A0A5K4FH60_SCHMA Loading...

Cadherin

AlphaFold DB , UniProt , Accession A0A5K4FH60, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 1,119 aa.

						>A0A5K4FH60_SCHMA|A0A5K4FH60
MISVRPVIKQKPSNFSPSLPIRPGVPNFINSRTILLYVTEHEPPGQLIGTVTVTDSDEIADPVLAKSDSLIENNAPAVNYHYQTIDPDTHLSINCQLNHNGLVLEPLFKGAKNQFKLLTYASFDREQQTDQFATLTCYDYGQPPLSSQVGLRLIIEDINDHGPQFKQSKMIAHIKENSPSGTKIYKIDAHDPDIGPNALLGYRLDGQHMDNFMIDEKTGTVTSLRPFDREQIDHFNLSVIVYDQSDWITLNNYNNDNITSITDITVKTNTMELFNHKAPKQHIVHGNLHVFIDDVNDCVPIFDNSLYQLRVSEDAKINHLIGQIEANDSDATEINNQIHYLIKPQIEGQVIHEFRVSSKGYIYVARGNLDREKISAYNFYLVAMDSGLPTLSSSTQVHIHLIDVNDNSPQWIFPAHNHQIINLTVNEPVGYRVAQLIAEDLDENENGEVIYRLVQTSFMSNMPNIVDRTIMTSPSTRLDNAINSNVQIVPKTDMRYIPSHNIGNLFELDSISGAIYVGRSMSIDDVGSIKLVLEASDRGHPAKVNHRVLQIDIFRYLSQTSAYLLSENDGDTVGVSEHDRQKSTVVGHGAYLENDLIVIVIMVAVTLIISLILILAILFLRCGACAQRNTTQCEQNNPRFYRQGLNHTHHLEEVFRDSGMLEVDGLLSPGAEHLLSEGGLNTFPPPNHLHHPSQSTDSEKMIRSFLSNAEKNQWMMAAVDPKKPDTLRSHKLFNSTHPFHPSPTKLNDLSNLKRASQTGTICRLKPVEERFLDTVSTKNSPDHELKFLMGACPTLRQQNQTCSTFKAGSSQISDLRINSPSYKDPGSIRNLTSPNEITEDIESMDSGHGCSTDTGMIENHFPNSRPQSSLNTFRVNNATFRQTPACYCSLNVEQLKSALSSRSPELLPTEQDDPTLRVLAYRRRSGTLPLCSIPINNNNIEDEDSILPTHFSTKLNSAKSSNDLLKTVDTKCCLKYNIEQQQPKNRLSVSWLDTHSNCNTSQNHISKTVTSVCAPTSNSDCCTTTVTTININNNTNEKSKFVNSSFENNNTTITTTTTNNNNNNSKEESQNDMSQSTEGTMILFSPVDPLGYAQLIHTQSDDQFISPQNIYTKFPTSFV
					

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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	43.6	Very low	44.3	Very low	190 Å²	190	97.7 Å²	97.7	94%	0.936	47%	0.466	S	S	*	.				0	126.6	0	-64.3	-165.1	-78.4	0	0	108.9	T50	M1-T50 CarbonylContact C-O 3.43Å; M1-T50 VanDerWaalsContact CA-O 3.3Å; M1-T50 WeakPolarHBondContact CA-O 3.47Å
2	I	56.2	Low	43	Very low	6 Å²	6	99.8 Å²	99.8	3%	0.031	49%	0.494	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.5	110.3	171.5	-68.9	155.6	0	0	0	107.2	V4 I34 L36 T50 V51 T52 L117 L135 V149 L151	I2-V4 HydrophobicContact CG2-CG2 3.84Å; I2-I34 HydrophobicContact CB-CD1 4.06Å; I2-I34 HydrophobicContact CG1-CD1 3.87Å; I2-I34 HydrophobicContact CG1-CG2 4.25Å; I2-I34 HydrophobicContact CG2-CD1 3.64Å; I2-L36 HydrophobicContact CD1-CD1 4.23Å; I2-L36 HydrophobicContact CD1-CD2 4.18Å; I2-T50 PolarHBondContact N-O 3.34Å; I2-V51 HydrophobicContact CB-CB 4.44Å; I2-V51 HydrophobicContact CB-CG2 4.01Å; I2-V51 HydrophobicContact CD1-CG2 3.74Å; I2-V51 HydrophobicContact CG1-CG2 4.5Å; I2-V51 HydrophobicContact CG2-CG1 4.31Å; I2-V51 HydrophobicContact CG2-CG2 4.18Å; I2-V51 CarbonylContact O-C 3.34Å; I2-V51 WeakPolarHBondContact O-CA 3.37Å; I2-T52 PolarHBondContact O-N 2.93Å; I2-T52 VanDerWaalsContact O-O 3.14Å; I2-L117 HydrophobicContact CD1-CD2 4.1Å; I2-L135 HydrophobicContact CG2-CD2 4.48Å; I2-V149 HydrophobicContact CG2-CG1 4.48Å; I2-L151 HydrophobicContact CD1-CD2 3.92Å; I2-L151 HydrophobicContact CG1-CD2 4.39Å
3	S	51.6	Low	42.1	Very low	56 Å²	56	100.4 Å²	100.4	39%	0.392	51%	0.514	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.4	113.2	169.7	174.9	0	0	0	0	109.2	T52	S3-T52 WeakPolarHBondContact CA-O 2.95Å
4	V	55	Low	41.1	Very low	4 Å²	4	103.5 Å²	103.5	2%	0.024	53%	0.532	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.3	134.8	169.4	-171.9	0	0	0	0	108.2	I2 V51 T52 V53 T54 L135 V149	I2-V4 HydrophobicContact CG2-CG2 3.84Å; V4-V51 HydrophobicContact CG2-CG1 4.35Å; V4-T52 PolarHBondContact N-O 3.24Å; V4-V53 HydrophobicContact CB-CG1 4.2Å; V4-V53 HydrophobicContact CB-CG2 4.3Å; V4-V53 WeakPolarHBondContact O-CA 3.23Å; V4-V53 WeakPolarHBondContact O-CG1 3.38Å; V4-T54 PolarHBondContact O-N 3.3Å; V4-L135 HydrophobicContact CG2-CD2 3.97Å; V4-V149 HydrophobicContact CG2-CB 4.3Å; V4-V149 HydrophobicContact CG2-CG1 3.72Å
5	R	53.4	Low	40.4	Very low	150 Å²	150	110.5 Å²	110.5	57%	0.566	56%	0.557	S	S	*	*			trans	-114.8	120.4	172	-69.9	-170.8	177.5	-157.1	-5	110	V7 S147	R5-V7 PolarHBondContact O-N 3.14Å; R5-S147 WeakPolarHBondContact O-CB 3.47Å; R5-S147 PolarHBondContact O-OG 2.86Å
6	P	45.4	Very low	39.6	Very low	8 Å²	8	110.1 Å²	110.1	5%	0.052	57%	0.568	C	S	.	*			trans	-59.4	127.3	160.2	-19.7	34	0	0	0	109	I8 V53 T54 S56 I93	P6-I8 VanDerWaalsContact C-N 3.28Å; P6-I8 HydrophobicContact CB-CG1 4.01Å; P6-I8 PolarHBondContact O-N 2.64Å; P6-V53 HydrophobicContact CG-CG1 4.12Å; P6-T54 WeakPolarHBondContact CD-O 3.4Å; P6-S56 PolarHBondContact O-OG 2.99Å; P6-I93 HydrophobicContact CG-CD1 4.03Å
7	V	42	Very low	39.2	Very low	102 Å²	102	110.9 Å²	110.9	62%	0.618	58%	0.582	S	S	*	*			trans	-89.6	75.7	170.3	-175.6	0	0	0	0	107.3	R5 K9	R5-V7 PolarHBondContact O-N 3.14Å; V7-K9 HydrophobicContact CG1-CG 4.44Å; V7-K9 PolarHBondContact O-N 2.95Å
8	I	44.1	Very low	38.6	Very low	45 Å²	45	110.8 Å²	110.8	23%	0.231	59%	0.592	C	S	.	*			trans	-66.2	104.5	173.6	-56.7	-170.6	0	0	0	107.4	P6 Q10 D55 L91 L145	P6-I8 VanDerWaalsContact C-N 3.28Å; P6-I8 HydrophobicContact CB-CG1 4.01Å; P6-I8 PolarHBondContact O-N 2.64Å; I8-Q10 PolarHBondContact O-N 3.39Å; I8-D55 VanDerWaalsContact CD1-OD1 3.22Å; I8-D55 WeakPolarHBondContact CD1-OD1 3.43Å; I8-L91 HydrophobicContact CD1-CD2 3.96Å; I8-L145 HydrophobicContact CB-CD1 4.49Å; I8-L145 HydrophobicContact CG2-CD1 4.16Å
9	K	36.1	Very low	38.3	Very low	178 Å²	178	113.6 Å²	113.6	77%	0.774	61%	0.606	S	S	*	*			trans	-77.1	94.5	176	-77.8	-172	175.8	-180	0	109.2	V7	V7-K9 HydrophobicContact CG1-CG 4.44Å; V7-K9 PolarHBondContact O-N 2.95Å
10	Q	32	Very low	38.1	Very low	142 Å²	142	114.1 Å²	114.1	66%	0.664	62%	0.616	S	S	*	*			trans	-51.3	155.2	164.3	-65.6	-168.6	0.5	0	0	111.2	I8 D57	I8-Q10 PolarHBondContact O-N 3.39Å; Q10-D57 PolarHBondContact NE2-OD2 3.46Å
11	K	28.4	Very low	37.8	Very low	194 Å²	194	116.6 Å²	116.6	84%	0.843	63%	0.627	S	S	*	*			trans	-49.5	145.4	-171.2	-90.8	173.3	175.3	165.3	0	113.5	S13	K11-S13 PolarHBondContact O-N 3.19Å
12	P	28.9	Very low	37.2	Very low	122 Å²	122	118.3 Å²	118.3	79%	0.792	62%	0.623	S	S	*	*			trans	-66.9	101.2	173.7	28.9	-34.3	0	0	0	110.9
13	S	30.6	Very low	35.9	Very low	108 Å²	108	124.2 Å²	124.2	76%	0.755	66%	0.662	S	S	*	*			trans	-69.1	131.6	161.8	53.9	0	0	0	0	109.5	K11	K11-S13 PolarHBondContact O-N 3.19Å
14	N	27.5	Very low	35	Very low	144 Å²	144	125.3 Å²	125.3	77%	0.77	68%	0.682	S	S	*	*			trans	-67	166.4	178.3	-73.5	-50.3	0	0	0	112.7
15	F	30.9	Very low	33.7	Very low	208 Å²	208	130.9 Å²	130.9	91%	0.912	72%	0.716	S	S	*	*			trans	75.7	130.8	-170.6	-59	-88.1	0	0	0	114
16	S	28.5	Very low	32.5	Very low	105 Å²	105	128.3 Å²	128.3	73%	0.734	72%	0.718	S	S	*	*			cis	-146.8	156.6	0.1	55.5	0	0	0	0	112.2
17	P	32.5	Very low	31.6	Very low	123 Å²	123	135 Å²	135	80%	0.799	75%	0.754	S	S	*	*			trans	-101.7	115.2	-173.9	35.6	-30.3	0	0	0	114.3
18	S	28.7	Very low	30.9	Very low	110 Å²	110	138.3 Å²	138.3	77%	0.769	76%	0.76	S	S	*	*			trans	-174.5	114.7	148	48	0	0	0	0	114
19	L	31.7	Very low	30.4	Very low	163 Å²	163	142.6 Å²	142.6	85%	0.853	78%	0.782	S	S	*	*			trans	168.7	132.3	131.9	-92.3	163.6	0	0	0	109.7
20	P	34.4	Very low	30.5	Very low	123 Å²	123	141.3 Å²	141.3	80%	0.799	78%	0.784	S	S	*	*	P	Polyproline II helix	trans	-85.1	123.9	-176.8	32.3	-32.2	0	0	0	112
21	I	32.2	Very low	31.2	Very low	167 Å²	167	137.1 Å²	137.1	86%	0.856	77%	0.77	S	S	*	*	P	Polyproline II helix	trans	-82.7	137.6	173	-61.8	178.1	0	0	0	109.9
22	R	30.7	Very low	32.9	Very low	227 Å²	227	137.6 Å²	137.6	86%	0.857	77%	0.767	S	S	*	*	P	Polyproline II helix	trans	-71.4	131	-175.7	-148.5	-178.6	-163.7	-167	5.2	110.9
23	P	30.4	Very low	35.1	Very low	129 Å²	129	135.1 Å²	135.1	84%	0.838	75%	0.749	S	S	*	*	S	Bend	trans	-70.5	131.3	172.1	29.5	-33.3	0	0	0	109.9
24	G	31.1	Very low	37.6	Very low	79 Å²	79	132.2 Å²	132.2	81%	0.814	73%	0.725	S	S	*	*			trans	149.2	-4.9	177.1	0	0	0	0	0	117.1
25	V	27.5	Very low	40.3	Very low	122 Å²	122	129.6 Å²	129.6	74%	0.739	71%	0.711	S	S	*	*	S	Bend	trans	-115.3	132	177	-175.2	0	0	0	0	109.5
26	P	28.8	Very low	42.9	Very low	95 Å²	95	120.6 Å²	120.6	62%	0.617	67%	0.672	S	S	*	*			trans	-69.8	133.5	173.4	28.7	-33.6	0	0	0	110.8	F28	P26-F28 VanDerWaalsContact C-N 3.29Å; P26-F28 HydrophobicContact CB-CD2 4.34Å; P26-F28 HydrophobicContact CG-CD2 4.46Å; P26-F28 PolarHBondContact O-N 2.81Å
27	N	25.8	Very low	45.7	Very low	148 Å²	148	122.1 Å²	122.1	79%	0.791	66%	0.662	S	S	*	*			trans	-73.4	71.8	-176.3	-80.8	-24.6	0	0	0	113.3	I29	N27-I29 PolarHBondContact O-N 2.81Å
28	F	29	Very low	48.3	Very low	172 Å²	172	116.3 Å²	116.3	75%	0.754	63%	0.625	S	S	*	*			trans	-84.1	83.5	162.5	-81.5	-81.8	0	0	0	110.1	P26 N30	P26-F28 VanDerWaalsContact C-N 3.29Å; P26-F28 HydrophobicContact CB-CD2 4.34Å; P26-F28 HydrophobicContact CG-CD2 4.46Å; P26-F28 PolarHBondContact O-N 2.81Å; F28-N30 PolarHBondContact O-N 3.02Å; F28-N30 VanDerWaalsContact O-N 3.15Å
29	I	32.1	Very low	51	Low	135 Å²	135	113.6 Å²	113.6	69%	0.692	60%	0.604	S	S	*	*			trans	-79	97.2	177.9	-58.6	177.3	0	0	0	109.5	N27 S31	N27-I29 PolarHBondContact O-N 2.81Å; I29-S31 PolarHBondContact O-N 2.85Å; I29-S31 VanDerWaalsContact O-N 3.09Å
30	N	39	Very low	53.6	Low	151 Å²	151	106 Å²	106	81%	0.807	56%	0.564	S	S	*	*			trans	51.9	35.4	156.5	-63.8	-10.4	0	0	0	118	F28 R32	F28-N30 PolarHBondContact O-N 3.02Å; F28-N30 VanDerWaalsContact O-N 3.15Å; N30-R32 PolarHBondContact O-N 3.32Å
31	S	47.4	Very low	55.8	Low	55 Å²	55	104.1 Å²	104.1	39%	0.385	54%	0.544	S	S	.	.			trans	-66.6	98.7	162.4	56	0	0	0	0	109.5	I29 T33	I29-S31 PolarHBondContact O-N 2.85Å; I29-S31 VanDerWaalsContact O-N 3.09Å; S31-T33 PolarHBondContact O-N 3.3Å
32	R	64	Low	58	Low	203 Å²	203	97.6 Å²	97.6	77%	0.766	51%	0.51	S	S	*	.	P	Polyproline II helix	trans	-61.6	119.8	168.8	-74	-176.8	173.6	-176.9	-2.5	108.1	N30 V149 G150	N30-R32 PolarHBondContact O-N 3.32Å; R32-V149 WeakPolarHBondContact O-CG2 3.16Å; R32-G150 PolarHBondContact O-N 2.87Å
33	T	75.2	Confident	60.5	Low	70 Å²	70	90.9 Å²	90.9	43%	0.429	50%	0.496	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.5	125.3	166.9	-56.1	0	0	0	0	108.3	S31 G150 R152	S31-T33 PolarHBondContact O-N 3.3Å; T33-G150 CarbonylContact C-O 3.43Å; T33-G150 VanDerWaalsContact CA-O 3.3Å; T33-G150 WeakPolarHBondContact CA-O 3.26Å; T33-R152 HydrophobicContact CG2-CB 3.86Å
34	I	83	Confident	63.2	Low	47 Å²	47	88.7 Å²	88.7	24%	0.241	48%	0.482	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.2	127.1	174.8	-60.9	173	0	0	0	107.3	I2 L36 V149 G150 L151 R152	I2-I34 HydrophobicContact CB-CD1 4.06Å; I2-I34 HydrophobicContact CG1-CD1 3.87Å; I2-I34 HydrophobicContact CG1-CG2 4.25Å; I2-I34 HydrophobicContact CG2-CD1 3.64Å; I34-L36 HydrophobicContact CG2-CD2 4.18Å; I34-L36 HydrophobicContact CG2-CG 4.49Å; I34-V149 HydrophobicContact CD1-CG2 3.82Å; I34-V149 HydrophobicContact CG1-CG2 4.13Å; I34-G150 PolarHBondContact N-O 3.38Å; I34-L151 HydrophobicContact CB-CD2 4.05Å; I34-L151 HydrophobicContact CD1-CD2 4.45Å; I34-L151 WeakPolarHBondContact O-CA 3.2Å; I34-R152 PolarHBondContact O-N 2.68Å
35	L	83.2	Confident	65.8	Low	90 Å²	90	87.2 Å²	87.2	47%	0.471	47%	0.467	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.3	135.2	169.8	-69.7	84.3	0	0	0	108.7	R152 I154	L35-R152 WeakPolarHBondContact CA-O 3.29Å; L35-I154 HydrophobicContact CD2-CG1 4.24Å
36	L	86.7	Confident	68.6	Low	19 Å²	19	85.8 Å²	85.8	10%	0.099	45%	0.452	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.5	133.2	173.3	-64.5	176.2	0	0	0	107.2	I2 I34 I48 L117 L151 R152 L153 I154	I2-L36 HydrophobicContact CD1-CD1 4.23Å; I2-L36 HydrophobicContact CD1-CD2 4.18Å; I34-L36 HydrophobicContact CG2-CD2 4.18Å; I34-L36 HydrophobicContact CG2-CG 4.49Å; L36-I48 HydrophobicContact CB-CG2 4.18Å; L36-I48 HydrophobicContact CD1-CG2 4.29Å; L36-L117 HydrophobicContact CD1-CD2 3.47Å; L36-L117 VanDerWaalsContact CD1-CD2 3.47Å; L36-L151 HydrophobicContact CD1-CB 4.17Å; L36-L151 HydrophobicContact CD1-CD1 4.22Å; L36-L151 HydrophobicContact CD1-CD2 4.3Å; L36-L151 HydrophobicContact CD1-CG 4.46Å; L36-R152 PolarHBondContact N-O 2.8Å; L36-L153 HydrophobicContact CB-CD1 3.91Å; L36-L153 HydrophobicContact CD1-CD1 4.32Å; L36-L153 CarbonylContact O-C 3.51Å; L36-L153 WeakPolarHBondContact O-CA 3.27Å; L36-I154 PolarHBondContact O-N 3.25Å
37	Y	85.5	Confident	71.4	Confident	136 Å²	136	85.5 Å²	85.5	53%	0.533	45%	0.445	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.2	136.8	173.8	-65.8	-91.6	0	0	0	108.1	I154 E156	Y37-I154 WeakPolarHBondContact CA-O 3.36Å; Y37-I154 HydrophobicContact CD1-CB 3.95Å; Y37-I154 HydrophobicContact CD1-CG2 4.07Å; Y37-I154 HydrophobicContact CE1-CB 4Å; Y37-I154 HydrophobicContact CE1-CG1 4.3Å; Y37-I154 HydrophobicContact CE1-CG2 3.94Å; Y37-E156 HydrophobicContact CD1-CG 3.93Å; Y37-E156 HydrophobicContact CG-CG 4.49Å
38	V	87.6	Confident	74.3	Confident	2 Å²	2	79.9 Å²	79.9	1%	0.012	41%	0.414	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.8	123.6	178.2	170.7	0	0	0	0	106.8	E42 I48 F123 L153 I154 I155 E156	V38-E42 HydrophobicContact CG1-CB 4.5Å; V38-I48 HydrophobicContact CG2-CB 4.46Å; V38-I48 HydrophobicContact CG2-CD1 3.72Å; V38-I48 HydrophobicContact CG2-CG1 3.84Å; V38-I48 HydrophobicContact CG2-CG2 3.76Å; V38-F123 HydrophobicContact CG1-CD2 3.59Å; V38-F123 HydrophobicContact CG1-CE2 4.07Å; V38-F123 HydrophobicContact CG1-CG 4.28Å; V38-L153 HydrophobicContact CB-CD1 4.5Å; V38-L153 HydrophobicContact CB-CD2 4.49Å; V38-L153 HydrophobicContact CB-CG 4.22Å; V38-L153 HydrophobicContact CG2-CD1 3.46Å; V38-L153 VanDerWaalsContact CG2-CD1 3.46Å; V38-L153 HydrophobicContact CG2-CD2 4.07Å; V38-L153 HydrophobicContact CG2-CG 3.68Å; V38-I154 PolarHBondContact N-O 2.89Å; V38-I155 CarbonylContact O-C 3.54Å; V38-I155 VanDerWaalsContact O-CA 3.3Å; V38-I155 WeakPolarHBondContact O-CA 3.34Å; V38-E156 PolarHBondContact O-N 3.19Å
39	T	84.8	Confident	76.9	Confident	53 Å²	53	72.6 Å²	72.6	33%	0.325	39%	0.388	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.8	143.9	178.2	-40.9	0	0	0	0	110.3	E42 E156 I158	T39-E42 WeakPolarHBondContact O-CB 3.21Å; T39-E42 PolarHBondContact O-N 3.19Å; T39-E156 PolarHBondContact OG1-OE2 3.07Å; T39-I158 HydrophobicContact CG2-CD1 3.95Å; T39-I158 HydrophobicContact CG2-CG1 4.02Å
40	E	86.7	Confident	79.5	Confident	3 Å²	3	67.9 Å²	67.9	1%	0.014	37%	0.365	C	S	.	.	T	Hydrogen-bonded Turn	trans	-57.5	150.8	175.2	174	144.1	-124.1	0	0	113.3	E42 D124 R125 I155 E156 D157 I158	E40-E42 PolarHBondContact O-N 2.72Å; E40-D124 WeakPolarHBondContact OE1-CA 3.38Å; E40-R125 WeakPolarHBondContact OE1-CB 3.42Å; E40-R125 PolarHBondContact OE1-N 3.17Å; E40-I155 HydrophobicContact CB-CG2 4.13Å; E40-E156 WeakPolarHBondContact CB-O 3.46Å; E40-E156 PolarHBondContact N-O 2.86Å; E40-D157 WeakPolarHBondContact OE2-CA 3.28Å; E40-I158 HydrophobicContact CB-CB 4.1Å; E40-I158 HydrophobicContact CB-CD1 4.21Å; E40-I158 HydrophobicContact CB-CG1 3.98Å; E40-I158 HydrophobicContact CG-CB 4.14Å; E40-I158 WeakPolarHBondContact O-CD1 3.42Å; E40-I158 PolarHBondContact OE2-N 2.99Å
41	H	81.4	Confident	81.6	Confident	83 Å²	83	60.7 Å²	60.7	38%	0.384	33%	0.327	S	S	.	.	T	Hydrogen-bonded Turn	trans	51.6	14.7	-173.9	-63.4	-58.6	0	0	0	115.7	F123 D160	H41-F123 PolarHBondContact N-O 2.54Å; H41-D160 IonicContact CD2-OD2 3.15Å; H41-D160 IonicContact CE1-OD2 2.6Å; H41-D160 IonicContact NE2-OD2 2.75Å; H41-D160 PolarHBondContact NE2-OD2 2.92Å
42	E	77.7	Confident	83.2	Confident	30 Å²	30	59.5 Å²	59.5	14%	0.14	32%	0.318	C	S	.	.	P	Polyproline II helix	trans	-59.2	124.8	179.5	-175	172.7	-117.7	0	0	110.4	V38 T39 E40 Q46 T119 S122	V38-E42 HydrophobicContact CG1-CB 4.5Å; T39-E42 WeakPolarHBondContact O-CB 3.21Å; T39-E42 PolarHBondContact O-N 3.19Å; E40-E42 PolarHBondContact O-N 2.72Å; E42-Q46 HydrophobicContact CG-CB 3.88Å; E42-Q46 HydrophobicContact CG-CG 3.46Å; E42-Q46 VanDerWaalsContact CG-CG 3.46Å; E42-Q46 WeakPolarHBondContact OE1-CG 3.12Å; E42-Q46 PolarHBondContact OE1-NE2 3.09Å; E42-T119 HydrophobicContact CG-CG2 4.13Å; E42-T119 WeakPolarHBondContact OE2-CG2 3.43Å; E42-S122 WeakPolarHBondContact O-CA 3.14Å
43	P	83.5	Confident	83.8	Confident	86 Å²	86	50.2 Å²	50.2	56%	0.558	28%	0.284	S	S	*	.	P	Polyproline II helix	trans	-70.5	152.3	-170.2	27.1	-35.4	0	0	0	112.3	Q46 T119	P43-Q46 WeakPolarHBondContact O-CB 3.42Å; P43-T119 PolarHBondContact O-OG1 3.21Å
44	P	86.5	Confident	83.6	Confident	84 Å²	84	48.7 Å²	48.7	55%	0.545	27%	0.274	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.1	139.2	175.8	-28.2	36.2	0	0	0	114.1	T119	P44-T119 WeakPolarHBondContact CA-OG1 3.48Å
45	G	85.6	Confident	82.4	Confident	48 Å²	48	47.8 Å²	47.8	50%	0.495	27%	0.27	S	S	.	.	T	Hydrogen-bonded Turn	trans	96.9	0.9	178.8	0	0	0	0	0	115.3	T119	G45-T119 PolarHBondContact N-O 3.46Å; G45-T119 PolarHBondContact N-OG1 3.31Å
46	Q	87.5	Confident	81.1	Confident	91 Å²	91	46 Å²	46	43%	0.425	26%	0.264	S	S	.	.			trans	-86.5	146.7	-173.6	171.2	56.1	-5.5	0	0	112.7	E42 P43 I48 L118 T119	E42-Q46 HydrophobicContact CG-CB 3.88Å; E42-Q46 HydrophobicContact CG-CG 3.46Å; E42-Q46 VanDerWaalsContact CG-CG 3.46Å; E42-Q46 WeakPolarHBondContact OE1-CG 3.12Å; E42-Q46 PolarHBondContact OE1-NE2 3.09Å; P43-Q46 WeakPolarHBondContact O-CB 3.42Å; Q46-I48 PolarHBondContact O-N 3.06Å; Q46-L118 CarbonylContact O-C 3.6Å; Q46-L118 WeakPolarHBondContact O-CA 3.24Å; Q46-T119 HydrophobicContact CB-CG2 4.43Å; Q46-T119 PolarHBondContact N-OG1 2.94Å; Q46-T119 PolarHBondContact O-N 2.96Å
47	L	88.3	Confident	79.1	Confident	90 Å²	90	47.7 Å²	47.7	47%	0.471	27%	0.274	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.8	102.9	-165.6	-179.4	65.3	0	0	0	114	G49 K116 L118	L47-G49 WeakPolarHBondContact CD1-O 3.04Å; L47-K116 HydrophobicContact CD1-CB 3.65Å; L47-L118 HydrophobicContact CB-CD2 4.17Å; L47-L118 HydrophobicContact CD1-CD2 3.81Å
48	I	85.3	Confident	77.1	Confident	29 Å²	29	48.3 Å²	48.3	15%	0.149	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.2	-29.6	177	-53.2	163	0	0	0	111.1	L36 V38 Q46 L102 L117 T119	L36-I48 HydrophobicContact CB-CG2 4.18Å; L36-I48 HydrophobicContact CD1-CG2 4.29Å; V38-I48 HydrophobicContact CG2-CB 4.46Å; V38-I48 HydrophobicContact CG2-CD1 3.72Å; V38-I48 HydrophobicContact CG2-CG1 3.84Å; V38-I48 HydrophobicContact CG2-CG2 3.76Å; Q46-I48 PolarHBondContact O-N 3.06Å; I48-L102 HydrophobicContact CD1-CD2 3.19Å; I48-L117 PolarHBondContact N-O 2.83Å; I48-T119 HydrophobicContact CD1-CG2 3.86Å; I48-T119 HydrophobicContact CG1-CG2 4.08Å
49	G	84.1	Confident	74.7	Confident	20 Å²	20	56 Å²	56	21%	0.206	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	168.6	-177.5	173.5	0	0	0	0	0	115.1	L47 L117	L47-G49 WeakPolarHBondContact CD1-O 3.04Å; G49-L117 PolarHBondContact N-O 2.87Å; G49-L117 PolarHBondContact O-N 2.63Å
50	T	85.8	Confident	72.1	Confident	35 Å²	35	57.6 Å²	57.6	22%	0.215	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110	137.7	178.4	57.3	0	0	0	0	111.5	M1 I2 L107 F115	M1-T50 CarbonylContact C-O 3.43Å; M1-T50 VanDerWaalsContact CA-O 3.3Å; M1-T50 WeakPolarHBondContact CA-O 3.47Å; I2-T50 PolarHBondContact N-O 3.34Å; T50-L107 HydrophobicContact CG2-CD1 3.56Å; T50-F115 CarbonylContact C-O 3.11Å; T50-F115 WeakPolarHBondContact CA-O 3.46Å
51	V	83.8	Confident	69.5	Low	1 Å²	1	64.6 Å²	64.6	1%	0.006	38%	0.377	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	126.7	175.3	174.1	0	0	0	0	108	I2 V4 V53 L104 Q114 F115 L117 L135	I2-V51 HydrophobicContact CB-CB 4.44Å; I2-V51 HydrophobicContact CB-CG2 4.01Å; I2-V51 HydrophobicContact CD1-CG2 3.74Å; I2-V51 HydrophobicContact CG1-CG2 4.5Å; I2-V51 HydrophobicContact CG2-CG1 4.31Å; I2-V51 HydrophobicContact CG2-CG2 4.18Å; I2-V51 CarbonylContact O-C 3.34Å; I2-V51 WeakPolarHBondContact O-CA 3.37Å; V4-V51 HydrophobicContact CG2-CG1 4.35Å; V51-V53 HydrophobicContact CG1-CG2 4.23Å; V51-L104 HydrophobicContact CB-CD1 4.39Å; V51-L104 HydrophobicContact CG2-CD1 4Å; V51-Q114 WeakPolarHBondContact O-CA 3.12Å; V51-F115 HydrophobicContact CB-CB 4.23Å; V51-F115 HydrophobicContact CG1-CD2 4.29Å; V51-F115 PolarHBondContact N-O 2.79Å; V51-F115 PolarHBondContact O-N 2.8Å; V51-L117 HydrophobicContact CG2-CB 4.47Å; V51-L135 HydrophobicContact CG1-CD2 3.76Å; V51-L135 HydrophobicContact CG2-CD2 4Å
52	T	82	Confident	67.2	Low	30 Å²	30	66.3 Å²	66.3	18%	0.184	40%	0.395	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	133.5	172	60	0	0	0	0	109	I2 S3 V4 Q114	I2-T52 PolarHBondContact O-N 2.93Å; I2-T52 VanDerWaalsContact O-O 3.14Å; S3-T52 WeakPolarHBondContact CA-O 2.95Å; V4-T52 PolarHBondContact N-O 3.24Å; T52-Q114 HydrophobicContact CG2-CG 4.17Å
53	V	76.5	Confident	64.9	Low	8 Å²	8	71.2 Å²	71.2	5%	0.048	43%	0.427	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	108.9	179.2	-163.8	0	0	0	0	108.3	V4 P6 V51 I93 N113 F115	V4-V53 HydrophobicContact CB-CG1 4.2Å; V4-V53 HydrophobicContact CB-CG2 4.3Å; V4-V53 WeakPolarHBondContact O-CA 3.23Å; V4-V53 WeakPolarHBondContact O-CG1 3.38Å; P6-V53 HydrophobicContact CG-CG1 4.12Å; V51-V53 HydrophobicContact CG1-CG2 4.23Å; V53-I93 HydrophobicContact CB-CD1 4.11Å; V53-I93 HydrophobicContact CG1-CD1 3.58Å; V53-I93 HydrophobicContact CG1-CG2 4.13Å; V53-N113 HydrophobicContact CB-CB 4.35Å; V53-N113 PolarHBondContact N-O 3.15Å; V53-F115 HydrophobicContact CG2-CE2 4.24Å
54	T	69.2	Low	62.4	Low	38 Å²	38	75.6 Å²	75.6	23%	0.233	45%	0.445	C	S	.	.			trans	-100.4	132.1	178.8	54.1	0	0	0	0	107.9	V4 P6	V4-T54 PolarHBondContact O-N 3.3Å; P6-T54 WeakPolarHBondContact CD-O 3.4Å
55	D	59.6	Low	59.5	Low	28 Å²	28	75.3 Å²	75.3	15%	0.15	45%	0.45	C	S	.	.			trans	-65.6	161.8	169.1	-140.2	-39	0	0	0	110.9	I8 D57 L91	I8-D55 VanDerWaalsContact CD1-OD1 3.22Å; I8-D55 WeakPolarHBondContact CD1-OD1 3.43Å; D55-D57 VanDerWaalsContact C-N 3.34Å; D55-L91 WeakPolarHBondContact OD2-CD2 3.47Å
56	S	54.5	Low	56.7	Low	51 Å²	51	82.2 Å²	82.2	36%	0.357	47%	0.466	S	S	.	.	S	Bend	trans	-84.7	-12.2	178.9	-68.6	0	0	0	0	113.2	P6	P6-S56 PolarHBondContact O-OG 2.99Å
57	D	44.2	Very low	53.8	Low	55 Å²	55	82.1 Å²	82.1	29%	0.294	48%	0.476	S	S	.	.			trans	-99.2	0.5	-167.8	-69.5	31.4	0	0	0	112.9	Q10 D55 I59	Q10-D57 PolarHBondContact NE2-OD2 3.46Å; D55-D57 VanDerWaalsContact C-N 3.34Å; D57-I59 VanDerWaalsContact C-N 3.35Å; D57-I59 PolarHBondContact O-N 2.86Å
58	E	44.9	Very low	50.8	Low	149 Å²	149	85 Å²	85	70%	0.696	49%	0.491	S	S	*	.			trans	-62.4	92.8	160.9	-78.9	-172.9	149.6	0	0	109.9	A60	E58-A60 PolarHBondContact O-N 3Å
59	I	36.1	Very low	48	Very low	164 Å²	164	88.5 Å²	88.5	84%	0.841	52%	0.519	S	S	*	.	P	Polyproline II helix	trans	-57.8	121.7	170.2	-62.9	176.6	0	0	0	108.2	D57 D61	D57-I59 VanDerWaalsContact C-N 3.35Å; D57-I59 PolarHBondContact O-N 2.86Å; I59-D61 PolarHBondContact O-N 3.25Å
60	A	31.3	Very low	45.3	Very low	87 Å²	87	94.7 Å²	94.7	72%	0.719	55%	0.546	S	S	*	.	P	Polyproline II helix	trans	-59.2	124.2	-178.1	0	0	0	0	0	111.6	E58	E58-A60 PolarHBondContact O-N 3Å
61	D	32	Very low	42.6	Very low	150 Å²	150	99.8 Å²	99.8	80%	0.802	57%	0.571	S	S	*	*	P	Polyproline II helix	trans	-50.9	130.6	169.2	-93.7	-42.3	0	0	0	110.1	I59 V63	I59-D61 PolarHBondContact O-N 3.25Å; D61-V63 PolarHBondContact O-N 3.14Å
62	P	33.6	Very low	39.9	Very low	118 Å²	118	107.2 Å²	107.2	77%	0.766	61%	0.605	S	S	*	*	P	Polyproline II helix	trans	-66.4	121.2	-177	26.1	-33.2	0	0	0	110.4	L64	P62-L64 PolarHBondContact O-N 2.99Å
63	V	29.1	Very low	37.4	Very low	134 Å²	134	111.5 Å²	111.5	81%	0.812	63%	0.627	S	S	*	*			trans	-53.2	101.2	-174.5	178.4	0	0	0	0	112.4	D61 A65	D61-V63 PolarHBondContact O-N 3.14Å; V63-A65 HydrophobicContact CG1-CB 3.79Å; V63-A65 PolarHBondContact O-N 3.35Å
64	L	29.8	Very low	35.3	Very low	177 Å²	177	118.1 Å²	118.1	93%	0.927	66%	0.662	S	S	*	*			trans	-93.4	72.5	164.5	-168.8	70.5	0	0	0	110.2	P62 K66	P62-L64 PolarHBondContact O-N 2.99Å; L64-K66 PolarHBondContact O-N 2.87Å
65	A	25.6	Very low	33.4	Very low	79 Å²	79	120.8 Å²	120.8	65%	0.653	69%	0.688	S	S	*	*			trans	-79.9	102.3	175.1	0	0	0	0	0	111.3	V63	V63-A65 HydrophobicContact CG1-CB 3.79Å; V63-A65 PolarHBondContact O-N 3.35Å
66	K	26.7	Very low	32.1	Very low	193 Å²	193	125 Å²	125	84%	0.839	72%	0.717	S	S	*	*				-179.6	146.8	128.9	-104.5	174.8	179.4	-174.5	0	117.1	L64	L64-K66 PolarHBondContact O-N 2.87Å
67	S	26.7	Very low	30.7	Very low	89 Å²	89	127.2 Å²	127.2	62%	0.622	74%	0.738	S	S	*	*			trans	58.5	102.8	145.7	61.4	0	0	0	0	121.4
68	D	26.2	Very low	30	Very low	149 Å²	149	130.7 Å²	130.7	80%	0.797	76%	0.761	S	S	*	*				76.4	131.5	115.9	-54.1	-41.3	0	0	0	123.1
69	S	26.2	Very low	29.1	Very low	104 Å²	104	130.5 Å²	130.5	73%	0.727	77%	0.765	S	S	*	*			trans	82.8	104.9	145.3	66.4	0	0	0	0	122.3
70	L	28.2	Very low	28.7	Very low	149 Å²	149	132 Å²	132	78%	0.78	76%	0.762	S	S	*	*				62.7	103.3	123.8	-60.3	170.7	0	0	0	122.5
71	I	29.1	Very low	28.4	Very low	143 Å²	143	134.4 Å²	134.4	73%	0.733	76%	0.758	S	S	*	*				75.2	122	119.8	-67.8	179.1	0	0	0	121.5
72	E	26.6	Very low	28.1	Very low	156 Å²	156	136.6 Å²	136.6	73%	0.729	76%	0.756	S	S	*	*			trans	72.2	121.1	150.7	-87.5	-173.8	106.4	0	0	125.3
73	N	29.8	Very low	27.6	Very low	120 Å²	120	137.3 Å²	137.3	64%	0.642	75%	0.75	S	S	*	*				106	133.9	127.4	-75.1	-28.1	0	0	0	123.2
74	N	31.3	Very low	27.6	Very low	147 Å²	147	137.1 Å²	137.1	79%	0.786	75%	0.749	S	S	*	*			trans	71.2	86.9	158.7	-60.3	-29.7	0	0	0	120.6
75	A	28.8	Very low	27.6	Very low	95 Å²	95	134.3 Å²	134.3	79%	0.785	73%	0.733	S	S	*	*				34.4	154.1	120.9	0	0	0	0	0	122.8
76	P	32.7	Very low	28.1	Very low	115 Å²	115	133.8 Å²	133.8	75%	0.747	72%	0.72	S	S	*	*			cis	-135.5	163.2	-16.8	37.4	-19.5	0	0	0	116.3
77	A	26.2	Very low	28.8	Very low	98 Å²	98	129 Å²	129	81%	0.81	71%	0.708	S	S	*	*			trans	32.7	108.7	148.4	0	0	0	0	0	121.2
78	V	29.8	Very low	29.6	Very low	128 Å²	128	128.5 Å²	128.5	78%	0.776	70%	0.698	S	S	*	*			trans	-127.9	131.5	148.1	177.7	0	0	0	0	108.7	Y80	V78-Y80 HydrophobicContact CG1-CE2 4.41Å
79	N	24.8	Very low	30.4	Very low	146 Å²	146	125.4 Å²	125.4	78%	0.781	69%	0.685	S	S	*	*			trans	-76.8	128	-178.8	-83.2	-38.6	0	0	0	112.4
80	Y	28.1	Very low	31.4	Very low	195 Å²	195	127.3 Å²	127.3	77%	0.765	68%	0.682	S	S	*	*			trans	-123.5	96.4	150.1	-79.6	-75.4	0	0	0	109.3	V78 Y82	V78-Y80 HydrophobicContact CG1-CE2 4.41Å; Y80-Y82 HydrophobicContact CD1-CE2 4.37Å; Y80-Y82 PolarHBondContact O-N 3.21Å
81	H	24.3	Very low	32.5	Very low	138 Å²	138	122.3 Å²	122.3	64%	0.639	66%	0.656	S	S	*	*			trans	-90.8	73.1	-172.1	-165.8	82.3	0	0	0	111.3	Q83	H81-Q83 PolarHBondContact O-N 3.24Å
82	Y	26.4	Very low	34.1	Very low	195 Å²	195	118.3 Å²	118.3	77%	0.765	64%	0.641	S	S	*	*			trans	-92.6	78.5	169.5	-76.1	-76.6	0	0	0	110.4	Y80 T84	Y80-Y82 HydrophobicContact CD1-CE2 4.37Å; Y80-Y82 PolarHBondContact O-N 3.21Å; Y82-T84 PolarHBondContact O-N 2.76Å
83	Q	24.1	Very low	36.1	Very low	134 Å²	134	111.2 Å²	111.2	63%	0.626	61%	0.608	S	S	*	*			trans	-75.1	78.9	164.8	-81.2	-168.5	-19.4	0	0	110.3	H81 I85	H81-Q83 PolarHBondContact O-N 3.24Å; Q83-I85 HydrophobicContact CB-CG1 4.15Å; Q83-I85 PolarHBondContact O-N 2.85Å
84	T	28.7	Very low	38.5	Very low	129 Å²	129	108.6 Å²	108.6	79%	0.791	59%	0.594	S	S	*	*			trans	-71.5	86.6	152	46.9	0	0	0	0	107.3	Y82 D86	Y82-T84 PolarHBondContact O-N 2.76Å; T84-D86 VanDerWaalsContact C-N 3.35Å; T84-D86 PolarHBondContact O-N 3.12Å
85	I	29.8	Very low	41	Very low	119 Å²	119	102.3 Å²	102.3	61%	0.61	56%	0.561	S	S	*	*			trans	-69.5	98.6	171.7	-57.8	177.8	0	0	0	107	Q83 P87	Q83-I85 HydrophobicContact CB-CG1 4.15Å; Q83-I85 PolarHBondContact O-N 2.85Å; I85-P87 WeakPolarHBondContact O-CD 3.33Å
86	D	36.2	Very low	43.7	Very low	68 Å²	68	102.9 Å²	102.9	36%	0.364	55%	0.548	S	S	.	.			trans	-62.6	117.2	162.9	171.1	10	0	0	0	108.8	T84 D88 T89	T84-D86 VanDerWaalsContact C-N 3.35Å; T84-D86 PolarHBondContact O-N 3.12Å; D86-D88 PolarHBondContact O-N 2.91Å; D86-D88 PolarHBondContact OD1-N 2.88Å; D86-T89 HydrophobicContact CB-CG2 3.85Å; D86-T89 WeakPolarHBondContact O-CG2 3.26Å; D86-T89 PolarHBondContact O-OG1 3.24Å
87	P	40.6	Very low	46.4	Very low	92 Å²	92	99 Å²	99	60%	0.597	52%	0.521	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.1	-25.5	-180	-22.3	34.4	0	0	0	113.9	I85 T89	I85-P87 WeakPolarHBondContact O-CD 3.33Å; P87-T89 VanDerWaalsContact C-N 3.33Å; P87-T89 PolarHBondContact O-N 2.76Å
88	D	43.9	Very low	49.3	Very low	78 Å²	78	100.2 Å²	100.2	42%	0.417	51%	0.514	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.5	-4.1	-167.2	-59.4	-43.8	0	0	0	112.6	D86 H90 L91	D86-D88 PolarHBondContact O-N 2.91Å; D86-D88 PolarHBondContact OD1-N 2.88Å; D88-H90 PolarHBondContact O-N 2.84Å; D88-L91 HydrophobicContact CB-CD1 4.38Å; D88-L91 PolarHBondContact O-N 2.97Å
89	T	43.6	Very low	52.1	Low	85 Å²	85	95.8 Å²	95.8	52%	0.521	48%	0.484	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58	4.8	167.6	59.6	0	0	0	0	115	D86 P87	D86-T89 HydrophobicContact CB-CG2 3.85Å; D86-T89 WeakPolarHBondContact O-CG2 3.26Å; D86-T89 PolarHBondContact O-OG1 3.24Å; P87-T89 VanDerWaalsContact C-N 3.33Å; P87-T89 PolarHBondContact O-N 2.76Å
90	H	46.4	Very low	55.1	Low	143 Å²	143	96 Å²	96	66%	0.662	49%	0.486	S	S	*	.	T	Hydrogen-bonded Turn	trans	-114.3	-2.5	-179.2	-59.2	8.7	0	0	0	113.1	D88 S92	D88-H90 PolarHBondContact O-N 2.84Å; H90-S92 VanDerWaalsContact C-N 3.33Å; H90-S92 PolarHBondContact O-N 3.43Å
91	L	52	Low	57.9	Low	44 Å²	44	87 Å²	87	23%	0.23	45%	0.452	C	S	.	.			trans	-68.3	87.6	174.8	-93.9	72.4	0	0	0	111.4	I8 D55 D88 N113 D139	I8-L91 HydrophobicContact CD1-CD2 3.96Å; D55-L91 WeakPolarHBondContact OD2-CD2 3.47Å; D88-L91 HydrophobicContact CB-CD1 4.38Å; D88-L91 PolarHBondContact O-N 2.97Å; L91-N113 PolarHBondContact O-ND2 3.41Å; L91-D139 HydrophobicContact CD2-CB 3.92Å
92	S	61.3	Low	61	Low	59 Å²	59	80.8 Å²	80.8	41%	0.413	42%	0.423	S	S	.	.			trans	-60.8	130.5	150.4	-175.8	0	0	0	0	107.7	H90 Y140	H90-S92 VanDerWaalsContact C-N 3.33Å; H90-S92 PolarHBondContact O-N 3.43Å; S92-Y140 WeakPolarHBondContact O-CD2 3.48Å; S92-Y140 WeakPolarHBondContact O-CE2 3.46Å
93	I	69	Low	64.1	Low	8 Å²	8	73.7 Å²	73.7	4%	0.041	40%	0.4	C	S	.	.			trans	-107.5	131.7	179.6	-59.6	173.8	0	0	0	109	P6 V53 N113 C137 Y138	P6-I93 HydrophobicContact CG-CD1 4.03Å; V53-I93 HydrophobicContact CB-CD1 4.11Å; V53-I93 HydrophobicContact CG1-CD1 3.58Å; V53-I93 HydrophobicContact CG1-CG2 4.13Å; I93-N113 PolarHBondContact N-OD1 2.94Å; I93-C137 HydrophobicContact CG2-CB 3.78Å; I93-Y138 WeakPolarHBondContact CG2-O 3.38Å
94	N	80.4	Confident	67.2	Low	64 Å²	64	68.9 Å²	68.9	34%	0.342	38%	0.378	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.8	109.2	179.2	-175.2	10.8	0	0	0	109.8	C137 Y138	N94-C137 WeakPolarHBondContact O-CA 3.48Å; N94-Y138 PolarHBondContact N-O 2.78Å; N94-Y138 PolarHBondContact O-N 2.81Å
95	C	84.6	Confident	70	Confident	16 Å²	16	66.6 Å²	66.6	11%	0.108	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	130.8	-179.1	-65.4	0	0	0	0	111.9	L104 F115 L135 T136 C137	C95-L104 HydrophobicContact CB-CD2 3.83Å; C95-F115 HydrophobicContact CB-CE2 4.09Å; C95-F115 HydrophobicContact CB-CZ 4.09Å; C95-L135 HydrophobicContact CB-CD1 4.06Å; C95-T136 WeakPolarHBondContact CA-O 3.27Å; C95-C137 HydrophobicContact CB-CB 4.2Å; C95-C137 WeakPolarHBondContact CB-SG 3.33Å; C95-C137 WeakPolarHBondContact SG-CB 3.42Å; C95-C137 CovalentContact SG-SG 2.05Å; C95-C137 PolarHBondContact SG-SG 2.77Å
96	Q	85.5	Confident	72.6	Confident	107 Å²	107	64.6 Å²	64.6	50%	0.5	35%	0.353	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	128.5	178.1	-64.2	-176.1	-14.5	0	0	109.5	T136 Y138	Q96-T136 PolarHBondContact N-O 3.31Å; Q96-T136 PolarHBondContact O-N 3.21Å; Q96-Y138 HydrophobicContact CG-CE2 4.49Å
97	L	88.9	Confident	75	Confident	33 Å²	33	64.1 Å²	64.1	17%	0.173	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	118	175	-177.8	67.6	0	0	0	109	H99 L102 L104 L117 A133 L135 L151	L97-H99 HydrophobicContact CG-CB 4.47Å; L97-H99 PolarHBondContact O-N 3.48Å; L97-L102 HydrophobicContact CD2-CB 3.67Å; L97-L104 HydrophobicContact CB-CB 4.23Å; L97-L104 HydrophobicContact CD2-CB 4.4Å; L97-L117 HydrophobicContact CD2-CD1 3.44Å; L97-L117 VanDerWaalsContact CD2-CD1 3.44Å; L97-A133 HydrophobicContact CD1-CB 4.09Å; L97-L135 HydrophobicContact CD1-CB 4.02Å; L97-L151 HydrophobicContact CD1-CD1 4.01Å
98	N	87.4	Confident	77.1	Confident	124 Å²	124	65.3 Å²	65.3	66%	0.663	35%	0.346	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-93.8	89.9	174.6	-174.4	22.8	0	0	0	109.6	T134	N98-T134 PolarHBondContact N-O 2.87Å; N98-T134 PolarHBondContact O-N 3.17Å
99	H	89.1	Confident	78.8	Confident	35 Å²	35	72 Å²	72	16%	0.162	37%	0.372	C	S	.	.			trans	-160.2	151.5	172.4	-156.9	-114.1	0	0	0	111	L97 G101 L102 Q131 A133	L97-H99 HydrophobicContact CG-CB 4.47Å; L97-H99 PolarHBondContact O-N 3.48Å; H99-G101 PolarHBondContact ND1-N 2.88Å; H99-L102 HydrophobicContact CB-CB 4.13Å; H99-L102 HydrophobicContact CB-CD1 4.41Å; H99-L102 HydrophobicContact CB-CG 4.49Å; H99-L102 WeakPolarHBondContact ND1-CG 3.37Å; H99-Q131 PolarHBondContact CE1-OE1 2.92Å; H99-Q131 VanDerWaalsContact CE1-OE1 3.23Å; H99-Q131 PolarHBondContact NE2-OE1 2.83Å; H99-A133 HydrophobicContact CB-CB 3.69Å
100	N	86.2	Confident	80.3	Confident	151 Å²	151	71.2 Å²	71.2	81%	0.807	38%	0.381	S	S	*	.	S	Bend	trans	-87.3	-33.3	179.3	-68.8	-14.1	0	0	0	113.2
101	G	87	Confident	81.8	Confident	5 Å²	5	65.4 Å²	65.4	5%	0.052	36%	0.357	C	S	.	.	S	Bend	trans	-95.1	2.8	-176.6	0	0	0	0	0	115.3	H99 Y120 A121 F123	H99-G101 PolarHBondContact ND1-N 2.88Å; G101-Y120 PolarHBondContact O-N 2.88Å; G101-A121 PolarHBondContact O-N 2.94Å; G101-F123 WeakPolarHBondContact O-CZ 2.92Å
102	L	90.2	Very high	83	Confident	8 Å²	8	70.9 Å²	70.9	4%	0.042	38%	0.379	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.7	146.7	-175.6	-61.7	174.2	0	0	0	111.3	I48 L97 H99 L117 L118 F123 A133 L153	I48-L102 HydrophobicContact CD1-CD2 3.19Å; L97-L102 HydrophobicContact CD2-CB 3.67Å; H99-L102 HydrophobicContact CB-CB 4.13Å; H99-L102 HydrophobicContact CB-CD1 4.41Å; H99-L102 HydrophobicContact CB-CG 4.49Å; H99-L102 WeakPolarHBondContact ND1-CG 3.37Å; L102-L117 HydrophobicContact CB-CD1 4.25Å; L102-L118 WeakPolarHBondContact CA-O 3.4Å; L102-F123 HydrophobicContact CD2-CE2 4.27Å; L102-F123 HydrophobicContact CD2-CZ 3.95Å; L102-F123 HydrophobicContact CG-CZ 4.3Å; L102-A133 HydrophobicContact CD1-CB 4.04Å; L102-L153 HydrophobicContact CD1-CD1 4.04Å; L102-L153 HydrophobicContact CD1-CD2 4.22Å; L102-L153 HydrophobicContact CD2-CD1 4.42Å; L102-L153 HydrophobicContact CD2-CD2 4.2Å; L102-L153 HydrophobicContact CG-CD2 4.41Å
103	V	90.7	Very high	83.9	Confident	45 Å²	45	69.7 Å²	69.7	27%	0.273	37%	0.368	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.5	148.6	176.5	66.3	0	0	0	0	111.6	L118 Y120	V103-L118 HydrophobicContact CG1-CB 3.85Å; V103-L118 HydrophobicContact CG1-CD1 4.4Å; V103-L118 PolarHBondContact N-O 2.91Å; V103-L118 PolarHBondContact O-N 3.47Å; V103-Y120 HydrophobicContact CB-CD2 4.39Å; V103-Y120 HydrophobicContact CG1-CD2 4.32Å
104	L	89.3	Confident	84.5	Confident	34 Å²	34	73 Å²	73	18%	0.178	38%	0.383	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112	117.6	179	-167.4	74.2	0	0	0	109.5	V51 C95 L97 F115 L135	V51-L104 HydrophobicContact CB-CD1 4.39Å; V51-L104 HydrophobicContact CG2-CD1 4Å; C95-L104 HydrophobicContact CB-CD2 3.83Å; L97-L104 HydrophobicContact CB-CB 4.23Å; L97-L104 HydrophobicContact CD2-CB 4.4Å; L104-F115 HydrophobicContact CD1-CB 3.58Å; L104-F115 HydrophobicContact CD1-CG 4.2Å; L104-F115 HydrophobicContact CD2-CB 4.32Å; L104-F115 HydrophobicContact CD2-CD1 4.04Å; L104-F115 HydrophobicContact CD2-CD2 4.39Å; L104-F115 HydrophobicContact CD2-CE1 4.44Å; L104-F115 HydrophobicContact CD2-CG 4.02Å; L104-F115 HydrophobicContact CG-CB 3.79Å; L104-F115 HydrophobicContact CG-CD1 4.02Å; L104-F115 HydrophobicContact CG-CG 3.97Å; L104-L135 HydrophobicContact CD2-CD1 3.87Å
105	E	87.8	Confident	84.8	Confident	81 Å²	81	71.4 Å²	71.4	38%	0.379	37%	0.374	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	156.6	178.3	-73	-171.2	178.5	0	0	111.4	L107 F115 K116 L118	E105-L107 PolarHBondContact O-N 2.58Å; E105-F115 CarbonylContact O-C 3.43Å; E105-F115 WeakPolarHBondContact O-CA 3.46Å; E105-F115 VanDerWaalsContact O-CB 3.27Å; E105-F115 WeakPolarHBondContact O-CB 3.37Å; E105-K116 HydrophobicContact CB-CD 4.47Å; E105-K116 HydrophobicContact CB-CG 3.89Å; E105-K116 PolarHBondContact N-O 3.29Å; E105-K116 PolarHBondContact O-N 3.36Å; E105-K116 WeakPolarHBondContact OE2-CE 3.08Å; E105-K116 IonicContact OE2-NZ 2.66Å; E105-K116 PolarHBondContact OE2-NZ 3.35Å; E105-L118 HydrophobicContact CG-CD1 4.23Å
106	P	85.5	Confident	85.1	Confident	76 Å²	76	73.4 Å²	73.4	49%	0.494	38%	0.38	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-57.3	138.3	171.5	-23.1	34.1	0	0	0	111.8	F108 K116	P106-F108 VanDerWaalsContact C-N 3.26Å; P106-F108 PolarHBondContact O-N 3.44Å; P106-K116 WeakPolarHBondContact O-CE 3.29Å
107	L	84.7	Confident	85.3	Confident	59 Å²	59	68.3 Å²	68.3	31%	0.309	36%	0.357	S	S	.	.	S	Bend	trans	-60.2	-37.1	-175.8	-177.1	60.4	0	0	0	112.5	T50 E105 A111 Q114 K116	T50-L107 HydrophobicContact CG2-CD1 3.56Å; E105-L107 PolarHBondContact O-N 2.58Å; L107-A111 HydrophobicContact CB-CB 4.22Å; L107-Q114 HydrophobicContact CB-CB 4.14Å; L107-Q114 WeakPolarHBondContact CB-O 3.26Å; L107-Q114 HydrophobicContact CD2-CB 4.11Å; L107-Q114 PolarHBondContact N-O 2.85Å; L107-K116 HydrophobicContact CD1-CB 4.2Å
108	F	85.2	Confident	85.3	Confident	116 Å²	116	67.1 Å²	67.1	51%	0.509	35%	0.35	S	S	.	.	S	Bend	trans	-150.3	167.3	169.9	54.9	-92.3	0	0	0	109.6	P106 G110 A111	P106-F108 VanDerWaalsContact C-N 3.26Å; P106-F108 PolarHBondContact O-N 3.44Å; F108-G110 PolarHBondContact O-N 2.92Å; F108-A111 HydrophobicContact CD1-CB 3.88Å; F108-A111 HydrophobicContact CD2-CB 3.95Å; F108-A111 HydrophobicContact CE1-CB 3.77Å; F108-A111 HydrophobicContact CE2-CB 3.85Å; F108-A111 HydrophobicContact CG-CB 3.96Å; F108-A111 HydrophobicContact CZ-CB 3.75Å; F108-A111 VanDerWaalsContact O-CB 3.28Å; F108-A111 WeakPolarHBondContact O-CB 3.39Å; F108-A111 PolarHBondContact O-N 3.43Å
109	K	79	Confident	85.5	Confident	219 Å²	219	61.2 Å²	61.2	95%	0.952	32%	0.319	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.2	107.8	179.6	-174.5	178.1	-179.2	178.7	0	110.6
110	G	75.4	Confident	85.5	Confident	69 Å²	69	67.1 Å²	67.1	71%	0.711	34%	0.341	S	S	*	.	T	Hydrogen-bonded Turn	trans	100.1	3	-176.6	0	0	0	0	0	115	F108 K112	F108-G110 PolarHBondContact O-N 2.92Å; G110-K112 PolarHBondContact O-N 2.86Å
111	A	78.4	Confident	85.6	Confident	20 Å²	20	61.8 Å²	61.8	17%	0.165	32%	0.318	C	S	.	.			trans	-59.8	131.5	171.4	0	0	0	0	0	111.2	L107 F108 Q114	L107-A111 HydrophobicContact CB-CB 4.22Å; F108-A111 HydrophobicContact CD1-CB 3.88Å; F108-A111 HydrophobicContact CD2-CB 3.95Å; F108-A111 HydrophobicContact CE1-CB 3.77Å; F108-A111 HydrophobicContact CE2-CB 3.85Å; F108-A111 HydrophobicContact CG-CB 3.96Å; F108-A111 HydrophobicContact CZ-CB 3.75Å; F108-A111 VanDerWaalsContact O-CB 3.28Å; F108-A111 WeakPolarHBondContact O-CB 3.39Å; F108-A111 PolarHBondContact O-N 3.43Å; A111-Q114 HydrophobicContact CB-CB 4.34Å
112	K	77.3	Confident	85.7	Confident	159 Å²	159	64.9 Å²	64.9	69%	0.691	34%	0.339	S	S	*	.	S	Bend	trans	-103.7	136.9	169.6	-69.2	-174.2	177.1	-175.1	0	109.3	G110 Q114	G110-K112 PolarHBondContact O-N 2.86Å; K112-Q114 WeakPolarHBondContact O-CG 3.48Å; K112-Q114 PolarHBondContact O-N 2.82Å
113	N	79.4	Confident	85.7	Confident	34 Å²	34	64.8 Å²	64.8	18%	0.182	34%	0.338	C	S	.	.	S	Bend	trans	52.2	20.6	174.8	-54.8	-5.5	0	0	0	114.5	V53 L91 I93	V53-N113 HydrophobicContact CB-CB 4.35Å; V53-N113 PolarHBondContact N-O 3.15Å; L91-N113 PolarHBondContact O-ND2 3.41Å; I93-N113 PolarHBondContact N-OD1 2.94Å
114	Q	83.1	Confident	85.7	Confident	77 Å²	77	65 Å²	65	36%	0.36	34%	0.338	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.8	122.9	-178.5	-66.6	-177.6	-1	0	0	109.4	V51 T52 L107 A111 K112	V51-Q114 WeakPolarHBondContact O-CA 3.12Å; T52-Q114 HydrophobicContact CG2-CG 4.17Å; L107-Q114 HydrophobicContact CB-CB 4.14Å; L107-Q114 WeakPolarHBondContact CB-O 3.26Å; L107-Q114 HydrophobicContact CD2-CB 4.11Å; L107-Q114 PolarHBondContact N-O 2.85Å; A111-Q114 HydrophobicContact CB-CB 4.34Å; K112-Q114 WeakPolarHBondContact O-CG 3.48Å; K112-Q114 PolarHBondContact O-N 2.82Å
115	F	87	Confident	85.8	Confident	32 Å²	32	64.4 Å²	64.4	14%	0.14	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.2	156.4	-172.1	-51	-93	0	0	0	111.3	T50 V51 V53 C95 L104 E105	T50-F115 CarbonylContact C-O 3.11Å; T50-F115 WeakPolarHBondContact CA-O 3.46Å; V51-F115 HydrophobicContact CB-CB 4.23Å; V51-F115 HydrophobicContact CG1-CD2 4.29Å; V51-F115 PolarHBondContact N-O 2.79Å; V51-F115 PolarHBondContact O-N 2.8Å; V53-F115 HydrophobicContact CG2-CE2 4.24Å; C95-F115 HydrophobicContact CB-CE2 4.09Å; C95-F115 HydrophobicContact CB-CZ 4.09Å; L104-F115 HydrophobicContact CD1-CB 3.58Å; L104-F115 HydrophobicContact CD1-CG 4.2Å; L104-F115 HydrophobicContact CD2-CB 4.32Å; L104-F115 HydrophobicContact CD2-CD1 4.04Å; L104-F115 HydrophobicContact CD2-CD2 4.39Å; L104-F115 HydrophobicContact CD2-CE1 4.44Å; L104-F115 HydrophobicContact CD2-CG 4.02Å; L104-F115 HydrophobicContact CG-CB 3.79Å; L104-F115 HydrophobicContact CG-CD1 4.02Å; L104-F115 HydrophobicContact CG-CG 3.97Å; E105-F115 CarbonylContact O-C 3.43Å; E105-F115 WeakPolarHBondContact O-CA 3.46Å; E105-F115 VanDerWaalsContact O-CB 3.27Å; E105-F115 WeakPolarHBondContact O-CB 3.37Å
116	K	89	Confident	86	Confident	57 Å²	57	62.9 Å²	62.9	25%	0.248	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	134.3	163.9	56.4	-173.3	179.9	117.7	0	109.3	L47 E105 P106 L107 L118	L47-K116 HydrophobicContact CD1-CB 3.65Å; E105-K116 HydrophobicContact CB-CD 4.47Å; E105-K116 HydrophobicContact CB-CG 3.89Å; E105-K116 PolarHBondContact N-O 3.29Å; E105-K116 PolarHBondContact O-N 3.36Å; E105-K116 WeakPolarHBondContact OE2-CE 3.08Å; E105-K116 IonicContact OE2-NZ 2.66Å; E105-K116 PolarHBondContact OE2-NZ 3.35Å; P106-K116 WeakPolarHBondContact O-CE 3.29Å; L107-K116 HydrophobicContact CD1-CB 4.2Å; K116-L118 HydrophobicContact CB-CD2 4.21Å; K116-L118 HydrophobicContact CD-CD1 4.48Å; K116-L118 HydrophobicContact CD-CD2 4.18Å; K116-L118 HydrophobicContact CG-CD1 4.49Å; K116-L118 HydrophobicContact CG-CD2 4.12Å; K116-L118 HydrophobicContact CG-CG 4.31Å
117	L	90.1	Very high	86.3	Confident	0 Å²	0	67 Å²	67	0%	0	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.2	119.9	174.5	177	64.7	0	0	0	107.9	I2 L36 I48 G49 V51 L97 L102 L151	I2-L117 HydrophobicContact CD1-CD2 4.1Å; L36-L117 HydrophobicContact CD1-CD2 3.47Å; L36-L117 VanDerWaalsContact CD1-CD2 3.47Å; I48-L117 PolarHBondContact N-O 2.83Å; G49-L117 PolarHBondContact N-O 2.87Å; G49-L117 PolarHBondContact O-N 2.63Å; V51-L117 HydrophobicContact CG2-CB 4.47Å; L97-L117 HydrophobicContact CD2-CD1 3.44Å; L97-L117 VanDerWaalsContact CD2-CD1 3.44Å; L102-L117 HydrophobicContact CB-CD1 4.25Å; L117-L151 HydrophobicContact CD2-CD1 4.06Å
118	L	89.7	Confident	86.5	Confident	8 Å²	8	68.7 Å²	68.7	4%	0.042	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	154.7	-174.4	-48.1	175.8	0	0	0	112	Q46 L47 L102 V103 E105 K116	Q46-L118 CarbonylContact O-C 3.6Å; Q46-L118 WeakPolarHBondContact O-CA 3.24Å; L47-L118 HydrophobicContact CB-CD2 4.17Å; L47-L118 HydrophobicContact CD1-CD2 3.81Å; L102-L118 WeakPolarHBondContact CA-O 3.4Å; V103-L118 HydrophobicContact CG1-CB 3.85Å; V103-L118 HydrophobicContact CG1-CD1 4.4Å; V103-L118 PolarHBondContact N-O 2.91Å; V103-L118 PolarHBondContact O-N 3.47Å; E105-L118 HydrophobicContact CG-CD1 4.23Å; K116-L118 HydrophobicContact CB-CD2 4.21Å; K116-L118 HydrophobicContact CD-CD1 4.48Å; K116-L118 HydrophobicContact CD-CD2 4.18Å; K116-L118 HydrophobicContact CG-CD1 4.49Å; K116-L118 HydrophobicContact CG-CD2 4.12Å; K116-L118 HydrophobicContact CG-CG 4.31Å
119	T	90.4	Very high	86.8	Confident	0 Å²	0	66.8 Å²	66.8	0%	0	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-60.9	145.1	159.7	59.8	0	0	0	0	110.3	E42 P43 P44 G45 Q46 I48 F123	E42-T119 HydrophobicContact CG-CG2 4.13Å; E42-T119 WeakPolarHBondContact OE2-CG2 3.43Å; P43-T119 PolarHBondContact O-OG1 3.21Å; P44-T119 WeakPolarHBondContact CA-OG1 3.48Å; G45-T119 PolarHBondContact N-O 3.46Å; G45-T119 PolarHBondContact N-OG1 3.31Å; Q46-T119 HydrophobicContact CB-CG2 4.43Å; Q46-T119 PolarHBondContact N-OG1 2.94Å; Q46-T119 PolarHBondContact O-N 2.96Å; I48-T119 HydrophobicContact CD1-CG2 3.86Å; I48-T119 HydrophobicContact CG1-CG2 4.08Å; T119-F123 HydrophobicContact CG2-CE2 4.1Å
120	Y	89.7	Confident	87.3	Confident	160 Å²	160	58 Å²	58	63%	0.627	31%	0.306	S	S	*	.	S	Bend	trans	-125.9	-22.1	171.1	-174.9	-103.5	0	0	0	112.2	G101 V103	G101-Y120 PolarHBondContact O-N 2.88Å; V103-Y120 HydrophobicContact CB-CD2 4.39Å; V103-Y120 HydrophobicContact CG1-CD2 4.32Å
121	A	89.1	Confident	87.9	Confident	39 Å²	39	56.3 Å²	56.3	32%	0.322	28%	0.28	S	S	.	.	S	Bend	trans	-124.7	164.2	163.9	0	0	0	0	0	108.9	G101 F123	G101-A121 PolarHBondContact O-N 2.94Å; A121-F123 WeakPolarHBondContact O-CE2 3.29Å
122	S	88.9	Confident	88.5	Confident	70 Å²	70	61.4 Å²	61.4	49%	0.49	30%	0.299	S	S	.	.			trans	-72.6	160.1	161.8	52.7	0	0	0	0	110.5	E42	E42-S122 WeakPolarHBondContact O-CA 3.14Å
123	F	89.8	Confident	89.1	Confident	5 Å²	5	54 Å²	54	2%	0.022	27%	0.266	C	S	.	.			trans	-118.7	150.7	178.6	-64.2	-83.2	0	0	0	110.9	V38 H41 G101 L102 T119 A121 L153 I155	V38-F123 HydrophobicContact CG1-CD2 3.59Å; V38-F123 HydrophobicContact CG1-CE2 4.07Å; V38-F123 HydrophobicContact CG1-CG 4.28Å; H41-F123 PolarHBondContact N-O 2.54Å; G101-F123 WeakPolarHBondContact O-CZ 2.92Å; L102-F123 HydrophobicContact CD2-CE2 4.27Å; L102-F123 HydrophobicContact CD2-CZ 3.95Å; L102-F123 HydrophobicContact CG-CZ 4.3Å; T119-F123 HydrophobicContact CG2-CE2 4.1Å; A121-F123 WeakPolarHBondContact O-CE2 3.29Å; F123-L153 HydrophobicContact CD1-CD2 4.07Å; F123-L153 HydrophobicContact CE1-CD2 3.51Å; F123-L153 HydrophobicContact CE2-CD2 4.08Å; F123-L153 HydrophobicContact CZ-CD2 3.51Å; F123-I155 HydrophobicContact CB-CD1 3.85Å; F123-I155 HydrophobicContact CB-CG1 3.92Å; F123-I155 HydrophobicContact CB-CG2 4.3Å; F123-I155 HydrophobicContact CD1-CD1 3.94Å; F123-I155 HydrophobicContact CD1-CG1 4.42Å; F123-I155 HydrophobicContact CG-CD1 4.22Å; F123-I155 HydrophobicContact CG-CG1 4.32Å
124	D	90.6	Very high	89.5	Confident	51 Å²	51	54.6 Å²	54.6	27%	0.273	27%	0.272	S	S	.	.			trans	-140.6	122.3	-171.4	171.2	-38.5	0	0	0	106.2	E40 E126 Q127 Q128	E40-D124 WeakPolarHBondContact OE1-CA 3.38Å; D124-E126 PolarHBondContact OD1-N 3.14Å; D124-Q127 HydrophobicContact CB-CB 4.14Å; D124-Q127 WeakPolarHBondContact OD1-CA 3.3Å; D124-Q127 WeakPolarHBondContact OD1-CB 3.44Å; D124-Q127 PolarHBondContact OD1-N 3.39Å; D124-Q128 PolarHBondContact O-N 3.39Å; D124-Q128 VanDerWaalsContact O-N 3.14Å
125	R	92.6	Very high	89.8	Confident	21 Å²	21	51 Å²	51	8%	0.079	26%	0.255	C	S	.	.	T	Hydrogen-bonded Turn	trans	-89	-34.5	-167.1	-162.1	-162.9	59.4	52	-7.8	111.7	E40 Q127 Q128 T129 I155 D157 P192	E40-R125 WeakPolarHBondContact OE1-CB 3.42Å; E40-R125 PolarHBondContact OE1-N 3.17Å; R125-Q127 VanDerWaalsContact C-N 3.27Å; R125-Q128 CarbonylContact O-C 3.59Å; R125-Q128 PolarHBondContact O-N 2.79Å; R125-T129 HydrophobicContact CG-CG2 4.3Å; R125-T129 PolarHBondContact O-N 3.47Å; R125-I155 HydrophobicContact CB-CG2 3.87Å; R125-I155 HydrophobicContact CG-CB 4.33Å; R125-I155 HydrophobicContact CG-CG2 4.13Å; R125-D157 IonicContact CZ-OD1 3.15Å; R125-D157 IonicContact NE-OD1 3.33Å; R125-D157 PolarHBondContact NE-OD1 3.45Å; R125-D157 IonicContact NH2-OD1 2.73Å; R125-D157 PolarHBondContact NH2-OD1 3.32Å; R125-P192 PolarHBondContact NH2-O 3.35Å; R125-P192 VanDerWaalsContact NH2-O 3.12Å
126	E	91.7	Very high	89.8	Confident	49 Å²	49	50.5 Å²	50.5	23%	0.229	26%	0.255	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66.4	-34.5	174.2	-72.4	57.9	-116.4	0	0	110.1	D124 H161 P192	D124-E126 PolarHBondContact OD1-N 3.14Å; E126-H161 IonicContact OE2-CE1 3.51Å; E126-H161 IonicContact OE2-ND1 3.88Å; E126-P192 HydrophobicContact CG-CB 3.53Å
127	Q	90.6	Very high	89.6	Confident	163 Å²	163	47.9 Å²	47.9	76%	0.762	24%	0.243	S	C	*	.	T	Hydrogen-bonded Turn	trans	-70.8	-48.7	169.8	-173.2	177	16.1	0	0	111.8	D124 R125	D124-Q127 HydrophobicContact CB-CB 4.14Å; D124-Q127 WeakPolarHBondContact OD1-CA 3.3Å; D124-Q127 WeakPolarHBondContact OD1-CB 3.44Å; D124-Q127 PolarHBondContact OD1-N 3.39Å; R125-Q127 VanDerWaalsContact C-N 3.27Å
128	Q	90.2	Very high	89.3	Confident	94 Å²	94	51.7 Å²	51.7	44%	0.439	26%	0.258	S	S	.	.			trans	-157.1	107.4	179.8	-173.9	171.7	-11.2	0	0	114	D124 R125 D130 Q131 I155	D124-Q128 PolarHBondContact O-N 3.39Å; D124-Q128 VanDerWaalsContact O-N 3.14Å; R125-Q128 CarbonylContact O-C 3.59Å; R125-Q128 PolarHBondContact O-N 2.79Å; Q128-D130 WeakPolarHBondContact CG-O 3.18Å; Q128-D130 PolarHBondContact NE2-O 3.09Å; Q128-D130 PolarHBondContact O-N 3.01Å; Q128-Q131 HydrophobicContact CG-CG 4.14Å; Q128-I155 WeakPolarHBondContact O-CD1 3.19Å
129	T	89.8	Confident	88.7	Confident	76 Å²	76	51.9 Å²	51.9	47%	0.466	26%	0.259	S	S	.	.	S	Bend	trans	-58.1	-35.9	-178.3	53.3	0	0	0	0	116.1	R125 I155	R125-T129 HydrophobicContact CG-CG2 4.3Å; R125-T129 PolarHBondContact O-N 3.47Å; T129-I155 PolarHBondContact O-N 2.89Å
130	D	89.6	Confident	88	Confident	34 Å²	34	59 Å²	59	18%	0.182	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.7	144.7	179.1	68.3	-72	0	0	0	113.4	Q128 F132 R152 L153 I154	Q128-D130 WeakPolarHBondContact CG-O 3.18Å; Q128-D130 PolarHBondContact NE2-O 3.09Å; Q128-D130 PolarHBondContact O-N 3.01Å; D130-F132 VanDerWaalsContact OD2-CE2 3.3Å; D130-F132 WeakPolarHBondContact OD2-CE2 3.48Å; D130-R152 IonicContact OD1-NH2 2.76Å; D130-R152 PolarHBondContact OD1-NH2 2.87Å; D130-R152 IonicContact OD2-CZ 3.97Å; D130-R152 IonicContact OD2-NE 2.8Å; D130-R152 PolarHBondContact OD2-NE 2.81Å; D130-R152 IonicContact OD2-NH2 3.15Å; D130-R152 PolarHBondContact OD2-NH2 3.36Å; D130-L153 CarbonylContact C-O 3.32Å; D130-L153 WeakPolarHBondContact CA-O 3.22Å; D130-L153 VanDerWaalsContact CB-O 3.24Å; D130-L153 WeakPolarHBondContact CB-O 3.02Å; D130-I154 HydrophobicContact CB-CD1 3.99Å
131	Q	89.6	Confident	87	Confident	33 Å²	33	52.8 Å²	52.8	15%	0.154	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	147.1	-175.3	-47.1	-161.2	3	0	0	110.6	H99 Q128 L153 I155	H99-Q131 PolarHBondContact CE1-OE1 2.92Å; H99-Q131 VanDerWaalsContact CE1-OE1 3.23Å; H99-Q131 PolarHBondContact NE2-OE1 2.83Å; Q128-Q131 HydrophobicContact CG-CG 4.14Å; Q131-L153 HydrophobicContact CB-CB 4.15Å; Q131-L153 PolarHBondContact N-O 3.46Å; Q131-L153 WeakPolarHBondContact O-CB 3.34Å; Q131-L153 PolarHBondContact O-N 2.96Å; Q131-I155 HydrophobicContact CG-CD1 4.08Å
132	F	90.2	Very high	86.2	Confident	128 Å²	128	60.4 Å²	60.4	56%	0.561	30%	0.301	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-115.3	114.4	-178.9	-75.2	-92.7	0	0	0	110.8	D130 L151 R152	D130-F132 VanDerWaalsContact OD2-CE2 3.3Å; D130-F132 WeakPolarHBondContact OD2-CE2 3.48Å; F132-L151 WeakPolarHBondContact CA-O 3.33Å; F132-R152 HydrophobicContact CD1-CB 4.14Å; F132-R152 HydrophobicContact CD1-CG 4.23Å; F132-R152 HydrophobicContact CE1-CB 3.81Å; F132-R152 HydrophobicContact CE1-CG 3.69Å; F132-R152 HydrophobicContact CE2-CG 4.17Å; F132-R152 HydrophobicContact CZ-CB 4.31Å; F132-R152 HydrophobicContact CZ-CG 3.67Å
133	A	88.9	Confident	85.3	Confident	2 Å²	2	62.3 Å²	62.3	2%	0.017	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.9	148.3	169.3	0	0	0	0	0	110.3	L97 H99 L102 L151	L97-A133 HydrophobicContact CD1-CB 4.09Å; H99-A133 HydrophobicContact CB-CB 3.69Å; L102-A133 HydrophobicContact CD1-CB 4.04Å; A133-L151 HydrophobicContact CB-CB 4.2Å; A133-L151 PolarHBondContact N-O 2.82Å; A133-L151 PolarHBondContact O-N 2.88Å
134	T	89.3	Confident	84.5	Confident	48 Å²	48	65.9 Å²	65.9	29%	0.294	34%	0.335	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	124.3	170.1	-56.4	0	0	0	0	109.2	N98 Q148	N98-T134 PolarHBondContact N-O 2.87Å; N98-T134 PolarHBondContact O-N 3.17Å; T134-Q148 HydrophobicContact CG2-CB 4.17Å
135	L	88.3	Confident	83.9	Confident	1 Å²	1	66.9 Å²	66.9	1%	0.005	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.1	113	173.4	168.4	65.2	0	0	0	108.2	I2 V4 V51 C95 L97 L104 Q148 V149 L151	I2-L135 HydrophobicContact CG2-CD2 4.48Å; V4-L135 HydrophobicContact CG2-CD2 3.97Å; V51-L135 HydrophobicContact CG1-CD2 3.76Å; V51-L135 HydrophobicContact CG2-CD2 4Å; C95-L135 HydrophobicContact CB-CD1 4.06Å; L97-L135 HydrophobicContact CD1-CB 4.02Å; L104-L135 HydrophobicContact CD2-CD1 3.87Å; L135-Q148 WeakPolarHBondContact O-CA 3.2Å; L135-V149 HydrophobicContact CB-CG1 3.69Å; L135-V149 HydrophobicContact CD2-CG1 3.82Å; L135-V149 HydrophobicContact CG-CG1 3.98Å; L135-V149 PolarHBondContact N-O 2.95Å; L135-V149 PolarHBondContact O-N 2.99Å; L135-L151 HydrophobicContact CB-CD1 4.19Å
136	T	87.5	Confident	83.3	Confident	22 Å²	22	69.3 Å²	69.3	14%	0.135	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	124.6	179.8	-54.2	0	0	0	0	109.6	C95 Q96 Y138 S147 Q148	C95-T136 WeakPolarHBondContact CA-O 3.27Å; Q96-T136 PolarHBondContact N-O 3.31Å; Q96-T136 PolarHBondContact O-N 3.21Å; T136-Y138 HydrophobicContact CG2-CD2 4.34Å; T136-Y138 HydrophobicContact CG2-CE1 4.23Å; T136-Y138 HydrophobicContact CG2-CE2 3.66Å; T136-S147 WeakPolarHBondContact CA-O 3.44Å; T136-Q148 HydrophobicContact CG2-CB 4.48Å
137	C	85.3	Confident	82.8	Confident	2 Å²	2	68 Å²	68	1%	0.014	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	132.7	177.7	-66.6	0	0	0	0	110.5	I93 N94 C95 S146 S147	I93-C137 HydrophobicContact CG2-CB 3.78Å; N94-C137 WeakPolarHBondContact O-CA 3.48Å; C95-C137 HydrophobicContact CB-CB 4.2Å; C95-C137 WeakPolarHBondContact CB-SG 3.33Å; C95-C137 WeakPolarHBondContact SG-CB 3.42Å; C95-C137 CovalentContact SG-SG 2.05Å; C95-C137 PolarHBondContact SG-SG 2.77Å; C137-S146 WeakPolarHBondContact O-CA 3.32Å; C137-S147 PolarHBondContact N-O 2.86Å; C137-S147 PolarHBondContact O-N 2.87Å
138	Y	82.9	Confident	82.4	Confident	80 Å²	80	66 Å²	66	31%	0.314	35%	0.348	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	138.1	-177.8	-58.2	-93.9	0	0	0	110.4	I93 N94 Q96 T136 L145	I93-Y138 WeakPolarHBondContact CG2-O 3.38Å; N94-Y138 PolarHBondContact N-O 2.78Å; N94-Y138 PolarHBondContact O-N 2.81Å; Q96-Y138 HydrophobicContact CG-CE2 4.49Å; T136-Y138 HydrophobicContact CG2-CD2 4.34Å; T136-Y138 HydrophobicContact CG2-CE1 4.23Å; T136-Y138 HydrophobicContact CG2-CE2 3.66Å; Y138-L145 WeakPolarHBondContact CA-O 3.32Å
139	D	78.2	Confident	82.2	Confident	11 Å²	11	62 Å²	62	6%	0.059	33%	0.329	C	S	.	.			trans	-76	175.6	162.8	65	38.3	0	0	0	111.4	L91 G141 P144 L145	L91-D139 HydrophobicContact CD2-CB 3.92Å; D139-G141 WeakPolarHBondContact OD1-CA 3.49Å; D139-G141 PolarHBondContact OD1-N 2.72Å; D139-P144 WeakPolarHBondContact O-CB 3.43Å; D139-P144 WeakPolarHBondContact OD1-CA 3.15Å; D139-L145 PolarHBondContact N-O 3.46Å; D139-L145 VanDerWaalsContact N-O 3.08Å; D139-L145 PolarHBondContact OD1-N 2.88Å; D139-L145 VanDerWaalsContact OD2-CB 3.25Å; D139-L145 WeakPolarHBondContact OD2-CB 3.25Å; D139-L145 PolarHBondContact OD2-N 2.68Å
140	Y	74.5	Confident	82	Confident	149 Å²	149	59 Å²	59	58%	0.584	32%	0.315	S	S	*	.	S	Bend	trans	-100	29	168.8	-69.5	-69.7	0	0	0	112.4	S92	S92-Y140 WeakPolarHBondContact O-CD2 3.48Å; S92-Y140 WeakPolarHBondContact O-CE2 3.46Å
141	G	69.2	Low	81.9	Confident	31 Å²	31	57.5 Å²	57.5	32%	0.32	31%	0.306	S	S	.	.			trans	-64.8	169.7	173.7	0	0	0	0	0	112.8	D139 P143 P144	D139-G141 WeakPolarHBondContact OD1-CA 3.49Å; D139-G141 PolarHBondContact OD1-N 2.72Å; G141-P143 VanDerWaalsContact C-C 3.42Å; G141-P143 CarbonylContact C-O 3.43Å; G141-P143 CarbonylContact O-C 3.54Å; G141-P144 WeakPolarHBondContact O-CA 3.49Å; G141-P144 WeakPolarHBondContact O-CD 3.26Å; G141-P144 VanDerWaalsContact O-N 3.09Å
142	Q	72.6	Confident	82	Confident	199 Å²	199	59.9 Å²	59.9	93%	0.93	31%	0.314	S	S	*	.	S	Bend	trans	-129.6	103.7	172.7	-67.5	-167.2	4.4	0	0	110.4
143	P	69.7	Low	81.9	Confident	109 Å²	109	53.9 Å²	53.9	71%	0.708	29%	0.288	S	S	*	.	S	Bend	cis	-67.4	154.3	-6.6	32.1	-36.6	0	0	0	112.1	G141	G141-P143 VanDerWaalsContact C-C 3.42Å; G141-P143 CarbonylContact C-O 3.43Å; G141-P143 CarbonylContact O-C 3.54Å
144	P	73.4	Confident	81.9	Confident	80 Å²	80	55.4 Å²	55.4	52%	0.519	30%	0.295	S	S	.	.	P	Polyproline II helix	trans	-72	137.2	178.2	28.9	-34.3	0	0	0	111	D139 G141	D139-P144 WeakPolarHBondContact O-CB 3.43Å; D139-P144 WeakPolarHBondContact OD1-CA 3.15Å; G141-P144 WeakPolarHBondContact O-CA 3.49Å; G141-P144 WeakPolarHBondContact O-CD 3.26Å; G141-P144 VanDerWaalsContact O-N 3.09Å
145	L	77.9	Confident	82	Confident	72 Å²	72	53.5 Å²	53.5	38%	0.377	28%	0.283	S	S	.	.	P	Polyproline II helix	trans	-93.6	150.8	173.2	-50.1	178.2	0	0	0	110.4	I8 Y138 D139	I8-L145 HydrophobicContact CB-CD1 4.49Å; I8-L145 HydrophobicContact CG2-CD1 4.16Å; Y138-L145 WeakPolarHBondContact CA-O 3.32Å; D139-L145 PolarHBondContact N-O 3.46Å; D139-L145 VanDerWaalsContact N-O 3.08Å; D139-L145 PolarHBondContact OD1-N 2.88Å; D139-L145 VanDerWaalsContact OD2-CB 3.25Å; D139-L145 WeakPolarHBondContact OD2-CB 3.25Å; D139-L145 PolarHBondContact OD2-N 2.68Å
146	S	79.8	Confident	82.1	Confident	73 Å²	73	57.6 Å²	57.6	51%	0.51	30%	0.302	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.2	137	-177.2	65	0	0	0	0	111.9	C137	C137-S146 WeakPolarHBondContact O-CA 3.32Å
147	S	81.1	Confident	82.2	Confident	22 Å²	22	58.1 Å²	58.1	15%	0.154	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	138.6	169.1	-173.7	0	0	0	0	109.9	R5 T136 C137	R5-S147 WeakPolarHBondContact O-CB 3.47Å; R5-S147 PolarHBondContact O-OG 2.86Å; T136-S147 WeakPolarHBondContact CA-O 3.44Å; C137-S147 PolarHBondContact N-O 2.86Å; C137-S147 PolarHBondContact O-N 2.87Å
148	Q	83.6	Confident	82.4	Confident	120 Å²	120	61.1 Å²	61.1	56%	0.561	32%	0.319	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-119.9	135.4	-178.1	59.5	176.1	75.9	0	0	111.2	T134 L135 T136	T134-Q148 HydrophobicContact CG2-CB 4.17Å; L135-Q148 WeakPolarHBondContact O-CA 3.2Å; T136-Q148 HydrophobicContact CG2-CB 4.48Å
149	V	84.8	Confident	82.7	Confident	9 Å²	9	58 Å²	58	6%	0.055	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115	136.1	170.4	71.7	0	0	0	0	109	I2 V4 R32 I34 L135 L151	I2-V149 HydrophobicContact CG2-CG1 4.48Å; V4-V149 HydrophobicContact CG2-CB 4.3Å; V4-V149 HydrophobicContact CG2-CG1 3.72Å; R32-V149 WeakPolarHBondContact O-CG2 3.16Å; I34-V149 HydrophobicContact CD1-CG2 3.82Å; I34-V149 HydrophobicContact CG1-CG2 4.13Å; L135-V149 HydrophobicContact CB-CG1 3.69Å; L135-V149 HydrophobicContact CD2-CG1 3.82Å; L135-V149 HydrophobicContact CG-CG1 3.98Å; L135-V149 PolarHBondContact N-O 2.95Å; L135-V149 PolarHBondContact O-N 2.99Å; V149-L151 HydrophobicContact CG1-CD2 4.19Å
150	G	85.7	Confident	83.2	Confident	15 Å²	15	60.1 Å²	60.1	16%	0.155	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.7	135.1	172.4	0	0	0	0	0	109.5	R32 T33 I34	R32-G150 PolarHBondContact O-N 2.87Å; T33-G150 CarbonylContact C-O 3.43Å; T33-G150 VanDerWaalsContact CA-O 3.3Å; T33-G150 WeakPolarHBondContact CA-O 3.26Å; I34-G150 PolarHBondContact N-O 3.38Å
151	L	88.6	Confident	84	Confident	1 Å²	1	56.1 Å²	56.1	1%	0.005	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	118.2	170.9	-53.3	178.2	0	0	0	107.4	I2 I34 L36 L97 L117 F132 A133 L135 V149	I2-L151 HydrophobicContact CD1-CD2 3.92Å; I2-L151 HydrophobicContact CG1-CD2 4.39Å; I34-L151 HydrophobicContact CB-CD2 4.05Å; I34-L151 HydrophobicContact CD1-CD2 4.45Å; I34-L151 WeakPolarHBondContact O-CA 3.2Å; L36-L151 HydrophobicContact CD1-CB 4.17Å; L36-L151 HydrophobicContact CD1-CD1 4.22Å; L36-L151 HydrophobicContact CD1-CD2 4.3Å; L36-L151 HydrophobicContact CD1-CG 4.46Å; L97-L151 HydrophobicContact CD1-CD1 4.01Å; L117-L151 HydrophobicContact CD2-CD1 4.06Å; F132-L151 WeakPolarHBondContact CA-O 3.33Å; A133-L151 HydrophobicContact CB-CB 4.2Å; A133-L151 PolarHBondContact N-O 2.82Å; A133-L151 PolarHBondContact O-N 2.88Å; L135-L151 HydrophobicContact CB-CD1 4.19Å; V149-L151 HydrophobicContact CG1-CD2 4.19Å
152	R	89.7	Confident	85.1	Confident	83 Å²	83	55 Å²	55	31%	0.313	30%	0.295	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100	108.7	171.8	-172.9	-178.5	-173.2	-142.6	0.5	108.1	T33 I34 L35 L36 D130 F132 I154	T33-R152 HydrophobicContact CG2-CB 3.86Å; I34-R152 PolarHBondContact O-N 2.68Å; L35-R152 WeakPolarHBondContact CA-O 3.29Å; L36-R152 PolarHBondContact N-O 2.8Å; D130-R152 IonicContact OD1-NH2 2.76Å; D130-R152 PolarHBondContact OD1-NH2 2.87Å; D130-R152 IonicContact OD2-CZ 3.97Å; D130-R152 IonicContact OD2-NE 2.8Å; D130-R152 PolarHBondContact OD2-NE 2.81Å; D130-R152 IonicContact OD2-NH2 3.15Å; D130-R152 PolarHBondContact OD2-NH2 3.36Å; F132-R152 HydrophobicContact CD1-CB 4.14Å; F132-R152 HydrophobicContact CD1-CG 4.23Å; F132-R152 HydrophobicContact CE1-CB 3.81Å; F132-R152 HydrophobicContact CE1-CG 3.69Å; F132-R152 HydrophobicContact CE2-CG 4.17Å; F132-R152 HydrophobicContact CZ-CB 4.31Å; F132-R152 HydrophobicContact CZ-CG 3.67Å; R152-I154 HydrophobicContact CG-CD1 3.92Å
153	L	89.6	Confident	86.2	Confident	3 Å²	3	45.9 Å²	45.9	2%	0.016	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.8	116.9	171.5	-139.8	67.2	0	0	0	107.7	L36 V38 L102 F123 D130 Q131	L36-L153 HydrophobicContact CB-CD1 3.91Å; L36-L153 HydrophobicContact CD1-CD1 4.32Å; L36-L153 CarbonylContact O-C 3.51Å; L36-L153 WeakPolarHBondContact O-CA 3.27Å; V38-L153 HydrophobicContact CB-CD1 4.5Å; V38-L153 HydrophobicContact CB-CD2 4.49Å; V38-L153 HydrophobicContact CB-CG 4.22Å; V38-L153 HydrophobicContact CG2-CD1 3.46Å; V38-L153 VanDerWaalsContact CG2-CD1 3.46Å; V38-L153 HydrophobicContact CG2-CD2 4.07Å; V38-L153 HydrophobicContact CG2-CG 3.68Å; L102-L153 HydrophobicContact CD1-CD1 4.04Å; L102-L153 HydrophobicContact CD1-CD2 4.22Å; L102-L153 HydrophobicContact CD2-CD1 4.42Å; L102-L153 HydrophobicContact CD2-CD2 4.2Å; L102-L153 HydrophobicContact CG-CD2 4.41Å; F123-L153 HydrophobicContact CD1-CD2 4.07Å; F123-L153 HydrophobicContact CE1-CD2 3.51Å; F123-L153 HydrophobicContact CE2-CD2 4.08Å; F123-L153 HydrophobicContact CZ-CD2 3.51Å; D130-L153 CarbonylContact C-O 3.32Å; D130-L153 WeakPolarHBondContact CA-O 3.22Å; D130-L153 VanDerWaalsContact CB-O 3.24Å; D130-L153 WeakPolarHBondContact CB-O 3.02Å; Q131-L153 HydrophobicContact CB-CB 4.15Å; Q131-L153 PolarHBondContact N-O 3.46Å; Q131-L153 WeakPolarHBondContact O-CB 3.34Å; Q131-L153 PolarHBondContact O-N 2.96Å
154	I	89.3	Confident	87.4	Confident	34 Å²	34	45.1 Å²	45.1	17%	0.174	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.5	125.2	166.4	-52.7	-58.1	0	0	0	106.1	L35 L36 Y37 V38 D130 R152	L35-I154 HydrophobicContact CD2-CG1 4.24Å; L36-I154 PolarHBondContact O-N 3.25Å; Y37-I154 WeakPolarHBondContact CA-O 3.36Å; Y37-I154 HydrophobicContact CD1-CB 3.95Å; Y37-I154 HydrophobicContact CD1-CG2 4.07Å; Y37-I154 HydrophobicContact CE1-CB 4Å; Y37-I154 HydrophobicContact CE1-CG1 4.3Å; Y37-I154 HydrophobicContact CE1-CG2 3.94Å; V38-I154 PolarHBondContact N-O 2.89Å; D130-I154 HydrophobicContact CB-CD1 3.99Å; R152-I154 HydrophobicContact CG-CD1 3.92Å
155	I	91	Very high	88.4	Confident	8 Å²	8	43.4 Å²	43.4	4%	0.041	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.3	125.1	178.3	-67.1	150.8	0	0	0	108.3	V38 E40 F123 R125 Q128 T129 Q131	V38-I155 CarbonylContact O-C 3.54Å; V38-I155 VanDerWaalsContact O-CA 3.3Å; V38-I155 WeakPolarHBondContact O-CA 3.34Å; E40-I155 HydrophobicContact CB-CG2 4.13Å; F123-I155 HydrophobicContact CB-CD1 3.85Å; F123-I155 HydrophobicContact CB-CG1 3.92Å; F123-I155 HydrophobicContact CB-CG2 4.3Å; F123-I155 HydrophobicContact CD1-CD1 3.94Å; F123-I155 HydrophobicContact CD1-CG1 4.42Å; F123-I155 HydrophobicContact CG-CD1 4.22Å; F123-I155 HydrophobicContact CG-CG1 4.32Å; R125-I155 HydrophobicContact CB-CG2 3.87Å; R125-I155 HydrophobicContact CG-CB 4.33Å; R125-I155 HydrophobicContact CG-CG2 4.13Å; Q128-I155 WeakPolarHBondContact O-CD1 3.19Å; T129-I155 PolarHBondContact O-N 2.89Å; Q131-I155 HydrophobicContact CG-CD1 4.08Å
156	E	89.1	Confident	89.1	Confident	86 Å²	86	45.3 Å²	45.3	40%	0.402	23%	0.229	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.6	120.2	179.1	-57.4	-178.7	132.2	0	0	110	Y37 V38 T39 E40	Y37-E156 HydrophobicContact CD1-CG 3.93Å; Y37-E156 HydrophobicContact CG-CG 4.49Å; V38-E156 PolarHBondContact O-N 3.19Å; T39-E156 PolarHBondContact OG1-OE2 3.07Å; E40-E156 WeakPolarHBondContact CB-O 3.46Å; E40-E156 PolarHBondContact N-O 2.86Å
157	D	89.4	Confident	89.4	Confident	33 Å²	33	47.1 Å²	47.1	18%	0.176	23%	0.23	C	C	.	.	P	Polyproline II helix	trans	-52.9	129	-177.5	-173.7	92.1	0	0	0	113.6	E40 R125 I194 N197	E40-D157 WeakPolarHBondContact OE2-CA 3.28Å; R125-D157 IonicContact CZ-OD1 3.15Å; R125-D157 IonicContact NE-OD1 3.33Å; R125-D157 PolarHBondContact NE-OD1 3.45Å; R125-D157 IonicContact NH2-OD1 2.73Å; R125-D157 PolarHBondContact NH2-OD1 3.32Å; D157-I194 HydrophobicContact CB-CG2 3.73Å; D157-I194 WeakPolarHBondContact OD1-CG2 3.22Å; D157-I194 PolarHBondContact OD1-N 3.18Å; D157-N197 WeakPolarHBondContact OD2-CB 3.23Å; D157-N197 PolarHBondContact OD2-ND2 3.26Å
158	I	89.5	Confident	89.5	Confident	65 Å²	65	52.6 Å²	52.6	33%	0.333	27%	0.268	S	S	.	.			trans	-110.7	140.7	162.4	-73	-179.7	0	0	0	108.2	T39 E40 D160	T39-I158 HydrophobicContact CG2-CD1 3.95Å; T39-I158 HydrophobicContact CG2-CG1 4.02Å; E40-I158 HydrophobicContact CB-CB 4.1Å; E40-I158 HydrophobicContact CB-CD1 4.21Å; E40-I158 HydrophobicContact CB-CG1 3.98Å; E40-I158 HydrophobicContact CG-CB 4.14Å; E40-I158 WeakPolarHBondContact O-CD1 3.42Å; E40-I158 PolarHBondContact OE2-N 2.99Å; I158-D160 HydrophobicContact CG2-CB 4.4Å; I158-D160 PolarHBondContact O-N 3.3Å
159	N	89.9	Confident	89.7	Confident	15 Å²	15	53.4 Å²	53.4	8%	0.08	27%	0.27	C	S	.	.	S	Bend	trans	-67.3	95.9	166.9	-175.8	-11.1	0	0	0	110.9	D193 N197 D243 Q244 K280 H282	N159-D193 WeakPolarHBondContact CA-OD2 3.38Å; N159-D193 PolarHBondContact OD1-OD2 3.42Å; N159-N197 HydrophobicContact CB-CB 4.08Å; N159-N197 PolarHBondContact N-ND2 2.73Å; N159-D243 VanDerWaalsContact ND2-CG 3.34Å; N159-D243 PolarHBondContact ND2-OD2 2.76Å; N159-D243 PolarHBondContact OD1-OD2 2.88Å; N159-Q244 PolarHBondContact ND2-NE2 3.31Å; N159-K280 PolarHBondContact ND2-O 3.46Å; N159-H282 PolarHBondContact OD1-CE1 3.19Å; N159-H282 PolarHBondContact OD1-ND1 2.88Å
160	D	89.7	Confident	90.2	Very high	55 Å²	55	53.3 Å²	53.3	29%	0.294	27%	0.269	S	S	.	.			trans	-127.6	-20.6	175.5	91.9	-39.4	0	0	0	114.4	H41 I158	H41-D160 IonicContact CD2-OD2 3.15Å; H41-D160 IonicContact CE1-OD2 2.6Å; H41-D160 IonicContact NE2-OD2 2.75Å; H41-D160 PolarHBondContact NE2-OD2 2.92Å; I158-D160 HydrophobicContact CG2-CB 4.4Å; I158-D160 PolarHBondContact O-N 3.3Å
161	H	90.8	Very high	90.7	Very high	66 Å²	66	55.4 Å²	55.4	31%	0.306	28%	0.276	S	S	.	.	S	Bend	trans	-85.6	-127.3	168.7	-68.3	73.4	0	0	0	110.8	E126 P192 D193 H282	E126-H161 IonicContact OE2-CE1 3.51Å; E126-H161 IonicContact OE2-ND1 3.88Å; H161-P192 HydrophobicContact CB-CB 4.06Å; H161-P192 HydrophobicContact CB-CG 3.84Å; H161-D193 WeakPolarHBondContact CB-OD1 3.2Å; H161-H282 PolarHBondContact O-CD2 2.75Å; H161-H282 VanDerWaalsContact O-CD2 3.25Å; H161-H282 PolarHBondContact O-CE1 3.02Å; H161-H282 PolarHBondContact O-ND1 2.79Å; H161-H282 PolarHBondContact O-NE2 2.96Å
162	G	91.9	Very high	91.1	Very high	8 Å²	8	55.7 Å²	55.7	8%	0.082	28%	0.278	C	S	.	.			trans	137.3	172.6	-174.9	0	0	0	0	0	114.8	D191	G162-D191 VanDerWaalsContact C-CG 3.48Å; G162-D191 WeakPolarHBondContact CA-OD1 3.33Å; G162-D191 VanDerWaalsContact CA-OD2 3.28Å; G162-D191 WeakPolarHBondContact CA-OD2 3.32Å; G162-D191 PolarHBondContact N-OD1 2.96Å
163	P	95.9	Very high	91.5	Very high	7 Å²	7	56.9 Å²	56.9	5%	0.045	29%	0.287	C	S	.	.			trans	-69.9	136	-156.1	-22.7	32.1	0	0	0	114.2	D191 L200 V241 D243 V284	P163-D191 WeakPolarHBondContact CA-OD2 3.07Å; P163-D191 VanDerWaalsContact CD-OD2 3.28Å; P163-D191 WeakPolarHBondContact CD-OD2 3.36Å; P163-D191 WeakPolarHBondContact CG-OD2 3.28Å; P163-L200 HydrophobicContact CB-CD2 3.7Å; P163-L200 HydrophobicContact CG-CD2 3.57Å; P163-V241 HydrophobicContact CB-CB 4.23Å; P163-V241 HydrophobicContact CB-CG1 3.97Å; P163-V241 HydrophobicContact CG-CG1 4.49Å; P163-D243 HydrophobicContact CG-CB 4.04Å; P163-V284 HydrophobicContact CB-CG1 3.87Å; P163-V284 VanDerWaalsContact O-CB 3.29Å; P163-V284 WeakPolarHBondContact O-CB 3.34Å; P163-V284 VanDerWaalsContact O-CG1 3.29Å; P163-V284 WeakPolarHBondContact O-CG1 3Å
164	Q	94.8	Very high	91.9	Very high	92 Å²	92	57.1 Å²	57.1	43%	0.43	29%	0.288	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	122.2	-179.1	-70.6	172.4	55.7	0	0	111.5	A189 H190	Q164-A189 CarbonylContact O-C 3.59Å; Q164-A189 VanDerWaalsContact O-CA 3.28Å; Q164-A189 WeakPolarHBondContact O-CA 3.33Å; Q164-H190 PolarHBondContact N-O 3.18Å; Q164-H190 PolarHBondContact O-N 2.96Å; Q164-H190 PolarHBondContact O-ND1 2.83Å
165	F	95.3	Very high	92.2	Very high	44 Å²	44	61 Å²	61	19%	0.193	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.9	135.5	171	-59.6	-74.6	0	0	0	111	Q167 M170 I187 A189 V239 V241 V284	F165-Q167 VanDerWaalsContact C-N 3.27Å; F165-Q167 PolarHBondContact O-N 2.92Å; F165-M170 HydrophobicContact CD1-CE 4.45Å; F165-M170 HydrophobicContact CD1-SD 3.97Å; F165-M170 HydrophobicContact CE1-CE 4.09Å; F165-M170 HydrophobicContact CE1-SD 4.05Å; F165-M170 HydrophobicContact CZ-CE 4.35Å; F165-I187 HydrophobicContact CD1-CG2 3.94Å; F165-I187 HydrophobicContact CE1-CG2 3.69Å; F165-A189 HydrophobicContact CD1-CB 4.47Å; F165-V239 HydrophobicContact CE1-CG1 4.47Å; F165-V241 HydrophobicContact CD1-CG2 4.42Å; F165-V241 HydrophobicContact CE1-CG2 3.54Å; F165-V241 HydrophobicContact CZ-CG2 3.89Å; F165-V284 HydrophobicContact CD2-CG1 4.15Å; F165-V284 HydrophobicContact CD2-CG2 4.12Å; F165-V284 HydrophobicContact CE2-CB 4.29Å; F165-V284 HydrophobicContact CE2-CG1 3.62Å; F165-V284 HydrophobicContact CE2-CG2 3.81Å; F165-V284 HydrophobicContact CZ-CG1 3.88Å
166	K	91.2	Very high	92.5	Very high	113 Å²	113	60.8 Å²	60.8	49%	0.491	30%	0.303	S	S	.	.	S	Bend	trans	-75	-16.5	174.9	-55.8	-149.5	-163.6	68.7	0	113.4	D188 A189	K166-D188 WeakPolarHBondContact CD-OD2 3.16Å; K166-D188 WeakPolarHBondContact CG-OD2 3.36Å; K166-D188 PolarHBondContact N-O 2.87Å; K166-D188 IonicContact NZ-OD1 2.84Å; K166-D188 PolarHBondContact NZ-OD1 2.83Å; K166-D188 IonicContact NZ-OD2 2.63Å; K166-D188 PolarHBondContact NZ-OD2 2.9Å; K166-A189 PolarHBondContact NZ-O 2.87Å
167	Q	87.8	Confident	92.8	Very high	110 Å²	110	60.9 Å²	60.9	51%	0.514	31%	0.306	S	S	.	.			trans	-124.3	129.7	178.1	-64.1	-172.8	-9.1	0	0	110.2	F165 K169 Y185	F165-Q167 VanDerWaalsContact C-N 3.27Å; F165-Q167 PolarHBondContact O-N 2.92Å; Q167-K169 VanDerWaalsContact C-N 3.27Å; Q167-K169 PolarHBondContact O-N 3.22Å; Q167-Y185 PolarHBondContact OE1-OH 2.8Å; Q167-Y185 VanDerWaalsContact OE1-OH 3.05Å
168	S	81.7	Confident	93.2	Very high	138 Å²	138	60.4 Å²	60.4	97%	0.965	31%	0.305	S	S	*	.	S	Bend	trans	-78.6	-7.2	179.1	54.6	0	0	0	0	114.3
169	K	88.7	Confident	93.6	Very high	137 Å²	137	61.7 Å²	61.7	60%	0.596	32%	0.318	S	S	*	.			trans	-140.6	116.2	175.9	-168.5	-175.6	-176.6	-166.9	0	109	Q167 I171	Q167-K169 VanDerWaalsContact C-N 3.27Å; Q167-K169 PolarHBondContact O-N 3.22Å; K169-I171 HydrophobicContact CD-CD1 3.87Å; K169-I171 HydrophobicContact CD-CG1 4.13Å; K169-I171 VanDerWaalsContact CE-CD1 3.44Å; K169-I171 HydrophobicContact CG-CD1 4.35Å; K169-I171 HydrophobicContact CG-CG1 4.05Å
170	M	95.3	Very high	93.9	Very high	7 Å²	7	64.7 Å²	64.7	3%	0.034	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.9	118.5	176.1	-59.2	-177.4	-64.2	0	0	108.6	F165 Y185 I187 V239 L288 H289	F165-M170 HydrophobicContact CD1-CE 4.45Å; F165-M170 HydrophobicContact CD1-SD 3.97Å; F165-M170 HydrophobicContact CE1-CE 4.09Å; F165-M170 HydrophobicContact CE1-SD 4.05Å; F165-M170 HydrophobicContact CZ-CE 4.35Å; M170-Y185 HydrophobicContact CB-CE1 3.98Å; M170-Y185 HydrophobicContact CG-CE1 4.03Å; M170-Y185 HydrophobicContact SD-CE1 4.15Å; M170-I187 HydrophobicContact CE-CD1 4.3Å; M170-I187 HydrophobicContact SD-CD1 3.61Å; M170-I187 HydrophobicContact SD-CG2 4.41Å; M170-V239 HydrophobicContact CE-CB 4.27Å; M170-V239 HydrophobicContact CE-CG2 4.24Å; M170-L288 HydrophobicContact CB-CB 4.26Å; M170-L288 HydrophobicContact CB-CD1 3.89Å; M170-L288 HydrophobicContact CE-CB 4.36Å; M170-H289 PolarHBondContact O-N 3.38Å
171	I	96.2	Very high	94.1	Very high	59 Å²	59	64.2 Å²	64.2	30%	0.303	35%	0.348	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	138.4	175	-48.5	175.4	0	0	0	108.1	K169 Y185 H289 F291	K169-I171 HydrophobicContact CD-CD1 3.87Å; K169-I171 HydrophobicContact CD-CG1 4.13Å; K169-I171 VanDerWaalsContact CE-CD1 3.44Å; K169-I171 HydrophobicContact CG-CD1 4.35Å; K169-I171 HydrophobicContact CG-CG1 4.05Å; I171-Y185 WeakPolarHBondContact O-CD2 3.27Å; I171-Y185 VanDerWaalsContact O-CE2 3.24Å; I171-Y185 WeakPolarHBondContact O-CE2 3.34Å; I171-H289 CarbonylContact C-O 3.56Å; I171-H289 VanDerWaalsContact CA-O 3.3Å; I171-H289 WeakPolarHBondContact CA-O 3.42Å; I171-F291 HydrophobicContact CG2-CD2 3.71Å; I171-F291 HydrophobicContact CG2-CE2 3.72Å
172	A	96.6	Very high	94.5	Very high	6 Å²	6	62.8 Å²	62.8	5%	0.05	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.2	160.6	167.7	0	0	0	0	0	111.1	I184 Y185 L288 H289 V290 F291	A172-I184 HydrophobicContact CB-CG2 3.4Å; A172-I184 VanDerWaalsContact CB-CG2 3.4Å; A172-Y185 HydrophobicContact CB-CD2 3.93Å; A172-Y185 HydrophobicContact CB-CG 4.28Å; A172-L288 HydrophobicContact CB-CD1 4.07Å; A172-H289 PolarHBondContact N-O 2.87Å; A172-V290 HydrophobicContact CB-CG2 4.46Å; A172-V290 WeakPolarHBondContact O-CA 3.39Å; A172-F291 PolarHBondContact O-N 2.88Å
173	H	97.6	Very high	94.8	Very high	109 Å²	109	70.2 Å²	70.2	51%	0.505	37%	0.374	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	137.6	175.1	-77.5	-101.9	0	0	0	107.9	F291 D293	H173-F291 WeakPolarHBondContact CA-O 3.12Å; H173-F291 AromaticContact CE1-CD2 3.98Å; H173-F291 AromaticContact NE2-CD2 3.84Å; H173-D293 IonicContact CE1-OD1 3.19Å; H173-D293 IonicContact CG-OD1 3.16Å; H173-D293 IonicContact ND1-OD1 2.71Å; H173-D293 PolarHBondContact ND1-OD1 3.2Å
174	I	97.4	Very high	94.8	Very high	8 Å²	8	70.7 Å²	70.7	4%	0.041	38%	0.376	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.3	128.6	174.2	178.2	167	0	0	0	108.2	T182 I184 F227 V290 F291 I292 D293	I174-T182 HydrophobicContact CD1-CG2 3.66Å; I174-T182 HydrophobicContact CG1-CG2 4.27Å; I174-I184 HydrophobicContact CB-CG1 4.25Å; I174-I184 HydrophobicContact CD1-CD1 4.16Å; I174-I184 HydrophobicContact CD1-CG1 3.62Å; I174-I184 HydrophobicContact CG1-CG1 4.49Å; I174-I184 HydrophobicContact CG2-CG1 4.38Å; I174-F227 HydrophobicContact CD1-CE2 4.45Å; I174-F227 HydrophobicContact CG2-CD2 4.38Å; I174-V290 HydrophobicContact CG2-CG1 3.68Å; I174-F291 PolarHBondContact N-O 2.86Å; I174-I292 HydrophobicContact CG2-CD1 3.63Å; I174-I292 CarbonylContact O-C 3.54Å; I174-I292 VanDerWaalsContact O-CA 3.29Å; I174-I292 WeakPolarHBondContact O-CA 3.26Å; I174-D293 PolarHBondContact O-N 2.85Å
175	K	97	Very high	94.9	Very high	114 Å²	114	68.3 Å²	68.3	50%	0.496	36%	0.364	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-60.4	141.5	172.2	-76.1	176.9	165.2	-73.7	0	110.8	S178 D293 V295	K175-S178 WeakPolarHBondContact O-CB 3.22Å; K175-S178 PolarHBondContact O-N 3.05Å; K175-S178 PolarHBondContact O-OG 3.48Å; K175-D293 WeakPolarHBondContact CA-O 3.48Å; K175-D293 HydrophobicContact CG-CB 3.93Å; K175-V295 HydrophobicContact CB-CG2 4.04Å; K175-V295 HydrophobicContact CD-CG2 4.24Å; K175-V295 HydrophobicContact CG-CG2 4.14Å
176	E	97	Very high	95	Very high	4 Å²	4	72.1 Å²	72.1	2%	0.019	38%	0.38	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59.6	167.4	163.4	69	-161.4	121.7	0	0	112.1	S178 F227 R229 I292 D293 D294 V295	E176-S178 PolarHBondContact O-N 3.18Å; E176-F227 WeakPolarHBondContact CB-O 3.09Å; E176-R229 HydrophobicContact CB-CB 4.44Å; E176-R229 VanDerWaalsContact CD-CB 3.44Å; E176-R229 WeakPolarHBondContact OE1-CB 3.27Å; E176-R229 WeakPolarHBondContact OE2-CB 3.4Å; E176-R229 PolarHBondContact OE2-N 3.44Å; E176-I292 HydrophobicContact CB-CG2 3.69Å; E176-D293 PolarHBondContact N-O 2.82Å; E176-D293 VanDerWaalsContact N-O 3.11Å; E176-D294 VanDerWaalsContact OE1-CA 3.24Å; E176-D294 WeakPolarHBondContact OE1-CA 3.49Å; E176-V295 HydrophobicContact CG-CB 3.79Å; E176-V295 HydrophobicContact CG-CG2 3.95Å; E176-V295 PolarHBondContact OE1-N 3.15Å
177	N	95.8	Very high	95.2	Very high	89 Å²	89	66.8 Å²	66.8	48%	0.476	36%	0.357	S	S	.	.	T	Hydrogen-bonded Turn	trans	56.2	-1	-169.8	-71.9	-67.5	0	0	0	115.9	F227 D297	N177-F227 PolarHBondContact N-O 2.86Å; N177-D297 PolarHBondContact ND2-OD2 3.36Å
178	S	96.9	Very high	95.5	Very high	23 Å²	23	64.6 Å²	64.6	16%	0.161	35%	0.349	C	S	.	.	P	Polyproline II helix	trans	-55.4	133.8	173.4	-70.2	0	0	0	0	111	K175 E176 P226	K175-S178 WeakPolarHBondContact O-CB 3.22Å; K175-S178 PolarHBondContact O-N 3.05Å; K175-S178 PolarHBondContact O-OG 3.48Å; E176-S178 PolarHBondContact O-N 3.18Å; S178-P226 VanDerWaalsContact O-CA 3.25Å; S178-P226 WeakPolarHBondContact O-CA 3.34Å; S178-P226 WeakPolarHBondContact O-CB 3.37Å
179	P	97.1	Very high	96.1	Very high	92 Å²	92	58.4 Å²	58.4	60%	0.597	31%	0.306	S	S	*	.	P	Polyproline II helix	trans	-64	156.2	-174.2	25.5	-34.2	0	0	0	112.6	T182 S223	P179-T182 VanDerWaalsContact O-CB 3.31Å; P179-T182 WeakPolarHBondContact O-CB 3.45Å; P179-T182 PolarHBondContact O-N 2.8Å; P179-T182 PolarHBondContact O-OG1 3.38Å; P179-S223 PolarHBondContact O-OG 3.29Å; P179-S223 VanDerWaalsContact O-OG 3.1Å
180	S	96.2	Very high	96.4	Very high	77 Å²	77	55.7 Å²	55.7	54%	0.538	30%	0.295	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.3	140.2	168.9	-178.5	0	0	0	0	110.7	L224	S180-L224 WeakPolarHBondContact CB-O 3.29Å; S180-L224 VanDerWaalsContact OG-C 3.27Å; S180-L224 PolarHBondContact OG-O 3.19Å
181	G	95.8	Very high	96.4	Very high	45 Å²	45	56.4 Å²	56.4	46%	0.464	30%	0.299	S	S	.	.	T	Hydrogen-bonded Turn	trans	85.2	3.3	-172.7	0	0	0	0	0	114.9	K183 S223	G181-K183 PolarHBondContact O-N 3.21Å; G181-S223 WeakPolarHBondContact CA-O 3.48Å; G181-S223 PolarHBondContact N-O 3.17Å
182	T	98	Very high	96.3	Very high	37 Å²	37	55.7 Å²	55.7	23%	0.227	30%	0.298	C	S	.	.			trans	-64.3	129.3	175.7	-65.4	0	0	0	0	110.2	I174 P179 T222 S223	I174-T182 HydrophobicContact CD1-CG2 3.66Å; I174-T182 HydrophobicContact CG1-CG2 4.27Å; P179-T182 VanDerWaalsContact O-CB 3.31Å; P179-T182 WeakPolarHBondContact O-CB 3.45Å; P179-T182 PolarHBondContact O-N 2.8Å; P179-T182 PolarHBondContact O-OG1 3.38Å; T182-T222 CarbonylContact O-C 3.45Å; T182-T222 WeakPolarHBondContact O-CA 3.38Å; T182-S223 PolarHBondContact N-OG 3.12Å; T182-S223 PolarHBondContact O-N 3.48Å
183	K	97.6	Very high	96.2	Very high	163 Å²	163	55.9 Å²	55.9	71%	0.709	30%	0.298	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-78.3	120.3	178.9	-66.3	179.2	180	-175	0	110	G181 T220 T222	G181-K183 PolarHBondContact O-N 3.21Å; K183-T220 HydrophobicContact CB-CG2 4.47Å; K183-T220 HydrophobicContact CD-CG2 4.1Å; K183-T220 HydrophobicContact CG-CG2 4.07Å; K183-T222 HydrophobicContact CG-CG2 3.83Å
184	I	97	Very high	95.8	Very high	18 Å²	18	55.7 Å²	55.7	9%	0.092	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.3	-49.6	-173.5	-66.7	155.5	0	0	0	110.7	A172 I174 F212 V221 V290	A172-I184 HydrophobicContact CB-CG2 3.4Å; A172-I184 VanDerWaalsContact CB-CG2 3.4Å; I174-I184 HydrophobicContact CB-CG1 4.25Å; I174-I184 HydrophobicContact CD1-CD1 4.16Å; I174-I184 HydrophobicContact CD1-CG1 3.62Å; I174-I184 HydrophobicContact CG1-CG1 4.49Å; I174-I184 HydrophobicContact CG2-CG1 4.38Å; I184-F212 HydrophobicContact CD1-CD1 3.4Å; I184-F212 VanDerWaalsContact CD1-CD1 3.4Å; I184-F212 HydrophobicContact CD1-CE1 3.42Å; I184-F212 VanDerWaalsContact CD1-CE1 3.42Å; I184-V221 HydrophobicContact CD1-CG1 4.39Å; I184-V221 PolarHBondContact N-O 3.04Å; I184-V290 HydrophobicContact CG2-CG1 3.81Å; I184-V290 HydrophobicContact CG2-CG2 4.02Å
185	Y	96.6	Very high	95.3	Very high	42 Å²	42	57.6 Å²	57.6	17%	0.165	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.1	161.5	-174.3	-162.5	-106.1	0	0	0	110.4	Q167 M170 I171 A172 I187 V221 L288	Q167-Y185 PolarHBondContact OE1-OH 2.8Å; Q167-Y185 VanDerWaalsContact OE1-OH 3.05Å; M170-Y185 HydrophobicContact CB-CE1 3.98Å; M170-Y185 HydrophobicContact CG-CE1 4.03Å; M170-Y185 HydrophobicContact SD-CE1 4.15Å; I171-Y185 WeakPolarHBondContact O-CD2 3.27Å; I171-Y185 VanDerWaalsContact O-CE2 3.24Å; I171-Y185 WeakPolarHBondContact O-CE2 3.34Å; A172-Y185 HydrophobicContact CB-CD2 3.93Å; A172-Y185 HydrophobicContact CB-CG 4.28Å; Y185-I187 HydrophobicContact CD1-CD1 3.78Å; Y185-I187 HydrophobicContact CE1-CD1 4.01Å; Y185-V221 PolarHBondContact O-N 3.22Å; Y185-L288 HydrophobicContact CD1-CD1 3.96Å; Y185-L288 HydrophobicContact CD1-CD2 4.21Å; Y185-L288 HydrophobicContact CD2-CD1 4.22Å; Y185-L288 HydrophobicContact CE1-CD1 4.36Å; Y185-L288 HydrophobicContact CG-CD1 3.88Å; Y185-L288 HydrophobicContact CG-CD2 4.31Å
186	K	96.7	Very high	94.9	Very high	124 Å²	124	56.6 Å²	56.6	54%	0.539	33%	0.327	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	117.5	166.5	-169	-162.1	174.4	-159.8	0	108.7	D188 T218 G219	K186-D188 PolarHBondContact O-N 3.33Å; K186-T218 WeakPolarHBondContact CE-O 3.1Å; K186-G219 WeakPolarHBondContact CA-O 3.28Å
187	I	96.1	Very high	94.6	Very high	0 Å²	0	57.7 Å²	57.7	0%	0	33%	0.333	C	S	.	.			trans	-62.8	127	174.8	-52.9	-61.9	0	0	0	108.5	F165 M170 Y185 Y202 I214 G219 V221 V239 V241 L288	F165-I187 HydrophobicContact CD1-CG2 3.94Å; F165-I187 HydrophobicContact CE1-CG2 3.69Å; M170-I187 HydrophobicContact CE-CD1 4.3Å; M170-I187 HydrophobicContact SD-CD1 3.61Å; M170-I187 HydrophobicContact SD-CG2 4.41Å; Y185-I187 HydrophobicContact CD1-CD1 3.78Å; Y185-I187 HydrophobicContact CE1-CD1 4.01Å; I187-Y202 HydrophobicContact CB-CD1 3.95Å; I187-Y202 HydrophobicContact CB-CE1 3.95Å; I187-Y202 HydrophobicContact CG2-CD1 3.89Å; I187-Y202 HydrophobicContact CG2-CE1 3.72Å; I187-I214 HydrophobicContact CG1-CD1 3.86Å; I187-G219 WeakPolarHBondContact CG1-O 3.3Å; I187-G219 PolarHBondContact N-O 2.76Å; I187-V221 HydrophobicContact CD1-CG2 4.5Å; I187-V221 HydrophobicContact CG1-CG2 4.36Å; I187-V239 HydrophobicContact CD1-CB 4.31Å; I187-V239 HydrophobicContact CD1-CG1 3.77Å; I187-V239 HydrophobicContact CD1-CG2 3.83Å; I187-V239 HydrophobicContact CG1-CG1 3.82Å; I187-V239 HydrophobicContact CG2-CG1 4.25Å; I187-V241 HydrophobicContact CG2-CG2 4Å; I187-L288 HydrophobicContact CD1-CD2 4.47Å
188	D	93.5	Very high	94.4	Very high	65 Å²	65	54.9 Å²	54.9	35%	0.348	32%	0.322	S	S	.	.			trans	-114.6	98.5	177.8	-165.3	38.5	0	0	0	110	K166 K186	K166-D188 WeakPolarHBondContact CD-OD2 3.16Å; K166-D188 WeakPolarHBondContact CG-OD2 3.36Å; K166-D188 PolarHBondContact N-O 2.87Å; K166-D188 IonicContact NZ-OD1 2.84Å; K166-D188 PolarHBondContact NZ-OD1 2.83Å; K166-D188 IonicContact NZ-OD2 2.63Å; K166-D188 PolarHBondContact NZ-OD2 2.9Å; K186-D188 PolarHBondContact O-N 3.33Å
189	A	95.4	Very high	94.2	Very high	8 Å²	8	55.4 Å²	55.4	7%	0.066	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	170.7	175.2	0	0	0	0	0	110.6	Q164 F165 K166 L200 Y202 V241	Q164-A189 CarbonylContact O-C 3.59Å; Q164-A189 VanDerWaalsContact O-CA 3.28Å; Q164-A189 WeakPolarHBondContact O-CA 3.33Å; F165-A189 HydrophobicContact CD1-CB 4.47Å; K166-A189 PolarHBondContact NZ-O 2.87Å; A189-L200 HydrophobicContact CB-CD1 3.76Å; A189-Y202 HydrophobicContact CB-CE1 4.3Å; A189-V241 HydrophobicContact CB-CG1 4.08Å; A189-V241 HydrophobicContact CB-CG2 4.34Å
190	H	94.7	Very high	94	Very high	80 Å²	80	51.9 Å²	51.9	37%	0.37	30%	0.299	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.7	160.5	171.7	69.3	-43.9	0	0	0	109.5	Q164	Q164-H190 PolarHBondContact N-O 3.18Å; Q164-H190 PolarHBondContact O-N 2.96Å; Q164-H190 PolarHBondContact O-ND1 2.83Å
191	D	95.7	Very high	94	Very high	21 Å²	21	48.2 Å²	48.2	11%	0.112	27%	0.273	C	S	.	.			trans	-123.5	141.5	172	-135.7	-60.4	0	0	0	109.3	G162 P163 D193 A198 L200	G162-D191 VanDerWaalsContact C-CG 3.48Å; G162-D191 WeakPolarHBondContact CA-OD1 3.33Å; G162-D191 VanDerWaalsContact CA-OD2 3.28Å; G162-D191 WeakPolarHBondContact CA-OD2 3.32Å; G162-D191 PolarHBondContact N-OD1 2.96Å; P163-D191 WeakPolarHBondContact CA-OD2 3.07Å; P163-D191 VanDerWaalsContact CD-OD2 3.28Å; P163-D191 WeakPolarHBondContact CD-OD2 3.36Å; P163-D191 WeakPolarHBondContact CG-OD2 3.28Å; D191-D193 VanDerWaalsContact C-N 3.32Å; D191-A198 HydrophobicContact CB-CB 3.78Å; D191-L200 HydrophobicContact CB-CD2 4.11Å; D191-L200 WeakPolarHBondContact OD2-CD2 3.38Å
192	P	93.6	Very high	93.9	Very high	44 Å²	44	47 Å²	47	29%	0.286	26%	0.255	S	S	.	.	S	Bend	trans	-70	-23.6	172.7	-23.2	37.1	0	0	0	115	R125 E126 H161	R125-P192 PolarHBondContact NH2-O 3.35Å; R125-P192 VanDerWaalsContact NH2-O 3.12Å; E126-P192 HydrophobicContact CG-CB 3.53Å; H161-P192 HydrophobicContact CB-CB 4.06Å; H161-P192 HydrophobicContact CB-CG 3.84Å
193	D	94	Very high	93.8	Very high	10 Å²	10	49.7 Å²	49.7	5%	0.053	26%	0.261	C	S	.	.	S	Bend	trans	-60.6	-176.8	-178.2	-72.9	16.9	0	0	0	113.8	N159 H161 D191 N197 A198	N159-D193 WeakPolarHBondContact CA-OD2 3.38Å; N159-D193 PolarHBondContact OD1-OD2 3.42Å; H161-D193 WeakPolarHBondContact CB-OD1 3.2Å; D191-D193 VanDerWaalsContact C-N 3.32Å; D193-N197 HydrophobicContact CB-CB 3.79Å; D193-N197 WeakPolarHBondContact OD2-CB 3.25Å; D193-A198 HydrophobicContact CB-CB 3.94Å; D193-A198 VanDerWaalsContact O-CB 3.26Å; D193-A198 WeakPolarHBondContact O-CB 3.46Å
194	I	89.9	Confident	93.6	Very high	105 Å²	105	42.6 Å²	42.6	54%	0.538	23%	0.23	S	C	.	.			trans	-130.2	157.6	172.9	-150	170	0	0	0	114.3	D157 N197	D157-I194 HydrophobicContact CB-CG2 3.73Å; D157-I194 WeakPolarHBondContact OD1-CG2 3.22Å; D157-I194 PolarHBondContact OD1-N 3.18Å; I194-N197 PolarHBondContact O-N 2.71Å
195	G	87	Confident	93.3	Very high	48 Å²	48	45.1 Å²	45.1	50%	0.495	24%	0.244	S	C	.	.	T	Hydrogen-bonded Turn	trans	64.7	-130.4	171.1	0	0	0	0	0	112.8	N197	G195-N197 PolarHBondContact O-N 2.89Å
196	P	88.1	Confident	92.8	Very high	93 Å²	93	45.4 Å²	45.4	60%	0.604	26%	0.259	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.5	-27.2	176.2	-21.7	34.1	0	0	0	113.9	L199 Q244	P196-L199 WeakPolarHBondContact O-CB 3.19Å; P196-L199 PolarHBondContact O-N 3.47Å; P196-Q244 WeakPolarHBondContact O-CA 3.48Å
197	N	90.2	Very high	92.2	Very high	28 Å²	28	46.9 Å²	46.9	15%	0.15	27%	0.268	C	S	.	.	T	Hydrogen-bonded Turn	trans	-69.6	-52	-178.2	-65.9	-21.6	0	0	0	109.4	D157 N159 D193 I194 G195 L199 D243 Q244	D157-N197 WeakPolarHBondContact OD2-CB 3.23Å; D157-N197 PolarHBondContact OD2-ND2 3.26Å; N159-N197 HydrophobicContact CB-CB 4.08Å; N159-N197 PolarHBondContact N-ND2 2.73Å; D193-N197 HydrophobicContact CB-CB 3.79Å; D193-N197 WeakPolarHBondContact OD2-CB 3.25Å; I194-N197 PolarHBondContact O-N 2.71Å; G195-N197 PolarHBondContact O-N 2.89Å; N197-L199 PolarHBondContact O-N 2.82Å; N197-D243 WeakPolarHBondContact O-CB 3.28Å; N197-Q244 PolarHBondContact O-N 3.29Å; N197-Q244 PolarHBondContact OD1-NE2 2.81Å
198	A	91.9	Very high	91.8	Very high	30 Å²	30	49.8 Å²	49.8	25%	0.248	28%	0.282	C	S	.	.	T	Hydrogen-bonded Turn	trans	-68.9	11.3	171.3	0	0	0	0	0	116.6	D191 D193 L200	D191-A198 HydrophobicContact CB-CB 3.78Å; D193-A198 HydrophobicContact CB-CB 3.94Å; D193-A198 VanDerWaalsContact O-CB 3.26Å; D193-A198 WeakPolarHBondContact O-CB 3.46Å; A198-L200 PolarHBondContact O-N 3.3Å; A198-L200 VanDerWaalsContact O-N 3.11Å
199	L	92.5	Very high	91.5	Very high	33 Å²	33	50.8 Å²	50.8	17%	0.173	29%	0.286	C	S	.	.			trans	-85	87.6	-174.9	-170.8	59.9	0	0	0	111.6	P196 N197 Q244 S245 W247 I248	P196-L199 WeakPolarHBondContact O-CB 3.19Å; P196-L199 PolarHBondContact O-N 3.47Å; N197-L199 PolarHBondContact O-N 2.82Å; L199-Q244 PolarHBondContact O-N 3.28Å; L199-S245 WeakPolarHBondContact CD2-O 3.36Å; L199-S245 WeakPolarHBondContact O-CB 3.33Å; L199-S245 PolarHBondContact O-N 2.93Å; L199-S245 PolarHBondContact O-OG 2.76Å; L199-W247 HydrophobicContact CD1-CH2 4.19Å; L199-W247 HydrophobicContact CD1-CZ2 3.51Å; L199-W247 HydrophobicContact CG-CZ2 4.46Å; L199-I248 HydrophobicContact CD1-CD1 3.87Å; L199-I248 HydrophobicContact CD1-CG1 4.45Å; L199-I248 HydrophobicContact CD2-CB 4.46Å; L199-I248 HydrophobicContact CD2-CD1 3.55Å; L199-I248 HydrophobicContact CD2-CG1 3.91Å; L199-I248 HydrophobicContact CG-CD1 4.39Å
200	L	94.4	Very high	91.3	Very high	18 Å²	18	55 Å²	55	9%	0.094	31%	0.307	C	S	.	.			trans	-68.3	135.1	-175.7	-58.7	-174.1	0	0	0	114.4	P163 A189 D191 A198 Y202 V241 Y242 S245 W247	P163-L200 HydrophobicContact CB-CD2 3.7Å; P163-L200 HydrophobicContact CG-CD2 3.57Å; A189-L200 HydrophobicContact CB-CD1 3.76Å; D191-L200 HydrophobicContact CB-CD2 4.11Å; D191-L200 WeakPolarHBondContact OD2-CD2 3.38Å; A198-L200 PolarHBondContact O-N 3.3Å; A198-L200 VanDerWaalsContact O-N 3.11Å; L200-Y202 HydrophobicContact CB-CE2 4.05Å; L200-V241 HydrophobicContact CB-CG1 4.19Å; L200-V241 HydrophobicContact CD1-CG1 4.18Å; L200-V241 HydrophobicContact CD2-CG1 4.16Å; L200-V241 HydrophobicContact CG-CG1 4.42Å; L200-Y242 CarbonylContact C-O 3.5Å; L200-Y242 WeakPolarHBondContact CA-O 3.2Å; L200-S245 PolarHBondContact O-OG 2.73Å; L200-W247 PolarHBondContact O-NE1 3.36Å
201	G	94.4	Very high	91.3	Very high	0 Å²	0	51.5 Å²	51.5	0%	0	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	151.9	166.4	0	0	0	0	0	111.6	E216 V241 Y242 S245	G201-E216 WeakPolarHBondContact CA-O 3.23Å; G201-V241 WeakPolarHBondContact O-CA 3.3Å; G201-Y242 PolarHBondContact N-O 2.69Å; G201-Y242 WeakPolarHBondContact O-CD1 3.46Å; G201-Y242 PolarHBondContact O-N 2.79Å; G201-S245 PolarHBondContact N-OG 3.35Å
202	Y	95.3	Very high	91.4	Very high	21 Å²	21	50.7 Å²	50.7	8%	0.082	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	131.1	-171.5	-59.2	-96.7	0	0	0	111.6	I187 A189 L200 E216 G219 V241	I187-Y202 HydrophobicContact CB-CD1 3.95Å; I187-Y202 HydrophobicContact CB-CE1 3.95Å; I187-Y202 HydrophobicContact CG2-CD1 3.89Å; I187-Y202 HydrophobicContact CG2-CE1 3.72Å; A189-Y202 HydrophobicContact CB-CE1 4.3Å; L200-Y202 HydrophobicContact CB-CE2 4.05Å; Y202-E216 WeakPolarHBondContact CD2-O 2.9Å; Y202-E216 PolarHBondContact N-O 3.46Å; Y202-E216 WeakPolarHBondContact O-CA 3.05Å; Y202-G219 VanDerWaalsContact CG-CA 3.5Å; Y202-V241 HydrophobicContact CD1-CB 4.41Å; Y202-V241 HydrophobicContact CD1-CG1 4.01Å; Y202-V241 HydrophobicContact CD1-CG2 3.68Å; Y202-V241 HydrophobicContact CE1-CB 4.47Å; Y202-V241 HydrophobicContact CE1-CG1 3.78Å; Y202-V241 HydrophobicContact CE1-CG2 3.82Å
203	R	94.9	Very high	91.4	Very high	92 Å²	92	53.5 Å²	53.5	35%	0.347	30%	0.297	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.8	153.9	171.6	67.5	-174	-178.3	-110.7	3.1	112.2	I240 Y242	R203-I240 HydrophobicContact CG-CB 3.78Å; R203-I240 HydrophobicContact CG-CG2 4.31Å; R203-I240 PolarHBondContact N-O 2.77Å; R203-I240 PolarHBondContact O-N 3.39Å; R203-Y242 HydrophobicContact CB-CE1 4.23Å; R203-Y242 HydrophobicContact CG-CD1 4.4Å; R203-Y242 HydrophobicContact CG-CE1 3.91Å; R203-Y242 VanDerWaalsContact NH1-CE1 3.27Å
204	L	94.8	Very high	91.6	Very high	14 Å²	14	54 Å²	54	7%	0.073	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.5	161.4	166.4	-60.5	-178.9	0	0	0	109.9	M209 F212 I214 S238 V239	L204-M209 HydrophobicContact CB-CE 4.22Å; L204-M209 HydrophobicContact CB-CG 4.15Å; L204-M209 WeakPolarHBondContact O-CE 3.04Å; L204-F212 HydrophobicContact CD1-CB 3.67Å; L204-I214 HydrophobicContact CD1-CB 4.49Å; L204-I214 HydrophobicContact CD2-CB 4.28Å; L204-I214 HydrophobicContact CD2-CD1 4.29Å; L204-I214 HydrophobicContact CD2-CG2 4.37Å; L204-I214 HydrophobicContact CG-CB 3.99Å; L204-I214 HydrophobicContact CG-CG2 3.81Å; L204-S238 CarbonylContact C-O 3.55Å; L204-S238 WeakPolarHBondContact CA-O 3.17Å; L204-V239 HydrophobicContact CD2-CG2 4.01Å
205	D	90	Very high	91.8	Very high	72 Å²	72	52.7 Å²	52.7	39%	0.385	29%	0.294	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.3	164.8	176.8	-179	33.8	0	0	0	110.7	M209 S238 I240	D205-M209 VanDerWaalsContact C-SD 3.54Å; D205-M209 WeakPolarHBondContact CA-SD 3.33Å; D205-S238 PolarHBondContact N-O 2.82Å; D205-S238 WeakPolarHBondContact O-CB 3.42Å; D205-I240 HydrophobicContact CB-CD1 3.59Å; D205-I240 HydrophobicContact CB-CG1 3.96Å
206	G	85.6	Confident	92.2	Very high	47 Å²	47	54.3 Å²	54.3	49%	0.485	29%	0.288	S	S	.	.	S	Bend	trans	77.3	-142.9	172.4	0	0	0	0	0	115.3
207	Q	84.8	Confident	92.3	Very high	155 Å²	155	55.1 Å²	55.1	72%	0.724	28%	0.282	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.7	154.1	-174.4	-66	-179.3	-8.8	0	0	111.4	M209	Q207-M209 VanDerWaalsContact C-N 3.26Å; Q207-M209 PolarHBondContact O-N 2.68Å
208	H	87	Confident	92.5	Very high	62 Å²	62	56.3 Å²	56.3	29%	0.287	29%	0.291	S	S	.	.	T	Hydrogen-bonded Turn	trans	66.1	14.2	179.6	-44	-70.6	0	0	0	116	D210 N211 F212 F235 L237	H208-D210 VanDerWaalsContact CA-OD1 3.31Å; H208-D210 WeakPolarHBondContact CA-OD1 3.39Å; H208-D210 PolarHBondContact O-N 2.89Å; H208-N211 WeakPolarHBondContact O-CB 3.08Å; H208-N211 PolarHBondContact O-N 3.37Å; H208-F212 HydrophobicContact CB-CE2 4.47Å; H208-F212 WeakPolarHBondContact O-CD2 3.17Å; H208-F235 HydrophobicContact CB-CD1 3.88Å; H208-F235 HydrophobicContact CB-CE1 4.42Å; H208-F235 AromaticContact CG-CD1 3.61Å; H208-F235 AromaticContact ND1-CD1 3.77Å; H208-F235 AromaticContact ND1-CE1 3.81Å; H208-L237 HydrophobicContact CB-CD2 4.04Å
209	M	87.2	Confident	92.6	Very high	86 Å²	86	54.9 Å²	54.9	42%	0.424	28%	0.279	S	S	.	.	G	3₁₀ helix	trans	-58.8	-23.9	170.8	-68.7	-179.2	69.1	0	0	113.2	L204 D205 Q207 N211 F212	L204-M209 HydrophobicContact CB-CE 4.22Å; L204-M209 HydrophobicContact CB-CG 4.15Å; L204-M209 WeakPolarHBondContact O-CE 3.04Å; D205-M209 VanDerWaalsContact C-SD 3.54Å; D205-M209 WeakPolarHBondContact CA-SD 3.33Å; Q207-M209 VanDerWaalsContact C-N 3.26Å; Q207-M209 PolarHBondContact O-N 2.68Å; M209-N211 PolarHBondContact O-N 2.86Å; M209-F212 PolarHBondContact O-N 2.84Å
210	D	91.4	Very high	92.9	Very high	96 Å²	96	54.5 Å²	54.5	51%	0.513	28%	0.278	S	S	.	.	G	3₁₀ helix	trans	-68.2	-15.7	173.9	62.3	-64.2	0	0	0	113.6	H208 R225	H208-D210 VanDerWaalsContact CA-OD1 3.31Å; H208-D210 WeakPolarHBondContact CA-OD1 3.39Å; H208-D210 PolarHBondContact O-N 2.89Å; D210-R225 IonicContact OD2-NH2 2.69Å; D210-R225 PolarHBondContact OD2-NH2 2.88Å
211	N	94.9	Very high	93	Very high	6 Å²	6	53.7 Å²	53.7	3%	0.032	27%	0.273	C	S	.	.	G	3₁₀ helix	trans	-93.3	-19.7	-179.6	-69.5	-20.3	0	0	0	113.7	H208 M209 L224 R225 F227 F235	H208-N211 WeakPolarHBondContact O-CB 3.08Å; H208-N211 PolarHBondContact O-N 3.37Å; M209-N211 PolarHBondContact O-N 2.86Å; N211-L224 PolarHBondContact O-N 3.39Å; N211-R225 PolarHBondContact OD1-NE 3.14Å; N211-R225 PolarHBondContact OD1-NH2 2.81Å; N211-F227 HydrophobicContact CB-CE1 3.84Å; N211-F227 HydrophobicContact CB-CZ 4.1Å; N211-F235 WeakPolarHBondContact ND2-CE1 3.33Å
212	F	96.8	Very high	93.2	Very high	5 Å²	5	54.3 Å²	54.3	2%	0.022	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.5	142.9	-166.1	-56	-76.3	0	0	0	112	I184 L204 H208 M209 V221 T222 F227 F235 L237	I184-F212 HydrophobicContact CD1-CD1 3.4Å; I184-F212 VanDerWaalsContact CD1-CD1 3.4Å; I184-F212 HydrophobicContact CD1-CE1 3.42Å; I184-F212 VanDerWaalsContact CD1-CE1 3.42Å; L204-F212 HydrophobicContact CD1-CB 3.67Å; H208-F212 HydrophobicContact CB-CE2 4.47Å; H208-F212 WeakPolarHBondContact O-CD2 3.17Å; M209-F212 PolarHBondContact O-N 2.84Å; F212-V221 HydrophobicContact CB-CG1 4.3Å; F212-V221 HydrophobicContact CD1-CG1 4.48Å; F212-T222 WeakPolarHBondContact CA-O 3.02Å; F212-F227 HydrophobicContact CD1-CE2 4.47Å; F212-F227 HydrophobicContact CD1-CZ 4.08Å; F212-F227 HydrophobicContact CE1-CE1 4.4Å; F212-F227 AromaticContact CE1-CE2 3.54Å; F212-F227 HydrophobicContact CE1-CE2 3.54Å; F212-F227 AromaticContact CE1-CZ 3.33Å; F212-F227 HydrophobicContact CE1-CZ 3.33Å; F212-F227 HydrophobicContact CE2-CZ 4.35Å; F212-F227 HydrophobicContact CZ-CE1 4.18Å; F212-F227 AromaticContact CZ-CE2 3.93Å; F212-F227 HydrophobicContact CZ-CE2 3.93Å; F212-F227 AromaticContact CZ-CZ 3.5Å; F212-F227 HydrophobicContact CZ-CZ 3.5Å; F212-F227 VanDerWaalsContact CZ-CZ 3.5Å; F212-F235 HydrophobicContact CE2-CB 3.85Å; F212-F235 HydrophobicContact CE2-CD1 4.09Å; F212-F235 HydrophobicContact CE2-CD2 4.01Å; F212-F235 AromaticContact CE2-CG 3.71Å; F212-F235 HydrophobicContact CE2-CG 3.71Å; F212-F235 HydrophobicContact CZ-CB 4.04Å; F212-F235 HydrophobicContact CZ-CD1 4.5Å; F212-F235 AromaticContact CZ-CD2 3.6Å; F212-F235 HydrophobicContact CZ-CD2 3.6Å; F212-F235 HydrophobicContact CZ-CE2 4.15Å; F212-F235 AromaticContact CZ-CG 3.78Å; F212-F235 HydrophobicContact CZ-CG 3.78Å; F212-L237 HydrophobicContact CB-CD1 4.26Å; F212-L237 HydrophobicContact CD1-CD1 4.26Å; F212-L237 HydrophobicContact CD2-CD1 3.49Å; F212-L237 VanDerWaalsContact CD2-CD1 3.49Å; F212-L237 HydrophobicContact CD2-CD2 3.49Å; F212-L237 VanDerWaalsContact CD2-CD2 3.49Å; F212-L237 HydrophobicContact CD2-CG 4.1Å; F212-L237 HydrophobicContact CE2-CD1 3.83Å; F212-L237 HydrophobicContact CE2-CD2 3.68Å; F212-L237 HydrophobicContact CE2-CG 4.24Å; F212-L237 HydrophobicContact CG-CD1 3.73Å; F212-L237 HydrophobicContact CG-CD2 4.48Å; F212-L237 HydrophobicContact CZ-CD1 4.34Å
213	M	95.2	Very high	93.3	Very high	102 Å²	102	53.4 Å²	53.4	50%	0.502	27%	0.274	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	145.5	169.6	179.2	176.2	67.3	0	0	108.9	V221 T222 L224	M213-V221 CarbonylContact O-C 3.58Å; M213-V221 WeakPolarHBondContact O-CA 3.31Å; M213-T222 PolarHBondContact N-O 3.23Å; M213-T222 PolarHBondContact O-N 2.87Å; M213-T222 PolarHBondContact O-OG1 3.43Å; M213-L224 HydrophobicContact CB-CD1 4.44Å; M213-L224 HydrophobicContact CB-CD2 3.91Å; M213-L224 HydrophobicContact CB-CG 4.13Å
214	I	96.4	Very high	93.3	Very high	22 Å²	22	52.7 Å²	52.7	11%	0.113	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	135.3	167.1	-166.1	167.3	0	0	0	109.2	I187 L204 E216 T220 V221 V239	I187-I214 HydrophobicContact CG1-CD1 3.86Å; L204-I214 HydrophobicContact CD1-CB 4.49Å; L204-I214 HydrophobicContact CD2-CB 4.28Å; L204-I214 HydrophobicContact CD2-CD1 4.29Å; L204-I214 HydrophobicContact CD2-CG2 4.37Å; L204-I214 HydrophobicContact CG-CB 3.99Å; L204-I214 HydrophobicContact CG-CG2 3.81Å; I214-E216 PolarHBondContact O-N 2.79Å; I214-T220 WeakPolarHBondContact CA-O 3.46Å; I214-V221 HydrophobicContact CB-CG2 4.31Å; I214-V221 HydrophobicContact CD1-CG2 3.8Å; I214-V221 HydrophobicContact CG1-CG2 3.93Å; I214-V239 HydrophobicContact CD1-CG1 4.37Å
215	D	95.3	Very high	93.3	Very high	77 Å²	77	57.7 Å²	57.7	41%	0.412	30%	0.295	S	S	.	.			trans	-75.6	114.2	172.2	175.2	-80.6	0	0	0	109.5	K217 T218 G219 T220	D215-K217 PolarHBondContact O-N 3.29Å; D215-K217 PolarHBondContact OD1-N 3.36Å; D215-T218 WeakPolarHBondContact CB-OG1 3.42Å; D215-T218 PolarHBondContact O-N 3.15Å; D215-T218 VanDerWaalsContact OD1-CB 3.25Å; D215-T218 WeakPolarHBondContact OD1-CB 3.37Å; D215-T218 WeakPolarHBondContact OD1-CG2 3.16Å; D215-T218 PolarHBondContact OD1-N 2.69Å; D215-T218 PolarHBondContact OD1-OG1 3.03Å; D215-G219 PolarHBondContact O-N 3.46Å; D215-T220 PolarHBondContact N-O 2.83Å
216	E	94.1	Very high	93.6	Very high	82 Å²	82	57 Å²	57	38%	0.383	29%	0.294	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.3	-23.6	-171.1	-166.4	-169.6	167.6	0	0	113.7	G201 Y202 I214 Y242	G201-E216 WeakPolarHBondContact CA-O 3.23Å; Y202-E216 WeakPolarHBondContact CD2-O 2.9Å; Y202-E216 PolarHBondContact N-O 3.46Å; Y202-E216 WeakPolarHBondContact O-CA 3.05Å; I214-E216 PolarHBondContact O-N 2.79Å; E216-Y242 VanDerWaalsContact CD-OH 3.31Å; E216-Y242 WeakPolarHBondContact CG-OH 3.33Å; E216-Y242 PolarHBondContact OE1-OH 2.95Å
217	K	91.1	Very high	94.2	Very high	110 Å²	110	55.5 Å²	55.5	48%	0.478	27%	0.274	S	S	.	.	T	Hydrogen-bonded Turn	trans	-97	-33	-174.9	171.3	173.1	179.7	165.9	0	113.5	D215 W247	D215-K217 PolarHBondContact O-N 3.29Å; D215-K217 PolarHBondContact OD1-N 3.36Å; K217-W247 HydrophobicContact CB-CD2 4.21Å; K217-W247 HydrophobicContact CB-CG 4.44Å; K217-W247 HydrophobicContact CD-CD2 4.06Å; K217-W247 HydrophobicContact CD-CE3 3.66Å; K217-W247 HydrophobicContact CD-CH2 3.98Å; K217-W247 HydrophobicContact CD-CZ2 4.29Å; K217-W247 HydrophobicContact CD-CZ3 3.65Å; K217-W247 VanDerWaalsContact CE-CH2 3.47Å; K217-W247 HydrophobicContact CG-CD2 3.98Å; K217-W247 HydrophobicContact CG-CE3 4.08Å; K217-W247 HydrophobicContact CG-CH2 4.03Å; K217-W247 HydrophobicContact CG-CZ2 3.85Å; K217-W247 HydrophobicContact CG-CZ3 4.14Å; K217-W247 VanDerWaalsContact NZ-CZ3 3.29Å
218	T	94.1	Very high	94.7	Very high	53 Å²	53	50.7 Å²	50.7	33%	0.325	25%	0.254	S	S	.	.	T	Hydrogen-bonded Turn	trans	-111.3	-10.7	-171.8	66.2	0	0	0	0	113.8	K186 D215 T220	K186-T218 WeakPolarHBondContact CE-O 3.1Å; D215-T218 WeakPolarHBondContact CB-OG1 3.42Å; D215-T218 PolarHBondContact O-N 3.15Å; D215-T218 VanDerWaalsContact OD1-CB 3.25Å; D215-T218 WeakPolarHBondContact OD1-CB 3.37Å; D215-T218 WeakPolarHBondContact OD1-CG2 3.16Å; D215-T218 PolarHBondContact OD1-N 2.69Å; D215-T218 PolarHBondContact OD1-OG1 3.03Å; T218-T220 PolarHBondContact O-N 3.44Å; T218-T220 PolarHBondContact OG1-OG1 3.23Å
219	G	94.8	Very high	95.2	Very high	0 Å²	0	49.4 Å²	49.4	0%	0	25%	0.246	C	C	.	.			trans	66.9	18.8	-175.8	0	0	0	0	0	113.5	K186 I187 Y202 D215	K186-G219 WeakPolarHBondContact CA-O 3.28Å; I187-G219 WeakPolarHBondContact CG1-O 3.3Å; I187-G219 PolarHBondContact N-O 2.76Å; Y202-G219 VanDerWaalsContact CG-CA 3.5Å; D215-G219 PolarHBondContact O-N 3.46Å
220	T	97.7	Very high	95.7	Very high	25 Å²	25	47.8 Å²	47.8	15%	0.153	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.6	118.8	-179.5	-50.7	0	0	0	0	109.9	K183 I214 D215 T218	K183-T220 HydrophobicContact CB-CG2 4.47Å; K183-T220 HydrophobicContact CD-CG2 4.1Å; K183-T220 HydrophobicContact CG-CG2 4.07Å; I214-T220 WeakPolarHBondContact CA-O 3.46Å; D215-T220 PolarHBondContact N-O 2.83Å; T218-T220 PolarHBondContact O-N 3.44Å; T218-T220 PolarHBondContact OG1-OG1 3.23Å
221	V	97.3	Very high	95.9	Very high	0 Å²	0	50.1 Å²	50.1	0%	0	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.7	132	176	-177.7	0	0	0	0	110	I184 Y185 I187 F212 M213 I214 L288	I184-V221 HydrophobicContact CD1-CG1 4.39Å; I184-V221 PolarHBondContact N-O 3.04Å; Y185-V221 PolarHBondContact O-N 3.22Å; I187-V221 HydrophobicContact CD1-CG2 4.5Å; I187-V221 HydrophobicContact CG1-CG2 4.36Å; F212-V221 HydrophobicContact CB-CG1 4.3Å; F212-V221 HydrophobicContact CD1-CG1 4.48Å; M213-V221 CarbonylContact O-C 3.58Å; M213-V221 WeakPolarHBondContact O-CA 3.31Å; I214-V221 HydrophobicContact CB-CG2 4.31Å; I214-V221 HydrophobicContact CD1-CG2 3.8Å; I214-V221 HydrophobicContact CG1-CG2 3.93Å; V221-L288 HydrophobicContact CB-CD2 4.41Å; V221-L288 HydrophobicContact CG1-CD2 4.38Å; V221-L288 HydrophobicContact CG2-CD2 4.02Å
222	T	97.6	Very high	95.9	Very high	14 Å²	14	52.5 Å²	52.5	9%	0.086	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131	147.5	-179.8	52.2	0	0	0	0	112.3	T182 K183 F212 M213	T182-T222 CarbonylContact O-C 3.45Å; T182-T222 WeakPolarHBondContact O-CA 3.38Å; K183-T222 HydrophobicContact CG-CG2 3.83Å; F212-T222 WeakPolarHBondContact CA-O 3.02Å; M213-T222 PolarHBondContact N-O 3.23Å; M213-T222 PolarHBondContact O-N 2.87Å; M213-T222 PolarHBondContact O-OG1 3.43Å
223	S	97.3	Very high	95.9	Very high	1 Å²	1	56.4 Å²	56.4	1%	0.007	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.6	142.7	171	61.2	0	0	0	0	111.7	P179 G181 T182 R225	P179-S223 PolarHBondContact O-OG 3.29Å; P179-S223 VanDerWaalsContact O-OG 3.1Å; G181-S223 WeakPolarHBondContact CA-O 3.48Å; G181-S223 PolarHBondContact N-O 3.17Å; T182-S223 PolarHBondContact N-OG 3.12Å; T182-S223 PolarHBondContact O-N 3.48Å; S223-R225 WeakPolarHBondContact CB-O 3.43Å
224	L	96.5	Very high	95.9	Very high	78 Å²	78	54.8 Å²	54.8	41%	0.408	27%	0.27	S	S	.	.	S	Bend	trans	-95	-22.3	169.3	-73.4	173.8	0	0	0	112.6	S180 N211 M213	S180-L224 WeakPolarHBondContact CB-O 3.29Å; S180-L224 VanDerWaalsContact OG-C 3.27Å; S180-L224 PolarHBondContact OG-O 3.19Å; N211-L224 PolarHBondContact O-N 3.39Å; M213-L224 HydrophobicContact CB-CD1 4.44Å; M213-L224 HydrophobicContact CB-CD2 3.91Å; M213-L224 HydrophobicContact CB-CG 4.13Å
225	R	95.2	Very high	95.9	Very high	118 Å²	118	54 Å²	54	45%	0.445	27%	0.266	S	S	.	.	S	Bend	trans	-139	159.4	175.1	47.5	169	151.4	-171.5	-9.3	110.7	D210 N211 S223 F227	D210-R225 IonicContact OD2-NH2 2.69Å; D210-R225 PolarHBondContact OD2-NH2 2.88Å; N211-R225 PolarHBondContact OD1-NE 3.14Å; N211-R225 PolarHBondContact OD1-NH2 2.81Å; S223-R225 WeakPolarHBondContact CB-O 3.43Å; R225-F227 HydrophobicContact CG-CE1 4.02Å
226	P	96.4	Very high	95.8	Very high	59 Å²	59	53.6 Å²	53.6	38%	0.383	26%	0.264	S	S	.	.			trans	-59.2	153.1	158	28.7	-35.2	0	0	0	110.4	S178	S178-P226 VanDerWaalsContact O-CA 3.25Å; S178-P226 WeakPolarHBondContact O-CA 3.34Å; S178-P226 WeakPolarHBondContact O-CB 3.37Å
227	F	96.4	Very high	95.8	Very high	14 Å²	14	49.9 Å²	49.9	6%	0.061	25%	0.246	C	C	.	.			trans	-109.4	167.7	174.4	-56.6	-59.8	0	0	0	110.6	I174 E176 N177 N211 F212 R225 F235 I292	I174-F227 HydrophobicContact CD1-CE2 4.45Å; I174-F227 HydrophobicContact CG2-CD2 4.38Å; E176-F227 WeakPolarHBondContact CB-O 3.09Å; N177-F227 PolarHBondContact N-O 2.86Å; N211-F227 HydrophobicContact CB-CE1 3.84Å; N211-F227 HydrophobicContact CB-CZ 4.1Å; F212-F227 HydrophobicContact CD1-CE2 4.47Å; F212-F227 HydrophobicContact CD1-CZ 4.08Å; F212-F227 HydrophobicContact CE1-CE1 4.4Å; F212-F227 AromaticContact CE1-CE2 3.54Å; F212-F227 HydrophobicContact CE1-CE2 3.54Å; F212-F227 AromaticContact CE1-CZ 3.33Å; F212-F227 HydrophobicContact CE1-CZ 3.33Å; F212-F227 HydrophobicContact CE2-CZ 4.35Å; F212-F227 HydrophobicContact CZ-CE1 4.18Å; F212-F227 AromaticContact CZ-CE2 3.93Å; F212-F227 HydrophobicContact CZ-CE2 3.93Å; F212-F227 AromaticContact CZ-CZ 3.5Å; F212-F227 HydrophobicContact CZ-CZ 3.5Å; F212-F227 VanDerWaalsContact CZ-CZ 3.5Å; R225-F227 HydrophobicContact CG-CE1 4.02Å; F227-F235 AromaticContact CD1-CE2 3.88Å; F227-F235 HydrophobicContact CD1-CE2 3.88Å; F227-F235 HydrophobicContact CD1-CZ 4.06Å; F227-F235 HydrophobicContact CE1-CE2 4.1Å; F227-F235 HydrophobicContact CE1-CZ 4.22Å; F227-F235 HydrophobicContact CG-CE2 4.22Å; F227-I292 HydrophobicContact CB-CD1 4.03Å; F227-I292 HydrophobicContact CB-CG1 4.42Å; F227-I292 HydrophobicContact CB-CG2 4.41Å; F227-I292 HydrophobicContact CD2-CD1 3.79Å; F227-I292 HydrophobicContact CG-CD1 4.01Å
228	D	97	Very high	96	Very high	54 Å²	54	46.3 Å²	46.3	29%	0.289	24%	0.235	S	C	.	.			trans	-142.7	114.7	-172	160.4	-25.3	0	0	0	103.4	E230 Q231 I232	D228-E230 PolarHBondContact OD1-N 3.47Å; D228-Q231 HydrophobicContact CB-CB 4.21Å; D228-Q231 PolarHBondContact O-N 3.47Å; D228-Q231 WeakPolarHBondContact OD1-CB 3.44Å; D228-Q231 PolarHBondContact OD1-N 3.47Å; D228-I232 PolarHBondContact O-N 2.86Å
229	R	97.3	Very high	96	Very high	36 Å²	36	43.8 Å²	43.8	14%	0.136	22%	0.219	C	C	.	.	T	Hydrogen-bonded Turn	trans	-82.6	-29.1	-166.4	-175.9	-133.3	59.8	76.3	-11.9	111.6	E176 Q231 I232 D233 I292 D294 S329	E176-R229 HydrophobicContact CB-CB 4.44Å; E176-R229 VanDerWaalsContact CD-CB 3.44Å; E176-R229 WeakPolarHBondContact OE1-CB 3.27Å; E176-R229 WeakPolarHBondContact OE2-CB 3.4Å; E176-R229 PolarHBondContact OE2-N 3.44Å; R229-Q231 PolarHBondContact O-N 2.85Å; R229-I232 CarbonylContact O-C 3.55Å; R229-I232 PolarHBondContact O-N 3.21Å; R229-D233 PolarHBondContact O-N 2.82Å; R229-I292 HydrophobicContact CB-CB 4.35Å; R229-I292 HydrophobicContact CB-CG2 3.78Å; R229-I292 HydrophobicContact CG-CB 4.21Å; R229-I292 HydrophobicContact CG-CG2 4.1Å; R229-D294 VanDerWaalsContact CD-OD1 3.24Å; R229-D294 WeakPolarHBondContact CD-OD1 3.48Å; R229-D294 IonicContact CZ-OD1 3.7Å; R229-D294 IonicContact NE-OD1 2.8Å; R229-D294 PolarHBondContact NE-OD1 3.32Å; R229-D294 VanDerWaalsContact NE-OD1 3.15Å; R229-S329 PolarHBondContact NH2-O 3.14Å
230	E	96.1	Very high	96	Very high	51 Å²	51	44.1 Å²	44.1	24%	0.238	22%	0.221	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.4	-32.2	170.4	-68.1	59.3	-129.2	0	0	110.5	D228 D330	D228-E230 PolarHBondContact OD1-N 3.47Å; E230-D330 WeakPolarHBondContact OE1-CA 3.47Å
231	Q	95.4	Very high	95.9	Very high	146 Å²	146	42.9 Å²	42.9	68%	0.682	21%	0.214	S	C	*	.	T	Hydrogen-bonded Turn	trans	-78.8	-52	171.2	-164.5	-173.8	14.6	0	0	112.6	D228 R229	D228-Q231 HydrophobicContact CB-CB 4.21Å; D228-Q231 PolarHBondContact O-N 3.47Å; D228-Q231 WeakPolarHBondContact OD1-CB 3.44Å; D228-Q231 PolarHBondContact OD1-N 3.47Å; R229-Q231 PolarHBondContact O-N 2.85Å
232	I	95.1	Very high	95.8	Very high	56 Å²	56	44 Å²	44	29%	0.287	22%	0.218	S	C	.	.			trans	-146.4	116.3	179.2	-54.4	180	0	0	0	111.2	D228 R229 H234 F235 I292	D228-I232 PolarHBondContact O-N 2.86Å; R229-I232 CarbonylContact O-C 3.55Å; R229-I232 PolarHBondContact O-N 3.21Å; I232-H234 VanDerWaalsContact CG2-O 3.27Å; I232-H234 WeakPolarHBondContact CG2-O 3.2Å; I232-F235 HydrophobicContact CB-CE1 4.3Å; I232-F235 HydrophobicContact CB-CE2 4.42Å; I232-F235 HydrophobicContact CB-CZ 3.87Å; I232-F235 HydrophobicContact CD1-CE1 3.71Å; I232-F235 HydrophobicContact CD1-CZ 3.88Å; I232-F235 HydrophobicContact CG1-CZ 4.43Å; I232-F235 HydrophobicContact CG2-CD1 4.24Å; I232-F235 HydrophobicContact CG2-CE1 3.73Å; I232-F235 HydrophobicContact CG2-CE2 4.06Å; I232-F235 HydrophobicContact CG2-CZ 3.64Å; I232-I292 WeakPolarHBondContact O-CG1 3.15Å
233	D	96.6	Very high	95.6	Very high	87 Å²	87	43.3 Å²	43.3	47%	0.465	21%	0.214	S	C	.	.	S	Bend	trans	-80	-26	-178.3	69.9	-32.6	0	0	0	114.6	R229 I292	R229-D233 PolarHBondContact O-N 2.82Å; D233-I292 PolarHBondContact O-N 2.97Å
234	H	96.4	Very high	95.1	Very high	68 Å²	68	45.1 Å²	45.1	32%	0.315	22%	0.222	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-154.1	155.4	179.3	73.7	-70.6	0	0	0	114.4	I232 N236 V290 F291	I232-H234 VanDerWaalsContact CG2-O 3.27Å; I232-H234 WeakPolarHBondContact CG2-O 3.2Å; H234-N236 PolarHBondContact NE2-ND2 3.25Å; H234-V290 CarbonylContact C-O 3.6Å; H234-V290 VanDerWaalsContact CA-O 3.25Å; H234-V290 WeakPolarHBondContact CA-O 3.45Å; H234-V290 WeakPolarHBondContact CB-O 3.19Å; H234-F291 HydrophobicContact CB-CD1 3.86Å; H234-F291 HydrophobicContact CB-CE1 4.16Å
235	F	95.8	Very high	94.4	Very high	5 Å²	5	41.6 Å²	41.6	2%	0.022	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	141.6	174.4	-62.1	-82.1	0	0	0	111.3	H208 N211 F212 F227 I232 L237 V290 I292	H208-F235 HydrophobicContact CB-CD1 3.88Å; H208-F235 HydrophobicContact CB-CE1 4.42Å; H208-F235 AromaticContact CG-CD1 3.61Å; H208-F235 AromaticContact ND1-CD1 3.77Å; H208-F235 AromaticContact ND1-CE1 3.81Å; N211-F235 WeakPolarHBondContact ND2-CE1 3.33Å; F212-F235 HydrophobicContact CE2-CB 3.85Å; F212-F235 HydrophobicContact CE2-CD1 4.09Å; F212-F235 HydrophobicContact CE2-CD2 4.01Å; F212-F235 AromaticContact CE2-CG 3.71Å; F212-F235 HydrophobicContact CE2-CG 3.71Å; F212-F235 HydrophobicContact CZ-CB 4.04Å; F212-F235 HydrophobicContact CZ-CD1 4.5Å; F212-F235 AromaticContact CZ-CD2 3.6Å; F212-F235 HydrophobicContact CZ-CD2 3.6Å; F212-F235 HydrophobicContact CZ-CE2 4.15Å; F212-F235 AromaticContact CZ-CG 3.78Å; F212-F235 HydrophobicContact CZ-CG 3.78Å; F227-F235 AromaticContact CD1-CE2 3.88Å; F227-F235 HydrophobicContact CD1-CE2 3.88Å; F227-F235 HydrophobicContact CD1-CZ 4.06Å; F227-F235 HydrophobicContact CE1-CE2 4.1Å; F227-F235 HydrophobicContact CE1-CZ 4.22Å; F227-F235 HydrophobicContact CG-CE2 4.22Å; I232-F235 HydrophobicContact CB-CE1 4.3Å; I232-F235 HydrophobicContact CB-CE2 4.42Å; I232-F235 HydrophobicContact CB-CZ 3.87Å; I232-F235 HydrophobicContact CD1-CE1 3.71Å; I232-F235 HydrophobicContact CD1-CZ 3.88Å; I232-F235 HydrophobicContact CG1-CZ 4.43Å; I232-F235 HydrophobicContact CG2-CD1 4.24Å; I232-F235 HydrophobicContact CG2-CE1 3.73Å; I232-F235 HydrophobicContact CG2-CE2 4.06Å; I232-F235 HydrophobicContact CG2-CZ 3.64Å; F235-L237 HydrophobicContact CB-CD2 4.3Å; F235-V290 HydrophobicContact CB-CB 4.39Å; F235-V290 PolarHBondContact N-O 2.87Å; F235-V290 PolarHBondContact O-N 2.85Å; F235-I292 HydrophobicContact CD2-CD1 4.07Å; F235-I292 HydrophobicContact CD2-CG1 4.39Å; F235-I292 HydrophobicContact CE2-CD1 3.95Å; F235-I292 HydrophobicContact CE2-CG1 4.14Å
236	N	94.6	Very high	93.5	Very high	69 Å²	69	41.4 Å²	41.4	37%	0.369	21%	0.212	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	105.5	177.6	-58.5	-47.4	0	0	0	108.5	H234 H289	H234-N236 PolarHBondContact NE2-ND2 3.25Å; N236-H289 PolarHBondContact OD1-CE1 3.17Å; N236-H289 VanDerWaalsContact OD1-CE1 3.31Å; N236-H289 PolarHBondContact OD1-ND1 2.97Å
237	L	94.1	Very high	92.1	Very high	3 Å²	3	40.7 Å²	40.7	2%	0.016	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	123	-169.8	-55.8	178.2	0	0	0	111.5	H208 F212 F235 V239 N287 L288 V290	H208-L237 HydrophobicContact CB-CD2 4.04Å; F212-L237 HydrophobicContact CB-CD1 4.26Å; F212-L237 HydrophobicContact CD1-CD1 4.26Å; F212-L237 HydrophobicContact CD2-CD1 3.49Å; F212-L237 VanDerWaalsContact CD2-CD1 3.49Å; F212-L237 HydrophobicContact CD2-CD2 3.49Å; F212-L237 VanDerWaalsContact CD2-CD2 3.49Å; F212-L237 HydrophobicContact CD2-CG 4.1Å; F212-L237 HydrophobicContact CE2-CD1 3.83Å; F212-L237 HydrophobicContact CE2-CD2 3.68Å; F212-L237 HydrophobicContact CE2-CG 4.24Å; F212-L237 HydrophobicContact CG-CD1 3.73Å; F212-L237 HydrophobicContact CG-CD2 4.48Å; F212-L237 HydrophobicContact CZ-CD1 4.34Å; F235-L237 HydrophobicContact CB-CD2 4.3Å; L237-V239 PolarHBondContact O-N 3.4Å; L237-N287 PolarHBondContact N-OD1 3.45Å; L237-N287 WeakPolarHBondContact O-CA 3.11Å; L237-N287 PolarHBondContact O-OD1 3.42Å; L237-L288 HydrophobicContact CB-CB 4.35Å; L237-L288 HydrophobicContact CD1-CD2 4.4Å; L237-L288 PolarHBondContact N-O 2.95Å; L237-L288 PolarHBondContact O-N 2.93Å; L237-V290 HydrophobicContact CD1-CG2 3.87Å; L237-V290 HydrophobicContact CG-CG2 4.47Å
238	S	94.1	Very high	90.2	Very high	35 Å²	35	44 Å²	44	25%	0.245	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.8	119.3	168.4	-173.2	0	0	0	0	108.6	L204 D205	L204-S238 CarbonylContact C-O 3.55Å; L204-S238 WeakPolarHBondContact CA-O 3.17Å; D205-S238 PolarHBondContact N-O 2.82Å; D205-S238 WeakPolarHBondContact O-CB 3.42Å
239	V	94.9	Very high	88.2	Confident	0 Å²	0	45.5 Å²	45.5	0%	0	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	126.9	175.4	-179	0	0	0	0	107.8	F165 M170 I187 L204 I214 L237 V241 H285 G286 L288	F165-V239 HydrophobicContact CE1-CG1 4.47Å; M170-V239 HydrophobicContact CE-CB 4.27Å; M170-V239 HydrophobicContact CE-CG2 4.24Å; I187-V239 HydrophobicContact CD1-CB 4.31Å; I187-V239 HydrophobicContact CD1-CG1 3.77Å; I187-V239 HydrophobicContact CD1-CG2 3.83Å; I187-V239 HydrophobicContact CG1-CG1 3.82Å; I187-V239 HydrophobicContact CG2-CG1 4.25Å; L204-V239 HydrophobicContact CD2-CG2 4.01Å; I214-V239 HydrophobicContact CD1-CG1 4.37Å; L237-V239 PolarHBondContact O-N 3.4Å; V239-V241 HydrophobicContact CG1-CG2 4.39Å; V239-H285 WeakPolarHBondContact O-CA 3.3Å; V239-G286 PolarHBondContact N-O 2.85Å; V239-G286 PolarHBondContact O-N 3.12Å; V239-L288 HydrophobicContact CG2-CB 3.91Å
240	I	94.4	Very high	85.8	Confident	7 Å²	7	49.3 Å²	49.3	4%	0.036	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	126.9	174	-55.9	-176.5	0	0	0	108.7	R203 D205 Y242 I283 V284 H285	R203-I240 HydrophobicContact CG-CB 3.78Å; R203-I240 HydrophobicContact CG-CG2 4.31Å; R203-I240 PolarHBondContact N-O 2.77Å; R203-I240 PolarHBondContact O-N 3.39Å; D205-I240 HydrophobicContact CB-CD1 3.59Å; D205-I240 HydrophobicContact CB-CG1 3.96Å; I240-Y242 HydrophobicContact CG2-CD1 4.49Å; I240-I283 HydrophobicContact CG2-CG2 3.27Å; I240-V284 WeakPolarHBondContact CA-O 3.18Å; I240-H285 VanDerWaalsContact CD1-CE1 3.43Å; I240-H285 WeakPolarHBondContact CD1-CE1 3.33Å
241	V	95.7	Very high	83.3	Confident	0 Å²	0	50.7 Å²	50.7	0%	0	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	133.9	167.5	-167.4	0	0	0	0	108	P163 F165 I187 A189 L200 G201 Y202 V239 I283 V284	P163-V241 HydrophobicContact CB-CB 4.23Å; P163-V241 HydrophobicContact CB-CG1 3.97Å; P163-V241 HydrophobicContact CG-CG1 4.49Å; F165-V241 HydrophobicContact CD1-CG2 4.42Å; F165-V241 HydrophobicContact CE1-CG2 3.54Å; F165-V241 HydrophobicContact CZ-CG2 3.89Å; I187-V241 HydrophobicContact CG2-CG2 4Å; A189-V241 HydrophobicContact CB-CG1 4.08Å; A189-V241 HydrophobicContact CB-CG2 4.34Å; L200-V241 HydrophobicContact CB-CG1 4.19Å; L200-V241 HydrophobicContact CD1-CG1 4.18Å; L200-V241 HydrophobicContact CD2-CG1 4.16Å; L200-V241 HydrophobicContact CG-CG1 4.42Å; G201-V241 WeakPolarHBondContact O-CA 3.3Å; Y202-V241 HydrophobicContact CD1-CB 4.41Å; Y202-V241 HydrophobicContact CD1-CG1 4.01Å; Y202-V241 HydrophobicContact CD1-CG2 3.68Å; Y202-V241 HydrophobicContact CE1-CB 4.47Å; Y202-V241 HydrophobicContact CE1-CG1 3.78Å; Y202-V241 HydrophobicContact CE1-CG2 3.82Å; V239-V241 HydrophobicContact CG1-CG2 4.39Å; V241-I283 WeakPolarHBondContact O-CA 3.2Å; V241-V284 HydrophobicContact CB-CG1 3.9Å; V241-V284 HydrophobicContact CG2-CG1 4.42Å; V241-V284 PolarHBondContact N-O 3.01Å; V241-V284 PolarHBondContact O-N 3.34Å
242	Y	94.4	Very high	80.7	Confident	22 Å²	22	50.1 Å²	50.1	9%	0.086	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	149	-179.6	50.9	-84.5	0	0	0	110.5	L200 G201 R203 E216 I240 H282	L200-Y242 CarbonylContact C-O 3.5Å; L200-Y242 WeakPolarHBondContact CA-O 3.2Å; G201-Y242 PolarHBondContact N-O 2.69Å; G201-Y242 WeakPolarHBondContact O-CD1 3.46Å; G201-Y242 PolarHBondContact O-N 2.79Å; R203-Y242 HydrophobicContact CB-CE1 4.23Å; R203-Y242 HydrophobicContact CG-CD1 4.4Å; R203-Y242 HydrophobicContact CG-CE1 3.91Å; R203-Y242 VanDerWaalsContact NH1-CE1 3.27Å; E216-Y242 VanDerWaalsContact CD-OH 3.31Å; E216-Y242 WeakPolarHBondContact CG-OH 3.33Å; E216-Y242 PolarHBondContact OE1-OH 2.95Å; I240-Y242 HydrophobicContact CG2-CD1 4.49Å; Y242-H282 WeakPolarHBondContact CA-O 3.34Å
243	D	93.9	Very high	78.2	Confident	0 Å²	0	54.2 Å²	54.2	0%	0	28%	0.276	C	S	.	.	S	Bend	trans	-81.2	-179.4	172	65.5	12.2	0	0	0	111.2	N159 P163 N197 S245 Q281 H282	N159-D243 VanDerWaalsContact ND2-CG 3.34Å; N159-D243 PolarHBondContact ND2-OD2 2.76Å; N159-D243 PolarHBondContact OD1-OD2 2.88Å; P163-D243 HydrophobicContact CG-CB 4.04Å; N197-D243 WeakPolarHBondContact O-CB 3.28Å; D243-S245 VanDerWaalsContact C-N 3.26Å; D243-S245 PolarHBondContact O-N 3.28Å; D243-S245 VanDerWaalsContact O-N 3.1Å; D243-Q281 PolarHBondContact O-NE2 2.56Å; D243-Q281 WeakPolarHBondContact OD1-CA 3.06Å; D243-Q281 WeakPolarHBondContact OD1-CG 3.24Å; D243-H282 PolarHBondContact N-O 3.1Å; D243-H282 VanDerWaalsContact N-O 3.16Å; D243-H282 PolarHBondContact OD1-N 3.15Å; D243-H282 WeakPolarHBondContact OD2-CA 3.25Å; D243-H282 WeakPolarHBondContact OD2-CB 3.17Å; D243-H282 IonicContact OD2-CG 3.86Å; D243-H282 PolarHBondContact OD2-N 3.25Å; D243-H282 IonicContact OD2-ND1 2.93Å; D243-H282 PolarHBondContact OD2-ND1 2.74Å; D243-H282 VanDerWaalsContact OD2-ND1 3.12Å
244	Q	87.4	Confident	75.6	Confident	40 Å²	40	56.2 Å²	56.2	19%	0.187	29%	0.287	C	S	.	.	S	Bend	trans	51.5	38.3	173.4	-63.9	-176.8	-21.4	0	0	115.1	N159 P196 N197 L199	N159-Q244 PolarHBondContact ND2-NE2 3.31Å; P196-Q244 WeakPolarHBondContact O-CA 3.48Å; N197-Q244 PolarHBondContact O-N 3.29Å; N197-Q244 PolarHBondContact OD1-NE2 2.81Å; L199-Q244 PolarHBondContact O-N 3.28Å
245	S	81.1	Confident	72.9	Confident	3 Å²	3	59.5 Å²	59.5	2%	0.021	31%	0.307	C	S	.	.			trans	-78.8	129.1	-174.5	64.1	0	0	0	0	113.8	L199 L200 G201 D243 W247	L199-S245 WeakPolarHBondContact CD2-O 3.36Å; L199-S245 WeakPolarHBondContact O-CB 3.33Å; L199-S245 PolarHBondContact O-N 2.93Å; L199-S245 PolarHBondContact O-OG 2.76Å; L200-S245 PolarHBondContact O-OG 2.73Å; G201-S245 PolarHBondContact N-OG 3.35Å; D243-S245 VanDerWaalsContact C-N 3.26Å; D243-S245 PolarHBondContact O-N 3.28Å; D243-S245 VanDerWaalsContact O-N 3.1Å; S245-W247 PolarHBondContact O-N 3.12Å; S245-W247 VanDerWaalsContact O-N 3.11Å; S245-W247 PolarHBondContact OG-NE1 3.37Å
246	D	77.2	Confident	70.2	Confident	114 Å²	114	65.2 Å²	65.2	61%	0.61	34%	0.337	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.9	2.8	-172.2	-83.6	-48	0	0	0	115.5	I248 T249	D246-I248 PolarHBondContact O-N 3.49Å; D246-T249 WeakPolarHBondContact O-CB 3.25Å; D246-T249 PolarHBondContact O-N 2.84Å; D246-T249 PolarHBondContact O-OG1 2.75Å
247	W	66	Low	67.3	Low	44 Å²	44	69.8 Å²	69.8	17%	0.167	36%	0.362	C	S	.	.	H	α-helix	trans	-61.4	-17.8	-169.4	65.1	-107.7	0	0	0	115.1	L199 L200 K217 S245 N251	L199-W247 HydrophobicContact CD1-CH2 4.19Å; L199-W247 HydrophobicContact CD1-CZ2 3.51Å; L199-W247 HydrophobicContact CG-CZ2 4.46Å; L200-W247 PolarHBondContact O-NE1 3.36Å; K217-W247 HydrophobicContact CB-CD2 4.21Å; K217-W247 HydrophobicContact CB-CG 4.44Å; K217-W247 HydrophobicContact CD-CD2 4.06Å; K217-W247 HydrophobicContact CD-CE3 3.66Å; K217-W247 HydrophobicContact CD-CH2 3.98Å; K217-W247 HydrophobicContact CD-CZ2 4.29Å; K217-W247 HydrophobicContact CD-CZ3 3.65Å; K217-W247 VanDerWaalsContact CE-CH2 3.47Å; K217-W247 HydrophobicContact CG-CD2 3.98Å; K217-W247 HydrophobicContact CG-CE3 4.08Å; K217-W247 HydrophobicContact CG-CH2 4.03Å; K217-W247 HydrophobicContact CG-CZ2 3.85Å; K217-W247 HydrophobicContact CG-CZ3 4.14Å; K217-W247 VanDerWaalsContact NZ-CZ3 3.29Å; S245-W247 PolarHBondContact O-N 3.12Å; S245-W247 VanDerWaalsContact O-N 3.11Å; S245-W247 PolarHBondContact OG-NE1 3.37Å; W247-N251 PolarHBondContact O-ND2 2.81Å
248	I	57.5	Low	64.8	Low	84 Å²	84	74.7 Å²	74.7	43%	0.431	39%	0.387	S	S	.	.	H	α-helix	trans	-69.5	-37	170.8	-69.7	-175.9	0	0	0	111.6	L199 D246	L199-I248 HydrophobicContact CD1-CD1 3.87Å; L199-I248 HydrophobicContact CD1-CG1 4.45Å; L199-I248 HydrophobicContact CD2-CB 4.46Å; L199-I248 HydrophobicContact CD2-CD1 3.55Å; L199-I248 HydrophobicContact CD2-CG1 3.91Å; L199-I248 HydrophobicContact CG-CD1 4.39Å; D246-I248 PolarHBondContact O-N 3.49Å
249	T	54.1	Low	61.7	Low	85 Å²	85	79 Å²	79	52%	0.521	41%	0.412	S	S	.	.	H	α-helix	trans	-68.2	-38.7	-177.1	69.2	0	0	0	0	112.1	D246 N251	D246-T249 WeakPolarHBondContact O-CB 3.25Å; D246-T249 PolarHBondContact O-N 2.84Å; D246-T249 PolarHBondContact O-OG1 2.75Å; T249-N251 PolarHBondContact O-N 3.46Å
250	L	47.7	Very low	58.7	Low	117 Å²	117	84.2 Å²	84.2	61%	0.613	45%	0.449	S	S	*	.	H	α-helix	trans	-66.9	-30.4	-178.5	-77.9	161.9	0	0	0	113.9
251	N	42.6	Very low	56	Low	80 Å²	80	87.3 Å²	87.3	43%	0.428	46%	0.464	S	S	.	.	H	α-helix	trans	-89.3	-13.2	-170.8	-80.8	-75.3	0	0	0	115.1	W247 T249 Y253	W247-N251 PolarHBondContact O-ND2 2.81Å; T249-N251 PolarHBondContact O-N 3.46Å; N251-Y253 PolarHBondContact O-N 3.16Å
252	N	41.9	Very low	53.1	Low	134 Å²	134	93.6 Å²	93.6	72%	0.717	50%	0.503	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.2	-7	173.7	-84.3	-7.6	0	0	0	113.6
253	Y	42.1	Very low	50	Low	142 Å²	142	98.5 Å²	98.5	56%	0.557	53%	0.531	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.2	-12.7	179	-112.9	-84.3	0	0	0	115	N251 I261 I264	N251-Y253 PolarHBondContact O-N 3.16Å; Y253-I261 HydrophobicContact CE1-CD1 4.24Å; Y253-I264 HydrophobicContact CE1-CD1 4.05Å
254	N	40.9	Very low	47.3	Very low	129 Å²	129	103 Å²	103	69%	0.69	55%	0.554	S	S	*	*	S	Bend	trans	-113.8	9.3	-166.7	-74.3	-28.5	0	0	0	115.3
255	N	39.7	Very low	44.4	Very low	137 Å²	137	106.8 Å²	106.8	73%	0.733	58%	0.58	S	S	*	*	S	Bend	trans	-120.4	-3.8	-177.9	-75.3	-68.8	0	0	0	115.3
256	D	39	Very low	42.2	Very low	124 Å²	124	111.3 Å²	111.3	66%	0.663	61%	0.607	S	S	*	*	S	Bend	trans	-106	137.6	172.1	-83.6	-44.8	0	0	0	111.3	I258	D256-I258 VanDerWaalsContact C-N 3.28Å; D256-I258 HydrophobicContact CB-CD1 4.22Å; D256-I258 HydrophobicContact CB-CG1 3.97Å; D256-I258 PolarHBondContact O-N 2.83Å
257	N	34.3	Very low	40	Very low	166 Å²	166	115 Å²	115	89%	0.888	62%	0.618	S	S	*	*			trans	-77.6	69.2	-177.3	-66	-51.1	0	0	0	111.9	T259	N257-T259 PolarHBondContact O-N 2.86Å
258	I	41.4	Very low	38.2	Very low	105 Å²	105	118.3 Å²	118.3	54%	0.538	64%	0.643	S	S	.	*			trans	-93.8	85.7	-176.8	-43.6	179.7	0	0	0	111.4	D256 I261	D256-I258 VanDerWaalsContact C-N 3.28Å; D256-I258 HydrophobicContact CB-CD1 4.22Å; D256-I258 HydrophobicContact CB-CG1 3.97Å; D256-I258 PolarHBondContact O-N 2.83Å; I258-I261 HydrophobicContact CB-CD1 4.15Å; I258-I261 HydrophobicContact CB-CG1 4.23Å; I258-I261 HydrophobicContact CD1-CD1 4.1Å; I258-I261 HydrophobicContact CG2-CD1 3.75Å; I258-I261 HydrophobicContact CG2-CG1 3.41Å; I258-I261 VanDerWaalsContact CG2-CG1 3.41Å
259	T	30.4	Very low	36.7	Very low	125 Å²	125	121.3 Å²	121.3	77%	0.767	66%	0.66	S	S	*	*			trans	-63	136.3	156.4	48.8	0	0	0	0	109.6	N257	N257-T259 PolarHBondContact O-N 2.86Å
260	S	30.4	Very low	35.8	Very low	110 Å²	110	123.8 Å²	123.8	77%	0.769	68%	0.675	S	S	*	*			trans	57.1	97.9	-177	57	0	0	0	0	115.7
261	I	39.1	Very low	35	Very low	72 Å²	72	126.5 Å²	126.5	37%	0.369	69%	0.687	S	S	.	*			trans	-121.8	102	151.6	-46.6	178.2	0	0	0	108.4	Y253 I258 I264	Y253-I261 HydrophobicContact CE1-CD1 4.24Å; I258-I261 HydrophobicContact CB-CD1 4.15Å; I258-I261 HydrophobicContact CB-CG1 4.23Å; I258-I261 HydrophobicContact CD1-CD1 4.1Å; I258-I261 HydrophobicContact CG2-CD1 3.75Å; I258-I261 HydrophobicContact CG2-CG1 3.41Å; I258-I261 VanDerWaalsContact CG2-CG1 3.41Å; I261-I264 HydrophobicContact CB-CG1 4.27Å; I261-I264 HydrophobicContact CG2-CD1 4.44Å; I261-I264 HydrophobicContact CG2-CG1 3.53Å
262	T	34.2	Very low	34.5	Very low	132 Å²	132	131.5 Å²	131.5	81%	0.81	71%	0.708	S	S	*	*			trans	-91.4	-2.9	164.6	42.6	0	0	0	0	112.6
263	D	29.3	Very low	34	Very low	126 Å²	126	132.6 Å²	132.6	67%	0.674	71%	0.713	S	S	*	*			trans	-121.1	51.9	-173.4	-67.4	-78.8	0	0	0	112.6	T265	D263-T265 PolarHBondContact O-N 3.48Å
264	I	37.8	Very low	33.6	Very low	95 Å²	95	134.9 Å²	134.9	49%	0.487	73%	0.726	S	S	.	*			trans	-78.4	78.7	160.3	-55.4	-174	0	0	0	107.8	Y253 I261 V266	Y253-I264 HydrophobicContact CE1-CD1 4.05Å; I261-I264 HydrophobicContact CB-CG1 4.27Å; I261-I264 HydrophobicContact CG2-CD1 4.44Å; I261-I264 HydrophobicContact CG2-CG1 3.53Å; I264-V266 VanDerWaalsContact C-N 3.33Å; I264-V266 HydrophobicContact CG2-CG2 4.23Å; I264-V266 PolarHBondContact O-N 3.48Å
265	T	26.3	Very low	33	Very low	118 Å²	118	136.8 Å²	136.8	72%	0.724	74%	0.736	S	S	*	*			trans	-68.4	95.4	165.4	-30.1	0	0	0	0	107.9	D263 K267	D263-T265 PolarHBondContact O-N 3.48Å; T265-K267 PolarHBondContact O-N 2.84Å
266	V	34.5	Very low	32.9	Very low	98 Å²	98	137.8 Å²	137.8	59%	0.594	74%	0.736	S	S	*	*			trans	-58.6	110.4	178.8	-174.6	0	0	0	0	109	I264 T268	I264-V266 VanDerWaalsContact C-N 3.33Å; I264-V266 HydrophobicContact CG2-CG2 4.23Å; I264-V266 PolarHBondContact O-N 3.48Å; V266-T268 HydrophobicContact CG1-CG2 3.75Å; V266-T268 WeakPolarHBondContact CG1-OG1 3.36Å; V266-T268 PolarHBondContact O-N 2.86Å
267	K	31.2	Very low	33.1	Very low	191 Å²	191	141.6 Å²	141.6	83%	0.83	75%	0.747	S	S	*	*			trans	-78.8	36.8	-180	-81.3	-169.4	174.3	-178.8	0	113.5	T265 N269	T265-K267 PolarHBondContact O-N 2.84Å; K267-N269 PolarHBondContact O-N 3.28Å
268	T	28.9	Very low	34	Very low	114 Å²	114	137.7 Å²	137.7	70%	0.699	74%	0.737	S	S	*	*			trans	-74.8	66.3	162.4	49.8	0	0	0	0	109.5	V266	V266-T268 HydrophobicContact CG1-CG2 3.75Å; V266-T268 WeakPolarHBondContact CG1-OG1 3.36Å; V266-T268 PolarHBondContact O-N 2.86Å
269	N	26	Very low	34.9	Very low	148 Å²	148	137.3 Å²	137.3	79%	0.791	74%	0.742	S	S	*	*			trans	-151.5	54.2	174.2	-105.3	-16.2	0	0	0	110.9	K267	K267-N269 PolarHBondContact O-N 3.28Å
270	T	34.1	Very low	36.8	Very low	137 Å²	137	137.8 Å²	137.8	84%	0.84	73%	0.733	S	S	*	*			trans	-132.2	26.7	158	45.8	0	0	0	0	111.7
271	M	32	Very low	39.4	Very low	173 Å²	173	136.7 Å²	136.7	85%	0.852	72%	0.716	S	S	*	*			trans	-74.6	145	147.1	-87	-170.2	156.1	0	0	108.3
272	E	31.9	Very low	41.9	Very low	185 Å²	185	134.8 Å²	134.8	86%	0.864	71%	0.705	S	S	*	*	S	Bend	trans	59.7	97.8	-171.3	-52.7	-174.6	-172.2	0	0	112.3
273	L	30.4	Very low	44.7	Very low	157 Å²	157	132.1 Å²	132.1	82%	0.822	69%	0.685	S	S	*	*	S	Bend		-167.6	50.1	72.9	-161.2	78	0	0	0	114.1
274	F	33.6	Very low	47.8	Very low	191 Å²	191	128 Å²	128	84%	0.838	66%	0.664	S	S	*	*			trans	-127.8	115.4	163.4	-86	-78.8	0	0	0	111.1	H276	F274-H276 PolarHBondContact O-N 3.36Å
275	N	29.7	Very low	50.5	Low	169 Å²	169	128.8 Å²	128.8	90%	0.904	67%	0.666	S	S	*	*			trans	-83.8	50.1	179.6	-167.3	19.6	0	0	0	111.7
276	H	36.8	Very low	53.7	Low	157 Å²	157	124 Å²	124	73%	0.727	64%	0.639	S	S	*	*	S	Bend	trans	-107.4	144.3	164.6	-73.6	-97.7	0	0	0	107.5	F274 A278	F274-H276 PolarHBondContact O-N 3.36Å; H276-A278 PolarHBondContact O-N 2.85Å
277	K	44.1	Very low	56.5	Low	205 Å²	205	122.7 Å²	122.7	89%	0.891	63%	0.629	S	S	*	*	P	Polyproline II helix	trans	-52.7	137.4	-174.2	-62.8	172.2	-177.1	171.1	0	110.2
278	A	51.7	Low	59.5	Low	84 Å²	84	113.6 Å²	113.6	69%	0.694	59%	0.59	S	S	*	*	P	Polyproline II helix	trans	-50	142.6	164.4	0	0	0	0	0	109.1	H276 K280	H276-A278 PolarHBondContact O-N 2.85Å; A278-K280 PolarHBondContact O-N 2.84Å
279	P	60.3	Low	62.7	Low	97 Å²	97	110.9 Å²	110.9	63%	0.63	57%	0.569	S	S	*	*	P	Polyproline II helix	trans	-56.5	133.4	-177.5	25.7	-34.8	0	0	0	109.9	Q281	P279-Q281 PolarHBondContact O-N 3.03Å; P279-Q281 VanDerWaalsContact O-N 3.1Å
280	K	71.9	Confident	66.1	Low	135 Å²	135	103.9 Å²	103.9	59%	0.587	53%	0.531	S	S	*	.			trans	-86.4	87.6	-167	176.1	170.1	151.9	-79.6	0	109.3	N159 A278 H282	N159-K280 PolarHBondContact ND2-O 3.46Å; A278-K280 PolarHBondContact O-N 2.84Å; K280-H282 PolarHBondContact NZ-NE2 3.28Å; K280-H282 PolarHBondContact O-CE1 3.36Å; K280-H282 PolarHBondContact O-N 3.24Å; K280-H282 PolarHBondContact O-ND1 3.39Å
281	Q	85.1	Confident	69.1	Low	86 Å²	86	101.1 Å²	101.1	40%	0.402	51%	0.508	S	S	.	.			trans	-53	125.7	174.7	-160.6	-177.7	39.8	0	0	111.1	D243 P279	D243-Q281 PolarHBondContact O-NE2 2.56Å; D243-Q281 WeakPolarHBondContact OD1-CA 3.06Å; D243-Q281 WeakPolarHBondContact OD1-CG 3.24Å; P279-Q281 PolarHBondContact O-N 3.03Å; P279-Q281 VanDerWaalsContact O-N 3.1Å
282	H	91.4	Very high	72.3	Confident	32 Å²	32	93.5 Å²	93.5	15%	0.148	47%	0.471	C	S	.	.			trans	-96.5	147	171.8	-60.4	94.7	0	0	0	111.7	N159 H161 Y242 D243 K280	N159-H282 PolarHBondContact OD1-CE1 3.19Å; N159-H282 PolarHBondContact OD1-ND1 2.88Å; H161-H282 PolarHBondContact O-CD2 2.75Å; H161-H282 VanDerWaalsContact O-CD2 3.25Å; H161-H282 PolarHBondContact O-CE1 3.02Å; H161-H282 PolarHBondContact O-ND1 2.79Å; H161-H282 PolarHBondContact O-NE2 2.96Å; Y242-H282 WeakPolarHBondContact CA-O 3.34Å; D243-H282 PolarHBondContact N-O 3.1Å; D243-H282 VanDerWaalsContact N-O 3.16Å; D243-H282 PolarHBondContact OD1-N 3.15Å; D243-H282 WeakPolarHBondContact OD2-CA 3.25Å; D243-H282 WeakPolarHBondContact OD2-CB 3.17Å; D243-H282 IonicContact OD2-CG 3.86Å; D243-H282 PolarHBondContact OD2-N 3.25Å; D243-H282 IonicContact OD2-ND1 2.93Å; D243-H282 PolarHBondContact OD2-ND1 2.74Å; D243-H282 VanDerWaalsContact OD2-ND1 3.12Å; K280-H282 PolarHBondContact NZ-NE2 3.28Å; K280-H282 PolarHBondContact O-CE1 3.36Å; K280-H282 PolarHBondContact O-N 3.24Å; K280-H282 PolarHBondContact O-ND1 3.39Å
283	I	92.8	Very high	75.4	Confident	77 Å²	77	87.4 Å²	87.4	40%	0.395	44%	0.444	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.1	128.4	-170.7	-54.6	-176	0	0	0	107.9	I240 V241	I240-I283 HydrophobicContact CG2-CG2 3.27Å; V241-I283 WeakPolarHBondContact O-CA 3.2Å
284	V	94	Very high	78.6	Confident	38 Å²	38	81.2 Å²	81.2	23%	0.23	41%	0.412	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	138.9	173.3	75.2	0	0	0	0	110.1	P163 F165 I240 V241	P163-V284 HydrophobicContact CB-CG1 3.87Å; P163-V284 VanDerWaalsContact O-CB 3.29Å; P163-V284 WeakPolarHBondContact O-CB 3.34Å; P163-V284 VanDerWaalsContact O-CG1 3.29Å; P163-V284 WeakPolarHBondContact O-CG1 3Å; F165-V284 HydrophobicContact CD2-CG1 4.15Å; F165-V284 HydrophobicContact CD2-CG2 4.12Å; F165-V284 HydrophobicContact CE2-CB 4.29Å; F165-V284 HydrophobicContact CE2-CG1 3.62Å; F165-V284 HydrophobicContact CE2-CG2 3.81Å; F165-V284 HydrophobicContact CZ-CG1 3.88Å; I240-V284 WeakPolarHBondContact CA-O 3.18Å; V241-V284 HydrophobicContact CB-CG1 3.9Å; V241-V284 HydrophobicContact CG2-CG1 4.42Å; V241-V284 PolarHBondContact N-O 3.01Å; V241-V284 PolarHBondContact O-N 3.34Å
285	H	93.9	Very high	81.6	Confident	113 Å²	113	74.2 Å²	74.2	52%	0.523	38%	0.384	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	132.9	177.2	-69.8	-111.3	0	0	0	109.8	V239 I240	V239-H285 WeakPolarHBondContact O-CA 3.3Å; I240-H285 VanDerWaalsContact CD1-CE1 3.43Å; I240-H285 WeakPolarHBondContact CD1-CE1 3.33Å
286	G	93	Very high	84.8	Confident	16 Å²	16	66.7 Å²	66.7	17%	0.165	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	161.4	173.7	0	0	0	0	0	111	V239	V239-G286 PolarHBondContact N-O 2.85Å; V239-G286 PolarHBondContact O-N 3.12Å
287	N	93.6	Very high	87.6	Confident	71 Å²	71	62.8 Å²	62.8	38%	0.38	33%	0.329	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	122.3	175.1	-173.5	10.3	0	0	0	109.6	L237 H289	L237-N287 PolarHBondContact N-OD1 3.45Å; L237-N287 WeakPolarHBondContact O-CA 3.11Å; L237-N287 PolarHBondContact O-OD1 3.42Å; N287-H289 PolarHBondContact ND2-CE1 2.9Å; N287-H289 PolarHBondContact ND2-NE2 3.02Å
288	L	95.1	Very high	90.1	Very high	0 Å²	0	54.1 Å²	54.1	0%	0	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.6	112.3	172.5	168.6	61.2	0	0	0	108.7	M170 A172 Y185 I187 V221 L237 V239 V290	M170-L288 HydrophobicContact CB-CB 4.26Å; M170-L288 HydrophobicContact CB-CD1 3.89Å; M170-L288 HydrophobicContact CE-CB 4.36Å; A172-L288 HydrophobicContact CB-CD1 4.07Å; Y185-L288 HydrophobicContact CD1-CD1 3.96Å; Y185-L288 HydrophobicContact CD1-CD2 4.21Å; Y185-L288 HydrophobicContact CD2-CD1 4.22Å; Y185-L288 HydrophobicContact CE1-CD1 4.36Å; Y185-L288 HydrophobicContact CG-CD1 3.88Å; Y185-L288 HydrophobicContact CG-CD2 4.31Å; I187-L288 HydrophobicContact CD1-CD2 4.47Å; V221-L288 HydrophobicContact CB-CD2 4.41Å; V221-L288 HydrophobicContact CG1-CD2 4.38Å; V221-L288 HydrophobicContact CG2-CD2 4.02Å; L237-L288 HydrophobicContact CB-CB 4.35Å; L237-L288 HydrophobicContact CD1-CD2 4.4Å; L237-L288 PolarHBondContact N-O 2.95Å; L237-L288 PolarHBondContact O-N 2.93Å; V239-L288 HydrophobicContact CG2-CB 3.91Å; L288-V290 HydrophobicContact CD1-CG2 4.45Å; L288-V290 HydrophobicContact CD2-CG2 4.16Å; L288-V290 HydrophobicContact CG-CG2 3.89Å
289	H	96	Very high	92.2	Very high	58 Å²	58	53.1 Å²	53.1	27%	0.269	28%	0.279	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.9	117.5	170.9	-67.2	-88.4	0	0	0	109.1	M170 I171 A172 N236 N287 F291	M170-H289 PolarHBondContact O-N 3.38Å; I171-H289 CarbonylContact C-O 3.56Å; I171-H289 VanDerWaalsContact CA-O 3.3Å; I171-H289 WeakPolarHBondContact CA-O 3.42Å; A172-H289 PolarHBondContact N-O 2.87Å; N236-H289 PolarHBondContact OD1-CE1 3.17Å; N236-H289 VanDerWaalsContact OD1-CE1 3.31Å; N236-H289 PolarHBondContact OD1-ND1 2.97Å; N287-H289 PolarHBondContact ND2-CE1 2.9Å; N287-H289 PolarHBondContact ND2-NE2 3.02Å; H289-F291 HydrophobicContact CB-CE2 4.31Å
290	V	96.9	Very high	94	Very high	0 Å²	0	48.5 Å²	48.5	0%	0	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	115.5	174.6	-174.3	0	0	0	0	108.1	A172 I174 I184 H234 F235 L237 L288	A172-V290 HydrophobicContact CB-CG2 4.46Å; A172-V290 WeakPolarHBondContact O-CA 3.39Å; I174-V290 HydrophobicContact CG2-CG1 3.68Å; I184-V290 HydrophobicContact CG2-CG1 3.81Å; I184-V290 HydrophobicContact CG2-CG2 4.02Å; H234-V290 CarbonylContact C-O 3.6Å; H234-V290 VanDerWaalsContact CA-O 3.25Å; H234-V290 WeakPolarHBondContact CA-O 3.45Å; H234-V290 WeakPolarHBondContact CB-O 3.19Å; F235-V290 HydrophobicContact CB-CB 4.39Å; F235-V290 PolarHBondContact N-O 2.87Å; F235-V290 PolarHBondContact O-N 2.85Å; L237-V290 HydrophobicContact CD1-CG2 3.87Å; L237-V290 HydrophobicContact CG-CG2 4.47Å; L288-V290 HydrophobicContact CD1-CG2 4.45Å; L288-V290 HydrophobicContact CD2-CG2 4.16Å; L288-V290 HydrophobicContact CG-CG2 3.89Å
291	F	98.1	Very high	95.1	Very high	80 Å²	80	46.9 Å²	46.9	35%	0.351	25%	0.246	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.4	143.2	170.4	-65.8	-78.1	0	0	0	110.2	I171 A172 H173 I174 H234 H289	I171-F291 HydrophobicContact CG2-CD2 3.71Å; I171-F291 HydrophobicContact CG2-CE2 3.72Å; A172-F291 PolarHBondContact O-N 2.88Å; H173-F291 WeakPolarHBondContact CA-O 3.12Å; H173-F291 AromaticContact CE1-CD2 3.98Å; H173-F291 AromaticContact NE2-CD2 3.84Å; I174-F291 PolarHBondContact N-O 2.86Å; H234-F291 HydrophobicContact CB-CD1 3.86Å; H234-F291 HydrophobicContact CB-CE1 4.16Å; H289-F291 HydrophobicContact CB-CE2 4.31Å
292	I	97.8	Very high	95.7	Very high	12 Å²	12	43.8 Å²	43.8	6%	0.062	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93	121.6	171.2	-51.8	-52.9	0	0	0	108.2	I174 E176 F227 R229 I232 D233 F235	I174-I292 HydrophobicContact CG2-CD1 3.63Å; I174-I292 CarbonylContact O-C 3.54Å; I174-I292 VanDerWaalsContact O-CA 3.29Å; I174-I292 WeakPolarHBondContact O-CA 3.26Å; E176-I292 HydrophobicContact CB-CG2 3.69Å; F227-I292 HydrophobicContact CB-CD1 4.03Å; F227-I292 HydrophobicContact CB-CG1 4.42Å; F227-I292 HydrophobicContact CB-CG2 4.41Å; F227-I292 HydrophobicContact CD2-CD1 3.79Å; F227-I292 HydrophobicContact CG-CD1 4.01Å; R229-I292 HydrophobicContact CB-CB 4.35Å; R229-I292 HydrophobicContact CB-CG2 3.78Å; R229-I292 HydrophobicContact CG-CB 4.21Å; R229-I292 HydrophobicContact CG-CG2 4.1Å; I232-I292 WeakPolarHBondContact O-CG1 3.15Å; D233-I292 PolarHBondContact O-N 2.97Å; F235-I292 HydrophobicContact CD2-CD1 4.07Å; F235-I292 HydrophobicContact CD2-CG1 4.39Å; F235-I292 HydrophobicContact CE2-CD1 3.95Å; F235-I292 HydrophobicContact CE2-CG1 4.14Å
293	D	97.4	Very high	95.9	Very high	58 Å²	58	49.3 Å²	49.3	31%	0.31	26%	0.262	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87	130.5	178.2	-62.5	-28.4	0	0	0	110.8	H173 I174 K175 E176	H173-D293 IonicContact CE1-OD1 3.19Å; H173-D293 IonicContact CG-OD1 3.16Å; H173-D293 IonicContact ND1-OD1 2.71Å; H173-D293 PolarHBondContact ND1-OD1 3.2Å; I174-D293 PolarHBondContact O-N 2.85Å; K175-D293 WeakPolarHBondContact CA-O 3.48Å; K175-D293 HydrophobicContact CG-CB 3.93Å; E176-D293 PolarHBondContact N-O 2.82Å; E176-D293 VanDerWaalsContact N-O 3.11Å
294	D	97.3	Very high	96.1	Very high	26 Å²	26	49.8 Å²	49.8	14%	0.139	27%	0.265	C	S	.	.	P	Polyproline II helix	trans	-54.5	138	179.9	-157.3	77.8	0	0	0	114.1	E176 R229 A331 T332 N335	E176-D294 VanDerWaalsContact OE1-CA 3.24Å; E176-D294 WeakPolarHBondContact OE1-CA 3.49Å; R229-D294 VanDerWaalsContact CD-OD1 3.24Å; R229-D294 WeakPolarHBondContact CD-OD1 3.48Å; R229-D294 IonicContact CZ-OD1 3.7Å; R229-D294 IonicContact NE-OD1 2.8Å; R229-D294 PolarHBondContact NE-OD1 3.32Å; R229-D294 VanDerWaalsContact NE-OD1 3.15Å; D294-A331 WeakPolarHBondContact OD1-CA 3.12Å; D294-A331 WeakPolarHBondContact OD1-CB 3.17Å; D294-A331 PolarHBondContact OD1-N 2.91Å; D294-T332 HydrophobicContact CB-CG2 3.69Å; D294-T332 PolarHBondContact OD1-N 3.36Å; D294-T332 WeakPolarHBondContact OD2-CB 3.5Å; D294-T332 WeakPolarHBondContact OD2-CG2 3.5Å; D294-T332 PolarHBondContact OD2-N 2.89Å; D294-T332 VanDerWaalsContact OD2-N 3.07Å; D294-T332 PolarHBondContact OD2-OG1 3.02Å; D294-N335 PolarHBondContact OD2-ND2 3.26Å
295	V	96.6	Very high	96.1	Very high	44 Å²	44	53 Å²	53	27%	0.267	29%	0.289	S	S	.	.			trans	-143.9	127	175.5	177.1	0	0	0	0	110.1	K175 E176 D297	K175-V295 HydrophobicContact CB-CG2 4.04Å; K175-V295 HydrophobicContact CD-CG2 4.24Å; K175-V295 HydrophobicContact CG-CG2 4.14Å; E176-V295 HydrophobicContact CG-CB 3.79Å; E176-V295 HydrophobicContact CG-CG2 3.95Å; E176-V295 PolarHBondContact OE1-N 3.15Å; V295-D297 PolarHBondContact O-N 3.49Å
296	N	96.8	Very high	96.2	Very high	12 Å²	12	50.9 Å²	50.9	6%	0.064	28%	0.281	C	S	.	.	S	Bend	trans	-59.4	101.8	179.5	-162.2	21	0	0	0	112.7	D330 N335 D385 P389	N296-D330 VanDerWaalsContact CA-OD2 3.23Å; N296-D330 WeakPolarHBondContact CA-OD2 3.4Å; N296-N335 HydrophobicContact CB-CB 4.15Å; N296-N335 PolarHBondContact N-ND2 3.09Å; N296-D385 PolarHBondContact ND2-OD1 3.5Å; N296-D385 PolarHBondContact ND2-OD2 2.87Å; N296-P389 PolarHBondContact ND2-O 2.72Å
297	D	95.9	Very high	96.5	Very high	75 Å²	75	51.7 Å²	51.7	40%	0.401	28%	0.28	S	S	.	.			trans	-138.8	-15.6	175.4	99.3	-12	0	0	0	114.8	N177 V295	N177-D297 PolarHBondContact ND2-OD2 3.36Å; V295-D297 PolarHBondContact O-N 3.49Å
298	C	95.8	Very high	96.7	Very high	23 Å²	23	55.1 Å²	55.1	16%	0.155	29%	0.293	C	S	.	.			trans	-72.5	165.1	162.7	-67.4	0	0	0	0	111.2	D328 D330 L391	C298-D328 WeakPolarHBondContact CB-OD1 3.17Å; C298-D330 WeakPolarHBondContact CB-OD1 3.47Å; C298-D330 PolarHBondContact N-OD1 3.21Å; C298-L391 WeakPolarHBondContact O-CD1 3.24Å
299	V	96.5	Very high	96.8	Very high	63 Å²	63	56.4 Å²	56.4	38%	0.382	30%	0.3	S	S	.	.			trans	-126	148.7	173.4	-50.8	0	0	0	0	108.6	I301 L391	V299-I301 HydrophobicContact CG2-CG1 4.46Å; V299-I301 WeakPolarHBondContact O-CG1 2.99Å; V299-I301 PolarHBondContact O-N 2.86Å; V299-I301 VanDerWaalsContact O-N 3.15Å; V299-L391 HydrophobicContact CG1-CB 4.04Å; V299-L391 HydrophobicContact CG1-CD1 4.36Å
300	P	97.4	Very high	96.8	Very high	0 Å²	0	60.8 Å²	60.8	0%	0	31%	0.314	C	S	.	.			trans	-60.4	120.7	177.7	-27.3	34.4	0	0	0	111	A326 D328 I338 A383 D385 S393	P300-A326 HydrophobicContact CB-CB 4.24Å; P300-D328 WeakPolarHBondContact CA-OD2 2.98Å; P300-D328 WeakPolarHBondContact CD-OD2 3.39Å; P300-D328 VanDerWaalsContact CG-OD2 3.25Å; P300-D328 WeakPolarHBondContact CG-OD2 3.33Å; P300-I338 HydrophobicContact CB-CD1 3.89Å; P300-I338 HydrophobicContact CB-CG1 3.97Å; P300-I338 HydrophobicContact CG-CD1 4.45Å; P300-I338 HydrophobicContact CG-CG1 4.03Å; P300-A383 HydrophobicContact CB-CB 3.75Å; P300-D385 HydrophobicContact CG-CB 4.34Å; P300-S393 WeakPolarHBondContact O-CB 3.48Å; P300-S393 PolarHBondContact O-OG 3.3Å
301	I	96.7	Very high	96.8	Very high	101 Å²	101	60.9 Å²	60.9	52%	0.518	32%	0.315	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105	124.5	-174.7	-49	-169.6	0	0	0	111.2	V299 A326 N327	V299-I301 HydrophobicContact CG2-CG1 4.46Å; V299-I301 WeakPolarHBondContact O-CG1 2.99Å; V299-I301 PolarHBondContact O-N 2.86Å; V299-I301 VanDerWaalsContact O-N 3.15Å; I301-A326 CarbonylContact O-C 3.59Å; I301-A326 WeakPolarHBondContact O-CA 3.4Å; I301-A326 WeakPolarHBondContact O-CB 3.47Å; I301-N327 PolarHBondContact N-O 3.05Å; I301-N327 PolarHBondContact O-N 3.14Å
302	F	97.2	Very high	96.7	Very high	20 Å²	20	58.5 Å²	58.5	9%	0.088	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.1	140.3	167.4	-64.4	-83.3	0	0	0	111.3	N304 Y307 I324 E325 A326 Y340 L381 A383 S393 T395	F302-N304 VanDerWaalsContact C-N 3.26Å; F302-N304 PolarHBondContact O-N 2.83Å; F302-Y307 HydrophobicContact CB-CE2 4.43Å; F302-I324 HydrophobicContact CD1-CG2 3.8Å; F302-I324 HydrophobicContact CE1-CG2 3.84Å; F302-E325 WeakPolarHBondContact CD1-O 3.5Å; F302-A326 HydrophobicContact CD1-CB 3.77Å; F302-A326 HydrophobicContact CD2-CB 4.34Å; F302-A326 HydrophobicContact CE1-CB 3.87Å; F302-A326 HydrophobicContact CE2-CB 4.42Å; F302-A326 HydrophobicContact CG-CB 4.03Å; F302-A326 HydrophobicContact CZ-CB 4.21Å; F302-Y340 HydrophobicContact CE1-CD1 4.36Å; F302-Y340 AromaticContact CE1-CE1 3.96Å; F302-Y340 HydrophobicContact CE1-CE1 3.96Å; F302-Y340 HydrophobicContact CZ-CD1 4.4Å; F302-Y340 HydrophobicContact CZ-CE1 4.27Å; F302-L381 HydrophobicContact CE1-CD2 3.94Å; F302-L381 HydrophobicContact CE1-CG 4.35Å; F302-L381 HydrophobicContact CZ-CD2 4.3Å; F302-L381 HydrophobicContact CZ-CG 4.21Å; F302-L381 WeakPolarHBondContact CZ-O 3.48Å; F302-A383 HydrophobicContact CE1-CB 4.25Å; F302-A383 HydrophobicContact CE2-CB 3.62Å; F302-A383 HydrophobicContact CZ-CB 3.42Å; F302-A383 VanDerWaalsContact CZ-CB 3.42Å; F302-S393 WeakPolarHBondContact CD2-OG 3.48Å; F302-S393 WeakPolarHBondContact CE2-OG 3.45Å; F302-T395 HydrophobicContact CB-CG2 4.38Å; F302-T395 HydrophobicContact CD1-CG2 3.59Å; F302-T395 HydrophobicContact CD2-CG2 3.91Å; F302-T395 HydrophobicContact CE1-CG2 3.67Å; F302-T395 HydrophobicContact CE2-CG2 3.99Å; F302-T395 HydrophobicContact CG-CG2 3.71Å; F302-T395 HydrophobicContact CZ-CG2 3.86Å
303	D	94.7	Very high	96.6	Very high	149 Å²	149	58.5 Å²	58.5	80%	0.797	31%	0.308	S	S	*	.	S	Bend	trans	-60.2	-32.5	176.8	-73.7	-25.9	0	0	0	113.6	Y307	D303-Y307 PolarHBondContact N-OH 3.4Å
304	N	96.4	Very high	96.5	Very high	87 Å²	87	60.8 Å²	60.8	47%	0.465	32%	0.32	S	S	.	.			trans	-129	149.6	-175.9	-59.2	-91.7	0	0	0	110.8	F302 Y307 T395	F302-N304 VanDerWaalsContact C-N 3.26Å; F302-N304 PolarHBondContact O-N 2.83Å; N304-Y307 HydrophobicContact CB-CD2 4.29Å; N304-Y307 HydrophobicContact CB-CE1 4.31Å; N304-Y307 HydrophobicContact CB-CE2 3.77Å; N304-Y307 PolarHBondContact N-OH 2.85Å; N304-Y307 PolarHBondContact ND2-OH 3.21Å; N304-Y307 WeakPolarHBondContact O-CE2 3.41Å; N304-T395 WeakPolarHBondContact O-CB 3.24Å; N304-T395 PolarHBondContact O-OG1 3.42Å
305	S	95	Very high	96.4	Very high	105 Å²	105	59.8 Å²	59.8	73%	0.734	32%	0.316	S	S	*	.	S	Bend	trans	-84.1	-15.3	173.7	53.9	0	0	0	0	113.9	T395 Q396	S305-T395 PolarHBondContact O-OG1 2.58Å; S305-Q396 PolarHBondContact O-N 3.07Å
306	L	97	Very high	96.3	Very high	68 Å²	68	65.6 Å²	65.6	36%	0.356	34%	0.337	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.4	123.4	176	174.5	63.2	0	0	0	109.9	Q308 Q396 H398	L306-Q308 HydrophobicContact CD2-CG 4.33Å; L306-Q308 HydrophobicContact CG-CG 4.25Å; L306-Q396 WeakPolarHBondContact CA-O 3.06Å; L306-Q396 HydrophobicContact CD1-CB 3.85Å; L306-Q396 HydrophobicContact CD1-CG 3.7Å; L306-H398 HydrophobicContact CD1-CB 4.18Å
307	Y	97.8	Very high	96.2	Very high	34 Å²	34	69.9 Å²	69.9	13%	0.133	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	130.5	168.1	-69.7	-96.6	0	0	0	109.9	F302 D303 N304 I324 T395 Q396 V397 H398	F302-Y307 HydrophobicContact CB-CE2 4.43Å; D303-Y307 PolarHBondContact N-OH 3.4Å; N304-Y307 HydrophobicContact CB-CD2 4.29Å; N304-Y307 HydrophobicContact CB-CE1 4.31Å; N304-Y307 HydrophobicContact CB-CE2 3.77Å; N304-Y307 PolarHBondContact N-OH 2.85Å; N304-Y307 PolarHBondContact ND2-OH 3.21Å; N304-Y307 WeakPolarHBondContact O-CE2 3.41Å; Y307-I324 VanDerWaalsContact CB-CD1 3.48Å; Y307-I324 HydrophobicContact CD1-CD1 4.11Å; Y307-I324 HydrophobicContact CD1-CG1 3.87Å; Y307-I324 HydrophobicContact CD1-CG2 4.27Å; Y307-I324 HydrophobicContact CD2-CD1 3.99Å; Y307-I324 HydrophobicContact CD2-CG1 4.36Å; Y307-I324 HydrophobicContact CD2-CG2 3.78Å; Y307-I324 HydrophobicContact CE1-CG1 4.34Å; Y307-I324 HydrophobicContact CE1-CG2 4.09Å; Y307-I324 HydrophobicContact CE2-CG2 3.59Å; Y307-I324 HydrophobicContact CG-CD1 3.59Å; Y307-I324 HydrophobicContact CG-CG1 3.88Å; Y307-I324 HydrophobicContact CG-CG2 4.13Å; Y307-T395 HydrophobicContact CD2-CG2 3.85Å; Y307-T395 WeakPolarHBondContact CD2-OG1 3.42Å; Y307-T395 HydrophobicContact CE2-CG2 3.92Å; Y307-Q396 PolarHBondContact N-O 3.45Å; Y307-V397 WeakPolarHBondContact O-CA 3.29Å; Y307-H398 PolarHBondContact O-N 3.46Å
308	Q	97.5	Very high	96.2	Very high	142 Å²	142	70.7 Å²	70.7	66%	0.664	36%	0.363	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-109	119.6	174.8	-65.3	-174	-13.7	0	0	109.3	L306 H398	L306-Q308 HydrophobicContact CD2-CG 4.33Å; L306-Q308 HydrophobicContact CG-CG 4.25Å; Q308-H398 WeakPolarHBondContact CA-O 3.45Å
309	L	97.1	Very high	96.2	Very high	28 Å²	28	73.7 Å²	73.7	15%	0.147	38%	0.375	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122	159.4	-179.7	-58.6	176	0	0	0	109.7	I321 I324 I362 V397 H398 I399 H400	L309-I321 HydrophobicContact CB-CG2 3.85Å; L309-I321 HydrophobicContact CD1-CG2 4.04Å; L309-I324 HydrophobicContact CD1-CD1 4.21Å; L309-I362 HydrophobicContact CD1-CD1 4.26Å; L309-V397 HydrophobicContact CD1-CG1 4.1Å; L309-H398 PolarHBondContact N-O 2.95Å; L309-I399 HydrophobicContact CB-CG1 4.32Å; L309-I399 WeakPolarHBondContact O-CA 3.3Å; L309-H400 PolarHBondContact O-N 2.92Å
310	R	97.4	Very high	96.2	Very high	149 Å²	149	74.6 Å²	74.6	56%	0.562	38%	0.377	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-134.4	142.7	176.3	-45.6	-172	82.7	-172.6	7.1	109.6	H400 I402	R310-H400 VanDerWaalsContact CA-O 3.3Å; R310-H400 WeakPolarHBondContact CA-O 3.29Å; R310-H400 HydrophobicContact CG-CB 4.34Å; R310-H400 PolarHBondContact NH2-CE1 3.25Å; R310-H400 PolarHBondContact NH2-NE2 2.85Å; R310-I402 HydrophobicContact CB-CD1 3.81Å; R310-I402 HydrophobicContact CB-CG1 3.93Å
311	V	96.9	Very high	96.2	Very high	3 Å²	3	75.6 Å²	75.6	2%	0.018	38%	0.382	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.4	141.1	178.4	66.3	0	0	0	0	109.4	A315 I321 V364 L369 I399 H400 L401 I402	V311-A315 HydrophobicContact CG2-CB 3.59Å; V311-I321 HydrophobicContact CB-CD1 4.19Å; V311-I321 HydrophobicContact CB-CG1 4.13Å; V311-I321 HydrophobicContact CB-CG2 4.16Å; V311-I321 HydrophobicContact CG1-CD1 4.2Å; V311-I321 HydrophobicContact CG2-CD1 4.18Å; V311-I321 HydrophobicContact CG2-CG1 3.92Å; V311-V364 HydrophobicContact CG2-CG2 3.97Å; V311-L369 HydrophobicContact CG1-CD1 3.96Å; V311-L369 HydrophobicContact CG2-CD1 4.45Å; V311-I399 HydrophobicContact CB-CG2 4.49Å; V311-I399 HydrophobicContact CG1-CG2 3.65Å; V311-H400 PolarHBondContact N-O 2.78Å; V311-H400 VanDerWaalsContact N-O 3.1Å; V311-L401 HydrophobicContact CG1-CD2 3.53Å; V311-L401 CarbonylContact O-C 3.53Å; V311-L401 WeakPolarHBondContact O-CA 3.42Å; V311-I402 PolarHBondContact O-N 2.9Å
312	S	96	Very high	96.1	Very high	29 Å²	29	71.6 Å²	71.6	20%	0.203	37%	0.366	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.8	146.4	172.7	-159.2	0	0	0	0	110.6	D314 A315 V404	S312-D314 WeakPolarHBondContact CB-OD1 3.43Å; S312-D314 PolarHBondContact OG-OD1 3.35Å; S312-A315 WeakPolarHBondContact O-CB 3.27Å; S312-A315 PolarHBondContact O-N 2.91Å; S312-V404 WeakPolarHBondContact OG-CG2 3.31Å
313	E	95.6	Very high	96.1	Very high	13 Å²	13	74.3 Å²	74.3	6%	0.061	38%	0.379	C	S	.	.	T	Hydrogen-bonded Turn	trans	-72.5	-30.2	174.6	68	-161.7	119.3	0	0	113.5	A315 L369 R371 L401 I402 D403 V404	E313-A315 PolarHBondContact O-N 3.01Å; E313-L369 HydrophobicContact CB-CB 4.25Å; E313-R371 WeakPolarHBondContact OE2-CB 2.94Å; E313-R371 PolarHBondContact OE2-N 2.82Å; E313-L401 HydrophobicContact CB-CD1 4.29Å; E313-I402 PolarHBondContact N-O 3.49Å; E313-D403 VanDerWaalsContact OE1-CA 3.28Å; E313-D403 WeakPolarHBondContact OE1-CA 3.39Å; E313-V404 HydrophobicContact CG-CB 4.05Å; E313-V404 HydrophobicContact CG-CG2 4Å; E313-V404 PolarHBondContact OE1-N 3.18Å
314	D	94.4	Very high	96.1	Very high	105 Å²	105	67.2 Å²	67.2	56%	0.561	34%	0.341	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.7	1	170.2	89	-46.8	0	0	0	113.5	S312 K316 V404	S312-D314 WeakPolarHBondContact CB-OD1 3.43Å; S312-D314 PolarHBondContact OG-OD1 3.35Å; D314-K316 PolarHBondContact O-N 3.48Å; D314-K316 VanDerWaalsContact O-N 3.15Å; D314-V404 HydrophobicContact CB-CG2 4.32Å
315	A	95.8	Very high	96	Very high	6 Å²	6	68.5 Å²	68.5	5%	0.05	34%	0.344	C	S	.	.	P	Polyproline II helix	trans	-62.1	117.1	-178.1	0	0	0	0	0	112.1	V311 S312 E313 H319 V364	V311-A315 HydrophobicContact CG2-CB 3.59Å; S312-A315 WeakPolarHBondContact O-CB 3.27Å; S312-A315 PolarHBondContact O-N 2.91Å; E313-A315 PolarHBondContact O-N 3.01Å; A315-H319 HydrophobicContact CB-CB 4.03Å; A315-V364 HydrophobicContact CB-CG2 4.04Å
316	K	95.1	Very high	96.1	Very high	166 Å²	166	63.8 Å²	63.8	72%	0.722	31%	0.311	S	S	*	.	P	Polyproline II helix	trans	-66.3	157.5	-178.7	-65.5	169	-174.5	167.2	0	111.8	D314 N318 H319	D314-K316 PolarHBondContact O-N 3.48Å; D314-K316 VanDerWaalsContact O-N 3.15Å; K316-N318 PolarHBondContact O-N 2.82Å; K316-H319 WeakPolarHBondContact O-CB 3.42Å; K316-H319 PolarHBondContact O-N 2.95Å
317	I	95	Very high	96	Very high	101 Å²	101	65.8 Å²	65.8	52%	0.518	32%	0.322	S	S	.	.	T	Hydrogen-bonded Turn	trans	-49.7	135.9	169.7	-59.3	169.9	0	0	0	109.4	H319	I317-H319 VanDerWaalsContact C-N 3.31Å
318	N	94.9	Very high	96	Very high	92 Å²	92	64.8 Å²	64.8	49%	0.492	32%	0.319	S	S	.	.	T	Hydrogen-bonded Turn	trans	70.1	10.8	-173.7	-51.4	-39	0	0	0	116.2	K316 L320 R355 Y363 V364	K316-N318 PolarHBondContact O-N 2.82Å; N318-L320 PolarHBondContact O-N 2.97Å; N318-R355 VanDerWaalsContact OD1-CZ 3.32Å; N318-R355 PolarHBondContact OD1-NH2 3.28Å; N318-Y363 WeakPolarHBondContact O-CD1 3.36Å; N318-V364 PolarHBondContact N-O 3.08Å
319	H	95.8	Very high	95.9	Very high	86 Å²	86	61 Å²	61	40%	0.398	31%	0.309	S	S	.	.			trans	-61.9	131	165.1	-176.6	91.8	0	0	0	110.4	A315 K316 I317 Y363 V364	A315-H319 HydrophobicContact CB-CB 4.03Å; K316-H319 WeakPolarHBondContact O-CB 3.42Å; K316-H319 PolarHBondContact O-N 2.95Å; I317-H319 VanDerWaalsContact C-N 3.31Å; H319-Y363 CarbonylContact O-C 3.58Å; H319-Y363 VanDerWaalsContact O-CA 3.26Å; H319-Y363 WeakPolarHBondContact O-CA 3.38Å; H319-V364 HydrophobicContact CB-CB 4.37Å; H319-V364 HydrophobicContact CB-CG2 4.04Å; H319-V364 PolarHBondContact O-N 3.17Å
320	L	96.7	Very high	95.9	Very high	83 Å²	83	59.9 Å²	59.9	44%	0.435	30%	0.303	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.1	123.6	178.5	174.8	65.1	0	0	0	110.1	N318 G322 Y361 Y363	N318-L320 PolarHBondContact O-N 2.97Å; L320-G322 WeakPolarHBondContact CD1-O 3.46Å; L320-Y361 HydrophobicContact CD1-CD1 3.93Å; L320-Y361 HydrophobicContact CD1-CG 4.33Å; L320-Y363 HydrophobicContact CB-CD1 4.04Å; L320-Y363 HydrophobicContact CB-CE1 3.89Å; L320-Y363 HydrophobicContact CD1-CD1 4.12Å; L320-Y363 HydrophobicContact CD1-CE1 3.72Å; L320-Y363 HydrophobicContact CG-CE1 4.36Å
321	I	96.9	Very high	95.8	Very high	20 Å²	20	55.5 Å²	55.5	10%	0.103	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.1	-35	-179.6	-53.8	-177.8	0	0	0	111.1	L309 V311 F354 I362 V364 I399	L309-I321 HydrophobicContact CB-CG2 3.85Å; L309-I321 HydrophobicContact CD1-CG2 4.04Å; V311-I321 HydrophobicContact CB-CD1 4.19Å; V311-I321 HydrophobicContact CB-CG1 4.13Å; V311-I321 HydrophobicContact CB-CG2 4.16Å; V311-I321 HydrophobicContact CG1-CD1 4.2Å; V311-I321 HydrophobicContact CG2-CD1 4.18Å; V311-I321 HydrophobicContact CG2-CG1 3.92Å; I321-F354 HydrophobicContact CD1-CD1 3.38Å; I321-F354 HydrophobicContact CD1-CE1 3.5Å; I321-F354 HydrophobicContact CD1-CG 4.48Å; I321-I362 HydrophobicContact CD1-CG2 4.39Å; I321-I362 PolarHBondContact N-O 3.17Å; I321-V364 HydrophobicContact CD1-CG2 3.87Å; I321-V364 HydrophobicContact CG1-CG2 4.07Å; I321-I399 HydrophobicContact CD1-CD1 4.08Å; I321-I399 HydrophobicContact CG2-CD1 4.39Å; I321-I399 HydrophobicContact CG2-CG2 4.46Å
322	G	95.3	Very high	95.6	Very high	17 Å²	17	58.1 Å²	58.1	18%	0.175	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	167.8	-176.8	-179.8	0	0	0	0	0	111.9	L320 Y361 I362	L320-G322 WeakPolarHBondContact CD1-O 3.46Å; G322-Y361 WeakPolarHBondContact O-CA 3.16Å; G322-I362 PolarHBondContact O-N 3Å
323	Q	95.9	Very high	95.4	Very high	78 Å²	78	64.5 Å²	64.5	36%	0.364	34%	0.341	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	136.3	172.8	-165	-173.4	-4.6	0	0	108.6	E325 K359 Y361	Q323-E325 PolarHBondContact NE2-OE2 2.96Å; Q323-K359 PolarHBondContact NE2-O 3.18Å; Q323-Y361 HydrophobicContact CB-CD1 3.65Å; Q323-Y361 HydrophobicContact CB-CE1 3.86Å; Q323-Y361 HydrophobicContact CB-CG 4.45Å; Q323-Y361 VanDerWaalsContact CD-CE1 3.45Å; Q323-Y361 HydrophobicContact CG-CD1 3.64Å; Q323-Y361 HydrophobicContact CG-CE1 3.72Å; Q323-Y361 HydrophobicContact CG-CG 4.08Å; Q323-Y361 VanDerWaalsContact OE1-CE1 3.29Å
324	I	96.2	Very high	95.3	Very high	0 Å²	0	69 Å²	69	0%	0	36%	0.364	C	S	.	.			trans	-128.5	117.5	170.5	-59.9	179.1	0	0	0	106.9	F302 Y307 L309 G360 I362 L381 T395 V397	F302-I324 HydrophobicContact CD1-CG2 3.8Å; F302-I324 HydrophobicContact CE1-CG2 3.84Å; Y307-I324 VanDerWaalsContact CB-CD1 3.48Å; Y307-I324 HydrophobicContact CD1-CD1 4.11Å; Y307-I324 HydrophobicContact CD1-CG1 3.87Å; Y307-I324 HydrophobicContact CD1-CG2 4.27Å; Y307-I324 HydrophobicContact CD2-CD1 3.99Å; Y307-I324 HydrophobicContact CD2-CG1 4.36Å; Y307-I324 HydrophobicContact CD2-CG2 3.78Å; Y307-I324 HydrophobicContact CE1-CG1 4.34Å; Y307-I324 HydrophobicContact CE1-CG2 4.09Å; Y307-I324 HydrophobicContact CE2-CG2 3.59Å; Y307-I324 HydrophobicContact CG-CD1 3.59Å; Y307-I324 HydrophobicContact CG-CG1 3.88Å; Y307-I324 HydrophobicContact CG-CG2 4.13Å; L309-I324 HydrophobicContact CD1-CD1 4.21Å; I324-G360 PolarHBondContact N-O 3.37Å; I324-G360 WeakPolarHBondContact O-CA 3.31Å; I324-I362 HydrophobicContact CD1-CD1 3.73Å; I324-I362 HydrophobicContact CG1-CD1 4.16Å; I324-L381 HydrophobicContact CB-CD2 3.76Å; I324-L381 HydrophobicContact CD1-CD2 4.34Å; I324-L381 HydrophobicContact CG2-CD2 3.7Å; I324-T395 HydrophobicContact CG2-CG2 4.19Å; I324-V397 HydrophobicContact CD1-CB 4.37Å; I324-V397 HydrophobicContact CD1-CG1 3.91Å; I324-V397 HydrophobicContact CD1-CG2 3.53Å
325	E	93.8	Very high	95.3	Very high	113 Å²	113	64.9 Å²	64.9	53%	0.528	34%	0.342	S	S	.	.			trans	-112.9	147.5	-176.4	-165.6	158.1	-161.7	0	0	109.9	F302 Q323	F302-E325 WeakPolarHBondContact CD1-O 3.5Å; Q323-E325 PolarHBondContact NE2-OE2 2.96Å
326	A	96.3	Very high	95.3	Very high	6 Å²	6	67.2 Å²	67.2	5%	0.05	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	152.2	165.5	0	0	0	0	0	107.8	P300 I301 F302 I338 Y340 A383	P300-A326 HydrophobicContact CB-CB 4.24Å; I301-A326 CarbonylContact O-C 3.59Å; I301-A326 WeakPolarHBondContact O-CA 3.4Å; I301-A326 WeakPolarHBondContact O-CB 3.47Å; F302-A326 HydrophobicContact CD1-CB 3.77Å; F302-A326 HydrophobicContact CD2-CB 4.34Å; F302-A326 HydrophobicContact CE1-CB 3.87Å; F302-A326 HydrophobicContact CE2-CB 4.42Å; F302-A326 HydrophobicContact CG-CB 4.03Å; F302-A326 HydrophobicContact CZ-CB 4.21Å; A326-I338 HydrophobicContact CB-CD1 4.2Å; A326-I338 WeakPolarHBondContact O-CD1 3.38Å; A326-Y340 HydrophobicContact CB-CE1 4.15Å; A326-Y340 PolarHBondContact N-OH 2.71Å; A326-Y340 PolarHBondContact O-OH 2.66Å; A326-A383 HydrophobicContact CB-CB 3.76Å
327	N	95.7	Very high	95.3	Very high	110 Å²	110	64.4 Å²	64.4	59%	0.588	34%	0.343	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-122.9	137.8	178.3	-179	91.6	0	0	0	110.4	I301	I301-N327 PolarHBondContact N-O 3.05Å; I301-N327 PolarHBondContact O-N 3.14Å
328	D	97	Very high	95.3	Very high	13 Å²	13	60.7 Å²	60.7	7%	0.07	32%	0.324	C	S	.	.			trans	-105.5	161.1	170.3	-138.8	-53.8	0	0	0	111.8	C298 P300 N336 I338	C298-D328 WeakPolarHBondContact CB-OD1 3.17Å; P300-D328 WeakPolarHBondContact CA-OD2 2.98Å; P300-D328 WeakPolarHBondContact CD-OD2 3.39Å; P300-D328 VanDerWaalsContact CG-OD2 3.25Å; P300-D328 WeakPolarHBondContact CG-OD2 3.33Å; D328-N336 HydrophobicContact CB-CB 3.93Å; D328-I338 HydrophobicContact CB-CD1 4.33Å
329	S	96.3	Very high	95.3	Very high	63 Å²	63	60 Å²	60	44%	0.441	32%	0.318	S	S	.	.			trans	-110.6	-19	-174.3	-54.9	0	0	0	0	114.4	R229	R229-S329 PolarHBondContact NH2-O 3.14Å
330	D	97.5	Very high	95.3	Very high	5 Å²	5	57.2 Å²	57.2	3%	0.027	30%	0.304	C	S	.	.			trans	-51.8	150	172.8	-87	44.6	0	0	0	112.6	E230 N296 C298 N335 N336	E230-D330 WeakPolarHBondContact OE1-CA 3.47Å; N296-D330 VanDerWaalsContact CA-OD2 3.23Å; N296-D330 WeakPolarHBondContact CA-OD2 3.4Å; C298-D330 WeakPolarHBondContact CB-OD1 3.47Å; C298-D330 PolarHBondContact N-OD1 3.21Å; D330-N335 HydrophobicContact CB-CB 3.71Å; D330-N335 WeakPolarHBondContact OD2-CB 3.45Å; D330-N335 PolarHBondContact OD2-ND2 3.36Å; D330-N336 HydrophobicContact CB-CB 4.42Å; D330-N336 PolarHBondContact O-ND2 3.41Å
331	A	94.6	Very high	95.3	Very high	56 Å²	56	57.6 Å²	57.6	46%	0.463	31%	0.306	S	S	.	.	S	Bend	trans	-89.6	-30.5	-176.7	0	0	0	0	0	114.5	D294 N336	D294-A331 WeakPolarHBondContact OD1-CA 3.12Å; D294-A331 WeakPolarHBondContact OD1-CB 3.17Å; D294-A331 PolarHBondContact OD1-N 2.91Å; A331-N336 PolarHBondContact O-ND2 2.89Å
332	T	93.6	Very high	95.2	Very high	58 Å²	58	58.2 Å²	58.2	36%	0.356	31%	0.31	S	S	.	.	S	Bend	trans	-78.4	137.8	-178.4	62.1	0	0	0	0	112	D294 I334 N335 N336	D294-T332 HydrophobicContact CB-CG2 3.69Å; D294-T332 PolarHBondContact OD1-N 3.36Å; D294-T332 WeakPolarHBondContact OD2-CB 3.5Å; D294-T332 WeakPolarHBondContact OD2-CG2 3.5Å; D294-T332 PolarHBondContact OD2-N 2.89Å; D294-T332 VanDerWaalsContact OD2-N 3.07Å; D294-T332 PolarHBondContact OD2-OG1 3.02Å; T332-I334 PolarHBondContact O-N 2.87Å; T332-N335 PolarHBondContact O-N 2.97Å; T332-N335 VanDerWaalsContact OG1-CG 3.3Å; T332-N335 PolarHBondContact OG1-ND2 3.28Å; T332-N336 VanDerWaalsContact O-CG 3.26Å; T332-N336 PolarHBondContact O-N 2.84Å; T332-N336 PolarHBondContact O-ND2 3.05Å; T332-N336 PolarHBondContact O-OD1 3.23Å
333	E	92	Very high	95.1	Very high	164 Å²	164	63 Å²	63	77%	0.766	33%	0.325	S	S	*	.	H	α-helix	trans	-53.3	-26	177.3	-65.3	178.8	172.1	0	0	112.8	N336 Q337	E333-N336 WeakPolarHBondContact CA-OD1 3.35Å; E333-Q337 WeakPolarHBondContact O-CB 3.32Å; E333-Q337 PolarHBondContact O-N 2.92Å; E333-Q337 VanDerWaalsContact O-N 3.08Å
334	I	93.2	Very high	95	Very high	107 Å²	107	60.6 Å²	60.6	55%	0.549	32%	0.317	S	S	.	.	H	α-helix	trans	-77.4	-41.8	178.4	-62	175.9	0	0	0	111.2	T332 S386 G387	T332-I334 PolarHBondContact O-N 2.87Å; I334-S386 VanDerWaalsContact CG2-O 3.25Å; I334-S386 WeakPolarHBondContact CG2-O 3.25Å; I334-S386 CarbonylContact O-C 3.58Å; I334-S386 VanDerWaalsContact O-CA 3.32Å; I334-S386 WeakPolarHBondContact O-CA 3.43Å; I334-S386 VanDerWaalsContact O-CB 3.24Å; I334-S386 WeakPolarHBondContact O-CB 3.21Å; I334-S386 PolarHBondContact O-N 2.87Å; I334-G387 PolarHBondContact O-N 2.9Å
335	N	94.7	Very high	94.7	Very high	18 Å²	18	64.6 Å²	64.6	10%	0.096	34%	0.335	C	S	.	.	H	α-helix	trans	-79.9	-25.4	-179.6	-58.2	-3.8	0	0	0	112.4	D294 N296 D330 T332 D385	D294-N335 PolarHBondContact OD2-ND2 3.26Å; N296-N335 HydrophobicContact CB-CB 4.15Å; N296-N335 PolarHBondContact N-ND2 3.09Å; D330-N335 HydrophobicContact CB-CB 3.71Å; D330-N335 WeakPolarHBondContact OD2-CB 3.45Å; D330-N335 PolarHBondContact OD2-ND2 3.36Å; T332-N335 PolarHBondContact O-N 2.97Å; T332-N335 VanDerWaalsContact OG1-CG 3.3Å; T332-N335 PolarHBondContact OG1-ND2 3.28Å; N335-D385 WeakPolarHBondContact O-CB 3.19Å
336	N	94.1	Very high	94.3	Very high	55 Å²	55	64.5 Å²	64.5	29%	0.294	34%	0.337	S	S	.	.	H	α-helix	trans	-101.2	-1.3	177	68.9	33.4	0	0	0	115.4	D328 D330 A331 T332 E333 I338	D328-N336 HydrophobicContact CB-CB 3.93Å; D330-N336 HydrophobicContact CB-CB 4.42Å; D330-N336 PolarHBondContact O-ND2 3.41Å; A331-N336 PolarHBondContact O-ND2 2.89Å; T332-N336 VanDerWaalsContact O-CG 3.26Å; T332-N336 PolarHBondContact O-N 2.84Å; T332-N336 PolarHBondContact O-ND2 3.05Å; T332-N336 PolarHBondContact O-OD1 3.23Å; E333-N336 WeakPolarHBondContact CA-OD1 3.35Å; N336-I338 PolarHBondContact O-N 2.88Å; N336-I338 VanDerWaalsContact O-N 3.09Å
337	Q	94.9	Very high	93.5	Very high	107 Å²	107	73.1 Å²	73.1	50%	0.5	38%	0.376	S	S	.	.			trans	-74	101	173.7	173.3	164.3	43.1	0	0	111.4	E333 D385 S386	E333-Q337 WeakPolarHBondContact O-CB 3.32Å; E333-Q337 PolarHBondContact O-N 2.92Å; E333-Q337 VanDerWaalsContact O-N 3.08Å; Q337-D385 CarbonylContact O-C 3.57Å; Q337-D385 VanDerWaalsContact O-C 3.32Å; Q337-D385 WeakPolarHBondContact O-CA 3.5Å; Q337-S386 PolarHBondContact O-N 2.99Å; Q337-S386 VanDerWaalsContact O-N 3.16Å; Q337-S386 PolarHBondContact O-OG 2.77Å
338	I	95.5	Very high	92.5	Very high	23 Å²	23	71.5 Å²	71.5	12%	0.118	39%	0.386	C	S	.	.			trans	-80.7	136.3	-179.3	-63	164.9	0	0	0	112	P300 A326 D328 N336 Y340 A383 M384	P300-I338 HydrophobicContact CB-CD1 3.89Å; P300-I338 HydrophobicContact CB-CG1 3.97Å; P300-I338 HydrophobicContact CG-CD1 4.45Å; P300-I338 HydrophobicContact CG-CG1 4.03Å; A326-I338 HydrophobicContact CB-CD1 4.2Å; A326-I338 WeakPolarHBondContact O-CD1 3.38Å; D328-I338 HydrophobicContact CB-CD1 4.33Å; N336-I338 PolarHBondContact O-N 2.88Å; N336-I338 VanDerWaalsContact O-N 3.09Å; I338-Y340 HydrophobicContact CG2-CD1 4.33Å; I338-Y340 HydrophobicContact CG2-CD2 4.32Å; I338-Y340 HydrophobicContact CG2-CE1 3.84Å; I338-Y340 HydrophobicContact CG2-CE2 3.81Å; I338-A383 HydrophobicContact CG2-CB 3.83Å; I338-M384 CarbonylContact C-O 3.4Å; I338-M384 WeakPolarHBondContact CA-O 3.26Å
339	H	95.2	Very high	91.7	Very high	77 Å²	77	75.9 Å²	75.9	36%	0.356	41%	0.406	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	138.6	166.7	-68.5	-42.9	0	0	0	110.7	M384 S386	H339-M384 HydrophobicContact CB-CE 3.87Å; H339-M384 HydrophobicContact CB-CG 4.11Å; H339-M384 PolarHBondContact N-O 2.85Å; H339-M384 PolarHBondContact O-N 2.9Å; H339-S386 PolarHBondContact CD2-OG 3.25Å; H339-S386 PolarHBondContact NE2-OG 3.47Å
340	Y	97	Very high	90.9	Very high	28 Å²	28	77.2 Å²	77.2	11%	0.11	41%	0.411	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.5	137.4	-177.9	-63.1	-79.8	0	0	0	112	F302 A326 I338 V356 S357 S358 L381 V382 A383	F302-Y340 HydrophobicContact CE1-CD1 4.36Å; F302-Y340 AromaticContact CE1-CE1 3.96Å; F302-Y340 HydrophobicContact CE1-CE1 3.96Å; F302-Y340 HydrophobicContact CZ-CD1 4.4Å; F302-Y340 HydrophobicContact CZ-CE1 4.27Å; A326-Y340 HydrophobicContact CB-CE1 4.15Å; A326-Y340 PolarHBondContact N-OH 2.71Å; A326-Y340 PolarHBondContact O-OH 2.66Å; I338-Y340 HydrophobicContact CG2-CD1 4.33Å; I338-Y340 HydrophobicContact CG2-CD2 4.32Å; I338-Y340 HydrophobicContact CG2-CE1 3.84Å; I338-Y340 HydrophobicContact CG2-CE2 3.81Å; Y340-V356 HydrophobicContact CG-CG2 4.33Å; Y340-S357 WeakPolarHBondContact CD2-O 3.33Å; Y340-S358 WeakPolarHBondContact CD2-O 3.44Å; Y340-S358 WeakPolarHBondContact CE2-O 3.46Å; Y340-L381 HydrophobicContact CD1-CD2 4.15Å; Y340-L381 HydrophobicContact CD1-CG 4.3Å; Y340-V382 CarbonylContact C-O 3.58Å; Y340-V382 WeakPolarHBondContact CA-O 3.27Å; Y340-A383 HydrophobicContact CD1-CB 4.12Å; Y340-A383 HydrophobicContact CE1-CB 3.94Å
341	L	94.8	Very high	90.5	Very high	92 Å²	92	78.2 Å²	78.2	48%	0.482	42%	0.416	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.8	127.2	178.5	176.8	64	0	0	0	111.1	V382 M384	L341-V382 HydrophobicContact CB-CB 4.34Å; L341-V382 PolarHBondContact N-O 3.49Å; L341-V382 PolarHBondContact O-N 3.15Å; L341-M384 HydrophobicContact CB-CE 3.96Å
342	I	95.7	Very high	90.3	Very high	33 Å²	33	79.9 Å²	79.9	17%	0.169	41%	0.414	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.9	121.6	170.9	-65.2	173.8	0	0	0	108.6	I351 F354 V356 F379 L381	I342-I351 HydrophobicContact CG2-CB 4.5Å; I342-F354 HydrophobicContact CD1-CB 4.18Å; I342-V356 HydrophobicContact CD1-CB 4.31Å; I342-V356 HydrophobicContact CD1-CG1 4.42Å; I342-V356 HydrophobicContact CG1-CB 4.35Å; I342-V356 HydrophobicContact CG1-CG1 4.08Å; I342-F379 HydrophobicContact CD1-CE2 4.33Å; I342-F379 HydrophobicContact CG1-CD2 4.37Å; I342-F379 HydrophobicContact CG1-CE2 4.02Å; I342-F379 HydrophobicContact CG2-CB 4.33Å; I342-F379 HydrophobicContact CG2-CD2 3.77Å; I342-F379 HydrophobicContact CG2-CE2 4.16Å; I342-F379 HydrophobicContact CG2-CG 4.06Å; I342-L381 HydrophobicContact CG1-CD1 4.12Å
343	K	94.1	Very high	90.3	Very high	116 Å²	116	78.6 Å²	78.6	50%	0.504	40%	0.404	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	132.3	176.4	-172.8	-178.1	179.3	-178.6	0	109.9	F379 Y380 V382	K343-F379 WeakPolarHBondContact O-CB 3.39Å; K343-Y380 PolarHBondContact N-O 3.04Å; K343-Y380 PolarHBondContact O-N 3.5Å; K343-V382 HydrophobicContact CB-CG2 4Å; K343-V382 HydrophobicContact CD-CG2 4.3Å
344	P	93.1	Very high	90.5	Very high	28 Å²	28	71.2 Å²	71.2	18%	0.182	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.6	158.6	177.1	33.7	-43	0	0	0	111.7	I346 Q349	P344-I346 WeakPolarHBondContact CB-O 3.5Å; P344-I346 WeakPolarHBondContact CG-O 3.32Å; P344-Q349 HydrophobicContact CB-CB 4.19Å; P344-Q349 VanDerWaalsContact CG-O 3.26Å; P344-Q349 WeakPolarHBondContact CG-O 3.37Å
345	Q	88.7	Confident	90.6	Very high	85 Å²	85	70.6 Å²	70.6	40%	0.397	36%	0.36	S	S	.	.	S	Bend	trans	-72.9	-33.4	166.1	-71.7	-168.6	-38.4	0	0	112.6	N378 Y380	Q345-N378 HydrophobicContact CG-CB 4.42Å; Q345-N378 VanDerWaalsContact OE1-CB 3.26Å; Q345-Y380 HydrophobicContact CB-CE2 4.34Å; Q345-Y380 HydrophobicContact CG-CD2 4.19Å; Q345-Y380 HydrophobicContact CG-CE2 3.83Å
346	I	86.4	Confident	90.7	Very high	111 Å²	111	71.3 Å²	71.3	57%	0.569	37%	0.365	S	S	*	.	S	Bend	trans	-101.6	124.5	179.3	-56.7	178.8	0	0	0	109.1	P344 G348 Q349	P344-I346 WeakPolarHBondContact CB-O 3.5Å; P344-I346 WeakPolarHBondContact CG-O 3.32Å; I346-G348 PolarHBondContact O-N 2.57Å; I346-Q349 HydrophobicContact CB-CB 4.31Å; I346-Q349 WeakPolarHBondContact O-CB 3.37Å; I346-Q349 PolarHBondContact O-N 2.98Å
347	E	79	Confident	90.7	Very high	186 Å²	186	70.3 Å²	70.3	87%	0.869	36%	0.363	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.4	131	-179	-169.5	160.6	-133.4	0	0	111.5	Q349	E347-Q349 VanDerWaalsContact C-N 3.35Å
348	G	74	Confident	90.5	Very high	76 Å²	76	68.5 Å²	68.5	78%	0.784	36%	0.362	S	S	*	.	T	Hydrogen-bonded Turn	trans	86.9	-12.2	-175.5	0	0	0	0	0	115.7	I346	I346-G348 PolarHBondContact O-N 2.57Å
349	Q	80.9	Confident	90.4	Very high	105 Å²	105	71.8 Å²	71.8	49%	0.491	38%	0.375	S	S	.	.			trans	-73.3	150	166.2	-171.1	172.9	-1.5	0	0	109.8	P344 I346 E347	P344-Q349 HydrophobicContact CB-CB 4.19Å; P344-Q349 VanDerWaalsContact CG-O 3.26Å; P344-Q349 WeakPolarHBondContact CG-O 3.37Å; I346-Q349 HydrophobicContact CB-CB 4.31Å; I346-Q349 WeakPolarHBondContact O-CB 3.37Å; I346-Q349 PolarHBondContact O-N 2.98Å; E347-Q349 VanDerWaalsContact C-N 3.35Å
350	V	80.8	Confident	90.4	Very high	91 Å²	91	68.1 Å²	68.1	55%	0.552	36%	0.358	S	S	*	.			trans	-127	135.2	173.4	-168.1	0	0	0	0	109.1	H352	V350-H352 WeakPolarHBondContact CG1-CE1 3.17Å
351	I	88.9	Confident	90.3	Very high	26 Å²	26	70.1 Å²	70.1	13%	0.133	37%	0.366	C	S	.	.			trans	-101.2	119.5	176.4	-62.5	170.8	0	0	0	106.5	I342 F354 F379	I342-I351 HydrophobicContact CG2-CB 4.5Å; I351-F354 HydrophobicContact CG2-CD2 3.9Å; I351-F379 HydrophobicContact CD1-CB 3.55Å; I351-F379 HydrophobicContact CD1-CD1 4.24Å; I351-F379 HydrophobicContact CD1-CG 4.23Å
352	H	89.8	Confident	90.5	Very high	91 Å²	91	65.7 Å²	65.7	42%	0.421	34%	0.343	S	S	.	.			trans	-115	-4.5	-176.7	-66.7	-59.5	0	0	0	112.8	V350 R366	V350-H352 WeakPolarHBondContact CG1-CE1 3.17Å; H352-R366 VanDerWaalsContact CB-CZ 3.41Å; H352-R366 WeakPolarHBondContact O-CD 3.46Å; H352-R366 WeakPolarHBondContact O-CG 3.37Å
353	E	93.8	Very high	90.5	Very high	31 Å²	31	66.9 Å²	66.9	15%	0.145	35%	0.346	C	S	.	.	S	Bend	trans	-82.1	-23.6	-171.7	-66.8	61.8	-130.3	0	0	111.2	A365 R366 L369 Y377	E353-A365 PolarHBondContact O-N 3.37Å; E353-R366 PolarHBondContact O-N 3.38Å; E353-L369 HydrophobicContact CB-CD2 3.98Å; E353-L369 HydrophobicContact CG-CD2 4.31Å; E353-Y377 HydrophobicContact CB-CE1 4.22Å; E353-Y377 HydrophobicContact CG-CE1 3.88Å
354	F	95.9	Very high	90.7	Very high	9 Å²	9	61.4 Å²	61.4	4%	0.039	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	155.3	-179.5	-48	-63.5	0	0	0	112.4	I321 I342 I351 I362 Y363 L369 Y377 F379 I399	I321-F354 HydrophobicContact CD1-CD1 3.38Å; I321-F354 HydrophobicContact CD1-CE1 3.5Å; I321-F354 HydrophobicContact CD1-CG 4.48Å; I342-F354 HydrophobicContact CD1-CB 4.18Å; I351-F354 HydrophobicContact CG2-CD2 3.9Å; F354-I362 HydrophobicContact CB-CG2 4.37Å; F354-Y363 CarbonylContact C-O 3.57Å; F354-Y363 VanDerWaalsContact CA-O 3.29Å; F354-Y363 WeakPolarHBondContact CA-O 3.26Å; F354-L369 HydrophobicContact CE1-CD1 4.31Å; F354-L369 HydrophobicContact CE1-CD2 4.1Å; F354-L369 HydrophobicContact CZ-CD2 4.07Å; F354-Y377 AromaticContact CE2-CD1 3.77Å; F354-Y377 HydrophobicContact CE2-CD1 3.77Å; F354-Y377 AromaticContact CE2-CD2 3.93Å; F354-Y377 HydrophobicContact CE2-CD2 3.93Å; F354-Y377 HydrophobicContact CE2-CE1 4.33Å; F354-Y377 HydrophobicContact CE2-CE2 4.5Å; F354-Y377 AromaticContact CE2-CG 3.54Å; F354-Y377 HydrophobicContact CE2-CG 3.54Å; F354-Y377 HydrophobicContact CZ-CD1 4.46Å; F354-Y377 AromaticContact CZ-CD2 3.89Å; F354-Y377 HydrophobicContact CZ-CD2 3.89Å; F354-Y377 HydrophobicContact CZ-CE2 4.27Å; F354-Y377 HydrophobicContact CZ-CG 4Å; F354-F379 AromaticContact CD2-CE1 3.96Å; F354-F379 HydrophobicContact CD2-CE1 3.96Å; F354-F379 HydrophobicContact CE2-CE1 4.47Å; F354-I399 HydrophobicContact CD1-CD1 4.03Å; F354-I399 HydrophobicContact CD2-CD1 3.98Å; F354-I399 HydrophobicContact CE1-CD1 3.98Å; F354-I399 HydrophobicContact CE1-CG2 4.4Å; F354-I399 HydrophobicContact CE2-CD1 3.94Å; F354-I399 HydrophobicContact CG-CD1 4.02Å; F354-I399 HydrophobicContact CZ-CB 4.39Å; F354-I399 HydrophobicContact CZ-CD1 3.95Å; F354-I399 HydrophobicContact CZ-CG2 4.12Å
355	R	95.5	Very high	90.7	Very high	94 Å²	94	61.4 Å²	61.4	36%	0.355	33%	0.325	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.4	148.2	170.4	63.9	-175.6	-169.2	141.7	9	110.1	N318 I362 Y363 A365	N318-R355 VanDerWaalsContact OD1-CZ 3.32Å; N318-R355 PolarHBondContact OD1-NH2 3.28Å; R355-I362 WeakPolarHBondContact O-CA 3.33Å; R355-Y363 PolarHBondContact N-O 3.16Å; R355-Y363 PolarHBondContact O-N 3.09Å; R355-A365 HydrophobicContact CB-CB 3.99Å; R355-A365 HydrophobicContact CG-CB 4Å
356	V	96.4	Very high	90.7	Very high	33 Å²	33	62.7 Å²	62.7	20%	0.2	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	149.2	172.8	67.9	0	0	0	0	110	Y340 I342 Y361 I362 L381	Y340-V356 HydrophobicContact CG-CG2 4.33Å; I342-V356 HydrophobicContact CD1-CB 4.31Å; I342-V356 HydrophobicContact CD1-CG1 4.42Å; I342-V356 HydrophobicContact CG1-CB 4.35Å; I342-V356 HydrophobicContact CG1-CG1 4.08Å; V356-Y361 CarbonylContact C-O 3.58Å; V356-Y361 WeakPolarHBondContact CA-O 3.13Å; V356-I362 HydrophobicContact CB-CG1 4.32Å; V356-I362 HydrophobicContact CG2-CG1 3.99Å; V356-L381 HydrophobicContact CB-CD1 4.26Å; V356-L381 HydrophobicContact CG1-CD1 4.1Å; V356-L381 HydrophobicContact CG2-CD1 4.12Å
357	S	94.8	Very high	90.1	Very high	34 Å²	34	59.5 Å²	59.5	24%	0.238	32%	0.32	C	S	.	.			trans	-96.1	169.3	174.6	62	0	0	0	0	112	Y340 K359 G360 Y361	Y340-S357 WeakPolarHBondContact CD2-O 3.33Å; S357-K359 PolarHBondContact O-N 3.43Å; S357-G360 PolarHBondContact O-N 3.41Å; S357-G360 VanDerWaalsContact O-N 3.14Å; S357-Y361 PolarHBondContact N-O 2.99Å; S357-Y361 WeakPolarHBondContact OG-CB 3.12Å; S357-Y361 PolarHBondContact OG-N 2.9Å; S357-Y361 PolarHBondContact OG-O 3.2Å
358	S	91	Very high	90.5	Very high	70 Å²	70	54.7 Å²	54.7	49%	0.49	30%	0.301	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58	-25	172.1	45	0	0	0	0	113.9	Y340	Y340-S358 WeakPolarHBondContact CD2-O 3.44Å; Y340-S358 WeakPolarHBondContact CE2-O 3.46Å
359	K	92.2	Very high	91.5	Very high	91 Å²	91	51.7 Å²	51.7	40%	0.396	27%	0.267	S	S	.	.	T	Hydrogen-bonded Turn	trans	-99.3	18.6	178	-57.2	-179.6	-170	166.8	0	113.7	Q323 S357 Y361 D840	Q323-K359 PolarHBondContact NE2-O 3.18Å; S357-K359 PolarHBondContact O-N 3.43Å; K359-Y361 VanDerWaalsContact C-N 3.27Å; K359-Y361 HydrophobicContact CB-CD2 3.87Å; K359-Y361 HydrophobicContact CB-CE2 3.8Å; K359-Y361 HydrophobicContact CD-CE2 4.41Å; K359-Y361 PolarHBondContact O-N 2.8Å; K359-D840 WeakPolarHBondContact CD-OD2 3.25Å; K359-D840 WeakPolarHBondContact CE-OD1 3.21Å; K359-D840 WeakPolarHBondContact CE-OD2 3.45Å; K359-D840 IonicContact NZ-OD1 2.68Å; K359-D840 PolarHBondContact NZ-OD1 3.18Å; K359-D840 IonicContact NZ-OD2 2.72Å; K359-D840 PolarHBondContact NZ-OD2 3.49Å
360	G	94.6	Very high	92.2	Very high	0 Å²	0	49.3 Å²	49.3	0%	0	26%	0.257	C	S	.	.	S	Bend	trans	77.4	-2.3	175.1	0	0	0	0	0	116.3	I324 S357 I362	I324-G360 PolarHBondContact N-O 3.37Å; I324-G360 WeakPolarHBondContact O-CA 3.31Å; S357-G360 PolarHBondContact O-N 3.41Å; S357-G360 VanDerWaalsContact O-N 3.14Å; G360-I362 PolarHBondContact O-N 3Å
361	Y	96.7	Very high	93	Very high	70 Å²	70	46.1 Å²	46.1	28%	0.275	24%	0.235	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.3	130.5	173.3	-58.9	-78.3	0	0	0	111.1	L320 G322 Q323 V356 S357 K359	L320-Y361 HydrophobicContact CD1-CD1 3.93Å; L320-Y361 HydrophobicContact CD1-CG 4.33Å; G322-Y361 WeakPolarHBondContact O-CA 3.16Å; Q323-Y361 HydrophobicContact CB-CD1 3.65Å; Q323-Y361 HydrophobicContact CB-CE1 3.86Å; Q323-Y361 HydrophobicContact CB-CG 4.45Å; Q323-Y361 VanDerWaalsContact CD-CE1 3.45Å; Q323-Y361 HydrophobicContact CG-CD1 3.64Å; Q323-Y361 HydrophobicContact CG-CE1 3.72Å; Q323-Y361 HydrophobicContact CG-CG 4.08Å; Q323-Y361 VanDerWaalsContact OE1-CE1 3.29Å; V356-Y361 CarbonylContact C-O 3.58Å; V356-Y361 WeakPolarHBondContact CA-O 3.13Å; S357-Y361 PolarHBondContact N-O 2.99Å; S357-Y361 WeakPolarHBondContact OG-CB 3.12Å; S357-Y361 PolarHBondContact OG-N 2.9Å; S357-Y361 PolarHBondContact OG-O 3.2Å; K359-Y361 VanDerWaalsContact C-N 3.27Å; K359-Y361 HydrophobicContact CB-CD2 3.87Å; K359-Y361 HydrophobicContact CB-CE2 3.8Å; K359-Y361 HydrophobicContact CD-CE2 4.41Å; K359-Y361 PolarHBondContact O-N 2.8Å
362	I	97.3	Very high	93.3	Very high	0 Å²	0	47.7 Å²	47.7	0%	0	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	128.6	179.1	-60.3	177.5	0	0	0	109.6	L309 I321 G322 I324 F354 R355 V356 G360 F379 L381 V397 I399	L309-I362 HydrophobicContact CD1-CD1 4.26Å; I321-I362 HydrophobicContact CD1-CG2 4.39Å; I321-I362 PolarHBondContact N-O 3.17Å; G322-I362 PolarHBondContact O-N 3Å; I324-I362 HydrophobicContact CD1-CD1 3.73Å; I324-I362 HydrophobicContact CG1-CD1 4.16Å; F354-I362 HydrophobicContact CB-CG2 4.37Å; R355-I362 WeakPolarHBondContact O-CA 3.33Å; V356-I362 HydrophobicContact CB-CG1 4.32Å; V356-I362 HydrophobicContact CG2-CG1 3.99Å; G360-I362 PolarHBondContact O-N 3Å; I362-F379 HydrophobicContact CD1-CZ 4.42Å; I362-L381 HydrophobicContact CD1-CD2 4.48Å; I362-V397 HydrophobicContact CD1-CG1 4.48Å; I362-I399 HydrophobicContact CG2-CD1 4.47Å
363	Y	97.1	Very high	93.5	Very high	58 Å²	58	50.1 Å²	50.1	23%	0.227	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	152.8	-177.4	-58.6	-90.3	0	0	0	112.3	N318 H319 L320 F354 R355 A365	N318-Y363 WeakPolarHBondContact O-CD1 3.36Å; H319-Y363 CarbonylContact O-C 3.58Å; H319-Y363 VanDerWaalsContact O-CA 3.26Å; H319-Y363 WeakPolarHBondContact O-CA 3.38Å; L320-Y363 HydrophobicContact CB-CD1 4.04Å; L320-Y363 HydrophobicContact CB-CE1 3.89Å; L320-Y363 HydrophobicContact CD1-CD1 4.12Å; L320-Y363 HydrophobicContact CD1-CE1 3.72Å; L320-Y363 HydrophobicContact CG-CE1 4.36Å; F354-Y363 CarbonylContact C-O 3.57Å; F354-Y363 VanDerWaalsContact CA-O 3.29Å; F354-Y363 WeakPolarHBondContact CA-O 3.26Å; R355-Y363 PolarHBondContact N-O 3.16Å; R355-Y363 PolarHBondContact O-N 3.09Å; Y363-A365 PolarHBondContact O-N 2.9Å
364	V	96.9	Very high	93.5	Very high	0 Å²	0	51.9 Å²	51.9	0%	0	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.2	117	162.5	-179.5	0	0	0	0	109.2	V311 A315 N318 H319 I321 R366 L369	V311-V364 HydrophobicContact CG2-CG2 3.97Å; A315-V364 HydrophobicContact CB-CG2 4.04Å; N318-V364 PolarHBondContact N-O 3.08Å; H319-V364 HydrophobicContact CB-CB 4.37Å; H319-V364 HydrophobicContact CB-CG2 4.04Å; H319-V364 PolarHBondContact O-N 3.17Å; I321-V364 HydrophobicContact CD1-CG2 3.87Å; I321-V364 HydrophobicContact CG1-CG2 4.07Å; V364-R366 VanDerWaalsContact CG1-O 3.27Å; V364-R366 WeakPolarHBondContact CG1-O 3.35Å; V364-L369 HydrophobicContact CG1-CD1 4.2Å; V364-L369 HydrophobicContact CG2-CD1 3.97Å
365	A	94.5	Very high	93.4	Very high	29 Å²	29	54.4 Å²	54.4	24%	0.24	28%	0.28	C	S	.	.	S	Bend	trans	-90.8	-25.8	177.3	0	0	0	0	0	112.6	E353 R355 Y363	E353-A365 PolarHBondContact O-N 3.37Å; R355-A365 HydrophobicContact CB-CB 3.99Å; R355-A365 HydrophobicContact CG-CB 4Å; Y363-A365 PolarHBondContact O-N 2.9Å
366	R	88.3	Confident	93.4	Very high	112 Å²	112	51.6 Å²	51.6	42%	0.423	28%	0.276	S	S	.	.	S	Bend	trans	-135.6	121	175.1	-67.8	179.7	175.6	177.1	1.5	110.5	H352 E353 V364 N368	H352-R366 VanDerWaalsContact CB-CZ 3.41Å; H352-R366 WeakPolarHBondContact O-CD 3.46Å; H352-R366 WeakPolarHBondContact O-CG 3.37Å; E353-R366 PolarHBondContact O-N 3.38Å; V364-R366 VanDerWaalsContact CG1-O 3.27Å; V364-R366 WeakPolarHBondContact CG1-O 3.35Å; R366-N368 WeakPolarHBondContact CB-OD1 3.43Å; R366-N368 PolarHBondContact O-N 3.49Å
367	G	74.6	Confident	93.3	Very high	44 Å²	44	51.1 Å²	51.1	45%	0.454	27%	0.271	S	S	.	.	S	Bend	trans	-81.7	60	178	0	0	0	0	0	111.5
368	N	87.5	Confident	93.3	Very high	85 Å²	85	52.1 Å²	52.1	46%	0.455	27%	0.274	S	S	.	.			trans	-140.1	36.7	171.7	69.5	-100.8	0	0	0	110.2	R366	R366-N368 WeakPolarHBondContact CB-OD1 3.43Å; R366-N368 PolarHBondContact O-N 3.49Å
369	L	94.8	Very high	93.6	Very high	13 Å²	13	48.8 Å²	48.8	7%	0.068	25%	0.25	C	S	.	.			trans	-64.1	147.5	165.1	-56.5	177.4	0	0	0	108	V311 E313 E353 F354 V364 Y377 L401	V311-L369 HydrophobicContact CG1-CD1 3.96Å; V311-L369 HydrophobicContact CG2-CD1 4.45Å; E313-L369 HydrophobicContact CB-CB 4.25Å; E353-L369 HydrophobicContact CB-CD2 3.98Å; E353-L369 HydrophobicContact CG-CD2 4.31Å; F354-L369 HydrophobicContact CE1-CD1 4.31Å; F354-L369 HydrophobicContact CE1-CD2 4.1Å; F354-L369 HydrophobicContact CZ-CD2 4.07Å; V364-L369 HydrophobicContact CG1-CD1 4.2Å; V364-L369 HydrophobicContact CG2-CD1 3.97Å; L369-Y377 HydrophobicContact CD2-CE2 4.31Å; L369-L401 HydrophobicContact CB-CD1 3.9Å; L369-L401 HydrophobicContact CB-CD2 4.24Å; L369-L401 HydrophobicContact CD1-CD2 3.97Å; L369-L401 HydrophobicContact CD2-CD2 4.33Å; L369-L401 HydrophobicContact CG-CD2 4.41Å
370	D	95.3	Very high	93.8	Very high	54 Å²	54	48.6 Å²	48.6	29%	0.289	25%	0.248	S	C	.	.			trans	-168.4	99.1	-157.3	166.4	-11.6	0	0	0	105.2	K373 I374	D370-K373 HydrophobicContact CB-CB 4.4Å; D370-K373 HydrophobicContact CB-CD 4.47Å; D370-K373 VanDerWaalsContact CG-CB 3.42Å; D370-K373 WeakPolarHBondContact OD1-CB 3.36Å; D370-K373 PolarHBondContact OD1-N 3.47Å; D370-K373 VanDerWaalsContact OD1-N 3.17Å; D370-K373 WeakPolarHBondContact OD2-CD 3.45Å; D370-K373 IonicContact OD2-NZ 2.86Å; D370-I374 PolarHBondContact O-N 3.07Å
371	R	96.5	Very high	93.9	Very high	25 Å²	25	48.6 Å²	48.6	9%	0.094	25%	0.248	C	C	.	.	H	α-helix	trans	-77.5	-34.8	-167.9	-176.2	-144.5	63.4	109.4	3.3	111.2	E313 K373 I374 S375 L401 D403 L441 E443	E313-R371 WeakPolarHBondContact OE2-CB 2.94Å; E313-R371 PolarHBondContact OE2-N 2.82Å; R371-K373 PolarHBondContact O-N 2.98Å; R371-I374 CarbonylContact O-C 3.46Å; R371-I374 PolarHBondContact O-N 3.15Å; R371-S375 WeakPolarHBondContact O-CA 3.48Å; R371-S375 PolarHBondContact O-N 3.16Å; R371-L401 HydrophobicContact CB-CB 4.05Å; R371-L401 HydrophobicContact CB-CD1 4.29Å; R371-L401 HydrophobicContact CG-CB 4.06Å; R371-D403 IonicContact CZ-OD1 3.12Å; R371-D403 IonicContact NE-OD1 3.67Å; R371-D403 PolarHBondContact NE-OD1 2.79Å; R371-D403 IonicContact NH1-OD1 2.73Å; R371-D403 IonicContact NH2-OD1 3.61Å; R371-L441 PolarHBondContact NH2-O 3.43Å; R371-E443 IonicContact CZ-OE2 3.52Å; R371-E443 IonicContact NH1-OE2 3.51Å; R371-E443 PolarHBondContact NH1-OE2 2.92Å
372	E	95.6	Very high	93.9	Very high	58 Å²	58	46.3 Å²	46.3	27%	0.271	24%	0.241	S	C	.	.	H	α-helix	trans	-61.3	-28.1	177.2	-65.2	59.7	-110.3	0	0	110.6	L441	E372-L441 HydrophobicContact CB-CB 4.47Å; E372-L441 HydrophobicContact CG-CB 3.59Å
373	K	94.1	Very high	93.9	Very high	143 Å²	143	46.3 Å²	46.3	62%	0.622	24%	0.241	S	C	*	.	H	α-helix	trans	-95.1	-42.5	175.5	-174.6	-171.9	172.9	-172.5	0	114.1	D370 R371	D370-K373 HydrophobicContact CB-CB 4.4Å; D370-K373 HydrophobicContact CB-CD 4.47Å; D370-K373 VanDerWaalsContact CG-CB 3.42Å; D370-K373 WeakPolarHBondContact OD1-CB 3.36Å; D370-K373 PolarHBondContact OD1-N 3.47Å; D370-K373 VanDerWaalsContact OD1-N 3.17Å; D370-K373 WeakPolarHBondContact OD2-CD 3.45Å; D370-K373 IonicContact OD2-NZ 2.86Å; R371-K373 PolarHBondContact O-N 2.98Å
374	I	93.3	Very high	93.8	Very high	68 Å²	68	46.2 Å²	46.2	35%	0.349	24%	0.244	S	C	.	.	H	α-helix	trans	-144	84.1	178.5	-49.1	-177.9	0	0	0	110.8	D370 R371 A376 Y377 L401	D370-I374 PolarHBondContact O-N 3.07Å; R371-I374 CarbonylContact O-C 3.46Å; R371-I374 PolarHBondContact O-N 3.15Å; I374-A376 WeakPolarHBondContact CG2-O 3.15Å; I374-A376 PolarHBondContact O-N 3.45Å; I374-Y377 HydrophobicContact CB-CE2 4.02Å; I374-Y377 HydrophobicContact CD1-CE1 4.25Å; I374-Y377 HydrophobicContact CG2-CD1 4.36Å; I374-Y377 HydrophobicContact CG2-CD2 4.01Å; I374-Y377 HydrophobicContact CG2-CE1 4.04Å; I374-Y377 HydrophobicContact CG2-CE2 3.64Å; I374-Y377 HydrophobicContact CG2-CG 4.35Å; I374-L401 VanDerWaalsContact O-CD1 3.24Å; I374-L401 WeakPolarHBondContact O-CD1 3.02Å
375	S	94.8	Very high	93.8	Very high	62 Å²	62	46.4 Å²	46.4	43%	0.434	24%	0.244	S	C	.	.	S	Bend	trans	-64.1	-20.9	-179.3	59.3	0	0	0	0	115.3	R371 L401	R371-S375 WeakPolarHBondContact O-CA 3.48Å; R371-S375 PolarHBondContact O-N 3.16Å; S375-L401 PolarHBondContact O-N 2.91Å
376	A	95.2	Very high	93.9	Very high	34 Å²	34	46.7 Å²	46.7	28%	0.281	25%	0.245	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.2	147.8	176.9	0	0	0	0	0	114	I374 I399	I374-A376 WeakPolarHBondContact CG2-O 3.15Å; I374-A376 PolarHBondContact O-N 3.45Å; A376-I399 CarbonylContact C-O 3.36Å; A376-I399 VanDerWaalsContact CA-O 3.29Å; A376-I399 WeakPolarHBondContact CA-O 3.3Å
377	Y	94.5	Very high	94.1	Very high	24 Å²	24	41.3 Å²	41.3	9%	0.094	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	133.3	177.9	-67.2	-104.6	0	0	0	110.6	E353 F354 L369 I374 H398 I399 L401	E353-Y377 HydrophobicContact CB-CE1 4.22Å; E353-Y377 HydrophobicContact CG-CE1 3.88Å; F354-Y377 AromaticContact CE2-CD1 3.77Å; F354-Y377 HydrophobicContact CE2-CD1 3.77Å; F354-Y377 AromaticContact CE2-CD2 3.93Å; F354-Y377 HydrophobicContact CE2-CD2 3.93Å; F354-Y377 HydrophobicContact CE2-CE1 4.33Å; F354-Y377 HydrophobicContact CE2-CE2 4.5Å; F354-Y377 AromaticContact CE2-CG 3.54Å; F354-Y377 HydrophobicContact CE2-CG 3.54Å; F354-Y377 HydrophobicContact CZ-CD1 4.46Å; F354-Y377 AromaticContact CZ-CD2 3.89Å; F354-Y377 HydrophobicContact CZ-CD2 3.89Å; F354-Y377 HydrophobicContact CZ-CE2 4.27Å; F354-Y377 HydrophobicContact CZ-CG 4Å; L369-Y377 HydrophobicContact CD2-CE2 4.31Å; I374-Y377 HydrophobicContact CB-CE2 4.02Å; I374-Y377 HydrophobicContact CD1-CE1 4.25Å; I374-Y377 HydrophobicContact CG2-CD1 4.36Å; I374-Y377 HydrophobicContact CG2-CD2 4.01Å; I374-Y377 HydrophobicContact CG2-CE1 4.04Å; I374-Y377 HydrophobicContact CG2-CE2 3.64Å; I374-Y377 HydrophobicContact CG2-CG 4.35Å; Y377-H398 WeakPolarHBondContact O-CA 3.37Å; Y377-I399 PolarHBondContact N-O 2.81Å; Y377-I399 PolarHBondContact O-N 3.38Å; Y377-L401 HydrophobicContact CD2-CD2 4.48Å; Y377-L401 HydrophobicContact CE2-CD1 4.15Å; Y377-L401 HydrophobicContact CE2-CD2 4.3Å; Y377-L401 HydrophobicContact CE2-CG 4.22Å
378	N	95.2	Very high	95.1	Very high	54 Å²	54	46.8 Å²	46.8	29%	0.289	24%	0.242	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-122	130.8	175.6	-78.6	-85.7	0	0	0	110.5	Q345 Q396 V397 H398	Q345-N378 HydrophobicContact CG-CB 4.42Å; Q345-N378 VanDerWaalsContact OE1-CB 3.26Å; N378-Q396 PolarHBondContact OD1-NE2 2.94Å; N378-V397 WeakPolarHBondContact CA-O 3.38Å; N378-H398 VanDerWaalsContact CG-CD2 3.48Å; N378-H398 PolarHBondContact ND2-CD2 2.87Å; N378-H398 PolarHBondContact ND2-NE2 3.22Å; N378-H398 PolarHBondContact OD1-CD2 2.73Å; N378-H398 VanDerWaalsContact OD1-CD2 3.26Å
379	F	96	Very high	95.4	Very high	0 Å²	0	47 Å²	47	0%	0	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.7	170	177.8	58.4	-94.2	0	0	0	112.1	I342 K343 I351 F354 I362 V397 I399	I342-F379 HydrophobicContact CD1-CE2 4.33Å; I342-F379 HydrophobicContact CG1-CD2 4.37Å; I342-F379 HydrophobicContact CG1-CE2 4.02Å; I342-F379 HydrophobicContact CG2-CB 4.33Å; I342-F379 HydrophobicContact CG2-CD2 3.77Å; I342-F379 HydrophobicContact CG2-CE2 4.16Å; I342-F379 HydrophobicContact CG2-CG 4.06Å; K343-F379 WeakPolarHBondContact O-CB 3.39Å; I351-F379 HydrophobicContact CD1-CB 3.55Å; I351-F379 HydrophobicContact CD1-CD1 4.24Å; I351-F379 HydrophobicContact CD1-CG 4.23Å; F354-F379 AromaticContact CD2-CE1 3.96Å; F354-F379 HydrophobicContact CD2-CE1 3.96Å; F354-F379 HydrophobicContact CE2-CE1 4.47Å; I362-F379 HydrophobicContact CD1-CZ 4.42Å; F379-V397 HydrophobicContact CD2-CB 3.89Å; F379-V397 HydrophobicContact CD2-CG2 4.17Å; F379-V397 HydrophobicContact CE1-CB 4.25Å; F379-V397 HydrophobicContact CE1-CG1 4.14Å; F379-V397 HydrophobicContact CE2-CB 3.57Å; F379-V397 HydrophobicContact CE2-CG1 3.94Å; F379-V397 HydrophobicContact CE2-CG2 3.77Å; F379-V397 HydrophobicContact CG-CB 4.36Å; F379-V397 HydrophobicContact CZ-CB 3.77Å; F379-V397 HydrophobicContact CZ-CG1 3.64Å; F379-V397 HydrophobicContact CZ-CG2 4.35Å; F379-V397 PolarHBondContact N-O 3.25Å; F379-V397 PolarHBondContact O-N 3.09Å; F379-I399 HydrophobicContact CE1-CD1 3.64Å; F379-I399 HydrophobicContact CE1-CG1 3.95Å; F379-I399 HydrophobicContact CZ-CD1 3.91Å; F379-I399 HydrophobicContact CZ-CG1 4.41Å
380	Y	96.3	Very high	95.5	Very high	87 Å²	87	50 Å²	50	34%	0.341	27%	0.268	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.8	130.4	167.4	-63.6	-69.4	0	0	0	109.1	K343 Q345 T395 Q396	K343-Y380 PolarHBondContact N-O 3.04Å; K343-Y380 PolarHBondContact O-N 3.5Å; Q345-Y380 HydrophobicContact CB-CE2 4.34Å; Q345-Y380 HydrophobicContact CG-CD2 4.19Å; Q345-Y380 HydrophobicContact CG-CE2 3.83Å; Y380-T395 CarbonylContact C-O 3.48Å; Y380-T395 VanDerWaalsContact CA-O 3.32Å; Y380-T395 WeakPolarHBondContact CA-O 3.24Å; Y380-Q396 HydrophobicContact CD1-CB 4.35Å; Y380-Q396 HydrophobicContact CE1-CB 4.29Å
381	L	96.9	Very high	95.6	Very high	0 Å²	0	49.6 Å²	49.6	0%	0	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.1	116.6	164.3	-173.6	68.3	0	0	0	107.4	F302 I324 Y340 I342 V356 I362 S394 T395 V397	F302-L381 HydrophobicContact CE1-CD2 3.94Å; F302-L381 HydrophobicContact CE1-CG 4.35Å; F302-L381 HydrophobicContact CZ-CD2 4.3Å; F302-L381 HydrophobicContact CZ-CG 4.21Å; F302-L381 WeakPolarHBondContact CZ-O 3.48Å; I324-L381 HydrophobicContact CB-CD2 3.76Å; I324-L381 HydrophobicContact CD1-CD2 4.34Å; I324-L381 HydrophobicContact CG2-CD2 3.7Å; Y340-L381 HydrophobicContact CD1-CD2 4.15Å; Y340-L381 HydrophobicContact CD1-CG 4.3Å; I342-L381 HydrophobicContact CG1-CD1 4.12Å; V356-L381 HydrophobicContact CB-CD1 4.26Å; V356-L381 HydrophobicContact CG1-CD1 4.1Å; V356-L381 HydrophobicContact CG2-CD1 4.12Å; I362-L381 HydrophobicContact CD1-CD2 4.48Å; L381-S394 CarbonylContact O-C 3.5Å; L381-S394 VanDerWaalsContact O-CA 3.26Å; L381-S394 WeakPolarHBondContact O-CA 3.3Å; L381-T395 HydrophobicContact CB-CG2 4.04Å; L381-T395 PolarHBondContact N-O 2.95Å; L381-T395 PolarHBondContact O-N 3.48Å; L381-V397 HydrophobicContact CB-CG2 3.73Å
382	V	96.7	Very high	95.6	Very high	22 Å²	22	51.8 Å²	51.8	13%	0.133	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.7	130.5	175.5	-178.5	0	0	0	0	108	Y340 L341 K343 S393	Y340-V382 CarbonylContact C-O 3.58Å; Y340-V382 WeakPolarHBondContact CA-O 3.27Å; L341-V382 HydrophobicContact CB-CB 4.34Å; L341-V382 PolarHBondContact N-O 3.49Å; L341-V382 PolarHBondContact O-N 3.15Å; K343-V382 HydrophobicContact CB-CG2 4Å; K343-V382 HydrophobicContact CD-CG2 4.3Å; V382-S393 VanDerWaalsContact CA-O 3.31Å; V382-S393 WeakPolarHBondContact CA-O 3.49Å; V382-S393 WeakPolarHBondContact CG1-O 3.25Å
383	A	97.6	Very high	95.7	Very high	0 Å²	0	50.4 Å²	50.4	0%	0	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	134	163.7	0	0	0	0	0	107.8	P300 F302 A326 I338 Y340 S392 S393	P300-A383 HydrophobicContact CB-CB 3.75Å; F302-A383 HydrophobicContact CE1-CB 4.25Å; F302-A383 HydrophobicContact CE2-CB 3.62Å; F302-A383 HydrophobicContact CZ-CB 3.42Å; F302-A383 VanDerWaalsContact CZ-CB 3.42Å; A326-A383 HydrophobicContact CB-CB 3.76Å; I338-A383 HydrophobicContact CG2-CB 3.83Å; Y340-A383 HydrophobicContact CD1-CB 4.12Å; Y340-A383 HydrophobicContact CE1-CB 3.94Å; A383-S392 CarbonylContact O-C 3.56Å; A383-S392 WeakPolarHBondContact O-CA 3.21Å; A383-S392 WeakPolarHBondContact O-CB 3.09Å; A383-S393 PolarHBondContact N-O 2.89Å; A383-S393 PolarHBondContact O-N 2.84Å
384	M	96.4	Very high	95.8	Very high	57 Å²	57	47.2 Å²	47.2	28%	0.281	28%	0.277	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135	144.6	175.5	63	-157.4	153.9	0	0	108.9	I338 H339 L341 T390 L391	I338-M384 CarbonylContact C-O 3.4Å; I338-M384 WeakPolarHBondContact CA-O 3.26Å; H339-M384 HydrophobicContact CB-CE 3.87Å; H339-M384 HydrophobicContact CB-CG 4.11Å; H339-M384 PolarHBondContact N-O 2.85Å; H339-M384 PolarHBondContact O-N 2.9Å; L341-M384 HydrophobicContact CB-CE 3.96Å; M384-T390 HydrophobicContact CB-CG2 4.34Å; M384-L391 VanDerWaalsContact CA-O 3.3Å; M384-L391 WeakPolarHBondContact CA-O 3.19Å
385	D	96.6	Very high	96	Very high	3 Å²	3	44 Å²	44	2%	0.016	26%	0.261	C	S	.	.			trans	-75.3	-169.9	174.2	61.4	58.8	0	0	0	112.4	N296 P300 N335 Q337 G387 T390 L391	N296-D385 PolarHBondContact ND2-OD1 3.5Å; N296-D385 PolarHBondContact ND2-OD2 2.87Å; P300-D385 HydrophobicContact CG-CB 4.34Å; N335-D385 WeakPolarHBondContact O-CB 3.19Å; Q337-D385 CarbonylContact O-C 3.57Å; Q337-D385 VanDerWaalsContact O-C 3.32Å; Q337-D385 WeakPolarHBondContact O-CA 3.5Å; D385-G387 WeakPolarHBondContact OD1-CA 3.24Å; D385-G387 PolarHBondContact OD1-N 3.31Å; D385-T390 WeakPolarHBondContact O-CG2 3.09Å; D385-T390 VanDerWaalsContact OD1-CA 3.3Å; D385-T390 WeakPolarHBondContact OD1-CA 3.25Å; D385-T390 VanDerWaalsContact OD1-CG2 3.3Å; D385-T390 WeakPolarHBondContact OD1-CG2 3.07Å; D385-L391 PolarHBondContact N-O 2.77Å; D385-L391 VanDerWaalsContact N-O 3.16Å; D385-L391 PolarHBondContact OD1-N 3.4Å; D385-L391 WeakPolarHBondContact OD2-CA 3.15Å; D385-L391 WeakPolarHBondContact OD2-CB 3.2Å; D385-L391 PolarHBondContact OD2-N 2.73Å
386	S	95.1	Very high	96.1	Very high	35 Å²	35	43.8 Å²	43.8	25%	0.245	25%	0.253	C	S	.	.	S	Bend	trans	-115.1	12.1	170.8	-54.5	0	0	0	0	113	I334 Q337 H339	I334-S386 VanDerWaalsContact CG2-O 3.25Å; I334-S386 WeakPolarHBondContact CG2-O 3.25Å; I334-S386 CarbonylContact O-C 3.58Å; I334-S386 VanDerWaalsContact O-CA 3.32Å; I334-S386 WeakPolarHBondContact O-CA 3.43Å; I334-S386 VanDerWaalsContact O-CB 3.24Å; I334-S386 WeakPolarHBondContact O-CB 3.21Å; I334-S386 PolarHBondContact O-N 2.87Å; Q337-S386 PolarHBondContact O-N 2.99Å; Q337-S386 VanDerWaalsContact O-N 3.16Å; Q337-S386 PolarHBondContact O-OG 2.77Å; H339-S386 PolarHBondContact CD2-OG 3.25Å; H339-S386 PolarHBondContact NE2-OG 3.47Å
387	G	94.3	Very high	96.2	Very high	0 Å²	0	42.2 Å²	42.2	0%	0	24%	0.239	C	C	.	.	S	Bend	trans	-78.6	177.7	-177.1	0	0	0	0	0	114.4	I334 D385 P389 T390	I334-G387 PolarHBondContact O-N 2.9Å; D385-G387 WeakPolarHBondContact OD1-CA 3.24Å; D385-G387 PolarHBondContact OD1-N 3.31Å; G387-P389 CarbonylContact C-O 3.55Å; G387-P389 CarbonylContact O-C 3.5Å; G387-T390 WeakPolarHBondContact O-CA 3.32Å; G387-T390 PolarHBondContact O-N 3.18Å; G387-T390 PolarHBondContact O-OG1 3.3Å
388	L	93.8	Very high	96.4	Very high	158 Å²	158	43.5 Å²	43.5	83%	0.827	25%	0.246	S	C	*	.	S	Bend	trans	-137.1	108.1	-178.5	-70.4	176.8	0	0	0	111.2
389	P	95	Very high	96.4	Very high	91 Å²	91	40.9 Å²	40.9	59%	0.591	23%	0.232	S	C	*	.	S	Bend	cis	-63.9	152.3	-0.1	31.1	-36.8	0	0	0	111.9	N296 G387 L391	N296-P389 PolarHBondContact ND2-O 2.72Å; G387-P389 CarbonylContact C-O 3.55Å; G387-P389 CarbonylContact O-C 3.5Å; P389-L391 HydrophobicContact CG-CD2 4.45Å
390	T	96.5	Very high	96.5	Very high	76 Å²	76	44 Å²	44	47%	0.466	25%	0.247	S	C	.	.			trans	-78.9	125.6	174.2	-45.3	0	0	0	0	109.4	M384 D385 G387	M384-T390 HydrophobicContact CB-CG2 4.34Å; D385-T390 WeakPolarHBondContact O-CG2 3.09Å; D385-T390 VanDerWaalsContact OD1-CA 3.3Å; D385-T390 WeakPolarHBondContact OD1-CA 3.25Å; D385-T390 VanDerWaalsContact OD1-CG2 3.3Å; D385-T390 WeakPolarHBondContact OD1-CG2 3.07Å; G387-T390 WeakPolarHBondContact O-CA 3.32Å; G387-T390 PolarHBondContact O-N 3.18Å; G387-T390 PolarHBondContact O-OG1 3.3Å
391	L	97.1	Very high	96.5	Very high	44 Å²	44	39.9 Å²	39.9	23%	0.23	23%	0.23	C	C	.	.			trans	-105.4	162	177.7	-52.7	174.7	0	0	0	109.7	C298 V299 M384 D385 P389	C298-L391 WeakPolarHBondContact O-CD1 3.24Å; V299-L391 HydrophobicContact CG1-CB 4.04Å; V299-L391 HydrophobicContact CG1-CD1 4.36Å; M384-L391 VanDerWaalsContact CA-O 3.3Å; M384-L391 WeakPolarHBondContact CA-O 3.19Å; D385-L391 PolarHBondContact N-O 2.77Å; D385-L391 VanDerWaalsContact N-O 3.16Å; D385-L391 PolarHBondContact OD1-N 3.4Å; D385-L391 WeakPolarHBondContact OD2-CA 3.15Å; D385-L391 WeakPolarHBondContact OD2-CB 3.2Å; D385-L391 PolarHBondContact OD2-N 2.73Å; P389-L391 HydrophobicContact CG-CD2 4.45Å
392	S	97	Very high	96.5	Very high	71 Å²	71	43.2 Å²	43.2	50%	0.497	25%	0.248	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-163	155.8	-173.2	55	0	0	0	0	113.3	A383	A383-S392 CarbonylContact O-C 3.56Å; A383-S392 WeakPolarHBondContact O-CA 3.21Å; A383-S392 WeakPolarHBondContact O-CB 3.09Å
393	S	97.6	Very high	96.5	Very high	30 Å²	30	43.6 Å²	43.6	21%	0.21	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.6	175.6	170.7	85.1	0	0	0	0	111	P300 F302 V382 A383	P300-S393 WeakPolarHBondContact O-CB 3.48Å; P300-S393 PolarHBondContact O-OG 3.3Å; F302-S393 WeakPolarHBondContact CD2-OG 3.48Å; F302-S393 WeakPolarHBondContact CE2-OG 3.45Å; V382-S393 VanDerWaalsContact CA-O 3.31Å; V382-S393 WeakPolarHBondContact CA-O 3.49Å; V382-S393 WeakPolarHBondContact CG1-O 3.25Å; A383-S393 PolarHBondContact N-O 2.89Å; A383-S393 PolarHBondContact O-N 2.84Å
394	S	96.8	Very high	96.5	Very high	75 Å²	75	45.5 Å²	45.5	52%	0.524	26%	0.26	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.2	135.9	177.4	64.1	0	0	0	0	113.2	L381	L381-S394 CarbonylContact O-C 3.5Å; L381-S394 VanDerWaalsContact O-CA 3.26Å; L381-S394 WeakPolarHBondContact O-CA 3.3Å
395	T	97.4	Very high	96.4	Very high	2 Å²	2	43.5 Å²	43.5	1%	0.012	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	153.5	167.8	-178.7	0	0	0	0	111	F302 N304 S305 Y307 I324 Y380 L381 V397	F302-T395 HydrophobicContact CB-CG2 4.38Å; F302-T395 HydrophobicContact CD1-CG2 3.59Å; F302-T395 HydrophobicContact CD2-CG2 3.91Å; F302-T395 HydrophobicContact CE1-CG2 3.67Å; F302-T395 HydrophobicContact CE2-CG2 3.99Å; F302-T395 HydrophobicContact CG-CG2 3.71Å; F302-T395 HydrophobicContact CZ-CG2 3.86Å; N304-T395 WeakPolarHBondContact O-CB 3.24Å; N304-T395 PolarHBondContact O-OG1 3.42Å; S305-T395 PolarHBondContact O-OG1 2.58Å; Y307-T395 HydrophobicContact CD2-CG2 3.85Å; Y307-T395 WeakPolarHBondContact CD2-OG1 3.42Å; Y307-T395 HydrophobicContact CE2-CG2 3.92Å; I324-T395 HydrophobicContact CG2-CG2 4.19Å; Y380-T395 CarbonylContact C-O 3.48Å; Y380-T395 VanDerWaalsContact CA-O 3.32Å; Y380-T395 WeakPolarHBondContact CA-O 3.24Å; L381-T395 HydrophobicContact CB-CG2 4.04Å; L381-T395 PolarHBondContact N-O 2.95Å; L381-T395 PolarHBondContact O-N 3.48Å; T395-V397 HydrophobicContact CG2-CG2 4.49Å
396	Q	97.2	Very high	96.4	Very high	57 Å²	57	48 Å²	48	27%	0.266	28%	0.275	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.8	142.8	167.5	-172.4	177	-10.1	0	0	110.4	S305 L306 Y307 N378 Y380	S305-Q396 PolarHBondContact O-N 3.07Å; L306-Q396 WeakPolarHBondContact CA-O 3.06Å; L306-Q396 HydrophobicContact CD1-CB 3.85Å; L306-Q396 HydrophobicContact CD1-CG 3.7Å; Y307-Q396 PolarHBondContact N-O 3.45Å; N378-Q396 PolarHBondContact OD1-NE2 2.94Å; Y380-Q396 HydrophobicContact CD1-CB 4.35Å; Y380-Q396 HydrophobicContact CE1-CB 4.29Å
397	V	97.5	Very high	96.4	Very high	0 Å²	0	48 Å²	48	0%	0	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	128.2	171.2	-171.6	0	0	0	0	108.7	Y307 L309 I324 I362 N378 F379 L381 T395 I399	Y307-V397 WeakPolarHBondContact O-CA 3.29Å; L309-V397 HydrophobicContact CD1-CG1 4.1Å; I324-V397 HydrophobicContact CD1-CB 4.37Å; I324-V397 HydrophobicContact CD1-CG1 3.91Å; I324-V397 HydrophobicContact CD1-CG2 3.53Å; I362-V397 HydrophobicContact CD1-CG1 4.48Å; N378-V397 WeakPolarHBondContact CA-O 3.38Å; F379-V397 HydrophobicContact CD2-CB 3.89Å; F379-V397 HydrophobicContact CD2-CG2 4.17Å; F379-V397 HydrophobicContact CE1-CB 4.25Å; F379-V397 HydrophobicContact CE1-CG1 4.14Å; F379-V397 HydrophobicContact CE2-CB 3.57Å; F379-V397 HydrophobicContact CE2-CG1 3.94Å; F379-V397 HydrophobicContact CE2-CG2 3.77Å; F379-V397 HydrophobicContact CG-CB 4.36Å; F379-V397 HydrophobicContact CZ-CB 3.77Å; F379-V397 HydrophobicContact CZ-CG1 3.64Å; F379-V397 HydrophobicContact CZ-CG2 4.35Å; F379-V397 PolarHBondContact N-O 3.25Å; F379-V397 PolarHBondContact O-N 3.09Å; L381-V397 HydrophobicContact CB-CG2 3.73Å; T395-V397 HydrophobicContact CG2-CG2 4.49Å; V397-I399 HydrophobicContact CG1-CG1 4.11Å
398	H	97	Very high	96.5	Very high	51 Å²	51	50 Å²	50	24%	0.236	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	116.1	175.2	-177.4	-149.6	0	0	0	108.8	L306 Y307 Q308 L309 Y377 N378	L306-H398 HydrophobicContact CD1-CB 4.18Å; Y307-H398 PolarHBondContact O-N 3.46Å; Q308-H398 WeakPolarHBondContact CA-O 3.45Å; L309-H398 PolarHBondContact N-O 2.95Å; Y377-H398 WeakPolarHBondContact O-CA 3.37Å; N378-H398 VanDerWaalsContact CG-CD2 3.48Å; N378-H398 PolarHBondContact ND2-CD2 2.87Å; N378-H398 PolarHBondContact ND2-NE2 3.22Å; N378-H398 PolarHBondContact OD1-CD2 2.73Å; N378-H398 VanDerWaalsContact OD1-CD2 3.26Å
399	I	96.8	Very high	96.7	Very high	0 Å²	0	42.5 Å²	42.5	0%	0	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	116.3	176.5	-53.7	-171.3	0	0	0	108.6	L309 V311 I321 F354 I362 A376 Y377 F379 V397	L309-I399 HydrophobicContact CB-CG1 4.32Å; L309-I399 WeakPolarHBondContact O-CA 3.3Å; V311-I399 HydrophobicContact CB-CG2 4.49Å; V311-I399 HydrophobicContact CG1-CG2 3.65Å; I321-I399 HydrophobicContact CD1-CD1 4.08Å; I321-I399 HydrophobicContact CG2-CD1 4.39Å; I321-I399 HydrophobicContact CG2-CG2 4.46Å; F354-I399 HydrophobicContact CD1-CD1 4.03Å; F354-I399 HydrophobicContact CD2-CD1 3.98Å; F354-I399 HydrophobicContact CE1-CD1 3.98Å; F354-I399 HydrophobicContact CE1-CG2 4.4Å; F354-I399 HydrophobicContact CE2-CD1 3.94Å; F354-I399 HydrophobicContact CG-CD1 4.02Å; F354-I399 HydrophobicContact CZ-CB 4.39Å; F354-I399 HydrophobicContact CZ-CD1 3.95Å; F354-I399 HydrophobicContact CZ-CG2 4.12Å; I362-I399 HydrophobicContact CG2-CD1 4.47Å; A376-I399 CarbonylContact C-O 3.36Å; A376-I399 VanDerWaalsContact CA-O 3.29Å; A376-I399 WeakPolarHBondContact CA-O 3.3Å; Y377-I399 PolarHBondContact N-O 2.81Å; Y377-I399 PolarHBondContact O-N 3.38Å; F379-I399 HydrophobicContact CE1-CD1 3.64Å; F379-I399 HydrophobicContact CE1-CG1 3.95Å; F379-I399 HydrophobicContact CZ-CD1 3.91Å; F379-I399 HydrophobicContact CZ-CG1 4.41Å; V397-I399 HydrophobicContact CG1-CG1 4.11Å
400	H	97.2	Very high	96.8	Very high	65 Å²	65	43.7 Å²	43.7	30%	0.301	25%	0.245	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.6	125.8	173.8	-172	-44.3	0	0	0	109.2	L309 R310 V311	L309-H400 PolarHBondContact O-N 2.92Å; R310-H400 VanDerWaalsContact CA-O 3.3Å; R310-H400 WeakPolarHBondContact CA-O 3.29Å; R310-H400 HydrophobicContact CG-CB 4.34Å; R310-H400 PolarHBondContact NH2-CE1 3.25Å; R310-H400 PolarHBondContact NH2-NE2 2.85Å; V311-H400 PolarHBondContact N-O 2.78Å; V311-H400 VanDerWaalsContact N-O 3.1Å
401	L	96.9	Very high	96.7	Very high	0 Å²	0	40.8 Å²	40.8	0%	0	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.2	133	170.5	-64.2	-161.8	0	0	0	109.7	V311 E313 L369 R371 I374 S375 Y377	V311-L401 HydrophobicContact CG1-CD2 3.53Å; V311-L401 CarbonylContact O-C 3.53Å; V311-L401 WeakPolarHBondContact O-CA 3.42Å; E313-L401 HydrophobicContact CB-CD1 4.29Å; L369-L401 HydrophobicContact CB-CD1 3.9Å; L369-L401 HydrophobicContact CB-CD2 4.24Å; L369-L401 HydrophobicContact CD1-CD2 3.97Å; L369-L401 HydrophobicContact CD2-CD2 4.33Å; L369-L401 HydrophobicContact CG-CD2 4.41Å; R371-L401 HydrophobicContact CB-CB 4.05Å; R371-L401 HydrophobicContact CB-CD1 4.29Å; R371-L401 HydrophobicContact CG-CB 4.06Å; I374-L401 VanDerWaalsContact O-CD1 3.24Å; I374-L401 WeakPolarHBondContact O-CD1 3.02Å; S375-L401 PolarHBondContact O-N 2.91Å; Y377-L401 HydrophobicContact CD2-CD2 4.48Å; Y377-L401 HydrophobicContact CE2-CD1 4.15Å; Y377-L401 HydrophobicContact CE2-CD2 4.3Å; Y377-L401 HydrophobicContact CE2-CG 4.22Å
402	I	96.8	Very high	96.7	Very high	71 Å²	71	42.6 Å²	42.6	36%	0.364	23%	0.234	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.8	125.7	173.8	-54.6	174.8	0	0	0	107.3	R310 V311 E313	R310-I402 HydrophobicContact CB-CD1 3.81Å; R310-I402 HydrophobicContact CB-CG1 3.93Å; V311-I402 PolarHBondContact O-N 2.9Å; E313-I402 PolarHBondContact N-O 3.49Å
403	D	96.8	Very high	96.6	Very high	29 Å²	29	41.6 Å²	41.6	16%	0.155	22%	0.221	C	C	.	.	P	Polyproline II helix	trans	-57	133.6	176.7	-173.3	83.6	0	0	0	113	E313 R371 E443 N446	E313-D403 VanDerWaalsContact OE1-CA 3.28Å; E313-D403 WeakPolarHBondContact OE1-CA 3.39Å; R371-D403 IonicContact CZ-OD1 3.12Å; R371-D403 IonicContact NE-OD1 3.67Å; R371-D403 PolarHBondContact NE-OD1 2.79Å; R371-D403 IonicContact NH1-OD1 2.73Å; R371-D403 IonicContact NH2-OD1 3.61Å; D403-E443 HydrophobicContact CB-CB 3.92Å; D403-E443 VanDerWaalsContact CG-CB 3.46Å; D403-E443 VanDerWaalsContact CG-N 3.28Å; D403-E443 WeakPolarHBondContact OD1-CB 3.45Å; D403-E443 PolarHBondContact OD1-N 3.31Å; D403-E443 PolarHBondContact OD2-N 2.99Å; D403-N446 WeakPolarHBondContact OD2-CB 3.44Å; D403-N446 PolarHBondContact OD2-ND2 3.39Å
404	V	96	Very high	96.4	Very high	40 Å²	40	40.1 Å²	40.1	24%	0.242	21%	0.211	C	C	.	.			trans	-125.9	139.7	174.6	175.9	0	0	0	0	108	S312 E313 D314 D406	S312-V404 WeakPolarHBondContact OG-CG2 3.31Å; E313-V404 HydrophobicContact CG-CB 4.05Å; E313-V404 HydrophobicContact CG-CG2 4Å; E313-V404 PolarHBondContact OE1-N 3.18Å; D314-V404 HydrophobicContact CB-CG2 4.32Å; V404-D406 VanDerWaalsContact C-N 3.32Å; V404-D406 WeakPolarHBondContact O-CB 3.23Å; V404-D406 PolarHBondContact O-N 3.01Å
405	N	96.1	Very high	96.3	Very high	16 Å²	16	39.5 Å²	39.5	9%	0.086	21%	0.21	C	C	.	.	S	Bend	trans	-63.6	92.6	176.1	-150	42.7	0	0	0	109.5	D442 N446 D537 P541 K543	N405-D442 WeakPolarHBondContact CA-OD2 3.08Å; N405-N446 HydrophobicContact CB-CB 4.26Å; N405-N446 PolarHBondContact N-ND2 2.71Å; N405-N446 WeakPolarHBondContact OD1-CA 3.33Å; N405-N446 WeakPolarHBondContact OD1-CB 3.4Å; N405-D537 VanDerWaalsContact ND2-CG 3.31Å; N405-D537 PolarHBondContact ND2-OD1 2.96Å; N405-D537 PolarHBondContact ND2-OD2 2.77Å; N405-P541 PolarHBondContact ND2-O 2.71Å; N405-K543 WeakPolarHBondContact O-CE 3.26Å; N405-K543 PolarHBondContact O-NZ 2.6Å
406	D	95.1	Very high	96.1	Very high	98 Å²	98	44.6 Å²	44.6	52%	0.524	23%	0.234	S	C	.	.			trans	-118.2	-38.9	-168.5	-173.8	-95.4	0	0	0	111	V404 D442 K543	V404-D406 VanDerWaalsContact C-N 3.32Å; V404-D406 WeakPolarHBondContact O-CB 3.23Å; V404-D406 PolarHBondContact O-N 3.01Å; D406-D442 PolarHBondContact N-OD2 2.78Å; D406-K543 PolarHBondContact O-NZ 3.15Å
407	N	96.4	Very high	95.9	Very high	35 Å²	35	45.9 Å²	45.9	19%	0.187	24%	0.242	C	C	.	.			trans	-87	-163	173.8	-66.7	-86.5	0	0	0	111.8	D440 L441 D442 K543	N407-D440 WeakPolarHBondContact CB-OD1 3.42Å; N407-L441 HydrophobicContact CB-CB 4.39Å; N407-D442 VanDerWaalsContact CB-OD1 3.24Å; N407-D442 WeakPolarHBondContact CB-OD1 3.3Å; N407-D442 PolarHBondContact N-OD1 2.75Å; N407-D442 PolarHBondContact N-OD2 2.8Å; N407-D442 PolarHBondContact ND2-OD1 2.85Å; N407-K543 WeakPolarHBondContact O-CD 3.48Å; N407-K543 WeakPolarHBondContact O-CE 3.44Å; N407-K543 PolarHBondContact O-NZ 3.35Å
408	S	96	Very high	95.7	Very high	42 Å²	42	50.1 Å²	50.1	29%	0.294	26%	0.262	S	S	.	.			trans	-171.1	147.2	-178.4	64.7	0	0	0	0	109.9	Q410 D440	S408-Q410 PolarHBondContact O-N 2.91Å; S408-D440 WeakPolarHBondContact CA-OD2 3.42Å; S408-D440 PolarHBondContact N-OD1 3.43Å; S408-D440 VanDerWaalsContact N-OD1 3.15Å; S408-D440 PolarHBondContact N-OD2 2.84Å
409	P	97.5	Very high	95.5	Very high	0 Å²	0	49.8 Å²	49.8	0%	0	26%	0.26	C	S	.	.			trans	-64.2	124.1	-158.7	-29.2	36.3	0	0	0	113.7	A438 D440 V449 A535 D537 N545	P409-A438 HydrophobicContact CB-CB 4.05Å; P409-D440 WeakPolarHBondContact CA-OD2 3.25Å; P409-D440 WeakPolarHBondContact CD-OD2 3.37Å; P409-D440 WeakPolarHBondContact CG-OD2 3.48Å; P409-V449 HydrophobicContact CB-CG1 4.01Å; P409-V449 HydrophobicContact CB-CG2 3.94Å; P409-V449 HydrophobicContact CG-CG1 4.24Å; P409-V449 HydrophobicContact CG-CG2 4.04Å; P409-A535 HydrophobicContact CB-CB 3.88Å; P409-A535 HydrophobicContact CG-CB 4.49Å; P409-D537 HydrophobicContact CG-CB 4.44Å; P409-N545 WeakPolarHBondContact O-CB 3.2Å; P409-N545 PolarHBondContact O-ND2 3.18Å
410	Q	96.4	Very high	95.4	Very high	116 Å²	116	53.9 Å²	53.9	54%	0.542	28%	0.281	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.1	108.8	-177.2	-61.2	-157	34.3	0	0	111.8	S408 I412 A438 E439	S408-Q410 PolarHBondContact O-N 2.91Å; Q410-I412 PolarHBondContact O-N 3.34Å; Q410-A438 VanDerWaalsContact O-CA 3.22Å; Q410-A438 WeakPolarHBondContact O-CA 3.21Å; Q410-E439 PolarHBondContact N-O 3.31Å; Q410-E439 PolarHBondContact O-N 2.68Å; Q410-E439 VanDerWaalsContact O-N 3.12Å
411	W	96.2	Very high	95.2	Very high	15 Å²	15	52.1 Å²	52.1	6%	0.057	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-60.4	111.8	179.3	-70.1	99.8	0	0	0	114.2	L436 A438 Y451 L533 A535 N545 R547	W411-L436 HydrophobicContact CH2-CD1 4.21Å; W411-L436 HydrophobicContact CZ3-CB 4.14Å; W411-L436 HydrophobicContact CZ3-CD1 4.17Å; W411-L436 HydrophobicContact CZ3-CD2 4.24Å; W411-L436 HydrophobicContact CZ3-CG 4.41Å; W411-A438 HydrophobicContact CD2-CB 4.38Å; W411-A438 HydrophobicContact CE3-CB 4.33Å; W411-Y451 HydrophobicContact CH2-CD1 4.04Å; W411-Y451 HydrophobicContact CH2-CE1 4.47Å; W411-Y451 HydrophobicContact CZ3-CD1 4.07Å; W411-Y451 HydrophobicContact CZ3-CE1 4.12Å; W411-L533 HydrophobicContact CH2-CB 3.67Å; W411-L533 HydrophobicContact CH2-CD1 4.49Å; W411-L533 HydrophobicContact CZ2-CB 4Å; W411-A535 HydrophobicContact CD2-CB 4.38Å; W411-A535 HydrophobicContact CH2-CB 3.93Å; W411-A535 HydrophobicContact CZ2-CB 3.5Å; W411-N545 VanDerWaalsContact NE1-C 3.27Å; W411-N545 PolarHBondContact NE1-O 2.68Å; W411-R547 HydrophobicContact CD2-CB 3.84Å; W411-R547 HydrophobicContact CD2-CG 4.27Å; W411-R547 HydrophobicContact CE3-CB 4.34Å; W411-R547 HydrophobicContact CG-CB 4.15Å; W411-R547 HydrophobicContact CG-CG 4.22Å; W411-R547 HydrophobicContact CH2-CB 4.49Å; W411-R547 HydrophobicContact CZ2-CB 3.99Å; W411-R547 PolarHBondContact O-NH2 3.42Å
412	I	96	Very high	95	Very high	81 Å²	81	57.4 Å²	57.4	42%	0.415	30%	0.302	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.2	-46.1	167.7	-64.3	177.6	0	0	0	110.2	Q410 A415 I437 E439	Q410-I412 PolarHBondContact O-N 3.34Å; I412-A415 VanDerWaalsContact O-CA 3.28Å; I412-A415 WeakPolarHBondContact O-CA 3.45Å; I412-A415 PolarHBondContact O-N 2.92Å; I412-I437 HydrophobicContact CB-CB 4.17Å; I412-I437 HydrophobicContact CB-CG2 3.96Å; I412-I437 HydrophobicContact CD1-CG2 4.19Å; I412-I437 HydrophobicContact CG2-CG2 4.33Å; I412-I437 PolarHBondContact N-O 2.81Å; I412-E439 HydrophobicContact CD1-CB 4.33Å; I412-E439 HydrophobicContact CD1-CG 3.72Å; I412-E439 VanDerWaalsContact CD1-OE1 3.3Å; I412-E439 WeakPolarHBondContact CD1-OE1 3.37Å
413	F	95.5	Very high	94.8	Very high	50 Å²	50	54.4 Å²	54.4	22%	0.219	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	120.2	170.9	-169.1	-81	0	0	0	110.6	I421 A434 Q435 L436 I437	F413-I421 HydrophobicContact CE1-CD1 4.25Å; F413-I421 HydrophobicContact CZ-CD1 3.99Å; F413-I421 HydrophobicContact CZ-CG1 4.49Å; F413-A434 HydrophobicContact CE1-CB 4.21Å; F413-Q435 WeakPolarHBondContact CD1-O 3.43Å; F413-L436 HydrophobicContact CD1-CD2 4.4Å; F413-I437 HydrophobicContact CB-CB 4.16Å; F413-I437 HydrophobicContact CB-CG1 4.24Å; F413-I437 PolarHBondContact N-O 3.33Å; F413-I437 PolarHBondContact O-N 2.85Å
414	P	94	Very high	94.4	Very high	0 Å²	0	54 Å²	54	0%	0	29%	0.286	C	S	.	.	S	Bend	cis	-72.3	135.8	7.5	-16.5	29.8	0	0	0	113.5	H416 Q419 L436 L533 R547 L549	P414-H416 PolarHBondContact O-N 2.86Å; P414-Q419 HydrophobicContact CB-CB 4.18Å; P414-L436 HydrophobicContact CG-CD2 4.49Å; P414-L533 HydrophobicContact CG-CD1 4.17Å; P414-R547 HydrophobicContact CB-CG 4.04Å; P414-R547 HydrophobicContact CG-CB 4.45Å; P414-R547 HydrophobicContact CG-CG 4Å; P414-R547 VanDerWaalsContact O-CZ 3.23Å; P414-R547 PolarHBondContact O-NE 2.96Å; P414-R547 PolarHBondContact O-NH2 3.07Å; P414-L549 HydrophobicContact CB-CD1 4.31Å; P414-L549 HydrophobicContact CG-CB 4.03Å; P414-L549 HydrophobicContact CG-CD1 3.99Å; P414-L549 HydrophobicContact CG-CG 4.45Å
415	A	93	Very high	94	Very high	62 Å²	62	52.9 Å²	52.9	51%	0.512	28%	0.279	S	S	.	.	S	Bend	trans	-65.7	-21	-175.5	0	0	0	0	0	113.6	I412 R547	I412-A415 VanDerWaalsContact O-CA 3.28Å; I412-A415 WeakPolarHBondContact O-CA 3.45Å; I412-A415 PolarHBondContact O-N 2.92Å; A415-R547 PolarHBondContact O-NH2 3.34Å
416	H	93.6	Very high	93.6	Very high	109 Å²	109	57.6 Å²	57.6	51%	0.505	30%	0.304	S	S	.	.	S	Bend	trans	-155.2	165.1	168.8	57.1	80.8	0	0	0	110.9	P414 Q419	P414-H416 PolarHBondContact O-N 2.86Å; H416-Q419 PolarHBondContact O-N 3.05Å
417	N	93.7	Very high	93.4	Very high	84 Å²	84	55 Å²	55	45%	0.449	29%	0.289	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.3	142.8	170.7	-79.9	-30.7	0	0	0	111.2	Q419 R547 V548	N417-Q419 VanDerWaalsContact C-N 3.25Å; N417-Q419 PolarHBondContact O-N 2.92Å; N417-R547 WeakPolarHBondContact OD1-CA 3.14Å; N417-V548 PolarHBondContact OD1-N 3Å
418	H	91.9	Very high	93.1	Very high	88 Å²	88	57.2 Å²	57.2	41%	0.407	31%	0.305	S	S	.	.	T	Hydrogen-bonded Turn	trans	58.1	30.4	-175.3	-52.2	106.8	0	0	0	114.4	K530 V548	H418-K530 VanDerWaalsContact CD2-CE 3.49Å; H418-K530 WeakPolarHBondContact CD2-CE 3.37Å; H418-K530 PolarHBondContact CD2-NZ 2.84Å; H418-K530 PolarHBondContact NE2-NZ 2.76Å; H418-V548 PolarHBondContact N-O 3.03Å
419	Q	94.3	Very high	92.9	Very high	44 Å²	44	59.5 Å²	59.5	21%	0.206	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-59.9	138.2	161.1	-173.4	172.2	1.1	0	0	109.1	P414 H416 N417 Q550	P414-Q419 HydrophobicContact CB-CB 4.18Å; H416-Q419 PolarHBondContact O-N 3.05Å; N417-Q419 VanDerWaalsContact C-N 3.25Å; N417-Q419 PolarHBondContact O-N 2.92Å; Q419-Q550 PolarHBondContact O-N 2.87Å
420	I	93.8	Very high	92.5	Very high	86 Å²	86	61.7 Å²	61.7	44%	0.441	34%	0.34	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	132.7	-174.8	-54.7	176.3	0	0	0	109.8	N422 Q550 D552	I420-N422 WeakPolarHBondContact CG2-OD1 3.44Å; I420-Q550 CarbonylContact C-O 3.52Å; I420-Q550 WeakPolarHBondContact CA-O 3.34Å; I420-Q550 HydrophobicContact CG1-CB 4.27Å; I420-Q550 HydrophobicContact CG1-CG 4.45Å; I420-D552 HydrophobicContact CG2-CB 4.2Å; I420-D552 WeakPolarHBondContact CG2-OD2 3.02Å
421	I	93.5	Very high	92.4	Very high	29 Å²	29	60.8 Å²	60.8	15%	0.149	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	134.1	164.2	-62.4	175.7	0	0	0	107.8	F413 V433 A434 L549 Q550 I551 D552	F413-I421 HydrophobicContact CE1-CD1 4.25Å; F413-I421 HydrophobicContact CZ-CD1 3.99Å; F413-I421 HydrophobicContact CZ-CG1 4.49Å; I421-V433 HydrophobicContact CG2-CG1 4.17Å; I421-A434 HydrophobicContact CD1-CB 3.6Å; I421-L549 HydrophobicContact CD1-CD1 3.89Å; I421-L549 HydrophobicContact CD1-CD2 4.02Å; I421-L549 HydrophobicContact CD1-CG 4.42Å; I421-L549 HydrophobicContact CG1-CD1 4.09Å; I421-Q550 PolarHBondContact N-O 3.14Å; I421-I551 CarbonylContact O-C 3.59Å; I421-I551 VanDerWaalsContact O-CA 3.29Å; I421-I551 WeakPolarHBondContact O-CA 3.49Å; I421-D552 PolarHBondContact O-N 3.35Å
422	N	93.2	Very high	92.3	Very high	110 Å²	110	65.2 Å²	65.2	59%	0.588	35%	0.348	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-97.5	129.3	177	-61.7	-16.1	0	0	0	109.3	I420 D552 F554	I420-N422 WeakPolarHBondContact CG2-OD1 3.44Å; N422-D552 WeakPolarHBondContact CA-O 3.22Å; N422-F554 HydrophobicContact CB-CD2 4.28Å; N422-F554 HydrophobicContact CB-CE2 4.03Å
423	L	91.5	Very high	92.2	Very high	8 Å²	8	62 Å²	62	4%	0.042	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	159.2	171.4	-69.6	-178.9	0	0	0	110.7	E427 Y431 V433 F506 I551 D552 I553 F554	L423-E427 HydrophobicContact CD2-CG 4.37Å; L423-Y431 HydrophobicContact CD2-CD1 4.19Å; L423-Y431 HydrophobicContact CD2-CE1 3.73Å; L423-V433 HydrophobicContact CD1-CB 4.41Å; L423-V433 HydrophobicContact CD1-CG1 3.86Å; L423-V433 HydrophobicContact CD1-CG2 3.7Å; L423-V433 HydrophobicContact CD2-CB 4.48Å; L423-V433 HydrophobicContact CD2-CG1 4.11Å; L423-V433 HydrophobicContact CD2-CG2 4.19Å; L423-V433 HydrophobicContact CG-CG1 4.22Å; L423-F506 HydrophobicContact CD1-CE1 3.67Å; L423-F506 HydrophobicContact CD1-CZ 4.02Å; L423-I551 HydrophobicContact CB-CG2 4.4Å; L423-I551 HydrophobicContact CD1-CG2 3.57Å; L423-I551 HydrophobicContact CG-CG2 3.82Å; L423-D552 PolarHBondContact N-O 3.14Å; L423-I553 HydrophobicContact CB-CG1 4.32Å; L423-F554 PolarHBondContact O-N 2.99Å
424	T	89.2	Confident	92.2	Very high	22 Å²	22	60.1 Å²	60.1	14%	0.135	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.9	149.1	165	87.9	0	0	0	0	110.5	N426 E427 M521 F554 Y556	T424-N426 PolarHBondContact O-N 2.88Å; T424-N426 WeakPolarHBondContact OG1-CB 3.17Å; T424-N426 PolarHBondContact OG1-N 3.35Å; T424-N426 VanDerWaalsContact OG1-N 3.14Å; T424-E427 WeakPolarHBondContact CB-OE1 3.35Å; T424-E427 VanDerWaalsContact CG2-OE1 3.27Å; T424-E427 WeakPolarHBondContact CG2-OE1 3.29Å; T424-E427 PolarHBondContact O-N 2.91Å; T424-E427 PolarHBondContact OG1-OE1 2.83Å; T424-M521 WeakPolarHBondContact O-CE 3.36Å; T424-F554 CarbonylContact C-O 3.58Å; T424-F554 WeakPolarHBondContact CA-O 3.11Å; T424-Y556 HydrophobicContact CG2-CD2 3.89Å; T424-Y556 HydrophobicContact CG2-CE2 3.55Å
425	V	87.9	Confident	92.2	Very high	16 Å²	16	63.2 Å²	63.2	10%	0.097	34%	0.341	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62.1	-5.5	170.7	74.6	0	0	0	0	113.3	M521 S522 V526 I553 F554 R555	V425-M521 HydrophobicContact CG2-CB 3.99Å; V425-S522 WeakPolarHBondContact CG2-O 3.2Å; V425-V526 HydrophobicContact CB-CG2 4.1Å; V425-V526 HydrophobicContact CG2-CG2 3.95Å; V425-I553 HydrophobicContact CB-CG2 4.22Å; V425-F554 PolarHBondContact N-O 2.76Å; V425-R555 HydrophobicContact CG1-CB 3.83Å; V425-R555 HydrophobicContact CG1-CG 3.77Å
426	N	86.9	Confident	92.4	Very high	115 Å²	115	60.4 Å²	60.4	62%	0.615	32%	0.317	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.8	-5.2	-178.7	-55.9	-26.7	0	0	0	113.5	T424	T424-N426 PolarHBondContact O-N 2.88Å; T424-N426 WeakPolarHBondContact OG1-CB 3.17Å; T424-N426 PolarHBondContact OG1-N 3.35Å; T424-N426 VanDerWaalsContact OG1-N 3.14Å
427	E	90.3	Very high	92.5	Very high	44 Å²	44	58.5 Å²	58.5	21%	0.206	31%	0.31	C	S	.	.	P	Polyproline II helix	trans	-64.2	138.2	-179.2	-54.4	-43	135.6	0	0	111.4	L423 T424 Y431 M521	L423-E427 HydrophobicContact CD2-CG 4.37Å; T424-E427 WeakPolarHBondContact CB-OE1 3.35Å; T424-E427 VanDerWaalsContact CG2-OE1 3.27Å; T424-E427 WeakPolarHBondContact CG2-OE1 3.29Å; T424-E427 PolarHBondContact O-N 2.91Å; T424-E427 PolarHBondContact OG1-OE1 2.83Å; E427-Y431 HydrophobicContact CB-CD1 4.12Å; E427-Y431 HydrophobicContact CB-CD2 4.1Å; E427-Y431 HydrophobicContact CB-CG 3.8Å; E427-Y431 HydrophobicContact CG-CD1 4.11Å; E427-Y431 HydrophobicContact CG-CD2 4.25Å; E427-Y431 HydrophobicContact CG-CE1 4.19Å; E427-Y431 HydrophobicContact CG-CE2 4.31Å; E427-Y431 HydrophobicContact CG-CG 4.14Å; E427-Y431 WeakPolarHBondContact OE2-CE2 3.45Å; E427-M521 HydrophobicContact CB-CE 3.66Å; E427-M521 HydrophobicContact CG-CE 4.24Å
428	P	91.5	Very high	92.7	Very high	81 Å²	81	54.9 Å²	54.9	53%	0.526	29%	0.291	S	S	.	.	P	Polyproline II helix	trans	-72.4	160.6	-177.2	29.8	-35.8	0	0	0	112.7	G430 Y431	P428-G430 PolarHBondContact O-N 2.63Å; P428-Y431 WeakPolarHBondContact O-CB 3.39Å; P428-Y431 PolarHBondContact O-N 3.11Å
429	V	90.2	Very high	92.9	Very high	90 Å²	90	56.5 Å²	56.5	55%	0.545	30%	0.299	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.4	135.9	167	-177.2	0	0	0	0	109.3	Y431 V517	V429-Y431 VanDerWaalsContact C-N 3.32Å; V429-V517 WeakPolarHBondContact CA-O 3.35Å
430	G	90.5	Very high	93	Very high	46 Å²	46	55.5 Å²	55.5	47%	0.474	30%	0.296	S	S	.	.	T	Hydrogen-bonded Turn	trans	81.5	2.7	-171.8	0	0	0	0	0	114.7	P428 R432 Y516 V517	P428-G430 PolarHBondContact O-N 2.63Å; G430-R432 PolarHBondContact O-N 3.43Å; G430-Y516 WeakPolarHBondContact O-CD1 3.35Å; G430-V517 PolarHBondContact N-O 3.07Å
431	Y	93.7	Very high	93.2	Very high	96 Å²	96	56.1 Å²	56.1	38%	0.376	30%	0.299	S	S	.	.			trans	-63.2	126.8	169	-178.6	-87.3	0	0	0	110.5	L423 E427 P428 V429 V433 Y516 V517	L423-Y431 HydrophobicContact CD2-CD1 4.19Å; L423-Y431 HydrophobicContact CD2-CE1 3.73Å; E427-Y431 HydrophobicContact CB-CD1 4.12Å; E427-Y431 HydrophobicContact CB-CD2 4.1Å; E427-Y431 HydrophobicContact CB-CG 3.8Å; E427-Y431 HydrophobicContact CG-CD1 4.11Å; E427-Y431 HydrophobicContact CG-CD2 4.25Å; E427-Y431 HydrophobicContact CG-CE1 4.19Å; E427-Y431 HydrophobicContact CG-CE2 4.31Å; E427-Y431 HydrophobicContact CG-CG 4.14Å; E427-Y431 WeakPolarHBondContact OE2-CE2 3.45Å; P428-Y431 WeakPolarHBondContact O-CB 3.39Å; P428-Y431 PolarHBondContact O-N 3.11Å; V429-Y431 VanDerWaalsContact C-N 3.32Å; Y431-V433 HydrophobicContact CD1-CG2 4.29Å; Y431-V433 PolarHBondContact O-N 3.49Å; Y431-Y516 CarbonylContact O-C 3.56Å; Y431-Y516 VanDerWaalsContact O-CA 3.26Å; Y431-Y516 WeakPolarHBondContact O-CA 3.43Å; Y431-V517 HydrophobicContact CD1-CG2 4.36Å; Y431-V517 PolarHBondContact O-N 2.69Å
432	R	94.8	Very high	93.4	Very high	108 Å²	108	55.2 Å²	55.2	41%	0.408	29%	0.294	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.4	104.3	178.6	177.2	-179.4	-88	-98.4	4.8	110.1	G430 A514 I515 Y516	G430-R432 PolarHBondContact O-N 3.43Å; R432-A514 VanDerWaalsContact CZ-CB 3.42Å; R432-A514 VanDerWaalsContact NH1-CB 3.34Å; R432-A514 VanDerWaalsContact NH2-CB 3.25Å; R432-I515 CarbonylContact C-O 3.53Å; R432-I515 WeakPolarHBondContact CA-O 3.43Å; R432-Y516 HydrophobicContact CB-CD1 4.1Å; R432-Y516 HydrophobicContact CB-CE1 3.98Å; R432-Y516 HydrophobicContact CG-CE1 4.45Å; R432-Y516 PolarHBondContact NH2-OH 3.35Å; R432-Y516 VanDerWaalsContact NH2-OH 3.09Å
433	V	93.9	Very high	93.4	Very high	14 Å²	14	53.3 Å²	53.3	9%	0.085	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.9	-42.1	-179.2	178	0	0	0	0	111.9	I421 L423 Y431 F506 I515 V517 I551	I421-V433 HydrophobicContact CG2-CG1 4.17Å; L423-V433 HydrophobicContact CD1-CB 4.41Å; L423-V433 HydrophobicContact CD1-CG1 3.86Å; L423-V433 HydrophobicContact CD1-CG2 3.7Å; L423-V433 HydrophobicContact CD2-CB 4.48Å; L423-V433 HydrophobicContact CD2-CG1 4.11Å; L423-V433 HydrophobicContact CD2-CG2 4.19Å; L423-V433 HydrophobicContact CG-CG1 4.22Å; Y431-V433 HydrophobicContact CD1-CG2 4.29Å; Y431-V433 PolarHBondContact O-N 3.49Å; V433-F506 HydrophobicContact CG2-CD1 4Å; V433-F506 HydrophobicContact CG2-CE1 3.92Å; V433-I515 HydrophobicContact CB-CB 4.42Å; V433-I515 HydrophobicContact CB-CG2 4.07Å; V433-I515 PolarHBondContact N-O 2.92Å; V433-V517 HydrophobicContact CG2-CG2 3.69Å; V433-I551 HydrophobicContact CG1-CD1 3.92Å; V433-I551 HydrophobicContact CG1-CG1 4.35Å
434	A	94.2	Very high	93.5	Very high	10 Å²	10	58.7 Å²	58.7	8%	0.083	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.5	166.9	-173.2	0	0	0	0	0	112	F413 I421 I515 L549	F413-A434 HydrophobicContact CE1-CB 4.21Å; I421-A434 HydrophobicContact CD1-CB 3.6Å; A434-I515 HydrophobicContact CB-CB 4.11Å; A434-I515 HydrophobicContact CB-CD1 4.24Å; A434-I515 HydrophobicContact CB-CG1 4.4Å; A434-I515 PolarHBondContact N-O 3.32Å; A434-I515 PolarHBondContact O-N 2.86Å; A434-L549 HydrophobicContact CB-CD2 4.43Å
435	Q	95.6	Very high	93.8	Very high	66 Å²	66	62.5 Å²	62.5	31%	0.308	33%	0.327	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	112	167.2	176.5	54.2	73.7	0	0	107.2	F413 I437 S512 G513	F413-Q435 WeakPolarHBondContact CD1-O 3.43Å; Q435-I437 HydrophobicContact CG-CG1 4.26Å; Q435-S512 PolarHBondContact NE2-O 3.4Å; Q435-G513 PolarHBondContact NE2-O 3.4Å
436	L	96.4	Very high	94.2	Very high	2 Å²	2	63.1 Å²	63.1	1%	0.01	33%	0.33	C	S	.	.			trans	-73	142.6	173.8	-59.4	-173.1	0	0	0	110	W411 F413 P414 Y451 L508 G513 I515 L533	W411-L436 HydrophobicContact CH2-CD1 4.21Å; W411-L436 HydrophobicContact CZ3-CB 4.14Å; W411-L436 HydrophobicContact CZ3-CD1 4.17Å; W411-L436 HydrophobicContact CZ3-CD2 4.24Å; W411-L436 HydrophobicContact CZ3-CG 4.41Å; F413-L436 HydrophobicContact CD1-CD2 4.4Å; P414-L436 HydrophobicContact CG-CD2 4.49Å; L436-Y451 HydrophobicContact CB-CD1 3.77Å; L436-Y451 HydrophobicContact CB-CE1 3.84Å; L436-Y451 HydrophobicContact CB-CG 4.29Å; L436-Y451 HydrophobicContact CD1-CD1 3.99Å; L436-Y451 HydrophobicContact CD1-CG 4.29Å; L436-L508 HydrophobicContact CD1-CD1 3.76Å; L436-L508 HydrophobicContact CD1-CD2 4.4Å; L436-L508 HydrophobicContact CG-CD1 4.43Å; L436-G513 VanDerWaalsContact CB-O 3.25Å; L436-G513 WeakPolarHBondContact CB-O 3.47Å; L436-G513 VanDerWaalsContact CG-O 3.26Å; L436-G513 WeakPolarHBondContact CG-O 2.92Å; L436-G513 PolarHBondContact N-O 2.73Å; L436-I515 HydrophobicContact CD1-CD1 4.2Å; L436-I515 HydrophobicContact CD1-CG1 4.43Å; L436-I515 HydrophobicContact CD2-CD1 3.89Å; L436-I515 HydrophobicContact CG-CD1 4.08Å; L436-I515 HydrophobicContact CG-CG1 4.26Å; L436-L533 HydrophobicContact CD1-CD1 3.98Å; L436-L533 HydrophobicContact CD1-CD2 4.18Å; L436-L533 HydrophobicContact CD1-CG 4.49Å; L436-L533 HydrophobicContact CD2-CD1 3.56Å; L436-L533 HydrophobicContact CG-CD1 4.43Å
437	I	96.4	Very high	94.6	Very high	69 Å²	69	58.6 Å²	58.6	35%	0.354	31%	0.311	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.8	120.4	177.4	-50.9	177.7	0	0	0	107.8	I412 F413 Q435	I412-I437 HydrophobicContact CB-CB 4.17Å; I412-I437 HydrophobicContact CB-CG2 3.96Å; I412-I437 HydrophobicContact CD1-CG2 4.19Å; I412-I437 HydrophobicContact CG2-CG2 4.33Å; I412-I437 PolarHBondContact N-O 2.81Å; F413-I437 HydrophobicContact CB-CB 4.16Å; F413-I437 HydrophobicContact CB-CG1 4.24Å; F413-I437 PolarHBondContact N-O 3.33Å; F413-I437 PolarHBondContact O-N 2.85Å; Q435-I437 HydrophobicContact CG-CG1 4.26Å
438	A	96.8	Very high	94.9	Very high	8 Å²	8	60.2 Å²	60.2	7%	0.066	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.6	146.4	162.4	0	0	0	0	0	108.4	P409 Q410 W411 V449 Y451 A535	P409-A438 HydrophobicContact CB-CB 4.05Å; Q410-A438 VanDerWaalsContact O-CA 3.22Å; Q410-A438 WeakPolarHBondContact O-CA 3.21Å; W411-A438 HydrophobicContact CD2-CB 4.38Å; W411-A438 HydrophobicContact CE3-CB 4.33Å; A438-V449 HydrophobicContact CB-CG1 4.28Å; A438-Y451 HydrophobicContact CB-CE1 4.15Å; A438-Y451 PolarHBondContact N-OH 2.83Å; A438-Y451 PolarHBondContact O-OH 3.46Å; A438-A535 HydrophobicContact CB-CB 4.09Å
439	E	96.1	Very high	95.1	Very high	123 Å²	123	57.4 Å²	57.4	58%	0.575	30%	0.299	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-115.7	142	175.5	-73	171.4	-172.3	0	0	108.4	Q410 I412	Q410-E439 PolarHBondContact N-O 3.31Å; Q410-E439 PolarHBondContact O-N 2.68Å; Q410-E439 VanDerWaalsContact O-N 3.12Å; I412-E439 HydrophobicContact CD1-CB 4.33Å; I412-E439 HydrophobicContact CD1-CG 3.72Å; I412-E439 VanDerWaalsContact CD1-OE1 3.3Å; I412-E439 WeakPolarHBondContact CD1-OE1 3.37Å
440	D	97.5	Very high	95.4	Very high	23 Å²	23	55.9 Å²	55.9	12%	0.123	29%	0.288	C	S	.	.			trans	-114.4	161.1	165.4	-139.8	-35	0	0	0	110.1	N407 S408 P409 V449	N407-D440 WeakPolarHBondContact CB-OD1 3.42Å; S408-D440 WeakPolarHBondContact CA-OD2 3.42Å; S408-D440 PolarHBondContact N-OD1 3.43Å; S408-D440 VanDerWaalsContact N-OD1 3.15Å; S408-D440 PolarHBondContact N-OD2 2.84Å; P409-D440 WeakPolarHBondContact CA-OD2 3.25Å; P409-D440 WeakPolarHBondContact CD-OD2 3.37Å; P409-D440 WeakPolarHBondContact CG-OD2 3.48Å; D440-V449 HydrophobicContact CB-CG2 4.25Å
441	L	96.5	Very high	95.7	Very high	99 Å²	99	54.5 Å²	54.5	52%	0.518	27%	0.268	S	S	.	.			trans	-98.9	-26.7	-174.8	-58.7	-179.5	0	0	0	112.8	R371 E372 N407	R371-L441 PolarHBondContact NH2-O 3.43Å; E372-L441 HydrophobicContact CB-CB 4.47Å; E372-L441 HydrophobicContact CG-CB 3.59Å; N407-L441 HydrophobicContact CB-CB 4.39Å
442	D	97.6	Very high	95.8	Very high	9 Å²	9	57 Å²	57	5%	0.048	28%	0.277	C	S	.	.	S	Bend	trans	-66	167.4	-179.3	-58.8	-0.4	0	0	0	111.6	N405 D406 N407 N446 G447	N405-D442 WeakPolarHBondContact CA-OD2 3.08Å; D406-D442 PolarHBondContact N-OD2 2.78Å; N407-D442 VanDerWaalsContact CB-OD1 3.24Å; N407-D442 WeakPolarHBondContact CB-OD1 3.3Å; N407-D442 PolarHBondContact N-OD1 2.75Å; N407-D442 PolarHBondContact N-OD2 2.8Å; N407-D442 PolarHBondContact ND2-OD1 2.85Å; D442-N446 HydrophobicContact CB-CB 3.58Å; D442-G447 WeakPolarHBondContact O-CA 3.46Å
443	E	95.1	Very high	95.6	Very high	71 Å²	71	54.3 Å²	54.3	33%	0.332	27%	0.271	S	S	.	.			trans	-96.2	152.2	-171.2	-137.9	-177.4	105.9	0	0	114	R371 D403 E445 N446 G447	R371-E443 IonicContact CZ-OE2 3.52Å; R371-E443 IonicContact NH1-OE2 3.51Å; R371-E443 PolarHBondContact NH1-OE2 2.92Å; D403-E443 HydrophobicContact CB-CB 3.92Å; D403-E443 VanDerWaalsContact CG-CB 3.46Å; D403-E443 VanDerWaalsContact CG-N 3.28Å; D403-E443 WeakPolarHBondContact OD1-CB 3.45Å; D403-E443 PolarHBondContact OD1-N 3.31Å; D403-E443 PolarHBondContact OD2-N 2.99Å; E443-E445 PolarHBondContact O-N 2.84Å; E443-N446 WeakPolarHBondContact O-CB 3.29Å; E443-N446 PolarHBondContact O-N 2.91Å; E443-G447 PolarHBondContact O-N 3.02Å
444	N	93.6	Very high	95.4	Very high	121 Å²	121	56.8 Å²	56.8	65%	0.647	29%	0.286	S	S	*	.	H	α-helix	trans	52.8	-121.2	170.2	-52.2	-76.2	0	0	0	112.6	N446 G447 E448	N444-N446 VanDerWaalsContact C-N 3.31Å; N444-N446 PolarHBondContact O-N 2.83Å; N444-G447 CarbonylContact O-C 3.53Å; N444-G447 PolarHBondContact O-N 2.93Å; N444-E448 WeakPolarHBondContact O-CB 3.24Å; N444-E448 PolarHBondContact O-N 3.2Å
445	E	95.5	Very high	95	Very high	102 Å²	102	61.1 Å²	61.1	48%	0.477	30%	0.304	S	S	.	.	H	α-helix	trans	-69.2	-25.4	-179.3	-62.1	-164.6	122	0	0	113.5	E443 G447 R538 G539	E443-E445 PolarHBondContact O-N 2.84Å; E445-G447 VanDerWaalsContact C-N 3.33Å; E445-R538 HydrophobicContact CB-CB 4.25Å; E445-R538 CarbonylContact O-C 3.54Å; E445-R538 WeakPolarHBondContact O-CA 3.45Å; E445-R538 WeakPolarHBondContact O-CB 3.08Å; E445-R538 PolarHBondContact O-N 2.74Å; E445-R538 IonicContact OE1-CZ 3.59Å; E445-R538 IonicContact OE1-NH2 3.54Å; E445-R538 PolarHBondContact OE1-NH2 2.88Å; E445-G539 PolarHBondContact O-N 2.9Å
446	N	95.7	Very high	94.4	Very high	28 Å²	28	60.3 Å²	60.3	15%	0.15	30%	0.304	C	S	.	.	H	α-helix	trans	-72.9	-31.1	172.7	-63	-21.6	0	0	0	110.5	D403 N405 D442 E443 N444 D537 G539	D403-N446 WeakPolarHBondContact OD2-CB 3.44Å; D403-N446 PolarHBondContact OD2-ND2 3.39Å; N405-N446 HydrophobicContact CB-CB 4.26Å; N405-N446 PolarHBondContact N-ND2 2.71Å; N405-N446 WeakPolarHBondContact OD1-CA 3.33Å; N405-N446 WeakPolarHBondContact OD1-CB 3.4Å; D442-N446 HydrophobicContact CB-CB 3.58Å; E443-N446 WeakPolarHBondContact O-CB 3.29Å; E443-N446 PolarHBondContact O-N 2.91Å; N444-N446 VanDerWaalsContact C-N 3.31Å; N444-N446 PolarHBondContact O-N 2.83Å; N446-D537 WeakPolarHBondContact O-CB 3.32Å; N446-G539 WeakPolarHBondContact OD1-CA 3.46Å
447	G	95.1	Very high	93.7	Very high	21 Å²	21	62.4 Å²	62.4	22%	0.216	32%	0.319	C	S	.	.	H	α-helix	trans	-83	-12.9	172.7	0	0	0	0	0	116	D442 E443 N444 E445 V449	D442-G447 WeakPolarHBondContact O-CA 3.46Å; E443-G447 PolarHBondContact O-N 3.02Å; N444-G447 CarbonylContact O-C 3.53Å; N444-G447 PolarHBondContact O-N 2.93Å; E445-G447 VanDerWaalsContact C-N 3.33Å; G447-V449 PolarHBondContact O-N 3.1Å
448	E	95.9	Very high	92.8	Very high	77 Å²	77	62.4 Å²	62.4	36%	0.36	32%	0.316	S	S	.	.			trans	-84.6	99.4	-168.9	-164.2	-164.4	133.5	0	0	112.5	N444 R538	N444-E448 WeakPolarHBondContact O-CB 3.24Å; N444-E448 PolarHBondContact O-N 3.2Å; E448-R538 HydrophobicContact CB-CG 4.48Å; E448-R538 PolarHBondContact O-N 2.91Å; E448-R538 WeakPolarHBondContact OE1-CD 3.34Å; E448-R538 IonicContact OE1-CZ 3.79Å; E448-R538 IonicContact OE1-NE 3.91Å; E448-R538 IonicContact OE1-NH1 3.58Å; E448-R538 PolarHBondContact OE1-NH1 2.68Å; E448-R538 WeakPolarHBondContact OE2-CD 3.39Å; E448-R538 IonicContact OE2-CZ 3.76Å; E448-R538 IonicContact OE2-NE 3.71Å; E448-R538 IonicContact OE2-NH1 3.34Å; E448-R538 PolarHBondContact OE2-NH1 3.42Å
449	V	96.8	Very high	91	Very high	22 Å²	22	66.1 Å²	66.1	13%	0.133	33%	0.333	C	S	.	.			trans	-76.3	123.6	-177.1	-173.5	0	0	0	0	113.2	P409 A438 D440 G447 Y451 A535 S536	P409-V449 HydrophobicContact CB-CG1 4.01Å; P409-V449 HydrophobicContact CB-CG2 3.94Å; P409-V449 HydrophobicContact CG-CG1 4.24Å; P409-V449 HydrophobicContact CG-CG2 4.04Å; A438-V449 HydrophobicContact CB-CG1 4.28Å; D440-V449 HydrophobicContact CB-CG2 4.25Å; G447-V449 PolarHBondContact O-N 3.1Å; V449-Y451 HydrophobicContact CG1-CE1 4.01Å; V449-Y451 HydrophobicContact CG1-CE2 4.21Å; V449-A535 HydrophobicContact CG1-CB 4.02Å; V449-S536 CarbonylContact C-O 3.56Å; V449-S536 WeakPolarHBondContact CA-O 3.37Å
450	I	96.6	Very high	88.8	Confident	58 Å²	58	64.2 Å²	64.2	30%	0.297	33%	0.334	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	137.1	167.4	-63.6	-175.3	0	0	0	110.3	S510 A535 S536 R538	I450-S510 WeakPolarHBondContact CA-O 3.46Å; I450-A535 WeakPolarHBondContact O-CA 3.47Å; I450-S536 PolarHBondContact N-O 2.95Å; I450-S536 PolarHBondContact O-N 3.19Å; I450-R538 HydrophobicContact CD1-CG 3.6Å; I450-R538 HydrophobicContact CG1-CG 3.98Å
451	Y	96.7	Very high	86.2	Confident	18 Å²	18	68.3 Å²	68.3	7%	0.071	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.1	145.5	177.4	-55	-85.3	0	0	0	112.9	W411 L436 A438 V449 S510 G513 E534 A535	W411-Y451 HydrophobicContact CH2-CD1 4.04Å; W411-Y451 HydrophobicContact CH2-CE1 4.47Å; W411-Y451 HydrophobicContact CZ3-CD1 4.07Å; W411-Y451 HydrophobicContact CZ3-CE1 4.12Å; L436-Y451 HydrophobicContact CB-CD1 3.77Å; L436-Y451 HydrophobicContact CB-CE1 3.84Å; L436-Y451 HydrophobicContact CB-CG 4.29Å; L436-Y451 HydrophobicContact CD1-CD1 3.99Å; L436-Y451 HydrophobicContact CD1-CG 4.29Å; A438-Y451 HydrophobicContact CB-CE1 4.15Å; A438-Y451 PolarHBondContact N-OH 2.83Å; A438-Y451 PolarHBondContact O-OH 3.46Å; V449-Y451 HydrophobicContact CG1-CE1 4.01Å; V449-Y451 HydrophobicContact CG1-CE2 4.21Å; Y451-S510 PolarHBondContact N-O 2.65Å; Y451-S510 VanDerWaalsContact O-CA 3.26Å; Y451-S510 WeakPolarHBondContact O-CA 3.38Å; Y451-S510 WeakPolarHBondContact O-CB 3.19Å; Y451-G513 VanDerWaalsContact CD2-CA 3.41Å; Y451-E534 CarbonylContact C-O 3.55Å; Y451-E534 WeakPolarHBondContact CA-O 3.34Å; Y451-A535 HydrophobicContact CD1-CB 4.22Å; Y451-A535 HydrophobicContact CE1-CB 4.31Å
452	R	94.3	Very high	83.1	Confident	149 Å²	149	71.7 Å²	71.7	56%	0.562	37%	0.371	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-143.7	142.6	177.4	-167.3	-166	-173.8	-177.6	1.6	112.8	L508 L533 E534	R452-L508 VanDerWaalsContact C-CD2 3.46Å; R452-L533 WeakPolarHBondContact O-CA 3.36Å; R452-E534 HydrophobicContact CB-CB 4.24Å; R452-E534 HydrophobicContact CB-CG 4.46Å; R452-E534 WeakPolarHBondContact CD-OE1 3.48Å; R452-E534 IonicContact CZ-OE1 2.72Å; R452-E534 PolarHBondContact N-O 2.97Å; R452-E534 IonicContact NE-OE1 3.79Å; R452-E534 IonicContact NH1-OE1 3.21Å; R452-E534 PolarHBondContact NH1-OE1 2.85Å; R452-E534 PolarHBondContact O-N 2.9Å
453	L	92	Very high	80.2	Confident	51 Å²	51	76.1 Å²	76.1	27%	0.267	40%	0.4	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.4	107.5	169.9	-179	60.2	0	0	0	109.1	T456 L508 L531 L533	L453-T456 HydrophobicContact CD1-CG2 4.09Å; L453-T456 HydrophobicContact CD2-CG2 3.84Å; L453-T456 HydrophobicContact CG-CG2 4.16Å; L453-L508 HydrophobicContact CB-CD2 4.15Å; L453-L531 HydrophobicContact CD1-CB 3.78Å; L453-L531 HydrophobicContact CD1-CD1 4.36Å; L453-L531 HydrophobicContact CD1-CD2 4.15Å; L453-L531 HydrophobicContact CD1-CG 4.31Å; L453-L533 HydrophobicContact CD1-CD2 3.82Å
454	V	89.4	Confident	77.2	Confident	66 Å²	66	79.5 Å²	79.5	40%	0.4	42%	0.42	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85	-43	-174.5	-178.1	0	0	0	0	111.8	V532 E534	V454-V532 HydrophobicContact CB-CB 4.45Å; V454-V532 HydrophobicContact CB-CG1 4.25Å; V454-V532 PolarHBondContact N-O 3.45Å; V454-E534 HydrophobicContact CG2-CB 3.36Å; V454-E534 HydrophobicContact CG2-CG 4.29Å
455	Q	85.7	Confident	74.2	Confident	100 Å²	100	82 Å²	82	47%	0.467	43%	0.432	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.9	143.3	-176.8	-167.9	177.6	19.2	0	0	111.5	V532	Q455-V532 HydrophobicContact CB-CB 3.99Å; Q455-V532 HydrophobicContact CB-CG2 3.99Å; Q455-V532 PolarHBondContact N-O 2.83Å; Q455-V532 PolarHBondContact O-N 3.05Å
456	T	83	Confident	71.1	Confident	50 Å²	50	82.2 Å²	82.2	31%	0.307	44%	0.44	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	137.5	168.2	61.8	0	0	0	0	109.9	L453 K530 L531	L453-T456 HydrophobicContact CD1-CG2 4.09Å; L453-T456 HydrophobicContact CD2-CG2 3.84Å; L453-T456 HydrophobicContact CG-CG2 4.16Å; T456-K530 WeakPolarHBondContact CA-O 3.31Å; T456-L531 HydrophobicContact CG2-CD2 3.73Å
457	S	81.8	Confident	67.9	Low	46 Å²	46	88.1 Å²	88.1	32%	0.322	47%	0.471	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.6	125.9	174.3	63.6	0	0	0	0	111.3	K530	S457-K530 PolarHBondContact N-O 3.5Å; S457-K530 PolarHBondContact O-N 2.65Å
458	F	76.7	Confident	64.8	Low	69 Å²	69	98.3 Å²	98.3	30%	0.303	50%	0.503	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.3	122.8	177.3	-167.6	-93.1	0	0	0	109.9	I502 I529	F458-I502 HydrophobicContact CB-CD1 3.84Å; F458-I529 HydrophobicContact CD2-CD1 3.67Å; F458-I529 HydrophobicContact CD2-CG1 3.62Å; F458-I529 HydrophobicContact CE2-CD1 3.9Å; F458-I529 HydrophobicContact CE2-CG1 3.95Å
459	M	59.9	Low	61.7	Low	86 Å²	86	100.8 Å²	100.8	42%	0.424	52%	0.524	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	98.3	171.7	-67.9	-171.7	63.1	0	0	109	N461 S528 K530	M459-N461 VanDerWaalsContact C-N 3.3Å; M459-N461 PolarHBondContact O-N 3.01Å; M459-S528 WeakPolarHBondContact CA-O 3.48Å; M459-S528 WeakPolarHBondContact CB-O 3.39Å; M459-S528 PolarHBondContact N-O 3.26Å; M459-S528 PolarHBondContact O-N 3.4Å; M459-K530 HydrophobicContact SD-CD 3.9Å; M459-K530 WeakPolarHBondContact SD-CE 3.28Å; M459-K530 HydrophobicContact SD-CG 4.48Å
460	S	50.1	Low	58.5	Low	83 Å²	83	107.2 Å²	107.2	58%	0.58	56%	0.556	S	S	*	*			trans	-70.1	81.8	178.2	61.5	0	0	0	0	111.5	M462	S460-M462 VanDerWaalsContact C-N 3.29Å; S460-M462 PolarHBondContact O-N 3.25Å
461	N	41.4	Very low	55.3	Low	108 Å²	108	112.4 Å²	112.4	58%	0.578	58%	0.581	S	S	*	*			trans	-69.7	87.7	164.3	-82.2	-34.2	0	0	0	109.1	M459 P463 S528	M459-N461 VanDerWaalsContact C-N 3.3Å; M459-N461 PolarHBondContact O-N 3.01Å; N461-P463 VanDerWaalsContact C-CD 3.42Å; N461-P463 WeakPolarHBondContact O-CD 3.28Å; N461-S528 PolarHBondContact ND2-OG 3.02Å; N461-S528 VanDerWaalsContact ND2-OG 3.15Å
462	M	32.7	Very low	52	Low	171 Å²	171	117.5 Å²	117.5	84%	0.842	61%	0.614	S	S	*	*			trans	-84.3	95.8	152.8	-87.9	-164.3	172.5	0	0	108.7	S460 N464	S460-M462 VanDerWaalsContact C-N 3.29Å; S460-M462 PolarHBondContact O-N 3.25Å; M462-N464 PolarHBondContact O-N 2.83Å
463	P	35.7	Very low	48.8	Very low	101 Å²	101	115.5 Å²	115.5	66%	0.656	62%	0.623	S	S	*	*			trans	-61.8	129.9	149.5	30.5	-32.1	0	0	0	106.9	N461 I465	N461-P463 VanDerWaalsContact C-CD 3.42Å; N461-P463 WeakPolarHBondContact O-CD 3.28Å; P463-I465 PolarHBondContact O-N 2.96Å
464	N	32.2	Very low	45.9	Very low	143 Å²	143	118.2 Å²	118.2	77%	0.765	64%	0.644	S	S	*	*			trans	-61.2	108.1	178.8	-73.7	-67.7	0	0	0	109.8	M462 V466	M462-N464 PolarHBondContact O-N 2.83Å; N464-V466 HydrophobicContact CB-CG2 4.22Å; N464-V466 PolarHBondContact O-N 2.94Å
465	I	31.4	Very low	42.9	Very low	173 Å²	173	119.8 Å²	119.8	89%	0.887	66%	0.657	S	S	*	*			trans	-74.3	78.9	164.4	-56.2	-179.5	0	0	0	107	P463	P463-I465 PolarHBondContact O-N 2.96Å
466	V	30.5	Very low	40.4	Very low	107 Å²	107	121.6 Å²	121.6	65%	0.648	68%	0.675	S	S	*	*			trans	-135.3	124.6	172.9	178.4	0	0	0	0	106.2	N464 R468	N464-V466 HydrophobicContact CB-CG2 4.22Å; N464-V466 PolarHBondContact O-N 2.94Å; V466-R468 PolarHBondContact O-N 3.37Å
467	D	28.7	Very low	37.8	Very low	151 Å²	151	128.8 Å²	128.8	81%	0.807	70%	0.697	S	S	*	*			trans	-49.2	126.5	-171.3	-68.9	-69	0	0	0	113.6
468	R	29.7	Very low	35.4	Very low	235 Å²	235	134.2 Å²	134.2	89%	0.887	72%	0.721	S	S	*	*			trans	-134.3	61	164.7	-71.8	-162.3	176.1	-170.6	0.5	111.8	V466	V466-R468 PolarHBondContact O-N 3.37Å
469	T	31.5	Very low	33	Very low	130 Å²	130	135.6 Å²	135.6	80%	0.798	73%	0.732	S	S	*	*			trans	-48	143.2	140.8	-4.1	0	0	0	0	109.5	M471	T469-M471 PolarHBondContact O-N 3.19Å
470	I	29.4	Very low	31.6	Very low	157 Å²	157	138.7 Å²	138.7	81%	0.805	75%	0.75	S	S	*	*	S	Bend	trans	-77.4	118.1	-173.4	-61.2	162.5	0	0	0	109.8
471	M	27.5	Very low	30.6	Very low	167 Å²	167	138.3 Å²	138.3	82%	0.823	75%	0.752	S	S	*	*				-170	168.6	121.2	-126.4	119.4	73.7	0	0	115.9	T469	T469-M471 PolarHBondContact O-N 3.19Å
472	T	28.1	Very low	30.1	Very low	125 Å²	125	140 Å²	140	77%	0.767	76%	0.76	S	S	*	*			trans	-56.8	150.6	-177.6	48	0	0	0	0	117.6
473	S	26.7	Very low	30.1	Very low	107 Å²	107	138.9 Å²	138.9	75%	0.748	76%	0.757	S	S	*	*			trans	-58.8	169.1	159.8	55.3	0	0	0	0	112.7
474	P	31.9	Very low	29.8	Very low	108 Å²	108	138.2 Å²	138.2	70%	0.701	76%	0.755	S	S	*	*			cis	-153.4	166.2	33.9	44	-22.3	0	0	0	122.2
475	S	27.2	Very low	29.7	Very low	98 Å²	98	139.3 Å²	139.3	69%	0.685	76%	0.761	S	S	*	*			trans	59.3	119.5	140.8	64.6	0	0	0	0	122.6
476	T	31.8	Very low	29.5	Very low	138 Å²	138	137.2 Å²	137.2	85%	0.847	76%	0.756	S	S	*	*				166.1	166.4	106.1	37.3	0	0	0	0	110.2
477	R	27.9	Very low	29.4	Very low	202 Å²	202	141.4 Å²	141.4	76%	0.762	77%	0.768	S	S	*	*			cis	178.1	115.2	-43.1	176.5	-172.7	-171.6	171.4	9	107.3	D479	R477-D479 IonicContact NE-OD2 3.83Å
478	L	31.6	Very low	29.4	Very low	160 Å²	160	140.6 Å²	140.6	84%	0.838	76%	0.763	S	S	*	*			trans	173.2	156	151.3	-123.7	59.9	0	0	0	109.4
479	D	27.1	Very low	29.2	Very low	97 Å²	97	135.6 Å²	135.6	52%	0.519	76%	0.758	S	S	.	*				-171.7	163.3	-67	-92.8	-32.1	0	0	0	105.8	R477	R477-D479 IonicContact NE-OD2 3.83Å
480	N	31.1	Very low	29	Very low	152 Å²	152	134.7 Å²	134.7	81%	0.813	75%	0.754	S	S	*	*			trans	74.2	144.6	167	-54.7	-44.7	0	0	0	118.3
481	A	28.8	Very low	29	Very low	75 Å²	75	136.9 Å²	136.9	62%	0.62	76%	0.758	S	S	*	*			cis	-162	124.2	-13	0	0	0	0	0	114.6
482	I	30.9	Very low	28.9	Very low	143 Å²	143	135.3 Å²	135.3	73%	0.733	76%	0.757	S	S	*	*				75.6	138.8	120.5	-63.9	169.6	0	0	0	121
483	N	31.8	Very low	28.8	Very low	147 Å²	147	136.6 Å²	136.6	79%	0.786	76%	0.76	S	S	*	*			trans	72.3	140.7	165.3	-72.5	-11.1	0	0	0	119.9
484	S	29.7	Very low	28.8	Very low	88 Å²	88	139.8 Å²	139.8	62%	0.615	77%	0.765	S	S	*	*			cis	-172.2	128.5	-24.6	46.6	0	0	0	0	110.2
485	N	30.3	Very low	28.5	Very low	165 Å²	165	145.2 Å²	145.2	88%	0.882	77%	0.772	S	S	*	*			trans	-173.4	128.2	133.6	-96.8	-17.1	0	0	0	109.5
486	V	28.3	Very low	28.3	Very low	129 Å²	129	150.2 Å²	150.2	78%	0.782	78%	0.777	S	S	*	*			trans	-120.1	126	179.1	172	0	0	0	0	108.4	I488	V486-I488 HydrophobicContact CG1-CD1 4.01Å; V486-I488 HydrophobicContact CG1-CG1 3.57Å
487	Q	28.2	Very low	28.1	Very low	196 Å²	196	149.6 Å²	149.6	92%	0.916	77%	0.767	S	S	*	*			trans	-126	138.2	161.5	-168.5	169.5	-1.7	0	0	107.2
488	I	27.7	Very low	28	Very low	134 Å²	134	145.1 Å²	145.1	69%	0.687	76%	0.764	S	S	*	*			trans	-120.9	151.5	-166.2	-39.7	179.3	0	0	0	109.6	V486	V486-I488 HydrophobicContact CG1-CD1 4.01Å; V486-I488 HydrophobicContact CG1-CG1 3.57Å
489	V	26.6	Very low	28.1	Very low	130 Å²	130	142 Å²	142	79%	0.788	76%	0.756	S	S	*	*			trans	80.7	138.8	168.7	-170.1	0	0	0	0	114.3
490	P	27.3	Very low	28.5	Very low	110 Å²	110	145.5 Å²	145.5	71%	0.714	77%	0.769	S	S	*	*			cis	-114.1	-179.9	-2.1	22	0	0	0	0	114.7	T492	P490-T492 PolarHBondContact O-N 2.71Å
491	K	29.2	Very low	29	Very low	204 Å²	204	144.9 Å²	144.9	89%	0.887	77%	0.765	S	S	*	*			trans	-66.4	118.9	159.1	-64.5	172.7	177.7	176.8	0	109.4
492	T	25.6	Very low	30.1	Very low	133 Å²	133	142.7 Å²	142.7	82%	0.816	74%	0.743	S	S	*	*			trans	-179.9	106.1	133.4	27.6	0	0	0	0	108.7	P490	P490-T492 PolarHBondContact O-N 2.71Å
493	D	25.1	Very low	30.9	Very low	153 Å²	153	138.4 Å²	138.4	82%	0.818	73%	0.734	S	S	*	*			trans	-153.2	80.3	160.3	-125.1	-21	0	0	0	108.8	R495	D493-R495 PolarHBondContact O-N 3.12Å; D493-R495 VanDerWaalsContact O-N 3.12Å
494	M	26.2	Very low	32.7	Very low	174 Å²	174	136.3 Å²	136.3	86%	0.857	72%	0.722	S	S	*	*			trans	-66.3	105.9	156.7	-76.9	-172.1	-68.9	0	0	105.6	Y496	M494-Y496 PolarHBondContact O-N 3.1Å
495	R	25.1	Very low	35.3	Very low	222 Å²	222	132.2 Å²	132.2	84%	0.838	69%	0.694	S	S	*	*			trans	-59	103.8	172.4	-75.8	-173.6	176.5	-177.8	-0.4	108.4	D493 I497	D493-R495 PolarHBondContact O-N 3.12Å; D493-R495 VanDerWaalsContact O-N 3.12Å; R495-I497 PolarHBondContact O-N 3.46Å
496	Y	23.9	Very low	38.1	Very low	202 Å²	202	124.9 Å²	124.9	79%	0.792	65%	0.654	S	S	*	*			trans	-60	92	157.9	-108.6	-94.8	0	0	0	106.9	M494 P498	M494-Y496 PolarHBondContact O-N 3.1Å; Y496-P498 WeakPolarHBondContact O-CD 3.17Å
497	I	27.7	Very low	41.1	Very low	125 Å²	125	123.1 Å²	123.1	64%	0.641	64%	0.637	S	S	*	*			trans	-67.2	118.1	164.9	-60.2	176.8	0	0	0	104.9	R495 S499	R495-I497 PolarHBondContact O-N 3.46Å; I497-S499 PolarHBondContact O-N 3.3Å
498	P	26.9	Very low	44.1	Very low	108 Å²	108	115.7 Å²	115.7	70%	0.701	60%	0.604	S	S	*	*			trans	-60.5	130.9	-179.9	25.1	-33.3	0	0	0	108.9	Y496 H500	Y496-P498 WeakPolarHBondContact O-CD 3.17Å; P498-H500 PolarHBondContact O-N 3.16Å
499	S	31.8	Very low	47.3	Very low	95 Å²	95	112.3 Å²	112.3	66%	0.664	59%	0.587	S	S	*	*			trans	-56.6	106.3	-164.1	49.8	0	0	0	0	113.2	I497 N501	I497-S499 PolarHBondContact O-N 3.3Å; S499-N501 PolarHBondContact O-N 3.32Å; S499-N501 VanDerWaalsContact O-N 3.14Å
500	H	36.3	Very low	50.4	Low	171 Å²	171	108.7 Å²	108.7	79%	0.792	57%	0.568	S	S	*	*			trans	-62.4	107.2	157.6	-87.6	18	0	0	0	108.7	P498 I502	P498-H500 PolarHBondContact O-N 3.16Å; H500-I502 VanDerWaalsContact C-N 3.29Å; H500-I502 WeakPolarHBondContact O-CG1 3.29Å; H500-I502 PolarHBondContact O-N 2.87Å
501	N	41.8	Very low	53.6	Low	138 Å²	138	109.6 Å²	109.6	74%	0.738	57%	0.565	S	S	*	*	S	Bend	trans	20.7	55.3	163	-67.2	-0.9	0	0	0	118.1	S499 G503 R519	S499-N501 PolarHBondContact O-N 3.32Å; S499-N501 VanDerWaalsContact O-N 3.14Å; N501-G503 PolarHBondContact O-N 3.22Å; N501-R519 PolarHBondContact O-NH2 2.85Å
502	I	50.8	Low	56.7	Low	30 Å²	30	102.2 Å²	102.2	15%	0.154	54%	0.539	C	S	.	.			trans	-70	-10.4	162.4	-41	176.9	0	0	0	110.2	F458 H500 N504 L505	F458-I502 HydrophobicContact CB-CD1 3.84Å; H500-I502 VanDerWaalsContact C-N 3.29Å; H500-I502 WeakPolarHBondContact O-CG1 3.29Å; H500-I502 PolarHBondContact O-N 2.87Å; I502-N504 PolarHBondContact O-N 2.85Å; I502-L505 HydrophobicContact CG2-CB 4.49Å; I502-L505 PolarHBondContact O-N 2.83Å; I502-L505 VanDerWaalsContact O-N 3.09Å
503	G	49.2	Very low	60	Low	52 Å²	52	95.9 Å²	95.9	54%	0.536	50%	0.5	S	S	.	.	T	Hydrogen-bonded Turn	trans	-44.7	120	175.9	0	0	0	0	0	112.2	N501 L505	N501-G503 PolarHBondContact O-N 3.22Å; G503-L505 PolarHBondContact O-N 2.76Å
504	N	68.8	Low	63.3	Low	103 Å²	103	88.6 Å²	88.6	55%	0.551	46%	0.461	S	S	*	.	T	Hydrogen-bonded Turn	trans	53	30.6	178.4	-60	43.3	0	0	0	115.1	I502 F506 E507 G518 R519	I502-N504 PolarHBondContact O-N 2.85Å; N504-F506 VanDerWaalsContact C-N 3.26Å; N504-E507 PolarHBondContact ND2-OE1 2.86Å; N504-G518 CarbonylContact O-C 3.52Å; N504-G518 VanDerWaalsContact O-C 3.25Å; N504-G518 VanDerWaalsContact O-CA 3.28Å; N504-G518 WeakPolarHBondContact O-CA 3.39Å; N504-R519 PolarHBondContact O-N 3Å
505	L	84.6	Confident	66.6	Low	2 Å²	2	80.4 Å²	80.4	1%	0.01	42%	0.421	C	S	.	.	S	Bend	trans	-61.1	-40.8	166.5	-175.3	65.8	0	0	0	111.2	I502 G503 G518 R519 M521 I529 I553	I502-L505 HydrophobicContact CG2-CB 4.49Å; I502-L505 PolarHBondContact O-N 2.83Å; I502-L505 VanDerWaalsContact O-N 3.09Å; G503-L505 PolarHBondContact O-N 2.76Å; L505-G518 PolarHBondContact O-N 3.45Å; L505-R519 HydrophobicContact CD1-CG 4.24Å; L505-M521 HydrophobicContact CD1-CG 3.93Å; L505-I529 HydrophobicContact CD2-CD1 3.22Å; L505-I553 HydrophobicContact CD2-CD1 4.22Å
506	F	89.7	Confident	69.9	Low	12 Å²	12	73.2 Å²	73.2	5%	0.053	39%	0.394	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122	141.4	170.6	-57.7	-67.3	0	0	0	110.4	L423 V433 N504 I515 Y516 I529 L531 I551 I553	L423-F506 HydrophobicContact CD1-CE1 3.67Å; L423-F506 HydrophobicContact CD1-CZ 4.02Å; V433-F506 HydrophobicContact CG2-CD1 4Å; V433-F506 HydrophobicContact CG2-CE1 3.92Å; N504-F506 VanDerWaalsContact C-N 3.26Å; F506-I515 HydrophobicContact CB-CG2 4.1Å; F506-I515 HydrophobicContact CD1-CG2 4.36Å; F506-I515 HydrophobicContact CG-CG2 4.45Å; F506-Y516 CarbonylContact C-O 3.25Å; F506-Y516 VanDerWaalsContact CA-O 3.23Å; F506-Y516 WeakPolarHBondContact CA-O 3.47Å; F506-I529 HydrophobicContact CE2-CB 4.47Å; F506-I529 HydrophobicContact CE2-CD1 4.15Å; F506-I529 HydrophobicContact CE2-CG2 4.24Å; F506-L531 HydrophobicContact CD2-CD1 4.27Å; F506-L531 HydrophobicContact CD2-CD2 3.84Å; F506-L531 HydrophobicContact CE2-CD2 4.41Å; F506-I551 HydrophobicContact CD1-CD1 4.31Å; F506-I551 HydrophobicContact CD2-CD1 4.05Å; F506-I551 HydrophobicContact CE1-CD1 3.99Å; F506-I551 HydrophobicContact CE1-CG2 4.48Å; F506-I551 HydrophobicContact CE2-CD1 3.69Å; F506-I551 HydrophobicContact CG-CD1 4.34Å; F506-I551 HydrophobicContact CZ-CB 4.29Å; F506-I551 HydrophobicContact CZ-CD1 3.65Å; F506-I551 HydrophobicContact CZ-CG2 3.82Å; F506-I553 HydrophobicContact CZ-CD1 4.15Å
507	E	89.8	Confident	73.1	Confident	91 Å²	91	63.6 Å²	63.6	43%	0.425	36%	0.357	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	148.9	171.6	-69.9	-179.4	163.2	0	0	108.9	N504 I515 Y516	N504-E507 PolarHBondContact ND2-OE1 2.86Å; E507-I515 CarbonylContact O-C 3.57Å; E507-I515 WeakPolarHBondContact O-CA 3.34Å; E507-Y516 PolarHBondContact N-O 2.99Å; E507-Y516 PolarHBondContact O-N 3.41Å
508	L	92.6	Very high	76	Confident	41 Å²	41	58.4 Å²	58.4	22%	0.215	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	125.1	-177.9	169.7	66.6	0	0	0	108.5	L436 R452 L453 S510 A514 I515	L436-L508 HydrophobicContact CD1-CD1 3.76Å; L436-L508 HydrophobicContact CD1-CD2 4.4Å; L436-L508 HydrophobicContact CG-CD1 4.43Å; R452-L508 VanDerWaalsContact C-CD2 3.46Å; L453-L508 HydrophobicContact CB-CD2 4.15Å; L508-S510 PolarHBondContact O-N 2.96Å; L508-A514 WeakPolarHBondContact CA-O 3.28Å; L508-I515 HydrophobicContact CD1-CG1 3.81Å
509	D	93.6	Very high	78.9	Confident	62 Å²	62	56.5 Å²	56.5	33%	0.332	31%	0.313	S	S	.	.			trans	-74.5	117.6	161.3	176.7	-7.1	0	0	0	108.6	I511 S512 G513 A514	D509-I511 VanDerWaalsContact C-N 3.31Å; D509-I511 PolarHBondContact O-N 3.27Å; D509-I511 PolarHBondContact OD1-N 3.02Å; D509-S512 WeakPolarHBondContact CB-OG 3.2Å; D509-S512 PolarHBondContact OD1-N 3.02Å; D509-S512 VanDerWaalsContact OD1-N 3.14Å; D509-S512 WeakPolarHBondContact OD2-CB 3.35Å; D509-S512 PolarHBondContact OD2-OG 2.92Å; D509-G513 VanDerWaalsContact O-CA 3.24Å; D509-G513 WeakPolarHBondContact O-CA 3.18Å; D509-G513 PolarHBondContact O-N 2.68Å; D509-A514 HydrophobicContact CB-CB 4.3Å; D509-A514 PolarHBondContact N-O 3.1Å
510	S	93	Very high	81.5	Confident	55 Å²	55	56 Å²	56	39%	0.385	31%	0.309	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.5	-19.4	-176.7	58.3	0	0	0	0	114.1	I450 Y451 L508	I450-S510 WeakPolarHBondContact CA-O 3.46Å; Y451-S510 PolarHBondContact N-O 2.65Å; Y451-S510 VanDerWaalsContact O-CA 3.26Å; Y451-S510 WeakPolarHBondContact O-CA 3.38Å; Y451-S510 WeakPolarHBondContact O-CB 3.19Å; L508-S510 PolarHBondContact O-N 2.96Å
511	I	93.3	Very high	83.9	Confident	129 Å²	129	48.9 Å²	48.9	66%	0.662	28%	0.277	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.9	-57	178.9	-57.7	176.4	0	0	0	109.2	D509 G513	D509-I511 VanDerWaalsContact C-N 3.31Å; D509-I511 PolarHBondContact O-N 3.27Å; D509-I511 PolarHBondContact OD1-N 3.02Å; I511-G513 VanDerWaalsContact C-N 3.29Å; I511-G513 PolarHBondContact O-N 2.96Å
512	S	94.5	Very high	86	Confident	48 Å²	48	44.4 Å²	44.4	34%	0.336	26%	0.256	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.2	-21.5	-178.7	75.7	0	0	0	0	113.2	Q435 D509 A514	Q435-S512 PolarHBondContact NE2-O 3.4Å; D509-S512 WeakPolarHBondContact CB-OG 3.2Å; D509-S512 PolarHBondContact OD1-N 3.02Å; D509-S512 VanDerWaalsContact OD1-N 3.14Å; D509-S512 WeakPolarHBondContact OD2-CB 3.35Å; D509-S512 PolarHBondContact OD2-OG 2.92Å; S512-A514 VanDerWaalsContact C-N 3.32Å; S512-A514 WeakPolarHBondContact OG-CB 3.35Å; S512-A514 PolarHBondContact OG-N 2.87Å
513	G	94.6	Very high	87.4	Confident	0 Å²	0	47.5 Å²	47.5	0%	0	27%	0.272	C	S	.	.			trans	79.9	9.5	-174.1	0	0	0	0	0	114.1	Q435 L436 Y451 D509 I511	Q435-G513 PolarHBondContact NE2-O 3.4Å; L436-G513 VanDerWaalsContact CB-O 3.25Å; L436-G513 WeakPolarHBondContact CB-O 3.47Å; L436-G513 VanDerWaalsContact CG-O 3.26Å; L436-G513 WeakPolarHBondContact CG-O 2.92Å; L436-G513 PolarHBondContact N-O 2.73Å; Y451-G513 VanDerWaalsContact CD2-CA 3.41Å; D509-G513 VanDerWaalsContact O-CA 3.24Å; D509-G513 WeakPolarHBondContact O-CA 3.18Å; D509-G513 PolarHBondContact O-N 2.68Å; I511-G513 VanDerWaalsContact C-N 3.29Å; I511-G513 PolarHBondContact O-N 2.96Å
514	A	95.9	Very high	88.9	Confident	0 Å²	0	51.5 Å²	51.5	0%	0	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.6	127.7	-177.2	0	0	0	0	0	112.8	R432 L508 D509 S512 Y516	R432-A514 VanDerWaalsContact CZ-CB 3.42Å; R432-A514 VanDerWaalsContact NH1-CB 3.34Å; R432-A514 VanDerWaalsContact NH2-CB 3.25Å; L508-A514 WeakPolarHBondContact CA-O 3.28Å; D509-A514 HydrophobicContact CB-CB 4.3Å; D509-A514 PolarHBondContact N-O 3.1Å; S512-A514 VanDerWaalsContact C-N 3.32Å; S512-A514 WeakPolarHBondContact OG-CB 3.35Å; S512-A514 PolarHBondContact OG-N 2.87Å; A514-Y516 HydrophobicContact CB-CD2 4.22Å; A514-Y516 HydrophobicContact CB-CE2 3.39Å
515	I	94.4	Very high	89.6	Confident	3 Å²	3	47.2 Å²	47.2	2%	0.015	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.9	131.4	173.4	-59.6	179.4	0	0	0	109.7	R432 V433 A434 L436 F506 E507 L508 L531 L533 L549	R432-I515 CarbonylContact C-O 3.53Å; R432-I515 WeakPolarHBondContact CA-O 3.43Å; V433-I515 HydrophobicContact CB-CB 4.42Å; V433-I515 HydrophobicContact CB-CG2 4.07Å; V433-I515 PolarHBondContact N-O 2.92Å; A434-I515 HydrophobicContact CB-CB 4.11Å; A434-I515 HydrophobicContact CB-CD1 4.24Å; A434-I515 HydrophobicContact CB-CG1 4.4Å; A434-I515 PolarHBondContact N-O 3.32Å; A434-I515 PolarHBondContact O-N 2.86Å; L436-I515 HydrophobicContact CD1-CD1 4.2Å; L436-I515 HydrophobicContact CD1-CG1 4.43Å; L436-I515 HydrophobicContact CD2-CD1 3.89Å; L436-I515 HydrophobicContact CG-CD1 4.08Å; L436-I515 HydrophobicContact CG-CG1 4.26Å; F506-I515 HydrophobicContact CB-CG2 4.1Å; F506-I515 HydrophobicContact CD1-CG2 4.36Å; F506-I515 HydrophobicContact CG-CG2 4.45Å; E507-I515 CarbonylContact O-C 3.57Å; E507-I515 WeakPolarHBondContact O-CA 3.34Å; L508-I515 HydrophobicContact CD1-CG1 3.81Å; I515-L531 HydrophobicContact CD1-CD1 4.08Å; I515-L533 HydrophobicContact CD1-CD1 4.5Å; I515-L533 HydrophobicContact CD1-CD2 4.28Å; I515-L549 HydrophobicContact CD1-CD2 3.94Å
516	Y	94.2	Very high	89.7	Confident	70 Å²	70	49.5 Å²	49.5	28%	0.275	27%	0.272	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	155	-177.9	-62.1	-86	0	0	0	112.5	G430 Y431 R432 F506 E507 A514 G518	G430-Y516 WeakPolarHBondContact O-CD1 3.35Å; Y431-Y516 CarbonylContact O-C 3.56Å; Y431-Y516 VanDerWaalsContact O-CA 3.26Å; Y431-Y516 WeakPolarHBondContact O-CA 3.43Å; R432-Y516 HydrophobicContact CB-CD1 4.1Å; R432-Y516 HydrophobicContact CB-CE1 3.98Å; R432-Y516 HydrophobicContact CG-CE1 4.45Å; R432-Y516 PolarHBondContact NH2-OH 3.35Å; R432-Y516 VanDerWaalsContact NH2-OH 3.09Å; F506-Y516 CarbonylContact C-O 3.25Å; F506-Y516 VanDerWaalsContact CA-O 3.23Å; F506-Y516 WeakPolarHBondContact CA-O 3.47Å; E507-Y516 PolarHBondContact N-O 2.99Å; E507-Y516 PolarHBondContact O-N 3.41Å; A514-Y516 HydrophobicContact CB-CD2 4.22Å; A514-Y516 HydrophobicContact CB-CE2 3.39Å; Y516-G518 PolarHBondContact O-N 3.38Å
517	V	92.3	Very high	89.5	Confident	1 Å²	1	49.4 Å²	49.4	1%	0.006	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.4	109.8	166.3	176.2	0	0	0	0	109.1	V429 G430 Y431 V433 R519 M521	V429-V517 WeakPolarHBondContact CA-O 3.35Å; G430-V517 PolarHBondContact N-O 3.07Å; Y431-V517 HydrophobicContact CD1-CG2 4.36Å; Y431-V517 PolarHBondContact O-N 2.69Å; V433-V517 HydrophobicContact CG2-CG2 3.69Å; V517-R519 WeakPolarHBondContact CG1-O 3.4Å; V517-M521 HydrophobicContact CG1-CE 4.19Å; V517-M521 HydrophobicContact CG1-CG 4.33Å; V517-M521 HydrophobicContact CG2-CE 4.07Å
518	G	87.8	Confident	89.5	Confident	16 Å²	16	45.5 Å²	45.5	17%	0.165	26%	0.257	C	S	.	.			trans	-84.7	-25.9	-174.3	0	0	0	0	0	114.8	N504 L505 Y516	N504-G518 CarbonylContact O-C 3.52Å; N504-G518 VanDerWaalsContact O-C 3.25Å; N504-G518 VanDerWaalsContact O-CA 3.28Å; N504-G518 WeakPolarHBondContact O-CA 3.39Å; L505-G518 PolarHBondContact O-N 3.45Å; Y516-G518 PolarHBondContact O-N 3.38Å
519	R	88	Confident	89.3	Confident	68 Å²	68	43.5 Å²	43.5	26%	0.257	25%	0.247	S	C	.	.	S	Bend	trans	-139.1	158.6	171.9	65	163.1	177.3	79.5	-5.4	112.1	N501 N504 L505 V517 M521 D525	N501-R519 PolarHBondContact O-NH2 2.85Å; N504-R519 PolarHBondContact O-N 3Å; L505-R519 HydrophobicContact CD1-CG 4.24Å; V517-R519 WeakPolarHBondContact CG1-O 3.4Å; R519-M521 PolarHBondContact O-N 2.9Å; R519-D525 IonicContact CZ-OD1 3.4Å; R519-D525 IonicContact CZ-OD2 3.76Å; R519-D525 IonicContact NH1-OD1 2.76Å; R519-D525 PolarHBondContact NH1-OD1 2.95Å; R519-D525 IonicContact NH1-OD2 2.81Å; R519-D525 PolarHBondContact NH1-OD2 3.11Å; R519-D525 IonicContact NH2-OD1 3.77Å; R519-D525 PolarHBondContact NH2-OD1 3.32Å; R519-D525 IonicContact NH2-OD2 3.71Å
520	S	85.9	Confident	89.2	Confident	85 Å²	85	42.6 Å²	42.6	59%	0.594	24%	0.24	S	C	*	.			trans	-54.7	128.7	173.6	54.7	0	0	0	0	110.7
521	M	86.8	Confident	89.2	Confident	21 Å²	21	40 Å²	40	10%	0.103	22%	0.222	C	C	.	.			trans	-78.7	148.2	178	-66.5	-176.4	-78.9	0	0	111	T424 V425 E427 L505 V517 R519 I553	T424-M521 WeakPolarHBondContact O-CE 3.36Å; V425-M521 HydrophobicContact CG2-CB 3.99Å; E427-M521 HydrophobicContact CB-CE 3.66Å; E427-M521 HydrophobicContact CG-CE 4.24Å; L505-M521 HydrophobicContact CD1-CG 3.93Å; V517-M521 HydrophobicContact CG1-CE 4.19Å; V517-M521 HydrophobicContact CG1-CG 4.33Å; V517-M521 HydrophobicContact CG2-CE 4.07Å; R519-M521 PolarHBondContact O-N 2.9Å; M521-I553 HydrophobicContact SD-CD1 3.81Å; M521-I553 HydrophobicContact SD-CG1 4.29Å; M521-I553 HydrophobicContact SD-CG2 4.16Å
522	S	85.2	Confident	89.1	Confident	44 Å²	44	35.3 Å²	35.3	31%	0.308	20%	0.199	S	C	.	.			trans	-123.8	171.3	-177.4	72.8	0	0	0	0	111.5	V425 D524 D525	V425-S522 WeakPolarHBondContact CG2-O 3.2Å; S522-D524 PolarHBondContact O-N 2.66Å; S522-D524 PolarHBondContact OG-N 3.39Å; S522-D525 WeakPolarHBondContact CB-OD2 3.42Å; S522-D525 PolarHBondContact N-OD2 2.99Å; S522-D525 PolarHBondContact O-N 3.19Å; S522-D525 PolarHBondContact OG-OD2 3.22Å
523	I	80.2	Confident	89.2	Confident	95 Å²	95	33 Å²	33	49%	0.487	18%	0.183	S	C	.	.	G	3₁₀ helix	trans	-60	-26.6	175.7	-165.1	62.3	0	0	0	112.6	D525 V526	I523-D525 VanDerWaalsContact C-N 3.35Å; I523-V526 HydrophobicContact CD1-CG2 4.29Å; I523-V526 WeakPolarHBondContact O-CB 3.44Å; I523-V526 PolarHBondContact O-N 3.2Å
524	D	81.5	Confident	89.2	Confident	135 Å²	135	34.4 Å²	34.4	72%	0.722	19%	0.189	S	C	*	.	G	3₁₀ helix	trans	-81.6	-15.5	179.9	-55	-50.2	0	0	0	112.5	S522 V526	S522-D524 PolarHBondContact O-N 2.66Å; S522-D524 PolarHBondContact OG-N 3.39Å; D524-V526 VanDerWaalsContact C-N 3.33Å
525	D	84.1	Confident	89.3	Confident	13 Å²	13	34.4 Å²	34.4	7%	0.07	19%	0.189	C	C	.	.	G	3₁₀ helix	trans	-85.2	-3.5	172.5	-58	-68.7	0	0	0	112.6	R519 S522 I523 G527 I553	R519-D525 IonicContact CZ-OD1 3.4Å; R519-D525 IonicContact CZ-OD2 3.76Å; R519-D525 IonicContact NH1-OD1 2.76Å; R519-D525 PolarHBondContact NH1-OD1 2.95Å; R519-D525 IonicContact NH1-OD2 2.81Å; R519-D525 PolarHBondContact NH1-OD2 3.11Å; R519-D525 IonicContact NH2-OD1 3.77Å; R519-D525 PolarHBondContact NH2-OD1 3.32Å; R519-D525 IonicContact NH2-OD2 3.71Å; S522-D525 WeakPolarHBondContact CB-OD2 3.42Å; S522-D525 PolarHBondContact N-OD2 2.99Å; S522-D525 PolarHBondContact O-N 3.19Å; S522-D525 PolarHBondContact OG-OD2 3.22Å; I523-D525 VanDerWaalsContact C-N 3.35Å; D525-G527 PolarHBondContact O-N 3.19Å; D525-I553 WeakPolarHBondContact O-CD1 3.38Å
526	V	85.3	Confident	89.4	Confident	50 Å²	50	35.3 Å²	35.3	30%	0.303	20%	0.196	S	C	.	.			trans	-72.5	115.4	178.4	175	0	0	0	0	110.1	V425 I523 D524 I553 R555	V425-V526 HydrophobicContact CB-CG2 4.1Å; V425-V526 HydrophobicContact CG2-CG2 3.95Å; I523-V526 HydrophobicContact CD1-CG2 4.29Å; I523-V526 WeakPolarHBondContact O-CB 3.44Å; I523-V526 PolarHBondContact O-N 3.2Å; D524-V526 VanDerWaalsContact C-N 3.33Å; V526-I553 WeakPolarHBondContact CG1-O 3.33Å; V526-I553 HydrophobicContact CG2-CG2 4.5Å; V526-R555 HydrophobicContact CG2-CB 4.36Å
527	G	87.1	Confident	89.5	Confident	10 Å²	10	32.1 Å²	32.1	10%	0.103	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	162.1	-169.5	-174.7	0	0	0	0	0	112.8	D525 I553	D525-G527 PolarHBondContact O-N 3.19Å; G527-I553 PolarHBondContact N-O 3.27Å; G527-I553 PolarHBondContact O-N 2.63Å
528	S	88.4	Confident	89.6	Confident	9 Å²	9	36.4 Å²	36.4	6%	0.063	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.6	121.8	177.9	-65.1	0	0	0	0	110.1	M459 N461 D552	M459-S528 WeakPolarHBondContact CA-O 3.48Å; M459-S528 WeakPolarHBondContact CB-O 3.39Å; M459-S528 PolarHBondContact N-O 3.26Å; M459-S528 PolarHBondContact O-N 3.4Å; N461-S528 PolarHBondContact ND2-OG 3.02Å; N461-S528 VanDerWaalsContact ND2-OG 3.15Å; S528-D552 VanDerWaalsContact CA-OD1 3.29Å; S528-D552 WeakPolarHBondContact CA-OD1 3.43Å; S528-D552 WeakPolarHBondContact CB-OD1 3.15Å; S528-D552 PolarHBondContact OG-OD1 3.01Å
529	I	89.7	Confident	89.8	Confident	0 Å²	0	35.7 Å²	35.7	0%	0	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	128.8	-179.1	-51.3	-169.4	0	0	0	109.1	F458 L505 F506 L531 Q550 I551 I553	F458-I529 HydrophobicContact CD2-CD1 3.67Å; F458-I529 HydrophobicContact CD2-CG1 3.62Å; F458-I529 HydrophobicContact CE2-CD1 3.9Å; F458-I529 HydrophobicContact CE2-CG1 3.95Å; L505-I529 HydrophobicContact CD2-CD1 3.22Å; F506-I529 HydrophobicContact CE2-CB 4.47Å; F506-I529 HydrophobicContact CE2-CD1 4.15Å; F506-I529 HydrophobicContact CE2-CG2 4.24Å; I529-L531 HydrophobicContact CG2-CD2 4.15Å; I529-Q550 CarbonylContact O-C 3.52Å; I529-Q550 WeakPolarHBondContact O-CA 3.5Å; I529-I551 PolarHBondContact N-O 2.81Å; I529-I551 PolarHBondContact O-N 3.32Å; I529-I553 HydrophobicContact CD1-CD1 3.65Å; I529-I553 HydrophobicContact CG1-CD1 4.42Å
530	K	91.1	Very high	90	Very high	42 Å²	42	40.7 Å²	40.7	18%	0.183	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.9	127.2	173.8	-65.6	-175.7	177.7	-171.9	0	110.5	H418 T456 S457 M459 V548 L549 Q550	H418-K530 VanDerWaalsContact CD2-CE 3.49Å; H418-K530 WeakPolarHBondContact CD2-CE 3.37Å; H418-K530 PolarHBondContact CD2-NZ 2.84Å; H418-K530 PolarHBondContact NE2-NZ 2.76Å; T456-K530 WeakPolarHBondContact CA-O 3.31Å; S457-K530 PolarHBondContact N-O 3.5Å; S457-K530 PolarHBondContact O-N 2.65Å; M459-K530 HydrophobicContact SD-CD 3.9Å; M459-K530 WeakPolarHBondContact SD-CE 3.28Å; M459-K530 HydrophobicContact SD-CG 4.48Å; K530-V548 HydrophobicContact CB-CG1 4.18Å; K530-V548 HydrophobicContact CD-CG1 4.27Å; K530-V548 HydrophobicContact CG-CG1 4.41Å; K530-L549 WeakPolarHBondContact CA-O 3.34Å; K530-Q550 HydrophobicContact CG-CB 4.47Å; K530-Q550 HydrophobicContact CG-CG 4.4Å
531	L	91.9	Very high	90.4	Very high	1 Å²	1	41.9 Å²	41.9	1%	0.005	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.8	125.4	170.5	-50.9	-172.1	0	0	0	108.3	L453 T456 F506 I515 I529 L533 V548 L549 I551	L453-L531 HydrophobicContact CD1-CB 3.78Å; L453-L531 HydrophobicContact CD1-CD1 4.36Å; L453-L531 HydrophobicContact CD1-CD2 4.15Å; L453-L531 HydrophobicContact CD1-CG 4.31Å; T456-L531 HydrophobicContact CG2-CD2 3.73Å; F506-L531 HydrophobicContact CD2-CD1 4.27Å; F506-L531 HydrophobicContact CD2-CD2 3.84Å; F506-L531 HydrophobicContact CE2-CD2 4.41Å; I515-L531 HydrophobicContact CD1-CD1 4.08Å; I529-L531 HydrophobicContact CG2-CD2 4.15Å; L531-L533 HydrophobicContact CB-CD2 4.03Å; L531-L533 HydrophobicContact CB-CG 4.3Å; L531-V548 WeakPolarHBondContact O-CA 3.41Å; L531-L549 HydrophobicContact CB-CB 4.46Å; L531-L549 PolarHBondContact N-O 3.11Å; L531-L549 PolarHBondContact O-N 2.96Å; L531-I551 HydrophobicContact CD1-CD1 3.51Å; L531-I551 HydrophobicContact CG-CD1 3.99Å
532	V	93.1	Very high	90.7	Very high	31 Å²	31	43.4 Å²	43.4	19%	0.188	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.1	117.3	166.5	-175.3	0	0	0	0	107.1	V454 Q455	V454-V532 HydrophobicContact CB-CB 4.45Å; V454-V532 HydrophobicContact CB-CG1 4.25Å; V454-V532 PolarHBondContact N-O 3.45Å; Q455-V532 HydrophobicContact CB-CB 3.99Å; Q455-V532 HydrophobicContact CB-CG2 3.99Å; Q455-V532 PolarHBondContact N-O 2.83Å; Q455-V532 PolarHBondContact O-N 3.05Å
533	L	94.7	Very high	91.3	Very high	0 Å²	0	44.3 Å²	44.3	0%	0	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	141.3	-174.2	-54.8	172.1	0	0	0	109.3	W411 P414 L436 R452 L453 I515 L531 H546 R547 L549	W411-L533 HydrophobicContact CH2-CB 3.67Å; W411-L533 HydrophobicContact CH2-CD1 4.49Å; W411-L533 HydrophobicContact CZ2-CB 4Å; P414-L533 HydrophobicContact CG-CD1 4.17Å; L436-L533 HydrophobicContact CD1-CD1 3.98Å; L436-L533 HydrophobicContact CD1-CD2 4.18Å; L436-L533 HydrophobicContact CD1-CG 4.49Å; L436-L533 HydrophobicContact CD2-CD1 3.56Å; L436-L533 HydrophobicContact CG-CD1 4.43Å; R452-L533 WeakPolarHBondContact O-CA 3.36Å; L453-L533 HydrophobicContact CD1-CD2 3.82Å; I515-L533 HydrophobicContact CD1-CD1 4.5Å; I515-L533 HydrophobicContact CD1-CD2 4.28Å; L531-L533 HydrophobicContact CB-CD2 4.03Å; L531-L533 HydrophobicContact CB-CG 4.3Å; L533-H546 CarbonylContact O-C 3.54Å; L533-H546 VanDerWaalsContact O-CA 3.32Å; L533-H546 WeakPolarHBondContact O-CA 2.89Å; L533-R547 PolarHBondContact N-O 3.29Å; L533-R547 PolarHBondContact O-N 2.76Å; L533-L549 HydrophobicContact CD1-CB 3.75Å; L533-L549 HydrophobicContact CD1-CD2 4.2Å
534	E	96.1	Very high	92	Very high	28 Å²	28	43.1 Å²	43.1	13%	0.131	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	131.7	176.4	166.1	178.7	98.8	0	0	107.3	Y451 R452 V454 V544 H546	Y451-E534 CarbonylContact C-O 3.55Å; Y451-E534 WeakPolarHBondContact CA-O 3.34Å; R452-E534 HydrophobicContact CB-CB 4.24Å; R452-E534 HydrophobicContact CB-CG 4.46Å; R452-E534 WeakPolarHBondContact CD-OE1 3.48Å; R452-E534 IonicContact CZ-OE1 2.72Å; R452-E534 PolarHBondContact N-O 2.97Å; R452-E534 IonicContact NE-OE1 3.79Å; R452-E534 IonicContact NH1-OE1 3.21Å; R452-E534 PolarHBondContact NH1-OE1 2.85Å; R452-E534 PolarHBondContact O-N 2.9Å; V454-E534 HydrophobicContact CG2-CB 3.36Å; V454-E534 HydrophobicContact CG2-CG 4.29Å; E534-V544 HydrophobicContact CG-CB 4.38Å; E534-V544 HydrophobicContact CG-CG1 4.3Å; E534-H546 IonicContact OE2-CE1 3.82Å; E534-H546 IonicContact OE2-NE2 2.92Å
535	A	96.9	Very high	92.7	Very high	0 Å²	0	39 Å²	39	0%	0	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113	126.3	164.9	0	0	0	0	0	106	P409 W411 A438 V449 I450 Y451 V544 N545	P409-A535 HydrophobicContact CB-CB 3.88Å; P409-A535 HydrophobicContact CG-CB 4.49Å; W411-A535 HydrophobicContact CD2-CB 4.38Å; W411-A535 HydrophobicContact CH2-CB 3.93Å; W411-A535 HydrophobicContact CZ2-CB 3.5Å; A438-A535 HydrophobicContact CB-CB 4.09Å; V449-A535 HydrophobicContact CG1-CB 4.02Å; I450-A535 WeakPolarHBondContact O-CA 3.47Å; Y451-A535 HydrophobicContact CD1-CB 4.22Å; Y451-A535 HydrophobicContact CE1-CB 4.31Å; A535-V544 CarbonylContact O-C 3.56Å; A535-V544 WeakPolarHBondContact O-CA 3.19Å; A535-N545 PolarHBondContact N-O 3.41Å; A535-N545 PolarHBondContact O-N 2.79Å
536	S	96.7	Very high	93.3	Very high	23 Å²	23	42.5 Å²	42.5	16%	0.161	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	139.9	-177.2	-173.8	0	0	0	0	108.7	V449 I450 K543	V449-S536 CarbonylContact C-O 3.56Å; V449-S536 WeakPolarHBondContact CA-O 3.37Å; I450-S536 PolarHBondContact N-O 2.95Å; I450-S536 PolarHBondContact O-N 3.19Å; S536-K543 VanDerWaalsContact CA-O 3.32Å; S536-K543 WeakPolarHBondContact CA-O 3.49Å
537	D	96.6	Very high	93.7	Very high	3 Å²	3	42.3 Å²	42.3	2%	0.016	22%	0.223	C	C	.	.			trans	-72	179.7	157.7	62.2	69.8	0	0	0	110.7	N405 P409 N446 G539 A542 K543	N405-D537 VanDerWaalsContact ND2-CG 3.31Å; N405-D537 PolarHBondContact ND2-OD1 2.96Å; N405-D537 PolarHBondContact ND2-OD2 2.77Å; P409-D537 HydrophobicContact CG-CB 4.44Å; N446-D537 WeakPolarHBondContact O-CB 3.32Å; D537-G539 WeakPolarHBondContact OD1-CA 3.33Å; D537-G539 PolarHBondContact OD1-N 3.1Å; D537-A542 WeakPolarHBondContact OD1-CA 3.2Å; D537-K543 PolarHBondContact N-O 3.12Å; D537-K543 PolarHBondContact OD1-N 2.96Å; D537-K543 VanDerWaalsContact OD2-CA 3.23Å; D537-K543 WeakPolarHBondContact OD2-CA 3.25Å; D537-K543 VanDerWaalsContact OD2-CB 3.22Å; D537-K543 WeakPolarHBondContact OD2-CB 3.47Å; D537-K543 PolarHBondContact OD2-N 2.75Å; D537-K543 VanDerWaalsContact OD2-O 3.07Å
538	R	95.2	Very high	94.1	Very high	90 Å²	90	43.2 Å²	43.2	34%	0.34	23%	0.227	S	C	.	.	S	Bend	trans	-107.7	6.5	171.7	-62.8	172.4	58.7	-174.7	-22.4	113	E445 E448 I450 H540	E445-R538 HydrophobicContact CB-CB 4.25Å; E445-R538 CarbonylContact O-C 3.54Å; E445-R538 WeakPolarHBondContact O-CA 3.45Å; E445-R538 WeakPolarHBondContact O-CB 3.08Å; E445-R538 PolarHBondContact O-N 2.74Å; E445-R538 IonicContact OE1-CZ 3.59Å; E445-R538 IonicContact OE1-NH2 3.54Å; E445-R538 PolarHBondContact OE1-NH2 2.88Å; E448-R538 HydrophobicContact CB-CG 4.48Å; E448-R538 PolarHBondContact O-N 2.91Å; E448-R538 WeakPolarHBondContact OE1-CD 3.34Å; E448-R538 IonicContact OE1-CZ 3.79Å; E448-R538 IonicContact OE1-NE 3.91Å; E448-R538 IonicContact OE1-NH1 3.58Å; E448-R538 PolarHBondContact OE1-NH1 2.68Å; E448-R538 WeakPolarHBondContact OE2-CD 3.39Å; E448-R538 IonicContact OE2-CZ 3.76Å; E448-R538 IonicContact OE2-NE 3.71Å; E448-R538 IonicContact OE2-NH1 3.34Å; E448-R538 PolarHBondContact OE2-NH1 3.42Å; I450-R538 HydrophobicContact CD1-CG 3.6Å; I450-R538 HydrophobicContact CG1-CG 3.98Å; R538-H540 PolarHBondContact O-ND1 2.96Å
539	G	92.3	Very high	94.3	Very high	2 Å²	2	42.8 Å²	42.8	2%	0.021	22%	0.224	C	C	.	.	S	Bend	trans	-64.9	174.6	179	0	0	0	0	0	113.1	E445 N446 D537 P541 A542	E445-G539 PolarHBondContact O-N 2.9Å; N446-G539 WeakPolarHBondContact OD1-CA 3.46Å; D537-G539 WeakPolarHBondContact OD1-CA 3.33Å; D537-G539 PolarHBondContact OD1-N 3.1Å; G539-P541 CarbonylContact O-C 3.58Å; G539-A542 WeakPolarHBondContact O-CA 3.34Å; G539-A542 WeakPolarHBondContact O-CB 3.16Å; G539-A542 PolarHBondContact O-N 3.4Å
540	H	91.1	Very high	94.5	Very high	173 Å²	173	44 Å²	44	80%	0.801	23%	0.23	S	C	*	.	S	Bend	trans	-135.4	106.3	-173.4	-81.2	63.6	0	0	0	111	R538	R538-H540 PolarHBondContact O-ND1 2.96Å
541	P	93.9	Very high	94.6	Very high	109 Å²	109	42 Å²	42	71%	0.708	22%	0.221	S	C	*	.	S	Bend	cis	-72.8	139.2	0.8	31.6	-35.2	0	0	0	112.3	N405 G539	N405-P541 PolarHBondContact ND2-O 2.71Å; G539-P541 CarbonylContact O-C 3.58Å
542	A	94.7	Very high	94.6	Very high	54 Å²	54	42.9 Å²	42.9	45%	0.446	23%	0.226	S	C	.	.			trans	-67.6	140.8	178.7	0	0	0	0	0	111.7	D537 G539	D537-A542 WeakPolarHBondContact OD1-CA 3.2Å; G539-A542 WeakPolarHBondContact O-CA 3.34Å; G539-A542 WeakPolarHBondContact O-CB 3.16Å; G539-A542 PolarHBondContact O-N 3.4Å
543	K	96	Very high	94.5	Very high	62 Å²	62	41.5 Å²	41.5	27%	0.27	22%	0.217	S	C	.	.			trans	-107.5	150.8	175.5	-43.9	-152.5	-142.1	-175.1	0	110.3	N405 D406 N407 S536 D537	N405-K543 WeakPolarHBondContact O-CE 3.26Å; N405-K543 PolarHBondContact O-NZ 2.6Å; D406-K543 PolarHBondContact O-NZ 3.15Å; N407-K543 WeakPolarHBondContact O-CD 3.48Å; N407-K543 WeakPolarHBondContact O-CE 3.44Å; N407-K543 PolarHBondContact O-NZ 3.35Å; S536-K543 VanDerWaalsContact CA-O 3.32Å; S536-K543 WeakPolarHBondContact CA-O 3.49Å; D537-K543 PolarHBondContact N-O 3.12Å; D537-K543 PolarHBondContact OD1-N 2.96Å; D537-K543 VanDerWaalsContact OD2-CA 3.23Å; D537-K543 WeakPolarHBondContact OD2-CA 3.25Å; D537-K543 VanDerWaalsContact OD2-CB 3.22Å; D537-K543 WeakPolarHBondContact OD2-CB 3.47Å; D537-K543 PolarHBondContact OD2-N 2.75Å; D537-K543 VanDerWaalsContact OD2-O 3.07Å
544	V	96	Very high	94.2	Very high	70 Å²	70	46.2 Å²	46.2	42%	0.424	24%	0.238	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.2	135	-168.7	-65.2	0	0	0	0	111.2	E534 A535	E534-V544 HydrophobicContact CG-CB 4.38Å; E534-V544 HydrophobicContact CG-CG1 4.3Å; A535-V544 CarbonylContact O-C 3.56Å; A535-V544 WeakPolarHBondContact O-CA 3.19Å
545	N	96.1	Very high	93.5	Very high	48 Å²	48	51.9 Å²	51.9	26%	0.257	26%	0.258	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	136.9	175.9	-161.2	-11.4	0	0	0	110.1	P409 W411 A535	P409-N545 WeakPolarHBondContact O-CB 3.2Å; P409-N545 PolarHBondContact O-ND2 3.18Å; W411-N545 VanDerWaalsContact NE1-C 3.27Å; W411-N545 PolarHBondContact NE1-O 2.68Å; A535-N545 PolarHBondContact N-O 3.41Å; A535-N545 PolarHBondContact O-N 2.79Å
546	H	95.6	Very high	92	Very high	88 Å²	88	60.4 Å²	60.4	41%	0.407	29%	0.292	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	139.2	-170.5	-71.5	67.4	0	0	0	112.2	L533 E534	L533-H546 CarbonylContact O-C 3.54Å; L533-H546 VanDerWaalsContact O-CA 3.32Å; L533-H546 WeakPolarHBondContact O-CA 2.89Å; E534-H546 IonicContact OE2-CE1 3.82Å; E534-H546 IonicContact OE2-NE2 2.92Å
547	R	95	Very high	90	Very high	45 Å²	45	66.8 Å²	66.8	17%	0.17	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.4	148.9	174.9	-141	71.9	150.2	-157.8	-16.5	111.5	W411 P414 A415 N417 L533	W411-R547 HydrophobicContact CD2-CB 3.84Å; W411-R547 HydrophobicContact CD2-CG 4.27Å; W411-R547 HydrophobicContact CE3-CB 4.34Å; W411-R547 HydrophobicContact CG-CB 4.15Å; W411-R547 HydrophobicContact CG-CG 4.22Å; W411-R547 HydrophobicContact CH2-CB 4.49Å; W411-R547 HydrophobicContact CZ2-CB 3.99Å; W411-R547 PolarHBondContact O-NH2 3.42Å; P414-R547 HydrophobicContact CB-CG 4.04Å; P414-R547 HydrophobicContact CG-CB 4.45Å; P414-R547 HydrophobicContact CG-CG 4Å; P414-R547 VanDerWaalsContact O-CZ 3.23Å; P414-R547 PolarHBondContact O-NE 2.96Å; P414-R547 PolarHBondContact O-NH2 3.07Å; A415-R547 PolarHBondContact O-NH2 3.34Å; N417-R547 WeakPolarHBondContact OD1-CA 3.14Å; L533-R547 PolarHBondContact N-O 3.29Å; L533-R547 PolarHBondContact O-N 2.76Å
548	V	94.1	Very high	87.5	Confident	29 Å²	29	71 Å²	71	18%	0.176	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	118	170.5	-176.4	0	0	0	0	109.1	N417 H418 K530 L531	N417-V548 PolarHBondContact OD1-N 3Å; H418-V548 PolarHBondContact N-O 3.03Å; K530-V548 HydrophobicContact CB-CG1 4.18Å; K530-V548 HydrophobicContact CD-CG1 4.27Å; K530-V548 HydrophobicContact CG-CG1 4.41Å; L531-V548 WeakPolarHBondContact O-CA 3.41Å
549	L	94.3	Very high	84.5	Confident	0 Å²	0	75.9 Å²	75.9	0%	0	38%	0.379	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100	138.9	170	-179.5	63.7	0	0	0	108.9	P414 I421 A434 I515 K530 L531 L533 I551	P414-L549 HydrophobicContact CB-CD1 4.31Å; P414-L549 HydrophobicContact CG-CB 4.03Å; P414-L549 HydrophobicContact CG-CD1 3.99Å; P414-L549 HydrophobicContact CG-CG 4.45Å; I421-L549 HydrophobicContact CD1-CD1 3.89Å; I421-L549 HydrophobicContact CD1-CD2 4.02Å; I421-L549 HydrophobicContact CD1-CG 4.42Å; I421-L549 HydrophobicContact CG1-CD1 4.09Å; A434-L549 HydrophobicContact CB-CD2 4.43Å; I515-L549 HydrophobicContact CD1-CD2 3.94Å; K530-L549 WeakPolarHBondContact CA-O 3.34Å; L531-L549 HydrophobicContact CB-CB 4.46Å; L531-L549 PolarHBondContact N-O 3.11Å; L531-L549 PolarHBondContact O-N 2.96Å; L533-L549 HydrophobicContact CD1-CB 3.75Å; L533-L549 HydrophobicContact CD1-CD2 4.2Å; L549-I551 HydrophobicContact CG-CG1 4.47Å
550	Q	93.4	Very high	81.7	Confident	26 Å²	26	81.6 Å²	81.6	12%	0.121	41%	0.414	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	135.4	171.3	-176.4	170.5	-45.3	0	0	109.7	Q419 I420 I421 I529 K530 D552	Q419-Q550 PolarHBondContact O-N 2.87Å; I420-Q550 CarbonylContact C-O 3.52Å; I420-Q550 WeakPolarHBondContact CA-O 3.34Å; I420-Q550 HydrophobicContact CG1-CB 4.27Å; I420-Q550 HydrophobicContact CG1-CG 4.45Å; I421-Q550 PolarHBondContact N-O 3.14Å; I529-Q550 CarbonylContact O-C 3.52Å; I529-Q550 WeakPolarHBondContact O-CA 3.5Å; K530-Q550 HydrophobicContact CG-CB 4.47Å; K530-Q550 HydrophobicContact CG-CG 4.4Å; Q550-D552 PolarHBondContact NE2-OD1 2.86Å; Q550-D552 PolarHBondContact NE2-OD2 2.96Å
551	I	92.5	Very high	78.8	Confident	0 Å²	0	78.8 Å²	78.8	0%	0	41%	0.414	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	114.5	175.3	-59.9	166.4	0	0	0	107.2	I421 L423 V433 F506 I529 L531 L549 I553	I421-I551 CarbonylContact O-C 3.59Å; I421-I551 VanDerWaalsContact O-CA 3.29Å; I421-I551 WeakPolarHBondContact O-CA 3.49Å; L423-I551 HydrophobicContact CB-CG2 4.4Å; L423-I551 HydrophobicContact CD1-CG2 3.57Å; L423-I551 HydrophobicContact CG-CG2 3.82Å; V433-I551 HydrophobicContact CG1-CD1 3.92Å; V433-I551 HydrophobicContact CG1-CG1 4.35Å; F506-I551 HydrophobicContact CD1-CD1 4.31Å; F506-I551 HydrophobicContact CD2-CD1 4.05Å; F506-I551 HydrophobicContact CE1-CD1 3.99Å; F506-I551 HydrophobicContact CE1-CG2 4.48Å; F506-I551 HydrophobicContact CE2-CD1 3.69Å; F506-I551 HydrophobicContact CG-CD1 4.34Å; F506-I551 HydrophobicContact CZ-CB 4.29Å; F506-I551 HydrophobicContact CZ-CD1 3.65Å; F506-I551 HydrophobicContact CZ-CG2 3.82Å; I529-I551 PolarHBondContact N-O 2.81Å; I529-I551 PolarHBondContact O-N 3.32Å; L531-I551 HydrophobicContact CD1-CD1 3.51Å; L531-I551 HydrophobicContact CG-CD1 3.99Å; L549-I551 HydrophobicContact CG-CG1 4.47Å; I551-I553 HydrophobicContact CG2-CG1 4.21Å
552	D	92.2	Very high	75.9	Confident	20 Å²	20	77.9 Å²	77.9	11%	0.107	42%	0.416	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.7	112.4	175.6	-69.9	-17.1	0	0	0	108.8	I420 I421 N422 L423 S528 Q550 F554	I420-D552 HydrophobicContact CG2-CB 4.2Å; I420-D552 WeakPolarHBondContact CG2-OD2 3.02Å; I421-D552 PolarHBondContact O-N 3.35Å; N422-D552 WeakPolarHBondContact CA-O 3.22Å; L423-D552 PolarHBondContact N-O 3.14Å; S528-D552 VanDerWaalsContact CA-OD1 3.29Å; S528-D552 WeakPolarHBondContact CA-OD1 3.43Å; S528-D552 WeakPolarHBondContact CB-OD1 3.15Å; S528-D552 PolarHBondContact OG-OD1 3.01Å; Q550-D552 PolarHBondContact NE2-OD1 2.86Å; Q550-D552 PolarHBondContact NE2-OD2 2.96Å; D552-F554 HydrophobicContact CB-CD2 4.32Å; D552-F554 HydrophobicContact CB-CE1 4.49Å; D552-F554 HydrophobicContact CB-CE2 3.4Å; D552-F554 HydrophobicContact CB-CZ 3.51Å; D552-F554 VanDerWaalsContact O-CD2 3.3Å; D552-F554 WeakPolarHBondContact O-CD2 3.3Å; D552-F554 WeakPolarHBondContact O-CE2 3.36Å
553	I	90.8	Very high	72.7	Confident	2 Å²	2	86.3 Å²	86.3	1%	0.01	44%	0.438	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.2	118.6	179.3	-59.8	172.3	0	0	0	108.4	L423 V425 L505 F506 M521 D525 V526 G527 I529 I551	L423-I553 HydrophobicContact CB-CG1 4.32Å; V425-I553 HydrophobicContact CB-CG2 4.22Å; L505-I553 HydrophobicContact CD2-CD1 4.22Å; F506-I553 HydrophobicContact CZ-CD1 4.15Å; M521-I553 HydrophobicContact SD-CD1 3.81Å; M521-I553 HydrophobicContact SD-CG1 4.29Å; M521-I553 HydrophobicContact SD-CG2 4.16Å; D525-I553 WeakPolarHBondContact O-CD1 3.38Å; V526-I553 WeakPolarHBondContact CG1-O 3.33Å; V526-I553 HydrophobicContact CG2-CG2 4.5Å; G527-I553 PolarHBondContact N-O 3.27Å; G527-I553 PolarHBondContact O-N 2.63Å; I529-I553 HydrophobicContact CD1-CD1 3.65Å; I529-I553 HydrophobicContact CG1-CD1 4.42Å; I551-I553 HydrophobicContact CG2-CG1 4.21Å
554	F	88.4	Confident	69.5	Low	99 Å²	99	91.3 Å²	91.3	43%	0.434	47%	0.466	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	158.1	-179.5	-59.2	-82.4	0	0	0	112.4	N422 L423 T424 V425 D552	N422-F554 HydrophobicContact CB-CD2 4.28Å; N422-F554 HydrophobicContact CB-CE2 4.03Å; L423-F554 PolarHBondContact O-N 2.99Å; T424-F554 CarbonylContact C-O 3.58Å; T424-F554 WeakPolarHBondContact CA-O 3.11Å; V425-F554 PolarHBondContact N-O 2.76Å; D552-F554 HydrophobicContact CB-CD2 4.32Å; D552-F554 HydrophobicContact CB-CE1 4.49Å; D552-F554 HydrophobicContact CB-CE2 3.4Å; D552-F554 HydrophobicContact CB-CZ 3.51Å; D552-F554 VanDerWaalsContact O-CD2 3.3Å; D552-F554 WeakPolarHBondContact O-CD2 3.3Å; D552-F554 WeakPolarHBondContact O-CE2 3.36Å
555	R	82	Confident	66.6	Low	147 Å²	147	96.1 Å²	96.1	56%	0.555	49%	0.489	S	S	*	.			trans	-116.5	117.3	167.4	-175.4	174.3	-174.6	-156.1	2.8	110	V425 V526 L557	V425-R555 HydrophobicContact CG1-CB 3.83Å; V425-R555 HydrophobicContact CG1-CG 3.77Å; V526-R555 HydrophobicContact CG2-CB 4.36Å; R555-L557 PolarHBondContact O-N 3.28Å
556	Y	65.3	Low	63.7	Low	179 Å²	179	99.5 Å²	99.5	70%	0.702	52%	0.516	S	S	*	.			trans	-66.2	117.6	168.6	-72.7	-67.6	0	0	0	110.1	T424 S558	T424-Y556 HydrophobicContact CG2-CD2 3.89Å; T424-Y556 HydrophobicContact CG2-CE2 3.55Å; Y556-S558 PolarHBondContact O-N 3.24Å
557	L	55.4	Low	60.7	Low	157 Å²	157	103.4 Å²	103.4	82%	0.822	54%	0.535	S	S	*	.			trans	-73.1	111.6	165.2	-76.1	164.8	0	0	0	108.2	R555 Q559	R555-L557 PolarHBondContact O-N 3.28Å; L557-Q559 PolarHBondContact O-N 3.44Å
558	S	42.8	Very low	57.7	Low	91 Å²	91	107.6 Å²	107.6	64%	0.636	56%	0.56	S	S	*	*			trans	-65.1	115.1	177.6	51	0	0	0	0	110.6	Y556 T560	Y556-S558 PolarHBondContact O-N 3.24Å; S558-T560 VanDerWaalsContact C-N 3.26Å; S558-T560 PolarHBondContact O-N 3.46Å; S558-T560 PolarHBondContact O-OG1 2.94Å
559	Q	33.3	Very low	54.9	Low	193 Å²	193	113.8 Å²	113.8	90%	0.902	59%	0.592	S	S	*	*			trans	-67.3	82.2	176.8	-71.6	-172.8	-9.4	0	0	111.2	L557	L557-Q559 PolarHBondContact O-N 3.44Å
560	T	32.1	Very low	52	Low	121 Å²	121	116.9 Å²	116.9	74%	0.742	63%	0.625	S	S	*	*			trans	-132.3	29.2	-179	40	0	0	0	0	111	S558	S558-T560 VanDerWaalsContact C-N 3.26Å; S558-T560 PolarHBondContact O-N 3.46Å; S558-T560 PolarHBondContact O-OG1 2.94Å
561	S	31.7	Very low	49.2	Very low	114 Å²	114	123.3 Å²	123.3	80%	0.797	66%	0.66	S	S	*	*	S	Bend	trans	-149.3	46.1	-178.4	65.1	0	0	0	0	112
562	A	31.7	Very low	46.3	Very low	91 Å²	91	129 Å²	129	75%	0.752	70%	0.695	S	S	*	*			trans	-142.1	36.6	-179.3	0	0	0	0	0	113.1
563	Y	28	Very low	43.6	Very low	231 Å²	231	134.8 Å²	134.8	91%	0.906	73%	0.73	S	S	*	*			trans	-125.6	101.6	169.5	-95.4	-82.8	0	0	0	109.5
564	L	29.5	Very low	40.9	Very low	167 Å²	167	137.6 Å²	137.6	87%	0.874	76%	0.76	S	S	*	*			trans	162.1	144.6	152.2	-91.3	163	0	0	0	109
565	L	35.1	Very low	38.2	Very low	171 Å²	171	140 Å²	140	90%	0.895	78%	0.782	S	S	*	*			trans	69.5	133.7	-175.3	-45.3	175	0	0	0	114
566	S	34.4	Very low	35.8	Very low	119 Å²	119	138 Å²	138	83%	0.832	79%	0.791	S	S	*	*			cis	-156	160	-12.3	-172.2	0	0	0	0	109.6
567	E	32.1	Very low	34.1	Very low	170 Å²	170	137.5 Å²	137.5	79%	0.794	80%	0.795	S	S	*	*			trans	-92.2	160.5	179.3	-65.2	176.8	117.1	0	0	114.3
568	N	33.5	Very low	32.9	Very low	132 Å²	132	138.1 Å²	138.1	71%	0.706	79%	0.793	S	S	*	*			trans	84.1	139.1	149.3	-65.5	-11	0	0	0	124.3
569	D	34.5	Very low	32.4	Very low	159 Å²	159	139.2 Å²	139.2	85%	0.85	79%	0.792	S	S	*	*			trans	60.4	138.3	154.8	-51	-21.8	0	0	0	121.5
570	G	33.3	Very low	32.2	Very low	66 Å²	66	139 Å²	139	68%	0.68	78%	0.783	S	S	*	*			cis	167.9	146.2	-8.4	0	0	0	0	0	114.2
571	D	33.9	Very low	32	Very low	160 Å²	160	141 Å²	141	86%	0.856	78%	0.784	S	S	*	*			trans	59.5	155.6	164.6	-68	-9.3	0	0	0	120.5
572	T	33.3	Very low	31.7	Very low	121 Å²	121	145.4 Å²	145.4	74%	0.742	79%	0.789	S	S	*	*			cis	-167.6	173.4	-22.1	36.1	0	0	0	0	106.7
573	V	33.9	Very low	31.6	Very low	140 Å²	140	146 Å²	146	85%	0.848	79%	0.787	S	S	*	*			cis	-160.7	164	-5.7	111.8	0	0	0	0	108.7
574	G	34.6	Very low	31.6	Very low	61 Å²	61	141.6 Å²	141.6	63%	0.629	79%	0.785	S	S	*	*			trans	137.6	93.9	146.1	0	0	0	0	0	121.8
575	V	31.2	Very low	31.9	Very low	150 Å²	150	139.3 Å²	139.3	91%	0.909	78%	0.778	S	S	*	*				42.7	132.6	122.7	-176.6	0	0	0	0	119.5
576	S	32	Very low	31.9	Very low	105 Å²	105	137.3 Å²	137.3	73%	0.734	77%	0.772	S	S	*	*			cis	-152.6	164	13	51.3	0	0	0	0	115.2
577	E	29.5	Very low	31.7	Very low	168 Å²	168	134.9 Å²	134.9	79%	0.785	77%	0.766	S	S	*	*			trans	-26	137.8	165.2	-44.5	174.2	133	0	0	119.6
578	H	30.3	Very low	31.6	Very low	170 Å²	170	135.2 Å²	135.2	79%	0.787	77%	0.767	S	S	*	*				-172.5	169	96.7	-118.6	60.2	0	0	0	113.4
579	D	33.5	Very low	31.4	Very low	114 Å²	114	132.4 Å²	132.4	61%	0.61	77%	0.77	S	S	*	*			trans	65.8	110.9	170.9	-105.3	-48.5	0	0	0	121.5
580	R	28	Very low	31.3	Very low	189 Å²	189	127.8 Å²	127.8	71%	0.713	75%	0.754	S	S	*	*			trans	58.1	114.8	136.2	-79.8	178.7	171.3	98.3	-8.1	123.9
581	Q	27.3	Very low	31.4	Very low	164 Å²	164	135.7 Å²	135.7	77%	0.766	76%	0.764	S	S	*	*				78.3	133.6	125.4	-67.7	178.4	-53.4	0	0	121.1
582	K	27.1	Very low	31.7	Very low	205 Å²	205	135.1 Å²	135.1	89%	0.891	76%	0.761	S	S	*	*			trans	58.1	82.6	160.7	-66.6	-175.3	174.8	-176.6	0	117.7
583	S	28.9	Very low	32.4	Very low	104 Å²	104	136.6 Å²	136.6	73%	0.727	76%	0.759	S	S	*	*				-175	121.2	113.4	-171.5	0	0	0	0	111.6
584	T	28.2	Very low	33.1	Very low	139 Å²	139	135.7 Å²	135.7	85%	0.853	75%	0.75	S	S	*	*			trans	-133.7	74.1	165.9	30.2	0	0	0	0	109.1	V586	T584-V586 PolarHBondContact O-N 2.84Å
585	V	35	Very low	34	Very low	119 Å²	119	138.2 Å²	138.2	72%	0.721	75%	0.748	S	S	*	*			trans	-85.7	99.9	167.4	179.8	0	0	0	0	108
586	V	34.6	Very low	35.5	Very low	129 Å²	129	136.7 Å²	136.7	78%	0.782	74%	0.735	S	S	*	*			trans	-84	153.5	169.8	177.1	0	0	0	0	109.2	T584	T584-V586 PolarHBondContact O-N 2.84Å
587	G	31.7	Very low	37.3	Very low	68 Å²	68	136.4 Å²	136.4	70%	0.701	72%	0.724	S	S	*	*			trans	-43.7	147.9	-164.3	0	0	0	0	0	118.4	G589	G587-G589 PolarHBondContact O-N 3.34Å
588	H	29.3	Very low	39.1	Very low	176 Å²	176	132.4 Å²	132.4	82%	0.815	71%	0.711	S	S	*	*			trans	-67.8	84.4	174.4	-83.4	32.2	0	0	0	112.5	A590	H588-A590 VanDerWaalsContact C-N 3.3Å; H588-A590 HydrophobicContact CB-CB 4.38Å; H588-A590 PolarHBondContact O-N 2.89Å
589	G	30	Very low	41.1	Very low	74 Å²	74	129 Å²	129	76%	0.763	70%	0.698	S	S	*	*			trans	-88.9	65.3	152.1	0	0	0	0	0	110	G587	G587-G589 PolarHBondContact O-N 3.34Å
590	A	30.9	Very low	43.3	Very low	62 Å²	62	127.9 Å²	127.9	51%	0.512	69%	0.694	S	S	.	*			trans	-124.1	49.5	-160.9	0	0	0	0	0	114.7	H588	H588-A590 VanDerWaalsContact C-N 3.3Å; H588-A590 HydrophobicContact CB-CB 4.38Å; H588-A590 PolarHBondContact O-N 2.89Å
591	Y	35.7	Very low	45.9	Very low	231 Å²	231	123.4 Å²	123.4	91%	0.906	68%	0.684	S	S	*	*	S	Bend	trans	-132.7	80.3	164.4	-80.8	-79.6	0	0	0	109.4
592	L	40.3	Very low	48.4	Very low	149 Å²	149	121 Å²	121	78%	0.78	67%	0.674	S	S	*	*	S	Bend	trans	174.1	-22.1	154.2	-99.4	157.4	0	0	0	114.1
593	E	48.1	Very low	51.4	Low	151 Å²	151	114.8 Å²	114.8	71%	0.706	65%	0.653	S	S	*	*	H	α-helix	trans	-81.4	-27	-171	-66.5	-166.8	129.2	0	0	115.4	L596 I597	E593-L596 PolarHBondContact O-N 3.31Å; E593-I597 PolarHBondContact O-N 3.45Å
594	N	48.2	Very low	54.1	Low	122 Å²	122	111.9 Å²	111.9	65%	0.652	64%	0.635	S	S	*	*	H	α-helix	trans	-68.1	-38.8	-178.6	-74	-8.4	0	0	0	112.6	L596 I597 V598	N594-L596 VanDerWaalsContact C-N 3.3Å; N594-L596 PolarHBondContact O-N 2.93Å; N594-I597 PolarHBondContact O-N 3.23Å; N594-V598 WeakPolarHBondContact O-CG2 3.09Å; N594-V598 PolarHBondContact O-N 2.9Å
595	D	54.6	Low	57.1	Low	113 Å²	113	108.4 Å²	108.4	60%	0.604	61%	0.613	S	S	*	*	H	α-helix	trans	-64	-37.7	175.9	-70	-23.4	0	0	0	111.2	I597 V598 I599	D595-I597 VanDerWaalsContact C-N 3.34Å; D595-I597 PolarHBondContact O-N 2.83Å; D595-V598 PolarHBondContact O-N 2.94Å; D595-I599 VanDerWaalsContact O-CB 3.26Å; D595-I599 WeakPolarHBondContact O-CB 3.48Å; D595-I599 WeakPolarHBondContact O-CD1 3.24Å; D595-I599 WeakPolarHBondContact O-CG1 3.16Å; D595-I599 PolarHBondContact O-N 3.33Å
596	L	61.7	Low	59.8	Low	118 Å²	118	106.2 Å²	106.2	62%	0.618	60%	0.6	S	S	*	*	H	α-helix	trans	-64.3	-39.7	176.5	-166.2	72.1	0	0	0	111.4	E593 N594 V600	E593-L596 PolarHBondContact O-N 3.31Å; N594-L596 VanDerWaalsContact C-N 3.3Å; N594-L596 PolarHBondContact O-N 2.93Å; L596-V600 VanDerWaalsContact O-CB 3.29Å; L596-V600 WeakPolarHBondContact O-CB 3.4Å; L596-V600 WeakPolarHBondContact O-CG2 3.41Å; L596-V600 PolarHBondContact O-N 3.27Å
597	I	69.4	Low	62.6	Low	100 Å²	100	105.4 Å²	105.4	51%	0.513	59%	0.591	S	S	.	*	H	α-helix	trans	-66.7	-44.7	176	-66.9	170.4	0	0	0	110.8	E593 N594 D595 V600 I601	E593-I597 PolarHBondContact O-N 3.45Å; N594-I597 PolarHBondContact O-N 3.23Å; D595-I597 VanDerWaalsContact C-N 3.34Å; D595-I597 PolarHBondContact O-N 2.83Å; I597-V600 PolarHBondContact O-N 2.63Å; I597-I601 HydrophobicContact CG2-CD1 3.81Å; I597-I601 WeakPolarHBondContact O-CB 3.48Å; I597-I601 VanDerWaalsContact O-CG1 3.27Å; I597-I601 WeakPolarHBondContact O-CG1 3.48Å; I597-I601 PolarHBondContact O-N 3.21Å
598	V	68.1	Low	65.5	Low	83 Å²	83	106.8 Å²	106.8	50%	0.503	58%	0.581	S	S	.	*	H	α-helix	trans	-64	-43.4	177	173.3	0	0	0	0	111.2	N594 D595 I601 M602	N594-V598 WeakPolarHBondContact O-CG2 3.09Å; N594-V598 PolarHBondContact O-N 2.9Å; D595-V598 PolarHBondContact O-N 2.94Å; V598-I601 PolarHBondContact O-N 3.47Å; V598-M602 HydrophobicContact CG1-CG 4.29Å; V598-M602 WeakPolarHBondContact O-CB 3.28Å; V598-M602 WeakPolarHBondContact O-CG 3.44Å; V598-M602 PolarHBondContact O-N 2.84Å
599	I	73.5	Confident	68.5	Low	100 Å²	100	102.8 Å²	102.8	51%	0.513	57%	0.565	S	S	.	*	H	α-helix	trans	-63.5	-43.8	175.9	-70.1	164.9	0	0	0	110.8	D595 I601 M602 V603	D595-I599 VanDerWaalsContact O-CB 3.26Å; D595-I599 WeakPolarHBondContact O-CB 3.48Å; D595-I599 WeakPolarHBondContact O-CD1 3.24Å; D595-I599 WeakPolarHBondContact O-CG1 3.16Å; D595-I599 PolarHBondContact O-N 3.33Å; I599-I601 VanDerWaalsContact C-N 3.33Å; I599-I601 PolarHBondContact O-N 3.06Å; I599-M602 PolarHBondContact O-N 2.91Å; I599-V603 HydrophobicContact CG2-CG2 4.31Å; I599-V603 WeakPolarHBondContact O-CB 3.3Å; I599-V603 VanDerWaalsContact O-CG2 3.27Å; I599-V603 WeakPolarHBondContact O-CG2 3.1Å; I599-V603 PolarHBondContact O-N 2.99Å
600	V	79.5	Confident	71.4	Confident	89 Å²	89	101.9 Å²	101.9	54%	0.539	55%	0.547	S	S	.	.	H	α-helix	trans	-64.1	-37.8	176.3	166.6	0	0	0	0	111.4	L596 I597 A604	L596-V600 VanDerWaalsContact O-CB 3.29Å; L596-V600 WeakPolarHBondContact O-CB 3.4Å; L596-V600 WeakPolarHBondContact O-CG2 3.41Å; L596-V600 PolarHBondContact O-N 3.27Å; I597-V600 PolarHBondContact O-N 2.63Å; V600-A604 VanDerWaalsContact O-CB 3.23Å; V600-A604 WeakPolarHBondContact O-CB 3.17Å; V600-A604 PolarHBondContact O-N 3.27Å
601	I	81.8	Confident	74.4	Confident	96 Å²	96	103.8 Å²	103.8	49%	0.492	55%	0.548	S	S	.	.	H	α-helix	trans	-67.4	-44.4	173.8	-70.1	168	0	0	0	110.8	I597 V598 I599 V603 A604 V605	I597-I601 HydrophobicContact CG2-CD1 3.81Å; I597-I601 WeakPolarHBondContact O-CB 3.48Å; I597-I601 VanDerWaalsContact O-CG1 3.27Å; I597-I601 WeakPolarHBondContact O-CG1 3.48Å; I597-I601 PolarHBondContact O-N 3.21Å; V598-I601 PolarHBondContact O-N 3.47Å; I599-I601 VanDerWaalsContact C-N 3.33Å; I599-I601 PolarHBondContact O-N 3.06Å; I601-V603 PolarHBondContact O-N 3.02Å; I601-A604 PolarHBondContact O-N 2.81Å; I601-V605 HydrophobicContact CG2-CG2 4.26Å; I601-V605 WeakPolarHBondContact O-CB 3.42Å; I601-V605 VanDerWaalsContact O-CG2 3.28Å; I601-V605 WeakPolarHBondContact O-CG2 3.44Å; I601-V605 PolarHBondContact O-N 3.45Å
602	M	79.3	Confident	77	Confident	114 Å²	114	97.7 Å²	97.7	56%	0.562	53%	0.53	S	S	*	.	H	α-helix	trans	-63	-40.8	176.6	-67.9	-122.9	71.1	0	0	112	V598 I599 T606	V598-M602 HydrophobicContact CG1-CG 4.29Å; V598-M602 WeakPolarHBondContact O-CB 3.28Å; V598-M602 WeakPolarHBondContact O-CG 3.44Å; V598-M602 PolarHBondContact O-N 2.84Å; I599-M602 PolarHBondContact O-N 2.91Å; M602-T606 WeakPolarHBondContact O-CB 3.27Å; M602-T606 WeakPolarHBondContact O-CG2 3.16Å; M602-T606 PolarHBondContact O-N 3.39Å; M602-T606 PolarHBondContact O-OG1 3.02Å
603	V	90	Very high	79.4	Confident	74 Å²	74	95.4 Å²	95.4	45%	0.448	52%	0.518	S	S	.	.	H	α-helix	trans	-66.2	-42	173.9	170.3	0	0	0	0	110.9	I599 I601 T606 L607	I599-V603 HydrophobicContact CG2-CG2 4.31Å; I599-V603 WeakPolarHBondContact O-CB 3.3Å; I599-V603 VanDerWaalsContact O-CG2 3.27Å; I599-V603 WeakPolarHBondContact O-CG2 3.1Å; I599-V603 PolarHBondContact O-N 2.99Å; I601-V603 PolarHBondContact O-N 3.02Å; V603-T606 WeakPolarHBondContact CA-OG1 3.3Å; V603-T606 PolarHBondContact O-OG1 2.98Å; V603-L607 HydrophobicContact CG1-CD1 3.85Å; V603-L607 HydrophobicContact CG1-CG 4.37Å; V603-L607 VanDerWaalsContact O-CB 3.25Å; V603-L607 WeakPolarHBondContact O-CB 3.36Å; V603-L607 WeakPolarHBondContact O-CG 3.43Å; V603-L607 PolarHBondContact O-N 2.8Å
604	A	87.3	Confident	81.3	Confident	42 Å²	42	92.8 Å²	92.8	35%	0.347	51%	0.508	S	S	.	.	H	α-helix	trans	-64.2	-44.9	175.5	0	0	0	0	0	112.1	V600 I601 L607 I608	V600-A604 VanDerWaalsContact O-CB 3.23Å; V600-A604 WeakPolarHBondContact O-CB 3.17Å; V600-A604 PolarHBondContact O-N 3.27Å; I601-A604 PolarHBondContact O-N 2.81Å; A604-L607 PolarHBondContact O-N 2.88Å; A604-I608 WeakPolarHBondContact O-CB 3.42Å; A604-I608 WeakPolarHBondContact O-CD1 3.46Å; A604-I608 WeakPolarHBondContact O-CG1 3.46Å; A604-I608 PolarHBondContact O-N 2.76Å
605	V	91	Very high	83	Confident	66 Å²	66	90.8 Å²	90.8	40%	0.4	50%	0.497	S	S	.	.	H	α-helix	trans	-65.2	-45.1	178.2	169.1	0	0	0	0	111	I601 I608 I609	I601-V605 HydrophobicContact CG2-CG2 4.26Å; I601-V605 WeakPolarHBondContact O-CB 3.42Å; I601-V605 VanDerWaalsContact O-CG2 3.28Å; I601-V605 WeakPolarHBondContact O-CG2 3.44Å; I601-V605 PolarHBondContact O-N 3.45Å; V605-I608 PolarHBondContact O-N 2.78Å; V605-I609 HydrophobicContact CG1-CD1 3.74Å; V605-I609 HydrophobicContact CG1-CG1 4.44Å; V605-I609 WeakPolarHBondContact O-CB 3.3Å; V605-I609 VanDerWaalsContact O-CG1 3.31Å; V605-I609 WeakPolarHBondContact O-CG1 3.19Å; V605-I609 PolarHBondContact O-N 2.9Å
606	T	91.4	Very high	84.3	Confident	73 Å²	73	87.4 Å²	87.4	45%	0.448	49%	0.485	S	S	.	.	H	α-helix	trans	-66.7	-35.2	176	50.1	0	0	0	0	112.5	M602 V603 S610	M602-T606 WeakPolarHBondContact O-CB 3.27Å; M602-T606 WeakPolarHBondContact O-CG2 3.16Å; M602-T606 PolarHBondContact O-N 3.39Å; M602-T606 PolarHBondContact O-OG1 3.02Å; V603-T606 WeakPolarHBondContact CA-OG1 3.3Å; V603-T606 PolarHBondContact O-OG1 2.98Å; T606-S610 WeakPolarHBondContact O-CB 3.44Å; T606-S610 PolarHBondContact O-N 3.48Å; T606-S610 PolarHBondContact O-OG 2.88Å
607	L	93.3	Very high	85.2	Confident	112 Å²	112	86.3 Å²	86.3	59%	0.586	48%	0.478	S	S	*	.	H	α-helix	trans	-67.4	-38.2	170.9	-75.3	172.4	0	0	0	112.5	V603 A604 S610 L611	V603-L607 HydrophobicContact CG1-CD1 3.85Å; V603-L607 HydrophobicContact CG1-CG 4.37Å; V603-L607 VanDerWaalsContact O-CB 3.25Å; V603-L607 WeakPolarHBondContact O-CB 3.36Å; V603-L607 WeakPolarHBondContact O-CG 3.43Å; V603-L607 PolarHBondContact O-N 2.8Å; A604-L607 PolarHBondContact O-N 2.88Å; L607-S610 PolarHBondContact O-N 2.9Å; L607-L611 VanDerWaalsContact O-CB 3.27Å; L607-L611 WeakPolarHBondContact O-CB 3.46Å; L607-L611 PolarHBondContact O-N 2.73Å
608	I	93.1	Very high	85.5	Confident	98 Å²	98	86.3 Å²	86.3	50%	0.503	48%	0.479	S	S	.	.	H	α-helix	trans	-67.2	-46.5	175.8	-72.7	163.2	0	0	0	110.7	A604 V605 S610 L611 I612	A604-I608 WeakPolarHBondContact O-CB 3.42Å; A604-I608 WeakPolarHBondContact O-CD1 3.46Å; A604-I608 WeakPolarHBondContact O-CG1 3.46Å; A604-I608 PolarHBondContact O-N 2.76Å; V605-I608 PolarHBondContact O-N 2.78Å; I608-S610 VanDerWaalsContact C-N 3.33Å; I608-S610 PolarHBondContact O-N 3.04Å; I608-L611 PolarHBondContact O-N 2.84Å; I608-I612 HydrophobicContact CG2-CD1 3.8Å; I608-I612 VanDerWaalsContact O-CG1 3.29Å; I608-I612 WeakPolarHBondContact O-CG1 3.44Å; I608-I612 PolarHBondContact O-N 2.86Å
609	I	90.9	Very high	85.7	Confident	92 Å²	92	89.9 Å²	89.9	47%	0.472	49%	0.488	S	S	.	.	H	α-helix	trans	-61.8	-42.8	175	-67.6	167.6	0	0	0	110.2	V605 L611 I612 L613	V605-I609 HydrophobicContact CG1-CD1 3.74Å; V605-I609 HydrophobicContact CG1-CG1 4.44Å; V605-I609 WeakPolarHBondContact O-CB 3.3Å; V605-I609 VanDerWaalsContact O-CG1 3.31Å; V605-I609 WeakPolarHBondContact O-CG1 3.19Å; V605-I609 PolarHBondContact O-N 2.9Å; I609-L611 PolarHBondContact O-N 3.08Å; I609-I612 PolarHBondContact O-N 2.82Å; I609-L613 HydrophobicContact CG2-CD1 3.99Å; I609-L613 HydrophobicContact CG2-CG 4.49Å; I609-L613 WeakPolarHBondContact O-CB 3Å; I609-L613 WeakPolarHBondContact O-CG 3.38Å; I609-L613 PolarHBondContact O-N 2.84Å
610	S	92.4	Very high	85.3	Confident	55 Å²	55	91.6 Å²	91.6	39%	0.385	50%	0.498	S	S	.	.	H	α-helix	trans	-62.3	-40.6	174.7	-61	0	0	0	0	112.1	T606 L607 I608 L613 I614	T606-S610 WeakPolarHBondContact O-CB 3.44Å; T606-S610 PolarHBondContact O-N 3.48Å; T606-S610 PolarHBondContact O-OG 2.88Å; L607-S610 PolarHBondContact O-N 2.9Å; I608-S610 VanDerWaalsContact C-N 3.33Å; I608-S610 PolarHBondContact O-N 3.04Å; S610-L613 PolarHBondContact O-N 2.92Å; S610-I614 VanDerWaalsContact O-CB 3.3Å; S610-I614 WeakPolarHBondContact O-CB 3.35Å; S610-I614 WeakPolarHBondContact O-CD1 3.43Å; S610-I614 WeakPolarHBondContact O-CG1 3.4Å; S610-I614 PolarHBondContact O-N 2.84Å
611	L	92.6	Very high	84.4	Confident	101 Å²	101	96.3 Å²	96.3	53%	0.529	51%	0.506	S	S	.	.	H	α-helix	trans	-66.1	-41.8	176.5	-175.6	68.4	0	0	0	111.4	L607 I608 I609 I614 L615	L607-L611 VanDerWaalsContact O-CB 3.27Å; L607-L611 WeakPolarHBondContact O-CB 3.46Å; L607-L611 PolarHBondContact O-N 2.73Å; I608-L611 PolarHBondContact O-N 2.84Å; I609-L611 PolarHBondContact O-N 3.08Å; L611-I614 PolarHBondContact O-N 2.88Å; L611-L615 HydrophobicContact CG-CD1 4.13Å; L611-L615 WeakPolarHBondContact O-CB 3.48Å; L611-L615 VanDerWaalsContact O-CG 3.25Å; L611-L615 WeakPolarHBondContact O-CG 3.45Å; L611-L615 PolarHBondContact O-N 2.83Å
612	I	91	Very high	83.2	Confident	104 Å²	104	95.7 Å²	95.7	53%	0.533	51%	0.509	S	S	.	.	H	α-helix	trans	-63.8	-44.1	175.6	-69.6	165.6	0	0	0	110.5	I608 I609 L615 A616	I608-I612 HydrophobicContact CG2-CD1 3.8Å; I608-I612 VanDerWaalsContact O-CG1 3.29Å; I608-I612 WeakPolarHBondContact O-CG1 3.44Å; I608-I612 PolarHBondContact O-N 2.86Å; I609-I612 PolarHBondContact O-N 2.82Å; I612-L615 PolarHBondContact O-N 3.45Å; I612-A616 WeakPolarHBondContact O-CB 3.36Å; I612-A616 PolarHBondContact O-N 3.03Å
613	L	89.7	Confident	81.9	Confident	101 Å²	101	93.5 Å²	93.5	53%	0.529	52%	0.515	S	S	.	.	H	α-helix	trans	-65.2	-42.1	175.1	-74.1	170.3	0	0	0	112.2	I609 S610 A616 I617	I609-L613 HydrophobicContact CG2-CD1 3.99Å; I609-L613 HydrophobicContact CG2-CG 4.49Å; I609-L613 WeakPolarHBondContact O-CB 3Å; I609-L613 WeakPolarHBondContact O-CG 3.38Å; I609-L613 PolarHBondContact O-N 2.84Å; S610-L613 PolarHBondContact O-N 2.92Å; L613-A616 PolarHBondContact O-N 2.9Å; L613-I617 WeakPolarHBondContact O-CB 3.43Å; L613-I617 WeakPolarHBondContact O-CD1 3.16Å; L613-I617 WeakPolarHBondContact O-CG1 3.36Å; L613-I617 PolarHBondContact O-N 2.05Å
614	I	89	Confident	79.8	Confident	95 Å²	95	94 Å²	94	49%	0.487	53%	0.528	S	S	.	.	H	α-helix	trans	-62.5	-42.6	174.7	-73.3	164.3	0	0	0	110.6	S610 L611 I617 L618	S610-I614 VanDerWaalsContact O-CB 3.3Å; S610-I614 WeakPolarHBondContact O-CB 3.35Å; S610-I614 WeakPolarHBondContact O-CD1 3.43Å; S610-I614 WeakPolarHBondContact O-CG1 3.4Å; S610-I614 PolarHBondContact O-N 2.84Å; L611-I614 PolarHBondContact O-N 2.88Å; I614-I617 PolarHBondContact O-N 2.92Å; I614-L618 HydrophobicContact CG2-CD1 3.87Å; I614-L618 HydrophobicContact CG2-CG 4.43Å; I614-L618 WeakPolarHBondContact O-CB 3.09Å; I614-L618 WeakPolarHBondContact O-CG 3.44Å; I614-L618 PolarHBondContact O-N 2.92Å
615	L	83.3	Confident	77.6	Confident	80 Å²	80	97 Å²	97	42%	0.419	55%	0.545	S	S	.	.	H	α-helix	trans	-65.3	-44.6	175.2	-74.4	168.9	0	0	0	111.7	L611 I612 I617 L618 F619	L611-L615 HydrophobicContact CG-CD1 4.13Å; L611-L615 WeakPolarHBondContact O-CB 3.48Å; L611-L615 VanDerWaalsContact O-CG 3.25Å; L611-L615 WeakPolarHBondContact O-CG 3.45Å; L611-L615 PolarHBondContact O-N 2.83Å; I612-L615 PolarHBondContact O-N 3.45Å; L615-I617 PolarHBondContact O-N 2.86Å; L615-L618 PolarHBondContact O-N 3.24Å; L615-L618 VanDerWaalsContact O-N 3.16Å; L615-F619 WeakPolarHBondContact O-CD2 3.19Å; L615-F619 PolarHBondContact O-N 2.8Å
616	A	81.4	Confident	75.3	Confident	43 Å²	43	98 Å²	98	36%	0.355	56%	0.56	S	S	.	*	H	α-helix	trans	-59.8	-45.9	175.5	0	0	0	0	0	111.5	I612 L613 L618 F619 L620	I612-A616 WeakPolarHBondContact O-CB 3.36Å; I612-A616 PolarHBondContact O-N 3.03Å; L613-A616 PolarHBondContact O-N 2.9Å; A616-L618 VanDerWaalsContact C-N 3.34Å; A616-L618 PolarHBondContact O-N 2.98Å; A616-F619 PolarHBondContact O-N 2.92Å; A616-L620 WeakPolarHBondContact O-CB 3.34Å; A616-L620 WeakPolarHBondContact O-CD1 3.39Å; A616-L620 VanDerWaalsContact O-CG 3.25Å; A616-L620 WeakPolarHBondContact O-CG 3.38Å; A616-L620 PolarHBondContact O-N 2.82Å
617	I	81.2	Confident	72.7	Confident	94 Å²	94	100.6 Å²	100.6	48%	0.482	57%	0.567	S	S	.	*	H	α-helix	trans	-62.3	-39.7	174.1	-69.4	164.5	0	0	0	110.9	L613 I614 L615 R621	L613-I617 WeakPolarHBondContact O-CB 3.43Å; L613-I617 WeakPolarHBondContact O-CD1 3.16Å; L613-I617 WeakPolarHBondContact O-CG1 3.36Å; L613-I617 PolarHBondContact O-N 2.05Å; I614-I617 PolarHBondContact O-N 2.92Å; L615-I617 PolarHBondContact O-N 2.86Å; I617-R621 WeakPolarHBondContact O-CB 3.46Å; I617-R621 PolarHBondContact O-N 2.89Å
618	L	75.6	Confident	70.1	Confident	100 Å²	100	104.6 Å²	104.6	52%	0.524	57%	0.574	S	S	.	*	H	α-helix	trans	-65.4	-40.6	175.6	-76.6	167.5	0	0	0	112	I614 L615 A616 R621 C622	I614-L618 HydrophobicContact CG2-CD1 3.87Å; I614-L618 HydrophobicContact CG2-CG 4.43Å; I614-L618 WeakPolarHBondContact O-CB 3.09Å; I614-L618 WeakPolarHBondContact O-CG 3.44Å; I614-L618 PolarHBondContact O-N 2.92Å; L615-L618 PolarHBondContact O-N 3.24Å; L615-L618 VanDerWaalsContact O-N 3.16Å; A616-L618 VanDerWaalsContact C-N 3.34Å; A616-L618 PolarHBondContact O-N 2.98Å; L618-R621 PolarHBondContact O-N 2.8Å; L618-C622 WeakPolarHBondContact O-CB 3.37Å; L618-C622 PolarHBondContact O-N 3.08Å
619	F	71.6	Confident	67.3	Low	158 Å²	158	107.3 Å²	107.3	69%	0.693	59%	0.59	S	S	*	*	H	α-helix	trans	-66.9	-46.4	174.5	-79.8	-67.6	0	0	0	112	L615 A616 R621 C622 G623	L615-F619 WeakPolarHBondContact O-CD2 3.19Å; L615-F619 PolarHBondContact O-N 2.8Å; A616-F619 PolarHBondContact O-N 2.92Å; F619-R621 VanDerWaalsContact C-N 3.27Å; F619-R621 PolarHBondContact O-N 3.21Å; F619-C622 PolarHBondContact O-N 3.2Å; F619-G623 PolarHBondContact O-N 3.02Å
620	L	66.7	Low	64.7	Low	137 Å²	137	109.2 Å²	109.2	72%	0.717	61%	0.606	S	S	*	*	H	α-helix	trans	-58.5	-37.7	174.5	-73	164.5	0	0	0	112.2	A616	A616-L620 WeakPolarHBondContact O-CB 3.34Å; A616-L620 WeakPolarHBondContact O-CD1 3.39Å; A616-L620 VanDerWaalsContact O-CG 3.25Å; A616-L620 WeakPolarHBondContact O-CG 3.38Å; A616-L620 PolarHBondContact O-N 2.82Å
621	R	59.5	Low	62	Low	187 Å²	187	112.1 Å²	112.1	71%	0.706	62%	0.621	S	S	*	*	H	α-helix	trans	-85.8	-19.7	-178.7	-158.6	172.7	-163.2	167	5.4	113.7	I617 L618 F619 C625	I617-R621 WeakPolarHBondContact O-CB 3.46Å; I617-R621 PolarHBondContact O-N 2.89Å; L618-R621 PolarHBondContact O-N 2.8Å; F619-R621 VanDerWaalsContact C-N 3.27Å; F619-R621 PolarHBondContact O-N 3.21Å; R621-C625 PolarHBondContact O-SG 2.88Å
622	C	56.4	Low	59.1	Low	83 Å²	83	115.1 Å²	115.1	56%	0.561	63%	0.633	S	S	*	*	H	α-helix	trans	-82	-37.7	172.1	-165	0	0	0	0	111.5	L618 F619 A624 C625	L618-C622 WeakPolarHBondContact O-CB 3.37Å; L618-C622 PolarHBondContact O-N 3.08Å; F619-C622 PolarHBondContact O-N 3.2Å; C622-A624 PolarHBondContact O-N 2.83Å; C622-A624 VanDerWaalsContact O-N 3.12Å; C622-C625 PolarHBondContact O-N 2.77Å
623	G	51.8	Low	56.3	Low	68 Å²	68	113.8 Å²	113.8	70%	0.701	63%	0.632	S	S	*	*	H	α-helix	trans	-58	-24.6	176.1	0	0	0	0	0	114.5	F619	F619-G623 PolarHBondContact O-N 3.02Å
624	A	45.6	Very low	53.6	Low	85 Å²	85	116 Å²	116	70%	0.702	64%	0.639	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.3	-3.9	177.2	0	0	0	0	0	115	C622	C622-A624 PolarHBondContact O-N 2.83Å; C622-A624 VanDerWaalsContact O-N 3.12Å
625	C	43	Very low	51	Low	106 Å²	106	117.9 Å²	117.9	72%	0.716	65%	0.646	S	S	*	*	S	Bend	trans	-118.7	10.2	-168.6	-70.6	0	0	0	0	114.8	R621 C622	R621-C625 PolarHBondContact O-SG 2.88Å; C622-C625 PolarHBondContact O-N 2.77Å
626	A	42.1	Very low	48.6	Very low	86 Å²	86	120.8 Å²	120.8	71%	0.711	66%	0.662	S	S	*	*	S	Bend	trans	-111.5	18.4	-173	0	0	0	0	0	115.3
627	Q	37.3	Very low	46.2	Very low	128 Å²	128	125.9 Å²	125.9	60%	0.598	68%	0.683	S	S	*	*			trans	-148.6	83.4	179.5	-127.9	-172.6	-3.2	0	0	114.2	C931	Q627-C931 PolarHBondContact NE2-O 3.39Å
628	R	37.7	Very low	44.2	Very low	195 Å²	195	126.8 Å²	126.8	74%	0.736	70%	0.696	S	S	*	*			trans	-177.1	107.6	150.7	-106.4	163.7	-172	-173.9	2.9	113.3
629	N	35.1	Very low	42.1	Very low	155 Å²	155	132 Å²	132	83%	0.829	71%	0.709	S	S	*	*			trans	63.5	147.9	159.1	-52.3	-11.2	0	0	0	116.1
630	T	36.1	Very low	40.3	Very low	132 Å²	132	132.8 Å²	132.8	81%	0.81	71%	0.712	S	S	*	*			cis	-138.9	152.6	26.7	50	0	0	0	0	114.3
631	T	35.4	Very low	38.6	Very low	116 Å²	116	135.4 Å²	135.4	71%	0.712	71%	0.714	S	S	*	*			trans	-71.8	168.3	156.2	45.9	0	0	0	0	110.9
632	Q	31	Very low	37.2	Very low	164 Å²	164	137.3 Å²	137.3	77%	0.766	72%	0.721	S	S	*	*			cis	-152.3	-168.8	4.6	-127	155.4	-90.5	0	0	106.9
633	C	32.2	Very low	36.1	Very low	77 Å²	77	142.4 Å²	142.4	52%	0.52	74%	0.736	S	S	.	*			cis	-157.8	-178.1	14.1	-138.4	0	0	0	0	112.8
634	E	33	Very low	35.1	Very low	146 Å²	146	142.3 Å²	142.3	68%	0.682	74%	0.735	S	S	*	*			trans	10.7	152.4	138.8	-70.1	177.3	113.8	0	0	121.9
635	Q	34.2	Very low	34.6	Very low	136 Å²	136	146.5 Å²	146.5	64%	0.636	75%	0.745	S	S	*	*			cis	-158.8	156.7	12.8	-130.9	174.2	50.1	0	0	113.4
636	N	34.2	Very low	34	Very low	141 Å²	141	147.8 Å²	147.8	75%	0.754	75%	0.745	S	S	*	*			trans	73	130	151.1	-63	-31.4	0	0	0	123.9
637	N	30.9	Very low	33.5	Very low	149 Å²	149	151.3 Å²	151.3	80%	0.797	75%	0.746	S	S	*	*			trans	-52	162.6	169.1	-113.4	-54.2	0	0	0	114.9	R639	N637-R639 PolarHBondContact OD1-N 3.04Å
638	P	38.6	Very low	33.1	Very low	114 Å²	114	150.8 Å²	150.8	74%	0.74	75%	0.752	S	S	*	*				-149.4	146.8	55.4	38.8	-17.4	0	0	0	121.1
639	R	31.7	Very low	32.7	Very low	210 Å²	210	149 Å²	149	79%	0.792	75%	0.752	S	S	*	*			trans	77.2	136.2	139.7	-78.8	-179.5	174.2	173.4	-1	122.7	N637	N637-R639 PolarHBondContact OD1-N 3.04Å
640	F	33.6	Very low	32.4	Very low	173 Å²	173	148.7 Å²	148.7	76%	0.759	75%	0.745	S	S	*	*			trans	98.5	136.6	146.1	-86.5	-62.2	0	0	0	122.1
641	Y	30.4	Very low	31.9	Very low	193 Å²	193	149.8 Å²	149.8	76%	0.757	75%	0.745	S	S	*	*			trans	78.9	77.9	165.7	-84.8	-82.3	0	0	0	123.1
642	R	31.1	Very low	31.5	Very low	226 Å²	226	153 Å²	153	85%	0.853	75%	0.752	S	S	*	*				67.1	136.6	124.1	-116.1	176.6	-173.3	172.9	1.8	123.1
643	Q	32.8	Very low	31.5	Very low	190 Å²	190	154 Å²	154	89%	0.888	76%	0.757	S	S	*	*			trans	-81.9	175.6	169.2	-56	130.3	-47.3	0	0	111.8
644	G	32.3	Very low	31.2	Very low	66 Å²	66	156 Å²	156	68%	0.68	77%	0.766	S	S	*	*			cis	-160.6	-166.4	3.5	0	0	0	0	0	109.9
645	L	33.8	Very low	31	Very low	173 Å²	173	157.8 Å²	157.8	91%	0.906	77%	0.772	S	S	*	*			cis	-144.5	173.6	17.2	-97.2	93.7	0	0	0	112.8
646	N	29.8	Very low	30.8	Very low	133 Å²	133	161.1 Å²	161.1	71%	0.711	78%	0.778	S	S	*	*			trans	-156.3	175.5	165.2	-119.2	-30.6	0	0	0	108.5
647	H	32.4	Very low	30.5	Very low	161 Å²	161	160.6 Å²	160.6	75%	0.745	78%	0.776	S	S	*	*			cis	-149.5	-154.5	11.8	-131.6	-21.8	0	0	0	111.1
648	T	29.8	Very low	30.4	Very low	117 Å²	117	159.6 Å²	159.6	72%	0.718	78%	0.781	S	S	*	*			trans	-133.2	162.2	-175.7	49.2	0	0	0	0	115.9
649	H	28.8	Very low	30	Very low	157 Å²	157	158 Å²	158	73%	0.727	78%	0.784	S	S	*	*			trans	78.6	132.7	156.4	-84	-80.6	0	0	0	125
650	H	28.6	Very low	29.8	Very low	148 Å²	148	156 Å²	156	69%	0.685	79%	0.786	S	S	*	*			trans	77.3	116.6	143.6	-76.4	-56.9	0	0	0	126.2
651	L	26	Very low	29.6	Very low	156 Å²	156	154.1 Å²	154.1	82%	0.817	78%	0.783	S	S	*	*			trans	47	119.3	130.8	-67.9	167.8	0	0	0	121.5
652	E	26.6	Very low	29.7	Very low	183 Å²	183	152.3 Å²	152.3	86%	0.855	78%	0.781	S	S	*	*				-164.2	170.3	103.3	-146.4	164.5	-152.7	0	0	112.3
653	E	30.8	Very low	29.6	Very low	186 Å²	186	148.6 Å²	148.6	87%	0.869	78%	0.784	S	S	*	*			trans	64.6	162.3	166	-66.3	-159	132.1	0	0	121.9
654	V	27.2	Very low	29.5	Very low	117 Å²	117	147.1 Å²	147.1	71%	0.709	78%	0.782	S	S	*	*			trans	-125.4	124.5	-168.5	177.7	0	0	0	0	110.2
655	F	28.3	Very low	29.3	Very low	184 Å²	184	146.6 Å²	146.6	81%	0.807	78%	0.776	S	S	*	*				170.7	137.8	124.7	-97.4	-64.4	0	0	0	113.5
656	R	29.2	Very low	29.2	Very low	206 Å²	206	146.3 Å²	146.3	78%	0.777	78%	0.775	S	S	*	*			trans	58	112.3	155.6	-75.8	-167.7	166.7	129.9	2.2	121.8
657	D	27.1	Very low	29.2	Very low	131 Å²	131	147.5 Å²	147.5	70%	0.701	78%	0.781	S	S	*	*				79	123.2	121.3	-55.6	-24.1	0	0	0	122.3
658	S	29.6	Very low	29	Very low	128 Å²	128	145.1 Å²	145.1	90%	0.895	78%	0.782	S	S	*	*			trans	76	126.2	150.3	-53.7	0	0	0	0	120
659	G	29.8	Very low	29.7	Very low	79 Å²	79	145.9 Å²	145.9	81%	0.814	79%	0.789	S	S	*	*			trans	148.6	57	152.8	0	0	0	0	0	119.3
660	M	27.5	Very low	29.7	Very low	170 Å²	170	142 Å²	142	84%	0.837	79%	0.791	S	S	*	*			trans	-18.8	150.4	159.8	-78.4	-72	-160.7	0	0	120.2
661	L	30.6	Very low	29.9	Very low	133 Å²	133	139.1 Å²	139.1	70%	0.696	79%	0.793	S	S	*	*			trans	70.5	145	155.1	-93.2	74.5	0	0	0	117.6
662	E	31.3	Very low	30.2	Very low	154 Å²	154	139.6 Å²	139.6	72%	0.72	79%	0.791	S	S	*	*			cis	-157.4	159	-11.2	-153.5	155.3	-137.2	0	0	109.3
663	V	30.2	Very low	30.4	Very low	149 Å²	149	138.6 Å²	138.6	90%	0.903	79%	0.786	S	S	*	*			trans	-131.4	117.9	165.3	178.9	0	0	0	0	108.6
664	D	29.4	Very low	30.2	Very low	158 Å²	158	135.9 Å²	135.9	85%	0.845	78%	0.777	S	S	*	*			trans	-99.6	161.6	-170.4	-165.8	5.9	0	0	0	112.2
665	G	29	Very low	30.4	Very low	55 Å²	55	138 Å²	138	57%	0.567	78%	0.783	S	S	*	*			trans	127.1	109.7	162.5	0	0	0	0	0	115.6
666	L	31.6	Very low	30.4	Very low	167 Å²	167	133.1 Å²	133.1	87%	0.874	77%	0.772	S	S	*	*				-178.5	155.6	83.1	-97.4	169.2	0	0	0	114.2
667	L	30.5	Very low	30.5	Very low	159 Å²	159	132.2 Å²	132.2	83%	0.832	78%	0.777	S	S	*	*			trans	82.9	141.1	165.2	-63.5	161.2	0	0	0	119.2
668	S	28.1	Very low	30.7	Very low	110 Å²	110	129.6 Å²	129.6	77%	0.769	78%	0.78	S	S	*	*			trans	-149.5	-167.7	-178.8	-37.5	0	0	0	0	106.3
669	P	42.8	Very low	30.7	Very low	133 Å²	133	126.9 Å²	126.9	86%	0.864	77%	0.773	S	S	*	*			cis	-131.2	-170.3	-14.2	40.1	-23	0	0	0	113
670	G	30	Very low	30.7	Very low	75 Å²	75	130.2 Å²	130.2	77%	0.773	77%	0.771	S	S	*	*			trans	-156.6	129.1	166.9	0	0	0	0	0	114.4
671	A	32.9	Very low	30.8	Very low	88 Å²	88	128.4 Å²	128.4	73%	0.727	77%	0.765	S	S	*	*			trans	-11.8	157.3	162.1	0	0	0	0	0	121.1
672	E	31	Very low	30.7	Very low	166 Å²	166	127 Å²	127	78%	0.776	76%	0.762	S	S	*	*			cis	-171.1	162.5	-4.7	-112.5	167.7	-154.4	0	0	111.1
673	H	31.1	Very low	30.6	Very low	163 Å²	163	129 Å²	129	76%	0.755	77%	0.769	S	S	*	*			trans	60.4	166.5	155	-89.5	-122.3	0	0	0	120
674	L	27.4	Very low	30.9	Very low	128 Å²	128	127.1 Å²	127.1	67%	0.67	76%	0.76	S	S	*	*				-173.6	168.8	-55.3	-115	172.2	0	0	0	108.8
675	L	30.2	Very low	31.7	Very low	162 Å²	162	125.1 Å²	125.1	85%	0.848	76%	0.755	S	S	*	*			trans	71.7	149.8	172.9	-54.9	178.7	0	0	0	116.1
676	S	29.5	Very low	32.4	Very low	82 Å²	82	127.5 Å²	127.5	57%	0.573	76%	0.761	S	S	*	*			cis	-159	158.5	-17.3	-162.3	0	0	0	0	110.5
677	E	32	Very low	32.4	Very low	187 Å²	187	125.9 Å²	125.9	87%	0.874	75%	0.753	S	S	*	*			trans	48	154.4	152.7	-71.6	149.8	143.2	0	0	122.3
678	G	30.1	Very low	32.6	Very low	75 Å²	75	125.9 Å²	125.9	77%	0.773	75%	0.749	S	S	*	*			cis	159.4	103.5	-9.8	0	0	0	0	0	115.8
679	G	30.5	Very low	32.8	Very low	72 Å²	72	126.8 Å²	126.8	74%	0.742	74%	0.744	S	S	*	*			trans	73.1	176.1	161	0	0	0	0	0	118
680	L	29.8	Very low	32.3	Very low	148 Å²	148	128.7 Å²	128.7	78%	0.775	74%	0.741	S	S	*	*			cis	-165.5	138.6	-11.2	-146.6	79.5	0	0	0	110.4
681	N	28.6	Very low	32.3	Very low	133 Å²	133	133.7 Å²	133.7	71%	0.711	74%	0.744	S	S	*	*			trans	64.3	156.8	152.9	-68.6	-3.6	0	0	0	119.6
682	T	28.8	Very low	32.8	Very low	104 Å²	104	135.1 Å²	135.1	64%	0.638	75%	0.746	S	S	*	*			cis	-169.6	166.9	-4.7	21.9	0	0	0	0	113.4
683	F	29.5	Very low	32.9	Very low	194 Å²	194	132.1 Å²	132.1	85%	0.851	74%	0.743	S	S	*	*			trans	87.7	151.9	153.5	-69.5	-63	0	0	0	122.6
684	P	37.3	Very low	33	Very low	110 Å²	110	132.8 Å²	132.8	71%	0.714	75%	0.747	S	S	*	*			trans	-114.5	-174.7	-167.8	47.5	-38.6	0	0	0	115.6
685	P	45.4	Very low	33.2	Very low	116 Å²	116	131.8 Å²	131.8	75%	0.753	75%	0.751	S	S	*	*			trans	-101.1	-175.7	-165.9	45.4	-39.1	0	0	0	113.9
686	P	44.2	Very low	33.4	Very low	105 Å²	105	130.2 Å²	130.2	68%	0.682	75%	0.748	S	S	*	*				-159.9	-171.7	73.2	44.3	-21.7	0	0	0	119.1
687	N	31.5	Very low	33.5	Very low	134 Å²	134	133.3 Å²	133.3	72%	0.717	76%	0.758	S	S	*	*			trans	74.3	149.7	159.7	-61.3	-17.4	0	0	0	119.2
688	H	34.4	Very low	33.5	Very low	159 Å²	159	130.2 Å²	130.2	74%	0.736	76%	0.757	S	S	*	*			cis	-156.4	155.2	40.7	-102.3	-82	0	0	0	116.6
689	L	31.8	Very low	33.5	Very low	128 Å²	128	134.8 Å²	134.8	67%	0.67	76%	0.758	S	S	*	*			trans	65.7	146.5	150.6	-68.1	160.3	0	0	0	119
690	H	32.8	Very low	33.5	Very low	174 Å²	174	139.3 Å²	139.3	81%	0.806	76%	0.757	S	S	*	*			cis	-133.2	-175.9	19.4	-112.2	-76.6	0	0	0	114.5
691	H	30.5	Very low	33.4	Very low	179 Å²	179	139.9 Å²	139.9	83%	0.829	76%	0.758	S	S	*	*			trans	-113.2	169.8	-164.6	-104.4	-104	0	0	0	116.1
692	P	42	Very low	33.5	Very low	119 Å²	119	140.5 Å²	140.5	77%	0.773	76%	0.76	S	S	*	*			trans	-115.4	-174.4	-169.3	43.7	-34.5	0	0	0	115.6
693	S	32.7	Very low	33.4	Very low	103 Å²	103	146.8 Å²	146.8	72%	0.72	77%	0.772	S	S	*	*			trans	-150.7	121	170.6	61	0	0	0	0	116.9
694	Q	33.4	Very low	33.3	Very low	177 Å²	177	143.5 Å²	143.5	83%	0.827	77%	0.773	S	S	*	*				73.9	111.7	127.9	-65.9	178.8	-17.9	0	0	124.3
695	S	32.3	Very low	32.9	Very low	107 Å²	107	147.3 Å²	147.3	75%	0.748	78%	0.778	S	S	*	*				65.4	153.6	119.1	81.8	0	0	0	0	121.4
696	T	34.2	Very low	32.1	Very low	129 Å²	129	149.3 Å²	149.3	79%	0.791	78%	0.782	S	S	*	*			cis	-139.9	176.9	12.1	34.1	0	0	0	0	112.6
697	D	31.9	Very low	31.4	Very low	146 Å²	146	150.2 Å²	150.2	78%	0.781	79%	0.791	S	S	*	*			trans	-72	170.9	-166.7	-52.2	-96.1	0	0	0	120
698	S	32.6	Very low	31.4	Very low	122 Å²	122	151.6 Å²	151.6	85%	0.853	80%	0.798	S	S	*	*			trans	108.5	123.8	138.1	74.6	0	0	0	0	119.8
699	E	28.8	Very low	31.3	Very low	171 Å²	171	148.6 Å²	148.6	80%	0.799	80%	0.801	S	S	*	*			trans	-87.6	142.2	166.9	-52.9	174.9	98.8	0	0	111.2
700	K	32.1	Very low	31.3	Very low	168 Å²	168	149.6 Å²	149.6	73%	0.73	80%	0.802	S	S	*	*				174.6	150.8	100.8	-98.4	173	-175.4	174.2	0	114
701	M	27.2	Very low	31.3	Very low	160 Å²	160	148.3 Å²	148.3	79%	0.788	79%	0.794	S	S	*	*			trans	59	98	154.6	-85.4	-171.1	-68.7	0	0	119
702	I	30.3	Very low	31.3	Very low	146 Å²	146	146.5 Å²	146.5	75%	0.749	79%	0.791	S	S	*	*				172.4	133.2	96	-90.6	152.2	0	0	0	111.3
703	R	26.4	Very low	30.5	Very low	236 Å²	236	147.6 Å²	147.6	89%	0.891	79%	0.785	S	S	*	*			trans	32.4	121.7	161.4	-64.8	176.8	-177.9	-152.6	0.5	119.5
704	S	28.3	Very low	30.2	Very low	124 Å²	124	152.1 Å²	152.1	87%	0.867	79%	0.787	S	S	*	*			trans	-133.4	125.7	130.1	56.3	0	0	0	0	110.5
705	F	28.8	Very low	30	Very low	190 Å²	190	151.9 Å²	151.9	83%	0.833	79%	0.788	S	S	*	*			trans	-111.8	147.9	166.7	-111.3	-98.8	0	0	0	107
706	L	29.1	Very low	29.5	Very low	158 Å²	158	155.9 Å²	155.9	83%	0.827	80%	0.797	S	S	*	*			trans	37.5	98	158.4	-66.9	168.6	0	0	0	117.3	N708	L706-N708 PolarHBondContact O-N 2.79Å; L706-N708 VanDerWaalsContact O-N 3.08Å
707	S	29.1	Very low	29.1	Very low	124 Å²	124	154.8 Å²	154.8	87%	0.867	80%	0.801	S	S	*	*			trans	-69.1	99.8	160.7	56	0	0	0	0	111.1
708	N	30.6	Very low	28.7	Very low	164 Å²	164	152.2 Å²	152.2	88%	0.877	80%	0.8	S	S	*	*			trans	-135.7	137.4	149.9	-115.5	-20.6	0	0	0	108.3	L706	L706-N708 PolarHBondContact O-N 2.79Å; L706-N708 VanDerWaalsContact O-N 3.08Å
709	A	33.7	Very low	28.5	Very low	96 Å²	96	152.9 Å²	152.9	79%	0.793	80%	0.798	S	S	*	*			trans	-78.7	144.9	-159.1	0	0	0	0	0	114.4
710	E	30.6	Very low	28.3	Very low	149 Å²	149	151.6 Å²	151.6	70%	0.696	80%	0.797	S	S	*	*			trans	0.4	142.9	144	-57	-158.8	144.8	0	0	118.8
711	K	32.3	Very low	28.5	Very low	147 Å²	147	148 Å²	148	64%	0.639	79%	0.791	S	S	*	*			cis	-161	141.3	8.9	-122.1	160.5	-169.6	147.1	0	111.1
712	N	30.8	Very low	28.6	Very low	141 Å²	141	150.5 Å²	150.5	75%	0.754	80%	0.797	S	S	*	*			trans	29.2	155.5	144.4	-56.9	5.1	0	0	0	123.3
713	Q	26.7	Very low	28.4	Very low	141 Å²	141	153.2 Å²	153.2	66%	0.659	80%	0.804	S	S	*	*			cis	179	159.7	-27.7	-162.7	176.4	21.4	0	0	107.7
714	W	25.9	Very low	28.9	Very low	198 Å²	198	147 Å²	147	75%	0.75	79%	0.794	S	S	*	*			trans	84.6	124.5	165.3	-58	93.4	0	0	0	121.6
715	M	28.1	Very low	29.1	Very low	172 Å²	172	147.4 Å²	147.4	85%	0.847	79%	0.787	S	S	*	*			trans	72	132.3	146.6	-65.8	-171.8	-63.6	0	0	122.6
716	M	23	Very low	29.1	Very low	192 Å²	192	144.1 Å²	144.1	95%	0.946	78%	0.782	S	S	*	*			trans	-90	145.5	156.2	-53.2	-172.1	-162.6	0	0	110.2
717	A	25.9	Very low	29.3	Very low	105 Å²	105	144.7 Å²	144.7	87%	0.868	79%	0.785	S	S	*	*			trans	-176.5	146.4	134.6	0	0	0	0	0	110.7
718	A	23.6	Very low	29.3	Very low	93 Å²	93	149.7 Å²	149.7	77%	0.769	79%	0.785	S	S	*	*			trans	-81.7	-177.3	-164.7	0	0	0	0	0	117.3
719	V	26.8	Very low	29.3	Very low	135 Å²	135	146.2 Å²	146.2	82%	0.818	77%	0.774	S	S	*	*			trans	89.7	83.7	160	-161.6	0	0	0	0	119.1
720	D	24.2	Very low	29.3	Very low	145 Å²	145	148.8 Å²	148.8	78%	0.775	77%	0.769	S	S	*	*				28.4	164	110.6	-141.4	35.5	0	0	0	121.7
721	P	37.2	Very low	29.3	Very low	92 Å²	92	149.2 Å²	149.2	60%	0.597	77%	0.768	S	S	*	*			cis	-128.1	157.7	-24.2	16.9	5.7	0	0	0	115.5
722	K	29.1	Very low	29.1	Very low	212 Å²	212	148.2 Å²	148.2	92%	0.922	77%	0.769	S	S	*	*			trans	179.1	152.1	132.5	-99.6	153.9	-173.1	168.9	0	115.2
723	K	26.1	Very low	28.9	Very low	203 Å²	203	151.9 Å²	151.9	88%	0.883	78%	0.779	S	S	*	*			trans	-118.1	176	174.7	-87.1	179.5	179.7	173.6	0	109.2
724	P	37.3	Very low	28.9	Very low	106 Å²	106	151.2 Å²	151.2	69%	0.688	78%	0.78	S	S	*	*			cis	-127.2	-165.4	17.2	37.8	-13.9	0	0	0	112.5
725	D	31.4	Very low	28.8	Very low	133 Å²	133	147.2 Å²	147.2	71%	0.711	78%	0.782	S	S	*	*			cis	-151.4	130.2	39.4	-94.9	-43.2	0	0	0	116.8
726	T	30.6	Very low	28.8	Very low	120 Å²	120	144.1 Å²	144.1	74%	0.736	77%	0.773	S	S	*	*			trans	34.5	120.6	134.8	67.6	0	0	0	0	124.2
727	L	32.2	Very low	28.9	Very low	171 Å²	171	143.7 Å²	143.7	90%	0.895	77%	0.769	S	S	*	*				-153	141.8	122.9	-116.8	150.4	0	0	0	113.5
728	R	30	Very low	29.3	Very low	228 Å²	228	144.2 Å²	144.2	86%	0.86	76%	0.763	S	S	*	*			trans	-54.8	163.7	-173.6	-77.3	175.1	178.6	-172.9	-0.3	116.9
729	S	30.3	Very low	29.6	Very low	91 Å²	91	148.4 Å²	148.4	64%	0.636	76%	0.764	S	S	*	*			cis	-171.4	161.3	-2.7	40.4	0	0	0	0	113.6
730	H	32.3	Very low	29.7	Very low	151 Å²	151	148.7 Å²	148.7	70%	0.699	76%	0.756	S	S	*	*			trans	76.5	154.2	163.7	-71.6	-5.5	0	0	0	115.7
731	K	30.7	Very low	30.3	Very low	157 Å²	157	147.5 Å²	147.5	68%	0.683	76%	0.756	S	S	*	*			cis	-164.6	157.8	-11.8	-111.5	170.4	176	156	0	107.4
732	L	28.7	Very low	29.8	Very low	126 Å²	126	148 Å²	148	66%	0.66	76%	0.762	S	S	*	*			cis	-158.7	133.1	-12.3	-152.2	175.6	0	0	0	108.2	N734	L732-N734 HydrophobicContact CD2-CB 4.34Å
733	F	27	Very low	30.6	Very low	218 Å²	218	143 Å²	143	96%	0.956	75%	0.752	S	S	*	*			trans	-145.8	153.8	154.6	-113.2	-83.1	0	0	0	108.7
734	N	27	Very low	30.8	Very low	128 Å²	128	140.4 Å²	140.4	68%	0.684	75%	0.753	S	S	*	*			trans	-132.4	132.8	-162.9	-163.8	33.6	0	0	0	112.9	L732	L732-N734 HydrophobicContact CD2-CB 4.34Å
735	S	23.6	Very low	30.4	Very low	114 Å²	114	144.4 Å²	144.4	80%	0.797	76%	0.759	S	S	*	*			trans	-152.4	138.4	162.3	72.3	0	0	0	0	109.3
736	T	27.7	Very low	30.3	Very low	107 Å²	107	144.7 Å²	144.7	66%	0.656	76%	0.76	S	S	*	*			trans	-151.9	132.5	-173.3	46.5	0	0	0	0	111.6
737	H	25.5	Very low	30.3	Very low	183 Å²	183	145 Å²	145	85%	0.847	76%	0.757	S	S	*	*			trans	-151.4	117.6	159.9	-102.5	-71.9	0	0	0	110.6
738	P	33.1	Very low	30.3	Very low	115 Å²	115	142.9 Å²	142.9	75%	0.747	75%	0.747	S	S	*	*			trans	-105.4	153.8	168.3	36.6	-29.5	0	0	0	112.6
739	F	30.4	Very low	30.4	Very low	182 Å²	182	139 Å²	139	80%	0.798	74%	0.742	S	S	*	*			trans	-125.2	150.8	169.9	-87.1	-110.1	0	0	0	107.7
740	H	28.9	Very low	30.5	Very low	141 Å²	141	139.1 Å²	139.1	65%	0.653	74%	0.743	S	S	*	*			cis	-163.2	171.2	-23.5	-137.9	-76.5	0	0	0	106.8
741	P	37.1	Very low	30.3	Very low	119 Å²	119	139.1 Å²	139.1	77%	0.773	75%	0.749	S	S	*	*				-140.8	171.7	110.7	29.2	-11.4	0	0	0	113.9
742	S	27.9	Very low	30.4	Very low	102 Å²	102	139.1 Å²	139.1	71%	0.713	76%	0.755	S	S	*	*			trans	-123.3	-157.8	-172.5	59.6	0	0	0	0	108.9
743	P	44.7	Very low	30.4	Very low	109 Å²	109	141.8 Å²	141.8	71%	0.708	76%	0.761	S	S	*	*			cis	-140.1	174.5	-6.6	41.8	-24.6	0	0	0	116.6
744	T	30.2	Very low	30.4	Very low	147 Å²	147	142.7 Å²	142.7	90%	0.902	76%	0.758	S	S	*	*			trans	-149.4	148.9	139.3	2.7	0	0	0	0	113.5
745	K	30	Very low	30.5	Very low	191 Å²	191	141.3 Å²	141.3	83%	0.83	77%	0.765	S	S	*	*			trans	-64.2	170.4	-175.1	-65	174.8	175.6	179.3	0	113.3
746	L	28.9	Very low	30.8	Very low	138 Å²	138	141.4 Å²	141.4	72%	0.723	77%	0.765	S	S	*	*			cis	-169.8	142.7	44.3	-170	72.5	0	0	0	113.8
747	N	31.1	Very low	31	Very low	128 Å²	128	145.6 Å²	145.6	68%	0.684	78%	0.777	S	S	*	*			trans	61.7	148.3	156	-76.4	30.4	0	0	0	121
748	D	31.1	Very low	31	Very low	126 Å²	126	143.6 Å²	143.6	67%	0.674	78%	0.778	S	S	*	*			cis	-162	165.4	-18.5	-133.9	-35.9	0	0	0	113.9
749	L	31.3	Very low	30.8	Very low	145 Å²	145	141.1 Å²	141.1	76%	0.759	77%	0.774	S	S	*	*			trans	62.8	133.3	153.9	-119.5	71.3	0	0	0	125.8
750	S	32.7	Very low	30.7	Very low	95 Å²	95	138.7 Å²	138.7	66%	0.664	77%	0.774	S	S	*	*			trans	63	122	154.6	40.3	0	0	0	0	120.1
751	N	29.6	Very low	30.7	Very low	151 Å²	151	139 Å²	139	81%	0.807	78%	0.779	S	S	*	*				77	140.3	60.8	-70.3	-31.8	0	0	0	113.9
752	L	31.2	Very low	30.2	Very low	156 Å²	156	138.2 Å²	138.2	82%	0.817	78%	0.775	S	S	*	*			cis	-144.5	176.7	17.2	-155.7	70.6	0	0	0	113.8
753	K	29.4	Very low	30	Very low	183 Å²	183	144.4 Å²	144.4	80%	0.796	78%	0.783	S	S	*	*			trans	-84.2	147.8	-170.4	-63.1	170.2	172.6	169.7	0	116.4
754	R	26.5	Very low	29.2	Very low	237 Å²	237	145.8 Å²	145.8	89%	0.894	78%	0.784	S	S	*	*				45.6	123.6	123.7	-172.4	-157	-86.8	-172.2	-9.7	119.8
755	A	28.8	Very low	29	Very low	99 Å²	99	148 Å²	148	82%	0.818	78%	0.781	S	S	*	*				174.8	156.2	120.5	0	0	0	0	0	112.8
756	S	31.5	Very low	29.2	Very low	115 Å²	115	144 Å²	144	80%	0.804	77%	0.774	S	S	*	*			trans	-86.7	159.7	-177	46.8	0	0	0	0	114.3
757	Q	30.2	Very low	29.2	Very low	195 Å²	195	143.8 Å²	143.8	91%	0.911	78%	0.779	S	S	*	*			trans	-158.3	157.3	146.7	-118.4	169.1	13.3	0	0	112.3
758	T	27.2	Very low	29.1	Very low	142 Å²	142	145.9 Å²	145.9	87%	0.871	78%	0.784	S	S	*	*			trans	-100.3	158.4	171.6	42.5	0	0	0	0	110.4
759	G	27.9	Very low	29.1	Very low	63 Å²	63	145.7 Å²	145.7	65%	0.649	78%	0.779	S	S	*	*			trans	129.5	94.3	158.4	0	0	0	0	0	118.5
760	T	28.3	Very low	29	Very low	131 Å²	131	147.1 Å²	147.1	80%	0.804	77%	0.774	S	S	*	*			trans	61.6	129.1	133.5	45.8	0	0	0	0	124.1
761	I	30.3	Very low	28.9	Very low	146 Å²	146	150 Å²	150	75%	0.749	78%	0.776	S	S	*	*			trans	92.4	102.7	133.6	-69.6	167	0	0	0	120.4
762	C	25	Very low	29	Very low	104 Å²	104	149.5 Å²	149.5	70%	0.703	77%	0.772	S	S	*	*			trans	68.2	126.5	137.2	-72	0	0	0	0	123.8
763	R	24.4	Very low	28.8	Very low	231 Å²	231	147.7 Å²	147.7	87%	0.872	76%	0.763	S	S	*	*			trans	72	145	146.8	-71.6	179.7	176.8	166.4	-0.5	116
764	L	28.2	Very low	28.8	Very low	139 Å²	139	144.6 Å²	144.6	73%	0.728	76%	0.76	S	S	*	*			cis	-153.5	144.1	8.9	-121.1	159	0	0	0	110.4
765	K	24.7	Very low	29.1	Very low	193 Å²	193	139.9 Å²	139.9	84%	0.839	76%	0.757	S	S	*	*			trans	33.4	164.8	148.1	-82.1	-171.4	173.1	-170	0	123.4
766	P	35.8	Very low	29	Very low	107 Å²	107	139.2 Å²	139.2	70%	0.695	75%	0.746	S	S	*	*			trans	-122	-174.2	-158.1	43.3	-30.2	0	0	0	115.8
767	V	28.8	Very low	28.8	Very low	134 Å²	134	139.2 Å²	139.2	81%	0.812	74%	0.742	S	S	*	*			trans	81.8	133.6	164.9	-179.7	0	0	0	0	116.8
768	E	28.7	Very low	28.8	Very low	171 Å²	171	138.6 Å²	138.6	80%	0.799	74%	0.736	S	S	*	*			trans	161.5	151.9	137.7	-88.2	-172.6	174.6	0	0	107.3
769	E	30	Very low	28.9	Very low	123 Å²	123	139.2 Å²	139.2	58%	0.575	73%	0.734	S	S	*	*			cis	-150.2	169.2	-8.7	-111.2	-166.9	139.2	0	0	105.3
770	R	30.3	Very low	28.9	Very low	174 Å²	174	141.4 Å²	141.4	66%	0.657	74%	0.74	S	S	*	*			cis	-148.8	174.2	7.4	-117.2	161.3	-168.3	146	20.1	105.7
771	F	30.7	Very low	29.7	Very low	157 Å²	157	139.8 Å²	139.8	69%	0.689	73%	0.731	S	S	*	*			cis	-150	-160.3	9	-126.9	-33.3	0	0	0	105.8
772	L	30.9	Very low	29.5	Very low	139 Å²	139	139.4 Å²	139.4	73%	0.728	73%	0.73	S	S	*	*			cis	-151.3	171.9	6.9	-136.2	168.8	0	0	0	108.6
773	D	27.2	Very low	29.6	Very low	119 Å²	119	143.1 Å²	143.1	64%	0.636	74%	0.737	S	S	*	*			trans	-69.6	165.3	179.7	-61.6	-65	0	0	0	115.1
774	T	29.7	Very low	29.9	Very low	118 Å²	118	139.8 Å²	139.8	72%	0.724	73%	0.732	S	S	*	*			cis	-163.7	163.8	19.1	-12.7	0	0	0	0	112
775	V	31.8	Very low	29.8	Very low	137 Å²	137	140 Å²	140	83%	0.83	73%	0.732	S	S	*	*			trans	64.5	150.4	153.1	168.8	0	0	0	0	118.3
776	S	27.7	Very low	29.9	Very low	86 Å²	86	138.9 Å²	138.9	60%	0.601	73%	0.728	S	S	*	*			cis	-174.9	132	-36.8	-174.2	0	0	0	0	108.5
777	T	26.9	Very low	29.4	Very low	115 Å²	115	143 Å²	143	71%	0.706	74%	0.735	S	S	*	*			trans	39.4	118.7	150.2	59.1	0	0	0	0	121.1
778	K	30.3	Very low	29.3	Very low	181 Å²	181	145 Å²	145	79%	0.787	74%	0.74	S	S	*	*				175.3	140.6	103.1	-97.5	-179	-178.8	177.8	0	115.4
779	N	29.8	Very low	29.3	Very low	155 Å²	155	145.6 Å²	145.6	83%	0.829	75%	0.745	S	S	*	*			trans	68.3	161.8	146.6	-63.3	19.4	0	0	0	120.5
780	S	27.4	Very low	29.3	Very low	110 Å²	110	143.2 Å²	143.2	77%	0.769	75%	0.754	S	S	*	*			trans	-161.3	164.8	-159.5	178.6	0	0	0	0	107.1
781	P	44.3	Very low	29.4	Very low	97 Å²	97	139.7 Å²	139.7	63%	0.63	76%	0.762	S	S	*	*			cis	-126.2	-176.4	-25.5	26.1	-4	0	0	0	112.6
782	D	27.8	Very low	29.1	Very low	137 Å²	137	138.1 Å²	138.1	73%	0.733	77%	0.769	S	S	*	*				139.5	103.9	125.7	-77.7	-26.3	0	0	0	114
783	H	27.2	Very low	29.5	Very low	182 Å²	182	137.6 Å²	137.6	84%	0.843	77%	0.774	S	S	*	*				-179	157.9	123.8	-112.9	-102.5	0	0	0	113.1
784	E	30.3	Very low	29.7	Very low	162 Å²	162	138 Å²	138	76%	0.757	78%	0.781	S	S	*	*			trans	69.4	108.8	156.5	-68.2	-167.6	163.1	0	0	123.8
785	L	26	Very low	29.6	Very low	142 Å²	142	141.2 Å²	141.2	74%	0.743	79%	0.792	S	S	*	*				65.8	137.2	120	-95.3	77.1	0	0	0	125.1
786	K	26.6	Very low	29.4	Very low	171 Å²	171	145.8 Å²	145.8	74%	0.743	80%	0.795	S	S	*	*			trans	48	118.9	143.3	-72.6	-172.5	178.6	179.8	0	121.4
787	F	24.9	Very low	29.6	Very low	194 Å²	194	150 Å²	150	85%	0.851	81%	0.805	S	S	*	*			trans	47.3	114	135.5	-82.8	-91.8	0	0	0	120.1
788	L	27.1	Very low	29.8	Very low	175 Å²	175	152.4 Å²	152.4	92%	0.916	81%	0.808	S	S	*	*			trans	-115.6	108.2	158	-84.8	168.1	0	0	0	110.9
789	M	28.4	Very low	29.8	Very low	184 Å²	184	150.7 Å²	150.7	91%	0.906	81%	0.808	S	S	*	*			trans	-100	115.6	155	-83.2	-84.8	-83.7	0	0	107.4
790	G	30.2	Very low	29.9	Very low	73 Å²	73	152.1 Å²	152.1	75%	0.753	81%	0.809	S	S	*	*			trans	-119.2	156.2	174.8	0	0	0	0	0	111.2
791	A	32.5	Very low	30	Very low	99 Å²	99	152.4 Å²	152.4	82%	0.818	81%	0.807	S	S	*	*			cis	-156	154.6	-1.1	0	0	0	0	0	111.2
792	C	25.4	Very low	29.1	Very low	124 Å²	124	153.6 Å²	153.6	84%	0.838	82%	0.816	S	S	*	*			trans	-79	166.7	168.7	-53.6	0	0	0	0	111.6
793	P	37.2	Very low	29.3	Very low	128 Å²	128	153 Å²	153	83%	0.831	82%	0.822	S	S	*	*			trans	-115.1	132.4	140	33.3	-27.3	0	0	0	112.2
794	T	31.6	Very low	29.5	Very low	129 Å²	129	149.9 Å²	149.9	79%	0.791	82%	0.816	S	S	*	*			trans	-60.9	149	-173.6	51.9	0	0	0	0	116.8
795	L	27.8	Very low	29.4	Very low	184 Å²	184	152.5 Å²	152.5	96%	0.963	83%	0.825	S	S	*	*			trans	-116.6	148.5	143.5	-100	168.9	0	0	0	109.5
796	R	27.4	Very low	29.6	Very low	233 Å²	233	154.9 Å²	154.9	88%	0.879	83%	0.83	S	S	*	*			trans	-149.5	89.2	-166.1	-166.7	-173.9	-167.9	-170.4	6	114.4
797	Q	32	Very low	29.7	Very low	174 Å²	174	151.2 Å²	151.2	81%	0.813	83%	0.832	S	S	*	*			trans	-154.7	151.5	167.7	-75.8	-174.5	-6.1	0	0	107.6
798	Q	31.5	Very low	29.8	Very low	166 Å²	166	145.4 Å²	145.4	78%	0.776	83%	0.826	S	S	*	*			cis	-154.5	177.4	-11.4	-123.3	177	5.6	0	0	110.5
799	N	30.3	Very low	30	Very low	145 Å²	145	142.1 Å²	142.1	78%	0.775	82%	0.818	S	S	*	*			trans	-69.3	148.6	-168.1	-50.4	-34.8	0	0	0	116.5
800	Q	32.1	Very low	30	Very low	186 Å²	186	138 Å²	138	87%	0.869	81%	0.807	S	S	*	*				-170.8	98.4	130	-101	174.1	27.1	0	0	108.6
801	T	30.4	Very low	30	Very low	116 Å²	116	142.7 Å²	142.7	71%	0.712	81%	0.809	S	S	*	*				75.7	98.6	79	60.4	0	0	0	0	116.7
802	C	25.1	Very low	29.7	Very low	121 Å²	121	145 Å²	145	82%	0.818	81%	0.807	S	S	*	*			trans	21.6	135	144.9	-54.8	0	0	0	0	122
803	S	31.5	Very low	29.8	Very low	125 Å²	125	143.5 Å²	143.5	87%	0.874	80%	0.797	S	S	*	*				-136.1	164.1	112.5	71.8	0	0	0	0	110.1
804	T	31.3	Very low	29.3	Very low	116 Å²	116	144.4 Å²	144.4	71%	0.712	80%	0.795	S	S	*	*			trans	-135.5	146.4	-168.9	54.1	0	0	0	0	112.1
805	F	27.8	Very low	29.2	Very low	217 Å²	217	145.5 Å²	145.5	95%	0.952	80%	0.796	S	S	*	*			trans	-134.5	115.6	148.5	-103.5	-80.4	0	0	0	112.1
806	K	29.9	Very low	29.2	Very low	193 Å²	193	147.3 Å²	147.3	84%	0.839	79%	0.789	S	S	*	*			trans	-94.6	164.2	158.7	-87	-169.7	172.3	-176.9	0	108.1
807	A	29.2	Very low	29.3	Very low	94 Å²	94	142.5 Å²	142.5	78%	0.777	78%	0.78	S	S	*	*			cis	-176.7	165.5	-23.2	0	0	0	0	0	109.1
808	G	27.5	Very low	29.2	Very low	71 Å²	71	142 Å²	142	73%	0.732	78%	0.782	S	S	*	*			trans	105.1	155.8	154	0	0	0	0	0	116.5
809	S	30.3	Very low	29.1	Very low	107 Å²	107	138.8 Å²	138.8	75%	0.748	78%	0.779	S	S	*	*			cis	-179.8	148.3	-16.1	39.5	0	0	0	0	110.6
810	S	29.8	Very low	29.5	Very low	97 Å²	97	138.3 Å²	138.3	68%	0.678	78%	0.784	S	S	*	*			trans	49.6	110	148.2	57.7	0	0	0	0	119.5
811	Q	29.7	Very low	29.4	Very low	171 Å²	171	133.8 Å²	133.8	80%	0.799	77%	0.772	S	S	*	*				87.6	138.6	75.3	-93	-169.6	-15.3	0	0	115.5
812	I	26.8	Very low	29.5	Very low	149 Å²	149	139.1 Å²	139.1	76%	0.764	78%	0.781	S	S	*	*			trans	72.4	134.9	151.9	-67.8	165.5	0	0	0	115
813	S	26.5	Very low	29.8	Very low	92 Å²	92	141.5 Å²	141.5	64%	0.643	78%	0.778	S	S	*	*			cis	-164	163.3	3.4	44.5	0	0	0	0	114.4
814	D	27.3	Very low	29.7	Very low	146 Å²	146	143.3 Å²	143.3	78%	0.781	78%	0.777	S	S	*	*			trans	59.2	124.9	146.3	-62.2	-6.9	0	0	0	124.4
815	L	29.9	Very low	29.8	Very low	153 Å²	153	143.6 Å²	143.6	80%	0.801	78%	0.781	S	S	*	*				171.3	121.8	116.9	-86.2	164.9	0	0	0	109.3
816	R	26.8	Very low	29.8	Very low	221 Å²	221	137.1 Å²	137.1	83%	0.834	78%	0.776	S	S	*	*				60.9	134.1	89.7	-91.4	-165.2	178.1	-180	0.9	114.7
817	I	29.3	Very low	29.9	Very low	132 Å²	132	133.6 Å²	133.6	68%	0.677	78%	0.776	S	S	*	*			cis	-150.4	142.1	4.8	-43.9	176.8	0	0	0	108.8
818	N	30.5	Very low	29.8	Very low	163 Å²	163	136.3 Å²	136.3	87%	0.872	78%	0.775	S	S	*	*			trans	-174.6	145.9	130.6	-100.5	-17.9	0	0	0	113.4
819	S	29.5	Very low	29.9	Very low	100 Å²	100	144.4 Å²	144.4	70%	0.699	78%	0.784	S	S	*	*			trans	-159.9	155.9	178.4	58.1	0	0	0	0	109.3
820	P	37.9	Very low	29.8	Very low	135 Å²	135	146.5 Å²	146.5	88%	0.877	79%	0.787	S	S	*	*			trans	-117.3	156.7	135.4	34.8	-30.6	0	0	0	111.7
821	S	29.8	Very low	29.7	Very low	90 Å²	90	150.2 Å²	150.2	63%	0.629	80%	0.798	S	S	*	*			trans	-106.1	144.8	-174.5	160.3	0	0	0	0	110.8
822	Y	34	Very low	29.8	Very low	228 Å²	228	148.2 Å²	148.2	89%	0.894	80%	0.798	S	S	*	*			trans	-127.5	147.6	141.3	-120	-91.2	0	0	0	109.6
823	K	30.3	Very low	29.9	Very low	172 Å²	172	146.6 Å²	146.6	75%	0.748	80%	0.799	S	S	*	*			trans	-126.5	144.5	175.8	-72.8	-177.9	175.3	-177.8	0	108.1
824	D	29.1	Very low	30.3	Very low	162 Å²	162	147.7 Å²	147.7	87%	0.866	81%	0.805	S	S	*	*			trans	-149.3	147.8	130.7	-107.8	-34.5	0	0	0	110.2
825	P	32.9	Very low	30.5	Very low	122 Å²	122	148.1 Å²	148.1	79%	0.792	81%	0.807	S	S	*	*			trans	-117.6	133.8	-174.9	38	-25.9	0	0	0	114.8
826	G	29.1	Very low	30.4	Very low	81 Å²	81	149.3 Å²	149.3	84%	0.835	81%	0.808	S	S	*	*			trans	133	145	169.9	0	0	0	0	0	112.2
827	S	31.8	Very low	30.7	Very low	120 Å²	120	146.8 Å²	146.8	84%	0.839	81%	0.809	S	S	*	*			cis	-141.6	159.7	2.3	-169.4	0	0	0	0	112.5
828	I	26.7	Very low	30.6	Very low	151 Å²	151	146 Å²	146	77%	0.774	81%	0.811	S	S	*	*			trans	-51.6	128.7	-177.5	-61.5	157.9	0	0	0	113.2
829	R	29.7	Very low	30.5	Very low	240 Å²	240	146.6 Å²	146.6	91%	0.906	81%	0.808	S	S	*	*			trans	-164.1	112	132.1	-107.8	168.8	-165.2	-151.2	2.4	111.2
830	N	27.9	Very low	30.5	Very low	151 Å²	151	146.3 Å²	146.3	81%	0.807	80%	0.799	S	S	*	*			trans	-75.6	126.2	171.7	-67.7	-2.1	0	0	0	109.6
831	L	29.2	Very low	30	Very low	176 Å²	176	148.1 Å²	148.1	92%	0.921	80%	0.8	S	S	*	*			trans	-96.9	112.1	155.6	-82.8	165.9	0	0	0	107.6	S833	L831-S833 PolarHBondContact O-N 3.44Å
832	T	30.2	Very low	30.1	Very low	129 Å²	129	151.5 Å²	151.5	79%	0.791	81%	0.805	S	S	*	*			trans	-87.5	98.4	175.3	49.2	0	0	0	0	109.8
833	S	30.4	Very low	29.8	Very low	114 Å²	114	145.8 Å²	145.8	80%	0.797	80%	0.799	S	S	*	*			trans	-73.7	133.4	161.7	42.8	0	0	0	0	109.8	L831	L831-S833 PolarHBondContact O-N 3.44Å
834	P	34.4	Very low	29.8	Very low	116 Å²	116	144.8 Å²	144.8	75%	0.753	80%	0.799	S	S	*	*			trans	-87.5	121.8	175	32.1	-30.7	0	0	0	111.6
835	N	31	Very low	29.7	Very low	155 Å²	155	144.3 Å²	144.3	83%	0.829	80%	0.796	S	S	*	*			trans	47.5	113.9	152.4	-57.2	-2.5	0	0	0	119.3
836	E	27.5	Very low	29.4	Very low	177 Å²	177	143.1 Å²	143.1	83%	0.827	79%	0.791	S	S	*	*			trans	-59	139.9	158.6	-62.5	163.4	118.1	0	0	111	T838	E836-T838 HydrophobicContact CB-CG2 4.3Å
837	I	33.1	Very low	29.3	Very low	168 Å²	168	142.4 Å²	142.4	86%	0.862	78%	0.783	S	S	*	*			trans	-93.2	96.4	163.5	-61.5	178.3	0	0	0	107.2	E839	I837-E839 PolarHBondContact O-N 3.09Å
838	T	26.8	Very low	29.2	Very low	116 Å²	116	145.7 Å²	145.7	71%	0.712	79%	0.785	S	S	*	*			trans	-85.4	87.1	175.2	52.8	0	0	0	0	110.9	E836	E836-T838 HydrophobicContact CB-CG2 4.3Å
839	E	28.8	Very low	29.3	Very low	175 Å²	175	142.3 Å²	142.3	82%	0.818	79%	0.788	S	S	*	*			trans	-157	74.5	164	-123.9	168.6	-124.5	0	0	112	I837	I837-E839 PolarHBondContact O-N 3.09Å
840	D	30.4	Very low	29.1	Very low	94 Å²	94	137.3 Å²	137.3	50%	0.503	79%	0.788	S	S	.	*			trans	-165.5	78.8	158.8	-93.7	-30.1	0	0	0	110	K359	K359-D840 WeakPolarHBondContact CD-OD2 3.25Å; K359-D840 WeakPolarHBondContact CE-OD1 3.21Å; K359-D840 WeakPolarHBondContact CE-OD2 3.45Å; K359-D840 IonicContact NZ-OD1 2.68Å; K359-D840 PolarHBondContact NZ-OD1 3.18Å; K359-D840 IonicContact NZ-OD2 2.72Å; K359-D840 PolarHBondContact NZ-OD2 3.49Å
841	I	27.9	Very low	29.2	Very low	173 Å²	173	135.8 Å²	135.8	89%	0.887	79%	0.79	S	S	*	*			trans	-119.3	67.5	169.6	-51.5	-177.2	0	0	0	108.8	S843	I841-S843 PolarHBondContact O-N 3.15Å
842	E	30.3	Very low	29.1	Very low	161 Å²	161	132.6 Å²	132.6	75%	0.752	78%	0.777	S	S	*	*			trans	-82.5	95.9	166.4	-68.1	-156.8	134.3	0	0	110.7	M844	E842-M844 PolarHBondContact O-N 3.31Å
843	S	28.5	Very low	29	Very low	109 Å²	109	133.3 Å²	133.3	76%	0.762	78%	0.776	S	S	*	*			trans	43	62.9	141.5	-171.5	0	0	0	0	118.6	I841 D845	I841-S843 PolarHBondContact O-N 3.15Å; S843-D845 PolarHBondContact O-N 3.26Å
844	M	30.6	Very low	29.1	Very low	150 Å²	150	134.5 Å²	134.5	74%	0.739	78%	0.779	S	S	*	*			trans	-90.7	77.5	156.7	-66.2	-161.7	97.9	0	0	111	E842 S846	E842-M844 PolarHBondContact O-N 3.31Å; M844-S846 VanDerWaalsContact C-N 3.3Å; M844-S846 PolarHBondContact O-N 3.02Å
845	D	25.9	Very low	28.8	Very low	152 Å²	152	132.2 Å²	132.2	81%	0.813	78%	0.777	S	S	*	*			trans	-79.1	79.1	169.3	-169.8	7.1	0	0	0	110.6	S843	S843-D845 PolarHBondContact O-N 3.26Å
846	S	28.3	Very low	28.9	Very low	97 Å²	97	133.3 Å²	133.3	68%	0.678	78%	0.779	S	S	*	*			trans	-109.4	75.6	174.7	65.7	0	0	0	0	110.7	M844 H848	M844-S846 VanDerWaalsContact C-N 3.3Å; M844-S846 PolarHBondContact O-N 3.02Å; S846-H848 PolarHBondContact O-N 2.84Å
847	G	25.7	Very low	29.2	Very low	66 Å²	66	131.2 Å²	131.2	68%	0.68	77%	0.772	S	S	*	*			trans	-61	95.4	179.5	0	0	0	0	0	114
848	H	30	Very low	29	Very low	189 Å²	189	131.2 Å²	131.2	88%	0.875	77%	0.768	S	S	*	*			trans	-121.7	79.2	163.5	-91.5	24.7	0	0	0	109.9	S846 C850	S846-H848 PolarHBondContact O-N 2.84Å; H848-C850 PolarHBondContact O-N 2.81Å
849	G	28.6	Very low	29.3	Very low	81 Å²	81	132 Å²	132	84%	0.835	77%	0.768	S	S	*	*			trans	-78.2	106.7	172.7	0	0	0	0	0	111.4
850	C	24.9	Very low	29.4	Very low	135 Å²	135	131.1 Å²	131.1	91%	0.912	76%	0.763	S	S	*	*			trans	-76.5	118.1	158.1	-67.5	0	0	0	0	109	H848	H848-C850 PolarHBondContact O-N 2.81Å
851	S	30.1	Very low	29.4	Very low	119 Å²	119	135.2 Å²	135.2	83%	0.832	78%	0.777	S	S	*	*			trans	-132.7	138.6	160.5	-171.7	0	0	0	0	108.7
852	T	28.3	Very low	29.8	Very low	108 Å²	108	131.9 Å²	131.9	66%	0.663	77%	0.767	S	S	*	*			trans	-97.1	-177.1	-172.5	45.1	0	0	0	0	112.2
853	D	27.6	Very low	29.8	Very low	145 Å²	145	132 Å²	132	78%	0.775	77%	0.773	S	S	*	*			trans	75.3	136.3	159	-51	-55.5	0	0	0	116.4
854	T	31.5	Very low	30	Very low	139 Å²	139	131.8 Å²	131.8	85%	0.853	77%	0.771	S	S	*	*			cis	-135.9	161.1	5.4	50.8	0	0	0	0	109.4
855	G	29.5	Very low	30	Very low	68 Å²	68	136.8 Å²	136.8	70%	0.701	78%	0.782	S	S	*	*			cis	145.5	161.6	6.1	0	0	0	0	0	109.4
856	M	32.3	Very low	30.5	Very low	177 Å²	177	135 Å²	135	87%	0.872	78%	0.779	S	S	*	*			trans	163.8	114.3	153.2	-84.9	-96	-174.2	0	0	113.6
857	I	33.3	Very low	30.6	Very low	133 Å²	133	139.1 Å²	139.1	68%	0.682	79%	0.787	S	S	*	*			trans	62	94.6	141	-48	178.9	0	0	0	120.6
858	E	29.1	Very low	30.8	Very low	168 Å²	168	140.6 Å²	140.6	79%	0.785	79%	0.787	S	S	*	*				25.5	125	124.8	-54.7	179.4	140.7	0	0	122.5
859	N	32.8	Very low	30.7	Very low	132 Å²	132	136.5 Å²	136.5	71%	0.706	78%	0.78	S	S	*	*				164.9	123.1	113.4	-89.5	-74.8	0	0	0	110.3
860	H	32.5	Very low	30.8	Very low	157 Å²	157	140.4 Å²	140.4	73%	0.727	78%	0.781	S	S	*	*				59.7	121.1	85	-82.6	15.6	0	0	0	114
861	F	29.2	Very low	30.9	Very low	181 Å²	181	140.9 Å²	140.9	79%	0.794	77%	0.774	S	S	*	*			cis	-144.6	169.4	4.3	-110.5	-98.4	0	0	0	109.9
862	P	37.3	Very low	30.9	Very low	103 Å²	103	141 Å²	141	67%	0.669	77%	0.77	S	S	*	*			trans	-114.4	166.8	-167.6	40.3	-30.1	0	0	0	116.4
863	N	30.8	Very low	30.8	Very low	163 Å²	163	145 Å²	145	87%	0.872	78%	0.778	S	S	*	*			trans	-171.9	168.2	140.4	-112.1	-53.8	0	0	0	117.1
864	S	32.3	Very low	30.8	Very low	105 Å²	105	149.2 Å²	149.2	73%	0.734	78%	0.783	S	S	*	*			trans	68.6	86.5	159.7	69.1	0	0	0	0	123.4
865	R	29.9	Very low	30.6	Very low	254 Å²	254	148 Å²	148	96%	0.958	78%	0.776	S	S	*	*				58	156.6	126	-77.4	-173.3	172.2	-176.3	-3	123.9
866	P	36.3	Very low	30.7	Very low	115 Å²	115	152.5 Å²	152.5	75%	0.747	78%	0.783	S	S	*	*			trans	-121.4	171.7	-165.6	43.6	-31.1	0	0	0	116.4
867	Q	30.9	Very low	30.5	Very low	184 Å²	184	151.3 Å²	151.3	86%	0.86	78%	0.781	S	S	*	*			trans	-162.5	150.5	150	-119.2	175.9	2.5	0	0	114.5
868	S	29.8	Very low	30.4	Very low	97 Å²	97	150 Å²	150	68%	0.678	79%	0.789	S	S	*	*			trans	4.4	149.4	149.5	47.1	0	0	0	0	121.2
869	S	27.4	Very low	30.3	Very low	103 Å²	103	148 Å²	148	72%	0.72	79%	0.789	S	S	*	*			cis	-178.4	-171.3	3.2	49	0	0	0	0	112.2
870	L	31.5	Very low	30	Very low	163 Å²	163	151.9 Å²	151.9	85%	0.853	80%	0.8	S	S	*	*			trans	103.7	135.3	160.2	-103	75.8	0	0	0	120.4
871	N	26.2	Very low	29.8	Very low	144 Å²	144	155.3 Å²	155.3	77%	0.77	81%	0.807	S	S	*	*			trans	-77	168.6	162.9	-59.9	-43.1	0	0	0	109.4
872	T	29.7	Very low	29.9	Very low	121 Å²	121	156 Å²	156	74%	0.742	81%	0.812	S	S	*	*			cis	-162.9	166.1	45.7	48.3	0	0	0	0	113.2
873	F	25.9	Very low	29.3	Very low	192 Å²	192	157.2 Å²	157.2	84%	0.842	82%	0.818	S	S	*	*			trans	8.9	139.1	150.8	-70.5	-93.8	0	0	0	119.1
874	R	28.4	Very low	29.4	Very low	234 Å²	234	155.9 Å²	155.9	88%	0.883	82%	0.818	S	S	*	*				-166	161.7	52	-146	174.3	-165.6	178.3	4.1	114.1
875	V	27.8	Very low	29.2	Very low	115 Å²	115	154.9 Å²	154.9	70%	0.697	82%	0.817	S	S	*	*			trans	-46.7	137.9	179.4	175.1	0	0	0	0	116.8
876	N	30.7	Very low	29.1	Very low	161 Å²	161	149.4 Å²	149.4	86%	0.861	82%	0.816	S	S	*	*			trans	-160.1	155.3	130.3	-112.4	-26.6	0	0	0	113.6
877	N	27.9	Very low	28.7	Very low	153 Å²	153	153.7 Å²	153.7	82%	0.818	82%	0.819	S	S	*	*			trans	-82.3	136.7	-166.9	-71.2	-37.4	0	0	0	114.9
878	A	30.9	Very low	28.4	Very low	104 Å²	104	151.4 Å²	151.4	86%	0.86	82%	0.821	S	S	*	*			trans	-146.9	117.3	152.2	0	0	0	0	0	109.3
879	T	27.2	Very low	28.4	Very low	128 Å²	128	150.8 Å²	150.8	79%	0.785	82%	0.817	S	S	*	*			trans	-70.9	138.3	-171.8	47.2	0	0	0	0	114.2
880	F	28.2	Very low	28.5	Very low	213 Å²	213	154.2 Å²	154.2	93%	0.934	83%	0.826	S	S	*	*			trans	-142.3	130.1	133.7	-120	-86.7	0	0	0	109.4
881	R	26.8	Very low	28.4	Very low	228 Å²	228	153.9 Å²	153.9	86%	0.86	83%	0.825	S	S	*	*			trans	-103.2	141.9	177	-84.4	-178.8	169.1	-179.2	-4.5	109.6
882	Q	31.3	Very low	28.4	Very low	195 Å²	195	153.4 Å²	153.4	91%	0.911	83%	0.827	S	S	*	*			trans	-158.6	116.5	130.8	-112.8	171.1	23.3	0	0	111
883	T	25.5	Very low	28.4	Very low	130 Å²	130	153.4 Å²	153.4	80%	0.798	82%	0.819	S	S	*	*			trans	-140.5	133.9	163.4	46.2	0	0	0	0	107.2
884	P	33.7	Very low	28.4	Very low	134 Å²	134	153.8 Å²	153.8	87%	0.87	82%	0.823	S	S	*	*			trans	-88	127.9	171.8	32.6	-29.6	0	0	0	110.1
885	A	27.5	Very low	28.3	Very low	85 Å²	85	149.8 Å²	149.8	70%	0.702	82%	0.819	S	S	*	*			trans	-128.8	125.4	163.9	0	0	0	0	0	107.8	Y887	A885-Y887 PolarHBondContact O-N 3.49Å
886	C	26.8	Very low	28.3	Very low	139 Å²	139	152.6 Å²	152.6	94%	0.939	82%	0.821	S	S	*	*			trans	-83.6	110.4	175.4	-75.5	0	0	0	0	109.6
887	Y	28	Very low	28.2	Very low	205 Å²	205	150.3 Å²	150.3	80%	0.804	82%	0.818	S	S	*	*			trans	-84.7	137.7	168.2	-103.9	-87.2	0	0	0	110.3	A885	A885-Y887 PolarHBondContact O-N 3.49Å
888	C	25	Very low	28.2	Very low	136 Å²	136	148 Å²	148	92%	0.919	82%	0.82	S	S	*	*			trans	-102.1	122.1	140.2	-72.5	0	0	0	0	107.5
889	S	29.7	Very low	28.1	Very low	84 Å²	84	151.2 Å²	151.2	59%	0.587	82%	0.822	S	S	*	*			trans	-135.4	127.2	176.6	179.6	0	0	0	0	108.8
890	L	30.2	Very low	28.1	Very low	175 Å²	175	150.5 Å²	150.5	92%	0.916	82%	0.822	S	S	*	*			trans	-88.9	130	167.4	-85.3	164.7	0	0	0	108.9	V892	L890-V892 PolarHBondContact O-N 3.23Å
891	N	28.6	Very low	28.2	Very low	155 Å²	155	145.4 Å²	145.4	83%	0.829	81%	0.813	S	S	*	*			trans	-75.3	125.8	-167.2	-84.8	-50.4	0	0	0	114.1
892	V	27.5	Very low	28.3	Very low	134 Å²	134	146.3 Å²	146.3	81%	0.812	82%	0.817	S	S	*	*			trans	-135	127.5	145.5	-175.4	0	0	0	0	104.2	L890	L890-V892 PolarHBondContact O-N 3.23Å
893	E	28.8	Very low	28.1	Very low	122 Å²	122	142.2 Å²	142.2	57%	0.57	81%	0.809	S	S	*	*			cis	-145.8	139.8	24.7	-157.4	-171.6	-114.4	0	0	110.7	K896	E893-K896 VanDerWaalsContact CD-NZ 3.27Å; E893-K896 IonicContact OE1-NZ 2.71Å; E893-K896 PolarHBondContact OE1-NZ 2.95Å; E893-K896 VanDerWaalsContact OE1-NZ 3.15Å; E893-K896 IonicContact OE2-NZ 3.61Å; E893-K896 PolarHBondContact OE2-NZ 3.21Å
894	Q	26.2	Very low	28.5	Very low	199 Å²	199	141.8 Å²	141.8	93%	0.93	81%	0.809	S	S	*	*			trans	-132.7	57.8	169.7	-112.5	-161.3	7.5	0	0	112.1
895	L	27	Very low	28.3	Very low	151 Å²	151	143.8 Å²	143.8	79%	0.791	81%	0.807	S	S	*	*			trans	-155.8	76.2	170.7	-127.8	159.2	0	0	0	114
896	K	26.8	Very low	28.4	Very low	173 Å²	173	147 Å²	147	75%	0.752	81%	0.811	S	S	*	*			trans	-130.1	87	167.1	-80.7	-169.2	170.7	83.5	0	111.9	E893	E893-K896 VanDerWaalsContact CD-NZ 3.27Å; E893-K896 IonicContact OE1-NZ 2.71Å; E893-K896 PolarHBondContact OE1-NZ 2.95Å; E893-K896 VanDerWaalsContact OE1-NZ 3.15Å; E893-K896 IonicContact OE2-NZ 3.61Å; E893-K896 PolarHBondContact OE2-NZ 3.21Å
897	S	28.7	Very low	28.3	Very low	114 Å²	114	148 Å²	148	80%	0.797	81%	0.807	S	S	*	*			trans	-150.6	56.6	167.2	67.9	0	0	0	0	112.7
898	A	27.3	Very low	28.4	Very low	104 Å²	104	144 Å²	144	86%	0.86	81%	0.805	S	S	*	*			trans	-133.3	121.1	161.7	0	0	0	0	0	107.9
899	L	29.3	Very low	28.6	Very low	172 Å²	172	143.3 Å²	143.3	90%	0.901	80%	0.797	S	S	*	*			trans	-95.9	146.2	-170.1	-84.6	151	0	0	0	112.2
900	S	26.9	Very low	28.5	Very low	112 Å²	112	146.9 Å²	146.9	78%	0.783	80%	0.804	S	S	*	*			trans	58.2	109	151.1	171.6	0	0	0	0	118.3
901	S	30.4	Very low	28.4	Very low	107 Å²	107	146 Å²	146	75%	0.748	80%	0.796	S	S	*	*				-161.7	137.2	99.4	60.2	0	0	0	0	115.2
902	R	28.7	Very low	28.5	Very low	247 Å²	247	146.6 Å²	146.6	93%	0.932	80%	0.799	S	S	*	*			trans	68.9	143.9	153.1	-78.6	-175	168.2	-177.6	-5.7	123
903	S	27.5	Very low	28.5	Very low	108 Å²	108	146 Å²	146	76%	0.755	79%	0.791	S	S	*	*			trans	-90.7	172.2	179.4	48	0	0	0	0	112.2
904	P	34.7	Very low	28.9	Very low	122 Å²	122	144.6 Å²	144.6	79%	0.792	79%	0.793	S	S	*	*			trans	-94.2	162.8	-168.6	37.7	-36	0	0	0	114.4
905	E	28.9	Very low	29.1	Very low	176 Å²	176	138.9 Å²	138.9	82%	0.822	77%	0.772	S	S	*	*			trans	-146.7	140.7	166.9	-97.3	-172.9	128.8	0	0	113
906	L	30	Very low	29.3	Very low	152 Å²	152	136.7 Å²	136.7	80%	0.796	76%	0.76	S	S	*	*			trans	65.8	122.5	144.9	-61.3	168	0	0	0	122.4
907	L	23.7	Very low	29.4	Very low	161 Å²	161	137.7 Å²	137.7	84%	0.843	76%	0.759	S	S	*	*			trans	-62.1	162.2	152.1	-73.8	152	0	0	0	111.3
908	P	30.1	Very low	29.3	Very low	119 Å²	119	139.4 Å²	139.4	77%	0.773	76%	0.764	S	S	*	*				-127.6	147.2	110.5	3.7	17.1	0	0	0	115.5
909	T	29.9	Very low	29.3	Very low	122 Å²	122	139.9 Å²	139.9	75%	0.748	75%	0.752	S	S	*	*			trans	-23.1	147.3	158.8	51.8	0	0	0	0	119.6
910	E	27.1	Very low	29.1	Very low	159 Å²	159	135.8 Å²	135.8	74%	0.743	74%	0.743	S	S	*	*				7.7	148.3	128.5	-57	-174.9	-177.7	0	0	118.6
911	Q	28.4	Very low	29	Very low	157 Å²	157	138.7 Å²	138.7	73%	0.734	74%	0.738	S	S	*	*			cis	-166.3	138.6	33.2	-145.7	163.9	70.1	0	0	111.2
912	D	30.6	Very low	28.8	Very low	167 Å²	167	144.4 Å²	144.4	89%	0.893	74%	0.743	S	S	*	*			trans	162.9	133.8	141.1	-95.7	-12.7	0	0	0	113
913	D	27.3	Very low	28.6	Very low	123 Å²	123	142.4 Å²	142.4	66%	0.658	74%	0.735	S	S	*	*			trans	-134.6	147.3	169.7	174.6	52.9	0	0	0	108.3	T915	D913-T915 VanDerWaalsContact CG-N 3.32Å; D913-T915 PolarHBondContact OD1-N 2.76Å; D913-T915 PolarHBondContact OD2-N 3.24Å; D913-T915 VanDerWaalsContact OD2-N 3.14Å; D913-T915 PolarHBondContact OD2-OG1 3.22Å; D913-T915 VanDerWaalsContact OD2-OG1 3.1Å
914	P	37.7	Very low	28.5	Very low	92 Å²	92	148.4 Å²	148.4	60%	0.597	74%	0.741	S	S	*	*				-146.1	111.5	114.2	32.7	-14.6	0	0	0	115.9
915	T	30.9	Very low	28.1	Very low	79 Å²	79	148.8 Å²	148.8	49%	0.485	75%	0.747	S	S	.	*				40.1	118.4	117	8.8	0	0	0	0	117.5	D913 F1114	D913-T915 VanDerWaalsContact CG-N 3.32Å; D913-T915 PolarHBondContact OD1-N 2.76Å; D913-T915 PolarHBondContact OD2-N 3.24Å; D913-T915 VanDerWaalsContact OD2-N 3.14Å; D913-T915 PolarHBondContact OD2-OG1 3.22Å; D913-T915 VanDerWaalsContact OD2-OG1 3.1Å; T915-F1114 WeakPolarHBondContact O-CD2 3.22Å; T915-F1114 WeakPolarHBondContact O-CE2 3.38Å
916	L	30.1	Very low	28	Very low	104 Å²	104	143.2 Å²	143.2	55%	0.545	74%	0.736	S	S	.	*				167	158.9	87.8	-91.8	143.9	0	0	0	108.2	F1114	L916-F1114 HydrophobicContact CB-CE2 4.11Å; L916-F1114 HydrophobicContact CB-CZ 3.96Å; L916-F1114 HydrophobicContact CD1-CD1 4.02Å; L916-F1114 HydrophobicContact CD1-CD2 4.09Å; L916-F1114 HydrophobicContact CD1-CE1 3.93Å; L916-F1114 HydrophobicContact CD1-CE2 4.01Å; L916-F1114 HydrophobicContact CD1-CG 4.11Å; L916-F1114 HydrophobicContact CD1-CZ 3.92Å
917	R	29.4	Very low	27.9	Very low	195 Å²	195	143 Å²	143	74%	0.736	74%	0.741	S	S	*	*			cis	-136.9	145.4	5.5	-61.9	177.5	169.4	166	-4	111.2
918	V	26.7	Very low	28	Very low	149 Å²	149	143 Å²	143	90%	0.903	74%	0.742	S	S	*	*				-129.2	122.3	126.8	171.6	0	0	0	0	105.7
919	L	27.1	Very low	28	Very low	114 Å²	114	142.5 Å²	142.5	60%	0.597	74%	0.738	S	S	*	*			trans	-97.4	103.6	-177.3	-93.8	167.9	0	0	0	110.7
920	A	25.7	Very low	27.8	Very low	86 Å²	86	143.5 Å²	143.5	71%	0.711	74%	0.738	S	S	*	*			trans	-69.8	146.7	153.9	0	0	0	0	0	109.4
921	Y	25.2	Very low	27.6	Very low	174 Å²	174	140.5 Å²	140.5	68%	0.682	73%	0.734	S	S	*	*			trans	-127.5	94.9	160.7	-123.2	-82.1	0	0	0	110.7	R923	Y921-R923 HydrophobicContact CD1-CG 4.34Å; Y921-R923 HydrophobicContact CE1-CG 4.11Å; Y921-R923 PolarHBondContact OH-NH2 3.2Å
922	R	24.3	Very low	27.4	Very low	226 Å²	226	136.8 Å²	136.8	85%	0.853	73%	0.725	S	S	*	*			trans	-112.3	113.6	169.1	-157.7	-175.9	-157.8	-175	8.8	106.8
923	R	26.2	Very low	27.4	Very low	206 Å²	206	135.5 Å²	135.5	78%	0.777	72%	0.717	S	S	*	*			trans	-115.3	121.2	164.1	-78.8	-165.5	-179.3	-177.7	8	109.2	Y921	Y921-R923 HydrophobicContact CD1-CG 4.34Å; Y921-R923 HydrophobicContact CE1-CG 4.11Å; Y921-R923 PolarHBondContact OH-NH2 3.2Å
924	R	24.8	Very low	27.5	Very low	234 Å²	234	134.5 Å²	134.5	88%	0.883	72%	0.717	S	S	*	*			trans	-98.3	128.2	161.7	-88.9	-175.3	167.8	-176.9	-3.5	108.3
925	S	27.1	Very low	27	Very low	130 Å²	130	135.8 Å²	135.8	91%	0.909	72%	0.718	S	S	*	*			trans	-172	124.7	156.3	-173	0	0	0	0	106.5
926	G	25.7	Very low	26.9	Very low	58 Å²	58	138.4 Å²	138.4	60%	0.598	73%	0.729	S	S	*	*			cis	-169	-166.4	-3.4	0	0	0	0	0	110.8
927	T	27.8	Very low	26.9	Very low	147 Å²	147	139 Å²	139	90%	0.902	73%	0.732	S	S	*	*			trans	53.2	102.8	163.6	52.4	0	0	0	0	119.9
928	L	25.6	Very low	27	Very low	163 Å²	163	134.6 Å²	134.6	85%	0.853	72%	0.723	S	S	*	*				-70.1	172.6	129.9	-77.5	165.2	0	0	0	109.3
929	P	31.6	Very low	27	Very low	107 Å²	107	133.5 Å²	133.5	70%	0.695	71%	0.712	S	S	*	*			cis	-142.2	168.3	17.2	42.7	-23.9	0	0	0	119.2
930	L	24.4	Very low	27	Very low	144 Å²	144	133.6 Å²	133.6	75%	0.754	71%	0.713	S	S	*	*			trans	54.2	114.6	140.4	-67.2	166.9	0	0	0	123.7
931	C	22.7	Very low	27	Very low	96 Å²	96	137.4 Å²	137.4	65%	0.649	72%	0.715	S	S	*	*				62.3	123.3	126.5	-65.1	0	0	0	0	123.3	Q627	Q627-C931 PolarHBondContact NE2-O 3.39Å
932	S	24.3	Very low	27.1	Very low	79 Å²	79	135.8 Å²	135.8	55%	0.552	72%	0.719	S	S	*	*			trans	-151.7	125.8	137.8	-62.4	0	0	0	0	110
933	I	30.8	Very low	27.2	Very low	140 Å²	140	133.2 Å²	133.2	72%	0.718	72%	0.716	S	S	*	*			trans	-97.5	156.4	166.6	-65.3	170.1	0	0	0	108.1	I935	I933-I935 HydrophobicContact CG2-CD1 4.24Å; I933-I935 HydrophobicContact CG2-CG1 3.86Å
934	P	30.5	Very low	27.1	Very low	102 Å²	102	130.1 Å²	130.1	66%	0.662	72%	0.715	S	S	*	*			trans	-127.6	129.3	140.1	34.9	-26.2	0	0	0	113
935	I	26.9	Very low	27.1	Very low	119 Å²	119	123.5 Å²	123.5	61%	0.61	71%	0.705	S	S	*	*			trans	-93.1	155.6	171.3	-70.4	151.9	0	0	0	109	I933	I933-I935 HydrophobicContact CG2-CD1 4.24Å; I933-I935 HydrophobicContact CG2-CG1 3.86Å
936	N	28.9	Very low	27.2	Very low	133 Å²	133	125 Å²	125	71%	0.711	70%	0.701	S	S	*	*			trans	-179.1	134.8	140.9	-94.6	1.6	0	0	0	107.9
937	N	30.1	Very low	27.1	Very low	117 Å²	117	129.7 Å²	129.7	63%	0.626	71%	0.711	S	S	*	*			cis	-139.9	149	-0.3	-90.8	-41.9	0	0	0	107.2
938	N	30.2	Very low	27.5	Very low	102 Å²	102	127.5 Å²	127.5	55%	0.545	70%	0.7	S	S	.	*				61.2	137.5	56.8	-56.5	-33.3	0	0	0	113
939	N	27	Very low	27.5	Very low	126 Å²	126	125.2 Å²	125.2	67%	0.674	69%	0.693	S	S	*	*			cis	-171.5	151.1	-24.5	-116.4	8.7	0	0	0	108.3
940	I	28.1	Very low	27.2	Very low	117 Å²	117	128 Å²	128	60%	0.6	70%	0.696	S	S	*	*			trans	68.4	129.8	137.9	-66.4	173.1	0	0	0	120.2
941	E	26.1	Very low	27.4	Very low	165 Å²	165	131.1 Å²	131.1	77%	0.771	70%	0.704	S	S	*	*			trans	59.3	146.1	154	-69.5	152.6	-152.1	0	0	119.4
942	D	25.6	Very low	27.4	Very low	141 Å²	141	131.3 Å²	131.3	75%	0.754	71%	0.706	S	S	*	*			cis	-159.7	-179	-9.3	-128.5	-19.9	0	0	0	112.5
943	E	26.6	Very low	27.7	Very low	171 Å²	171	134.7 Å²	134.7	80%	0.799	72%	0.724	S	S	*	*			trans	70.7	121.3	159.8	-66.3	-116.3	126.4	0	0	121.6
944	D	25.6	Very low	27.4	Very low	142 Å²	142	137.1 Å²	137.1	76%	0.759	73%	0.73	S	S	*	*			trans	45.6	107.1	137.7	-99	30.3	0	0	0	123.2
945	S	24.2	Very low	27.4	Very low	94 Å²	94	139.7 Å²	139.7	66%	0.657	74%	0.737	S	S	*	*				136.9	152.6	101.5	71.2	0	0	0	0	116.9
946	I	28.8	Very low	27.4	Very low	163 Å²	163	140.5 Å²	140.5	84%	0.836	74%	0.742	S	S	*	*			trans	76.9	117.5	161	-61.8	165.4	0	0	0	119
947	L	24.4	Very low	27.2	Very low	155 Å²	155	139.3 Å²	139.3	81%	0.812	75%	0.745	S	S	*	*			trans	-66.5	172.8	164.6	-104.5	71.6	0	0	0	113.3
948	P	35.3	Very low	27.2	Very low	101 Å²	101	138.5 Å²	138.5	66%	0.656	75%	0.754	S	S	*	*			cis	-142.6	-166.2	-15.2	34.6	-11.6	0	0	0	115.3
949	T	26.3	Very low	27.1	Very low	115 Å²	115	143.2 Å²	143.2	71%	0.706	77%	0.769	S	S	*	*			trans	83.6	123.7	153.1	55.9	0	0	0	0	122.7
950	H	25.2	Very low	27.1	Very low	167 Å²	167	142.4 Å²	142.4	77%	0.773	77%	0.774	S	S	*	*			trans	32.8	125.1	143.2	-69	-84.5	0	0	0	121.6
951	F	27	Very low	27	Very low	208 Å²	208	141.4 Å²	141.4	91%	0.912	78%	0.777	S	S	*	*				-159.7	163.7	104	-121.2	-85.2	0	0	0	111.8
952	S	24.5	Very low	27.2	Very low	100 Å²	100	141.3 Å²	141.3	70%	0.699	78%	0.782	S	S	*	*			trans	-128.5	141.4	177.1	-52	0	0	0	0	111.7
953	T	30	Very low	27.3	Very low	151 Å²	151	141.5 Å²	141.5	93%	0.926	78%	0.783	S	S	*	*			trans	-155.5	153	156.4	10.4	0	0	0	0	112.3
954	K	25.1	Very low	27.3	Very low	191 Å²	191	140.6 Å²	140.6	83%	0.83	78%	0.783	S	S	*	*			trans	-95.4	162.2	179.5	-54.4	169.8	179.4	175.9	0	111.2
955	L	28.9	Very low	27.3	Very low	156 Å²	156	140.5 Å²	140.5	82%	0.817	78%	0.782	S	S	*	*			trans	-160.8	127.3	132.5	-133.6	72.9	0	0	0	114.4
956	N	28.1	Very low	27.6	Very low	136 Å²	136	146.1 Å²	146.1	73%	0.727	79%	0.794	S	S	*	*			trans	24.9	160.1	134.4	-56.2	2.5	0	0	0	123.1
957	S	25	Very low	27.3	Very low	108 Å²	108	144.1 Å²	144.1	76%	0.755	79%	0.789	S	S	*	*			cis	171.8	123.9	-38.9	55.7	0	0	0	0	111.8
958	A	28.7	Very low	27.5	Very low	99 Å²	99	142.5 Å²	142.5	82%	0.818	79%	0.786	S	S	*	*			trans	-167	128.9	156.5	0	0	0	0	0	108.3
959	K	29.3	Very low	27.1	Very low	201 Å²	201	144.8 Å²	144.8	87%	0.874	79%	0.792	S	S	*	*				80.3	106.2	51.2	-89.6	-161.1	171.8	-172.2	0	116.1
960	S	26.8	Very low	27.1	Very low	110 Å²	110	146 Å²	146	77%	0.769	80%	0.8	S	S	*	*			trans	65.7	140.2	134.9	-176.4	0	0	0	0	119.3
961	S	26.2	Very low	27.2	Very low	95 Å²	95	147.6 Å²	147.6	66%	0.664	81%	0.805	S	S	*	*			cis	-168.8	161.7	-16.7	-88.9	0	0	0	0	107.9
962	N	30.6	Very low	27.4	Very low	163 Å²	163	143.2 Å²	143.2	87%	0.872	80%	0.799	S	S	*	*			trans	-176.7	128.6	138.9	-99.1	-9.2	0	0	0	111.6
963	D	25.9	Very low	27.5	Very low	146 Å²	146	142.9 Å²	142.9	78%	0.781	80%	0.796	S	S	*	*			trans	-80.3	147.2	162.2	-58	-77.3	0	0	0	110.5
964	L	27.1	Very low	27.4	Very low	152 Å²	152	142.9 Å²	142.9	80%	0.796	79%	0.789	S	S	*	*				-174.7	148.7	108.1	-131.8	71.1	0	0	0	113.2
965	L	26.5	Very low	27.5	Very low	140 Å²	140	142.7 Å²	142.7	73%	0.733	79%	0.788	S	S	*	*			trans	55.7	106.1	154.8	-113.3	73.6	0	0	0	119.4
966	K	30	Very low	27.3	Very low	212 Å²	212	144.5 Å²	144.5	92%	0.922	79%	0.785	S	S	*	*				-152.1	86	122	-118.6	178.3	-175.1	-177.9	0	112.5
967	T	22.7	Very low	27.2	Very low	120 Å²	120	142.8 Å²	142.8	74%	0.736	78%	0.776	S	S	*	*			trans	-74.5	131.3	156.9	44.1	0	0	0	0	109.9
968	V	28	Very low	27.2	Very low	122 Å²	122	145.1 Å²	145.1	74%	0.739	78%	0.779	S	S	*	*			trans	-172.5	131.3	138.8	140.2	0	0	0	0	107.5
969	D	26.3	Very low	27.1	Very low	148 Å²	148	147.7 Å²	147.7	79%	0.791	77%	0.774	S	S	*	*			trans	41.3	98.3	163.9	-54	-20.1	0	0	0	119.6
970	T	28.2	Very low	27	Very low	142 Å²	142	147 Å²	147	87%	0.871	77%	0.774	S	S	*	*			trans	-152.2	112.4	144.1	-3.4	0	0	0	0	109.1
971	K	25.9	Very low	26.9	Very low	199 Å²	199	151 Å²	151	87%	0.865	78%	0.78	S	S	*	*			trans	-115.1	96.3	165.3	-89.5	-167.6	170.8	-165	0	107.7
972	C	31.9	Very low	26.9	Very low	116 Å²	116	154.6 Å²	154.6	78%	0.784	79%	0.787	S	S	*	*	S	Bend	trans	-154.2	155.6	164.1	-84.1	0	0	0	0	107.2	L974	C972-L974 PolarHBondContact O-N 3.28Å
973	C	27.2	Very low	26.9	Very low	94 Å²	94	152.6 Å²	152.6	64%	0.635	78%	0.783	S	S	*	*			trans	-70.3	110	-168.1	-72.3	0	0	0	0	113.8
974	L	27.7	Very low	27	Very low	150 Å²	150	155.2 Å²	155.2	79%	0.785	79%	0.787	S	S	*	*			trans	-124.9	85.3	166.3	-84.5	175.6	0	0	0	110.9	C972 Y976	C972-L974 PolarHBondContact O-N 3.28Å; L974-Y976 PolarHBondContact O-N 2.72Å; L974-Y976 VanDerWaalsContact O-N 3.09Å
975	K	26.4	Very low	27.1	Very low	187 Å²	187	155.7 Å²	155.7	81%	0.813	79%	0.79	S	S	*	*			trans	-75.8	91.4	174.3	-174.9	177.9	178.7	178.2	0	110.4	N977	K975-N977 PolarHBondContact O-N 3.04Å
976	Y	23.8	Very low	27.1	Very low	194 Å²	194	160.4 Å²	160.4	76%	0.761	80%	0.798	S	S	*	*			trans	-65.9	89.9	172.3	-90.4	-92.2	0	0	0	111.8	L974 I978	L974-Y976 PolarHBondContact O-N 2.72Å; L974-Y976 VanDerWaalsContact O-N 3.09Å; Y976-I978 PolarHBondContact O-N 3.04Å
977	N	26.5	Very low	26.9	Very low	100 Å²	100	158.6 Å²	158.6	54%	0.535	80%	0.798	S	S	.	*			trans	-76.3	96.3	167	-114.3	48.9	0	0	0	109.5	K975 E979	K975-N977 PolarHBondContact O-N 3.04Å; N977-E979 PolarHBondContact ND2-OE2 2.88Å; N977-E979 PolarHBondContact O-N 2.99Å
978	I	24.4	Very low	26.9	Very low	158 Å²	158	158.4 Å²	158.4	81%	0.81	80%	0.801	S	S	*	*			trans	-79.1	77.7	167.9	-53.7	179.5	0	0	0	108.4	Y976	Y976-I978 PolarHBondContact O-N 3.04Å
979	E	27.5	Very low	26.8	Very low	153 Å²	153	159.3 Å²	159.3	72%	0.715	81%	0.807	S	S	*	*			trans	-109.6	142.6	169.9	-70.9	-165.9	116.9	0	0	111.5	N977 Q981	N977-E979 PolarHBondContact ND2-OE2 2.88Å; N977-E979 PolarHBondContact O-N 2.99Å; E979-Q981 PolarHBondContact O-N 3.4Å
980	Q	26.5	Very low	26.6	Very low	186 Å²	186	157.1 Å²	157.1	87%	0.869	80%	0.803	S	S	*	*			trans	-79.8	116.2	-165.8	-63.5	-178.4	1.3	0	0	111.7	Q982	Q980-Q982 PolarHBondContact O-N 3.01Å; Q980-Q982 VanDerWaalsContact O-N 3.12Å
981	Q	25.8	Very low	26.5	Very low	195 Å²	195	161.9 Å²	161.9	91%	0.911	81%	0.805	S	S	*	*			trans	-65.5	109.8	170.1	-69.4	-175.5	-9.1	0	0	111	E979	E979-Q981 PolarHBondContact O-N 3.4Å
982	Q	26.6	Very low	26.4	Very low	170 Å²	170	158.7 Å²	158.7	79%	0.794	80%	0.797	S	S	*	*			trans	-100.6	125.4	154.8	-72.8	-167	-3.9	0	0	109.1	Q980 K984	Q980-Q982 PolarHBondContact O-N 3.01Å; Q980-Q982 VanDerWaalsContact O-N 3.12Å; Q982-K984 PolarHBondContact O-N 3.18Å
983	P	29.7	Very low	26	Very low	121 Å²	121	159.3 Å²	159.3	79%	0.786	79%	0.793	S	S	*	*			trans	-75.9	119.2	-175	29.4	-34.1	0	0	0	111.6	N985	P983-N985 PolarHBondContact O-N 2.92Å
984	K	29	Very low	26.1	Very low	201 Å²	201	161.2 Å²	161.2	87%	0.874	80%	0.801	S	S	*	*			trans	-97.3	75.2	169.1	-79	-178.1	178.4	168.5	0	111.3	Q982 R986	Q982-K984 PolarHBondContact O-N 3.18Å; K984-R986 PolarHBondContact O-N 2.94Å
985	N	27.4	Very low	26.2	Very low	161 Å²	161	162.5 Å²	162.5	86%	0.861	80%	0.803	S	S	*	*			trans	-59.4	127.3	158.6	-77.4	-9.6	0	0	0	108.8	P983	P983-N985 PolarHBondContact O-N 2.92Å
986	R	27.5	Very low	26.4	Very low	239 Å²	239	159.3 Å²	159.3	90%	0.902	80%	0.804	S	S	*	*			trans	-139.9	67.1	175	-153.7	180	-164.2	-164.1	3.2	112.8	K984	K984-R986 PolarHBondContact O-N 2.94Å
987	L	26.3	Very low	26.5	Very low	175 Å²	175	157.6 Å²	157.6	92%	0.916	81%	0.808	S	S	*	*			trans	-64.4	139.7	158.2	-80.8	165.3	0	0	0	109.6
988	S	22.2	Very low	26.5	Very low	116 Å²	116	158.9 Å²	158.9	81%	0.811	82%	0.824	S	S	*	*			trans	-95.5	130.6	179.4	46	0	0	0	0	111.3
989	V	26.2	Very low	26.7	Very low	140 Å²	140	158.5 Å²	158.5	85%	0.848	82%	0.824	S	S	*	*			trans	-136.6	128.8	160.7	-176.5	0	0	0	0	107.7
990	S	22.5	Very low	26.9	Very low	103 Å²	103	157.1 Å²	157.1	72%	0.72	83%	0.825	S	S	*	*			trans	-113	138.8	178.8	49.6	0	0	0	0	110.6
991	W	25.1	Very low	27.1	Very low	241 Å²	241	152.8 Å²	152.8	91%	0.913	82%	0.816	S	S	*	*			trans	-152.8	169.9	156.6	-93.5	107.2	0	0	0	110.4
992	L	24.8	Very low	27.4	Very low	133 Å²	133	152.3 Å²	152.3	70%	0.696	81%	0.814	S	S	*	*			trans	-96.9	158.1	-152.9	-115.2	63.1	0	0	0	116
993	D	23.4	Very low	27.6	Very low	129 Å²	129	151.3 Å²	151.3	69%	0.69	81%	0.814	S	S	*	*			trans	44.5	125.2	146.3	-56.8	-21.9	0	0	0	121.8
994	T	29.8	Very low	27.6	Very low	133 Å²	133	153.7 Å²	153.7	82%	0.816	81%	0.814	S	S	*	*				-171.9	152.9	93.8	24.2	0	0	0	0	114.7
995	H	28.1	Very low	27.7	Very low	177 Å²	177	151.7 Å²	151.7	82%	0.819	81%	0.811	S	S	*	*			trans	-29.3	142.6	-179.6	-53.2	-76.1	0	0	0	121.1
996	S	30.7	Very low	27.6	Very low	120 Å²	120	148.7 Å²	148.7	84%	0.839	80%	0.803	S	S	*	*				177.7	165.4	90.6	47.3	0	0	0	0	113.8
997	N	26.4	Very low	27.7	Very low	158 Å²	158	146.2 Å²	146.2	85%	0.845	80%	0.799	S	S	*	*			trans	-101.8	151.5	-168.5	-58.6	-32	0	0	0	113.7
998	C	27.4	Very low	27.7	Very low	128 Å²	128	144 Å²	144	87%	0.865	79%	0.792	S	S	*	*				-173.5	158.4	118	-96.4	0	0	0	0	115
999	N	27.2	Very low	28	Very low	150 Å²	150	145.5 Å²	145.5	80%	0.802	80%	0.796	S	S	*	*			trans	-70.8	173.9	175.4	-59.5	-44.6	0	0	0	111.6
1000	T	31.8	Very low	28.1	Very low	123 Å²	123	144.7 Å²	144.7	76%	0.755	79%	0.792	S	S	*	*			cis	-166.1	152.3	32.3	-29.2	0	0	0	0	113.4
1001	S	31.1	Very low	28.4	Very low	96 Å²	96	145.3 Å²	145.3	67%	0.671	80%	0.796	S	S	*	*			trans	49.6	113.9	146	60	0	0	0	0	123.7
1002	Q	33	Very low	28.6	Very low	184 Å²	184	140 Å²	140	86%	0.86	79%	0.79	S	S	*	*				59.1	101.5	127.6	-67.2	-176.4	-27	0	0	122.3
1003	N	29.6	Very low	28.8	Very low	149 Å²	149	139.3 Å²	139.3	80%	0.797	80%	0.795	S	S	*	*				13.8	124	127.7	-57.6	-5.8	0	0	0	119.7
1004	H	30.9	Very low	29.2	Very low	172 Å²	172	137 Å²	137	80%	0.796	79%	0.794	S	S	*	*				-169.8	148.5	103.5	-112.9	-79.8	0	0	0	114.1
1005	I	30.1	Very low	29.9	Very low	159 Å²	159	135.9 Å²	135.9	82%	0.815	79%	0.789	S	S	*	*			trans	73.1	165.4	159.3	-62.2	161.4	0	0	0	115.4
1006	S	26.6	Very low	30.2	Very low	98 Å²	98	133.8 Å²	133.8	69%	0.685	79%	0.789	S	S	*	*			trans	-131.1	168.1	-148.1	60.5	0	0	0	0	115.7
1007	K	28.3	Very low	30.5	Very low	186 Å²	186	132.6 Å²	132.6	81%	0.809	78%	0.78	S	S	*	*			trans	85	96.4	163.7	-66.7	-172.1	175	-176.8	0	120.1
1008	T	27.1	Very low	30.8	Very low	128 Å²	128	132.4 Å²	132.4	79%	0.785	78%	0.78	S	S	*	*				53.7	118.3	125.2	56.2	0	0	0	0	122.1
1009	V	28.7	Very low	31	Very low	148 Å²	148	130.3 Å²	130.3	90%	0.897	77%	0.766	S	S	*	*			trans	-137.8	155.5	136.8	-178.3	0	0	0	0	107.9
1010	T	27.6	Very low	31.4	Very low	123 Å²	123	130.2 Å²	130.2	76%	0.755	77%	0.766	S	S	*	*			trans	-128.2	164	-168.7	22.6	0	0	0	0	114.5
1011	S	28.6	Very low	31.1	Very low	116 Å²	116	129.7 Å²	129.7	81%	0.811	77%	0.766	S	S	*	*			trans	69.1	156.1	172.6	75.3	0	0	0	0	115.1
1012	V	30.1	Very low	31.1	Very low	130 Å²	130	130.3 Å²	130.3	79%	0.788	77%	0.769	S	S	*	*			cis	-135.7	152.8	20.1	-174.1	0	0	0	0	106.5
1013	C	28.3	Very low	31	Very low	119 Å²	119	127.2 Å²	127.2	80%	0.804	76%	0.763	S	S	*	*			cis	-151.9	-126.6	47.3	-160.2	0	0	0	0	115.1
1014	A	31.9	Very low	31.1	Very low	80 Å²	80	125.5 Å²	125.5	66%	0.661	76%	0.758	S	S	*	*			trans	-170.6	-168.2	-143.4	0	0	0	0	0	112.2
1015	P	45.5	Very low	31	Very low	110 Å²	110	123.5 Å²	123.5	71%	0.714	76%	0.758	S	S	*	*			cis	-136.9	-164.3	-28.7	26.3	-2.1	0	0	0	114.5
1016	T	33.6	Very low	30.9	Very low	133 Å²	133	121.7 Å²	121.7	82%	0.816	75%	0.754	S	S	*	*			trans	93.3	136.2	161.9	69.1	0	0	0	0	118
1017	S	35.9	Very low	31.1	Very low	94 Å²	94	122.3 Å²	122.3	66%	0.657	75%	0.754	S	S	*	*			cis	-167.2	141.9	-12.9	49.3	0	0	0	0	114.3
1018	N	32.8	Very low	31.2	Very low	155 Å²	155	119.3 Å²	119.3	83%	0.829	75%	0.751	S	S	*	*			trans	60.2	160.1	145.6	-62.1	20.2	0	0	0	122.5
1019	S	33.3	Very low	31.2	Very low	83 Å²	83	119.6 Å²	119.6	58%	0.58	75%	0.747	S	S	*	*			cis	-172.4	178.2	-41.5	60.8	0	0	0	0	111.4
1020	D	33.9	Very low	31.2	Very low	149 Å²	149	118.9 Å²	118.9	80%	0.797	74%	0.738	S	S	*	*			trans	81.3	144.1	158.5	-53.4	-2.1	0	0	0	120.2
1021	C	26.8	Very low	31.5	Very low	112 Å²	112	120 Å²	120	76%	0.757	74%	0.738	S	S	*	*			cis	-166.1	173.9	-31.6	-154.2	0	0	0	0	112
1022	C	30.4	Very low	31.5	Very low	109 Å²	109	121.2 Å²	121.2	74%	0.736	74%	0.735	S	S	*	*			trans	73.9	143.4	166.3	-60.6	0	0	0	0	118.1
1023	T	31.8	Very low	31.5	Very low	119 Å²	119	122.9 Å²	122.9	73%	0.73	74%	0.74	S	S	*	*			cis	-156	133	2.5	-2.4	0	0	0	0	114.5
1024	T	30.2	Very low	31.7	Very low	113 Å²	113	125.1 Å²	125.1	69%	0.693	74%	0.743	S	S	*	*			trans	49.7	112	145.3	46.5	0	0	0	0	125.4
1025	T	29	Very low	31.8	Very low	129 Å²	129	126.6 Å²	126.6	79%	0.791	74%	0.744	S	S	*	*			trans	65.2	147.7	131.6	60	0	0	0	0	120.8
1026	V	29.4	Very low	31	Very low	121 Å²	121	128.3 Å²	128.3	73%	0.733	75%	0.748	S	S	*	*			cis	-149	141.7	44	163.6	0	0	0	0	113.2
1027	T	29.7	Very low	30.9	Very low	111 Å²	111	128.9 Å²	128.9	68%	0.681	74%	0.741	S	S	*	*			trans	12.6	151.1	163.3	64	0	0	0	0	122.7	I1029	T1027-I1029 HydrophobicContact CG2-CD1 4.32Å
1028	T	30.2	Very low	30.6	Very low	123 Å²	123	132.2 Å²	132.2	76%	0.755	74%	0.743	S	S	*	*			cis	-129.9	143.1	21.4	36.6	0	0	0	0	111.9
1029	I	28.8	Very low	30.5	Very low	135 Å²	135	129.5 Å²	129.5	69%	0.692	74%	0.737	S	S	*	*				69.4	92.5	65.1	-60	173.5	0	0	0	112.2	T1027	T1027-I1029 HydrophobicContact CG2-CD1 4.32Å
1030	N	27.5	Very low	30.3	Very low	133 Å²	133	134.2 Å²	134.2	71%	0.711	75%	0.747	S	S	*	*				87.8	155.6	92	-136.6	12.8	0	0	0	111.6
1031	I	33.5	Very low	29.9	Very low	147 Å²	147	135.6 Å²	135.6	75%	0.754	75%	0.746	S	S	*	*			cis	-143.8	158.9	31.8	-62.8	175	0	0	0	111.9
1032	N	29.7	Very low	30	Very low	141 Å²	141	135.8 Å²	135.8	75%	0.754	74%	0.744	S	S	*	*			trans	-65.2	153.4	177	-57.8	-56.2	0	0	0	115.9
1033	N	29.6	Very low	29.8	Very low	165 Å²	165	137.2 Å²	137.2	88%	0.882	74%	0.744	S	S	*	*			trans	-74.8	153.7	157.2	-95.2	-37.2	0	0	0	111.6
1034	N	32.6	Very low	29.5	Very low	165 Å²	165	136.2 Å²	136.2	88%	0.882	74%	0.742	S	S	*	*			trans	-139.7	154.3	166.7	-130.3	-8.3	0	0	0	112
1035	T	34.4	Very low	29.3	Very low	112 Å²	112	135.6 Å²	135.6	69%	0.687	74%	0.742	S	S	*	*			trans	-92.2	150	-150.9	53.9	0	0	0	0	117.5
1036	N	28.2	Very low	29.3	Very low	146 Å²	146	138.2 Å²	138.2	78%	0.781	74%	0.743	S	S	*	*			trans	41.1	137.2	135.6	-54.7	-19.2	0	0	0	120.1
1037	E	30.9	Very low	29.2	Very low	145 Å²	145	139.7 Å²	139.7	68%	0.678	74%	0.742	S	S	*	*				-173.4	153.4	76.6	-91	-157.8	129.5	0	0	114.1
1038	K	30.9	Very low	29.2	Very low	163 Å²	163	140.8 Å²	140.8	71%	0.709	74%	0.743	S	S	*	*			trans	58.3	154.3	147.6	-66.9	162.7	-175.6	151.1	0	120.3
1039	S	30.1	Very low	29.3	Very low	99 Å²	99	140.9 Å²	140.9	69%	0.692	74%	0.739	S	S	*	*			cis	-170.6	130.6	-31.3	54.7	0	0	0	0	112.1
1040	K	27.7	Very low	29.4	Very low	182 Å²	182	140.8 Å²	140.8	79%	0.791	74%	0.74	S	S	*	*			trans	52.9	129.8	148.7	-86.1	179.7	170.1	180	0	122.8
1041	F	26.4	Very low	29.6	Very low	178 Å²	178	140.6 Å²	140.6	78%	0.781	74%	0.744	S	S	*	*			trans	101.1	131	130.1	-92	-49	0	0	0	123.5
1042	V	28.1	Very low	29.4	Very low	116 Å²	116	139.4 Å²	139.4	70%	0.703	74%	0.744	S	S	*	*			trans	88.1	110.5	148.8	177.2	0	0	0	0	120.9
1043	N	26.1	Very low	29.6	Very low	139 Å²	139	139.6 Å²	139.6	74%	0.743	74%	0.743	S	S	*	*			trans	47.2	110.5	139.3	-63	19.9	0	0	0	124
1044	S	25.6	Very low	29.7	Very low	97 Å²	97	137 Å²	137	68%	0.678	73%	0.734	S	S	*	*				40.1	111.8	120.8	68.5	0	0	0	0	122.5
1045	S	27.5	Very low	29.4	Very low	101 Å²	101	134.9 Å²	134.9	71%	0.706	73%	0.727	S	S	*	*				91.7	145.3	114.2	74.8	0	0	0	0	122.9
1046	F	27.4	Very low	29.2	Very low	184 Å²	184	135 Å²	135	81%	0.807	73%	0.727	S	S	*	*			trans	86.3	133.4	160.6	-85.6	-84.6	0	0	0	122.6
1047	E	28.9	Very low	29.4	Very low	152 Å²	152	133.6 Å²	133.6	71%	0.71	72%	0.724	S	S	*	*			trans	70.8	91.7	150.2	-89	156.4	-144.9	0	0	123.9
1048	N	30	Very low	29.5	Very low	133 Å²	133	133.1 Å²	133.1	71%	0.711	73%	0.731	S	S	*	*				70.4	136.5	103.6	-70.2	-9.4	0	0	0	124.3
1049	N	31.9	Very low	29.5	Very low	125 Å²	125	132.4 Å²	132.4	67%	0.668	74%	0.735	S	S	*	*			trans	89.7	105.7	140.5	-69.3	-13	0	0	0	122.3
1050	N	30	Very low	29.7	Very low	133 Å²	133	134.3 Å²	134.3	71%	0.711	74%	0.738	S	S	*	*				65.8	119	124.3	-56.4	-20.1	0	0	0	120.9
1051	T	31.5	Very low	30.1	Very low	130 Å²	130	131.3 Å²	131.3	80%	0.798	73%	0.731	S	S	*	*				-169	127.6	102.2	17.2	0	0	0	0	113.9
1052	T	30	Very low	30.5	Very low	121 Å²	121	128.3 Å²	128.3	74%	0.742	72%	0.723	S	S	*	*			trans	24.4	150.7	133.9	52.2	0	0	0	0	121.2
1053	I	33.7	Very low	31	Very low	145 Å²	145	129.8 Å²	129.8	74%	0.744	73%	0.727	S	S	*	*				-164.5	132.8	70.3	-83.6	178.2	0	0	0	113.4
1054	T	31.3	Very low	31.4	Very low	112 Å²	112	129.1 Å²	129.1	69%	0.687	72%	0.723	S	S	*	*			trans	20.7	122	154.9	65.4	0	0	0	0	124.4
1055	T	27.6	Very low	32	Very low	120 Å²	120	129.5 Å²	129.5	74%	0.736	73%	0.726	S	S	*	*				33.1	160.4	107.4	72.8	0	0	0	0	121.5
1056	T	30.3	Very low	32.3	Very low	114 Å²	114	132 Å²	132	70%	0.699	72%	0.724	S	S	*	*			cis	-167.4	165.2	29.6	-20.5	0	0	0	0	114.1
1057	T	31.5	Very low	32.6	Very low	116 Å²	116	129.7 Å²	129.7	71%	0.712	72%	0.716	S	S	*	*			trans	78.6	126.3	145.2	39.6	0	0	0	0	126.3
1058	T	33	Very low	32.8	Very low	135 Å²	135	130.5 Å²	130.5	83%	0.828	72%	0.719	S	S	*	*			trans	92.1	139.6	134.2	47.7	0	0	0	0	124.1
1059	N	30.4	Very low	32.9	Very low	148 Å²	148	128.4 Å²	128.4	79%	0.791	72%	0.715	S	S	*	*			trans	-96.3	159.2	-173.6	-58.6	-20.2	0	0	0	113.6
1060	N	34.7	Very low	33	Very low	140 Å²	140	130.5 Å²	130.5	75%	0.749	72%	0.721	S	S	*	*				-177.9	125	118.7	-97.6	-20.9	0	0	0	116.1
1061	N	36.6	Very low	33	Very low	119 Å²	119	130.8 Å²	130.8	64%	0.636	72%	0.723	S	S	*	*				62	117.8	127.4	-61.7	-3.9	0	0	0	124.8
1062	N	34.9	Very low	32.9	Very low	115 Å²	115	131.2 Å²	131.2	62%	0.615	72%	0.72	S	S	*	*				80.3	124.2	119.4	-60.3	-2.4	0	0	0	123.3
1063	N	37.8	Very low	32.9	Very low	147 Å²	147	133.5 Å²	133.5	79%	0.786	72%	0.724	S	S	*	*				-149.4	124.7	107.3	-85.7	-53.1	0	0	0	107.4
1064	N	35.9	Very low	32.8	Very low	124 Å²	124	132.7 Å²	132.7	66%	0.663	73%	0.731	S	S	*	*				62.3	131.1	73.5	-64.2	-22.9	0	0	0	112.1
1065	S	37.2	Very low	32.8	Very low	106 Å²	106	137 Å²	137	74%	0.741	74%	0.744	S	S	*	*			cis	-156.4	178.8	18.5	-17.6	0	0	0	0	109.6
1066	K	34.3	Very low	32.7	Very low	153 Å²	153	137 Å²	137	67%	0.665	75%	0.749	S	S	*	*			cis	-162.6	154.3	16.5	-133.1	176.9	-171.9	-69.9	0	110.2
1067	E	32.8	Very low	32.8	Very low	136 Å²	136	137.9 Å²	137.9	64%	0.636	75%	0.754	S	S	*	*			trans	24.2	143.5	143.9	-71.1	143.6	-142.4	0	0	121.3
1068	E	32.6	Very low	32.9	Very low	168 Å²	168	141.6 Å²	141.6	79%	0.785	76%	0.763	S	S	*	*			cis	-172.3	165.6	-9.3	-118.1	-165.5	-103.4	0	0	105.7
1069	S	32.8	Very low	32.6	Very low	89 Å²	89	138.5 Å²	138.5	62%	0.622	76%	0.758	S	S	*	*			cis	-157.2	-172.3	-4.2	56	0	0	0	0	107.2
1070	Q	33.5	Very low	32.5	Very low	170 Å²	170	137.4 Å²	137.4	79%	0.794	76%	0.757	S	S	*	*			cis	-148	-148.2	7.7	-151.6	177.1	9.8	0	0	109.9
1071	N	30.2	Very low	32.1	Very low	139 Å²	139	138.3 Å²	138.3	74%	0.743	76%	0.759	S	S	*	*			trans	-118	163.8	-168.3	-58.6	-13.4	0	0	0	110.6
1072	D	29.7	Very low	31.6	Very low	139 Å²	139	139.2 Å²	139.2	74%	0.743	76%	0.762	S	S	*	*			cis	-144.2	149.8	43.9	-93.9	-42.6	0	0	0	117.9
1073	M	29.9	Very low	31.3	Very low	169 Å²	169	142 Å²	142	83%	0.833	78%	0.776	S	S	*	*			trans	41.8	109.4	151.9	-59.7	-159.2	-61.9	0	0	121.8
1074	S	31.2	Very low	30.8	Very low	127 Å²	127	143.6 Å²	143.6	89%	0.888	78%	0.776	S	S	*	*				-170.5	171.1	98.6	37	0	0	0	0	111.4
1075	Q	31.4	Very low	30.4	Very low	204 Å²	204	142.1 Å²	142.1	95%	0.953	78%	0.776	S	S	*	*			trans	-103.7	159.1	-159.5	-66.5	172.2	-28	0	0	114.3
1076	S	25.6	Very low	30.4	Very low	120 Å²	120	143 Å²	143	84%	0.839	78%	0.779	S	S	*	*			trans	-132.1	134.3	173.4	59.6	0	0	0	0	113.3
1077	T	33.1	Very low	30.3	Very low	132 Å²	132	140.9 Å²	140.9	81%	0.81	78%	0.779	S	S	*	*			trans	-154.4	145.3	165.8	49.2	0	0	0	0	106.1
1078	E	32.6	Very low	30.2	Very low	193 Å²	193	142.1 Å²	142.1	90%	0.902	79%	0.789	S	S	*	*			cis	-152.4	171.5	-9.5	-115.2	-177.7	168.7	0	0	106.3
1079	G	26.5	Very low	30.3	Very low	70 Å²	70	138.6 Å²	138.6	72%	0.722	78%	0.781	S	S	*	*			trans	-166.9	149.7	177.3	0	0	0	0	0	115.3
1080	T	28.4	Very low	30.2	Very low	126 Å²	126	143 Å²	143	77%	0.773	80%	0.797	S	S	*	*			trans	-153.8	125	175	-67.2	0	0	0	0	112.4
1081	M	27.3	Very low	29.8	Very low	159 Å²	159	138.1 Å²	138.1	78%	0.783	79%	0.792	S	S	*	*			trans	41.6	100	157.9	-66.6	-174.1	-79.1	0	0	122
1082	I	26.1	Very low	29.6	Very low	137 Å²	137	142.8 Å²	142.8	70%	0.703	80%	0.801	S	S	*	*				47.6	113.9	107.6	-56.7	161.4	0	0	0	118.2
1083	L	27.5	Very low	29.5	Very low	174 Å²	174	141.1 Å²	141.1	91%	0.911	81%	0.806	S	S	*	*				-152.6	120.7	122.1	-114.6	169.7	0	0	0	109.2
1084	F	28.2	Very low	29.4	Very low	180 Å²	180	141 Å²	141	79%	0.789	80%	0.804	S	S	*	*	P	Polyproline II helix	trans	-101.5	132.7	-176.5	-85.5	-86	0	0	0	112.2
1085	S	26.7	Very low	29.2	Very low	94 Å²	94	143.3 Å²	143.3	66%	0.657	81%	0.805	S	S	*	*	P	Polyproline II helix	trans	-91.9	147.5	151.4	177.6	0	0	0	0	108.2
1086	P	38.8	Very low	29	Very low	125 Å²	125	139.1 Å²	139.1	81%	0.812	79%	0.788	S	S	*	*	P	Polyproline II helix	trans	-62.4	148.1	178.8	25.6	-35	0	0	0	112.4
1087	V	30.7	Very low	29.1	Very low	108 Å²	108	142.2 Å²	142.2	66%	0.655	79%	0.789	S	S	*	*			trans	-105.9	144.2	178	170.7	0	0	0	0	108.4	P1089	V1087-P1089 HydrophobicContact CG1-CB 4.32Å
1088	D	31.6	Very low	28.8	Very low	161 Å²	161	140.6 Å²	140.6	86%	0.861	78%	0.779	S	S	*	*			trans	-151.6	153.4	133.9	-103.3	-17.3	0	0	0	109.6
1089	P	34	Very low	28.6	Very low	95 Å²	95	140.1 Å²	140.1	62%	0.617	78%	0.777	S	S	*	*			trans	-131.6	162.9	-136.1	39.5	-24	0	0	0	115.4	V1087	V1087-P1089 HydrophobicContact CG1-CB 4.32Å
1090	L	30.9	Very low	28.7	Very low	180 Å²	180	141.1 Å²	141.1	94%	0.942	77%	0.773	S	S	*	*				-172.6	103.3	128.7	-102.9	161.2	0	0	0	110.5
1091	G	25.2	Very low	28.8	Very low	68 Å²	68	141.9 Å²	141.9	70%	0.701	77%	0.772	S	S	*	*			trans	-110	149.9	168.8	0	0	0	0	0	110.7
1092	Y	26.4	Very low	28.9	Very low	238 Å²	238	140.9 Å²	140.9	93%	0.933	77%	0.77	S	S	*	*			trans	-63.1	147.4	179.8	-85.8	-113.8	0	0	0	112.7
1093	A	27.9	Very low	29	Very low	103 Å²	103	141.1 Å²	141.1	85%	0.851	77%	0.768	S	S	*	*			trans	-131.6	120.4	156.5	0	0	0	0	0	109
1094	Q	27.8	Very low	28.9	Very low	166 Å²	166	141.2 Å²	141.2	78%	0.776	76%	0.762	S	S	*	*			trans	-112.4	138.5	176.7	-170.5	179	13	0	0	108.2
1095	L	26.8	Very low	28.9	Very low	176 Å²	176	140.4 Å²	140.4	92%	0.921	76%	0.764	S	S	*	*			trans	-133.5	138.9	173.4	-104.8	168.5	0	0	0	109.9
1096	I	27.5	Very low	28.8	Very low	116 Å²	116	140.8 Å²	140.8	60%	0.595	77%	0.766	S	S	*	*			trans	-122.3	147.6	-171.5	-63.3	172.2	0	0	0	108.3	T1098	I1096-T1098 HydrophobicContact CG2-CG2 3.79Å
1097	H	26.4	Very low	28.8	Very low	186 Å²	186	140 Å²	140	86%	0.861	76%	0.761	S	S	*	*			trans	-138.7	156.8	150.8	-140.8	-84.2	0	0	0	111.1
1098	T	27.2	Very low	28.6	Very low	97 Å²	97	142.9 Å²	142.9	60%	0.595	77%	0.767	S	S	*	*			trans	-131.9	145.3	-152.7	53.9	0	0	0	0	115.1	I1096	I1096-T1098 HydrophobicContact CG2-CG2 3.79Å
1099	Q	29.6	Very low	28.4	Very low	184 Å²	184	141.5 Å²	141.5	86%	0.86	76%	0.76	S	S	*	*			trans	-179	132.8	151.6	-101.3	156.9	-4	0	0	105.7
1100	S	27.5	Very low	28.2	Very low	90 Å²	90	144.3 Å²	144.3	63%	0.629	77%	0.768	S	S	*	*			cis	71.7	128.2	32.6	114.8	0	0	0	0	112.1
1101	D	29.9	Very low	28	Very low	143 Å²	143	145.5 Å²	145.5	77%	0.765	76%	0.762	S	S	*	*			cis	-122.4	-160.6	9.7	-56.4	-55.5	0	0	0	110.8
1102	D	30.7	Very low	28.1	Very low	137 Å²	137	147.7 Å²	147.7	73%	0.733	76%	0.762	S	S	*	*			cis	-157.9	-164.7	12.3	-159	10.5	0	0	0	114.1
1103	Q	28.4	Very low	28.3	Very low	142 Å²	142	145.6 Å²	145.6	66%	0.664	76%	0.758	S	S	*	*			trans	-76.5	152.6	-161.9	-81.3	161.8	77	0	0	124.1
1104	F	25	Very low	28.2	Very low	177 Å²	177	147.1 Å²	147.1	78%	0.776	75%	0.745	S	S	*	*			trans	73.6	141.3	134.2	-85.8	-62.4	0	0	0	126.8
1105	I	27.5	Very low	28.6	Very low	162 Å²	162	143.8 Å²	143.8	83%	0.831	74%	0.738	S	S	*	*			trans	86.6	147.7	154.7	-66.1	157	0	0	0	119.1
1106	S	25.2	Very low	28.7	Very low	102 Å²	102	141.7 Å²	141.7	71%	0.713	73%	0.732	S	S	*	*			trans	-140.5	175.8	-169.3	62.7	0	0	0	0	110.9
1107	P	38.1	Very low	28.7	Very low	108 Å²	108	140.3 Å²	140.3	70%	0.701	73%	0.733	S	S	*	*			cis	-133.1	169.9	-43	36.9	-21.6	0	0	0	113
1108	Q	28	Very low	28.8	Very low	169 Å²	169	140.8 Å²	140.8	79%	0.79	73%	0.733	S	S	*	*			trans	159.3	144.4	136.3	-90.2	-174.8	22.3	0	0	114.8
1109	N	26.3	Very low	29.1	Very low	132 Å²	132	146 Å²	146	71%	0.706	76%	0.764	S	S	*	*			trans	31.3	127.6	146.3	-51.7	-16	0	0	0	122.2
1110	I	29.9	Very low	29	Very low	155 Å²	155	144.1 Å²	144.1	80%	0.795	76%	0.759	S	S	*	*				170.4	127.3	115.1	-88.5	163.7	0	0	0	113.9
1111	Y	27.5	Very low	29.1	Very low	204 Å²	204	146.9 Å²	146.9	80%	0.8	77%	0.766	S	S	*	*			trans	28.4	112.7	153.6	-71.7	-95.9	0	0	0	125.3
1112	T	26.9	Very low	29.1	Very low	114 Å²	114	147.1 Å²	147.1	70%	0.699	77%	0.766	S	S	*	*				35.1	118.2	125.5	64	0	0	0	0	123.3
1113	K	30.1	Very low	29	Very low	195 Å²	195	147.7 Å²	147.7	85%	0.848	77%	0.768	S	S	*	*				173	153.9	107.8	-95.2	-174.5	176.1	-175	0	113.8
1114	F	26.4	Very low	29	Very low	135 Å²	135	148.1 Å²	148.1	59%	0.592	78%	0.775	S	S	*	*			trans	-91.4	-175.9	171.8	-83	-72.9	0	0	0	111.6	T915 L916	T915-F1114 WeakPolarHBondContact O-CD2 3.22Å; T915-F1114 WeakPolarHBondContact O-CE2 3.38Å; L916-F1114 HydrophobicContact CB-CE2 4.11Å; L916-F1114 HydrophobicContact CB-CZ 3.96Å; L916-F1114 HydrophobicContact CD1-CD1 4.02Å; L916-F1114 HydrophobicContact CD1-CD2 4.09Å; L916-F1114 HydrophobicContact CD1-CE1 3.93Å; L916-F1114 HydrophobicContact CD1-CE2 4.01Å; L916-F1114 HydrophobicContact CD1-CG 4.11Å; L916-F1114 HydrophobicContact CD1-CZ 3.92Å
1115	P	35.6	Very low	29.3	Very low	95 Å²	95	146.1 Å²	146.1	62%	0.617	78%	0.775	S	S	*	*			cis	-136.5	-175	-1.6	35.9	-14.6	0	0	0	117
1116	T	30.1	Very low	29.4	Very low	132 Å²	132	145 Å²	145	81%	0.81	77%	0.771	S	S	*	*			trans	65.7	152.2	154.7	41.6	0	0	0	0	120
1117	S	27.2	Very low	29.8	Very low	88 Å²	88	148.3 Å²	148.3	62%	0.615	78%	0.775	S	S	*	*			cis	-169.2	166.4	-8	46.4	0	0	0	0	111.5
1118	F	28.1	Very low	29.1	Very low	195 Å²	195	151.7 Å²	151.7	86%	0.855	78%	0.781	S	S	*	*			trans	68	151.7	-178.5	-64.3	-91.4	0	0	0	114.8
1119	V	32.5	Very low	29.1	Very low	206 Å²	206	150.1 Å²	150.1	100%	1.248	78%	0.781	S	S	*	*			cis	-102.5	0	0.2	172.5	0	0	0	0	111

Retrieved 1,119 of 1,119 residues in 800.3 ms (Link to these results)

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