A0A087WZ03_HUMAN Loading...

Contactin associated protein family member 3B

AlphaFold DB , UniProt , Accession A0A087WZ03, Species HUMAN (Homo sapiens, Human), Gene CNTNAP3B, Length 966 aa.

						>A0A087WZ03_HUMAN|A0A087WZ03|CNTNAP3B
MASVAWAVLKVLLLLPTQTWSPVGAGNPPDCDSPLASALPRSSFSSSSELSSSHGPGFSRLNRRDGAGGWTPLVSNKYQWLQIDLGERMEVTAVATQGGYGSSDWVTSYLLMFSDGGRNWKQYRREESIWGFPGNTNADSVVHYRLQPPFEARFLRFLPLAWNPRGRIGMRIEVYGCAYKSEVVYFDGQSALLYTLDKKPLKPIRDVISLKFKAMQSNGILLHREGQHGNHITLELIKGKLVFFLNSGNAKLPSTIAPVTLTLGSLLDDQHWHSVLIELLDTQVNFTVDKHTHHFQAKGDSSNLDLNFEISFGGILSPGRSRAFTRKSFHGCLENLYYNGVDVTELAKKHKPQILMMGNVSFSCPQPQTVPVTFLSSRSYLALPGNSGEDKVSVTFQFRTWNRAGHLLFGELQRGSGSFVLFLKDGKLKLSLFQAGQSPRNVTAGAGLNDGQWHSVSFSAKWSHMNVVVDDDTAVQPLVAVLIDSGDTYYFGALYEQSCEAHKHRGNPSGLYYIDADGSGPLGPFLVYCNMTDSAWTVVRHGGPDAVTLRGAPSGHPLSAVSFAYAAGAGQLRAAVNLAERCEQRLALRCGTARRPDSRDGTPLSWWVGRTNETHTSWGGSLPDAQKCTCGLEGNCIDSQYYCNCDAGQNEWTSDTIVLSQKEHLPVTQIVMTDTGQPHSEADYTLGPLLCRGDKSFWNSASFNTETSYLHFPAFHGELTADVCFFFKTTVSSGVFMENLGITDFIRIELRAPTEVTFSFDVGNGPCEVTVQSPTPFNDNQWHHVRAERNVKGASLQVDQLPQKMQPAPADGHVRLQLNSQLFIGGTATRQRGFLGCIRSLQLNGVALDLEERATVTPGVEPGCAGHCSTYGHLCRNGGRCREKRRGVTCDCAFSAYDGPFCSNEISAYFATGSSMTYHFQEHYTLSENSSSLVSSLHRDVTLTREMITLSFRTTRTPSLLLKFAD
					

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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	32	Very low	29.1	Very low	243 Å²	243	144.8 Å²	144.8	100%	1.197	83%	0.828	S	S	*	*				0	122.9	0	-83.6	-168.9	-83.9	0	0	108.5
2	A	30.8	Very low	29.2	Very low	102 Å²	102	145.6 Å²	145.6	84%	0.843	83%	0.826	S	S	*	*			trans	50.4	120.6	161.6	0	0	0	0	0	121.4
3	S	30.9	Very low	29.3	Very low	113 Å²	113	145.8 Å²	145.8	79%	0.79	82%	0.822	S	S	*	*				162.2	95.4	113.5	-169.4	0	0	0	0	108.9
4	V	31.8	Very low	29.2	Very low	130 Å²	130	147 Å²	147	79%	0.788	82%	0.824	S	S	*	*				79.2	107.3	84.6	178	0	0	0	0	113.9
5	A	31.1	Very low	29.1	Very low	86 Å²	86	148.1 Å²	148.1	71%	0.711	83%	0.826	S	S	*	*			trans	51.1	130.5	143.3	0	0	0	0	0	123
6	W	25.4	Very low	29	Very low	261 Å²	261	146.1 Å²	146.1	99%	0.989	82%	0.822	S	S	*	*			trans	110	144.2	143.5	-95.9	30.6	0	0	0	121.6
7	A	25.2	Very low	28.8	Very low	88 Å²	88	145 Å²	145	73%	0.727	82%	0.82	S	S	*	*			trans	79.7	104.7	179.2	0	0	0	0	0	116.4
8	V	29.7	Very low	28.8	Very low	137 Å²	137	147.4 Å²	147.4	83%	0.83	82%	0.823	S	S	*	*				56.7	101.3	65.9	-172.8	0	0	0	0	113.1
9	L	27.1	Very low	28.5	Very low	139 Å²	139	145.7 Å²	145.7	73%	0.728	82%	0.817	S	S	*	*				155.8	129.9	120.5	-157.1	74.8	0	0	0	113.6
10	K	26.5	Very low	28.4	Very low	162 Å²	162	151.1 Å²	151.1	70%	0.704	82%	0.824	S	S	*	*			trans	64.4	116.7	150.5	-84	169.4	-172.1	-177.4	0	121.5
11	V	29.9	Very low	28.2	Very low	132 Å²	132	148.6 Å²	148.6	80%	0.8	82%	0.817	S	S	*	*				-141.5	115.9	110.9	177.5	0	0	0	0	109.1	L13	V11-L13 HydrophobicContact CG1-CD1 4.17Å
12	L	29.6	Very low	28.2	Very low	154 Å²	154	142.6 Å²	142.6	81%	0.806	80%	0.797	S	S	*	*			trans	-85.1	133.2	165.1	-100	99.2	0	0	0	108.8
13	L	31.4	Very low	28.4	Very low	148 Å²	148	144.7 Å²	144.7	78%	0.775	80%	0.799	S	S	*	*			trans	-141	102.4	163	-97.5	153.9	0	0	0	109.5	V11	V11-L13 HydrophobicContact CG1-CD1 4.17Å
14	L	28	Very low	28.4	Very low	163 Å²	163	142.4 Å²	142.4	85%	0.853	79%	0.793	S	S	*	*			trans	24.3	97.1	148.8	-62.8	161.4	0	0	0	118.2
15	L	27.4	Very low	28.8	Very low	163 Å²	163	140.9 Å²	140.9	85%	0.853	79%	0.794	S	S	*	*			trans	-86.8	129.1	152.9	-77.5	160.6	0	0	0	108.8	T17	L15-T17 PolarHBondContact O-N 3.48Å
16	P	27.8	Very low	28.9	Very low	116 Å²	116	139.8 Å²	139.8	75%	0.753	79%	0.791	S	S	*	*			trans	-74.9	122.3	159.5	29.8	-26.8	0	0	0	108.2	Q18	P16-Q18 PolarHBondContact O-N 3.02Å
17	T	25.3	Very low	29.4	Very low	128 Å²	128	133.7 Å²	133.7	79%	0.785	78%	0.778	S	S	*	*			trans	-61.4	100	166.9	48.3	0	0	0	0	109.2	L15 T19	L15-T17 PolarHBondContact O-N 3.48Å; T17-T19 PolarHBondContact O-N 3.09Å
18	Q	28.1	Very low	30.3	Very low	188 Å²	188	131.9 Å²	131.9	88%	0.879	76%	0.759	S	S	*	*			trans	-77	103.5	155.2	-98.9	-177	-0.8	0	0	107.1	P16 W20	P16-Q18 PolarHBondContact O-N 3.02Å; Q18-W20 PolarHBondContact O-N 3.28Å; Q18-W20 VanDerWaalsContact O-N 3.09Å
19	T	24.1	Very low	31.5	Very low	116 Å²	116	131.9 Å²	131.9	71%	0.712	76%	0.762	S	S	*	*			trans	-53.1	108.1	166.2	47.5	0	0	0	0	109.2	T17 S21	T17-T19 PolarHBondContact O-N 3.09Å; T19-S21 VanDerWaalsContact C-N 3.34Å; T19-S21 PolarHBondContact O-N 3.1Å; T19-S21 VanDerWaalsContact O-N 3.1Å
20	W	26.8	Very low	33.5	Very low	253 Å²	253	130.7 Å²	130.7	96%	0.958	76%	0.756	S	S	*	*			trans	-67.3	100.8	154	-89.6	-7.4	0	0	0	107.2	Q18 P22	Q18-W20 PolarHBondContact O-N 3.28Å; Q18-W20 VanDerWaalsContact O-N 3.09Å; W20-P22 WeakPolarHBondContact O-CD 3.44Å
21	S	23.6	Very low	36.5	Very low	98 Å²	98	124.2 Å²	124.2	69%	0.685	73%	0.731	S	S	*	*			trans	-66	121.9	163.2	-56.6	0	0	0	0	107.4	T19 V23	T19-S21 VanDerWaalsContact C-N 3.34Å; T19-S21 PolarHBondContact O-N 3.1Å; T19-S21 VanDerWaalsContact O-N 3.1Å; S21-V23 PolarHBondContact O-N 3.35Å
22	P	31.2	Very low	39.3	Very low	117 Å²	117	120 Å²	120	76%	0.76	70%	0.704	S	S	*	*			trans	-63.8	127.1	166.6	28.1	-30.3	0	0	0	106.8	W20 G24	W20-P22 WeakPolarHBondContact O-CD 3.44Å; P22-G24 PolarHBondContact O-N 2.91Å
23	V	36.3	Very low	42.4	Very low	146 Å²	146	115 Å²	115	89%	0.885	68%	0.682	S	S	*	*			trans	-56.7	107.7	171.7	174.8	0	0	0	0	107	S21 A25	S21-V23 PolarHBondContact O-N 3.35Å; V23-A25 PolarHBondContact O-N 3.3Å
24	G	30.5	Very low	45.4	Very low	66 Å²	66	111.5 Å²	111.5	68%	0.68	67%	0.668	S	S	*	*			trans	-60.5	130.9	177.9	0	0	0	0	0	110.1	P22 G26	P22-G24 PolarHBondContact O-N 2.91Å; G24-G26 PolarHBondContact O-N 3.45Å
25	A	40.5	Very low	48.6	Very low	98 Å²	98	104.8 Å²	104.8	81%	0.81	63%	0.633	S	S	*	*			trans	-63.9	112.3	175.7	0	0	0	0	0	110.8	V23	V23-A25 PolarHBondContact O-N 3.3Å
26	G	32.2	Very low	51.6	Low	62 Å²	62	97 Å²	97	64%	0.639	59%	0.592	S	S	*	*			trans	-172.7	115	164.1	0	0	0	0	0	107.2	G24	G24-G26 PolarHBondContact O-N 3.45Å
27	N	36.3	Very low	54.4	Low	133 Å²	133	94.2 Å²	94.2	71%	0.711	58%	0.575	S	S	*	*			trans	-56.7	125.5	171.9	-78.1	-9.7	0	0	0	107.4
28	P	43.2	Very low	57.3	Low	51 Å²	51	92.6 Å²	92.6	33%	0.331	58%	0.575	S	S	.	*			trans	-56.5	144.9	171.7	22.7	-29.8	0	0	0	108.8	D30	P28-D30 CarbonylContact O-C 3.6Å; P28-D30 PolarHBondContact O-N 2.87Å
29	P	55.6	Low	60.4	Low	137 Å²	137	85.1 Å²	85.1	89%	0.89	54%	0.541	S	S	*	.	S	Bend	trans	-60.2	-19.6	-171.2	19.1	-29.7	0	0	0	114.1
30	D	69.7	Low	63.7	Low	113 Å²	113	83.1 Å²	83.1	60%	0.604	53%	0.53	S	S	*	.	S	Bend	trans	-125.9	121.2	164	-82.9	-43.7	0	0	0	107.9	P28 D32	P28-D30 CarbonylContact O-C 3.6Å; P28-D30 PolarHBondContact O-N 2.87Å; D30-D32 PolarHBondContact O-N 2.92Å
31	C	88	Confident	66.7	Low	26 Å²	26	78.4 Å²	78.4	18%	0.176	51%	0.512	C	S	.	.	S	Bend	trans	-67.5	56.4	178.5	-178.6	0	0	0	0	112	T92 G176 C177	C31-T92 HydrophobicContact CB-CG2 4.21Å; C31-T92 WeakPolarHBondContact O-CG2 3.06Å; C31-T92 PolarHBondContact O-OG1 2.84Å; C31-G176 CarbonylContact O-C 3.52Å; C31-G176 VanDerWaalsContact O-CA 3.29Å; C31-G176 WeakPolarHBondContact O-CA 3.32Å; C31-C177 HydrophobicContact CB-CB 4Å; C31-C177 WeakPolarHBondContact CB-SG 3.48Å; C31-C177 WeakPolarHBondContact SG-CB 3.29Å; C31-C177 PolarHBondContact SG-N 3.19Å; C31-C177 CovalentContact SG-SG 2.04Å; C31-C177 PolarHBondContact SG-SG 3.24Å
32	D	90.8	Very high	70	Confident	44 Å²	44	78.9 Å²	78.9	24%	0.235	52%	0.515	C	S	.	.			trans	-127.2	28.8	-169.6	-76.4	-23.5	0	0	0	112.1	D30 T92 R145 Y175	D30-D32 PolarHBondContact O-N 2.92Å; D32-T92 VanDerWaalsContact OD1-CB 3.31Å; D32-T92 WeakPolarHBondContact OD1-CB 3.49Å; D32-T92 PolarHBondContact OD1-OG1 3.3Å; D32-R145 IonicContact OD1-CZ 3.42Å; D32-R145 IonicContact OD1-NH1 3.96Å; D32-R145 IonicContact OD1-NH2 3.21Å; D32-R145 IonicContact OD2-CZ 3.56Å; D32-R145 IonicContact OD2-NH1 2.75Å; D32-R145 PolarHBondContact OD2-NH1 2.94Å; D32-R145 IonicContact OD2-NH2 3.67Å; D32-R145 PolarHBondContact OD2-NH2 3.44Å; D32-Y175 WeakPolarHBondContact O-CD1 3.42Å
33	S	93.9	Very high	73.1	Confident	50 Å²	50	74 Å²	74	35%	0.35	48%	0.484	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.4	143.3	179.8	-64.5	0	0	0	0	111.8	L35 Y175 G176	S33-L35 PolarHBondContact O-N 3.26Å; S33-Y175 CarbonylContact O-C 3.57Å; S33-Y175 VanDerWaalsContact O-CA 3.29Å; S33-Y175 WeakPolarHBondContact O-CA 3.31Å; S33-G176 PolarHBondContact N-O 2.55Å; S33-G176 VanDerWaalsContact N-O 3.1Å; S33-G176 PolarHBondContact O-N 3.23Å
34	P	94.6	Very high	75.9	Confident	73 Å²	73	67.5 Å²	67.5	47%	0.474	44%	0.444	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68	131.9	176.7	28.2	-33.9	0	0	0	111.1	E173 Y175	P34-E173 HydrophobicContact CB-CG 4.16Å; P34-Y175 HydrophobicContact CB-CD1 4.24Å; P34-Y175 HydrophobicContact CB-CE1 4.1Å
35	L	94.5	Very high	79	Confident	22 Å²	22	66.3 Å²	66.3	12%	0.115	43%	0.425	C	S	.	.			trans	-106.6	-36.6	-173.7	-56.3	-175.8	0	0	0	112.4	S33 L39 L85 M89 E173 V174	S33-L35 PolarHBondContact O-N 3.26Å; L35-L39 WeakPolarHBondContact O-CG 3.33Å; L35-L85 HydrophobicContact CB-CD2 4.1Å; L35-L85 HydrophobicContact CD1-CD1 4.13Å; L35-M89 HydrophobicContact CD1-CB 3.95Å; L35-M89 HydrophobicContact CD1-CE 4.15Å; L35-M89 HydrophobicContact CD1-CG 4.18Å; L35-M89 HydrophobicContact CD2-CE 3.68Å; L35-E173 PolarHBondContact N-OE1 2.85Å; L35-V174 WeakPolarHBondContact CB-O 3.44Å; L35-V174 HydrophobicContact CD1-CG1 4.33Å; L35-V174 PolarHBondContact N-O 2.82Å
36	A	90.9	Very high	81.7	Confident	0 Å²	0	62.7 Å²	62.7	0%	0	39%	0.394	C	S	.	.	S	Bend	trans	-75.9	-33.9	-173.8	0	0	0	0	0	113.1	A38 L39 F44 I83 E173	A36-A38 VanDerWaalsContact C-N 3.26Å; A36-A38 PolarHBondContact O-N 3.09Å; A36-L39 PolarHBondContact O-N 3.38Å; A36-F44 HydrophobicContact CB-CE1 4.46Å; A36-F44 HydrophobicContact CB-CZ 4.1Å; A36-I83 HydrophobicContact CB-CD1 3.29Å; A36-E173 WeakPolarHBondContact CA-OE1 3.47Å; A36-E173 WeakPolarHBondContact CB-OE1 3.38Å; A36-E173 PolarHBondContact N-OE1 3.37Å
37	S	86.9	Confident	84.6	Confident	58 Å²	58	61.7 Å²	61.7	41%	0.406	38%	0.377	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.3	-31.1	-177	-79.3	0	0	0	0	114.2	E173	S37-E173 VanDerWaalsContact CB-OE2 3.32Å; S37-E173 WeakPolarHBondContact CB-OE2 3.29Å; S37-E173 PolarHBondContact N-OE2 3.5Å; S37-E173 PolarHBondContact OG-OE2 2.76Å
38	A	85.9	Confident	87.3	Confident	94 Å²	94	56.9 Å²	56.9	78%	0.777	35%	0.354	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.2	-11	-178.4	0	0	0	0	0	114.1	A36	A36-A38 VanDerWaalsContact C-N 3.26Å; A36-A38 PolarHBondContact O-N 3.09Å
39	L	92.8	Very high	89.7	Confident	31 Å²	31	58.8 Å²	58.8	16%	0.162	36%	0.358	C	S	.	.	S	Bend	trans	-78.9	150	-173.6	-68	171.4	0	0	0	112.7	L35 A36 F44 R60 I83 L85	L35-L39 WeakPolarHBondContact O-CG 3.33Å; A36-L39 PolarHBondContact O-N 3.38Å; L39-F44 HydrophobicContact CB-CE2 4.07Å; L39-R60 PolarHBondContact O-NH2 2.74Å; L39-I83 HydrophobicContact CD1-CD1 3.81Å; L39-I83 HydrophobicContact CD1-CG1 3.9Å; L39-L85 HydrophobicContact CD1-CD2 3.93Å
40	P	93.7	Very high	91.5	Very high	73 Å²	73	55 Å²	55	47%	0.474	33%	0.33	S	S	.	.			trans	-67.8	161.9	173.8	29.7	-35.6	0	0	0	112.1	S42 S43 F44 R60	P40-S42 PolarHBondContact O-N 3.39Å; P40-S43 WeakPolarHBondContact O-CB 3.12Å; P40-S43 PolarHBondContact O-N 2.86Å; P40-S43 VanDerWaalsContact O-N 3.1Å; P40-F44 WeakPolarHBondContact O-CD2 3.05Å; P40-R60 VanDerWaalsContact C-NH2 3.28Å; P40-R60 PolarHBondContact O-NH2 3.1Å
41	R	89.8	Confident	92.6	Very high	155 Å²	155	51.7 Å²	51.7	59%	0.585	32%	0.316	S	S	*	.	G	3₁₀ helix	trans	-60.1	-29.4	178	-70.5	-175.5	178.8	-176	0.4	113.2	S43 F44	R41-S43 PolarHBondContact O-N 2.86Å; R41-F44 PolarHBondContact O-N 3.47Å; R41-F44 VanDerWaalsContact O-N 3.16Å
42	S	92.6	Very high	92.9	Very high	107 Å²	107	55.4 Å²	55.4	75%	0.748	34%	0.342	S	S	*	.	G	3₁₀ helix	trans	-64.8	-19.1	176.8	53.4	0	0	0	0	113.9	P40 F44	P40-S42 PolarHBondContact O-N 3.39Å; S42-F44 PolarHBondContact O-N 3.47Å
43	S	96.1	Very high	93	Very high	15 Å²	15	55.2 Å²	55.2	11%	0.105	34%	0.344	C	S	.	.	G	3₁₀ helix	trans	-74.5	-9.5	175	-68.2	0	0	0	0	113.4	P40 R41 I83 D84	P40-S43 WeakPolarHBondContact O-CB 3.12Å; P40-S43 PolarHBondContact O-N 2.86Å; P40-S43 VanDerWaalsContact O-N 3.1Å; R41-S43 PolarHBondContact O-N 2.86Å; S43-I83 CarbonylContact O-C 3.47Å; S43-I83 WeakPolarHBondContact O-CA 3.29Å; S43-D84 VanDerWaalsContact CB-O 3.28Å; S43-D84 WeakPolarHBondContact CB-O 3.46Å; S43-D84 PolarHBondContact O-N 2.85Å; S43-D84 PolarHBondContact OG-O 2.77Å
44	F	95.8	Very high	93	Very high	10 Å²	10	54.3 Å²	54.3	4%	0.044	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	129.8	-177.7	-63.7	-101.1	0	0	0	110	A36 L39 P40 R41 S42 P56 S59 R60 Q82 I83	A36-F44 HydrophobicContact CB-CE1 4.46Å; A36-F44 HydrophobicContact CB-CZ 4.1Å; L39-F44 HydrophobicContact CB-CE2 4.07Å; P40-F44 WeakPolarHBondContact O-CD2 3.05Å; R41-F44 PolarHBondContact O-N 3.47Å; R41-F44 VanDerWaalsContact O-N 3.16Å; S42-F44 PolarHBondContact O-N 3.47Å; F44-P56 HydrophobicContact CB-CB 4.04Å; F44-S59 WeakPolarHBondContact CD1-OG 3.06Å; F44-R60 HydrophobicContact CE1-CG 4.33Å; F44-R60 HydrophobicContact CE2-CG 4.48Å; F44-R60 HydrophobicContact CZ-CG 3.89Å; F44-Q82 WeakPolarHBondContact CA-O 3.37Å; F44-I83 HydrophobicContact CD1-CD1 4.4Å; F44-I83 HydrophobicContact CD1-CG1 4.34Å; F44-I83 HydrophobicContact CE1-CD1 3.62Å; F44-I83 HydrophobicContact CE1-CG1 4.03Å; F44-I83 HydrophobicContact CZ-CD1 3.69Å; F44-I83 HydrophobicContact CZ-CG1 4.19Å
45	S	96.3	Very high	92.9	Very high	40 Å²	40	51 Å²	51	28%	0.28	31%	0.314	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.4	160.9	176.4	62.6	0	0	0	0	111	Q82	S45-Q82 PolarHBondContact N-O 3.35Å; S45-Q82 PolarHBondContact O-N 2.89Å; S45-Q82 PolarHBondContact OG-NE2 2.9Å
46	S	95.6	Very high	93	Very high	23 Å²	23	50.7 Å²	50.7	16%	0.161	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.5	162.4	-179.9	55	0	0	0	0	112	S48 P56 W70 W80	S46-S48 PolarHBondContact O-N 2.96Å; S46-S48 PolarHBondContact OG-O 3.33Å; S46-S48 VanDerWaalsContact OG-O 3.05Å; S46-P56 WeakPolarHBondContact OG-CD 3.37Å; S46-W70 PolarHBondContact OG-NE1 2.53Å; S46-W80 VanDerWaalsContact C-CZ3 3.43Å; S46-W80 VanDerWaalsContact CA-O 3.32Å; S46-W80 WeakPolarHBondContact CA-O 3.41Å; S46-W80 WeakPolarHBondContact CB-O 3.36Å; S46-W80 WeakPolarHBondContact O-CH2 3.5Å
47	S	93.2	Very high	93.1	Very high	40 Å²	40	51.2 Å²	51.2	28%	0.28	32%	0.318	S	S	.	.	S	Bend	trans	-52.9	-46.8	170.7	43.9	0	0	0	0	114	Q79 W80	S47-Q79 WeakPolarHBondContact OG-CA 3.34Å; S47-Q79 PolarHBondContact OG-OE1 3.07Å; S47-W80 PolarHBondContact N-O 2.79Å; S47-W80 PolarHBondContact OG-N 3.13Å; S47-W80 PolarHBondContact OG-O 2.74Å; S47-W80 VanDerWaalsContact OG-O 3.08Å
48	S	93	Very high	93.4	Very high	33 Å²	33	50 Å²	50	23%	0.231	31%	0.305	C	S	.	.			trans	-158.4	172.9	177.3	65	0	0	0	0	109.8	S46 W70 P72 L73 Q79	S46-S48 PolarHBondContact O-N 2.96Å; S46-S48 PolarHBondContact OG-O 3.33Å; S46-S48 VanDerWaalsContact OG-O 3.05Å; S48-W70 PolarHBondContact O-NE1 2.88Å; S48-P72 WeakPolarHBondContact OG-CA 3.46Å; S48-P72 VanDerWaalsContact OG-CB 3.29Å; S48-P72 WeakPolarHBondContact OG-CB 3.34Å; S48-L73 PolarHBondContact OG-N 3.33Å; S48-Q79 PolarHBondContact OG-OE1 2.75Å
49	E	95.1	Very high	93.8	Very high	90 Å²	90	45.5 Å²	45.5	42%	0.421	27%	0.268	S	S	.	.			trans	-138.4	139.6	172.3	59.7	-178.4	-150.1	0	0	110.1	S51 G55 T71	E49-S51 VanDerWaalsContact C-N 3.35Å; E49-G55 WeakPolarHBondContact OE2-CA 3.29Å; E49-T71 WeakPolarHBondContact CA-O 3.5Å
50	L	93.1	Very high	93.9	Very high	57 Å²	57	45.2 Å²	45.2	30%	0.298	27%	0.265	S	S	.	.	S	Bend	trans	-67.8	-36.5	-179.6	179	61.4	0	0	0	112.4	H54 T71 L73	L50-H54 HydrophobicContact CB-CB 4.13Å; L50-T71 HydrophobicContact CB-CG2 4.12Å; L50-T71 HydrophobicContact CD2-CG2 3.96Å; L50-T71 PolarHBondContact N-O 3.34Å; L50-L73 HydrophobicContact CD1-CD1 4.24Å
51	S	93.3	Very high	93.9	Very high	44 Å²	44	42.4 Å²	42.4	31%	0.308	25%	0.246	S	C	.	.	S	Bend	trans	-160.3	172.7	170.8	63.3	0	0	0	0	109.2	E49 S53 H54	E49-S51 VanDerWaalsContact C-N 3.35Å; S51-S53 PolarHBondContact O-N 3.49Å; S51-S53 PolarHBondContact OG-OG 2.9Å; S51-H54 PolarHBondContact O-N 3.1Å; S51-H54 PolarHBondContact OG-ND1 2.74Å
52	S	92.4	Very high	94	Very high	104 Å²	104	39.9 Å²	39.9	73%	0.727	24%	0.244	S	C	*	.	T	Hydrogen-bonded Turn	trans	-57.2	-19.5	177.7	58.5	0	0	0	0	114.3	F58	S52-F58 WeakPolarHBondContact O-CE2 3.48Å
53	S	92.8	Very high	93.7	Very high	40 Å²	40	41 Å²	41	28%	0.28	23%	0.232	S	C	.	.	T	Hydrogen-bonded Turn	trans	-89.1	-10.2	176.1	63.3	0	0	0	0	114.4	S51 F58 A67	S51-S53 PolarHBondContact O-N 3.49Å; S51-S53 PolarHBondContact OG-OG 2.9Å; S53-F58 VanDerWaalsContact O-CD2 3.31Å; S53-F58 WeakPolarHBondContact O-CD2 3.31Å; S53-A67 PolarHBondContact O-N 3.1Å
54	H	94.4	Very high	93.5	Very high	32 Å²	32	48 Å²	48	15%	0.148	26%	0.256	C	S	.	.	S	Bend	trans	-109.9	14.7	178.4	-61.7	71.1	0	0	0	111.9	L50 S51 A67 W70 T71	L50-H54 HydrophobicContact CB-CB 4.13Å; S51-H54 PolarHBondContact O-N 3.1Å; S51-H54 PolarHBondContact OG-ND1 2.74Å; H54-A67 WeakPolarHBondContact CE1-CB 3.28Å; H54-A67 WeakPolarHBondContact ND1-CB 3.36Å; H54-A67 VanDerWaalsContact NE2-CB 3.29Å; H54-A67 WeakPolarHBondContact NE2-CB 3.22Å; H54-W70 WeakPolarHBondContact O-CA 3.13Å; H54-W70 VanDerWaalsContact O-CD1 3.32Å; H54-T71 PolarHBondContact O-N 3.01Å
55	G	93.9	Very high	93	Very high	4 Å²	4	50.9 Å²	50.9	4%	0.041	27%	0.272	C	S	.	.	S	Bend	trans	-64.6	162.3	-178.5	0	0	0	0	0	113.2	E49 G57 F58	E49-G55 WeakPolarHBondContact OE2-CA 3.29Å; G55-G57 PolarHBondContact O-N 3.02Å; G55-G57 VanDerWaalsContact O-N 3.1Å; G55-F58 PolarHBondContact O-N 2.96Å
56	P	94.8	Very high	92.6	Very high	15 Å²	15	51.2 Å²	51.2	10%	0.097	28%	0.281	C	S	.	.	G	3₁₀ helix	trans	-61.3	-25.3	-175.7	26.1	-35.2	0	0	0	112.8	F44 S46 F58 S59 L81	F44-P56 HydrophobicContact CB-CB 4.04Å; S46-P56 WeakPolarHBondContact OG-CD 3.37Å; P56-F58 PolarHBondContact O-N 2.99Å; P56-F58 VanDerWaalsContact O-N 3.16Å; P56-S59 VanDerWaalsContact O-CB 3.26Å; P56-S59 WeakPolarHBondContact O-CB 3.39Å; P56-S59 PolarHBondContact O-N 3.16Å; P56-S59 VanDerWaalsContact O-N 3.07Å; P56-S59 PolarHBondContact O-OG 3.03Å; P56-L81 HydrophobicContact CB-CD1 3.68Å
57	G	93	Very high	92.2	Very high	10 Å²	10	52 Å²	52	10%	0.103	29%	0.289	C	S	.	.	G	3₁₀ helix	trans	-63.8	-14.6	175.3	0	0	0	0	0	115.2	G55 R60	G55-G57 PolarHBondContact O-N 3.02Å; G55-G57 VanDerWaalsContact O-N 3.1Å; G57-R60 PolarHBondContact O-NH1 2.88Å
58	F	93.7	Very high	92	Very high	32 Å²	32	50.1 Å²	50.1	14%	0.14	28%	0.277	C	S	.	.	G	3₁₀ helix	trans	-94.1	0.8	175.1	-60.7	-71.8	0	0	0	113.2	S52 S53 G55 P56 R60 D65	S52-F58 WeakPolarHBondContact O-CE2 3.48Å; S53-F58 VanDerWaalsContact O-CD2 3.31Å; S53-F58 WeakPolarHBondContact O-CD2 3.31Å; G55-F58 PolarHBondContact O-N 2.96Å; P56-F58 PolarHBondContact O-N 2.99Å; P56-F58 VanDerWaalsContact O-N 3.16Å; F58-R60 PolarHBondContact O-N 3.07Å; F58-R60 VanDerWaalsContact O-N 3.13Å; F58-D65 HydrophobicContact CD1-CB 3.78Å; F58-D65 HydrophobicContact CE1-CB 4.07Å
59	S	94.5	Very high	92.1	Very high	0 Å²	0	48.6 Å²	48.6	0%	0	27%	0.266	C	S	.	.			trans	-78.9	15.9	-177.9	68.6	0	0	0	0	114.6	F44 P56 R171 I172	F44-S59 WeakPolarHBondContact CD1-OG 3.06Å; P56-S59 VanDerWaalsContact O-CB 3.26Å; P56-S59 WeakPolarHBondContact O-CB 3.39Å; P56-S59 PolarHBondContact O-N 3.16Å; P56-S59 VanDerWaalsContact O-N 3.07Å; P56-S59 PolarHBondContact O-OG 3.03Å; S59-R171 CarbonylContact O-C 3.54Å; S59-R171 WeakPolarHBondContact O-CA 3.43Å; S59-I172 WeakPolarHBondContact O-CG1 3.48Å; S59-I172 PolarHBondContact O-N 3.42Å
60	R	94.2	Very high	92.2	Very high	26 Å²	26	44.3 Å²	44.3	10%	0.098	25%	0.246	C	C	.	.	B	Isolated β-bridge	trans	-75.9	137.8	177	-71.9	-178.2	-168.8	73.5	3.2	110.6	L39 P40 F44 G57 F58 R63	L39-R60 PolarHBondContact O-NH2 2.74Å; P40-R60 VanDerWaalsContact C-NH2 3.28Å; P40-R60 PolarHBondContact O-NH2 3.1Å; F44-R60 HydrophobicContact CE1-CG 4.33Å; F44-R60 HydrophobicContact CE2-CG 4.48Å; F44-R60 HydrophobicContact CZ-CG 3.89Å; G57-R60 PolarHBondContact O-NH1 2.88Å; F58-R60 PolarHBondContact O-N 3.07Å; F58-R60 VanDerWaalsContact O-N 3.13Å; R60-R63 HydrophobicContact CB-CB 4.39Å; R60-R63 HydrophobicContact CB-CG 3.74Å; R60-R63 WeakPolarHBondContact O-CB 3.47Å; R60-R63 PolarHBondContact O-N 2.7Å
61	L	93.7	Very high	92.3	Very high	13 Å²	13	41.8 Å²	41.8	7%	0.068	23%	0.233	C	C	.	.	T	Hydrogen-bonded Turn	trans	-52.8	141.9	177.3	-161	75.7	0	0	0	111.8	R63 A95 Q97 V141 I172 E173	L61-R63 PolarHBondContact O-N 3.23Å; L61-A95 HydrophobicContact CD1-CB 4.5Å; L61-A95 HydrophobicContact CD2-CB 4.17Å; L61-Q97 HydrophobicContact CD1-CB 3.56Å; L61-V141 HydrophobicContact CD1-CG1 4.11Å; L61-V141 HydrophobicContact CD1-CG2 4.09Å; L61-V141 HydrophobicContact CD2-CG1 3.95Å; L61-V141 HydrophobicContact CD2-CG2 4.25Å; L61-V141 HydrophobicContact CG-CG2 4.27Å; L61-I172 PolarHBondContact N-O 3.3Å; L61-E173 HydrophobicContact CB-CB 3.79Å; L61-E173 HydrophobicContact CD2-CB 3.73Å; L61-E173 HydrophobicContact CD2-CG 4.48Å; L61-E173 HydrophobicContact CG-CB 4.28Å
62	N	92.1	Very high	92.4	Very high	103 Å²	103	39.7 Å²	39.7	55%	0.551	22%	0.218	S	C	*	.	T	Hydrogen-bonded Turn	trans	59.7	0.9	178.7	-62.2	-42.7	0	0	0	116.5	Q97	N62-Q97 PolarHBondContact OD1-NE2 3.1Å; N62-Q97 VanDerWaalsContact OD1-NE2 3.09Å; N62-Q97 PolarHBondContact OD1-OE1 3.23Å
63	R	87.6	Confident	92.5	Very high	130 Å²	130	39.7 Å²	39.7	49%	0.491	21%	0.21	S	C	.	.			trans	-76.7	146.1	172.9	-66.7	-61.7	-171.3	132.4	-8.1	110.7	R60 L61 D65 R171	R60-R63 HydrophobicContact CB-CB 4.39Å; R60-R63 HydrophobicContact CB-CG 3.74Å; R60-R63 WeakPolarHBondContact O-CB 3.47Å; R60-R63 PolarHBondContact O-N 2.7Å; L61-R63 PolarHBondContact O-N 3.23Å; R63-D65 IonicContact NH1-OD2 3.35Å; R63-D65 PolarHBondContact NH1-OD2 3.16Å; R63-R171 WeakPolarHBondContact O-CD 3.42Å; R63-R171 PolarHBondContact O-NH1 2.95Å
64	R	90.3	Very high	92.2	Very high	162 Å²	162	41.6 Å²	41.6	61%	0.611	22%	0.219	S	C	*	.			trans	-116.7	14.1	176.3	-58.2	-178.4	-178.6	-163.6	2.6	111.7	Y100	R64-Y100 HydrophobicContact CB-CD1 3.89Å; R64-Y100 HydrophobicContact CB-CE1 4.12Å; R64-Y100 HydrophobicContact CB-CG 4.35Å; R64-Y100 HydrophobicContact CG-CD1 3.81Å; R64-Y100 HydrophobicContact CG-CD2 4.08Å; R64-Y100 HydrophobicContact CG-CE1 3.94Å; R64-Y100 HydrophobicContact CG-CE2 4.22Å; R64-Y100 HydrophobicContact CG-CG 3.89Å; R64-Y100 PolarHBondContact NH1-OH 2.82Å
65	D	86.1	Confident	91.8	Very high	71 Å²	71	41.6 Å²	41.6	38%	0.38	22%	0.223	S	C	.	.			trans	-72.7	154.3	-179.6	-56.6	-42.7	0	0	0	110.1	F58 R63 G68	F58-D65 HydrophobicContact CD1-CB 3.78Å; F58-D65 HydrophobicContact CE1-CB 4.07Å; R63-D65 IonicContact NH1-OD2 3.35Å; R63-D65 PolarHBondContact NH1-OD2 3.16Å; D65-G68 PolarHBondContact O-N 3.23Å
66	G	87	Confident	90.9	Very high	46 Å²	46	43.8 Å²	43.8	47%	0.474	23%	0.234	S	C	.	.	T	Hydrogen-bonded Turn	trans	65.5	-142.1	-178	0	0	0	0	0	112	G68	G66-G68 PolarHBondContact O-N 3.26Å
67	A	87.9	Confident	89.8	Confident	39 Å²	39	49.5 Å²	49.5	32%	0.322	26%	0.257	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.9	22.9	175.3	0	0	0	0	0	113.2	S53 H54	S53-A67 PolarHBondContact O-N 3.1Å; H54-A67 WeakPolarHBondContact CE1-CB 3.28Å; H54-A67 WeakPolarHBondContact ND1-CB 3.36Å; H54-A67 VanDerWaalsContact NE2-CB 3.29Å; H54-A67 WeakPolarHBondContact NE2-CB 3.22Å
68	G	89.7	Confident	89	Confident	2 Å²	2	58 Å²	58	2%	0.021	29%	0.288	C	S	.	.	S	Bend	trans	93.9	0.7	171.8	0	0	0	0	0	116.4	D65 G66 G99 Y100 R171	D65-G68 PolarHBondContact O-N 3.23Å; G66-G68 PolarHBondContact O-N 3.26Å; G68-G99 WeakPolarHBondContact O-CA 3.45Å; G68-Y100 PolarHBondContact O-N 3.03Å; G68-R171 VanDerWaalsContact O-CD 3.31Å; G68-R171 WeakPolarHBondContact O-CD 3.46Å; G68-R171 PolarHBondContact O-NE 3.3Å
69	G	94.1	Very high	88.8	Confident	1 Å²	1	57.4 Å²	57.4	1%	0.01	29%	0.285	C	S	.	.	S	Bend	trans	162.8	-173.8	175.8	0	0	0	0	0	112.8
70	W	96.7	Very high	88.8	Confident	0 Å²	0	60.4 Å²	60.4	0%	0	30%	0.296	C	S	.	.	B	Isolated β-bridge	trans	-82.8	133.9	169.8	168.1	69.2	0	0	0	111.2	S46 S48 H54 P72 Q79 W80 L81 P159 I168 G169 M170	S46-W70 PolarHBondContact OG-NE1 2.53Å; S48-W70 PolarHBondContact O-NE1 2.88Å; H54-W70 WeakPolarHBondContact O-CA 3.13Å; H54-W70 VanDerWaalsContact O-CD1 3.32Å; W70-P72 HydrophobicContact CH2-CB 4.46Å; W70-P72 HydrophobicContact CH2-CG 4.31Å; W70-P72 HydrophobicContact CZ2-CB 3.88Å; W70-P72 HydrophobicContact CZ2-CG 4.16Å; W70-Q79 HydrophobicContact CH2-CB 4.11Å; W70-W80 VanDerWaalsContact CH2-C 3.48Å; W70-W80 WeakPolarHBondContact CH2-O 3.36Å; W70-W80 VanDerWaalsContact CZ2-O 3.24Å; W70-W80 WeakPolarHBondContact CZ2-O 3.17Å; W70-L81 HydrophobicContact CB-CD1 4.21Å; W70-L81 HydrophobicContact CB-CD2 4.47Å; W70-L81 HydrophobicContact CD2-CB 4.06Å; W70-L81 HydrophobicContact CD2-CD1 4.02Å; W70-L81 HydrophobicContact CD2-CD2 4.44Å; W70-L81 HydrophobicContact CD2-CG 4.4Å; W70-L81 HydrophobicContact CE3-CB 3.64Å; W70-L81 HydrophobicContact CE3-CD1 4.32Å; W70-L81 HydrophobicContact CE3-CD2 4Å; W70-L81 HydrophobicContact CE3-CG 4.2Å; W70-L81 HydrophobicContact CG-CD1 3.96Å; W70-L81 HydrophobicContact CH2-CB 4.09Å; W70-L81 HydrophobicContact CZ3-CB 3.65Å; W70-P159 HydrophobicContact CH2-CG 4.5Å; W70-P159 HydrophobicContact CZ3-CG 4.23Å; W70-I168 HydrophobicContact CE3-CG2 4.43Å; W70-I168 HydrophobicContact CH2-CG2 4.25Å; W70-I168 HydrophobicContact CZ3-CG2 3.82Å; W70-G169 WeakPolarHBondContact O-CA 3.48Å; W70-M170 HydrophobicContact CE3-CB 4.11Å; W70-M170 HydrophobicContact CE3-CG 4.26Å; W70-M170 HydrophobicContact CE3-SD 4.39Å; W70-M170 HydrophobicContact CZ3-CG 4.34Å; W70-M170 HydrophobicContact CZ3-SD 4.02Å; W70-M170 PolarHBondContact N-O 3.15Å; W70-M170 PolarHBondContact O-N 3.15Å
71	T	96.8	Very high	88.9	Confident	4 Å²	4	59.2 Å²	59.2	3%	0.025	29%	0.292	C	S	.	.			trans	-139	127.3	172.2	-65.3	0	0	0	0	109.8	E49 L50 H54 R167 I168	E49-T71 WeakPolarHBondContact CA-O 3.5Å; L50-T71 HydrophobicContact CB-CG2 4.12Å; L50-T71 HydrophobicContact CD2-CG2 3.96Å; L50-T71 PolarHBondContact N-O 3.34Å; H54-T71 PolarHBondContact O-N 3.01Å; T71-R167 HydrophobicContact CG2-CB 4.37Å; T71-I168 WeakPolarHBondContact CA-O 3.5Å; T71-I168 WeakPolarHBondContact CB-O 3.39Å; T71-I168 VanDerWaalsContact CG2-O 3.27Å; T71-I168 WeakPolarHBondContact CG2-O 3.31Å; T71-I168 PolarHBondContact OG1-O 2.77Å; T71-I168 VanDerWaalsContact OG1-O 3.06Å
72	P	95.5	Very high	89	Confident	0 Å²	0	59.6 Å²	59.6	0%	0	29%	0.293	C	S	.	.			trans	-71.9	160.7	177.1	29.5	-33.6	0	0	0	112.1	S48 W70 V74 Q79 I168	S48-P72 WeakPolarHBondContact OG-CA 3.46Å; S48-P72 VanDerWaalsContact OG-CB 3.29Å; S48-P72 WeakPolarHBondContact OG-CB 3.34Å; W70-P72 HydrophobicContact CH2-CB 4.46Å; W70-P72 HydrophobicContact CH2-CG 4.31Å; W70-P72 HydrophobicContact CZ2-CB 3.88Å; W70-P72 HydrophobicContact CZ2-CG 4.16Å; P72-V74 VanDerWaalsContact C-N 3.31Å; P72-V74 PolarHBondContact O-N 3.12Å; P72-Q79 HydrophobicContact CB-CB 4.19Å; P72-Q79 HydrophobicContact CB-CG 3.76Å; P72-Q79 HydrophobicContact CG-CB 4.11Å; P72-Q79 HydrophobicContact CG-CG 3.75Å; P72-I168 HydrophobicContact CG-CB 3.8Å; P72-I168 HydrophobicContact CG-CD1 4.08Å; P72-I168 HydrophobicContact CG-CG1 4.5Å; P72-I168 HydrophobicContact CG-CG2 3.93Å
73	L	93.5	Very high	89.2	Confident	103 Å²	103	54.7 Å²	54.7	54%	0.539	27%	0.267	S	S	.	.	S	Bend	trans	-60.9	-41.7	176.1	-178.2	63.4	0	0	0	111.7	S48 L50	S48-L73 PolarHBondContact OG-N 3.33Å; L50-L73 HydrophobicContact CD1-CD1 4.24Å
74	V	86.8	Confident	89.7	Confident	80 Å²	80	50 Å²	50	49%	0.485	25%	0.252	S	S	.	.	S	Bend	trans	-123.7	130.4	178.1	-177.3	0	0	0	0	109.2	P72 N76 Q79	P72-V74 VanDerWaalsContact C-N 3.31Å; P72-V74 PolarHBondContact O-N 3.12Å; V74-N76 PolarHBondContact O-N 3.26Å; V74-Q79 WeakPolarHBondContact O-CG 3.21Å; V74-Q79 PolarHBondContact O-NE2 3.33Å
75	S	85.6	Confident	89.9	Confident	33 Å²	33	43 Å²	43	23%	0.231	23%	0.226	C	C	.	.			trans	-87.4	98.3	174.9	-67	0	0	0	0	110.6	W162 I168	S75-W162 WeakPolarHBondContact O-CZ2 3.3Å; S75-I168 PolarHBondContact OG-N 2.89Å; S75-I168 VanDerWaalsContact OG-N 3.15Å
76	N	76.3	Confident	90.2	Very high	49 Å²	49	41.5 Å²	41.5	26%	0.262	23%	0.228	S	C	.	.	S	Bend	trans	-143.4	175.3	173.9	66.3	33.7	0	0	0	110.6	V74 Y78 Q79	V74-N76 PolarHBondContact O-N 3.26Å; N76-Y78 HydrophobicContact CB-CD2 4.44Å; N76-Y78 PolarHBondContact O-N 2.88Å; N76-Y78 VanDerWaalsContact O-N 3.15Å; N76-Y78 WeakPolarHBondContact OD1-CB 3.23Å; N76-Y78 PolarHBondContact OD1-N 2.85Å; N76-Q79 WeakPolarHBondContact O-CG 3.46Å; N76-Q79 PolarHBondContact O-N 2.91Å; N76-Q79 PolarHBondContact OD1-NE2 3.14Å
77	K	69.9	Low	90.4	Very high	136 Å²	136	45 Å²	45	59%	0.591	23%	0.232	S	C	*	.	T	Hydrogen-bonded Turn	trans	-72	-2.6	-176.2	-62.6	-178.3	178.5	179.8	0	114.7
78	Y	76.5	Confident	90.5	Very high	189 Å²	189	45.2 Å²	45.2	74%	0.741	22%	0.224	S	C	*	.	T	Hydrogen-bonded Turn	trans	-97	-1.6	-178.7	-51.3	-68.6	0	0	0	112.9	N76	N76-Y78 HydrophobicContact CB-CD2 4.44Å; N76-Y78 PolarHBondContact O-N 2.88Å; N76-Y78 VanDerWaalsContact O-N 3.15Å; N76-Y78 WeakPolarHBondContact OD1-CB 3.23Å; N76-Y78 PolarHBondContact OD1-N 2.85Å
79	Q	89.6	Confident	90.6	Very high	18 Å²	18	46 Å²	46	8%	0.084	23%	0.228	C	C	.	.			trans	-75.1	151.1	179.7	-54.1	-52.9	-56.2	0	0	110.9	S47 S48 W70 P72 V74 N76 P159 I168	S47-Q79 WeakPolarHBondContact OG-CA 3.34Å; S47-Q79 PolarHBondContact OG-OE1 3.07Å; S48-Q79 PolarHBondContact OG-OE1 2.75Å; W70-Q79 HydrophobicContact CH2-CB 4.11Å; P72-Q79 HydrophobicContact CB-CB 4.19Å; P72-Q79 HydrophobicContact CB-CG 3.76Å; P72-Q79 HydrophobicContact CG-CB 4.11Å; P72-Q79 HydrophobicContact CG-CG 3.75Å; V74-Q79 WeakPolarHBondContact O-CG 3.21Å; V74-Q79 PolarHBondContact O-NE2 3.33Å; N76-Q79 WeakPolarHBondContact O-CG 3.46Å; N76-Q79 PolarHBondContact O-N 2.91Å; N76-Q79 PolarHBondContact OD1-NE2 3.14Å; Q79-P159 VanDerWaalsContact O-CD 3.25Å; Q79-P159 WeakPolarHBondContact O-CD 3.45Å; Q79-I168 HydrophobicContact CB-CD1 4.06Å; Q79-I168 HydrophobicContact CG-CD1 4.02Å
80	W	94.4	Very high	90.7	Very high	64 Å²	64	48.6 Å²	48.6	24%	0.242	24%	0.239	C	C	.	.			trans	-150.8	150.2	176.7	58	-97.2	0	0	0	111.8	S46 S47 W70 Q82 R156 F157 L158	S46-W80 VanDerWaalsContact C-CZ3 3.43Å; S46-W80 VanDerWaalsContact CA-O 3.32Å; S46-W80 WeakPolarHBondContact CA-O 3.41Å; S46-W80 WeakPolarHBondContact CB-O 3.36Å; S46-W80 WeakPolarHBondContact O-CH2 3.5Å; S47-W80 PolarHBondContact N-O 2.79Å; S47-W80 PolarHBondContact OG-N 3.13Å; S47-W80 PolarHBondContact OG-O 2.74Å; S47-W80 VanDerWaalsContact OG-O 3.08Å; W70-W80 VanDerWaalsContact CH2-C 3.48Å; W70-W80 WeakPolarHBondContact CH2-O 3.36Å; W70-W80 VanDerWaalsContact CZ2-O 3.24Å; W70-W80 WeakPolarHBondContact CZ2-O 3.17Å; W80-Q82 HydrophobicContact CE3-CB 3.72Å; W80-Q82 HydrophobicContact CZ3-CB 3.54Å; W80-R156 HydrophobicContact CB-CG 3.76Å; W80-R156 HydrophobicContact CD2-CG 4.39Å; W80-R156 HydrophobicContact CE3-CG 4.18Å; W80-R156 HydrophobicContact CG-CG 4.26Å; W80-F157 VanDerWaalsContact CA-O 3.32Å; W80-F157 WeakPolarHBondContact CA-O 3.31Å; W80-L158 HydrophobicContact CB-CG 4.17Å
81	L	96.6	Very high	90.6	Very high	0 Å²	0	48.6 Å²	48.6	0%	0	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	134.7	170.5	175.3	65.6	0	0	0	108.8	P56 W70 R156 F157 M170 I172	P56-L81 HydrophobicContact CB-CD1 3.68Å; W70-L81 HydrophobicContact CB-CD1 4.21Å; W70-L81 HydrophobicContact CB-CD2 4.47Å; W70-L81 HydrophobicContact CD2-CB 4.06Å; W70-L81 HydrophobicContact CD2-CD1 4.02Å; W70-L81 HydrophobicContact CD2-CD2 4.44Å; W70-L81 HydrophobicContact CD2-CG 4.4Å; W70-L81 HydrophobicContact CE3-CB 3.64Å; W70-L81 HydrophobicContact CE3-CD1 4.32Å; W70-L81 HydrophobicContact CE3-CD2 4Å; W70-L81 HydrophobicContact CE3-CG 4.2Å; W70-L81 HydrophobicContact CG-CD1 3.96Å; W70-L81 HydrophobicContact CH2-CB 4.09Å; W70-L81 HydrophobicContact CZ3-CB 3.65Å; L81-R156 CarbonylContact O-C 3.54Å; L81-R156 VanDerWaalsContact O-CA 3.3Å; L81-R156 WeakPolarHBondContact O-CA 3.24Å; L81-F157 PolarHBondContact N-O 3.45Å; L81-F157 PolarHBondContact O-N 2.79Å; L81-M170 HydrophobicContact CD2-CB 4.24Å; L81-I172 HydrophobicContact CD2-CD1 3.84Å; L81-I172 HydrophobicContact CD2-CG1 4.1Å; L81-I172 HydrophobicContact CD2-CG2 4Å; L81-I172 HydrophobicContact CG-CD1 4.25Å
82	Q	96.2	Very high	90.5	Very high	22 Å²	22	49 Å²	49	10%	0.103	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.9	148.6	-171.9	176.4	179.4	-53.8	0	0	111.6	F44 S45 W80 W120 L155 R156	F44-Q82 WeakPolarHBondContact CA-O 3.37Å; S45-Q82 PolarHBondContact N-O 3.35Å; S45-Q82 PolarHBondContact O-N 2.89Å; S45-Q82 PolarHBondContact OG-NE2 2.9Å; W80-Q82 HydrophobicContact CE3-CB 3.72Å; W80-Q82 HydrophobicContact CZ3-CB 3.54Å; Q82-W120 HydrophobicContact CG-CH2 3.98Å; Q82-W120 HydrophobicContact CG-CZ2 4.47Å; Q82-L155 CarbonylContact C-O 3.4Å; Q82-L155 VanDerWaalsContact CA-O 3.29Å; Q82-L155 WeakPolarHBondContact CA-O 3.46Å; Q82-L155 WeakPolarHBondContact CG-O 3.13Å; Q82-R156 HydrophobicContact CB-CB 4.42Å; Q82-R156 HydrophobicContact CB-CG 4.34Å; Q82-R156 VanDerWaalsContact OE1-NE 3.16Å
83	I	96.6	Very high	90.5	Very high	0 Å²	0	49 Å²	49	0%	0	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.5	135.5	173.5	-167.8	170.4	0	0	0	111	A36 L39 S43 F44 L85 F154 L155 V174	A36-I83 HydrophobicContact CB-CD1 3.29Å; L39-I83 HydrophobicContact CD1-CD1 3.81Å; L39-I83 HydrophobicContact CD1-CG1 3.9Å; S43-I83 CarbonylContact O-C 3.47Å; S43-I83 WeakPolarHBondContact O-CA 3.29Å; F44-I83 HydrophobicContact CD1-CD1 4.4Å; F44-I83 HydrophobicContact CD1-CG1 4.34Å; F44-I83 HydrophobicContact CE1-CD1 3.62Å; F44-I83 HydrophobicContact CE1-CG1 4.03Å; F44-I83 HydrophobicContact CZ-CD1 3.69Å; F44-I83 HydrophobicContact CZ-CG1 4.19Å; I83-L85 HydrophobicContact CD1-CD2 4.12Å; I83-L85 HydrophobicContact CG1-CD2 4.25Å; I83-F154 WeakPolarHBondContact O-CA 3.24Å; I83-L155 HydrophobicContact CG2-CB 3.74Å; I83-L155 HydrophobicContact CG2-CD1 4.36Å; I83-L155 PolarHBondContact N-O 2.86Å; I83-L155 PolarHBondContact O-N 2.99Å; I83-V174 HydrophobicContact CG2-CG2 4.27Å
84	D	96.7	Very high	90.6	Very high	32 Å²	32	44.1 Å²	44.1	17%	0.171	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	111.3	167.7	-178	3.5	0	0	0	109.1	S43 G86 R153 F154	S43-D84 VanDerWaalsContact CB-O 3.28Å; S43-D84 WeakPolarHBondContact CB-O 3.46Å; S43-D84 PolarHBondContact O-N 2.85Å; S43-D84 PolarHBondContact OG-O 2.77Å; D84-G86 PolarHBondContact O-N 2.75Å; D84-G86 WeakPolarHBondContact OD1-CA 3.1Å; D84-G86 PolarHBondContact OD1-N 2.9Å; D84-R153 VanDerWaalsContact OD1-CG 3.3Å; D84-R153 WeakPolarHBondContact OD1-CG 3.12Å; D84-R153 IonicContact OD1-CZ 2.79Å; D84-R153 IonicContact OD1-NE 3.08Å; D84-R153 PolarHBondContact OD1-NE 2.68Å; D84-R153 IonicContact OD1-NH2 2.9Å; D84-R153 PolarHBondContact OD1-NH2 3.01Å; D84-R153 IonicContact OD2-CZ 3.95Å; D84-R153 IonicContact OD2-NE 3Å; D84-R153 IonicContact OD2-NH2 3.22Å; D84-R153 PolarHBondContact OD2-NH2 2.93Å; D84-F154 HydrophobicContact CB-CD1 3.75Å; D84-F154 HydrophobicContact CB-CE1 3.54Å; D84-F154 HydrophobicContact CB-CZ 4.47Å; D84-F154 WeakPolarHBondContact OD2-CE1 3.37Å
85	L	95.6	Very high	91.1	Very high	13 Å²	13	40.3 Å²	40.3	7%	0.068	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.1	-4.7	178.8	-57.5	179.9	0	0	0	113	L35 L39 I83 E87 M89 V91 R153 L155	L35-L85 HydrophobicContact CB-CD2 4.1Å; L35-L85 HydrophobicContact CD1-CD1 4.13Å; L39-L85 HydrophobicContact CD1-CD2 3.93Å; I83-L85 HydrophobicContact CD1-CD2 4.12Å; I83-L85 HydrophobicContact CG1-CD2 4.25Å; L85-E87 PolarHBondContact O-N 3.06Å; L85-E87 VanDerWaalsContact O-N 3.15Å; L85-M89 HydrophobicContact CB-CG 3.78Å; L85-M89 HydrophobicContact CD1-CB 3.74Å; L85-M89 HydrophobicContact CD1-CG 3.69Å; L85-M89 HydrophobicContact CG-CG 4.36Å; L85-V91 HydrophobicContact CD1-CG2 4.16Å; L85-R153 VanDerWaalsContact CB-O 3.31Å; L85-R153 WeakPolarHBondContact CB-O 3.46Å; L85-R153 WeakPolarHBondContact CG-O 3.29Å; L85-R153 PolarHBondContact N-O 2.84Å; L85-L155 HydrophobicContact CD1-CD1 3.5Å; L85-L155 VanDerWaalsContact CD1-CD1 3.5Å; L85-L155 HydrophobicContact CG-CD1 3.93Å
86	G	92.6	Very high	91.6	Very high	40 Å²	40	38.7 Å²	38.7	41%	0.412	18%	0.182	S	C	.	.	E	Extended strand (participates in β ladder)	trans	87.1	-49.9	178.7	0	0	0	0	0	112.9	D84 R153	D84-G86 PolarHBondContact O-N 2.75Å; D84-G86 WeakPolarHBondContact OD1-CA 3.1Å; D84-G86 PolarHBondContact OD1-N 2.9Å; G86-R153 PolarHBondContact O-NE 3.4Å; G86-R153 PolarHBondContact O-NH1 3.18Å
87	E	90.1	Very high	92.6	Very high	121 Å²	121	36.8 Å²	36.8	57%	0.565	17%	0.172	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-126.5	176.5	173.7	67.6	-171.8	149.4	0	0	111.4	L85 M89 R153	L85-E87 PolarHBondContact O-N 3.06Å; L85-E87 VanDerWaalsContact O-N 3.15Å; E87-M89 HydrophobicContact CG-SD 3.57Å; E87-M89 VanDerWaalsContact CG-SD 3.57Å; E87-M89 PolarHBondContact O-N 2.98Å; E87-R153 WeakPolarHBondContact O-CA 3.26Å
88	R	90	Very high	93.8	Very high	42 Å²	42	30.3 Å²	30.3	16%	0.158	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78	121	179.1	-161.5	169.8	172.7	-148.2	-10.3	108.3	D115 E151 Y179 W272 E334	R88-D115 IonicContact NE-OD1 3.59Å; R88-D115 PolarHBondContact NE-OD1 2.69Å; R88-D115 IonicContact NE-OD2 3.66Å; R88-E151 HydrophobicContact CG-CB 4.33Å; R88-Y179 HydrophobicContact CG-CD1 4.42Å; R88-Y179 PolarHBondContact O-N 2.97Å; R88-W272 VanDerWaalsContact NH2-CD1 3.27Å; R88-E334 IonicContact CZ-OE1 3.49Å; R88-E334 IonicContact CZ-OE2 2.85Å; R88-E334 VanDerWaalsContact NH1-CD 3.3Å; R88-E334 IonicContact NH1-OE1 3.93Å; R88-E334 PolarHBondContact NH1-OE1 3.16Å; R88-E334 IonicContact NH1-OE2 3.58Å; R88-E334 PolarHBondContact NH1-OE2 2.98Å; R88-E334 IonicContact NH2-OE1 2.62Å; R88-E334 IonicContact NH2-OE2 2.8Å; R88-E334 PolarHBondContact NH2-OE2 3.33Å
89	M	93.4	Very high	94.7	Very high	19 Å²	19	21.4 Å²	21.4	9%	0.094	11%	0.109	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	150.6	-177.5	-53.6	-59.9	-80.7	0	0	109.3	L35 L85 E87 E151 A152 C177 A178	L35-M89 HydrophobicContact CD1-CB 3.95Å; L35-M89 HydrophobicContact CD1-CE 4.15Å; L35-M89 HydrophobicContact CD1-CG 4.18Å; L35-M89 HydrophobicContact CD2-CE 3.68Å; L85-M89 HydrophobicContact CB-CG 3.78Å; L85-M89 HydrophobicContact CD1-CB 3.74Å; L85-M89 HydrophobicContact CD1-CG 3.69Å; L85-M89 HydrophobicContact CG-CG 4.36Å; E87-M89 HydrophobicContact CG-SD 3.57Å; E87-M89 VanDerWaalsContact CG-SD 3.57Å; E87-M89 PolarHBondContact O-N 2.98Å; M89-E151 VanDerWaalsContact O-CA 3.31Å; M89-E151 WeakPolarHBondContact O-CA 3.45Å; M89-A152 PolarHBondContact N-O 2.94Å; M89-A152 PolarHBondContact O-N 3.49Å; M89-C177 WeakPolarHBondContact CA-O 3.09Å; M89-A178 HydrophobicContact CE-CB 4.16Å; M89-A178 HydrophobicContact SD-CB 4.28Å
90	E	94.5	Very high	94.9	Very high	55 Å²	55	24.5 Å²	24.5	26%	0.257	12%	0.121	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.3	118.4	164.9	-177.4	175.3	-179.8	0	0	107.6	T92 P149 G176 C177 Y179	E90-T92 HydrophobicContact CG-CG2 4.5Å; E90-P149 HydrophobicContact CG-CB 4.33Å; E90-G176 CarbonylContact O-C 3.55Å; E90-G176 WeakPolarHBondContact O-CA 3.1Å; E90-C177 PolarHBondContact N-O 3.03Å; E90-C177 PolarHBondContact O-N 3.11Å; E90-C177 VanDerWaalsContact O-N 3.1Å; E90-Y179 HydrophobicContact CB-CD2 4.44Å
91	V	95.4	Very high	94.6	Very high	0 Å²	0	24.9 Å²	24.9	0%	0	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.4	120.1	-176.7	-174.5	0	0	0	0	109.6	L85 L146 P149 F150 L155 V174	L85-V91 HydrophobicContact CD1-CG2 4.16Å; V91-L146 HydrophobicContact CB-CD1 4.47Å; V91-L146 HydrophobicContact CG1-CD1 3.67Å; V91-P149 WeakPolarHBondContact O-CA 3.37Å; V91-P149 WeakPolarHBondContact O-CB 3.45Å; V91-F150 HydrophobicContact CB-CE1 4.28Å; V91-F150 HydrophobicContact CB-CE2 4.2Å; V91-F150 HydrophobicContact CB-CZ 4.07Å; V91-F150 HydrophobicContact CG1-CE1 4.34Å; V91-F150 HydrophobicContact CG1-CZ 4.18Å; V91-F150 HydrophobicContact CG2-CE2 4.24Å; V91-F150 HydrophobicContact CG2-CZ 4.46Å; V91-F150 PolarHBondContact N-O 2.85Å; V91-F150 PolarHBondContact O-N 3.33Å; V91-L155 HydrophobicContact CG1-CD2 4.06Å; V91-L155 HydrophobicContact CG2-CD1 4.21Å; V91-L155 HydrophobicContact CG2-CD2 4.28Å; V91-V174 HydrophobicContact CG1-CG1 3.55Å; V91-V174 HydrophobicContact CG2-CG1 4.23Å
92	T	95.4	Very high	94.3	Very high	12 Å²	12	26.8 Å²	26.8	7%	0.074	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110	-24.6	-174.8	60.9	0	0	0	0	113.2	C31 D32 E90 L146 P149 Y175	C31-T92 HydrophobicContact CB-CG2 4.21Å; C31-T92 WeakPolarHBondContact O-CG2 3.06Å; C31-T92 PolarHBondContact O-OG1 2.84Å; D32-T92 VanDerWaalsContact OD1-CB 3.31Å; D32-T92 WeakPolarHBondContact OD1-CB 3.49Å; D32-T92 PolarHBondContact OD1-OG1 3.3Å; E90-T92 HydrophobicContact CG-CG2 4.5Å; T92-L146 WeakPolarHBondContact O-CB 3.32Å; T92-L146 PolarHBondContact O-N 3.08Å; T92-P149 HydrophobicContact CG2-CB 4.19Å; T92-Y175 PolarHBondContact N-O 3.46Å; T92-Y175 PolarHBondContact OG1-O 3.09Å
93	A	95	Very high	94.2	Very high	1 Å²	1	28.2 Å²	28.2	1%	0.008	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.9	161.8	175.1	0	0	0	0	0	113.1	H143 Y144 Y175	A93-H143 WeakPolarHBondContact CB-NE2 3.24Å; A93-Y144 CarbonylContact C-O 3.58Å; A93-Y144 VanDerWaalsContact CA-O 3.22Å; A93-Y144 WeakPolarHBondContact CA-O 3.43Å; A93-Y144 VanDerWaalsContact CB-O 3.23Å; A93-Y144 WeakPolarHBondContact CB-O 3.46Å; A93-Y175 HydrophobicContact CB-CD2 4.07Å; A93-Y175 HydrophobicContact CB-CG 4.39Å; A93-Y175 PolarHBondContact N-O 3.03Å; A93-Y175 PolarHBondContact O-N 3Å
94	V	96	Very high	94.1	Very high	0 Å²	0	29.3 Å²	29.3	0%	0	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.8	149.4	170.4	-65.8	0	0	0	0	109.7	L111 Y144 L146 L155 F157 E173 V174	V94-L111 HydrophobicContact CG1-CD1 4.4Å; V94-L111 HydrophobicContact CG1-CD2 3.98Å; V94-L111 HydrophobicContact CG2-CD2 4.35Å; V94-Y144 PolarHBondContact N-O 2.96Å; V94-Y144 PolarHBondContact O-N 2.77Å; V94-L146 HydrophobicContact CG1-CD1 4.29Å; V94-L155 HydrophobicContact CG1-CD2 4.38Å; V94-F157 HydrophobicContact CB-CE1 4.15Å; V94-F157 HydrophobicContact CB-CZ 4.17Å; V94-F157 HydrophobicContact CG1-CE1 4.34Å; V94-F157 HydrophobicContact CG1-CZ 3.99Å; V94-F157 HydrophobicContact CG2-CE1 4.48Å; V94-E173 WeakPolarHBondContact CA-O 3.44Å; V94-V174 HydrophobicContact CG1-CG2 4.49Å
95	A	96.9	Very high	94.1	Very high	0 Å²	0	29.7 Å²	29.7	0%	0	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	147.4	171.9	0	0	0	0	0	111.8	L61 V141 V142 H143 I172 E173 Y175	L61-A95 HydrophobicContact CD1-CB 4.5Å; L61-A95 HydrophobicContact CD2-CB 4.17Å; A95-V141 HydrophobicContact CB-CG1 3.89Å; A95-V142 CarbonylContact C-O 3.58Å; A95-V142 WeakPolarHBondContact CA-O 3.35Å; A95-H143 HydrophobicContact CB-CB 4.37Å; A95-I172 CarbonylContact O-C 3.5Å; A95-I172 VanDerWaalsContact O-CA 3.24Å; A95-I172 WeakPolarHBondContact O-CA 3.44Å; A95-E173 HydrophobicContact CB-CB 4.34Å; A95-E173 PolarHBondContact N-O 2.91Å; A95-E173 PolarHBondContact O-N 3.02Å; A95-Y175 HydrophobicContact CB-CE2 3.87Å
96	T	96.9	Very high	93.9	Very high	0 Å²	0	29.1 Å²	29.1	0%	0	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	150.3	178.9	57.4	0	0	0	0	111.5	Y109 N135 V141 V142 F157 M170 R171 I172	T96-Y109 HydrophobicContact CG2-CD1 4.21Å; T96-Y109 HydrophobicContact CG2-CE1 3.52Å; T96-Y109 HydrophobicContact CG2-CE2 4.26Å; T96-N135 PolarHBondContact O-ND2 3.4Å; T96-N135 PolarHBondContact OG1-OD1 2.81Å; T96-V141 WeakPolarHBondContact O-CA 3.48Å; T96-V142 PolarHBondContact N-O 2.9Å; T96-V142 PolarHBondContact O-N 3.05Å; T96-F157 HydrophobicContact CG2-CD1 4.32Å; T96-F157 HydrophobicContact CG2-CE1 4.24Å; T96-M170 HydrophobicContact CG2-CE 4.05Å; T96-R171 CarbonylContact C-O 3.46Å; T96-R171 WeakPolarHBondContact CA-O 3.41Å; T96-I172 HydrophobicContact CG2-CG2 4.28Å
97	Q	96.7	Very high	93.6	Very high	8 Å²	8	29.8 Å²	29.8	4%	0.037	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.4	147.8	178.4	-170.3	-178.9	39.8	0	0	108.6	L61 N62 N135 D139 V141 M170 R171	L61-Q97 HydrophobicContact CD1-CB 3.56Å; N62-Q97 PolarHBondContact OD1-NE2 3.1Å; N62-Q97 VanDerWaalsContact OD1-NE2 3.09Å; N62-Q97 PolarHBondContact OD1-OE1 3.23Å; Q97-N135 VanDerWaalsContact CA-ND2 3.26Å; Q97-N135 WeakPolarHBondContact CA-ND2 3.27Å; Q97-N135 PolarHBondContact N-OD1 2.62Å; Q97-D139 PolarHBondContact NE2-O 3.19Å; Q97-V141 HydrophobicContact CB-CG2 4.47Å; Q97-V141 HydrophobicContact CG-CG2 4.35Å; Q97-M170 CarbonylContact O-C 3.37Å; Q97-M170 WeakPolarHBondContact O-CA 3.35Å; Q97-R171 HydrophobicContact CB-CB 4.14Å; Q97-R171 VanDerWaalsContact CD-CZ 3.45Å; Q97-R171 VanDerWaalsContact CD-NH2 3.33Å; Q97-R171 PolarHBondContact N-O 2.92Å; Q97-R171 PolarHBondContact O-N 3.38Å
98	G	95.5	Very high	93.4	Very high	0 Å²	0	25.5 Å²	25.5	0%	0	15%	0.152	C	C	.	.			trans	-75.3	178.7	178.5	0	0	0	0	0	113.6	Y100 A138 R171	G98-Y100 PolarHBondContact O-N 3.4Å; G98-A138 CarbonylContact C-O 3.58Å; G98-A138 WeakPolarHBondContact CA-O 3.48Å; G98-A138 PolarHBondContact N-O 3.43Å; G98-A138 VanDerWaalsContact O-O 3.09Å; G98-R171 PolarHBondContact O-NE 3.41Å; G98-R171 PolarHBondContact O-NH2 3.3Å
99	G	94.4	Very high	93.1	Very high	2 Å²	2	23.5 Å²	23.5	2%	0.021	14%	0.144	C	C	.	.			trans	-68.1	124.1	174.9	0	0	0	0	0	111.7	G68 G101 S102 D104 A138	G68-G99 WeakPolarHBondContact O-CA 3.45Å; G99-G101 PolarHBondContact O-N 2.87Å; G99-S102 PolarHBondContact O-N 3.26Å; G99-S102 PolarHBondContact O-OG 2.89Å; G99-D104 PolarHBondContact N-O 2.04Å; G99-A138 WeakPolarHBondContact O-CB 3.35Å
100	Y	93.5	Very high	92.5	Very high	84 Å²	84	24.1 Å²	24.1	33%	0.329	15%	0.148	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.2	129.5	-176.2	177.2	-110.5	0	0	0	112.3	R64 G68 G98 S102	R64-Y100 HydrophobicContact CB-CD1 3.89Å; R64-Y100 HydrophobicContact CB-CE1 4.12Å; R64-Y100 HydrophobicContact CB-CG 4.35Å; R64-Y100 HydrophobicContact CG-CD1 3.81Å; R64-Y100 HydrophobicContact CG-CD2 4.08Å; R64-Y100 HydrophobicContact CG-CE1 3.94Å; R64-Y100 HydrophobicContact CG-CE2 4.22Å; R64-Y100 HydrophobicContact CG-CG 3.89Å; R64-Y100 PolarHBondContact NH1-OH 2.82Å; G68-Y100 PolarHBondContact O-N 3.03Å; G98-Y100 PolarHBondContact O-N 3.4Å; Y100-S102 PolarHBondContact O-N 3.43Å
101	G	89.6	Confident	92.2	Very high	71 Å²	71	21.6 Å²	21.6	73%	0.732	14%	0.136	S	C	*	.	T	Hydrogen-bonded Turn	trans	70.3	14.1	176	0	0	0	0	0	114.9	G99	G99-G101 PolarHBondContact O-N 2.87Å
102	S	90.2	Very high	91.8	Very high	41 Å²	41	23.3 Å²	23.3	29%	0.287	14%	0.144	S	C	.	.	S	Bend	trans	-123.7	176	-179.8	79.6	0	0	0	0	112.7	G99 Y100 D104 A138	G99-S102 PolarHBondContact O-N 3.26Å; G99-S102 PolarHBondContact O-OG 2.89Å; Y100-S102 PolarHBondContact O-N 3.43Å; S102-D104 VanDerWaalsContact OG-CB 3.31Å; S102-D104 WeakPolarHBondContact OG-CB 3.31Å; S102-D104 PolarHBondContact OG-N 3.29Å; S102-A138 WeakPolarHBondContact O-CB 3.29Å
103	S	93.1	Very high	91.6	Very high	52 Å²	52	24 Å²	24	36%	0.364	15%	0.147	S	C	.	.	S	Bend	trans	-87.7	12	169	53.4	0	0	0	0	113.1	W105 N163	S103-W105 VanDerWaalsContact C-CZ3 3.47Å; S103-W105 VanDerWaalsContact O-CE3 3.28Å; S103-W105 WeakPolarHBondContact O-CZ3 3.41Å; S103-N163 WeakPolarHBondContact O-CB 3.48Å; S103-N163 PolarHBondContact O-ND2 2.99Å
104	D	94.9	Very high	91.4	Very high	22 Å²	22	24.2 Å²	24.2	12%	0.118	15%	0.148	C	C	.	.			trans	-101.7	106.1	-166	-54.1	-26.4	0	0	0	110.6	G99 S102 R167 G169	G99-D104 PolarHBondContact N-O 2.04Å; S102-D104 VanDerWaalsContact OG-CB 3.31Å; S102-D104 WeakPolarHBondContact OG-CB 3.31Å; S102-D104 PolarHBondContact OG-N 3.29Å; D104-R167 CarbonylContact C-O 3.54Å; D104-R167 VanDerWaalsContact CA-O 3.25Å; D104-R167 WeakPolarHBondContact CA-O 3.35Å; D104-R167 HydrophobicContact CB-CB 4.31Å; D104-R167 WeakPolarHBondContact CB-O 3.48Å; D104-R167 PolarHBondContact OD1-N 3.01Å; D104-G169 WeakPolarHBondContact O-CA 3.43Å
105	W	96.3	Very high	91	Very high	41 Å²	41	26 Å²	26	16%	0.155	16%	0.157	C	C	.	.			trans	-152.4	150.3	176.6	64.1	84.3	0	0	0	111.8	S103 N135 T136 A138 W162 N163 R167 G169	S103-W105 VanDerWaalsContact C-CZ3 3.47Å; S103-W105 VanDerWaalsContact O-CE3 3.28Å; S103-W105 WeakPolarHBondContact O-CZ3 3.41Å; W105-N135 HydrophobicContact CB-CB 4.18Å; W105-N135 HydrophobicContact CG-CB 4.45Å; W105-T136 WeakPolarHBondContact CZ2-O 3.46Å; W105-T136 PolarHBondContact NE1-O 2.97Å; W105-A138 HydrophobicContact CE3-CB 4.42Å; W105-W162 VanDerWaalsContact O-CA 3.28Å; W105-W162 WeakPolarHBondContact O-CA 3.3Å; W105-W162 WeakPolarHBondContact O-CB 3.48Å; W105-N163 HydrophobicContact CD2-CB 3.91Å; W105-N163 HydrophobicContact CE3-CB 4.47Å; W105-N163 HydrophobicContact CG-CB 4.36Å; W105-N163 HydrophobicContact CH2-CB 4.33Å; W105-N163 WeakPolarHBondContact CH2-ND2 3.38Å; W105-N163 HydrophobicContact CZ2-CB 3.73Å; W105-N163 VanDerWaalsContact CZ2-ND2 3.29Å; W105-N163 WeakPolarHBondContact CZ2-ND2 3.2Å; W105-N163 PolarHBondContact O-N 3.3Å; W105-R167 PolarHBondContact N-O 3.18Å; W105-G169 WeakPolarHBondContact CA-O 3.37Å
106	V	92.6	Very high	90.4	Very high	0 Å²	0	27 Å²	27	0%	0	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.7	127.5	178.9	172.9	0	0	0	0	109.3	S108 G134 N135 P159 A161 I168 M170	V106-S108 WeakPolarHBondContact CG1-O 3.43Å; V106-G134 CarbonylContact O-C 3.15Å; V106-G134 WeakPolarHBondContact O-CA 3.04Å; V106-N135 PolarHBondContact O-N 3.32Å; V106-P159 HydrophobicContact CG1-CB 3.99Å; V106-P159 HydrophobicContact CG2-CB 3.82Å; V106-P159 HydrophobicContact CG2-CG 3.95Å; V106-A161 WeakPolarHBondContact CG1-O 3.38Å; V106-I168 HydrophobicContact CG2-CB 4.46Å; V106-I168 HydrophobicContact CG2-CG2 3.82Å; V106-M170 HydrophobicContact CB-CE 4.33Å; V106-M170 HydrophobicContact CB-CG 4.07Å; V106-M170 HydrophobicContact CB-SD 4.22Å; V106-M170 HydrophobicContact CG1-CE 4.43Å; V106-M170 HydrophobicContact CG1-SD 4.49Å; V106-M170 HydrophobicContact CG2-CE 4.45Å; V106-M170 HydrophobicContact CG2-CG 3.44Å; V106-M170 VanDerWaalsContact CG2-CG 3.44Å; V106-M170 HydrophobicContact CG2-SD 3.69Å
107	T	85.2	Confident	89.8	Confident	54 Å²	54	27.8 Å²	27.8	33%	0.331	18%	0.176	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.5	-18.8	-178.7	54.8	0	0	0	0	112.5	G134 N135 A161 W162	T107-G134 WeakPolarHBondContact O-CA 3.41Å; T107-G134 PolarHBondContact O-N 2.76Å; T107-N135 WeakPolarHBondContact CG2-O 3.22Å; T107-A161 PolarHBondContact N-O 2.65Å; T107-A161 WeakPolarHBondContact OG1-CB 3.36Å; T107-A161 PolarHBondContact OG1-O 2.85Å; T107-W162 PolarHBondContact OG1-N 3.49Å
108	S	85.9	Confident	89.1	Confident	31 Å²	31	35.6 Å²	35.6	22%	0.217	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-156.5	148.7	169.5	61.9	0	0	0	0	112.1	V106 F132 L160 A161	V106-S108 WeakPolarHBondContact CG1-O 3.43Å; S108-F132 VanDerWaalsContact CA-O 3.29Å; S108-F132 WeakPolarHBondContact CA-O 3.43Å; S108-L160 PolarHBondContact O-N 2.8Å; S108-A161 PolarHBondContact N-O 3.21Å; S108-A161 PolarHBondContact O-N 2.86Å; S108-A161 WeakPolarHBondContact OG-CB 3.38Å; S108-A161 PolarHBondContact OG-N 2.57Å
109	Y	84	Confident	88.4	Confident	0 Å²	0	36.5 Å²	36.5	0%	0	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.9	152.3	-176.7	64.1	-85.7	0	0	0	113.5	T96 G131 F132 F157 L158	T96-Y109 HydrophobicContact CG2-CD1 4.21Å; T96-Y109 HydrophobicContact CG2-CE1 3.52Å; T96-Y109 HydrophobicContact CG2-CE2 4.26Å; Y109-G131 CarbonylContact O-C 3.48Å; Y109-G131 WeakPolarHBondContact O-CA 3.41Å; Y109-F132 HydrophobicContact CD1-CB 4.07Å; Y109-F132 HydrophobicContact CD2-CB 4.07Å; Y109-F132 HydrophobicContact CD2-CD2 4.38Å; Y109-F132 HydrophobicContact CE1-CB 3.55Å; Y109-F132 HydrophobicContact CE2-CB 3.56Å; Y109-F132 AromaticContact CE2-CD2 3.97Å; Y109-F132 HydrophobicContact CE2-CD2 3.97Å; Y109-F132 AromaticContact CE2-CG 3.83Å; Y109-F132 HydrophobicContact CE2-CG 3.83Å; Y109-F132 HydrophobicContact CG-CB 4.31Å; Y109-F132 AromaticContact CZ-CG 3.89Å; Y109-F132 PolarHBondContact N-O 2.73Å; Y109-F132 PolarHBondContact O-N 2.88Å; Y109-F157 AromaticContact CD2-CD1 3.71Å; Y109-F157 HydrophobicContact CD2-CD1 3.71Å; Y109-F157 HydrophobicContact CD2-CE1 4.44Å; Y109-F157 AromaticContact CE2-CD1 3.58Å; Y109-F157 HydrophobicContact CE2-CD1 3.58Å; Y109-F157 AromaticContact CE2-CE1 3.85Å; Y109-F157 HydrophobicContact CE2-CE1 3.85Å; Y109-L158 CarbonylContact C-O 3.57Å; Y109-L158 WeakPolarHBondContact CA-O 3.14Å; Y109-L158 WeakPolarHBondContact CB-O 3.01Å
110	L	81.5	Confident	87.8	Confident	33 Å²	33	38.3 Å²	38.3	17%	0.173	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89	146.5	165.5	-59.8	173.9	0	0	0	110.6	F157 L158 L160	L110-F157 WeakPolarHBondContact O-CA 3.39Å; L110-L158 HydrophobicContact CB-CB 4.21Å; L110-L158 PolarHBondContact N-O 3.46Å; L110-L158 PolarHBondContact O-N 3.19Å; L110-L160 HydrophobicContact CD1-CD2 4Å; L110-L160 HydrophobicContact CD2-CD1 3.84Å; L110-L160 HydrophobicContact CG-CD1 3.77Å; L110-L160 HydrophobicContact CG-CD2 3.91Å; L110-L160 HydrophobicContact CG-CG 3.97Å
111	L	86.9	Confident	87.1	Confident	1 Å²	1	37.4 Å²	37.4	1%	0.005	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	122.1	168.9	-171.9	65.7	0	0	0	109.3	V94 Y123 F132 L146 F150 L155 F157	V94-L111 HydrophobicContact CG1-CD1 4.4Å; V94-L111 HydrophobicContact CG1-CD2 3.98Å; V94-L111 HydrophobicContact CG2-CD2 4.35Å; L111-Y123 PolarHBondContact O-N 3.41Å; L111-F132 HydrophobicContact CB-CD2 3.9Å; L111-F132 HydrophobicContact CB-CE2 3.4Å; L111-F132 HydrophobicContact CB-CZ 4.1Å; L111-F132 HydrophobicContact CD2-CE2 4.18Å; L111-F132 HydrophobicContact CD2-CZ 4.02Å; L111-F132 HydrophobicContact CG-CE2 4.45Å; L111-L146 HydrophobicContact CD2-CD2 4.05Å; L111-F150 HydrophobicContact CD2-CE1 4.12Å; L111-F150 HydrophobicContact CD2-CZ 4.14Å; L111-L155 HydrophobicContact CD1-CD2 4.3Å; L111-F157 HydrophobicContact CD1-CD1 4.07Å; L111-F157 HydrophobicContact CD1-CD2 4.33Å; L111-F157 HydrophobicContact CD1-CE1 3.8Å; L111-F157 HydrophobicContact CD1-CE2 4.07Å; L111-F157 HydrophobicContact CD1-CG 4.32Å; L111-F157 HydrophobicContact CD1-CZ 3.79Å
112	M	87.8	Confident	86.6	Confident	36 Å²	36	35.7 Å²	35.7	18%	0.177	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	149.4	173	-55.2	-77	-65.6	0	0	108.9	W120 K121 Q122 L155 R156 L158	M112-W120 HydrophobicContact CB-CB 4.48Å; M112-W120 HydrophobicContact CB-CE3 3.76Å; M112-W120 HydrophobicContact CB-CZ3 4.45Å; M112-W120 HydrophobicContact CE-CB 3.55Å; M112-K121 CarbonylContact C-O 3.59Å; M112-K121 VanDerWaalsContact CA-O 3.3Å; M112-K121 WeakPolarHBondContact CA-O 3.42Å; M112-Q122 HydrophobicContact CE-CB 4.4Å; M112-Q122 VanDerWaalsContact SD-CA 3.51Å; M112-Q122 HydrophobicContact SD-CB 3.56Å; M112-Q122 VanDerWaalsContact SD-CB 3.56Å; M112-Q122 HydrophobicContact SD-CG 3.92Å; M112-L155 CarbonylContact O-C 3.57Å; M112-L155 WeakPolarHBondContact O-CA 3.31Å; M112-R156 HydrophobicContact CB-CB 4.24Å; M112-R156 PolarHBondContact N-O 3.01Å; M112-R156 PolarHBondContact O-N 3.47Å; M112-L158 HydrophobicContact CB-CD1 4.21Å; M112-L158 HydrophobicContact CG-CD1 3.4Å; M112-L158 VanDerWaalsContact CG-CD1 3.4Å; M112-L158 HydrophobicContact CG-CD2 4.47Å
113	F	91.1	Very high	86	Confident	28 Å²	28	34.5 Å²	34.5	12%	0.123	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.4	155.1	177.1	66.1	-85.6	0	0	0	112	K121 Y123 F150 A152 F154	F113-K121 HydrophobicContact CD1-CB 4.36Å; F113-K121 VanDerWaalsContact CD1-O 3.26Å; F113-K121 WeakPolarHBondContact CD1-O 3.29Å; F113-K121 HydrophobicContact CD2-CB 4.42Å; F113-K121 HydrophobicContact CE1-CB 3.91Å; F113-K121 HydrophobicContact CE1-CD 4.44Å; F113-K121 HydrophobicContact CE1-CG 3.97Å; F113-K121 HydrophobicContact CE2-CB 3.98Å; F113-K121 HydrophobicContact CE2-CD 4.17Å; F113-K121 HydrophobicContact CE2-CG 4.36Å; F113-K121 HydrophobicContact CZ-CB 3.72Å; F113-K121 HydrophobicContact CZ-CD 3.68Å; F113-K121 HydrophobicContact CZ-CG 3.7Å; F113-K121 PolarHBondContact N-O 2.62Å; F113-K121 PolarHBondContact O-N 2.86Å; F113-Y123 HydrophobicContact CE1-CD2 4.34Å; F113-F150 HydrophobicContact CB-CD2 3.99Å; F113-F150 HydrophobicContact CB-CE2 3.33Å; F113-F150 HydrophobicContact CB-CZ 3.99Å; F113-F150 HydrophobicContact CD1-CD2 4.03Å; F113-F150 AromaticContact CD1-CE2 3.92Å; F113-F150 HydrophobicContact CD1-CE2 3.92Å; F113-F150 HydrophobicContact CD1-CZ 4.26Å; F113-F150 AromaticContact CD2-CD2 3.69Å; F113-F150 HydrophobicContact CD2-CD2 3.69Å; F113-F150 AromaticContact CD2-CE2 3.97Å; F113-F150 HydrophobicContact CD2-CE2 3.97Å; F113-F150 HydrophobicContact CE1-CD2 4.41Å; F113-F150 HydrophobicContact CE2-CD2 4.09Å; F113-F150 AromaticContact CG-CD2 3.64Å; F113-F150 HydrophobicContact CG-CD2 3.64Å; F113-F150 AromaticContact CG-CE2 3.48Å; F113-F150 HydrophobicContact CG-CE2 3.48Å; F113-F150 VanDerWaalsContact CG-CE2 3.48Å; F113-F150 HydrophobicContact CG-CZ 4.22Å; F113-F150 HydrophobicContact CZ-CD2 4.43Å; F113-A152 HydrophobicContact CB-CB 3.81Å; F113-A152 HydrophobicContact CD2-CB 4.04Å; F113-A152 HydrophobicContact CG-CB 4.36Å; F113-F154 CarbonylContact C-O 3.59Å; F113-F154 VanDerWaalsContact CA-O 3.24Å; F113-F154 WeakPolarHBondContact CA-O 3.35Å
114	S	90.1	Very high	84.8	Confident	5 Å²	5	37.7 Å²	37.7	4%	0.035	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-155.5	151.6	-179.8	-171.9	0	0	0	0	111.3	G116 G117 N119 R153 F154	S114-G116 PolarHBondContact OG-N 3.38Å; S114-G117 PolarHBondContact OG-N 3.45Å; S114-N119 WeakPolarHBondContact CB-O 3.13Å; S114-N119 PolarHBondContact OG-O 3.47Å; S114-R153 PolarHBondContact O-N 2.88Å; S114-F154 PolarHBondContact N-O 3.26Å; S114-F154 PolarHBondContact O-N 2.83Å
115	D	87.3	Confident	82.9	Confident	38 Å²	38	40.8 Å²	40.8	20%	0.203	19%	0.19	C	C	.	.	S	Bend	trans	-85.2	-24.1	169.9	-67.1	-27.6	0	0	0	112.7	R88 W272 Q366	R88-D115 IonicContact NE-OD1 3.59Å; R88-D115 PolarHBondContact NE-OD1 2.69Å; R88-D115 IonicContact NE-OD2 3.66Å; D115-W272 PolarHBondContact OD2-NE1 2.91Å; D115-W272 VanDerWaalsContact OD2-NE1 3.09Å; D115-Q366 PolarHBondContact O-NE2 2.96Å
116	G	84.6	Confident	80.5	Confident	20 Å²	20	46.2 Å²	46.2	21%	0.206	22%	0.217	C	C	.	.	S	Bend	trans	-124.7	2.7	-173.9	0	0	0	0	0	115.4	S114 R118	S114-G116 PolarHBondContact OG-N 3.38Å; G116-R118 PolarHBondContact O-N 3.13Å
117	G	84.8	Confident	77.8	Confident	17 Å²	17	54.1 Å²	54.1	18%	0.175	25%	0.254	C	S	.	.	S	Bend	trans	71.7	6.4	179.1	0	0	0	0	0	114.8	S114 W120	S114-G117 PolarHBondContact OG-N 3.45Å; G117-W120 WeakPolarHBondContact O-CZ2 3.42Å; G117-W120 PolarHBondContact O-NE1 2.99Å
118	R	81.6	Confident	75.6	Confident	171 Å²	171	52.2 Å²	52.2	65%	0.645	24%	0.243	S	C	*	.	S	Bend	trans	-118.5	-53.9	-177.1	-61.1	-179.7	-176.8	-99.1	-0.6	112.8	G116 V370	G116-R118 PolarHBondContact O-N 3.13Å; R118-V370 HydrophobicContact CB-CG2 3.7Å
119	N	80.2	Confident	73.3	Confident	20 Å²	20	52 Å²	52	11%	0.107	24%	0.239	C	C	.	.	S	Bend	trans	-89	105.7	175.2	-168.5	15	0	0	0	109.2	S114 D269 H271 V370	S114-N119 WeakPolarHBondContact CB-O 3.13Å; S114-N119 PolarHBondContact OG-O 3.47Å; N119-D269 PolarHBondContact ND2-O 3.32Å; N119-H271 PolarHBondContact ND2-CE1 2.88Å; N119-H271 VanDerWaalsContact ND2-CE1 3.32Å; N119-H271 PolarHBondContact ND2-NE2 2.81Å; N119-H271 PolarHBondContact OD1-CE1 2.86Å; N119-V370 HydrophobicContact CB-CG1 3.98Å; N119-V370 HydrophobicContact CB-CG2 4.17Å
120	W	82.4	Confident	71.5	Confident	39 Å²	39	54.8 Å²	54.8	15%	0.148	25%	0.25	C	C	.	.	P	Polyproline II helix	trans	-102.9	126.2	-171.8	-68.2	89.9	0	0	0	111	Q82 M112 G117 F154 R156	Q82-W120 HydrophobicContact CG-CH2 3.98Å; Q82-W120 HydrophobicContact CG-CZ2 4.47Å; M112-W120 HydrophobicContact CB-CB 4.48Å; M112-W120 HydrophobicContact CB-CE3 3.76Å; M112-W120 HydrophobicContact CB-CZ3 4.45Å; M112-W120 HydrophobicContact CE-CB 3.55Å; G117-W120 WeakPolarHBondContact O-CZ2 3.42Å; G117-W120 PolarHBondContact O-NE1 2.99Å; W120-F154 HydrophobicContact CH2-CB 3.63Å; W120-F154 HydrophobicContact CZ2-CB 4.36Å; W120-F154 HydrophobicContact CZ3-CB 4.08Å; W120-R156 HydrophobicContact CE3-CB 3.96Å; W120-R156 HydrophobicContact CH2-CB 3.65Å; W120-R156 HydrophobicContact CZ2-CB 4.42Å; W120-R156 VanDerWaalsContact CZ2-CZ 3.45Å; W120-R156 HydrophobicContact CZ3-CB 3.4Å
121	K	79	Confident	70.6	Confident	65 Å²	65	53.9 Å²	53.9	28%	0.283	25%	0.249	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-100	134.8	170.8	-166.6	162.1	177.7	173.7	0	109.2	M112 F113 H271	M112-K121 CarbonylContact C-O 3.59Å; M112-K121 VanDerWaalsContact CA-O 3.3Å; M112-K121 WeakPolarHBondContact CA-O 3.42Å; F113-K121 HydrophobicContact CD1-CB 4.36Å; F113-K121 VanDerWaalsContact CD1-O 3.26Å; F113-K121 WeakPolarHBondContact CD1-O 3.29Å; F113-K121 HydrophobicContact CD2-CB 4.42Å; F113-K121 HydrophobicContact CE1-CB 3.91Å; F113-K121 HydrophobicContact CE1-CD 4.44Å; F113-K121 HydrophobicContact CE1-CG 3.97Å; F113-K121 HydrophobicContact CE2-CB 3.98Å; F113-K121 HydrophobicContact CE2-CD 4.17Å; F113-K121 HydrophobicContact CE2-CG 4.36Å; F113-K121 HydrophobicContact CZ-CB 3.72Å; F113-K121 HydrophobicContact CZ-CD 3.68Å; F113-K121 HydrophobicContact CZ-CG 3.7Å; F113-K121 PolarHBondContact N-O 2.62Å; F113-K121 PolarHBondContact O-N 2.86Å; K121-H271 HydrophobicContact CD-CB 4.32Å
122	Q	78.3	Confident	70	Confident	35 Å²	35	54.3 Å²	54.3	16%	0.164	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.7	131.7	170.8	-173.2	-170.6	-14.6	0	0	109	M112 R124	M112-Q122 HydrophobicContact CE-CB 4.4Å; M112-Q122 VanDerWaalsContact SD-CA 3.51Å; M112-Q122 HydrophobicContact SD-CB 3.56Å; M112-Q122 VanDerWaalsContact SD-CB 3.56Å; M112-Q122 HydrophobicContact SD-CG 3.92Å; Q122-R124 HydrophobicContact CB-CG 4.39Å; Q122-R124 HydrophobicContact CG-CG 4.18Å; Q122-R124 PolarHBondContact O-N 3.49Å
123	Y	79.1	Confident	69.8	Low	16 Å²	16	55.7 Å²	55.7	6%	0.063	26%	0.262	C	S	.	.	P	Polyproline II helix	trans	-74.3	120.7	164.9	-173.6	-86.5	0	0	0	109.3	L111 F113 F132 L146 Q147 P148 F150	L111-Y123 PolarHBondContact O-N 3.41Å; F113-Y123 HydrophobicContact CE1-CD2 4.34Å; Y123-F132 HydrophobicContact CD1-CE1 4.49Å; Y123-F132 AromaticContact CD1-CE2 3.99Å; Y123-F132 HydrophobicContact CD1-CE2 3.99Å; Y123-F132 AromaticContact CD1-CZ 3.42Å; Y123-F132 HydrophobicContact CD1-CZ 3.42Å; Y123-F132 VanDerWaalsContact CD1-CZ 3.42Å; Y123-F132 AromaticContact CE1-CZ 3.8Å; Y123-F132 HydrophobicContact CE1-CZ 3.8Å; Y123-F132 HydrophobicContact CG-CZ 4.37Å; Y123-L146 HydrophobicContact CD1-CD2 3.92Å; Y123-L146 HydrophobicContact CE1-CD2 3.5Å; Y123-L146 HydrophobicContact CE2-CB 4.46Å; Y123-L146 HydrophobicContact CE2-CD2 4.21Å; Y123-L146 HydrophobicContact CG-CD2 4.38Å; Y123-Q147 PolarHBondContact OH-N 2.78Å; Y123-Q147 PolarHBondContact OH-O 2.77Å; Y123-P148 VanDerWaalsContact CE2-O 3.31Å; Y123-P148 WeakPolarHBondContact CE2-O 3.3Å; Y123-P148 PolarHBondContact OH-O 2.81Å; Y123-F150 AromaticContact CD2-CD1 3.23Å; Y123-F150 HydrophobicContact CD2-CD1 3.23Å; Y123-F150 AromaticContact CD2-CE1 3.48Å; Y123-F150 HydrophobicContact CD2-CE1 3.48Å; Y123-F150 VanDerWaalsContact CD2-CE1 3.48Å; Y123-F150 HydrophobicContact CD2-CG 4.04Å; Y123-F150 AromaticContact CE2-CD1 3.37Å; Y123-F150 HydrophobicContact CE2-CD1 3.37Å; Y123-F150 AromaticContact CE2-CE1 3.9Å; Y123-F150 HydrophobicContact CE2-CE1 3.9Å; Y123-F150 HydrophobicContact CE2-CG 4.29Å; Y123-F150 HydrophobicContact CG-CD1 4.28Å; Y123-F150 HydrophobicContact CG-CE1 4.12Å
124	R	66.6	Low	69.6	Low	120 Å²	120	54.8 Å²	54.8	45%	0.453	26%	0.261	S	S	.	.			trans	-115	130.4	-175.8	-65.5	-178	179.3	170.8	-0.7	110	Q122	Q122-R124 HydrophobicContact CB-CG 4.39Å; Q122-R124 HydrophobicContact CG-CG 4.18Å; Q122-R124 PolarHBondContact O-N 3.49Å
125	R	55.7	Low	69.9	Low	87 Å²	87	54.7 Å²	54.7	33%	0.328	26%	0.26	S	S	.	.	B	Isolated β-bridge	trans	-83.8	144.2	174.1	-170.5	179.2	82.6	-176.4	14.6	109.5	E127 S128 Y144	R125-E127 PolarHBondContact NH2-O 3.31Å; R125-E127 VanDerWaalsContact NH2-O 3.12Å; R125-E127 PolarHBondContact O-N 2.96Å; R125-S128 WeakPolarHBondContact CB-O 3.49Å; R125-S128 VanDerWaalsContact NE-CB 3.26Å; R125-S128 VanDerWaalsContact NE-N 3.18Å; R125-Y144 WeakPolarHBondContact CD-OH 3.42Å
126	E	45.8	Very low	70.2	Confident	154 Å²	154	58.2 Å²	58.2	72%	0.72	28%	0.283	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.9	-28	175.2	-73.8	172.4	-173.5	0	0	112.4	K290	E126-K290 IonicContact OE1-NZ 3.78Å; E126-K290 PolarHBondContact OE1-NZ 3.03Å
127	E	35.3	Very low	70.6	Confident	167 Å²	167	59.9 Å²	59.9	78%	0.78	29%	0.287	S	S	*	.	T	Hydrogen-bonded Turn	trans	-112.6	5.4	-178.2	-58.9	-171.6	166.2	0	0	115.3	R125	R125-E127 PolarHBondContact NH2-O 3.31Å; R125-E127 VanDerWaalsContact NH2-O 3.12Å; R125-E127 PolarHBondContact O-N 2.96Å
128	S	39.5	Very low	70.9	Confident	14 Å²	14	59.3 Å²	59.3	10%	0.098	28%	0.281	C	S	.	.	B	Isolated β-bridge	trans	-163	128.4	169.7	175.6	0	0	0	0	112.8	R125 W130	R125-S128 WeakPolarHBondContact CB-O 3.49Å; R125-S128 VanDerWaalsContact NE-CB 3.26Å; R125-S128 VanDerWaalsContact NE-N 3.18Å; S128-W130 VanDerWaalsContact C-N 3.29Å; S128-W130 WeakPolarHBondContact OG-CB 3.44Å; S128-W130 PolarHBondContact OG-N 3.47Å; S128-W130 VanDerWaalsContact OG-N 3.07Å
129	I	38.7	Very low	71.4	Confident	27 Å²	27	55.5 Å²	55.5	14%	0.138	27%	0.273	C	S	.	.	S	Bend	trans	-89.9	-2.9	177.9	-56.7	125.2	0	0	0	111.1	G131 K804 M805	I129-G131 PolarHBondContact O-N 2.78Å; I129-K804 HydrophobicContact CD1-CD 4.4Å; I129-M805 WeakPolarHBondContact CD1-O 3.44Å; I129-M805 WeakPolarHBondContact CG1-O 3.26Å; I129-M805 HydrophobicContact CG2-CB 3.81Å; I129-M805 HydrophobicContact CG2-CE 3.91Å; I129-M805 HydrophobicContact CG2-CG 4.09Å
130	W	44.9	Very low	72	Confident	57 Å²	57	56.4 Å²	56.4	22%	0.216	28%	0.281	C	S	.	.	S	Bend	trans	-86	4.6	-166.9	-61.4	140.5	0	0	0	118	S128 L160 P802 Q803 K804	S128-W130 VanDerWaalsContact C-N 3.29Å; S128-W130 WeakPolarHBondContact OG-CB 3.44Å; S128-W130 PolarHBondContact OG-N 3.47Å; S128-W130 VanDerWaalsContact OG-N 3.07Å; W130-L160 WeakPolarHBondContact O-CD1 3.25Å; W130-P802 HydrophobicContact CD2-CB 3.58Å; W130-P802 HydrophobicContact CD2-CG 4.46Å; W130-P802 HydrophobicContact CE3-CB 3.02Å; W130-P802 HydrophobicContact CE3-CG 4.22Å; W130-P802 HydrophobicContact CH2-CB 3.36Å; W130-P802 WeakPolarHBondContact CH2-O 3Å; W130-P802 HydrophobicContact CZ2-CB 3.74Å; W130-P802 WeakPolarHBondContact CZ2-O 3.45Å; W130-P802 HydrophobicContact CZ3-CB 2.92Å; W130-P802 HydrophobicContact CZ3-CG 4.36Å; W130-P802 WeakPolarHBondContact CZ3-O 3.28Å; W130-Q803 WeakPolarHBondContact CH2-O 3.22Å; W130-Q803 HydrophobicContact CZ3-CB 4.46Å; W130-Q803 WeakPolarHBondContact CZ3-O 3.47Å; W130-K804 VanDerWaalsContact CD1-NZ 3.34Å; W130-K804 HydrophobicContact CD2-CD 4.14Å; W130-K804 VanDerWaalsContact CH2-CA 3.45Å; W130-K804 HydrophobicContact CH2-CB 3.99Å; W130-K804 HydrophobicContact CH2-CD 3.85Å; W130-K804 HydrophobicContact CH2-CG 3.53Å; W130-K804 HydrophobicContact CZ2-CB 4.18Å; W130-K804 HydrophobicContact CZ2-CD 3.25Å; W130-K804 HydrophobicContact CZ2-CG 3.23Å; W130-K804 VanDerWaalsContact CZ3-N 3.31Å
131	G	62.2	Low	72.7	Confident	15 Å²	15	57.4 Å²	57.4	16%	0.155	29%	0.291	C	S	.	.			trans	79.8	-177.8	-166	0	0	0	0	0	112.6	Y109 I129	Y109-G131 CarbonylContact O-C 3.48Å; Y109-G131 WeakPolarHBondContact O-CA 3.41Å; I129-G131 PolarHBondContact O-N 2.78Å
132	F	76	Confident	73.5	Confident	9 Å²	9	56 Å²	56	4%	0.039	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.9	140.2	-171.1	-67	-102.1	0	0	0	109.6	S108 Y109 L111 Y123 G134 Y144 L146	S108-F132 VanDerWaalsContact CA-O 3.29Å; S108-F132 WeakPolarHBondContact CA-O 3.43Å; Y109-F132 HydrophobicContact CD1-CB 4.07Å; Y109-F132 HydrophobicContact CD2-CB 4.07Å; Y109-F132 HydrophobicContact CD2-CD2 4.38Å; Y109-F132 HydrophobicContact CE1-CB 3.55Å; Y109-F132 HydrophobicContact CE2-CB 3.56Å; Y109-F132 AromaticContact CE2-CD2 3.97Å; Y109-F132 HydrophobicContact CE2-CD2 3.97Å; Y109-F132 AromaticContact CE2-CG 3.83Å; Y109-F132 HydrophobicContact CE2-CG 3.83Å; Y109-F132 HydrophobicContact CG-CB 4.31Å; Y109-F132 AromaticContact CZ-CG 3.89Å; Y109-F132 PolarHBondContact N-O 2.73Å; Y109-F132 PolarHBondContact O-N 2.88Å; L111-F132 HydrophobicContact CB-CD2 3.9Å; L111-F132 HydrophobicContact CB-CE2 3.4Å; L111-F132 HydrophobicContact CB-CZ 4.1Å; L111-F132 HydrophobicContact CD2-CE2 4.18Å; L111-F132 HydrophobicContact CD2-CZ 4.02Å; L111-F132 HydrophobicContact CG-CE2 4.45Å; Y123-F132 HydrophobicContact CD1-CE1 4.49Å; Y123-F132 AromaticContact CD1-CE2 3.99Å; Y123-F132 HydrophobicContact CD1-CE2 3.99Å; Y123-F132 AromaticContact CD1-CZ 3.42Å; Y123-F132 HydrophobicContact CD1-CZ 3.42Å; Y123-F132 VanDerWaalsContact CD1-CZ 3.42Å; Y123-F132 AromaticContact CE1-CZ 3.8Å; Y123-F132 HydrophobicContact CE1-CZ 3.8Å; Y123-F132 HydrophobicContact CG-CZ 4.37Å; F132-G134 PolarHBondContact O-N 3.35Å; F132-Y144 AromaticContact CD1-CD1 3.55Å; F132-Y144 HydrophobicContact CD1-CD1 3.55Å; F132-Y144 HydrophobicContact CD1-CD2 4.03Å; F132-Y144 AromaticContact CD1-CE1 3.83Å; F132-Y144 HydrophobicContact CD1-CE1 3.83Å; F132-Y144 HydrophobicContact CD1-CE2 4.28Å; F132-Y144 AromaticContact CD1-CG 3.65Å; F132-Y144 HydrophobicContact CD1-CG 3.65Å; F132-Y144 AromaticContact CE1-CD1 3.31Å; F132-Y144 HydrophobicContact CE1-CD1 3.31Å; F132-Y144 AromaticContact CE1-CE1 3.44Å; F132-Y144 HydrophobicContact CE1-CE1 3.44Å; F132-Y144 VanDerWaalsContact CE1-CE1 3.44Å; F132-Y144 AromaticContact CE1-CG 3.93Å; F132-Y144 HydrophobicContact CE1-CG 3.93Å; F132-L146 HydrophobicContact CE1-CD2 3.63Å; F132-L146 HydrophobicContact CZ-CD2 3.59Å
133	P	82.5	Confident	74.3	Confident	66 Å²	66	59 Å²	59	43%	0.429	30%	0.302	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-60.3	130.8	167.4	27.9	-32.7	0	0	0	108.8
134	G	88	Confident	74.8	Confident	9 Å²	9	61 Å²	61	9%	0.093	31%	0.309	C	S	.	.			trans	-95.8	-150.9	174.8	0	0	0	0	0	111.3	V106 T107 F132	V106-G134 CarbonylContact O-C 3.15Å; V106-G134 WeakPolarHBondContact O-CA 3.04Å; T107-G134 WeakPolarHBondContact O-CA 3.41Å; T107-G134 PolarHBondContact O-N 2.76Å; F132-G134 PolarHBondContact O-N 3.35Å
135	N	95.2	Very high	76	Confident	2 Å²	2	61.2 Å²	61.2	1%	0.011	31%	0.311	C	S	.	.			trans	-86.6	154.9	-172.9	-54.4	95.3	0	0	0	112.9	T96 Q97 W105 V106 T107 N137 S140	T96-N135 PolarHBondContact O-ND2 3.4Å; T96-N135 PolarHBondContact OG1-OD1 2.81Å; Q97-N135 VanDerWaalsContact CA-ND2 3.26Å; Q97-N135 WeakPolarHBondContact CA-ND2 3.27Å; Q97-N135 PolarHBondContact N-OD1 2.62Å; W105-N135 HydrophobicContact CB-CB 4.18Å; W105-N135 HydrophobicContact CG-CB 4.45Å; V106-N135 PolarHBondContact O-N 3.32Å; T107-N135 WeakPolarHBondContact CG2-O 3.22Å; N135-N137 WeakPolarHBondContact CB-O 3.35Å; N135-S140 PolarHBondContact ND2-O 2.94Å
136	T	93.4	Very high	77.5	Confident	112 Å²	112	57.3 Å²	57.3	69%	0.687	30%	0.296	S	S	*	.	S	Bend	trans	-102.5	-9.2	170.4	54.4	0	0	0	0	112.8	W105	W105-T136 WeakPolarHBondContact CZ2-O 3.46Å; W105-T136 PolarHBondContact NE1-O 2.97Å
137	N	93.2	Very high	79.3	Confident	56 Å²	56	56.9 Å²	56.9	30%	0.299	29%	0.294	S	S	.	.	S	Bend	trans	-157.7	-179.6	178.6	62.7	64.3	0	0	0	110.8	N135 D139 S140	N135-N137 WeakPolarHBondContact CB-O 3.35Å; N137-D139 PolarHBondContact OD1-N 3.15Å; N137-S140 PolarHBondContact ND2-OG 2.79Å; N137-S140 VanDerWaalsContact ND2-OG 3.12Å; N137-S140 WeakPolarHBondContact OD1-CB 3.41Å; N137-S140 PolarHBondContact OD1-N 3.23Å; N137-S140 PolarHBondContact OD1-OG 2.96Å
138	A	91.3	Very high	81.5	Confident	5 Å²	5	51.5 Å²	51.5	4%	0.041	27%	0.273	C	S	.	.	S	Bend	trans	-71.5	-28.5	-179.5	0	0	0	0	0	115.5	G98 G99 S102 W105 R171	G98-A138 CarbonylContact C-O 3.58Å; G98-A138 WeakPolarHBondContact CA-O 3.48Å; G98-A138 PolarHBondContact N-O 3.43Å; G98-A138 VanDerWaalsContact O-O 3.09Å; G99-A138 WeakPolarHBondContact O-CB 3.35Å; S102-A138 WeakPolarHBondContact O-CB 3.29Å; W105-A138 HydrophobicContact CE3-CB 4.42Å; A138-R171 PolarHBondContact O-NH2 2.92Å
139	D	91.4	Very high	83.9	Confident	91 Å²	91	53.5 Å²	53.5	49%	0.487	29%	0.286	S	S	.	.	S	Bend	trans	-108.5	-30.3	-162.2	-63.1	-63.2	0	0	0	114.1	Q97 N137	Q97-D139 PolarHBondContact NE2-O 3.19Å; N137-D139 PolarHBondContact OD1-N 3.15Å
140	S	93.6	Very high	86.4	Confident	39 Å²	39	52.9 Å²	52.9	27%	0.273	28%	0.283	S	S	.	.			trans	-72	131.4	-178.6	61.7	0	0	0	0	111.3	N135 N137	N135-S140 PolarHBondContact ND2-O 2.94Å; N137-S140 PolarHBondContact ND2-OG 2.79Å; N137-S140 VanDerWaalsContact ND2-OG 3.12Å; N137-S140 WeakPolarHBondContact OD1-CB 3.41Å; N137-S140 PolarHBondContact OD1-N 3.23Å; N137-S140 PolarHBondContact OD1-OG 2.96Å
141	V	96.6	Very high	88.6	Confident	59 Å²	59	52.3 Å²	52.3	36%	0.358	28%	0.282	S	S	.	.			trans	-82.4	127.1	172.1	178.4	0	0	0	0	109.2	L61 A95 T96 Q97	L61-V141 HydrophobicContact CD1-CG1 4.11Å; L61-V141 HydrophobicContact CD1-CG2 4.09Å; L61-V141 HydrophobicContact CD2-CG1 3.95Å; L61-V141 HydrophobicContact CD2-CG2 4.25Å; L61-V141 HydrophobicContact CG-CG2 4.27Å; A95-V141 HydrophobicContact CB-CG1 3.89Å; T96-V141 WeakPolarHBondContact O-CA 3.48Å; Q97-V141 HydrophobicContact CB-CG2 4.47Å; Q97-V141 HydrophobicContact CG-CG2 4.35Å
142	V	95.9	Very high	90.1	Very high	35 Å²	35	51.6 Å²	51.6	21%	0.212	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	107.2	171.3	176.4	0	0	0	0	107.5	A95 T96	A95-V142 CarbonylContact C-O 3.58Å; A95-V142 WeakPolarHBondContact CA-O 3.35Å; T96-V142 PolarHBondContact N-O 2.9Å; T96-V142 PolarHBondContact O-N 3.05Å
143	H	94.8	Very high	90.9	Very high	100 Å²	100	55 Å²	55	46%	0.463	29%	0.287	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.5	136	179.4	178.7	-81.4	0	0	0	110.3	A93 A95 Y175	A93-H143 WeakPolarHBondContact CB-NE2 3.24Å; A95-H143 HydrophobicContact CB-CB 4.37Å; H143-Y175 AromaticContact CD2-CE2 3.6Å; H143-Y175 AromaticContact NE2-CD2 3.82Å; H143-Y175 AromaticContact NE2-CE2 3.84Å
144	Y	90.4	Very high	91.5	Very high	56 Å²	56	53 Å²	53	22%	0.22	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.1	119.9	-178.6	-165.2	-80.3	0	0	0	111.6	A93 V94 R125 F132 L146	A93-Y144 CarbonylContact C-O 3.58Å; A93-Y144 VanDerWaalsContact CA-O 3.22Å; A93-Y144 WeakPolarHBondContact CA-O 3.43Å; A93-Y144 VanDerWaalsContact CB-O 3.23Å; A93-Y144 WeakPolarHBondContact CB-O 3.46Å; V94-Y144 PolarHBondContact N-O 2.96Å; V94-Y144 PolarHBondContact O-N 2.77Å; R125-Y144 WeakPolarHBondContact CD-OH 3.42Å; F132-Y144 AromaticContact CD1-CD1 3.55Å; F132-Y144 HydrophobicContact CD1-CD1 3.55Å; F132-Y144 HydrophobicContact CD1-CD2 4.03Å; F132-Y144 AromaticContact CD1-CE1 3.83Å; F132-Y144 HydrophobicContact CD1-CE1 3.83Å; F132-Y144 HydrophobicContact CD1-CE2 4.28Å; F132-Y144 AromaticContact CD1-CG 3.65Å; F132-Y144 HydrophobicContact CD1-CG 3.65Å; F132-Y144 AromaticContact CE1-CD1 3.31Å; F132-Y144 HydrophobicContact CE1-CD1 3.31Å; F132-Y144 AromaticContact CE1-CE1 3.44Å; F132-Y144 HydrophobicContact CE1-CE1 3.44Å; F132-Y144 VanDerWaalsContact CE1-CE1 3.44Å; F132-Y144 AromaticContact CE1-CG 3.93Å; F132-Y144 HydrophobicContact CE1-CG 3.93Å; Y144-L146 HydrophobicContact CD1-CD2 4.36Å
145	R	90.7	Very high	91.9	Very high	126 Å²	126	52.6 Å²	52.6	48%	0.475	27%	0.268	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.9	126.6	174.7	-164	170.8	-170.7	112.6	6.4	110.2	D32	D32-R145 IonicContact OD1-CZ 3.42Å; D32-R145 IonicContact OD1-NH1 3.96Å; D32-R145 IonicContact OD1-NH2 3.21Å; D32-R145 IonicContact OD2-CZ 3.56Å; D32-R145 IonicContact OD2-NH1 2.75Å; D32-R145 PolarHBondContact OD2-NH1 2.94Å; D32-R145 IonicContact OD2-NH2 3.67Å; D32-R145 PolarHBondContact OD2-NH2 3.44Å
146	L	87.6	Confident	91.9	Very high	4 Å²	4	54.8 Å²	54.8	2%	0.021	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.7	127.9	-177.8	-63.3	161.5	0	0	0	109.3	V91 T92 V94 L111 Y123 F132 Y144 P148 F150	V91-L146 HydrophobicContact CB-CD1 4.47Å; V91-L146 HydrophobicContact CG1-CD1 3.67Å; T92-L146 WeakPolarHBondContact O-CB 3.32Å; T92-L146 PolarHBondContact O-N 3.08Å; V94-L146 HydrophobicContact CG1-CD1 4.29Å; L111-L146 HydrophobicContact CD2-CD2 4.05Å; Y123-L146 HydrophobicContact CD1-CD2 3.92Å; Y123-L146 HydrophobicContact CE1-CD2 3.5Å; Y123-L146 HydrophobicContact CE2-CB 4.46Å; Y123-L146 HydrophobicContact CE2-CD2 4.21Å; Y123-L146 HydrophobicContact CG-CD2 4.38Å; F132-L146 HydrophobicContact CE1-CD2 3.63Å; F132-L146 HydrophobicContact CZ-CD2 3.59Å; Y144-L146 HydrophobicContact CD1-CD2 4.36Å; L146-P148 CarbonylContact C-O 3.44Å; L146-P148 CarbonylContact O-C 3.37Å; L146-F150 HydrophobicContact CD1-CD1 4.11Å; L146-F150 HydrophobicContact CD1-CE1 3.51Å; L146-F150 HydrophobicContact CD1-CZ 4.39Å; L146-F150 HydrophobicContact CD2-CE1 4.36Å; L146-F150 HydrophobicContact CG-CE1 4.45Å
147	Q	84.8	Confident	92	Very high	146 Å²	146	49.4 Å²	49.4	68%	0.682	24%	0.243	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-134.8	109.3	177.3	-68.8	-174.5	-5.6	0	0	108.9	Y123	Y123-Q147 PolarHBondContact OH-N 2.78Å; Y123-Q147 PolarHBondContact OH-O 2.77Å
148	P	81.6	Confident	91.7	Very high	53 Å²	53	48.7 Å²	48.7	34%	0.344	24%	0.239	S	C	.	.	E	Extended strand (participates in β ladder)	cis	-73.3	161.6	-2.7	33.9	-38.8	0	0	0	112.4	Y123 L146	Y123-P148 VanDerWaalsContact CE2-O 3.31Å; Y123-P148 WeakPolarHBondContact CE2-O 3.3Å; Y123-P148 PolarHBondContact OH-O 2.81Å; L146-P148 CarbonylContact C-O 3.44Å; L146-P148 CarbonylContact O-C 3.37Å
149	P	90.1	Very high	91.5	Very high	57 Å²	57	48.5 Å²	48.5	37%	0.37	24%	0.237	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-61.9	164.3	162.2	30.3	-35.3	0	0	0	110.6	E90 V91 T92	E90-P149 HydrophobicContact CG-CB 4.33Å; V91-P149 WeakPolarHBondContact O-CA 3.37Å; V91-P149 WeakPolarHBondContact O-CB 3.45Å; T92-P149 HydrophobicContact CG2-CB 4.19Å
150	F	89.6	Confident	90.9	Very high	14 Å²	14	46.4 Å²	46.4	6%	0.061	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.4	154	178.1	66.8	-89.9	0	0	0	111.4	V91 L111 F113 Y123 L146 A152 L155	V91-F150 HydrophobicContact CB-CE1 4.28Å; V91-F150 HydrophobicContact CB-CE2 4.2Å; V91-F150 HydrophobicContact CB-CZ 4.07Å; V91-F150 HydrophobicContact CG1-CE1 4.34Å; V91-F150 HydrophobicContact CG1-CZ 4.18Å; V91-F150 HydrophobicContact CG2-CE2 4.24Å; V91-F150 HydrophobicContact CG2-CZ 4.46Å; V91-F150 PolarHBondContact N-O 2.85Å; V91-F150 PolarHBondContact O-N 3.33Å; L111-F150 HydrophobicContact CD2-CE1 4.12Å; L111-F150 HydrophobicContact CD2-CZ 4.14Å; F113-F150 HydrophobicContact CB-CD2 3.99Å; F113-F150 HydrophobicContact CB-CE2 3.33Å; F113-F150 HydrophobicContact CB-CZ 3.99Å; F113-F150 HydrophobicContact CD1-CD2 4.03Å; F113-F150 AromaticContact CD1-CE2 3.92Å; F113-F150 HydrophobicContact CD1-CE2 3.92Å; F113-F150 HydrophobicContact CD1-CZ 4.26Å; F113-F150 AromaticContact CD2-CD2 3.69Å; F113-F150 HydrophobicContact CD2-CD2 3.69Å; F113-F150 AromaticContact CD2-CE2 3.97Å; F113-F150 HydrophobicContact CD2-CE2 3.97Å; F113-F150 HydrophobicContact CE1-CD2 4.41Å; F113-F150 HydrophobicContact CE2-CD2 4.09Å; F113-F150 AromaticContact CG-CD2 3.64Å; F113-F150 HydrophobicContact CG-CD2 3.64Å; F113-F150 AromaticContact CG-CE2 3.48Å; F113-F150 HydrophobicContact CG-CE2 3.48Å; F113-F150 VanDerWaalsContact CG-CE2 3.48Å; F113-F150 HydrophobicContact CG-CZ 4.22Å; F113-F150 HydrophobicContact CZ-CD2 4.43Å; Y123-F150 AromaticContact CD2-CD1 3.23Å; Y123-F150 HydrophobicContact CD2-CD1 3.23Å; Y123-F150 AromaticContact CD2-CE1 3.48Å; Y123-F150 HydrophobicContact CD2-CE1 3.48Å; Y123-F150 VanDerWaalsContact CD2-CE1 3.48Å; Y123-F150 HydrophobicContact CD2-CG 4.04Å; Y123-F150 AromaticContact CE2-CD1 3.37Å; Y123-F150 HydrophobicContact CE2-CD1 3.37Å; Y123-F150 AromaticContact CE2-CE1 3.9Å; Y123-F150 HydrophobicContact CE2-CE1 3.9Å; Y123-F150 HydrophobicContact CE2-CG 4.29Å; Y123-F150 HydrophobicContact CG-CD1 4.28Å; Y123-F150 HydrophobicContact CG-CE1 4.12Å; L146-F150 HydrophobicContact CD1-CD1 4.11Å; L146-F150 HydrophobicContact CD1-CE1 3.51Å; L146-F150 HydrophobicContact CD1-CZ 4.39Å; L146-F150 HydrophobicContact CD2-CE1 4.36Å; L146-F150 HydrophobicContact CG-CE1 4.45Å; F150-A152 HydrophobicContact CD2-CB 3.87Å; F150-A152 HydrophobicContact CE2-CB 3.67Å; F150-L155 HydrophobicContact CE2-CD2 4.43Å; F150-L155 HydrophobicContact CZ-CD2 3.95Å; F150-L155 HydrophobicContact CZ-CG 4.45Å
151	E	91.4	Very high	90.3	Very high	44 Å²	44	46.3 Å²	46.3	21%	0.206	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.8	127.9	177.5	-48.6	87.1	178.2	0	0	111.2	R88 M89 Y179 K211	R88-E151 HydrophobicContact CG-CB 4.33Å; M89-E151 VanDerWaalsContact O-CA 3.31Å; M89-E151 WeakPolarHBondContact O-CA 3.45Å; E151-Y179 HydrophobicContact CB-CD1 4.14Å; E151-Y179 HydrophobicContact CB-CE1 4.24Å; E151-Y179 HydrophobicContact CB-CG 4.37Å; E151-Y179 HydrophobicContact CG-CD1 3.93Å; E151-Y179 HydrophobicContact CG-CD2 3.75Å; E151-Y179 HydrophobicContact CG-CE1 3.86Å; E151-Y179 HydrophobicContact CG-CE2 3.71Å; E151-Y179 HydrophobicContact CG-CG 3.86Å; E151-K211 IonicContact OE1-NZ 3.99Å; E151-K211 PolarHBondContact OE1-NZ 2.8Å; E151-K211 IonicContact OE2-NZ 2.86Å; E151-K211 PolarHBondContact OE2-NZ 3.17Å
152	A	93.4	Very high	90.1	Very high	0 Å²	0	46.4 Å²	46.4	0%	0	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-157.3	160.2	177.8	0	0	0	0	0	111.9	M89 F113 F150	M89-A152 PolarHBondContact N-O 2.94Å; M89-A152 PolarHBondContact O-N 3.49Å; F113-A152 HydrophobicContact CB-CB 3.81Å; F113-A152 HydrophobicContact CD2-CB 4.04Å; F113-A152 HydrophobicContact CG-CB 4.36Å; F150-A152 HydrophobicContact CD2-CB 3.87Å; F150-A152 HydrophobicContact CE2-CB 3.67Å
153	R	92.9	Very high	89.9	Confident	81 Å²	81	45.5 Å²	45.5	31%	0.306	22%	0.215	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.3	-38.8	168.3	174	175.8	164.8	172.1	-0.4	112.1	D84 L85 G86 E87 S114	D84-R153 VanDerWaalsContact OD1-CG 3.3Å; D84-R153 WeakPolarHBondContact OD1-CG 3.12Å; D84-R153 IonicContact OD1-CZ 2.79Å; D84-R153 IonicContact OD1-NE 3.08Å; D84-R153 PolarHBondContact OD1-NE 2.68Å; D84-R153 IonicContact OD1-NH2 2.9Å; D84-R153 PolarHBondContact OD1-NH2 3.01Å; D84-R153 IonicContact OD2-CZ 3.95Å; D84-R153 IonicContact OD2-NE 3Å; D84-R153 IonicContact OD2-NH2 3.22Å; D84-R153 PolarHBondContact OD2-NH2 2.93Å; L85-R153 VanDerWaalsContact CB-O 3.31Å; L85-R153 WeakPolarHBondContact CB-O 3.46Å; L85-R153 WeakPolarHBondContact CG-O 3.29Å; L85-R153 PolarHBondContact N-O 2.84Å; G86-R153 PolarHBondContact O-NE 3.4Å; G86-R153 PolarHBondContact O-NH1 3.18Å; E87-R153 WeakPolarHBondContact O-CA 3.26Å; S114-R153 PolarHBondContact O-N 2.88Å
154	F	95.6	Very high	89.3	Confident	24 Å²	24	46.6 Å²	46.6	11%	0.105	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	136.7	-176.8	-60.5	-92	0	0	0	110.6	I83 D84 F113 S114 W120	I83-F154 WeakPolarHBondContact O-CA 3.24Å; D84-F154 HydrophobicContact CB-CD1 3.75Å; D84-F154 HydrophobicContact CB-CE1 3.54Å; D84-F154 HydrophobicContact CB-CZ 4.47Å; D84-F154 WeakPolarHBondContact OD2-CE1 3.37Å; F113-F154 CarbonylContact C-O 3.59Å; F113-F154 VanDerWaalsContact CA-O 3.24Å; F113-F154 WeakPolarHBondContact CA-O 3.35Å; S114-F154 PolarHBondContact N-O 3.26Å; S114-F154 PolarHBondContact O-N 2.83Å; W120-F154 HydrophobicContact CH2-CB 3.63Å; W120-F154 HydrophobicContact CZ2-CB 4.36Å; W120-F154 HydrophobicContact CZ3-CB 4.08Å
155	L	97	Very high	89.2	Confident	0 Å²	0	54.8 Å²	54.8	0%	0	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	144.6	171.7	-65	82.6	0	0	0	109.5	Q82 I83 L85 V91 V94 L111 M112 F150 F157 V174	Q82-L155 CarbonylContact C-O 3.4Å; Q82-L155 VanDerWaalsContact CA-O 3.29Å; Q82-L155 WeakPolarHBondContact CA-O 3.46Å; Q82-L155 WeakPolarHBondContact CG-O 3.13Å; I83-L155 HydrophobicContact CG2-CB 3.74Å; I83-L155 HydrophobicContact CG2-CD1 4.36Å; I83-L155 PolarHBondContact N-O 2.86Å; I83-L155 PolarHBondContact O-N 2.99Å; L85-L155 HydrophobicContact CD1-CD1 3.5Å; L85-L155 VanDerWaalsContact CD1-CD1 3.5Å; L85-L155 HydrophobicContact CG-CD1 3.93Å; V91-L155 HydrophobicContact CG1-CD2 4.06Å; V91-L155 HydrophobicContact CG2-CD1 4.21Å; V91-L155 HydrophobicContact CG2-CD2 4.28Å; V94-L155 HydrophobicContact CG1-CD2 4.38Å; L111-L155 HydrophobicContact CD1-CD2 4.3Å; M112-L155 CarbonylContact O-C 3.57Å; M112-L155 WeakPolarHBondContact O-CA 3.31Å; F150-L155 HydrophobicContact CE2-CD2 4.43Å; F150-L155 HydrophobicContact CZ-CD2 3.95Å; F150-L155 HydrophobicContact CZ-CG 4.45Å; L155-F157 HydrophobicContact CB-CE2 4.42Å; L155-V174 HydrophobicContact CD2-CG1 3.92Å; L155-V174 HydrophobicContact CD2-CG2 4.2Å
156	R	95.2	Very high	89.2	Confident	48 Å²	48	49.8 Å²	49.8	18%	0.181	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.4	127	178.9	-174.8	-172.7	-72.3	176.5	-5.1	110.2	W80 L81 Q82 M112 W120 L158	W80-R156 HydrophobicContact CB-CG 3.76Å; W80-R156 HydrophobicContact CD2-CG 4.39Å; W80-R156 HydrophobicContact CE3-CG 4.18Å; W80-R156 HydrophobicContact CG-CG 4.26Å; L81-R156 CarbonylContact O-C 3.54Å; L81-R156 VanDerWaalsContact O-CA 3.3Å; L81-R156 WeakPolarHBondContact O-CA 3.24Å; Q82-R156 HydrophobicContact CB-CB 4.42Å; Q82-R156 HydrophobicContact CB-CG 4.34Å; Q82-R156 VanDerWaalsContact OE1-NE 3.16Å; M112-R156 HydrophobicContact CB-CB 4.24Å; M112-R156 PolarHBondContact N-O 3.01Å; M112-R156 PolarHBondContact O-N 3.47Å; W120-R156 HydrophobicContact CE3-CB 3.96Å; W120-R156 HydrophobicContact CH2-CB 3.65Å; W120-R156 HydrophobicContact CZ2-CB 4.42Å; W120-R156 VanDerWaalsContact CZ2-CZ 3.45Å; W120-R156 HydrophobicContact CZ3-CB 3.4Å; R156-L158 HydrophobicContact CB-CD1 4.3Å; R156-L158 HydrophobicContact CG-CD1 3.74Å
157	F	94.9	Very high	89.5	Confident	0 Å²	0	54.9 Å²	54.9	0%	0	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.2	122.7	178.2	-63.6	-103.8	0	0	0	108.5	W80 L81 V94 T96 Y109 L110 L111 L155 M170 I172 V174	W80-F157 VanDerWaalsContact CA-O 3.32Å; W80-F157 WeakPolarHBondContact CA-O 3.31Å; L81-F157 PolarHBondContact N-O 3.45Å; L81-F157 PolarHBondContact O-N 2.79Å; V94-F157 HydrophobicContact CB-CE1 4.15Å; V94-F157 HydrophobicContact CB-CZ 4.17Å; V94-F157 HydrophobicContact CG1-CE1 4.34Å; V94-F157 HydrophobicContact CG1-CZ 3.99Å; V94-F157 HydrophobicContact CG2-CE1 4.48Å; T96-F157 HydrophobicContact CG2-CD1 4.32Å; T96-F157 HydrophobicContact CG2-CE1 4.24Å; Y109-F157 AromaticContact CD2-CD1 3.71Å; Y109-F157 HydrophobicContact CD2-CD1 3.71Å; Y109-F157 HydrophobicContact CD2-CE1 4.44Å; Y109-F157 AromaticContact CE2-CD1 3.58Å; Y109-F157 HydrophobicContact CE2-CD1 3.58Å; Y109-F157 AromaticContact CE2-CE1 3.85Å; Y109-F157 HydrophobicContact CE2-CE1 3.85Å; L110-F157 WeakPolarHBondContact O-CA 3.39Å; L111-F157 HydrophobicContact CD1-CD1 4.07Å; L111-F157 HydrophobicContact CD1-CD2 4.33Å; L111-F157 HydrophobicContact CD1-CE1 3.8Å; L111-F157 HydrophobicContact CD1-CE2 4.07Å; L111-F157 HydrophobicContact CD1-CG 4.32Å; L111-F157 HydrophobicContact CD1-CZ 3.79Å; L155-F157 HydrophobicContact CB-CE2 4.42Å; F157-M170 HydrophobicContact CB-CE 4.22Å; F157-M170 HydrophobicContact CD1-CE 4.47Å; F157-I172 HydrophobicContact CD1-CG2 4.31Å; F157-I172 HydrophobicContact CD2-CD1 3.81Å; F157-I172 HydrophobicContact CD2-CG2 4.48Å; F157-I172 HydrophobicContact CE1-CG2 4.32Å; F157-I172 HydrophobicContact CE2-CD1 3.58Å; F157-I172 HydrophobicContact CG-CG2 4.4Å; F157-I172 HydrophobicContact CZ-CB 4.4Å; F157-I172 HydrophobicContact CZ-CD1 4.28Å; F157-I172 HydrophobicContact CZ-CG2 4.42Å; F157-V174 HydrophobicContact CE2-CG2 4.48Å; F157-V174 HydrophobicContact CZ-CG2 4.33Å
158	L	86.1	Confident	90	Very high	41 Å²	41	48 Å²	48	22%	0.215	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	107.6	-179.2	-67.8	74	0	0	0	109	W80 Y109 L110 M112 R156 L160	W80-L158 HydrophobicContact CB-CG 4.17Å; Y109-L158 CarbonylContact C-O 3.57Å; Y109-L158 WeakPolarHBondContact CA-O 3.14Å; Y109-L158 WeakPolarHBondContact CB-O 3.01Å; L110-L158 HydrophobicContact CB-CB 4.21Å; L110-L158 PolarHBondContact N-O 3.46Å; L110-L158 PolarHBondContact O-N 3.19Å; M112-L158 HydrophobicContact CB-CD1 4.21Å; M112-L158 HydrophobicContact CG-CD1 3.4Å; M112-L158 VanDerWaalsContact CG-CD1 3.4Å; M112-L158 HydrophobicContact CG-CD2 4.47Å; R156-L158 HydrophobicContact CB-CD1 4.3Å; R156-L158 HydrophobicContact CG-CD1 3.74Å; L158-L160 PolarHBondContact O-N 3.28Å
159	P	87.8	Confident	90.6	Very high	0 Å²	0	45.4 Å²	45.4	0%	0	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-59.7	129	176	-24.6	36.1	0	0	0	112	W70 Q79 V106 I168 M170	W70-P159 HydrophobicContact CH2-CG 4.5Å; W70-P159 HydrophobicContact CZ3-CG 4.23Å; Q79-P159 VanDerWaalsContact O-CD 3.25Å; Q79-P159 WeakPolarHBondContact O-CD 3.45Å; V106-P159 HydrophobicContact CG1-CB 3.99Å; V106-P159 HydrophobicContact CG2-CB 3.82Å; V106-P159 HydrophobicContact CG2-CG 3.95Å; P159-I168 HydrophobicContact CB-CD1 3.88Å; P159-I168 HydrophobicContact CB-CG1 4.2Å; P159-I168 HydrophobicContact CB-CG2 4.26Å; P159-I168 HydrophobicContact CG-CD1 4.15Å; P159-I168 HydrophobicContact CG-CG2 3.74Å; P159-M170 HydrophobicContact CG-SD 3.8Å
160	L	79.3	Confident	90.9	Very high	47 Å²	47	42.7 Å²	42.7	25%	0.246	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.1	-40.1	175.9	-68	-179.2	0	0	0	112.1	S108 L110 W130 L158	S108-L160 PolarHBondContact O-N 2.8Å; L110-L160 HydrophobicContact CD1-CD2 4Å; L110-L160 HydrophobicContact CD2-CD1 3.84Å; L110-L160 HydrophobicContact CG-CD1 3.77Å; L110-L160 HydrophobicContact CG-CD2 3.91Å; L110-L160 HydrophobicContact CG-CG 3.97Å; W130-L160 WeakPolarHBondContact O-CD1 3.25Å; L158-L160 PolarHBondContact O-N 3.28Å
161	A	80	Confident	91.2	Very high	37 Å²	37	42.2 Å²	42.2	31%	0.306	20%	0.2	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.6	155.3	175.4	0	0	0	0	0	110.4	V106 T107 S108	V106-A161 WeakPolarHBondContact CG1-O 3.38Å; T107-A161 PolarHBondContact N-O 2.65Å; T107-A161 WeakPolarHBondContact OG1-CB 3.36Å; T107-A161 PolarHBondContact OG1-O 2.85Å; S108-A161 PolarHBondContact N-O 3.21Å; S108-A161 PolarHBondContact O-N 2.86Å; S108-A161 WeakPolarHBondContact OG-CB 3.38Å; S108-A161 PolarHBondContact OG-N 2.57Å
162	W	92.1	Very high	91.5	Very high	61 Å²	61	40.1 Å²	40.1	23%	0.231	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.3	174.1	-178.6	54.8	92	0	0	0	110	S75 W105 T107 P164 I168	S75-W162 WeakPolarHBondContact O-CZ2 3.3Å; W105-W162 VanDerWaalsContact O-CA 3.28Å; W105-W162 WeakPolarHBondContact O-CA 3.3Å; W105-W162 WeakPolarHBondContact O-CB 3.48Å; T107-W162 PolarHBondContact OG1-N 3.49Å; W162-P164 WeakPolarHBondContact O-CD 3.39Å; W162-I168 HydrophobicContact CB-CG1 4.25Å; W162-I168 HydrophobicContact CD2-CD1 4.27Å; W162-I168 HydrophobicContact CD2-CG1 3.69Å; W162-I168 HydrophobicContact CE3-CD1 3.88Å; W162-I168 HydrophobicContact CE3-CG1 3.7Å; W162-I168 HydrophobicContact CG-CG1 3.94Å; W162-I168 HydrophobicContact CZ3-CD1 4.04Å; W162-I168 HydrophobicContact CZ3-CG1 4.35Å
163	N	93	Very high	91.7	Very high	16 Å²	16	40.3 Å²	40.3	9%	0.086	19%	0.191	C	C	.	.			trans	-55.8	121.3	176.7	-177.9	14.5	0	0	0	111.3	S103 W105 R165 G166	S103-N163 WeakPolarHBondContact O-CB 3.48Å; S103-N163 PolarHBondContact O-ND2 2.99Å; W105-N163 HydrophobicContact CD2-CB 3.91Å; W105-N163 HydrophobicContact CE3-CB 4.47Å; W105-N163 HydrophobicContact CG-CB 4.36Å; W105-N163 HydrophobicContact CH2-CB 4.33Å; W105-N163 WeakPolarHBondContact CH2-ND2 3.38Å; W105-N163 HydrophobicContact CZ2-CB 3.73Å; W105-N163 VanDerWaalsContact CZ2-ND2 3.29Å; W105-N163 WeakPolarHBondContact CZ2-ND2 3.2Å; W105-N163 PolarHBondContact O-N 3.3Å; N163-R165 PolarHBondContact O-N 2.78Å; N163-R165 VanDerWaalsContact O-N 3.11Å; N163-R165 PolarHBondContact OD1-N 2.88Å; N163-G166 CarbonylContact O-C 3.49Å; N163-G166 PolarHBondContact O-N 3.16Å
164	P	82.6	Confident	91.9	Very high	123 Å²	123	36.4 Å²	36.4	80%	0.799	18%	0.176	S	C	*	.	T	Hydrogen-bonded Turn	trans	-64.8	-17.7	179.7	26.3	-35.8	0	0	0	113.4	W162	W162-P164 WeakPolarHBondContact O-CD 3.39Å
165	R	86.8	Confident	91.9	Very high	228 Å²	228	37.6 Å²	37.6	86%	0.86	18%	0.18	S	C	*	.	T	Hydrogen-bonded Turn	trans	-92	-0.9	176.6	-57.8	-174.7	-170.4	167.8	3.6	113.8	N163	N163-R165 PolarHBondContact O-N 2.78Å; N163-R165 VanDerWaalsContact O-N 3.11Å; N163-R165 PolarHBondContact OD1-N 2.88Å
166	G	90.8	Very high	91.8	Very high	21 Å²	21	37.6 Å²	37.6	22%	0.216	18%	0.18	C	C	.	.	S	Bend	trans	-140.6	-157.2	-176.7	0	0	0	0	0	112.8	N163	N163-G166 CarbonylContact O-C 3.49Å; N163-G166 PolarHBondContact O-N 3.16Å
167	R	93.6	Very high	91.8	Very high	112 Å²	112	35.9 Å²	35.9	42%	0.423	18%	0.175	S	C	.	.			trans	-114.6	179	179.3	-61.2	-179.1	178.7	-134.2	-0.4	111.3	T71 D104 W105 G169	T71-R167 HydrophobicContact CG2-CB 4.37Å; D104-R167 CarbonylContact C-O 3.54Å; D104-R167 VanDerWaalsContact CA-O 3.25Å; D104-R167 WeakPolarHBondContact CA-O 3.35Å; D104-R167 HydrophobicContact CB-CB 4.31Å; D104-R167 WeakPolarHBondContact CB-O 3.48Å; D104-R167 PolarHBondContact OD1-N 3.01Å; W105-R167 PolarHBondContact N-O 3.18Å; R167-G169 PolarHBondContact O-N 3.44Å
168	I	95.3	Very high	91.6	Very high	0 Å²	0	37.9 Å²	37.9	0%	0	19%	0.192	C	C	.	.			trans	-66.7	120.9	164.6	-65.9	172.3	0	0	0	108.7	W70 T71 P72 S75 Q79 V106 P159 W162	W70-I168 HydrophobicContact CE3-CG2 4.43Å; W70-I168 HydrophobicContact CH2-CG2 4.25Å; W70-I168 HydrophobicContact CZ3-CG2 3.82Å; T71-I168 WeakPolarHBondContact CA-O 3.5Å; T71-I168 WeakPolarHBondContact CB-O 3.39Å; T71-I168 VanDerWaalsContact CG2-O 3.27Å; T71-I168 WeakPolarHBondContact CG2-O 3.31Å; T71-I168 PolarHBondContact OG1-O 2.77Å; T71-I168 VanDerWaalsContact OG1-O 3.06Å; P72-I168 HydrophobicContact CG-CB 3.8Å; P72-I168 HydrophobicContact CG-CD1 4.08Å; P72-I168 HydrophobicContact CG-CG1 4.5Å; P72-I168 HydrophobicContact CG-CG2 3.93Å; S75-I168 PolarHBondContact OG-N 2.89Å; S75-I168 VanDerWaalsContact OG-N 3.15Å; Q79-I168 HydrophobicContact CB-CD1 4.06Å; Q79-I168 HydrophobicContact CG-CD1 4.02Å; V106-I168 HydrophobicContact CG2-CB 4.46Å; V106-I168 HydrophobicContact CG2-CG2 3.82Å; P159-I168 HydrophobicContact CB-CD1 3.88Å; P159-I168 HydrophobicContact CB-CG1 4.2Å; P159-I168 HydrophobicContact CB-CG2 4.26Å; P159-I168 HydrophobicContact CG-CD1 4.15Å; P159-I168 HydrophobicContact CG-CG2 3.74Å; W162-I168 HydrophobicContact CB-CG1 4.25Å; W162-I168 HydrophobicContact CD2-CD1 4.27Å; W162-I168 HydrophobicContact CD2-CG1 3.69Å; W162-I168 HydrophobicContact CE3-CD1 3.88Å; W162-I168 HydrophobicContact CE3-CG1 3.7Å; W162-I168 HydrophobicContact CG-CG1 3.94Å; W162-I168 HydrophobicContact CZ3-CD1 4.04Å; W162-I168 HydrophobicContact CZ3-CG1 4.35Å
169	G	95.6	Very high	91.8	Very high	0 Å²	0	37.8 Å²	37.8	0%	0	19%	0.189	C	C	.	.			trans	-137.1	127.8	171.8	0	0	0	0	0	109.5	W70 D104 W105 R167	W70-G169 WeakPolarHBondContact O-CA 3.48Å; D104-G169 WeakPolarHBondContact O-CA 3.43Å; W105-G169 WeakPolarHBondContact CA-O 3.37Å; R167-G169 PolarHBondContact O-N 3.44Å
170	M	96.1	Very high	91.5	Very high	0 Å²	0	46.3 Å²	46.3	0%	0	23%	0.226	C	C	.	.	B	Isolated β-bridge	trans	-141	139.9	-179	-56.6	-173.9	76.9	0	0	113.7	W70 L81 T96 Q97 V106 F157 P159 I172	W70-M170 HydrophobicContact CE3-CB 4.11Å; W70-M170 HydrophobicContact CE3-CG 4.26Å; W70-M170 HydrophobicContact CE3-SD 4.39Å; W70-M170 HydrophobicContact CZ3-CG 4.34Å; W70-M170 HydrophobicContact CZ3-SD 4.02Å; W70-M170 PolarHBondContact N-O 3.15Å; W70-M170 PolarHBondContact O-N 3.15Å; L81-M170 HydrophobicContact CD2-CB 4.24Å; T96-M170 HydrophobicContact CG2-CE 4.05Å; Q97-M170 CarbonylContact O-C 3.37Å; Q97-M170 WeakPolarHBondContact O-CA 3.35Å; V106-M170 HydrophobicContact CB-CE 4.33Å; V106-M170 HydrophobicContact CB-CG 4.07Å; V106-M170 HydrophobicContact CB-SD 4.22Å; V106-M170 HydrophobicContact CG1-CE 4.43Å; V106-M170 HydrophobicContact CG1-SD 4.49Å; V106-M170 HydrophobicContact CG2-CE 4.45Å; V106-M170 HydrophobicContact CG2-CG 3.44Å; V106-M170 VanDerWaalsContact CG2-CG 3.44Å; V106-M170 HydrophobicContact CG2-SD 3.69Å; F157-M170 HydrophobicContact CB-CE 4.22Å; F157-M170 HydrophobicContact CD1-CE 4.47Å; P159-M170 HydrophobicContact CG-SD 3.8Å; M170-I172 HydrophobicContact CE-CG2 4.32Å
171	R	96.6	Very high	91.6	Very high	3 Å²	3	45.8 Å²	45.8	1%	0.011	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	143.1	159.6	-68.4	175.9	-72.4	174	0.1	108.1	S59 R63 G68 T96 Q97 G98 A138	S59-R171 CarbonylContact O-C 3.54Å; S59-R171 WeakPolarHBondContact O-CA 3.43Å; R63-R171 WeakPolarHBondContact O-CD 3.42Å; R63-R171 PolarHBondContact O-NH1 2.95Å; G68-R171 VanDerWaalsContact O-CD 3.31Å; G68-R171 WeakPolarHBondContact O-CD 3.46Å; G68-R171 PolarHBondContact O-NE 3.3Å; T96-R171 CarbonylContact C-O 3.46Å; T96-R171 WeakPolarHBondContact CA-O 3.41Å; Q97-R171 HydrophobicContact CB-CB 4.14Å; Q97-R171 VanDerWaalsContact CD-CZ 3.45Å; Q97-R171 VanDerWaalsContact CD-NH2 3.33Å; Q97-R171 PolarHBondContact N-O 2.92Å; Q97-R171 PolarHBondContact O-N 3.38Å; G98-R171 PolarHBondContact O-NE 3.41Å; G98-R171 PolarHBondContact O-NH2 3.3Å; A138-R171 PolarHBondContact O-NH2 2.92Å
172	I	96.9	Very high	91.9	Very high	0 Å²	0	46.4 Å²	46.4	0%	0	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.1	153.7	-169.3	63.5	167.9	0	0	0	111.9	S59 L61 L81 A95 T96 F157 M170	S59-I172 WeakPolarHBondContact O-CG1 3.48Å; S59-I172 PolarHBondContact O-N 3.42Å; L61-I172 PolarHBondContact N-O 3.3Å; L81-I172 HydrophobicContact CD2-CD1 3.84Å; L81-I172 HydrophobicContact CD2-CG1 4.1Å; L81-I172 HydrophobicContact CD2-CG2 4Å; L81-I172 HydrophobicContact CG-CD1 4.25Å; A95-I172 CarbonylContact O-C 3.5Å; A95-I172 VanDerWaalsContact O-CA 3.24Å; A95-I172 WeakPolarHBondContact O-CA 3.44Å; T96-I172 HydrophobicContact CG2-CG2 4.28Å; F157-I172 HydrophobicContact CD1-CG2 4.31Å; F157-I172 HydrophobicContact CD2-CD1 3.81Å; F157-I172 HydrophobicContact CD2-CG2 4.48Å; F157-I172 HydrophobicContact CE1-CG2 4.32Å; F157-I172 HydrophobicContact CE2-CD1 3.58Å; F157-I172 HydrophobicContact CG-CG2 4.4Å; F157-I172 HydrophobicContact CZ-CB 4.4Å; F157-I172 HydrophobicContact CZ-CD1 4.28Å; F157-I172 HydrophobicContact CZ-CG2 4.42Å; M170-I172 HydrophobicContact CE-CG2 4.32Å
173	E	96.8	Very high	91.8	Very high	4 Å²	4	44.4 Å²	44.4	2%	0.019	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.6	151.2	164.5	-176.4	56.6	-90	0	0	108.8	P34 L35 A36 S37 L61 V94 A95 Y175	P34-E173 HydrophobicContact CB-CG 4.16Å; L35-E173 PolarHBondContact N-OE1 2.85Å; A36-E173 WeakPolarHBondContact CA-OE1 3.47Å; A36-E173 WeakPolarHBondContact CB-OE1 3.38Å; A36-E173 PolarHBondContact N-OE1 3.37Å; S37-E173 VanDerWaalsContact CB-OE2 3.32Å; S37-E173 WeakPolarHBondContact CB-OE2 3.29Å; S37-E173 PolarHBondContact N-OE2 3.5Å; S37-E173 PolarHBondContact OG-OE2 2.76Å; L61-E173 HydrophobicContact CB-CB 3.79Å; L61-E173 HydrophobicContact CD2-CB 3.73Å; L61-E173 HydrophobicContact CD2-CG 4.48Å; L61-E173 HydrophobicContact CG-CB 4.28Å; V94-E173 WeakPolarHBondContact CA-O 3.44Å; A95-E173 HydrophobicContact CB-CB 4.34Å; A95-E173 PolarHBondContact N-O 2.91Å; A95-E173 PolarHBondContact O-N 3.02Å; E173-Y175 HydrophobicContact CB-CE2 3.97Å; E173-Y175 HydrophobicContact CG-CD2 4.2Å; E173-Y175 HydrophobicContact CG-CE1 4Å; E173-Y175 HydrophobicContact CG-CE2 3.59Å; E173-Y175 VanDerWaalsContact CG-CZ 3.48Å
174	V	97.1	Very high	91.9	Very high	0 Å²	0	43.6 Å²	43.6	0%	0	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	132.9	176.2	-177.4	0	0	0	0	107.1	L35 I83 V91 V94 L155 F157	L35-V174 WeakPolarHBondContact CB-O 3.44Å; L35-V174 HydrophobicContact CD1-CG1 4.33Å; L35-V174 PolarHBondContact N-O 2.82Å; I83-V174 HydrophobicContact CG2-CG2 4.27Å; V91-V174 HydrophobicContact CG1-CG1 3.55Å; V91-V174 HydrophobicContact CG2-CG1 4.23Å; V94-V174 HydrophobicContact CG1-CG2 4.49Å; L155-V174 HydrophobicContact CD2-CG1 3.92Å; L155-V174 HydrophobicContact CD2-CG2 4.2Å; F157-V174 HydrophobicContact CE2-CG2 4.48Å; F157-V174 HydrophobicContact CZ-CG2 4.33Å
175	Y	96.8	Very high	92.4	Very high	48 Å²	48	39.8 Å²	39.8	19%	0.188	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114	144	-179.3	-58.3	-95.3	0	0	0	110.6	D32 S33 P34 T92 A93 A95 H143 E173	D32-Y175 WeakPolarHBondContact O-CD1 3.42Å; S33-Y175 CarbonylContact O-C 3.57Å; S33-Y175 VanDerWaalsContact O-CA 3.29Å; S33-Y175 WeakPolarHBondContact O-CA 3.31Å; P34-Y175 HydrophobicContact CB-CD1 4.24Å; P34-Y175 HydrophobicContact CB-CE1 4.1Å; T92-Y175 PolarHBondContact N-O 3.46Å; T92-Y175 PolarHBondContact OG1-O 3.09Å; A93-Y175 HydrophobicContact CB-CD2 4.07Å; A93-Y175 HydrophobicContact CB-CG 4.39Å; A93-Y175 PolarHBondContact N-O 3.03Å; A93-Y175 PolarHBondContact O-N 3Å; A95-Y175 HydrophobicContact CB-CE2 3.87Å; H143-Y175 AromaticContact CD2-CE2 3.6Å; H143-Y175 AromaticContact NE2-CD2 3.82Å; H143-Y175 AromaticContact NE2-CE2 3.84Å; E173-Y175 HydrophobicContact CB-CE2 3.97Å; E173-Y175 HydrophobicContact CG-CD2 4.2Å; E173-Y175 HydrophobicContact CG-CE1 4Å; E173-Y175 HydrophobicContact CG-CE2 3.59Å; E173-Y175 VanDerWaalsContact CG-CZ 3.48Å
176	G	95.7	Very high	92.7	Very high	0 Å²	0	28.9 Å²	28.9	0%	0	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	167.3	-158.3	-176.7	0	0	0	0	0	113.8	C31 S33 E90	C31-G176 CarbonylContact O-C 3.52Å; C31-G176 VanDerWaalsContact O-CA 3.29Å; C31-G176 WeakPolarHBondContact O-CA 3.32Å; S33-G176 PolarHBondContact N-O 2.55Å; S33-G176 VanDerWaalsContact N-O 3.1Å; S33-G176 PolarHBondContact O-N 3.23Å; E90-G176 CarbonylContact O-C 3.55Å; E90-G176 WeakPolarHBondContact O-CA 3.1Å
177	C	94.2	Very high	92.7	Very high	12 Å²	12	30.5 Å²	30.5	8%	0.081	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.1	169.5	175.7	65.5	0	0	0	0	111.9	C31 M89 E90 Y179	C31-C177 HydrophobicContact CB-CB 4Å; C31-C177 WeakPolarHBondContact CB-SG 3.48Å; C31-C177 WeakPolarHBondContact SG-CB 3.29Å; C31-C177 PolarHBondContact SG-N 3.19Å; C31-C177 CovalentContact SG-SG 2.04Å; C31-C177 PolarHBondContact SG-SG 3.24Å; M89-C177 WeakPolarHBondContact CA-O 3.09Å; E90-C177 PolarHBondContact N-O 3.03Å; E90-C177 PolarHBondContact O-N 3.11Å; E90-C177 VanDerWaalsContact O-N 3.1Å; C177-Y179 PolarHBondContact O-N 3.4Å
178	A	91.4	Very high	92.4	Very high	43 Å²	43	26.2 Å²	26.2	36%	0.355	14%	0.136	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-66	126.2	179.6	0	0	0	0	0	110.8	M89	M89-A178 HydrophobicContact CE-CB 4.16Å; M89-A178 HydrophobicContact SD-CB 4.28Å
179	Y	89.3	Confident	92	Very high	38 Å²	38	34.4 Å²	34.4	15%	0.149	18%	0.175	C	C	.	.			trans	-98.3	111.7	178.7	178.8	-104.7	0	0	0	110	R88 E90 E151 C177 S181 K211 N335	R88-Y179 HydrophobicContact CG-CD1 4.42Å; R88-Y179 PolarHBondContact O-N 2.97Å; E90-Y179 HydrophobicContact CB-CD2 4.44Å; E151-Y179 HydrophobicContact CB-CD1 4.14Å; E151-Y179 HydrophobicContact CB-CE1 4.24Å; E151-Y179 HydrophobicContact CB-CG 4.37Å; E151-Y179 HydrophobicContact CG-CD1 3.93Å; E151-Y179 HydrophobicContact CG-CD2 3.75Å; E151-Y179 HydrophobicContact CG-CE1 3.86Å; E151-Y179 HydrophobicContact CG-CE2 3.71Å; E151-Y179 HydrophobicContact CG-CG 3.86Å; C177-Y179 PolarHBondContact O-N 3.4Å; Y179-S181 VanDerWaalsContact CE1-CB 3.42Å; Y179-K211 PolarHBondContact OH-NZ 2.8Å; Y179-N335 PolarHBondContact OH-ND2 3.35Å
180	K	81.8	Confident	91.8	Very high	180 Å²	180	34.4 Å²	34.4	78%	0.783	18%	0.175	S	C	*	.			trans	-92.9	119.8	174	-68.7	-176.7	-178.9	177.3	0	109.2
181	S	81.1	Confident	91.5	Very high	35 Å²	35	34.7 Å²	34.7	25%	0.245	18%	0.177	C	C	.	.			trans	-133.9	152.1	172.4	64.2	0	0	0	0	112.5	Y179 E334 N335	Y179-S181 VanDerWaalsContact CE1-CB 3.42Å; S181-E334 WeakPolarHBondContact CB-OE1 3.12Å; S181-E334 PolarHBondContact OG-OE1 2.81Å; S181-N335 WeakPolarHBondContact CB-OD1 3.25Å
182	E	85.8	Confident	91.3	Very high	51 Å²	51	34.5 Å²	34.5	24%	0.238	18%	0.176	C	C	.	.			trans	-104.7	127	175.9	-68	-63.4	167.4	0	0	108.7	E334 N335 T344 K348	E182-E334 WeakPolarHBondContact O-CA 3.45Å; E182-N335 PolarHBondContact N-OD1 3.11Å; E182-N335 PolarHBondContact O-N 2.89Å; E182-T344 HydrophobicContact CB-CG2 3.72Å; E182-K348 IonicContact OE1-NZ 3.58Å; E182-K348 PolarHBondContact OE1-NZ 3.34Å; E182-K348 WeakPolarHBondContact OE2-CD 3.42Å; E182-K348 WeakPolarHBondContact OE2-CE 3.28Å; E182-K348 IonicContact OE2-NZ 3.94Å; E182-K348 PolarHBondContact OE2-NZ 2.95Å
183	V	91.6	Very high	91.1	Very high	18 Å²	18	35.6 Å²	35.6	11%	0.109	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	141.7	-172.6	-176	0	0	0	0	109.9	W272 C332 L333 E334 F362 C364	V183-W272 HydrophobicContact CG1-CH2 3.88Å; V183-W272 HydrophobicContact CG1-CZ2 4.35Å; V183-C332 HydrophobicContact CG1-CB 4.12Å; V183-L333 CarbonylContact C-O 3.59Å; V183-L333 WeakPolarHBondContact CA-O 3.18Å; V183-E334 HydrophobicContact CG2-CB 4.12Å; V183-E334 HydrophobicContact CG2-CG 4.28Å; V183-F362 CarbonylContact O-C 3.53Å; V183-F362 WeakPolarHBondContact O-CA 3.43Å; V183-C364 HydrophobicContact CG1-CB 3.87Å
184	V	93.8	Very high	90.8	Very high	0 Å²	0	35.8 Å²	35.8	0%	0	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129	134.6	172.6	56.8	0	0	0	0	109.8	F186 L192 C332 L333 T344 V360 S361	V184-F186 HydrophobicContact CB-CE2 4.39Å; V184-F186 HydrophobicContact CG1-CE2 3.65Å; V184-F186 HydrophobicContact CG1-CZ 3.99Å; V184-F186 HydrophobicContact CG2-CE2 4.01Å; V184-F186 HydrophobicContact CG2-CZ 3.97Å; V184-L192 HydrophobicContact CG1-CD1 4.38Å; V184-L192 HydrophobicContact CG2-CD1 4.15Å; V184-C332 CarbonylContact O-C 3.6Å; V184-C332 VanDerWaalsContact O-CA 3.31Å; V184-C332 WeakPolarHBondContact O-CA 3.14Å; V184-L333 HydrophobicContact CG1-CB 3.93Å; V184-L333 PolarHBondContact N-O 3.21Å; V184-L333 PolarHBondContact O-N 3.36Å; V184-T344 HydrophobicContact CB-CG2 4.22Å; V184-T344 HydrophobicContact CG1-CG2 4.24Å; V184-V360 HydrophobicContact CG2-CG1 3.24Å; V184-S361 WeakPolarHBondContact CA-O 3.43Å
185	Y	94.1	Very high	90.5	Very high	42 Å²	42	38.2 Å²	38.2	17%	0.165	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105	137.5	178.1	167.7	-102.4	0	0	0	111	D187 H330 G331 S361 S363 P365	Y185-D187 HydrophobicContact CE1-CB 3.89Å; Y185-H330 PolarHBondContact OH-NE2 2.88Å; Y185-H330 VanDerWaalsContact OH-NE2 3.12Å; Y185-G331 WeakPolarHBondContact CD2-O 3.31Å; Y185-S361 WeakPolarHBondContact CB-OG 3.43Å; Y185-S361 PolarHBondContact N-O 3Å; Y185-S363 WeakPolarHBondContact CB-O 2.74Å; Y185-P365 VanDerWaalsContact CD2-CD 3.4Å; Y185-P365 HydrophobicContact CD2-CG 3.7Å; Y185-P365 HydrophobicContact CE2-CG 3.51Å; Y185-P365 HydrophobicContact CG-CG 4.27Å
186	F	92.9	Very high	89.9	Confident	0 Å²	0	37 Å²	37	0%	0	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	128.5	175.6	-58.5	-90	0	0	0	110.1	V184 S190 L192 F312 F329 H330 G331 L333	V184-F186 HydrophobicContact CB-CE2 4.39Å; V184-F186 HydrophobicContact CG1-CE2 3.65Å; V184-F186 HydrophobicContact CG1-CZ 3.99Å; V184-F186 HydrophobicContact CG2-CE2 4.01Å; V184-F186 HydrophobicContact CG2-CZ 3.97Å; F186-S190 VanDerWaalsContact CA-OG 3.26Å; F186-S190 WeakPolarHBondContact CA-OG 3.14Å; F186-L192 HydrophobicContact CE1-CB 4.49Å; F186-L192 HydrophobicContact CE1-CG 3.98Å; F186-L192 HydrophobicContact CZ-CD1 4.04Å; F186-L192 HydrophobicContact CZ-CG 4Å; F186-F312 WeakPolarHBondContact CE1-O 3.3Å; F186-F312 HydrophobicContact CZ-CB 4.37Å; F186-F329 HydrophobicContact CB-CD1 4.28Å; F186-F329 VanDerWaalsContact CB-O 3.3Å; F186-F329 WeakPolarHBondContact CB-O 3.43Å; F186-F329 HydrophobicContact CD2-CD1 4.14Å; F186-F329 HydrophobicContact CD2-CE1 4.5Å; F186-F329 HydrophobicContact CG-CD1 4.46Å; F186-H330 WeakPolarHBondContact O-CA 3.32Å; F186-H330 PolarHBondContact O-CD2 3.35Å; F186-G331 PolarHBondContact N-O 3.06Å; F186-G331 PolarHBondContact O-N 2.9Å; F186-L333 HydrophobicContact CD2-CD1 4.3Å; F186-L333 HydrophobicContact CD2-CG 4.07Å; F186-L333 HydrophobicContact CE2-CB 4.09Å; F186-L333 HydrophobicContact CE2-CD1 3.49Å; F186-L333 VanDerWaalsContact CE2-CD1 3.49Å; F186-L333 HydrophobicContact CE2-CG 3.57Å; F186-L333 HydrophobicContact CZ-CD1 4.07Å
187	D	89.7	Confident	88.9	Confident	54 Å²	54	41.8 Å²	41.8	29%	0.289	22%	0.219	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-91	6.6	-177.4	64.8	-2.1	0	0	0	114	Y185 Q189 S190	Y185-D187 HydrophobicContact CE1-CB 3.89Å; D187-Q189 VanDerWaalsContact C-N 3.33Å; D187-Q189 WeakPolarHBondContact OD1-CA 3.26Å; D187-Q189 PolarHBondContact OD1-N 3.03Å; D187-S190 PolarHBondContact N-OG 3.34Å; D187-S190 WeakPolarHBondContact OD1-CB 3.48Å; D187-S190 PolarHBondContact OD1-N 3.35Å; D187-S190 PolarHBondContact OD1-OG 2.85Å
188	G	88.6	Confident	87.4	Confident	22 Å²	22	49.8 Å²	49.8	23%	0.227	25%	0.253	C	S	.	.	S	Bend	trans	82.7	3.4	-172	0	0	0	0	0	114.6	S328 F329	G188-S328 VanDerWaalsContact O-CB 3.27Å; G188-S328 WeakPolarHBondContact O-CB 3.36Å; G188-F329 WeakPolarHBondContact CA-O 3.37Å; G188-F329 PolarHBondContact N-O 2.88Å
189	Q	87.5	Confident	85.8	Confident	173 Å²	173	55.6 Å²	55.6	81%	0.808	27%	0.27	S	S	*	.	S	Bend	trans	-127.5	-23.7	173	-59	-175.9	11	0	0	112.4	D187	D187-Q189 VanDerWaalsContact C-N 3.33Å; D187-Q189 WeakPolarHBondContact OD1-CA 3.26Å; D187-Q189 PolarHBondContact OD1-N 3.03Å
190	S	89.6	Confident	83.8	Confident	0 Å²	0	60 Å²	60	0%	0	30%	0.303	C	S	.	.			trans	-80.1	152.8	175.7	62.9	0	0	0	0	113.3	F186 D187 M357	F186-S190 VanDerWaalsContact CA-OG 3.26Å; F186-S190 WeakPolarHBondContact CA-OG 3.14Å; D187-S190 PolarHBondContact N-OG 3.34Å; D187-S190 WeakPolarHBondContact OD1-CB 3.48Å; D187-S190 PolarHBondContact OD1-N 3.35Å; D187-S190 PolarHBondContact OD1-OG 2.85Å; S190-M357 CarbonylContact C-O 3.59Å; S190-M357 WeakPolarHBondContact CA-O 3.44Å; S190-M357 WeakPolarHBondContact CB-O 3.26Å
191	A	91.4	Very high	82.3	Confident	5 Å²	5	58.5 Å²	58.5	4%	0.041	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150	155.9	173.3	0	0	0	0	0	111.5	F312 M357	A191-F312 CarbonylContact C-O 3.4Å; A191-F312 WeakPolarHBondContact CA-O 3.47Å; A191-M357 PolarHBondContact N-O 2.88Å; A191-M357 PolarHBondContact O-N 2.79Å
192	L	92.5	Very high	81	Confident	0 Å²	0	63.7 Å²	63.7	0%	0	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	131.9	169.5	-67.6	-177.9	0	0	0	109.5	V184 F186 S311 F312 A347 I354 M356 V360	V184-L192 HydrophobicContact CG1-CD1 4.38Å; V184-L192 HydrophobicContact CG2-CD1 4.15Å; F186-L192 HydrophobicContact CE1-CB 4.49Å; F186-L192 HydrophobicContact CE1-CG 3.98Å; F186-L192 HydrophobicContact CZ-CD1 4.04Å; F186-L192 HydrophobicContact CZ-CG 4Å; L192-S311 CarbonylContact O-C 3.46Å; L192-S311 VanDerWaalsContact O-CA 3.28Å; L192-S311 WeakPolarHBondContact O-CA 3.29Å; L192-F312 HydrophobicContact CB-CB 4.36Å; L192-F312 PolarHBondContact N-O 3.08Å; L192-F312 PolarHBondContact O-N 3.42Å; L192-A347 HydrophobicContact CD1-CB 4.08Å; L192-A347 HydrophobicContact CD2-CB 4.21Å; L192-I354 HydrophobicContact CD2-CG2 4.27Å; L192-M356 HydrophobicContact CD2-CB 4.13Å; L192-M356 HydrophobicContact CD2-CG 3.55Å; L192-M356 HydrophobicContact CD2-SD 4.34Å; L192-V360 HydrophobicContact CD2-CG1 4.23Å; L192-V360 HydrophobicContact CD2-CG2 4.13Å
193	L	91.8	Very high	79.4	Confident	23 Å²	23	64.9 Å²	64.9	12%	0.12	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	120.3	171.7	-175.3	70.6	0	0	0	108.9	E309 L316 I354 L355	L193-E309 HydrophobicContact CD1-CB 4.1Å; L193-L316 HydrophobicContact CB-CD1 4.2Å; L193-L316 HydrophobicContact CD1-CD1 4.35Å; L193-L316 HydrophobicContact CD2-CD1 4.46Å; L193-I354 WeakPolarHBondContact O-CA 3.36Å; L193-L355 HydrophobicContact CB-CB 4.25Å; L193-L355 HydrophobicContact CD2-CD2 4.33Å; L193-L355 PolarHBondContact N-O 2.72Å; L193-L355 PolarHBondContact O-N 3.23Å
194	Y	91.3	Very high	77.8	Confident	8 Å²	8	70.2 Å²	70.2	3%	0.031	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	124.6	177	174.2	-129	0	0	0	110.6	L196 E309 I310 Y338 V343 L346 Q353 I354	Y194-L196 HydrophobicContact CD1-CD2 4.38Å; Y194-L196 HydrophobicContact CE1-CD2 3.81Å; Y194-L196 HydrophobicContact CE1-CG 4.33Å; Y194-E309 WeakPolarHBondContact O-CA 3.21Å; Y194-I310 HydrophobicContact CD1-CG2 3.76Å; Y194-I310 HydrophobicContact CG-CG2 4.3Å; Y194-I310 PolarHBondContact N-O 2.94Å; Y194-I310 PolarHBondContact O-N 2.82Å; Y194-Y338 HydrophobicContact CE1-CD1 4.23Å; Y194-V343 HydrophobicContact CD1-CG2 4.13Å; Y194-V343 HydrophobicContact CE1-CG2 4.41Å; Y194-V343 HydrophobicContact CG-CG1 4.42Å; Y194-V343 HydrophobicContact CG-CG2 4.43Å; Y194-L346 HydrophobicContact CD2-CD1 4.41Å; Y194-L346 HydrophobicContact CE2-CD1 3.83Å; Y194-Q353 HydrophobicContact CD2-CB 4.32Å; Y194-Q353 HydrophobicContact CE2-CB 4.06Å; Y194-I354 HydrophobicContact CD2-CD1 3.45Å; Y194-I354 VanDerWaalsContact CD2-CD1 3.45Å; Y194-I354 HydrophobicContact CD2-CG1 4.34Å; Y194-I354 HydrophobicContact CE2-CD1 4.44Å; Y194-I354 HydrophobicContact CG-CD1 3.89Å
195	T	89.6	Confident	76.8	Confident	50 Å²	50	76 Å²	76	31%	0.307	38%	0.382	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.9	119.4	175.8	-51.4	0	0	0	0	110.2	F308 Q353	T195-F308 CarbonylContact C-O 3.56Å; T195-F308 WeakPolarHBondContact CA-O 3.33Å; T195-Q353 PolarHBondContact N-O 2.94Å
196	L	83.6	Confident	76.1	Confident	23 Å²	23	75.1 Å²	75.1	12%	0.12	38%	0.38	C	S	.	.	P	Polyproline II helix	trans	-72.6	143.4	179.9	-64.9	150.6	0	0	0	111	Y194 K198 F308 Y338	Y194-L196 HydrophobicContact CD1-CD2 4.38Å; Y194-L196 HydrophobicContact CE1-CD2 3.81Å; Y194-L196 HydrophobicContact CE1-CG 4.33Å; L196-K198 PolarHBondContact O-N 2.91Å; L196-F308 HydrophobicContact CB-CB 4.2Å; L196-F308 HydrophobicContact CB-CD1 4.4Å; L196-F308 WeakPolarHBondContact CB-O 3.48Å; L196-F308 PolarHBondContact N-O 3.38Å; L196-Y338 HydrophobicContact CD2-CD1 3.66Å; L196-Y338 HydrophobicContact CD2-CE1 3.21Å
197	D	74.4	Confident	76	Confident	100 Å²	100	76.7 Å²	76.7	54%	0.535	39%	0.389	S	S	.	.	P	Polyproline II helix	trans	-64.1	132	176.1	-72.7	-29.6	0	0	0	111.1	K199 Q353	D197-K199 PolarHBondContact O-N 2.63Å; D197-Q353 PolarHBondContact OD1-NE2 3.45Å
198	K	64	Low	76.1	Confident	180 Å²	180	74.4 Å²	74.4	78%	0.783	38%	0.377	S	S	*	.			trans	-72.8	36.9	-176.5	-61.8	-177.4	179	179.5	0	114.5	L196	L196-K198 PolarHBondContact O-N 2.91Å
199	K	57.2	Low	76.4	Confident	166 Å²	166	75 Å²	75	72%	0.722	38%	0.378	S	S	*	.			trans	-75.9	131.5	175.6	-77.2	-174.2	179.5	176.3	0	110.2	D197 L201	D197-K199 PolarHBondContact O-N 2.63Å; K199-L201 PolarHBondContact O-N 3.41Å
200	P	47.5	Very low	76.7	Confident	129 Å²	129	67 Å²	67	84%	0.838	34%	0.34	S	S	*	.	S	Bend	trans	-83.7	60.6	-175.8	35.8	-35.5	0	0	0	111.4
201	L	50.1	Low	77	Confident	149 Å²	149	68.9 Å²	68.9	78%	0.78	35%	0.348	S	S	*	.			trans	-126.5	114.6	159.1	-85.6	106.4	0	0	0	107.5	K199 P203	K199-L201 PolarHBondContact O-N 3.41Å; L201-P203 VanDerWaalsContact O-CD 3.29Å; L201-P203 WeakPolarHBondContact O-CD 3.39Å; L201-P203 VanDerWaalsContact O-N 3.1Å
202	K	53.5	Low	77.2	Confident	145 Å²	145	68.6 Å²	68.6	63%	0.63	35%	0.346	S	S	*	.			trans	-49.4	116.1	164.8	-68.1	-177.5	170.4	-163.4	0	107	I204 S302 N303	K202-I204 PolarHBondContact O-N 2.83Å; K202-S302 PolarHBondContact NZ-O 2.92Å; K202-N303 PolarHBondContact NZ-OD1 3Å
203	P	53.5	Low	77.1	Confident	75 Å²	75	69.5 Å²	69.5	49%	0.487	35%	0.35	S	S	.	.			trans	-62.5	117.9	173.5	21.8	-26.6	0	0	0	107.3	L201 R205	L201-P203 VanDerWaalsContact O-CD 3.29Å; L201-P203 WeakPolarHBondContact O-CD 3.39Å; L201-P203 VanDerWaalsContact O-N 3.1Å; P203-R205 WeakPolarHBondContact CB-O 3.04Å; P203-R205 PolarHBondContact O-N 2.95Å; P203-R205 VanDerWaalsContact O-N 3.15Å
204	I	57.3	Low	77.1	Confident	131 Å²	131	68.4 Å²	68.4	67%	0.672	34%	0.344	S	S	*	.	S	Bend	trans	-60.7	-16.7	170.5	-62.7	164.3	0	0	0	109.9	K202	K202-I204 PolarHBondContact O-N 2.83Å
205	R	72.6	Confident	76.9	Confident	121 Å²	121	70.1 Å²	70.1	46%	0.457	35%	0.354	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.1	125	-177.9	-172.8	-178.1	-172.8	177.4	-2.7	111.4	P203 V207 E278 L279 L280	P203-R205 WeakPolarHBondContact CB-O 3.04Å; P203-R205 PolarHBondContact O-N 2.95Å; P203-R205 VanDerWaalsContact O-N 3.15Å; R205-V207 HydrophobicContact CG-CG2 3.75Å; R205-E278 IonicContact CZ-OE1 3.97Å; R205-E278 IonicContact NH2-OE1 2.8Å; R205-E278 PolarHBondContact NH2-OE1 3.27Å; R205-L279 CarbonylContact C-O 3.41Å; R205-L279 VanDerWaalsContact CA-O 3.24Å; R205-L279 WeakPolarHBondContact CA-O 3.29Å; R205-L280 HydrophobicContact CB-CD2 3.84Å; R205-L280 HydrophobicContact CB-CG 4.49Å; R205-L280 HydrophobicContact CG-CD2 3.6Å; R205-L280 HydrophobicContact CG-CG 3.92Å
206	D	80.4	Confident	76.7	Confident	23 Å²	23	71.8 Å²	71.8	12%	0.123	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	124.8	165.4	-90	-25.5	0	0	0	109.1	R224 E278 L279 Y338 N339	D206-R224 IonicContact OD2-NH1 3.28Å; D206-R224 PolarHBondContact OD2-NH1 2.86Å; D206-E278 WeakPolarHBondContact O-CA 3.28Å; D206-L279 HydrophobicContact CB-CB 4.11Å; D206-L279 HydrophobicContact CB-CD1 3.98Å; D206-L279 PolarHBondContact N-O 2.82Å; D206-L279 PolarHBondContact O-N 2.82Å; D206-Y338 PolarHBondContact OD1-OH 3.08Å; D206-Y338 PolarHBondContact OD2-OH 3.46Å; D206-N339 WeakPolarHBondContact CA-OD1 3.15Å; D206-N339 PolarHBondContact OD1-ND2 3.36Å
207	V	89.2	Confident	76.7	Confident	33 Å²	33	71.6 Å²	71.6	20%	0.2	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	118.9	177.8	-174.8	0	0	0	0	109.1	R205 L276 I277 E278 N339	R205-V207 HydrophobicContact CG-CG2 3.75Å; V207-L276 HydrophobicContact CG1-CD1 3.79Å; V207-I277 WeakPolarHBondContact CA-O 3.44Å; V207-E278 HydrophobicContact CG1-CG 4.48Å; V207-N339 PolarHBondContact N-OD1 2.9Å; V207-N339 PolarHBondContact O-N 2.88Å; V207-N339 PolarHBondContact O-OD1 2.71Å
208	I	91.9	Very high	77.3	Confident	6 Å²	6	69 Å²	69	3%	0.031	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	121.4	175.2	-50.5	176.3	0	0	0	107.5	L222 L276 I277 I310 Y338	I208-L222 HydrophobicContact CD1-CD2 4.24Å; I208-L222 HydrophobicContact CG2-CD2 4.03Å; I208-L276 WeakPolarHBondContact O-CA 3.33Å; I208-I277 HydrophobicContact CB-CB 4.34Å; I208-I277 PolarHBondContact N-O 3.03Å; I208-I277 PolarHBondContact O-N 2.85Å; I208-I310 HydrophobicContact CD1-CD1 4.33Å; I208-Y338 HydrophobicContact CD1-CD2 4.26Å; I208-Y338 HydrophobicContact CD1-CE2 4.14Å; I208-Y338 HydrophobicContact CG1-CD2 3.83Å; I208-Y338 HydrophobicContact CG1-CE2 3.98Å
209	S	94.7	Very high	78.6	Confident	35 Å²	35	60.5 Å²	60.5	25%	0.245	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.4	133.6	174.6	66.5	0	0	0	0	110.8	V275 Y337	S209-V275 VanDerWaalsContact CA-O 3.3Å; S209-V275 WeakPolarHBondContact CA-O 3.3Å; S209-Y337 PolarHBondContact N-O 2.86Å; S209-Y337 PolarHBondContact O-N 3.09Å; S209-Y337 WeakPolarHBondContact OG-CB 3.02Å
210	L	95.3	Very high	80.3	Confident	5 Å²	5	52.7 Å²	52.7	3%	0.026	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.6	156.6	177.3	59.4	85.4	0	0	0	110.2	F212 L221 V275 L333 L336	L210-F212 HydrophobicContact CD1-CB 4.05Å; L210-F212 HydrophobicContact CD1-CD1 4.2Å; L210-L221 HydrophobicContact CD1-CD2 4.34Å; L210-V275 HydrophobicContact CD1-CB 3.93Å; L210-V275 HydrophobicContact CD1-CG2 4.03Å; L210-V275 HydrophobicContact CG-CB 4.22Å; L210-V275 PolarHBondContact N-O 2.86Å; L210-V275 PolarHBondContact O-N 3.45Å; L210-L333 HydrophobicContact CD1-CD2 4.28Å; L210-L336 HydrophobicContact CB-CD1 3.75Å; L210-L336 HydrophobicContact CD2-CD1 3.67Å; L210-L336 HydrophobicContact CG-CD1 4.35Å
211	K	94.9	Very high	82.5	Confident	39 Å²	39	46.6 Å²	46.6	17%	0.17	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	140.2	159.9	-71.5	178.6	178.9	179.6	0	108.3	E151 Y179 W272 H273 L333 E334	E151-K211 IonicContact OE1-NZ 3.99Å; E151-K211 PolarHBondContact OE1-NZ 2.8Å; E151-K211 IonicContact OE2-NZ 2.86Å; E151-K211 PolarHBondContact OE2-NZ 3.17Å; Y179-K211 PolarHBondContact OH-NZ 2.8Å; K211-W272 HydrophobicContact CB-CE3 4.01Å; K211-H273 CarbonylContact C-O 3.51Å; K211-H273 WeakPolarHBondContact CA-O 3.35Å; K211-L333 CarbonylContact O-C 3.55Å; K211-L333 WeakPolarHBondContact O-CA 3.46Å; K211-E334 HydrophobicContact CB-CB 4.01Å; K211-E334 HydrophobicContact CB-CG 4.31Å; K211-E334 WeakPolarHBondContact CD-OE2 3.31Å; K211-E334 PolarHBondContact N-O 3.47Å; K211-E334 PolarHBondContact O-N 2.84Å
212	F	95.2	Very high	84.5	Confident	0 Å²	0	39.5 Å²	39.5	0%	0	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	151.5	174.3	78.7	-85.2	0	0	0	111.9	L210 A214 L221 L236 L241 L267 W272 H273 V275 F329 C332 L333	L210-F212 HydrophobicContact CD1-CB 4.05Å; L210-F212 HydrophobicContact CD1-CD1 4.2Å; F212-A214 HydrophobicContact CD2-CB 4.16Å; F212-A214 HydrophobicContact CE2-CB 4.1Å; F212-L221 HydrophobicContact CB-CD2 3.9Å; F212-L221 HydrophobicContact CD1-CD2 3.79Å; F212-L221 HydrophobicContact CD2-CD2 4.09Å; F212-L221 HydrophobicContact CE1-CD2 4.3Å; F212-L221 HydrophobicContact CG-CD2 3.65Å; F212-L236 HydrophobicContact CE2-CD1 4.34Å; F212-L236 HydrophobicContact CZ-CD1 4.45Å; F212-L241 HydrophobicContact CE1-CD1 4.4Å; F212-L241 HydrophobicContact CE1-CD2 4.14Å; F212-L241 HydrophobicContact CZ-CD1 4.31Å; F212-L267 HydrophobicContact CE2-CB 4.19Å; F212-L267 HydrophobicContact CZ-CB 3.84Å; F212-L267 HydrophobicContact CZ-CD1 4Å; F212-L267 HydrophobicContact CZ-CG 4.46Å; F212-W272 CarbonylContact O-C 3.58Å; F212-W272 WeakPolarHBondContact O-CA 3.25Å; F212-H273 HydrophobicContact CD1-CB 4.07Å; F212-H273 HydrophobicContact CE1-CB 3.65Å; F212-H273 HydrophobicContact CZ-CB 3.93Å; F212-H273 PolarHBondContact N-O 3.05Å; F212-H273 PolarHBondContact O-N 3.15Å; F212-V275 HydrophobicContact CD1-CG2 3.65Å; F212-V275 HydrophobicContact CE1-CG2 3.6Å; F212-F329 HydrophobicContact CB-CZ 4.19Å; F212-F329 HydrophobicContact CD2-CE2 4.22Å; F212-F329 HydrophobicContact CD2-CZ 4.14Å; F212-C332 CarbonylContact C-O 3.6Å; F212-C332 VanDerWaalsContact CA-O 3.29Å; F212-C332 WeakPolarHBondContact CA-O 3.48Å; F212-L333 HydrophobicContact CB-CD2 3.46Å; F212-L333 VanDerWaalsContact CB-CD2 3.46Å
213	K	92.1	Very high	86.3	Confident	18 Å²	18	33.4 Å²	33.4	8%	0.078	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	109.6	171.5	172.7	169	168.5	147	0	108.3	M215 Q270 H271 W272 G331 C332	K213-M215 HydrophobicContact CG-CE 4.43Å; K213-Q270 WeakPolarHBondContact CD-O 3.29Å; K213-Q270 WeakPolarHBondContact CE-O 3.32Å; K213-Q270 PolarHBondContact NZ-O 3.11Å; K213-H271 WeakPolarHBondContact CA-O 3.31Å; K213-W272 HydrophobicContact CB-CD2 3.87Å; K213-W272 HydrophobicContact CB-CE3 3.69Å; K213-W272 HydrophobicContact CB-CH2 4.24Å; K213-W272 HydrophobicContact CB-CZ2 4.39Å; K213-W272 HydrophobicContact CB-CZ3 3.88Å; K213-W272 HydrophobicContact CD-CD2 4.46Å; K213-W272 HydrophobicContact CD-CZ2 4.5Å; K213-G331 CarbonylContact O-C 3.58Å; K213-G331 WeakPolarHBondContact O-CA 3.34Å; K213-C332 HydrophobicContact CB-CB 4.44Å; K213-C332 PolarHBondContact N-O 2.93Å; K213-C332 PolarHBondContact O-N 2.73Å
214	A	90.7	Very high	87.8	Confident	0 Å²	0	31 Å²	31	0%	0	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.8	135.5	-174.7	0	0	0	0	0	111.9	F212 L236 F329	F212-A214 HydrophobicContact CD2-CB 4.16Å; F212-A214 HydrophobicContact CE2-CB 4.1Å; A214-L236 HydrophobicContact CB-CD2 3.5Å; A214-L236 VanDerWaalsContact CB-CD2 3.5Å; A214-F329 HydrophobicContact CB-CE2 3.98Å; A214-F329 HydrophobicContact CB-CZ 4.43Å
215	M	86.6	Confident	89	Confident	45 Å²	45	29.2 Å²	29.2	22%	0.222	14%	0.141	C	C	.	.	S	Bend	trans	-99	-12.7	171.7	-60	-62.2	178.2	0	0	112.1	K213 Q270 H330 P367	K213-M215 HydrophobicContact CG-CE 4.43Å; M215-Q270 HydrophobicContact SD-CG 4.29Å; M215-H330 PolarHBondContact N-O 2.78Å; M215-P367 HydrophobicContact SD-CB 4.46Å
216	Q	85.4	Confident	89	Confident	85 Å²	85	23.7 Å²	23.7	40%	0.397	12%	0.121	S	C	.	.	S	Bend	trans	-131.8	155.7	175.8	-67.6	-173.4	-3	0	0	110.6	N218 L236 H330	Q216-N218 VanDerWaalsContact C-N 3.26Å; Q216-N218 PolarHBondContact O-N 3.47Å; Q216-L236 VanDerWaalsContact O-CD2 3.26Å; Q216-L236 WeakPolarHBondContact O-CD2 3.39Å; Q216-H330 HydrophobicContact CB-CB 4.46Å; Q216-H330 HydrophobicContact CG-CB 4.04Å; Q216-H330 PolarHBondContact NE2-ND1 2.92Å; Q216-H330 VanDerWaalsContact NE2-ND1 3.16Å
217	S	83.8	Confident	88.2	Confident	19 Å²	19	29.8 Å²	29.8	13%	0.133	15%	0.149	C	C	.	.	S	Bend	trans	-78.4	-6.3	-178.4	62.1	0	0	0	0	114.3	I237 K238 G239 D268	S217-I237 CarbonylContact O-C 3.59Å; S217-K238 WeakPolarHBondContact O-CA 3.41Å; S217-K238 PolarHBondContact O-N 3.45Å; S217-G239 PolarHBondContact O-N 3.44Å; S217-D268 WeakPolarHBondContact CB-OD2 3.47Å
218	N	87.6	Confident	86.9	Confident	45 Å²	45	33.9 Å²	33.9	24%	0.241	17%	0.166	C	C	.	.			trans	-137	142.1	178.9	-58.2	-79	0	0	0	111.3	Q216 L236 I237 K238	Q216-N218 VanDerWaalsContact C-N 3.26Å; Q216-N218 PolarHBondContact O-N 3.47Å; N218-L236 CarbonylContact C-O 3.54Å; N218-L236 WeakPolarHBondContact CA-O 3.42Å; N218-I237 WeakPolarHBondContact OD1-CA 3.11Å; N218-K238 PolarHBondContact OD1-N 2.82Å
219	G	91.3	Very high	85.6	Confident	1 Å²	1	35 Å²	35	1%	0.01	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	163.5	149.3	173.9	0	0	0	0	0	114.2	L221 L236 K327	G219-L221 WeakPolarHBondContact O-CD1 3.17Å; G219-L236 PolarHBondContact N-O 2.82Å; G219-L236 PolarHBondContact O-N 2.85Å; G219-K327 WeakPolarHBondContact CA-O 3.44Å
220	I	92.6	Very high	84.5	Confident	3 Å²	3	33.7 Å²	33.7	2%	0.015	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.5	116.2	178.6	-61.2	175.3	0	0	0	111	H223 T233 E235 G313 G314 I315 R326 K327 F329	I220-H223 HydrophobicContact CG2-CB 4.14Å; I220-T233 HydrophobicContact CG2-CG2 4.13Å; I220-E235 HydrophobicContact CG1-CG 3.99Å; I220-G313 CarbonylContact O-C 3.52Å; I220-G313 VanDerWaalsContact O-C 3.27Å; I220-G314 PolarHBondContact O-N 3.2Å; I220-I315 HydrophobicContact CD1-CD1 3.42Å; I220-I315 VanDerWaalsContact CD1-CD1 3.42Å; I220-I315 HydrophobicContact CD1-CG1 3.57Å; I220-I315 HydrophobicContact CG2-CG1 4.21Å; I220-R326 HydrophobicContact CD1-CB 3.76Å; I220-R326 HydrophobicContact CG1-CB 4.42Å; I220-K327 PolarHBondContact N-O 2.92Å; I220-F329 WeakPolarHBondContact O-CB 3.49Å
221	L	94	Very high	83.8	Confident	0 Å²	0	35.6 Å²	35.6	0%	0	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.7	-46.1	179.2	-81.8	73	0	0	0	111.4	L210 F212 G219 L234 L236 L241 F312 G313 F329 L333	L210-L221 HydrophobicContact CD1-CD2 4.34Å; F212-L221 HydrophobicContact CB-CD2 3.9Å; F212-L221 HydrophobicContact CD1-CD2 3.79Å; F212-L221 HydrophobicContact CD2-CD2 4.09Å; F212-L221 HydrophobicContact CE1-CD2 4.3Å; F212-L221 HydrophobicContact CG-CD2 3.65Å; G219-L221 WeakPolarHBondContact O-CD1 3.17Å; L221-L234 HydrophobicContact CB-CB 4.45Å; L221-L234 HydrophobicContact CB-CD2 4.14Å; L221-L234 HydrophobicContact CB-CG 4.41Å; L221-L234 HydrophobicContact CD2-CD2 4.15Å; L221-L234 PolarHBondContact N-O 3.04Å; L221-L236 HydrophobicContact CD1-CB 3.87Å; L221-L241 HydrophobicContact CD1-CD1 4.2Å; L221-L241 HydrophobicContact CD2-CD1 4.06Å; L221-F312 VanDerWaalsContact O-CA 3.31Å; L221-F312 WeakPolarHBondContact O-CA 3.39Å; L221-G313 PolarHBondContact O-N 2.63Å; L221-F329 HydrophobicContact CD1-CD2 3.53Å; L221-F329 HydrophobicContact CD1-CE2 3.78Å; L221-F329 HydrophobicContact CD1-CG 4.24Å; L221-F329 HydrophobicContact CG-CD2 3.94Å; L221-F329 HydrophobicContact CG-CE2 4.03Å; L221-F329 HydrophobicContact CG-CG 4.29Å; L221-F329 HydrophobicContact CG-CZ 4.45Å; L221-L333 HydrophobicContact CD2-CD2 4.45Å
222	L	93	Very high	83.4	Confident	0 Å²	0	34 Å²	34	0%	0	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.3	150.3	175.2	75.5	90	0	0	0	111.6	I208 I232 T233 L234 I277 I310 S311 F312	I208-L222 HydrophobicContact CD1-CD2 4.24Å; I208-L222 HydrophobicContact CG2-CD2 4.03Å; L222-I232 HydrophobicContact CD1-CG2 4.11Å; L222-T233 WeakPolarHBondContact O-CA 3.4Å; L222-L234 HydrophobicContact CD1-CB 4.33Å; L222-L234 HydrophobicContact CD2-CB 3.87Å; L222-L234 HydrophobicContact CD2-CD2 3.95Å; L222-L234 HydrophobicContact CG-CB 3.59Å; L222-L234 PolarHBondContact N-O 2.03Å; L222-L234 PolarHBondContact O-N 3.25Å; L222-I277 HydrophobicContact CD2-CD1 4.36Å; L222-I310 HydrophobicContact CD1-CD1 4.4Å; L222-S311 CarbonylContact C-O 3.55Å; L222-S311 VanDerWaalsContact CA-O 3.25Å; L222-S311 WeakPolarHBondContact CA-O 3.44Å; L222-F312 HydrophobicContact CB-CD1 3.65Å; L222-F312 HydrophobicContact CB-CE1 3.79Å; L222-F312 HydrophobicContact CD2-CE1 4.43Å
223	H	90.5	Very high	83.1	Confident	17 Å²	17	34.1 Å²	34.1	8%	0.079	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.6	136	173.5	179.5	70.2	0	0	0	111.6	I220 I232 T233 S311 I315	I220-H223 HydrophobicContact CG2-CB 4.14Å; H223-I232 CarbonylContact C-O 3.06Å; H223-I232 WeakPolarHBondContact CA-O 3.47Å; H223-T233 PolarHBondContact ND1-OG1 2.94Å; H223-S311 PolarHBondContact N-O 3.04Å; H223-S311 PolarHBondContact O-N 2.85Å; H223-S311 PolarHBondContact O-OG 3.46Å; H223-I315 HydrophobicContact CB-CD1 4.18Å; H223-I315 HydrophobicContact CB-CG1 3.67Å
224	R	85.9	Confident	83.1	Confident	24 Å²	24	33.3 Å²	33.3	9%	0.091	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.4	123.6	174.7	-177.2	169.8	-179.5	-150.2	-5.3	108.9	D206 H231 I232 L306 N307 E309 I310 Y338	D206-R224 IonicContact OD2-NH1 3.28Å; D206-R224 PolarHBondContact OD2-NH1 2.86Å; R224-H231 CarbonylContact O-C 3.45Å; R224-H231 WeakPolarHBondContact O-CA 3.06Å; R224-H231 WeakPolarHBondContact O-CB 3.12Å; R224-I232 PolarHBondContact N-O 3.09Å; R224-I232 PolarHBondContact O-N 2.81Å; R224-L306 HydrophobicContact CG-CB 4.14Å; R224-L306 HydrophobicContact CG-CD1 4.34Å; R224-L306 HydrophobicContact CG-CD2 4.36Å; R224-L306 VanDerWaalsContact CZ-CB 3.48Å; R224-L306 PolarHBondContact NH2-O 3.37Å; R224-N307 PolarHBondContact NE-O 2.85Å; R224-N307 PolarHBondContact NH2-O 2.83Å; R224-E309 WeakPolarHBondContact CG-O 3.34Å; R224-I310 HydrophobicContact CB-CB 4.41Å; R224-I310 HydrophobicContact CB-CD1 4.46Å; R224-I310 HydrophobicContact CB-CG1 4.17Å; R224-Y338 PolarHBondContact NH1-OH 2.73Å
225	E	81.3	Confident	83.2	Confident	94 Å²	94	34 Å²	34	44%	0.439	17%	0.172	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	148.4	179.2	-171.3	173.1	-166.7	0	0	110.8	N230 N307	E225-N230 CarbonylContact C-O 3.54Å; E225-N307 WeakPolarHBondContact O-CB 3.34Å; E225-N307 PolarHBondContact O-N 2.88Å; E225-N307 PolarHBondContact O-ND2 2.8Å; E225-N307 VanDerWaalsContact O-ND2 3.11Å
226	G	72.4	Confident	83.4	Confident	5 Å²	5	31.9 Å²	31.9	5%	0.052	16%	0.161	C	C	.	.			trans	-113.3	168.8	178.3	0	0	0	0	0	113.8	H228 G229 N230 D305	G226-H228 PolarHBondContact O-N 2.82Å; G226-H228 VanDerWaalsContact O-N 3.16Å; G226-G229 PolarHBondContact O-N 3.25Å; G226-N230 PolarHBondContact N-O 2.89Å; G226-D305 WeakPolarHBondContact CA-O 3.47Å
227	Q	63	Low	83.5	Confident	151 Å²	151	30.4 Å²	30.4	71%	0.706	16%	0.156	S	C	*	.	T	Hydrogen-bonded Turn	trans	-64.8	-22.4	-174.2	-57.8	-168.6	-4.8	0	0	114.1	N307	Q227-N307 VanDerWaalsContact CG-OD1 3.25Å; Q227-N307 WeakPolarHBondContact CG-OD1 3.4Å; Q227-N307 PolarHBondContact N-OD1 2.79Å
228	H	62.1	Low	83.3	Confident	119 Å²	119	35.2 Å²	35.2	55%	0.551	17%	0.174	S	C	*	.	T	Hydrogen-bonded Turn	trans	-110	18.3	-175.2	-61.5	97.7	0	0	0	114	G226 N230 D305	G226-H228 PolarHBondContact O-N 2.82Å; G226-H228 VanDerWaalsContact O-N 3.16Å; H228-N230 VanDerWaalsContact C-N 3.3Å; H228-D305 IonicContact CE1-OD2 3.45Å; H228-D305 PolarHBondContact CE1-OD2 2.95Å; H228-D305 VanDerWaalsContact CE1-OD2 3.3Å; H228-D305 IonicContact ND1-OD2 3.74Å; H228-D305 PolarHBondContact ND1-OD2 2.77Å
229	G	65.3	Low	82.9	Confident	31 Å²	31	33 Å²	33	32%	0.32	16%	0.163	S	C	.	.	S	Bend	trans	82.4	3.9	-179.4	0	0	0	0	0	114.8	G226 H231 N246	G226-G229 PolarHBondContact O-N 3.25Å; G229-H231 PolarHBondContact O-ND1 3.44Å; G229-H231 VanDerWaalsContact O-ND1 3.15Å; G229-N246 PolarHBondContact O-ND2 3.06Å
230	N	72	Confident	82.5	Confident	6 Å²	6	35.8 Å²	35.8	3%	0.032	18%	0.175	C	C	.	.			trans	-62	132.9	167.1	-66.9	-29.8	0	0	0	109.3	E225 G226 H228 N246 S247 G248 L306	E225-N230 CarbonylContact C-O 3.54Å; G226-N230 PolarHBondContact N-O 2.89Å; H228-N230 VanDerWaalsContact C-N 3.3Å; N230-N246 VanDerWaalsContact CA-O 3.28Å; N230-N246 WeakPolarHBondContact CA-O 3.35Å; N230-S247 VanDerWaalsContact OD1-CA 3.27Å; N230-S247 WeakPolarHBondContact OD1-CA 3.46Å; N230-S247 PolarHBondContact OD1-O 3.12Å; N230-G248 PolarHBondContact OD1-N 3.45Å; N230-G248 PolarHBondContact OD1-O 3.37Å; N230-L306 HydrophobicContact CB-CD2 4.11Å
231	H	81.1	Confident	82.3	Confident	45 Å²	45	35.7 Å²	35.7	21%	0.208	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.7	150.9	176.6	61.6	-89.6	0	0	0	112.3	R224 G229 N246	R224-H231 CarbonylContact O-C 3.45Å; R224-H231 WeakPolarHBondContact O-CA 3.06Å; R224-H231 WeakPolarHBondContact O-CB 3.12Å; G229-H231 PolarHBondContact O-ND1 3.44Å; G229-H231 VanDerWaalsContact O-ND1 3.15Å; H231-N246 VanDerWaalsContact CE1-CB 3.43Å; H231-N246 WeakPolarHBondContact CE1-CB 3.35Å; H231-N246 PolarHBondContact CE1-ND2 3.31Å; H231-N246 PolarHBondContact N-O 2.91Å; H231-N246 PolarHBondContact O-N 2.98Å
232	I	85.8	Confident	82	Confident	7 Å²	7	36.1 Å²	36.1	4%	0.036	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	124.5	167.8	-60.4	-177.7	0	0	0	106.8	L222 H223 R224 F243 F244 L245 L279 L304 L306	L222-I232 HydrophobicContact CD1-CG2 4.11Å; H223-I232 CarbonylContact C-O 3.06Å; H223-I232 WeakPolarHBondContact CA-O 3.47Å; R224-I232 PolarHBondContact N-O 3.09Å; R224-I232 PolarHBondContact O-N 2.81Å; I232-F243 HydrophobicContact CG2-CD2 4.43Å; I232-F243 HydrophobicContact CG2-CE2 3.39Å; I232-F243 HydrophobicContact CG2-CZ 3.74Å; I232-F244 WeakPolarHBondContact CA-O 3.21Å; I232-L245 HydrophobicContact CD1-CD1 4.19Å; I232-L245 HydrophobicContact CG1-CD1 3.71Å; I232-L279 HydrophobicContact CD1-CD1 3.99Å; I232-L304 HydrophobicContact CD1-CD2 4.3Å; I232-L304 HydrophobicContact CG1-CD2 4.13Å; I232-L306 HydrophobicContact CD1-CD1 3.45Å; I232-L306 VanDerWaalsContact CD1-CD1 3.45Å; I232-L306 HydrophobicContact CG1-CD1 3.83Å
233	T	88.4	Confident	81.8	Confident	2 Å²	2	36.1 Å²	36.1	1%	0.012	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.4	130.8	176.2	-51	0	0	0	0	109.8	I220 L222 H223 E235 F244	I220-T233 HydrophobicContact CG2-CG2 4.13Å; L222-T233 WeakPolarHBondContact O-CA 3.4Å; H223-T233 PolarHBondContact ND1-OG1 2.94Å; T233-E235 HydrophobicContact CG2-CB 4.46Å; T233-F244 HydrophobicContact CG2-CD2 4.49Å; T233-F244 PolarHBondContact N-O 3.37Å; T233-F244 PolarHBondContact O-N 2.89Å
234	L	92.6	Very high	81.6	Confident	0 Å²	0	36.8 Å²	36.8	0%	0	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	119.5	166.3	-169.2	69	0	0	0	108.4	L221 L222 L241 F243 V275 I277 F286	L221-L234 HydrophobicContact CB-CB 4.45Å; L221-L234 HydrophobicContact CB-CD2 4.14Å; L221-L234 HydrophobicContact CB-CG 4.41Å; L221-L234 HydrophobicContact CD2-CD2 4.15Å; L221-L234 PolarHBondContact N-O 3.04Å; L222-L234 HydrophobicContact CD1-CB 4.33Å; L222-L234 HydrophobicContact CD2-CB 3.87Å; L222-L234 HydrophobicContact CD2-CD2 3.95Å; L222-L234 HydrophobicContact CG-CB 3.59Å; L222-L234 PolarHBondContact N-O 2.03Å; L222-L234 PolarHBondContact O-N 3.25Å; L234-L241 HydrophobicContact CD1-CD1 4.14Å; L234-L241 HydrophobicContact CD1-CD2 3.83Å; L234-L241 HydrophobicContact CD1-CG 3.65Å; L234-L241 HydrophobicContact CD2-CD1 4.32Å; L234-L241 HydrophobicContact CD2-CD2 4.14Å; L234-L241 HydrophobicContact CD2-CG 4.45Å; L234-L241 HydrophobicContact CG-CD1 3.92Å; L234-L241 HydrophobicContact CG-CD2 4.2Å; L234-L241 HydrophobicContact CG-CG 4.01Å; L234-F243 HydrophobicContact CD1-CB 4.18Å; L234-F243 HydrophobicContact CD1-CD2 4.13Å; L234-V275 HydrophobicContact CD2-CG1 4.03Å; L234-I277 HydrophobicContact CD1-CD1 4.24Å; L234-I277 HydrophobicContact CD2-CD1 4.21Å; L234-F286 HydrophobicContact CD1-CE2 3.88Å; L234-F286 HydrophobicContact CD1-CZ 3.81Å
235	E	92.5	Very high	81.3	Confident	15 Å²	15	36 Å²	36	7%	0.07	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	132.3	-174.9	-169.5	175.2	178.8	0	0	110.4	I220 T233 I237 V242 F244 R326	I220-E235 HydrophobicContact CG1-CG 3.99Å; T233-E235 HydrophobicContact CG2-CB 4.46Å; E235-I237 HydrophobicContact CB-CD1 4.43Å; E235-I237 HydrophobicContact CB-CG1 4.21Å; E235-I237 HydrophobicContact CG-CD1 4.11Å; E235-I237 HydrophobicContact CG-CG1 3.67Å; E235-V242 PolarHBondContact N-O 2.98Å; E235-V242 PolarHBondContact O-N 2.9Å; E235-F244 HydrophobicContact CB-CE2 4.1Å; E235-R326 WeakPolarHBondContact OE2-CD 3.39Å; E235-R326 IonicContact OE2-CZ 3.41Å; E235-R326 IonicContact OE2-NE 3.39Å; E235-R326 IonicContact OE2-NH1 2.85Å; E235-R326 PolarHBondContact OE2-NH1 2.95Å
236	L	91.6	Very high	80.9	Confident	0 Å²	0	33.8 Å²	33.8	0%	0	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.3	122.9	165.1	-170.6	70.9	0	0	0	107.8	F212 A214 Q216 N218 G219 L221 K240 L241 L267	F212-L236 HydrophobicContact CE2-CD1 4.34Å; F212-L236 HydrophobicContact CZ-CD1 4.45Å; A214-L236 HydrophobicContact CB-CD2 3.5Å; A214-L236 VanDerWaalsContact CB-CD2 3.5Å; Q216-L236 VanDerWaalsContact O-CD2 3.26Å; Q216-L236 WeakPolarHBondContact O-CD2 3.39Å; N218-L236 CarbonylContact C-O 3.54Å; N218-L236 WeakPolarHBondContact CA-O 3.42Å; G219-L236 PolarHBondContact N-O 2.82Å; G219-L236 PolarHBondContact O-N 2.85Å; L221-L236 HydrophobicContact CD1-CB 3.87Å; L236-K240 CarbonylContact C-O 3.46Å; L236-K240 WeakPolarHBondContact CA-O 3.46Å; L236-L241 HydrophobicContact CB-CD1 4.49Å; L236-L241 HydrophobicContact CD1-CD1 4.36Å; L236-L267 HydrophobicContact CD1-CB 4.05Å; L236-L267 HydrophobicContact CD1-CD1 4.37Å
237	I	86.4	Confident	80.4	Confident	54 Å²	54	36.6 Å²	36.6	28%	0.277	19%	0.187	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	116.3	178.7	-55.8	-177.3	0	0	0	108.5	S217 N218 E235 G239 K240 V242 F244	S217-I237 CarbonylContact O-C 3.59Å; N218-I237 WeakPolarHBondContact OD1-CA 3.11Å; E235-I237 HydrophobicContact CB-CD1 4.43Å; E235-I237 HydrophobicContact CB-CG1 4.21Å; E235-I237 HydrophobicContact CG-CD1 4.11Å; E235-I237 HydrophobicContact CG-CG1 3.67Å; I237-G239 PolarHBondContact O-N 2.79Å; I237-K240 PolarHBondContact N-O 2.91Å; I237-K240 PolarHBondContact O-N 2.85Å; I237-V242 HydrophobicContact CB-CG2 4.06Å; I237-V242 HydrophobicContact CD1-CB 4.16Å; I237-V242 HydrophobicContact CD1-CG2 3.95Å; I237-V242 HydrophobicContact CG1-CB 4.48Å; I237-V242 HydrophobicContact CG1-CG2 4.07Å; I237-F244 HydrophobicContact CD1-CE2 4.11Å; I237-F244 HydrophobicContact CD1-CZ 4Å
238	K	79.3	Confident	80	Confident	120 Å²	120	30.6 Å²	30.6	52%	0.522	17%	0.165	S	C	.	.	T	Hydrogen-bonded Turn	trans	50.4	40.1	-178.7	-61.5	-174.9	173.2	-168	0	113	S217 N218 K240	S217-K238 WeakPolarHBondContact O-CA 3.41Å; S217-K238 PolarHBondContact O-N 3.45Å; N218-K238 PolarHBondContact OD1-N 2.82Å; K238-K240 VanDerWaalsContact C-N 3.3Å; K238-K240 PolarHBondContact O-N 2.89Å
239	G	79.1	Confident	79.2	Confident	0 Å²	0	31.4 Å²	31.4	0%	0	17%	0.174	C	C	.	.	T	Hydrogen-bonded Turn	trans	74.7	12.7	-178.8	0	0	0	0	0	114.9	S217 I237 S265 L266 L267	S217-G239 PolarHBondContact O-N 3.44Å; I237-G239 PolarHBondContact O-N 2.79Å; G239-S265 CarbonylContact O-C 3.57Å; G239-L266 PolarHBondContact O-N 3.39Å; G239-L267 PolarHBondContact O-N 2.95Å
240	K	83.3	Confident	78.1	Confident	59 Å²	59	34.6 Å²	34.6	26%	0.257	20%	0.197	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	145.2	172.5	-54.5	-170.1	177.6	-172.4	0	110.2	L236 I237 K238 T262 G264	L236-K240 CarbonylContact C-O 3.46Å; L236-K240 WeakPolarHBondContact CA-O 3.46Å; I237-K240 PolarHBondContact N-O 2.91Å; I237-K240 PolarHBondContact O-N 2.85Å; K238-K240 VanDerWaalsContact C-N 3.3Å; K238-K240 PolarHBondContact O-N 2.89Å; K240-T262 HydrophobicContact CB-CG2 3.68Å; K240-T262 HydrophobicContact CD-CG2 3.74Å; K240-T262 HydrophobicContact CG-CG2 4.36Å; K240-G264 WeakPolarHBondContact CB-O 3.49Å; K240-G264 WeakPolarHBondContact CG-O 3.33Å
241	L	89.1	Confident	76.7	Confident	0 Å²	0	43.9 Å²	43.9	0%	0	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.1	120.7	179.5	-158.7	66.2	0	0	0	109.6	F212 L221 L234 L236 T262 L263 L267 V275 F286 V288	F212-L241 HydrophobicContact CE1-CD1 4.4Å; F212-L241 HydrophobicContact CE1-CD2 4.14Å; F212-L241 HydrophobicContact CZ-CD1 4.31Å; L221-L241 HydrophobicContact CD1-CD1 4.2Å; L221-L241 HydrophobicContact CD2-CD1 4.06Å; L234-L241 HydrophobicContact CD1-CD1 4.14Å; L234-L241 HydrophobicContact CD1-CD2 3.83Å; L234-L241 HydrophobicContact CD1-CG 3.65Å; L234-L241 HydrophobicContact CD2-CD1 4.32Å; L234-L241 HydrophobicContact CD2-CD2 4.14Å; L234-L241 HydrophobicContact CD2-CG 4.45Å; L234-L241 HydrophobicContact CG-CD1 3.92Å; L234-L241 HydrophobicContact CG-CD2 4.2Å; L234-L241 HydrophobicContact CG-CG 4.01Å; L236-L241 HydrophobicContact CB-CD1 4.49Å; L236-L241 HydrophobicContact CD1-CD1 4.36Å; L241-T262 CarbonylContact O-C 3.58Å; L241-T262 WeakPolarHBondContact O-CA 3.39Å; L241-L263 WeakPolarHBondContact CB-O 3.48Å; L241-L263 PolarHBondContact N-O 3.34Å; L241-L263 PolarHBondContact O-N 3.46Å; L241-L267 HydrophobicContact CB-CD1 3.68Å; L241-V275 HydrophobicContact CD2-CG1 4.19Å; L241-V275 HydrophobicContact CD2-CG2 3.53Å; L241-F286 HydrophobicContact CB-CZ 4.33Å; L241-F286 HydrophobicContact CD2-CE2 4.01Å; L241-F286 HydrophobicContact CD2-CZ 3.76Å; L241-F286 HydrophobicContact CG-CZ 4.03Å; L241-V288 HydrophobicContact CD2-CG2 3.74Å
242	V	87.7	Confident	74.8	Confident	9 Å²	9	48.3 Å²	48.3	6%	0.055	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	120.4	-177.2	-170.1	0	0	0	0	109.4	E235 I237 F244 T260 L261 T262	E235-V242 PolarHBondContact N-O 2.98Å; E235-V242 PolarHBondContact O-N 2.9Å; I237-V242 HydrophobicContact CB-CG2 4.06Å; I237-V242 HydrophobicContact CD1-CB 4.16Å; I237-V242 HydrophobicContact CD1-CG2 3.95Å; I237-V242 HydrophobicContact CG1-CB 4.48Å; I237-V242 HydrophobicContact CG1-CG2 4.07Å; V242-F244 HydrophobicContact CB-CE2 3.91Å; V242-F244 HydrophobicContact CB-CZ 4.16Å; V242-F244 HydrophobicContact CG1-CD1 4.43Å; V242-F244 HydrophobicContact CG1-CD2 4.1Å; V242-F244 HydrophobicContact CG1-CE1 3.88Å; V242-F244 HydrophobicContact CG1-CE2 3.51Å; V242-F244 HydrophobicContact CG1-CZ 3.38Å; V242-T260 HydrophobicContact CG1-CG2 3.58Å; V242-L261 CarbonylContact C-O 3.57Å; V242-L261 VanDerWaalsContact CA-O 3.23Å; V242-L261 WeakPolarHBondContact CA-O 3.3Å; V242-T262 HydrophobicContact CG2-CG2 4.12Å
243	F	88.4	Confident	72.7	Confident	0 Å²	0	53.9 Å²	53.9	0%	0	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.3	120.6	174.1	-176.9	-108.2	0	0	0	109.6	I232 L234 L245 L261 I277 L279 V284 F286 F295	I232-F243 HydrophobicContact CG2-CD2 4.43Å; I232-F243 HydrophobicContact CG2-CE2 3.39Å; I232-F243 HydrophobicContact CG2-CZ 3.74Å; L234-F243 HydrophobicContact CD1-CB 4.18Å; L234-F243 HydrophobicContact CD1-CD2 4.13Å; F243-L245 HydrophobicContact CE1-CB 3.9Å; F243-L245 HydrophobicContact CZ-CB 4.48Å; F243-L261 PolarHBondContact N-O 2.66Å; F243-L261 PolarHBondContact O-N 3.31Å; F243-I277 HydrophobicContact CD2-CD1 4Å; F243-I277 HydrophobicContact CE2-CD1 3.93Å; F243-I277 HydrophobicContact CE2-CG2 4.15Å; F243-I277 HydrophobicContact CZ-CG2 4.18Å; F243-L279 HydrophobicContact CZ-CD2 4.34Å; F243-V284 HydrophobicContact CE1-CG1 4.2Å; F243-F286 HydrophobicContact CB-CD1 4.05Å; F243-F286 HydrophobicContact CB-CE1 3.84Å; F243-F286 HydrophobicContact CB-CZ 4.15Å; F243-F295 HydrophobicContact CD1-CZ 4.32Å; F243-F295 HydrophobicContact CE1-CZ 4.21Å
244	F	85.4	Confident	70.3	Confident	32 Å²	32	57.6 Å²	57.6	14%	0.14	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	123.8	175.8	-60.9	-83.4	0	0	0	109.5	I232 T233 E235 I237 V242 T260	I232-F244 WeakPolarHBondContact CA-O 3.21Å; T233-F244 HydrophobicContact CG2-CD2 4.49Å; T233-F244 PolarHBondContact N-O 3.37Å; T233-F244 PolarHBondContact O-N 2.89Å; E235-F244 HydrophobicContact CB-CE2 4.1Å; I237-F244 HydrophobicContact CD1-CE2 4.11Å; I237-F244 HydrophobicContact CD1-CZ 4Å; V242-F244 HydrophobicContact CB-CE2 3.91Å; V242-F244 HydrophobicContact CB-CZ 4.16Å; V242-F244 HydrophobicContact CG1-CD1 4.43Å; V242-F244 HydrophobicContact CG1-CD2 4.1Å; V242-F244 HydrophobicContact CG1-CE1 3.88Å; V242-F244 HydrophobicContact CG1-CE2 3.51Å; V242-F244 HydrophobicContact CG1-CZ 3.38Å; F244-T260 HydrophobicContact CD1-CG2 3.86Å; F244-T260 HydrophobicContact CE1-CG2 3.5Å; F244-T260 HydrophobicContact CZ-CG2 4.26Å
245	L	81.7	Confident	67.8	Low	8 Å²	8	64.4 Å²	64.4	4%	0.042	37%	0.366	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	116.9	172.4	-179	67.4	0	0	0	109.2	I232 F243 V259 V284 A297 L304	I232-L245 HydrophobicContact CD1-CD1 4.19Å; I232-L245 HydrophobicContact CG1-CD1 3.71Å; F243-L245 HydrophobicContact CE1-CB 3.9Å; F243-L245 HydrophobicContact CZ-CB 4.48Å; L245-V259 HydrophobicContact CB-CB 4.4Å; L245-V259 PolarHBondContact N-O 3.43Å; L245-V259 PolarHBondContact O-N 3.36Å; L245-V259 VanDerWaalsContact O-N 3.14Å; L245-V284 HydrophobicContact CD2-CG2 4.37Å; L245-A297 HydrophobicContact CD2-CB 3.99Å; L245-L304 HydrophobicContact CD1-CD1 4.05Å; L245-L304 HydrophobicContact CD1-CD2 3.71Å
246	N	72.8	Confident	65.8	Low	46 Å²	46	69.1 Å²	69.1	25%	0.246	39%	0.391	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	124	174.3	-171.1	16.2	0	0	0	110.5	G229 N230 H231 G248	G229-N246 PolarHBondContact O-ND2 3.06Å; N230-N246 VanDerWaalsContact CA-O 3.28Å; N230-N246 WeakPolarHBondContact CA-O 3.35Å; H231-N246 VanDerWaalsContact CE1-CB 3.43Å; H231-N246 WeakPolarHBondContact CE1-CB 3.35Å; H231-N246 PolarHBondContact CE1-ND2 3.31Å; H231-N246 PolarHBondContact N-O 2.91Å; H231-N246 PolarHBondContact O-N 2.98Å; N246-G248 PolarHBondContact OD1-N 3.15Å
247	S	60.6	Low	63.8	Low	64 Å²	64	73 Å²	73	45%	0.448	42%	0.423	S	S	.	.			trans	-111.2	25	-179.2	-173	0	0	0	0	112.6	N230	N230-S247 VanDerWaalsContact OD1-CA 3.27Å; N230-S247 WeakPolarHBondContact OD1-CA 3.46Å; N230-S247 PolarHBondContact OD1-O 3.12Å
248	G	54.1	Low	62.5	Low	25 Å²	25	74.5 Å²	74.5	26%	0.258	44%	0.436	S	S	.	.			trans	-45.2	137.6	-167.3	0	0	0	0	0	118.2	N230 N246	N230-G248 PolarHBondContact OD1-N 3.45Å; N230-G248 PolarHBondContact OD1-O 3.37Å; N246-G248 PolarHBondContact OD1-N 3.15Å
249	N	46	Very low	62	Low	137 Å²	137	70.8 Å²	70.8	73%	0.733	42%	0.423	S	S	*	.			trans	-109.1	103.6	159.5	-109.8	-19.6	0	0	0	108.3	K251	N249-K251 VanDerWaalsContact C-N 3.26Å; N249-K251 PolarHBondContact O-N 3.07Å
250	A	42	Very low	61.8	Low	97 Å²	97	74.3 Å²	74.3	80%	0.802	45%	0.445	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.6	13.9	-174.2	0	0	0	0	0	115.4
251	K	42.5	Very low	61.5	Low	201 Å²	201	72.9 Å²	72.9	87%	0.874	44%	0.44	S	S	*	.	T	Hydrogen-bonded Turn	trans	-113.7	2.3	-177	-79.3	-173.9	178.2	177.7	0	115.8	N249	N249-K251 VanDerWaalsContact C-N 3.26Å; N249-K251 PolarHBondContact O-N 3.07Å
252	L	42.1	Very low	61.1	Low	139 Å²	139	75.6 Å²	75.6	73%	0.728	46%	0.456	S	S	*	.	S	Bend	trans	-128.4	156.1	169	-119.2	78.7	0	0	0	108.5	S254	L252-S254 PolarHBondContact O-N 2.67Å
253	P	42	Very low	60.6	Low	124 Å²	124	75.2 Å²	75.2	81%	0.805	45%	0.454	S	S	*	.			trans	-65.9	92.5	167.9	21.2	-14.9	0	0	0	107	T255	P253-T255 PolarHBondContact O-N 3.15Å
254	S	38.3	Very low	59.7	Low	80 Å²	80	75.5 Å²	75.5	56%	0.559	46%	0.457	S	S	*	.			trans	-73.7	114.4	-171.3	45.7	0	0	0	0	110	L252 I256	L252-S254 PolarHBondContact O-N 2.67Å; S254-I256 PolarHBondContact O-N 3.43Å
255	T	39.8	Very low	58.9	Low	143 Å²	143	76 Å²	76	88%	0.877	46%	0.464	S	S	*	.			trans	-76.4	11.9	173.4	37.1	0	0	0	0	113.6	P253	P253-T255 PolarHBondContact O-N 3.15Å
256	I	48.8	Very low	58.6	Low	114 Å²	114	76.8 Å²	76.8	59%	0.585	47%	0.469	S	S	*	.			trans	-113.4	111.6	-171.2	-53.6	177	0	0	0	109.8	S254	S254-I256 PolarHBondContact O-N 3.43Å
257	A	49.6	Very low	59.2	Low	81 Å²	81	74.8 Å²	74.8	67%	0.669	46%	0.458	S	S	*	.	P	Polyproline II helix	trans	-68.9	145.1	177.9	0	0	0	0	0	111.9
258	P	60.7	Low	60.3	Low	85 Å²	85	72.2 Å²	72.2	55%	0.552	44%	0.439	S	S	*	.	P	Polyproline II helix	trans	-60.6	141.2	174.6	24.4	-32.7	0	0	0	111.5	T260	P258-T260 PolarHBondContact O-N 3.03Å
259	V	67.8	Low	61.4	Low	43 Å²	43	72.8 Å²	72.8	26%	0.261	44%	0.436	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.8	117	177.7	-177.6	0	0	0	0	108.4	L245 L261 F295	L245-V259 HydrophobicContact CB-CB 4.4Å; L245-V259 PolarHBondContact N-O 3.43Å; L245-V259 PolarHBondContact O-N 3.36Å; L245-V259 VanDerWaalsContact O-N 3.14Å; V259-L261 HydrophobicContact CG1-CD1 4.02Å; V259-L261 HydrophobicContact CG1-CG 4.16Å; V259-F295 HydrophobicContact CG1-CD2 4.13Å; V259-F295 HydrophobicContact CG1-CE2 3.68Å; V259-F295 HydrophobicContact CG1-CZ 4.3Å
260	T	74.9	Confident	63.2	Low	74 Å²	74	67.6 Å²	67.6	45%	0.454	41%	0.407	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	123.2	176	-56.4	0	0	0	0	108.3	V242 F244 P258	V242-T260 HydrophobicContact CG1-CG2 3.58Å; F244-T260 HydrophobicContact CD1-CG2 3.86Å; F244-T260 HydrophobicContact CE1-CG2 3.5Å; F244-T260 HydrophobicContact CZ-CG2 4.26Å; P258-T260 PolarHBondContact O-N 3.03Å
261	L	77.5	Confident	65.3	Low	29 Å²	29	64.2 Å²	64.2	15%	0.152	38%	0.375	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	136.6	179.6	-71.9	159.5	0	0	0	110	V242 F243 V259 F295	V242-L261 CarbonylContact C-O 3.57Å; V242-L261 VanDerWaalsContact CA-O 3.23Å; V242-L261 WeakPolarHBondContact CA-O 3.3Å; F243-L261 PolarHBondContact N-O 2.66Å; F243-L261 PolarHBondContact O-N 3.31Å; V259-L261 HydrophobicContact CG1-CD1 4.02Å; V259-L261 HydrophobicContact CG1-CG 4.16Å; L261-F295 HydrophobicContact CD1-CD1 3.19Å; L261-F295 HydrophobicContact CD1-CD2 3.93Å; L261-F295 HydrophobicContact CD1-CE1 2.85Å; L261-F295 HydrophobicContact CD1-CE2 3.67Å; L261-F295 HydrophobicContact CD1-CG 3.69Å; L261-F295 HydrophobicContact CD1-CZ 3.11Å; L261-F295 HydrophobicContact CG-CD1 4.48Å; L261-F295 HydrophobicContact CG-CE1 4.33Å
262	T	80.2	Confident	67.5	Low	56 Å²	56	56.2 Å²	56.2	34%	0.344	34%	0.34	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120	123.5	-179.9	-56.8	0	0	0	0	108.5	K240 L241 V242	K240-T262 HydrophobicContact CB-CG2 3.68Å; K240-T262 HydrophobicContact CD-CG2 3.74Å; K240-T262 HydrophobicContact CG-CG2 4.36Å; L241-T262 CarbonylContact O-C 3.58Å; L241-T262 WeakPolarHBondContact O-CA 3.39Å; V242-T262 HydrophobicContact CG2-CG2 4.12Å
263	L	78.1	Confident	69.8	Low	1 Å²	1	50 Å²	50	1%	0.005	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	147	173.5	-81.8	178.7	0	0	0	111.2	L241 F286 V288 H293	L241-L263 WeakPolarHBondContact CB-O 3.48Å; L241-L263 PolarHBondContact N-O 3.34Å; L241-L263 PolarHBondContact O-N 3.46Å; L263-F286 HydrophobicContact CB-CD1 4.19Å; L263-F286 HydrophobicContact CB-CE1 3.69Å; L263-F286 HydrophobicContact CB-CZ 4.26Å; L263-F286 HydrophobicContact CD1-CB 4.26Å; L263-F286 HydrophobicContact CD1-CD1 3.35Å; L263-F286 HydrophobicContact CD1-CE1 3.72Å; L263-F286 HydrophobicContact CD1-CG 3.8Å; L263-F286 HydrophobicContact CD1-CZ 4.45Å; L263-F286 WeakPolarHBondContact CD1-O 3.24Å; L263-F286 HydrophobicContact CG-CD1 3.88Å; L263-F286 HydrophobicContact CG-CE1 3.9Å; L263-V288 HydrophobicContact CB-CB 4.3Å; L263-V288 HydrophobicContact CB-CG2 3.75Å; L263-V288 HydrophobicContact CD1-CG2 4.2Å; L263-H293 HydrophobicContact CD1-CB 3.75Å; L263-H293 HydrophobicContact CD2-CB 4.14Å; L263-H293 HydrophobicContact CG-CB 4.23Å
264	G	68.9	Low	72.2	Confident	6 Å²	6	46.2 Å²	46.2	6%	0.062	28%	0.283	C	S	.	.			trans	75.2	163.8	178.4	0	0	0	0	0	113.5	K240 A810	K240-G264 WeakPolarHBondContact CB-O 3.49Å; K240-G264 WeakPolarHBondContact CG-O 3.33Å; G264-A810 PolarHBondContact N-O 2.89Å
265	S	69.6	Low	74.9	Confident	42 Å²	42	42.6 Å²	42.6	29%	0.294	26%	0.257	S	S	.	.	S	Bend	trans	-149.6	138.8	-176.3	-175.4	0	0	0	0	109.1	G239 L267	G239-S265 CarbonylContact O-C 3.57Å; S265-L267 PolarHBondContact O-N 3.32Å
266	L	75.2	Confident	77.4	Confident	26 Å²	26	38.4 Å²	38.4	14%	0.136	23%	0.229	C	C	.	.			trans	55.8	38.1	-178.2	-48.9	178.8	0	0	0	113.2	G239 D268 D269 V791 K792	G239-L266 PolarHBondContact O-N 3.39Å; L266-D268 WeakPolarHBondContact CA-OD1 2.97Å; L266-D268 PolarHBondContact O-N 3.43Å; L266-D268 VanDerWaalsContact O-N 3.08Å; L266-D269 WeakPolarHBondContact O-CB 3.41Å; L266-D269 PolarHBondContact O-N 2.88Å; L266-V791 HydrophobicContact CD1-CG2 4.06Å; L266-K792 HydrophobicContact CD1-CD 3.9Å; L266-K792 HydrophobicContact CD1-CG 3.45Å; L266-K792 VanDerWaalsContact CD1-CG 3.45Å
267	L	84.4	Confident	79.5	Confident	4 Å²	4	33 Å²	33	2%	0.021	20%	0.202	C	C	.	.	T	Hydrogen-bonded Turn	trans	-71.5	5.4	175.4	-52.1	172.2	0	0	0	112.7	F212 L236 G239 L241 S265 D269 V288	F212-L267 HydrophobicContact CE2-CB 4.19Å; F212-L267 HydrophobicContact CZ-CB 3.84Å; F212-L267 HydrophobicContact CZ-CD1 4Å; F212-L267 HydrophobicContact CZ-CG 4.46Å; L236-L267 HydrophobicContact CD1-CB 4.05Å; L236-L267 HydrophobicContact CD1-CD1 4.37Å; G239-L267 PolarHBondContact O-N 2.95Å; L241-L267 HydrophobicContact CB-CD1 3.68Å; S265-L267 PolarHBondContact O-N 3.32Å; L267-D269 VanDerWaalsContact C-N 3.33Å; L267-V288 HydrophobicContact CD1-CG1 4.19Å; L267-V288 HydrophobicContact CD2-CG1 4.3Å
268	D	84.4	Confident	81.3	Confident	10 Å²	10	30.7 Å²	30.7	5%	0.053	18%	0.177	C	C	.	.	T	Hydrogen-bonded Turn	trans	-97	27	173.8	69.5	-29.4	0	0	0	111.9	S217 L266 Q270 R399 W453	S217-D268 WeakPolarHBondContact CB-OD2 3.47Å; L266-D268 WeakPolarHBondContact CA-OD1 2.97Å; L266-D268 PolarHBondContact O-N 3.43Å; L266-D268 VanDerWaalsContact O-N 3.08Å; D268-Q270 VanDerWaalsContact C-N 3.27Å; D268-Q270 PolarHBondContact O-N 2.82Å; D268-R399 VanDerWaalsContact CG-NH1 3.27Å; D268-R399 IonicContact OD1-CZ 2.67Å; D268-R399 IonicContact OD1-NH1 2.95Å; D268-R399 PolarHBondContact OD1-NH1 2.88Å; D268-R399 IonicContact OD1-NH2 2.66Å; D268-R399 PolarHBondContact OD1-NH2 3.49Å; D268-R399 IonicContact OD2-CZ 2.93Å; D268-R399 IonicContact OD2-NH1 3.71Å; D268-R399 PolarHBondContact OD2-NH1 2.94Å; D268-W453 PolarHBondContact OD2-NE1 3.15Å
269	D	77.6	Confident	82.4	Confident	36 Å²	36	27.6 Å²	27.6	19%	0.193	16%	0.156	C	C	.	.	S	Bend	trans	-86.9	6.8	-177.1	74.8	-7.6	0	0	0	114.1	N119 L266 L267 H271 H273	N119-D269 PolarHBondContact ND2-O 3.32Å; L266-D269 WeakPolarHBondContact O-CB 3.41Å; L266-D269 PolarHBondContact O-N 2.88Å; L267-D269 VanDerWaalsContact C-N 3.33Å; D269-H271 VanDerWaalsContact CG-ND1 3.26Å; D269-H271 PolarHBondContact O-N 2.84Å; D269-H271 PolarHBondContact O-ND1 2.92Å; D269-H271 WeakPolarHBondContact OD1-CB 3.2Å; D269-H271 IonicContact OD1-CG 3.89Å; D269-H271 PolarHBondContact OD1-N 2.76Å; D269-H271 IonicContact OD1-ND1 3.66Å; D269-H271 PolarHBondContact OD1-ND1 2.97Å; D269-H271 IonicContact OD2-CG 3.63Å; D269-H271 IonicContact OD2-ND1 2.8Å; D269-H271 PolarHBondContact OD2-ND1 3.01Å; D269-H273 IonicContact OD1-CE1 2.65Å; D269-H273 IonicContact OD1-NE2 3.17Å; D269-H273 PolarHBondContact OD1-NE2 2.97Å; D269-H273 IonicContact OD2-NE2 2.66Å
270	Q	83.3	Confident	82.9	Confident	28 Å²	28	28.1 Å²	28.1	13%	0.131	16%	0.157	C	C	.	.	S	Bend	trans	59.9	25.8	-176.2	-51.7	170.6	9.8	0	0	114.3	K213 M215 D268 P367 T369	K213-Q270 WeakPolarHBondContact CD-O 3.29Å; K213-Q270 WeakPolarHBondContact CE-O 3.32Å; K213-Q270 PolarHBondContact NZ-O 3.11Å; M215-Q270 HydrophobicContact SD-CG 4.29Å; D268-Q270 VanDerWaalsContact C-N 3.27Å; D268-Q270 PolarHBondContact O-N 2.82Å; Q270-P367 HydrophobicContact CB-CG 4.39Å; Q270-T369 PolarHBondContact OE1-O 3.49Å
271	H	85.1	Confident	82.7	Confident	26 Å²	26	31.4 Å²	31.4	12%	0.12	17%	0.172	C	C	.	.	S	Bend	trans	-100.7	165.7	163.9	-63.1	101.9	0	0	0	111.3	N119 K121 K213 D269 H273	N119-H271 PolarHBondContact ND2-CE1 2.88Å; N119-H271 VanDerWaalsContact ND2-CE1 3.32Å; N119-H271 PolarHBondContact ND2-NE2 2.81Å; N119-H271 PolarHBondContact OD1-CE1 2.86Å; K121-H271 HydrophobicContact CD-CB 4.32Å; K213-H271 WeakPolarHBondContact CA-O 3.31Å; D269-H271 VanDerWaalsContact CG-ND1 3.26Å; D269-H271 PolarHBondContact O-N 2.84Å; D269-H271 PolarHBondContact O-ND1 2.92Å; D269-H271 WeakPolarHBondContact OD1-CB 3.2Å; D269-H271 IonicContact OD1-CG 3.89Å; D269-H271 PolarHBondContact OD1-N 2.76Å; D269-H271 IonicContact OD1-ND1 3.66Å; D269-H271 PolarHBondContact OD1-ND1 2.97Å; D269-H271 IonicContact OD2-CG 3.63Å; D269-H271 IonicContact OD2-ND1 2.8Å; D269-H271 PolarHBondContact OD2-ND1 3.01Å; H271-H273 PolarHBondContact O-CD2 2.82Å
272	W	89.4	Confident	82.2	Confident	34 Å²	34	31.7 Å²	31.7	13%	0.129	18%	0.175	C	C	.	.			trans	-75.3	133	170.2	-68.3	105.7	0	0	0	110.3	R88 D115 V183 K211 F212 K213 C332 E334 C364	R88-W272 VanDerWaalsContact NH2-CD1 3.27Å; D115-W272 PolarHBondContact OD2-NE1 2.91Å; D115-W272 VanDerWaalsContact OD2-NE1 3.09Å; V183-W272 HydrophobicContact CG1-CH2 3.88Å; V183-W272 HydrophobicContact CG1-CZ2 4.35Å; K211-W272 HydrophobicContact CB-CE3 4.01Å; F212-W272 CarbonylContact O-C 3.58Å; F212-W272 WeakPolarHBondContact O-CA 3.25Å; K213-W272 HydrophobicContact CB-CD2 3.87Å; K213-W272 HydrophobicContact CB-CE3 3.69Å; K213-W272 HydrophobicContact CB-CH2 4.24Å; K213-W272 HydrophobicContact CB-CZ2 4.39Å; K213-W272 HydrophobicContact CB-CZ3 3.88Å; K213-W272 HydrophobicContact CD-CD2 4.46Å; K213-W272 HydrophobicContact CD-CZ2 4.5Å; W272-C332 HydrophobicContact CH2-CB 3.48Å; W272-C332 VanDerWaalsContact CH2-CB 3.48Å; W272-C332 HydrophobicContact CZ2-CB 4.24Å; W272-C332 HydrophobicContact CZ3-CB 4.07Å; W272-E334 HydrophobicContact CE3-CB 3.99Å; W272-E334 HydrophobicContact CH2-CB 3.57Å; W272-E334 HydrophobicContact CZ2-CB 4.29Å; W272-E334 HydrophobicContact CZ3-CB 3.41Å; W272-E334 VanDerWaalsContact CZ3-CB 3.41Å; W272-C364 HydrophobicContact CZ2-CB 4.42Å
273	H	90.9	Very high	82	Confident	8 Å²	8	34.5 Å²	34.5	4%	0.037	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	134.1	172.5	-65.6	-76.8	0	0	0	109.8	K211 F212 D269 H271 D289	K211-H273 CarbonylContact C-O 3.51Å; K211-H273 WeakPolarHBondContact CA-O 3.35Å; F212-H273 HydrophobicContact CD1-CB 4.07Å; F212-H273 HydrophobicContact CE1-CB 3.65Å; F212-H273 HydrophobicContact CZ-CB 3.93Å; F212-H273 PolarHBondContact N-O 3.05Å; F212-H273 PolarHBondContact O-N 3.15Å; D269-H273 IonicContact OD1-CE1 2.65Å; D269-H273 IonicContact OD1-NE2 3.17Å; D269-H273 PolarHBondContact OD1-NE2 2.97Å; D269-H273 IonicContact OD2-NE2 2.66Å; H271-H273 PolarHBondContact O-CD2 2.82Å; H273-D289 WeakPolarHBondContact CA-OD1 3.44Å; H273-D289 WeakPolarHBondContact CB-OD1 2.83Å; H273-D289 IonicContact CE1-OD2 3.21Å; H273-D289 IonicContact CG-OD1 3.2Å; H273-D289 IonicContact CG-OD2 3.64Å; H273-D289 IonicContact ND1-OD1 3.74Å; H273-D289 IonicContact ND1-OD2 3.01Å; H273-D289 PolarHBondContact ND1-OD2 2.93Å
274	S	91.8	Very high	82.2	Confident	44 Å²	44	34.6 Å²	34.6	31%	0.308	18%	0.184	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.1	142.9	177	56.2	0	0	0	0	111.3	V288 D289	S274-V288 CarbonylContact O-C 3.58Å; S274-V288 WeakPolarHBondContact O-CA 3.26Å; S274-D289 PolarHBondContact N-OD1 2.8Å; S274-D289 PolarHBondContact O-N 3.41Å; S274-D289 VanDerWaalsContact OG-CA 3.31Å; S274-D289 WeakPolarHBondContact OG-CA 3.47Å; S274-D289 PolarHBondContact OG-O 3.12Å
275	V	94.8	Very high	83.1	Confident	4 Å²	4	35.6 Å²	35.6	2%	0.024	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.5	129.9	175.6	-179	0	0	0	0	108.1	S209 L210 F212 L234 L241 I277 F286 T287	S209-V275 VanDerWaalsContact CA-O 3.3Å; S209-V275 WeakPolarHBondContact CA-O 3.3Å; L210-V275 HydrophobicContact CD1-CB 3.93Å; L210-V275 HydrophobicContact CD1-CG2 4.03Å; L210-V275 HydrophobicContact CG-CB 4.22Å; L210-V275 PolarHBondContact N-O 2.86Å; L210-V275 PolarHBondContact O-N 3.45Å; F212-V275 HydrophobicContact CD1-CG2 3.65Å; F212-V275 HydrophobicContact CE1-CG2 3.6Å; L234-V275 HydrophobicContact CD2-CG1 4.03Å; L241-V275 HydrophobicContact CD2-CG1 4.19Å; L241-V275 HydrophobicContact CD2-CG2 3.53Å; V275-I277 HydrophobicContact CG1-CD1 4.25Å; V275-I277 HydrophobicContact CG1-CG1 4.13Å; V275-F286 HydrophobicContact CG1-CE2 3.97Å; V275-T287 WeakPolarHBondContact CA-O 3.43Å
276	L	93.3	Very high	83.9	Confident	55 Å²	55	33.6 Å²	33.6	29%	0.288	17%	0.174	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	121.2	171.4	171.8	69.1	0	0	0	108.6	V207 I208 E278 T287	V207-L276 HydrophobicContact CG1-CD1 3.79Å; I208-L276 WeakPolarHBondContact O-CA 3.33Å; L276-E278 HydrophobicContact CD1-CG 4.09Å; L276-E278 HydrophobicContact CD2-CG 4.3Å; L276-E278 HydrophobicContact CG-CG 4.01Å; L276-T287 PolarHBondContact N-O 3.33Å; L276-T287 PolarHBondContact O-N 3.08Å
277	I	91.1	Very high	84.5	Confident	0 Å²	0	33.2 Å²	33.2	0%	0	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	119.9	175	-60	162.5	0	0	0	107	V207 I208 L222 L234 F243 V275 L279 N285 F286	V207-I277 WeakPolarHBondContact CA-O 3.44Å; I208-I277 HydrophobicContact CB-CB 4.34Å; I208-I277 PolarHBondContact N-O 3.03Å; I208-I277 PolarHBondContact O-N 2.85Å; L222-I277 HydrophobicContact CD2-CD1 4.36Å; L234-I277 HydrophobicContact CD1-CD1 4.24Å; L234-I277 HydrophobicContact CD2-CD1 4.21Å; F243-I277 HydrophobicContact CD2-CD1 4Å; F243-I277 HydrophobicContact CE2-CD1 3.93Å; F243-I277 HydrophobicContact CE2-CG2 4.15Å; F243-I277 HydrophobicContact CZ-CG2 4.18Å; V275-I277 HydrophobicContact CG1-CD1 4.25Å; V275-I277 HydrophobicContact CG1-CG1 4.13Å; I277-L279 HydrophobicContact CG2-CD1 3.94Å; I277-L279 HydrophobicContact CG2-CG 4.07Å; I277-N285 WeakPolarHBondContact CA-O 3.3Å; I277-F286 HydrophobicContact CD1-CD2 4.47Å; I277-F286 HydrophobicContact CD1-CE2 4.48Å; I277-F286 HydrophobicContact CG1-CD2 3.72Å; I277-F286 HydrophobicContact CG1-CE2 4.14Å
278	E	88.6	Confident	84.7	Confident	33 Å²	33	33.1 Å²	33.1	15%	0.154	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	120	172.9	-46.9	-179.8	100.3	0	0	108.7	R205 D206 V207 L276 V284 N285	R205-E278 IonicContact CZ-OE1 3.97Å; R205-E278 IonicContact NH2-OE1 2.8Å; R205-E278 PolarHBondContact NH2-OE1 3.27Å; D206-E278 WeakPolarHBondContact O-CA 3.28Å; V207-E278 HydrophobicContact CG1-CG 4.48Å; L276-E278 HydrophobicContact CD1-CG 4.09Å; L276-E278 HydrophobicContact CD2-CG 4.3Å; L276-E278 HydrophobicContact CG-CG 4.01Å; E278-V284 CarbonylContact O-C 3.55Å; E278-V284 VanDerWaalsContact O-CA 3.29Å; E278-V284 WeakPolarHBondContact O-CA 3.48Å; E278-N285 HydrophobicContact CB-CB 4.11Å; E278-N285 HydrophobicContact CG-CB 4.42Å; E278-N285 PolarHBondContact N-O 2.91Å; E278-N285 PolarHBondContact O-N 2.94Å; E278-N285 PolarHBondContact OE2-ND2 2.94Å
279	L	83.3	Confident	84.7	Confident	21 Å²	21	35.1 Å²	35.1	11%	0.11	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	113.6	177.2	-65.6	139.7	0	0	0	107.4	R205 D206 I232 F243 I277 V284	R205-L279 CarbonylContact C-O 3.41Å; R205-L279 VanDerWaalsContact CA-O 3.24Å; R205-L279 WeakPolarHBondContact CA-O 3.29Å; D206-L279 HydrophobicContact CB-CB 4.11Å; D206-L279 HydrophobicContact CB-CD1 3.98Å; D206-L279 PolarHBondContact N-O 2.82Å; D206-L279 PolarHBondContact O-N 2.82Å; I232-L279 HydrophobicContact CD1-CD1 3.99Å; F243-L279 HydrophobicContact CZ-CD2 4.34Å; I277-L279 HydrophobicContact CG2-CD1 3.94Å; I277-L279 HydrophobicContact CG2-CG 4.07Å; L279-V284 HydrophobicContact CD2-CB 4.36Å; L279-V284 HydrophobicContact CD2-CG1 3.87Å; L279-V284 HydrophobicContact CD2-CG2 3.66Å; L279-V284 HydrophobicContact CG-CG1 4.3Å
280	L	77.8	Confident	84.6	Confident	54 Å²	54	38.7 Å²	38.7	28%	0.283	20%	0.197	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	100.6	-178.1	-77.7	149.3	0	0	0	108.8	R205 T282 Q283	R205-L280 HydrophobicContact CB-CD2 3.84Å; R205-L280 HydrophobicContact CB-CG 4.49Å; R205-L280 HydrophobicContact CG-CD2 3.6Å; R205-L280 HydrophobicContact CG-CG 3.92Å; L280-T282 PolarHBondContact O-N 2.81Å; L280-Q283 HydrophobicContact CB-CB 4.47Å; L280-Q283 PolarHBondContact N-O 2.88Å; L280-Q283 PolarHBondContact O-N 3.36Å
281	D	70.6	Confident	84.1	Confident	143 Å²	143	41.4 Å²	41.4	77%	0.765	21%	0.21	S	C	*	.	T	Hydrogen-bonded Turn	trans	52.1	-94.1	-173.5	-63	-41.2	0	0	0	114
282	T	68.3	Low	83.8	Confident	35 Å²	35	42.9 Å²	42.9	22%	0.215	22%	0.221	C	C	.	.	T	Hydrogen-bonded Turn	trans	-111.2	-10.2	175.3	59	0	0	0	0	112.9	L280 Q296 A297	L280-T282 PolarHBondContact O-N 2.81Å; T282-Q296 CarbonylContact O-C 3.56Å; T282-Q296 WeakPolarHBondContact O-CA 3.4Å; T282-Q296 PolarHBondContact OG1-NE2 3.29Å; T282-A297 PolarHBondContact O-N 3.4Å
283	Q	76.3	Confident	83.2	Confident	114 Å²	114	44.6 Å²	44.6	53%	0.533	23%	0.23	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.1	134.5	177.8	-68.9	-173.9	-16.3	0	0	110.2	L280	L280-Q283 HydrophobicContact CB-CB 4.47Å; L280-Q283 PolarHBondContact N-O 2.88Å; L280-Q283 PolarHBondContact O-N 3.36Å
284	V	82	Confident	82.8	Confident	3 Å²	3	50 Å²	50	2%	0.018	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.9	123.7	176.8	-173.7	0	0	0	0	108.8	F243 L245 E278 L279 F295	F243-V284 HydrophobicContact CE1-CG1 4.2Å; L245-V284 HydrophobicContact CD2-CG2 4.37Å; E278-V284 CarbonylContact O-C 3.55Å; E278-V284 VanDerWaalsContact O-CA 3.29Å; E278-V284 WeakPolarHBondContact O-CA 3.48Å; L279-V284 HydrophobicContact CD2-CB 4.36Å; L279-V284 HydrophobicContact CD2-CG1 3.87Å; L279-V284 HydrophobicContact CD2-CG2 3.66Å; L279-V284 HydrophobicContact CG-CG1 4.3Å; V284-F295 HydrophobicContact CB-CD1 3.9Å; V284-F295 HydrophobicContact CB-CD2 4.38Å; V284-F295 HydrophobicContact CB-CE1 3.26Å; V284-F295 HydrophobicContact CB-CE2 3.82Å; V284-F295 HydrophobicContact CB-CG 4.43Å; V284-F295 HydrophobicContact CB-CZ 3.25Å; V284-F295 HydrophobicContact CG1-CD1 4.33Å; V284-F295 HydrophobicContact CG1-CE1 3.33Å; V284-F295 HydrophobicContact CG1-CE2 4.43Å; V284-F295 HydrophobicContact CG1-CZ 3.42Å; V284-F295 VanDerWaalsContact CG1-CZ 3.42Å; V284-F295 HydrophobicContact CG2-CE1 4.15Å; V284-F295 HydrophobicContact CG2-CE2 3.8Å; V284-F295 HydrophobicContact CG2-CZ 3.6Å; V284-F295 PolarHBondContact N-O 3.31Å; V284-F295 WeakPolarHBondContact O-CD1 3.26Å; V284-F295 PolarHBondContact O-N 2.81Å
285	N	86.5	Confident	82	Confident	27 Å²	27	49.5 Å²	49.5	14%	0.144	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	113.1	170.8	-58.1	-18.4	0	0	0	107.3	I277 E278 T292 H294	I277-N285 WeakPolarHBondContact CA-O 3.3Å; E278-N285 HydrophobicContact CB-CB 4.11Å; E278-N285 HydrophobicContact CG-CB 4.42Å; E278-N285 PolarHBondContact N-O 2.91Å; E278-N285 PolarHBondContact O-N 2.94Å; E278-N285 PolarHBondContact OE2-ND2 2.94Å; N285-T292 HydrophobicContact CB-CG2 4.25Å; N285-H294 VanDerWaalsContact CG-ND1 3.35Å; N285-H294 PolarHBondContact OD1-ND1 2.8Å
286	F	88.4	Confident	80.9	Confident	0 Å²	0	55.8 Å²	55.8	0%	0	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	112.5	174.9	178	-145.3	0	0	0	108.6	L234 L241 F243 L263 V275 I277 V288 T292 H293	L234-F286 HydrophobicContact CD1-CE2 3.88Å; L234-F286 HydrophobicContact CD1-CZ 3.81Å; L241-F286 HydrophobicContact CB-CZ 4.33Å; L241-F286 HydrophobicContact CD2-CE2 4.01Å; L241-F286 HydrophobicContact CD2-CZ 3.76Å; L241-F286 HydrophobicContact CG-CZ 4.03Å; F243-F286 HydrophobicContact CB-CD1 4.05Å; F243-F286 HydrophobicContact CB-CE1 3.84Å; F243-F286 HydrophobicContact CB-CZ 4.15Å; L263-F286 HydrophobicContact CB-CD1 4.19Å; L263-F286 HydrophobicContact CB-CE1 3.69Å; L263-F286 HydrophobicContact CB-CZ 4.26Å; L263-F286 HydrophobicContact CD1-CB 4.26Å; L263-F286 HydrophobicContact CD1-CD1 3.35Å; L263-F286 HydrophobicContact CD1-CE1 3.72Å; L263-F286 HydrophobicContact CD1-CG 3.8Å; L263-F286 HydrophobicContact CD1-CZ 4.45Å; L263-F286 WeakPolarHBondContact CD1-O 3.24Å; L263-F286 HydrophobicContact CG-CD1 3.88Å; L263-F286 HydrophobicContact CG-CE1 3.9Å; V275-F286 HydrophobicContact CG1-CE2 3.97Å; I277-F286 HydrophobicContact CD1-CD2 4.47Å; I277-F286 HydrophobicContact CD1-CE2 4.48Å; I277-F286 HydrophobicContact CG1-CD2 3.72Å; I277-F286 HydrophobicContact CG1-CE2 4.14Å; F286-V288 HydrophobicContact CD2-CG2 4.41Å; F286-V288 HydrophobicContact CE1-CG2 4.31Å; F286-V288 HydrophobicContact CE2-CG2 3.7Å; F286-V288 HydrophobicContact CZ-CG2 3.63Å; F286-T292 WeakPolarHBondContact O-CA 3.33Å; F286-H293 PolarHBondContact N-O 2.89Å; F286-H293 PolarHBondContact O-N 3.2Å
287	T	86.3	Confident	79.5	Confident	18 Å²	18	54.1 Å²	54.1	11%	0.11	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	129.3	-178.4	-51.2	0	0	0	0	110.3	V275 L276 H291 T292	V275-T287 WeakPolarHBondContact CA-O 3.43Å; L276-T287 PolarHBondContact N-O 3.33Å; L276-T287 PolarHBondContact O-N 3.08Å; T287-H291 CarbonylContact C-O 3.59Å; T287-H291 VanDerWaalsContact CA-O 3.26Å; T287-H291 WeakPolarHBondContact CA-O 3Å; T287-T292 VanDerWaalsContact CG2-OG1 3.28Å; T287-T292 WeakPolarHBondContact CG2-OG1 3.45Å; T287-T292 WeakPolarHBondContact OG1-CB 3.28Å; T287-T292 VanDerWaalsContact OG1-CG2 3.26Å; T287-T292 WeakPolarHBondContact OG1-CG2 3.26Å; T287-T292 PolarHBondContact OG1-OG1 2.88Å
288	V	88.5	Confident	77.9	Confident	3 Å²	3	63 Å²	63	2%	0.018	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	124.2	169.9	-176.6	0	0	0	0	108.9	L241 L263 L267 S274 F286 K290 H291	L241-V288 HydrophobicContact CD2-CG2 3.74Å; L263-V288 HydrophobicContact CB-CB 4.3Å; L263-V288 HydrophobicContact CB-CG2 3.75Å; L263-V288 HydrophobicContact CD1-CG2 4.2Å; L267-V288 HydrophobicContact CD1-CG1 4.19Å; L267-V288 HydrophobicContact CD2-CG1 4.3Å; S274-V288 CarbonylContact O-C 3.58Å; S274-V288 WeakPolarHBondContact O-CA 3.26Å; F286-V288 HydrophobicContact CD2-CG2 4.41Å; F286-V288 HydrophobicContact CE1-CG2 4.31Å; F286-V288 HydrophobicContact CE2-CG2 3.7Å; F286-V288 HydrophobicContact CZ-CG2 3.63Å; V288-K290 PolarHBondContact O-N 3.41Å; V288-H291 PolarHBondContact N-O 2.81Å; V288-H291 PolarHBondContact O-N 2.88Å
289	D	85.1	Confident	76.2	Confident	52 Å²	52	63.3 Å²	63.3	28%	0.278	32%	0.322	S	S	.	.	T	Hydrogen-bonded Turn	trans	53	-100.5	-167.3	-65.4	-28.3	0	0	0	111.4	H273 S274	H273-D289 WeakPolarHBondContact CA-OD1 3.44Å; H273-D289 WeakPolarHBondContact CB-OD1 2.83Å; H273-D289 IonicContact CE1-OD2 3.21Å; H273-D289 IonicContact CG-OD1 3.2Å; H273-D289 IonicContact CG-OD2 3.64Å; H273-D289 IonicContact ND1-OD1 3.74Å; H273-D289 IonicContact ND1-OD2 3.01Å; H273-D289 PolarHBondContact ND1-OD2 2.93Å; S274-D289 PolarHBondContact N-OD1 2.8Å; S274-D289 PolarHBondContact O-N 3.41Å; S274-D289 VanDerWaalsContact OG-CA 3.31Å; S274-D289 WeakPolarHBondContact OG-CA 3.47Å; S274-D289 PolarHBondContact OG-O 3.12Å
290	K	75.9	Confident	74.5	Confident	110 Å²	110	70.4 Å²	70.4	48%	0.478	36%	0.36	S	S	.	.	T	Hydrogen-bonded Turn	trans	-113	-0.2	177.3	-65	-176.8	173.7	-175.3	0	113.9	E126 V288	E126-K290 IonicContact OE1-NZ 3.78Å; E126-K290 PolarHBondContact OE1-NZ 3.03Å; V288-K290 PolarHBondContact O-N 3.41Å
291	H	71.6	Confident	72.9	Confident	86 Å²	86	72.2 Å²	72.2	40%	0.398	38%	0.377	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	113.8	-171.6	-57.4	92.6	0	0	0	109.5	T287 V288 A810	T287-H291 CarbonylContact C-O 3.59Å; T287-H291 VanDerWaalsContact CA-O 3.26Å; T287-H291 WeakPolarHBondContact CA-O 3Å; V288-H291 PolarHBondContact N-O 2.81Å; V288-H291 PolarHBondContact O-N 2.88Å; H291-A810 HydrophobicContact CB-CB 3.41Å; H291-A810 VanDerWaalsContact CB-CB 3.41Å; H291-A810 WeakPolarHBondContact ND1-CB 3.37Å
292	T	79.6	Confident	71.8	Confident	57 Å²	57	69.5 Å²	69.5	35%	0.35	37%	0.37	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.1	125.5	179.5	-54	0	0	0	0	110	N285 F286 T287 H294	N285-T292 HydrophobicContact CB-CG2 4.25Å; F286-T292 WeakPolarHBondContact O-CA 3.33Å; T287-T292 VanDerWaalsContact CG2-OG1 3.28Å; T287-T292 WeakPolarHBondContact CG2-OG1 3.45Å; T287-T292 WeakPolarHBondContact OG1-CB 3.28Å; T287-T292 VanDerWaalsContact OG1-CG2 3.26Å; T287-T292 WeakPolarHBondContact OG1-CG2 3.26Å; T287-T292 PolarHBondContact OG1-OG1 2.88Å; T292-H294 WeakPolarHBondContact CG2-CE1 3.42Å; T292-H294 WeakPolarHBondContact CG2-NE2 3.31Å
293	H	77.6	Confident	71	Confident	69 Å²	69	73 Å²	73	32%	0.319	39%	0.387	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	123.2	167.1	-163.4	-74.5	0	0	0	109.2	L263 F286	L263-H293 HydrophobicContact CD1-CB 3.75Å; L263-H293 HydrophobicContact CD2-CB 4.14Å; L263-H293 HydrophobicContact CG-CB 4.23Å; F286-H293 PolarHBondContact N-O 2.89Å; F286-H293 PolarHBondContact O-N 3.2Å
294	H	81.5	Confident	70	Confident	123 Å²	123	70.8 Å²	70.8	57%	0.569	38%	0.379	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-100.3	132.1	176.5	-58.4	-80.5	0	0	0	109.1	N285 T292	N285-H294 VanDerWaalsContact CG-ND1 3.35Å; N285-H294 PolarHBondContact OD1-ND1 2.8Å; T292-H294 WeakPolarHBondContact CG2-CE1 3.42Å; T292-H294 WeakPolarHBondContact CG2-NE2 3.31Å
295	F	74.2	Confident	69.1	Low	32 Å²	32	73.4 Å²	73.4	14%	0.14	39%	0.392	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.5	159.2	173.6	71	-80.5	0	0	0	111.8	F243 V259 L261 V284	F243-F295 HydrophobicContact CD1-CZ 4.32Å; F243-F295 HydrophobicContact CE1-CZ 4.21Å; V259-F295 HydrophobicContact CG1-CD2 4.13Å; V259-F295 HydrophobicContact CG1-CE2 3.68Å; V259-F295 HydrophobicContact CG1-CZ 4.3Å; L261-F295 HydrophobicContact CD1-CD1 3.19Å; L261-F295 HydrophobicContact CD1-CD2 3.93Å; L261-F295 HydrophobicContact CD1-CE1 2.85Å; L261-F295 HydrophobicContact CD1-CE2 3.67Å; L261-F295 HydrophobicContact CD1-CG 3.69Å; L261-F295 HydrophobicContact CD1-CZ 3.11Å; L261-F295 HydrophobicContact CG-CD1 4.48Å; L261-F295 HydrophobicContact CG-CE1 4.33Å; V284-F295 HydrophobicContact CB-CD1 3.9Å; V284-F295 HydrophobicContact CB-CD2 4.38Å; V284-F295 HydrophobicContact CB-CE1 3.26Å; V284-F295 HydrophobicContact CB-CE2 3.82Å; V284-F295 HydrophobicContact CB-CG 4.43Å; V284-F295 HydrophobicContact CB-CZ 3.25Å; V284-F295 HydrophobicContact CG1-CD1 4.33Å; V284-F295 HydrophobicContact CG1-CE1 3.33Å; V284-F295 HydrophobicContact CG1-CE2 4.43Å; V284-F295 HydrophobicContact CG1-CZ 3.42Å; V284-F295 VanDerWaalsContact CG1-CZ 3.42Å; V284-F295 HydrophobicContact CG2-CE1 4.15Å; V284-F295 HydrophobicContact CG2-CE2 3.8Å; V284-F295 HydrophobicContact CG2-CZ 3.6Å; V284-F295 PolarHBondContact N-O 3.31Å; V284-F295 WeakPolarHBondContact O-CD1 3.26Å; V284-F295 PolarHBondContact O-N 2.81Å
296	Q	71.6	Confident	68.2	Low	136 Å²	136	72.8 Å²	72.8	64%	0.636	39%	0.389	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-106.3	119.3	175	-165.2	172	10.7	0	0	109.3	T282 K298	T282-Q296 CarbonylContact O-C 3.56Å; T282-Q296 WeakPolarHBondContact O-CA 3.4Å; T282-Q296 PolarHBondContact OG1-NE2 3.29Å; Q296-K298 PolarHBondContact O-N 2.84Å
297	A	65.6	Low	67.3	Low	21 Å²	21	75.3 Å²	75.3	17%	0.174	40%	0.402	C	S	.	.			trans	-65.4	123	172.3	0	0	0	0	0	109.3	L245 T282 G299	L245-A297 HydrophobicContact CD2-CB 3.99Å; T282-A297 PolarHBondContact O-N 3.4Å; A297-G299 PolarHBondContact O-N 2.8Å
298	K	56.8	Low	66.9	Low	185 Å²	185	79.8 Å²	79.8	80%	0.804	42%	0.421	S	S	*	.			trans	-78.4	105	176.4	-75.3	-174.8	177.8	-179.8	0	110	Q296	Q296-K298 PolarHBondContact O-N 2.84Å
299	G	53.7	Low	66.8	Low	41 Å²	41	84.3 Å²	84.3	42%	0.423	44%	0.441	S	S	.	.	S	Bend	trans	-173.7	146	171.2	0	0	0	0	0	109.7	A297 S301	A297-G299 PolarHBondContact O-N 2.8Å; G299-S301 PolarHBondContact O-N 2.96Å
300	D	47.1	Very low	67	Low	169 Å²	169	81.9 Å²	81.9	90%	0.904	43%	0.428	S	S	*	.			trans	-56.4	127.1	170.9	-91.4	-25.7	0	0	0	108.3	S302	D300-S302 PolarHBondContact O-N 2.98Å
301	S	44.5	Very low	67.7	Low	92 Å²	92	77 Å²	77	64%	0.643	41%	0.408	S	S	*	.	S	Bend	trans	-40.5	126.2	179.2	50.9	0	0	0	0	111.4	G299	G299-S301 PolarHBondContact O-N 2.96Å
302	S	47.3	Very low	68.8	Low	87 Å²	87	72.9 Å²	72.9	61%	0.608	39%	0.389	S	S	*	.	S	Bend	trans	133.1	8.5	135.3	74.5	0	0	0	0	120.6	K202 D300	K202-S302 PolarHBondContact NZ-O 2.92Å; D300-S302 PolarHBondContact O-N 2.98Å
303	N	51.7	Low	69.2	Low	107 Å²	107	70.1 Å²	70.1	57%	0.572	37%	0.372	S	S	*	.			trans	-150.3	79.6	175.4	-76.3	-42.1	0	0	0	115.3	K202 D305	K202-N303 PolarHBondContact NZ-OD1 3Å; N303-D305 PolarHBondContact O-N 2.78Å; N303-D305 VanDerWaalsContact O-N 3.11Å
304	L	55.1	Low	69.6	Low	69 Å²	69	66.9 Å²	66.9	36%	0.361	36%	0.358	S	S	.	.			trans	-75.4	86.7	148.6	-102.2	120.5	0	0	0	107.3	I232 L245 L306	I232-L304 HydrophobicContact CD1-CD2 4.3Å; I232-L304 HydrophobicContact CG1-CD2 4.13Å; L245-L304 HydrophobicContact CD1-CD1 4.05Å; L245-L304 HydrophobicContact CD1-CD2 3.71Å; L304-L306 HydrophobicContact CB-CD1 4.31Å; L304-L306 HydrophobicContact CB-CG 4.17Å; L304-L306 HydrophobicContact CD2-CD1 3.7Å; L304-L306 HydrophobicContact CD2-CD2 3.94Å; L304-L306 HydrophobicContact CD2-CG 3.8Å; L304-L306 PolarHBondContact O-N 2.92Å
305	D	62	Low	69.5	Low	58 Å²	58	62.5 Å²	62.5	31%	0.31	34%	0.338	S	S	.	.			trans	-70.9	73.5	173.5	179.4	34.2	0	0	0	109.8	G226 H228 N303	G226-D305 WeakPolarHBondContact CA-O 3.47Å; H228-D305 IonicContact CE1-OD2 3.45Å; H228-D305 PolarHBondContact CE1-OD2 2.95Å; H228-D305 VanDerWaalsContact CE1-OD2 3.3Å; H228-D305 IonicContact ND1-OD2 3.74Å; H228-D305 PolarHBondContact ND1-OD2 2.77Å; N303-D305 PolarHBondContact O-N 2.78Å; N303-D305 VanDerWaalsContact O-N 3.11Å
306	L	68.4	Low	69	Low	14 Å²	14	63.7 Å²	63.7	7%	0.073	35%	0.345	C	S	.	.			trans	-92.7	140.8	178.1	-65.9	173.7	0	0	0	110.3	R224 N230 I232 L304	R224-L306 HydrophobicContact CG-CB 4.14Å; R224-L306 HydrophobicContact CG-CD1 4.34Å; R224-L306 HydrophobicContact CG-CD2 4.36Å; R224-L306 VanDerWaalsContact CZ-CB 3.48Å; R224-L306 PolarHBondContact NH2-O 3.37Å; N230-L306 HydrophobicContact CB-CD2 4.11Å; I232-L306 HydrophobicContact CD1-CD1 3.45Å; I232-L306 VanDerWaalsContact CD1-CD1 3.45Å; I232-L306 HydrophobicContact CG1-CD1 3.83Å; L304-L306 HydrophobicContact CB-CD1 4.31Å; L304-L306 HydrophobicContact CB-CG 4.17Å; L304-L306 HydrophobicContact CD2-CD1 3.7Å; L304-L306 HydrophobicContact CD2-CD2 3.94Å; L304-L306 HydrophobicContact CD2-CG 3.8Å; L304-L306 PolarHBondContact O-N 2.92Å
307	N	69.9	Low	68.1	Low	52 Å²	52	60 Å²	60	28%	0.278	33%	0.334	S	S	.	.			trans	-63.3	163.8	179.4	-65.7	-23.9	0	0	0	111.7	R224 E225 Q227 E309	R224-N307 PolarHBondContact NE-O 2.85Å; R224-N307 PolarHBondContact NH2-O 2.83Å; E225-N307 WeakPolarHBondContact O-CB 3.34Å; E225-N307 PolarHBondContact O-N 2.88Å; E225-N307 PolarHBondContact O-ND2 2.8Å; E225-N307 VanDerWaalsContact O-ND2 3.11Å; Q227-N307 VanDerWaalsContact CG-OD1 3.25Å; Q227-N307 WeakPolarHBondContact CG-OD1 3.4Å; Q227-N307 PolarHBondContact N-OD1 2.79Å; N307-E309 PolarHBondContact O-N 2.85Å; N307-E309 VanDerWaalsContact O-N 3.08Å
308	F	78.1	Confident	67.1	Low	113 Å²	113	65.2 Å²	65.2	50%	0.496	37%	0.367	S	S	.	.	S	Bend	trans	-76.8	20.1	175.3	-60	-80.4	0	0	0	113	T195 L196	T195-F308 CarbonylContact C-O 3.56Å; T195-F308 WeakPolarHBondContact CA-O 3.33Å; L196-F308 HydrophobicContact CB-CB 4.2Å; L196-F308 HydrophobicContact CB-CD1 4.4Å; L196-F308 WeakPolarHBondContact CB-O 3.48Å; L196-F308 PolarHBondContact N-O 3.38Å
309	E	86	Confident	66.4	Low	97 Å²	97	60.3 Å²	60.3	45%	0.453	37%	0.369	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	131	-178.1	-67.3	-178.7	170.9	0	0	109.8	L193 Y194 R224 N307	L193-E309 HydrophobicContact CD1-CB 4.1Å; Y194-E309 WeakPolarHBondContact O-CA 3.21Å; R224-E309 WeakPolarHBondContact CG-O 3.34Å; N307-E309 PolarHBondContact O-N 2.85Å; N307-E309 VanDerWaalsContact O-N 3.08Å
310	I	88.7	Confident	65.7	Low	1 Å²	1	68.1 Å²	68.1	1%	0.005	39%	0.385	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	134.3	174.6	-176.8	166.4	0	0	0	109.4	Y194 I208 L222 R224 F312 Y338	Y194-I310 HydrophobicContact CD1-CG2 3.76Å; Y194-I310 HydrophobicContact CG-CG2 4.3Å; Y194-I310 PolarHBondContact N-O 2.94Å; Y194-I310 PolarHBondContact O-N 2.82Å; I208-I310 HydrophobicContact CD1-CD1 4.33Å; L222-I310 HydrophobicContact CD1-CD1 4.4Å; R224-I310 HydrophobicContact CB-CB 4.41Å; R224-I310 HydrophobicContact CB-CD1 4.46Å; R224-I310 HydrophobicContact CB-CG1 4.17Å; I310-F312 HydrophobicContact CD1-CE1 4.11Å; I310-F312 HydrophobicContact CD1-CE2 4.36Å; I310-F312 HydrophobicContact CD1-CZ 3.68Å; I310-F312 HydrophobicContact CG1-CE1 4.36Å; I310-F312 HydrophobicContact CG1-CE2 4.08Å; I310-F312 HydrophobicContact CG1-CZ 3.87Å; I310-F312 HydrophobicContact CG2-CE2 3.8Å; I310-F312 HydrophobicContact CG2-CZ 4.11Å; I310-Y338 HydrophobicContact CD1-CD2 4.03Å; I310-Y338 HydrophobicContact CD1-CE2 4.01Å
311	S	91.5	Very high	64.9	Low	7 Å²	7	66.5 Å²	66.5	5%	0.049	39%	0.387	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	142.4	179.4	62.2	0	0	0	0	111.2	L192 L222 H223 G314	L192-S311 CarbonylContact O-C 3.46Å; L192-S311 VanDerWaalsContact O-CA 3.28Å; L192-S311 WeakPolarHBondContact O-CA 3.29Å; L222-S311 CarbonylContact C-O 3.55Å; L222-S311 VanDerWaalsContact CA-O 3.25Å; L222-S311 WeakPolarHBondContact CA-O 3.44Å; H223-S311 PolarHBondContact N-O 3.04Å; H223-S311 PolarHBondContact O-N 2.85Å; H223-S311 PolarHBondContact O-OG 3.46Å; S311-G314 WeakPolarHBondContact CB-O 3.49Å; S311-G314 PolarHBondContact OG-O 2.84Å
312	F	93.4	Very high	64.6	Low	0 Å²	0	71.9 Å²	71.9	0%	0	39%	0.394	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	139.4	174.6	-58.7	-82.5	0	0	0	110	F186 A191 L192 L221 L222 I310 G314 L333 L336 V343	F186-F312 WeakPolarHBondContact CE1-O 3.3Å; F186-F312 HydrophobicContact CZ-CB 4.37Å; A191-F312 CarbonylContact C-O 3.4Å; A191-F312 WeakPolarHBondContact CA-O 3.47Å; L192-F312 HydrophobicContact CB-CB 4.36Å; L192-F312 PolarHBondContact N-O 3.08Å; L192-F312 PolarHBondContact O-N 3.42Å; L221-F312 VanDerWaalsContact O-CA 3.31Å; L221-F312 WeakPolarHBondContact O-CA 3.39Å; L222-F312 HydrophobicContact CB-CD1 3.65Å; L222-F312 HydrophobicContact CB-CE1 3.79Å; L222-F312 HydrophobicContact CD2-CE1 4.43Å; I310-F312 HydrophobicContact CD1-CE1 4.11Å; I310-F312 HydrophobicContact CD1-CE2 4.36Å; I310-F312 HydrophobicContact CD1-CZ 3.68Å; I310-F312 HydrophobicContact CG1-CE1 4.36Å; I310-F312 HydrophobicContact CG1-CE2 4.08Å; I310-F312 HydrophobicContact CG1-CZ 3.87Å; I310-F312 HydrophobicContact CG2-CE2 3.8Å; I310-F312 HydrophobicContact CG2-CZ 4.11Å; F312-G314 VanDerWaalsContact C-N 3.34Å; F312-L333 HydrophobicContact CB-CD1 4.38Å; F312-L336 HydrophobicContact CB-CD2 4.25Å; F312-L336 HydrophobicContact CD1-CD1 3.9Å; F312-L336 HydrophobicContact CD1-CD2 3.72Å; F312-L336 HydrophobicContact CD1-CG 4.43Å; F312-L336 HydrophobicContact CD2-CD2 3.72Å; F312-L336 HydrophobicContact CE1-CD1 3.54Å; F312-L336 HydrophobicContact CE1-CD2 3.93Å; F312-L336 HydrophobicContact CE1-CG 4.23Å; F312-L336 HydrophobicContact CE2-CD2 3.89Å; F312-L336 HydrophobicContact CG-CD2 3.62Å; F312-L336 HydrophobicContact CZ-CD1 3.97Å; F312-L336 HydrophobicContact CZ-CD2 3.99Å; F312-L336 HydrophobicContact CZ-CG 4.29Å; F312-V343 HydrophobicContact CD2-CG1 4.35Å; F312-V343 HydrophobicContact CE2-CG1 4.1Å
313	G	89.4	Confident	64.1	Low	0 Å²	0	72.5 Å²	72.5	0%	0	40%	0.404	C	S	.	.	S	Bend	trans	87	-11.4	-179.9	0	0	0	0	0	115.7	I220 L221 S328 F329	I220-G313 CarbonylContact O-C 3.52Å; I220-G313 VanDerWaalsContact O-C 3.27Å; L221-G313 PolarHBondContact O-N 2.63Å; G313-S328 WeakPolarHBondContact O-CB 3.48Å; G313-F329 PolarHBondContact O-N 3.38Å
314	G	86.1	Confident	64	Low	1 Å²	1	72.5 Å²	72.5	1%	0.01	40%	0.399	C	S	.	.	S	Bend	trans	172.1	171.5	178.1	0	0	0	0	0	112.8	I220 S311 F312	I220-G314 PolarHBondContact O-N 3.2Å; S311-G314 WeakPolarHBondContact CB-O 3.49Å; S311-G314 PolarHBondContact OG-O 2.84Å; F312-G314 VanDerWaalsContact C-N 3.34Å
315	I	78.5	Confident	64	Low	31 Å²	31	76 Å²	76	16%	0.159	42%	0.423	C	S	.	.			trans	-96.5	138	174.5	-62.3	-178.4	0	0	0	109.5	I220 H223 F324	I220-I315 HydrophobicContact CD1-CD1 3.42Å; I220-I315 VanDerWaalsContact CD1-CD1 3.42Å; I220-I315 HydrophobicContact CD1-CG1 3.57Å; I220-I315 HydrophobicContact CG2-CG1 4.21Å; H223-I315 HydrophobicContact CB-CD1 4.18Å; H223-I315 HydrophobicContact CB-CG1 3.67Å; I315-F324 HydrophobicContact CD1-CD1 4.41Å; I315-F324 HydrophobicContact CD1-CE1 4.12Å; I315-F324 HydrophobicContact CG2-CE1 4.16Å; I315-F324 HydrophobicContact CG2-CE2 4.47Å; I315-F324 HydrophobicContact CG2-CZ 4.04Å
316	L	62.7	Low	64.5	Low	56 Å²	56	77.9 Å²	77.9	29%	0.293	43%	0.426	S	S	.	.			trans	-104.8	140.5	174.2	-66.1	166.4	0	0	0	111	L193 M357	L193-L316 HydrophobicContact CB-CD1 4.2Å; L193-L316 HydrophobicContact CD1-CD1 4.35Å; L193-L316 HydrophobicContact CD2-CD1 4.46Å; L316-M357 HydrophobicContact CD1-CE 3.56Å; L316-M357 HydrophobicContact CD1-SD 3.47Å; L316-M357 WeakPolarHBondContact CD1-SD 3.39Å; L316-M357 HydrophobicContact CD2-CE 4.32Å; L316-M357 HydrophobicContact CD2-SD 3.3Å; L316-M357 WeakPolarHBondContact CD2-SD 3.26Å; L316-M357 HydrophobicContact CG-SD 4.01Å
317	S	54.2	Low	65.2	Low	58 Å²	58	83.6 Å²	83.6	41%	0.406	45%	0.45	S	S	.	.			trans	-135.3	97	164	-76.1	0	0	0	0	108.3	G319 F324	S317-G319 PolarHBondContact O-N 2.85Å; S317-G319 VanDerWaalsContact O-N 3.08Å; S317-F324 WeakPolarHBondContact OG-CE2 3.46Å
318	P	44	Very low	66.1	Low	131 Å²	131	82.9 Å²	82.9	85%	0.851	45%	0.449	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.6	111.5	172.7	-13	27	0	0	0	108.8
319	G	41.2	Very low	66.8	Low	82 Å²	82	77.5 Å²	77.5	85%	0.845	43%	0.426	S	S	*	.	T	Hydrogen-bonded Turn	trans	85.3	14.3	164	0	0	0	0	0	118.6	S317	S317-G319 PolarHBondContact O-N 2.85Å; S317-G319 VanDerWaalsContact O-N 3.08Å
320	R	39.6	Very low	67.1	Low	206 Å²	206	75 Å²	75	78%	0.777	41%	0.414	S	S	*	.			trans	-128.7	113.4	166.7	-84.8	-176.3	175.4	175.8	-0.4	111.5	R322	R320-R322 PolarHBondContact O-N 2.84Å
321	S	30.7	Very low	67.3	Low	135 Å²	135	75 Å²	75	94%	0.944	41%	0.414	S	S	*	.			trans	-67.9	68.9	167.4	-49.7	0	0	0	0	110.8
322	R	38.3	Very low	67.4	Low	205 Å²	205	74.6 Å²	74.6	77%	0.774	41%	0.411	S	S	*	.			trans	-95	118.8	153.2	-93	-176.8	167.5	176.7	-4.1	106	R320 F324	R320-R322 PolarHBondContact O-N 2.84Å; R322-F324 VanDerWaalsContact C-N 3.3Å; R322-F324 PolarHBondContact O-N 2.81Å
323	A	35.7	Very low	67.5	Low	99 Å²	99	74.6 Å²	74.6	82%	0.818	41%	0.411	S	S	*	.			trans	-59.1	97.4	168.3	0	0	0	0	0	107.8	T325	A323-T325 PolarHBondContact O-N 3.46Å
324	F	50.8	Low	67.7	Low	107 Å²	107	74.6 Å²	74.6	47%	0.469	41%	0.411	S	S	.	.			trans	-65.2	118.7	166.7	-90.7	-92.6	0	0	0	106.5	I315 S317 R322 R326	I315-F324 HydrophobicContact CD1-CD1 4.41Å; I315-F324 HydrophobicContact CD1-CE1 4.12Å; I315-F324 HydrophobicContact CG2-CE1 4.16Å; I315-F324 HydrophobicContact CG2-CE2 4.47Å; I315-F324 HydrophobicContact CG2-CZ 4.04Å; S317-F324 WeakPolarHBondContact OG-CE2 3.46Å; R322-F324 VanDerWaalsContact C-N 3.3Å; R322-F324 PolarHBondContact O-N 2.81Å; F324-R326 PolarHBondContact O-N 2.83Å
325	T	55	Low	67.9	Low	142 Å²	142	76 Å²	76	87%	0.871	42%	0.419	S	S	*	.			trans	-70.7	-10.6	176.4	37.9	0	0	0	0	112.8	A323	A323-T325 PolarHBondContact O-N 3.46Å
326	R	71.9	Confident	68.7	Low	98 Å²	98	74.6 Å²	74.6	37%	0.37	41%	0.411	S	S	.	.	S	Bend	trans	-92.4	138.2	-176.8	-57.7	-171.3	-175.9	-161.2	6.5	111.3	I220 E235 F324	I220-R326 HydrophobicContact CD1-CB 3.76Å; I220-R326 HydrophobicContact CG1-CB 4.42Å; E235-R326 WeakPolarHBondContact OE2-CD 3.39Å; E235-R326 IonicContact OE2-CZ 3.41Å; E235-R326 IonicContact OE2-NE 3.39Å; E235-R326 IonicContact OE2-NH1 2.85Å; E235-R326 PolarHBondContact OE2-NH1 2.95Å; F324-R326 PolarHBondContact O-N 2.83Å
327	K	82.7	Confident	70.1	Confident	134 Å²	134	75.6 Å²	75.6	58%	0.583	41%	0.412	S	S	*	.	P	Polyproline II helix	trans	-84.4	144.2	-178.3	-63.1	-176.6	178.5	-177	0	111	G219 I220	G219-K327 WeakPolarHBondContact CA-O 3.44Å; I220-K327 PolarHBondContact N-O 2.92Å
328	S	90.5	Very high	71.9	Confident	37 Å²	37	73.1 Å²	73.1	26%	0.259	39%	0.393	S	S	.	.	B	Isolated β-bridge	trans	-70.3	159.3	168.7	-64.5	0	0	0	0	111	G188 G313	G188-S328 VanDerWaalsContact O-CB 3.27Å; G188-S328 WeakPolarHBondContact O-CB 3.36Å; G313-S328 WeakPolarHBondContact O-CB 3.48Å
329	F	92.8	Very high	74	Confident	1 Å²	1	70 Å²	70	0%	0.004	37%	0.37	C	S	.	.	P	Polyproline II helix	trans	-76.3	132.2	-177	177.9	-108.9	0	0	0	112	F186 G188 F212 A214 I220 L221 G313 L333	F186-F329 HydrophobicContact CB-CD1 4.28Å; F186-F329 VanDerWaalsContact CB-O 3.3Å; F186-F329 WeakPolarHBondContact CB-O 3.43Å; F186-F329 HydrophobicContact CD2-CD1 4.14Å; F186-F329 HydrophobicContact CD2-CE1 4.5Å; F186-F329 HydrophobicContact CG-CD1 4.46Å; G188-F329 WeakPolarHBondContact CA-O 3.37Å; G188-F329 PolarHBondContact N-O 2.88Å; F212-F329 HydrophobicContact CB-CZ 4.19Å; F212-F329 HydrophobicContact CD2-CE2 4.22Å; F212-F329 HydrophobicContact CD2-CZ 4.14Å; A214-F329 HydrophobicContact CB-CE2 3.98Å; A214-F329 HydrophobicContact CB-CZ 4.43Å; I220-F329 WeakPolarHBondContact O-CB 3.49Å; L221-F329 HydrophobicContact CD1-CD2 3.53Å; L221-F329 HydrophobicContact CD1-CE2 3.78Å; L221-F329 HydrophobicContact CD1-CG 4.24Å; L221-F329 HydrophobicContact CG-CD2 3.94Å; L221-F329 HydrophobicContact CG-CE2 4.03Å; L221-F329 HydrophobicContact CG-CG 4.29Å; L221-F329 HydrophobicContact CG-CZ 4.45Å; G313-F329 PolarHBondContact O-N 3.38Å; F329-L333 HydrophobicContact CD1-CD2 4.37Å; F329-L333 HydrophobicContact CE1-CD2 3.71Å; F329-L333 HydrophobicContact CE1-CG 4.17Å; F329-L333 HydrophobicContact CZ-CD2 4.19Å
330	H	92.3	Very high	76.2	Confident	44 Å²	44	69.4 Å²	69.4	20%	0.204	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	108.6	172.1	-177.5	-178.8	0	0	0	108.7	Y185 F186 M215 Q216	Y185-H330 PolarHBondContact OH-NE2 2.88Å; Y185-H330 VanDerWaalsContact OH-NE2 3.12Å; F186-H330 WeakPolarHBondContact O-CA 3.32Å; F186-H330 PolarHBondContact O-CD2 3.35Å; M215-H330 PolarHBondContact N-O 2.78Å; Q216-H330 HydrophobicContact CB-CB 4.46Å; Q216-H330 HydrophobicContact CG-CB 4.04Å; Q216-H330 PolarHBondContact NE2-ND1 2.92Å; Q216-H330 VanDerWaalsContact NE2-ND1 3.16Å
331	G	92.7	Very high	78.6	Confident	0 Å²	0	62.1 Å²	62.1	0%	0	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	161.9	-164.9	-173.6	0	0	0	0	0	112.9	Y185 F186 K213	Y185-G331 WeakPolarHBondContact CD2-O 3.31Å; F186-G331 PolarHBondContact N-O 3.06Å; F186-G331 PolarHBondContact O-N 2.9Å; K213-G331 CarbonylContact O-C 3.58Å; K213-G331 WeakPolarHBondContact O-CA 3.34Å
332	C	94	Very high	81.5	Confident	0 Å²	0	56.6 Å²	56.6	0%	0	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	141.8	-179.5	-50.8	0	0	0	0	110.3	V183 V184 F212 K213 W272 C364	V183-C332 HydrophobicContact CG1-CB 4.12Å; V184-C332 CarbonylContact O-C 3.6Å; V184-C332 VanDerWaalsContact O-CA 3.31Å; V184-C332 WeakPolarHBondContact O-CA 3.14Å; F212-C332 CarbonylContact C-O 3.6Å; F212-C332 VanDerWaalsContact CA-O 3.29Å; F212-C332 WeakPolarHBondContact CA-O 3.48Å; K213-C332 HydrophobicContact CB-CB 4.44Å; K213-C332 PolarHBondContact N-O 2.93Å; K213-C332 PolarHBondContact O-N 2.73Å; W272-C332 HydrophobicContact CH2-CB 3.48Å; W272-C332 VanDerWaalsContact CH2-CB 3.48Å; W272-C332 HydrophobicContact CZ2-CB 4.24Å; W272-C332 HydrophobicContact CZ3-CB 4.07Å; C332-C364 HydrophobicContact CB-CB 3.8Å; C332-C364 WeakPolarHBondContact CB-SG 3.31Å; C332-C364 WeakPolarHBondContact SG-CA 3.38Å; C332-C364 WeakPolarHBondContact SG-CB 2.86Å; C332-C364 CovalentContact SG-SG 2.03Å; C332-C364 PolarHBondContact SG-SG 2.8Å
333	L	95.3	Very high	84.1	Confident	0 Å²	0	46.9 Å²	46.9	0%	0	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112	138.8	166	-55.3	-177.1	0	0	0	109	V183 V184 F186 L210 K211 F212 L221 F312 F329	V183-L333 CarbonylContact C-O 3.59Å; V183-L333 WeakPolarHBondContact CA-O 3.18Å; V184-L333 HydrophobicContact CG1-CB 3.93Å; V184-L333 PolarHBondContact N-O 3.21Å; V184-L333 PolarHBondContact O-N 3.36Å; F186-L333 HydrophobicContact CD2-CD1 4.3Å; F186-L333 HydrophobicContact CD2-CG 4.07Å; F186-L333 HydrophobicContact CE2-CB 4.09Å; F186-L333 HydrophobicContact CE2-CD1 3.49Å; F186-L333 VanDerWaalsContact CE2-CD1 3.49Å; F186-L333 HydrophobicContact CE2-CG 3.57Å; F186-L333 HydrophobicContact CZ-CD1 4.07Å; L210-L333 HydrophobicContact CD1-CD2 4.28Å; K211-L333 CarbonylContact O-C 3.55Å; K211-L333 WeakPolarHBondContact O-CA 3.46Å; F212-L333 HydrophobicContact CB-CD2 3.46Å; F212-L333 VanDerWaalsContact CB-CD2 3.46Å; L221-L333 HydrophobicContact CD2-CD2 4.45Å; F312-L333 HydrophobicContact CB-CD1 4.38Å; F329-L333 HydrophobicContact CD1-CD2 4.37Å; F329-L333 HydrophobicContact CE1-CD2 3.71Å; F329-L333 HydrophobicContact CE1-CG 4.17Å; F329-L333 HydrophobicContact CZ-CD2 4.19Å
334	E	92.8	Very high	86.7	Confident	0 Å²	0	42.1 Å²	42.1	0%	0	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	140.1	179.7	164.8	172	-108.8	0	0	109.1	R88 S181 E182 V183 K211 W272 L336	R88-E334 IonicContact CZ-OE1 3.49Å; R88-E334 IonicContact CZ-OE2 2.85Å; R88-E334 VanDerWaalsContact NH1-CD 3.3Å; R88-E334 IonicContact NH1-OE1 3.93Å; R88-E334 PolarHBondContact NH1-OE1 3.16Å; R88-E334 IonicContact NH1-OE2 3.58Å; R88-E334 PolarHBondContact NH1-OE2 2.98Å; R88-E334 IonicContact NH2-OE1 2.62Å; R88-E334 IonicContact NH2-OE2 2.8Å; R88-E334 PolarHBondContact NH2-OE2 3.33Å; S181-E334 WeakPolarHBondContact CB-OE1 3.12Å; S181-E334 PolarHBondContact OG-OE1 2.81Å; E182-E334 WeakPolarHBondContact O-CA 3.45Å; V183-E334 HydrophobicContact CG2-CB 4.12Å; V183-E334 HydrophobicContact CG2-CG 4.28Å; K211-E334 HydrophobicContact CB-CB 4.01Å; K211-E334 HydrophobicContact CB-CG 4.31Å; K211-E334 WeakPolarHBondContact CD-OE2 3.31Å; K211-E334 PolarHBondContact N-O 3.47Å; K211-E334 PolarHBondContact O-N 2.84Å; W272-E334 HydrophobicContact CE3-CB 3.99Å; W272-E334 HydrophobicContact CH2-CB 3.57Å; W272-E334 HydrophobicContact CZ2-CB 4.29Å; W272-E334 HydrophobicContact CZ3-CB 3.41Å; W272-E334 VanDerWaalsContact CZ3-CB 3.41Å; E334-L336 PolarHBondContact O-N 3.07Å
335	N	91.3	Very high	88.6	Confident	31 Å²	31	40.7 Å²	40.7	17%	0.166	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	52.1	53.4	172.6	-68.6	-5.1	0	0	0	112.1	Y179 S181 E182 Y337	Y179-N335 PolarHBondContact OH-ND2 3.35Å; S181-N335 WeakPolarHBondContact CB-OD1 3.25Å; E182-N335 PolarHBondContact N-OD1 3.11Å; E182-N335 PolarHBondContact O-N 2.89Å; N335-Y337 HydrophobicContact CB-CD2 4.4Å; N335-Y337 HydrophobicContact CB-CE2 3.82Å; N335-Y337 WeakPolarHBondContact O-CD2 3.37Å; N335-Y337 PolarHBondContact O-N 3.16Å
336	L	94.5	Very high	90.4	Very high	0 Å²	0	35.3 Å²	35.3	0%	0	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.7	105.9	-179.5	176	62	0	0	0	110.1	L210 F312 E334 V343 T344	L210-L336 HydrophobicContact CB-CD1 3.75Å; L210-L336 HydrophobicContact CD2-CD1 3.67Å; L210-L336 HydrophobicContact CG-CD1 4.35Å; F312-L336 HydrophobicContact CB-CD2 4.25Å; F312-L336 HydrophobicContact CD1-CD1 3.9Å; F312-L336 HydrophobicContact CD1-CD2 3.72Å; F312-L336 HydrophobicContact CD1-CG 4.43Å; F312-L336 HydrophobicContact CD2-CD2 3.72Å; F312-L336 HydrophobicContact CE1-CD1 3.54Å; F312-L336 HydrophobicContact CE1-CD2 3.93Å; F312-L336 HydrophobicContact CE1-CG 4.23Å; F312-L336 HydrophobicContact CE2-CD2 3.89Å; F312-L336 HydrophobicContact CG-CD2 3.62Å; F312-L336 HydrophobicContact CZ-CD1 3.97Å; F312-L336 HydrophobicContact CZ-CD2 3.99Å; F312-L336 HydrophobicContact CZ-CG 4.29Å; E334-L336 PolarHBondContact O-N 3.07Å; L336-V343 HydrophobicContact CB-CB 4.49Å; L336-V343 HydrophobicContact CD2-CB 3.87Å; L336-V343 HydrophobicContact CD2-CG1 3.85Å; L336-V343 HydrophobicContact CG-CB 3.92Å; L336-V343 HydrophobicContact CG-CG1 4.44Å; L336-V343 HydrophobicContact CG-CG2 4.35Å; L336-V343 PolarHBondContact O-N 3.21Å; L336-T344 WeakPolarHBondContact CB-OG1 3.27Å; L336-T344 PolarHBondContact N-OG1 3.49Å
337	Y	93.1	Very high	91.4	Very high	77 Å²	77	30.6 Å²	30.6	30%	0.302	17%	0.168	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	135.3	175.4	-63.1	-83.9	0	0	0	111.8	S209 N335 V341 D342	S209-Y337 PolarHBondContact N-O 2.86Å; S209-Y337 PolarHBondContact O-N 3.09Å; S209-Y337 WeakPolarHBondContact OG-CB 3.02Å; N335-Y337 HydrophobicContact CB-CD2 4.4Å; N335-Y337 HydrophobicContact CB-CE2 3.82Å; N335-Y337 WeakPolarHBondContact O-CD2 3.37Å; N335-Y337 PolarHBondContact O-N 3.16Å; Y337-V341 VanDerWaalsContact CA-O 3.3Å; Y337-V341 WeakPolarHBondContact CA-O 3.15Å; Y337-D342 HydrophobicContact CD1-CB 3.98Å; Y337-D342 HydrophobicContact CE1-CB 3.47Å; Y337-D342 VanDerWaalsContact CE1-CB 3.47Å; Y337-D342 WeakPolarHBondContact CE1-OD2 3.25Å; Y337-D342 VanDerWaalsContact CZ-OD2 3.27Å; Y337-D342 PolarHBondContact OH-OD2 2.96Å
338	Y	90.7	Very high	91.7	Very high	6 Å²	6	28.7 Å²	28.7	2%	0.024	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	117.3	167.7	-176.1	-81.5	0	0	0	108.7	Y194 L196 D206 I208 R224 I310 G340 V341	Y194-Y338 HydrophobicContact CE1-CD1 4.23Å; L196-Y338 HydrophobicContact CD2-CD1 3.66Å; L196-Y338 HydrophobicContact CD2-CE1 3.21Å; D206-Y338 PolarHBondContact OD1-OH 3.08Å; D206-Y338 PolarHBondContact OD2-OH 3.46Å; I208-Y338 HydrophobicContact CD1-CD2 4.26Å; I208-Y338 HydrophobicContact CD1-CE2 4.14Å; I208-Y338 HydrophobicContact CG1-CD2 3.83Å; I208-Y338 HydrophobicContact CG1-CE2 3.98Å; R224-Y338 PolarHBondContact NH1-OH 2.73Å; I310-Y338 HydrophobicContact CD1-CD2 4.03Å; I310-Y338 HydrophobicContact CD1-CE2 4.01Å; Y338-G340 PolarHBondContact O-N 3.07Å; Y338-G340 VanDerWaalsContact O-N 3.11Å; Y338-V341 PolarHBondContact N-O 3.44Å; Y338-V341 WeakPolarHBondContact O-CB 3.34Å; Y338-V341 PolarHBondContact O-N 3.23Å
339	N	87.9	Confident	91.8	Very high	67 Å²	67	32.8 Å²	32.8	36%	0.358	17%	0.173	S	C	.	.	T	Hydrogen-bonded Turn	trans	48.1	39.5	-178.1	-69.4	-13.2	0	0	0	113.6	D206 V207 V341	D206-N339 WeakPolarHBondContact CA-OD1 3.15Å; D206-N339 PolarHBondContact OD1-ND2 3.36Å; V207-N339 PolarHBondContact N-OD1 2.9Å; V207-N339 PolarHBondContact O-N 2.88Å; V207-N339 PolarHBondContact O-OD1 2.71Å; N339-V341 VanDerWaalsContact C-N 3.3Å; N339-V341 PolarHBondContact O-N 3.19Å
340	G	87	Confident	91.6	Very high	68 Å²	68	39.2 Å²	39.2	70%	0.701	20%	0.203	S	C	*	.	T	Hydrogen-bonded Turn	trans	81.3	-2.3	-179.1	0	0	0	0	0	115.6	Y338	Y338-G340 PolarHBondContact O-N 3.07Å; Y338-G340 VanDerWaalsContact O-N 3.11Å
341	V	90.1	Very high	91.7	Very high	53 Å²	53	41.7 Å²	41.7	32%	0.321	21%	0.213	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.8	125.7	174.2	-178.6	0	0	0	0	109.9	Y337 Y338 N339 V343 L346	Y337-V341 VanDerWaalsContact CA-O 3.3Å; Y337-V341 WeakPolarHBondContact CA-O 3.15Å; Y338-V341 PolarHBondContact N-O 3.44Å; Y338-V341 WeakPolarHBondContact O-CB 3.34Å; Y338-V341 PolarHBondContact O-N 3.23Å; N339-V341 VanDerWaalsContact C-N 3.3Å; N339-V341 PolarHBondContact O-N 3.19Å; V341-V343 PolarHBondContact O-N 3.11Å; V341-L346 HydrophobicContact CG1-CD1 3.55Å; V341-L346 HydrophobicContact CG1-CG 4.33Å
342	D	91.6	Very high	91.5	Very high	20 Å²	20	48 Å²	48	11%	0.107	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.6	95.5	174.9	-162.4	-41.3	0	0	0	110.8	Y337 T344 E345 L346	Y337-D342 HydrophobicContact CD1-CB 3.98Å; Y337-D342 HydrophobicContact CE1-CB 3.47Å; Y337-D342 VanDerWaalsContact CE1-CB 3.47Å; Y337-D342 WeakPolarHBondContact CE1-OD2 3.25Å; Y337-D342 VanDerWaalsContact CZ-OD2 3.27Å; Y337-D342 PolarHBondContact OH-OD2 2.96Å; D342-T344 VanDerWaalsContact C-N 3.27Å; D342-T344 PolarHBondContact O-N 2.8Å; D342-T344 PolarHBondContact OD1-N 3.34Å; D342-T344 VanDerWaalsContact OD1-N 3.16Å; D342-E345 HydrophobicContact CB-CB 3.81Å; D342-E345 PolarHBondContact O-N 2.78Å; D342-E345 PolarHBondContact OD1-N 2.81Å; D342-L346 WeakPolarHBondContact O-CG 3.12Å; D342-L346 PolarHBondContact O-N 3.03Å; D342-L346 VanDerWaalsContact O-N 3.15Å
343	V	92.8	Very high	91.2	Very high	0 Å²	0	50.7 Å²	50.7	0%	0	27%	0.266	C	S	.	.	H	α-helix	trans	-67.1	-32.8	-177.6	-179.1	0	0	0	0	110.6	Y194 F312 L336 V341 L346 A347 I354	Y194-V343 HydrophobicContact CD1-CG2 4.13Å; Y194-V343 HydrophobicContact CE1-CG2 4.41Å; Y194-V343 HydrophobicContact CG-CG1 4.42Å; Y194-V343 HydrophobicContact CG-CG2 4.43Å; F312-V343 HydrophobicContact CD2-CG1 4.35Å; F312-V343 HydrophobicContact CE2-CG1 4.1Å; L336-V343 HydrophobicContact CB-CB 4.49Å; L336-V343 HydrophobicContact CD2-CB 3.87Å; L336-V343 HydrophobicContact CD2-CG1 3.85Å; L336-V343 HydrophobicContact CG-CB 3.92Å; L336-V343 HydrophobicContact CG-CG1 4.44Å; L336-V343 HydrophobicContact CG-CG2 4.35Å; L336-V343 PolarHBondContact O-N 3.21Å; V341-V343 PolarHBondContact O-N 3.11Å; V343-L346 PolarHBondContact O-N 2.75Å; V343-A347 WeakPolarHBondContact O-CB 3.35Å; V343-A347 PolarHBondContact O-N 2.71Å; V343-I354 HydrophobicContact CG1-CD1 3.66Å
344	T	91.6	Very high	91.1	Very high	0 Å²	0	51.5 Å²	51.5	0%	0	27%	0.271	C	S	.	.	H	α-helix	trans	-67.9	-42.7	178.6	-50.3	0	0	0	0	111.1	E182 V184 L336 D342 A347 K348	E182-T344 HydrophobicContact CB-CG2 3.72Å; V184-T344 HydrophobicContact CB-CG2 4.22Å; V184-T344 HydrophobicContact CG1-CG2 4.24Å; L336-T344 WeakPolarHBondContact CB-OG1 3.27Å; L336-T344 PolarHBondContact N-OG1 3.49Å; D342-T344 VanDerWaalsContact C-N 3.27Å; D342-T344 PolarHBondContact O-N 2.8Å; D342-T344 PolarHBondContact OD1-N 3.34Å; D342-T344 VanDerWaalsContact OD1-N 3.16Å; T344-A347 PolarHBondContact O-N 2.76Å; T344-K348 WeakPolarHBondContact O-CB 3.38Å; T344-K348 PolarHBondContact O-N 2.73Å
345	E	91.1	Very high	90.9	Very high	77 Å²	77	55.8 Å²	55.8	36%	0.36	29%	0.293	S	S	.	.	H	α-helix	trans	-62.8	-42.1	175.3	-169.6	-173.7	-177.7	0	0	111.7	D342 A347 K348 K349	D342-E345 HydrophobicContact CB-CB 3.81Å; D342-E345 PolarHBondContact O-N 2.78Å; D342-E345 PolarHBondContact OD1-N 2.81Å; E345-A347 VanDerWaalsContact C-N 3.33Å; E345-A347 PolarHBondContact O-N 2.89Å; E345-K348 PolarHBondContact O-N 2.81Å; E345-K349 HydrophobicContact CG-CD 4.18Å; E345-K349 WeakPolarHBondContact O-CB 2.89Å; E345-K349 WeakPolarHBondContact O-CG 3.48Å; E345-K349 PolarHBondContact O-N 2.87Å; E345-K349 WeakPolarHBondContact OE1-CE 3.34Å; E345-K349 IonicContact OE1-NZ 2.53Å; E345-K349 PolarHBondContact OE1-NZ 3.27Å
346	L	92.1	Very high	90.9	Very high	28 Å²	28	57.1 Å²	57.1	15%	0.147	30%	0.299	C	S	.	.	H	α-helix	trans	-60.4	-42.8	175.5	-68.1	-179.4	0	0	0	111.9	Y194 V341 D342 V343 K349 H350 K351 I354	Y194-L346 HydrophobicContact CD2-CD1 4.41Å; Y194-L346 HydrophobicContact CE2-CD1 3.83Å; V341-L346 HydrophobicContact CG1-CD1 3.55Å; V341-L346 HydrophobicContact CG1-CG 4.33Å; D342-L346 WeakPolarHBondContact O-CG 3.12Å; D342-L346 PolarHBondContact O-N 3.03Å; D342-L346 VanDerWaalsContact O-N 3.15Å; V343-L346 PolarHBondContact O-N 2.75Å; L346-K349 PolarHBondContact O-N 2.85Å; L346-H350 PolarHBondContact O-N 2.81Å; L346-H350 VanDerWaalsContact O-N 3.13Å; L346-K351 HydrophobicContact CB-CB 4.28Å; L346-K351 HydrophobicContact CB-CG 4.41Å; L346-K351 HydrophobicContact CD2-CB 4.01Å; L346-K351 HydrophobicContact CD2-CG 3.71Å; L346-K351 PolarHBondContact O-N 2.87Å; L346-I354 HydrophobicContact CB-CD1 4.25Å; L346-I354 HydrophobicContact CB-CG1 3.58Å; L346-I354 HydrophobicContact CD1-CG1 4.42Å
347	A	91.8	Very high	90.4	Very high	0 Å²	0	60 Å²	60	0%	0	31%	0.313	C	S	.	.	H	α-helix	trans	-63.3	-48.8	177	0	0	0	0	0	111.3	L192 V343 T344 E345 K349 H350 I354 M356 F362	L192-A347 HydrophobicContact CD1-CB 4.08Å; L192-A347 HydrophobicContact CD2-CB 4.21Å; V343-A347 WeakPolarHBondContact O-CB 3.35Å; V343-A347 PolarHBondContact O-N 2.71Å; T344-A347 PolarHBondContact O-N 2.76Å; E345-A347 VanDerWaalsContact C-N 3.33Å; E345-A347 PolarHBondContact O-N 2.89Å; A347-K349 VanDerWaalsContact C-N 3.29Å; A347-K349 PolarHBondContact O-N 3.2Å; A347-H350 PolarHBondContact O-N 2.84Å; A347-I354 HydrophobicContact CB-CG2 3.92Å; A347-M356 HydrophobicContact CB-SD 4.42Å; A347-F362 HydrophobicContact CB-CE1 3.97Å; A347-F362 HydrophobicContact CB-CZ 4.11Å
348	K	90.6	Very high	90	Very high	93 Å²	93	59.3 Å²	59.3	40%	0.404	33%	0.33	S	S	.	.	H	α-helix	trans	-60.5	-38.2	179.2	-169.8	173.9	179.7	-178	0	112.3	E182 T344 E345 H350 F362	E182-K348 IonicContact OE1-NZ 3.58Å; E182-K348 PolarHBondContact OE1-NZ 3.34Å; E182-K348 WeakPolarHBondContact OE2-CD 3.42Å; E182-K348 WeakPolarHBondContact OE2-CE 3.28Å; E182-K348 IonicContact OE2-NZ 3.94Å; E182-K348 PolarHBondContact OE2-NZ 2.95Å; T344-K348 WeakPolarHBondContact O-CB 3.38Å; T344-K348 PolarHBondContact O-N 2.73Å; E345-K348 PolarHBondContact O-N 2.81Å; K348-H350 VanDerWaalsContact C-N 3.29Å; K348-H350 PolarHBondContact O-N 3.25Å; K348-H350 PolarHBondContact O-ND1 2.93Å; K348-F362 VanDerWaalsContact CA-CZ 3.45Å; K348-F362 HydrophobicContact CB-CD1 3.94Å; K348-F362 HydrophobicContact CB-CE1 3.75Å; K348-F362 HydrophobicContact CB-CG 4.45Å; K348-F362 HydrophobicContact CB-CZ 4.11Å; K348-F362 HydrophobicContact CG-CD1 4.2Å; K348-F362 HydrophobicContact CG-CD2 4.5Å; K348-F362 HydrophobicContact CG-CE1 4.41Å; K348-F362 HydrophobicContact CG-CG 4.24Å
349	K	92	Very high	89.6	Confident	123 Å²	123	65 Å²	65	54%	0.535	36%	0.361	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.8	5	176.3	-66.6	-176.3	-175.6	174.6	0	114.3	E345 L346 A347 K351	E345-K349 HydrophobicContact CG-CD 4.18Å; E345-K349 WeakPolarHBondContact O-CB 2.89Å; E345-K349 WeakPolarHBondContact O-CG 3.48Å; E345-K349 PolarHBondContact O-N 2.87Å; E345-K349 WeakPolarHBondContact OE1-CE 3.34Å; E345-K349 IonicContact OE1-NZ 2.53Å; E345-K349 PolarHBondContact OE1-NZ 3.27Å; L346-K349 PolarHBondContact O-N 2.85Å; A347-K349 VanDerWaalsContact C-N 3.29Å; A347-K349 PolarHBondContact O-N 3.2Å; K349-K351 VanDerWaalsContact C-N 3.3Å; K349-K351 HydrophobicContact CB-CG 4.15Å; K349-K351 PolarHBondContact O-N 2.85Å
350	H	89.6	Confident	89.3	Confident	136 Å²	136	62.8 Å²	62.8	63%	0.63	35%	0.349	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.4	45.3	177.9	-61.5	63.5	0	0	0	112.9	L346 A347 K348 M356	L346-H350 PolarHBondContact O-N 2.81Å; L346-H350 VanDerWaalsContact O-N 3.13Å; A347-H350 PolarHBondContact O-N 2.84Å; K348-H350 VanDerWaalsContact C-N 3.29Å; K348-H350 PolarHBondContact O-N 3.25Å; K348-H350 PolarHBondContact O-ND1 2.93Å; H350-M356 WeakPolarHBondContact CD2-CE 3.11Å; H350-M356 WeakPolarHBondContact NE2-CE 3.2Å
351	K	93	Very high	89.4	Confident	97 Å²	97	61.1 Å²	61.1	42%	0.422	33%	0.327	S	S	.	.			trans	-72.6	147.4	-180	-65.7	-65.2	-172.3	179.9	0	111.1	L346 K349 Q353 I354	L346-K351 HydrophobicContact CB-CB 4.28Å; L346-K351 HydrophobicContact CB-CG 4.41Å; L346-K351 HydrophobicContact CD2-CB 4.01Å; L346-K351 HydrophobicContact CD2-CG 3.71Å; L346-K351 PolarHBondContact O-N 2.87Å; K349-K351 VanDerWaalsContact C-N 3.3Å; K349-K351 HydrophobicContact CB-CG 4.15Å; K349-K351 PolarHBondContact O-N 2.85Å; K351-Q353 PolarHBondContact O-N 2.88Å; K351-Q353 VanDerWaalsContact O-N 3.09Å; K351-I354 PolarHBondContact O-N 2.95Å
352	P	88.6	Confident	89.4	Confident	131 Å²	131	61.6 Å²	61.6	85%	0.851	33%	0.325	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.7	-16.8	-173.9	26.9	-36.2	0	0	0	114.6	I354	P352-I354 PolarHBondContact O-N 2.74Å
353	Q	88.6	Confident	89.3	Confident	57 Å²	57	64.3 Å²	64.3	27%	0.266	35%	0.346	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.3	-10.6	175	-67.6	163.7	-25.2	0	0	112.9	Y194 T195 D197 K351	Y194-Q353 HydrophobicContact CD2-CB 4.32Å; Y194-Q353 HydrophobicContact CE2-CB 4.06Å; T195-Q353 PolarHBondContact N-O 2.94Å; D197-Q353 PolarHBondContact OD1-NE2 3.45Å; K351-Q353 PolarHBondContact O-N 2.88Å; K351-Q353 VanDerWaalsContact O-N 3.09Å
354	I	91.6	Very high	89	Confident	18 Å²	18	66.1 Å²	66.1	9%	0.092	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	129.9	-179.3	-61.7	-71.2	0	0	0	109.8	L192 L193 Y194 V343 L346 A347 K351 P352 M356	L192-I354 HydrophobicContact CD2-CG2 4.27Å; L193-I354 WeakPolarHBondContact O-CA 3.36Å; Y194-I354 HydrophobicContact CD2-CD1 3.45Å; Y194-I354 VanDerWaalsContact CD2-CD1 3.45Å; Y194-I354 HydrophobicContact CD2-CG1 4.34Å; Y194-I354 HydrophobicContact CE2-CD1 4.44Å; Y194-I354 HydrophobicContact CG-CD1 3.89Å; V343-I354 HydrophobicContact CG1-CD1 3.66Å; L346-I354 HydrophobicContact CB-CD1 4.25Å; L346-I354 HydrophobicContact CB-CG1 3.58Å; L346-I354 HydrophobicContact CD1-CG1 4.42Å; A347-I354 HydrophobicContact CB-CG2 3.92Å; K351-I354 PolarHBondContact O-N 2.95Å; P352-I354 PolarHBondContact O-N 2.74Å; I354-M356 HydrophobicContact CG2-CG 4.11Å
355	L	90.4	Very high	88.7	Confident	90 Å²	90	68.8 Å²	68.8	47%	0.471	38%	0.375	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	119.2	167.7	179.5	62.2	0	0	0	109.2	L193 M357	L193-L355 HydrophobicContact CB-CB 4.25Å; L193-L355 HydrophobicContact CD2-CD2 4.33Å; L193-L355 PolarHBondContact N-O 2.72Å; L193-L355 PolarHBondContact O-N 3.23Å; L355-M357 HydrophobicContact CD2-CE 3.34Å; L355-M357 HydrophobicContact CG-CE 3.95Å; L355-M357 HydrophobicContact CG-CG 4.35Å
356	M	89.4	Confident	87.8	Confident	59 Å²	59	70.8 Å²	70.8	29%	0.291	38%	0.384	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.4	129.6	174.9	-57.9	-168.5	-79.3	0	0	109.6	L192 A347 H350 I354 V360 F362	L192-M356 HydrophobicContact CD2-CB 4.13Å; L192-M356 HydrophobicContact CD2-CG 3.55Å; L192-M356 HydrophobicContact CD2-SD 4.34Å; A347-M356 HydrophobicContact CB-SD 4.42Å; H350-M356 WeakPolarHBondContact CD2-CE 3.11Å; H350-M356 WeakPolarHBondContact NE2-CE 3.2Å; I354-M356 HydrophobicContact CG2-CG 4.11Å; M356-V360 HydrophobicContact CB-CG2 4.26Å; M356-V360 HydrophobicContact SD-CB 4.43Å; M356-F362 HydrophobicContact SD-CE2 4.35Å; M356-F362 HydrophobicContact SD-CZ 3.85Å
357	M	85.9	Confident	86.6	Confident	59 Å²	59	70.8 Å²	70.8	29%	0.291	39%	0.386	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	137	177.8	-61.2	-165.3	-173.8	0	0	110.7	S190 A191 L316 L355	S190-M357 CarbonylContact C-O 3.59Å; S190-M357 WeakPolarHBondContact CA-O 3.44Å; S190-M357 WeakPolarHBondContact CB-O 3.26Å; A191-M357 PolarHBondContact N-O 2.88Å; A191-M357 PolarHBondContact O-N 2.79Å; L316-M357 HydrophobicContact CD1-CE 3.56Å; L316-M357 HydrophobicContact CD1-SD 3.47Å; L316-M357 WeakPolarHBondContact CD1-SD 3.39Å; L316-M357 HydrophobicContact CD2-CE 4.32Å; L316-M357 HydrophobicContact CD2-SD 3.3Å; L316-M357 WeakPolarHBondContact CD2-SD 3.26Å; L316-M357 HydrophobicContact CG-SD 4.01Å; L355-M357 HydrophobicContact CD2-CE 3.34Å; L355-M357 HydrophobicContact CG-CE 3.95Å; L355-M357 HydrophobicContact CG-CG 4.35Å
358	G	83.9	Confident	85.4	Confident	64 Å²	64	79.5 Å²	79.5	66%	0.66	43%	0.427	S	S	*	.	S	Bend	trans	73.3	-162.3	-172.3	0	0	0	0	0	112.5	V360	G358-V360 PolarHBondContact O-N 2.83Å
359	N	81.1	Confident	84.4	Confident	126 Å²	126	79.9 Å²	79.9	67%	0.674	44%	0.437	S	S	*	.			trans	-94.7	84.4	-178.4	-170.2	17.3	0	0	0	110.9
360	V	82.3	Confident	83.5	Confident	19 Å²	19	76.6 Å²	76.6	12%	0.115	43%	0.427	C	S	.	.			trans	-80.6	127	176.5	-177.9	0	0	0	0	109.6	V184 L192 M356 G358	V184-V360 HydrophobicContact CG2-CG1 3.24Å; L192-V360 HydrophobicContact CD2-CG1 4.23Å; L192-V360 HydrophobicContact CD2-CG2 4.13Å; M356-V360 HydrophobicContact CB-CG2 4.26Å; M356-V360 HydrophobicContact SD-CB 4.43Å; G358-V360 PolarHBondContact O-N 2.83Å
361	S	89.6	Confident	82.9	Confident	34 Å²	34	72 Å²	72	24%	0.238	41%	0.41	C	S	.	.	B	Isolated β-bridge	trans	-116.3	148.9	175.8	81.8	0	0	0	0	111.7	V184 Y185 S363	V184-S361 WeakPolarHBondContact CA-O 3.43Å; Y185-S361 WeakPolarHBondContact CB-OG 3.43Å; Y185-S361 PolarHBondContact N-O 3Å; S361-S363 VanDerWaalsContact C-N 3.33Å; S361-S363 PolarHBondContact O-N 3.11Å; S361-S363 PolarHBondContact OG-O 3.39Å
362	F	90.5	Very high	82.2	Confident	62 Å²	62	71.9 Å²	71.9	27%	0.272	42%	0.417	S	S	.	.	S	Bend	trans	-99.3	29.5	-177.6	-61.7	-79.6	0	0	0	113	V183 A347 K348 M356	V183-F362 CarbonylContact O-C 3.53Å; V183-F362 WeakPolarHBondContact O-CA 3.43Å; A347-F362 HydrophobicContact CB-CE1 3.97Å; A347-F362 HydrophobicContact CB-CZ 4.11Å; K348-F362 VanDerWaalsContact CA-CZ 3.45Å; K348-F362 HydrophobicContact CB-CD1 3.94Å; K348-F362 HydrophobicContact CB-CE1 3.75Å; K348-F362 HydrophobicContact CB-CG 4.45Å; K348-F362 HydrophobicContact CB-CZ 4.11Å; K348-F362 HydrophobicContact CG-CD1 4.2Å; K348-F362 HydrophobicContact CG-CD2 4.5Å; K348-F362 HydrophobicContact CG-CE1 4.41Å; K348-F362 HydrophobicContact CG-CG 4.24Å; M356-F362 HydrophobicContact SD-CE2 4.35Å; M356-F362 HydrophobicContact SD-CZ 3.85Å
363	S	88.4	Confident	81.5	Confident	77 Å²	77	69 Å²	69	54%	0.538	40%	0.397	S	S	.	.	S	Bend	trans	-138.5	134.7	177.9	60.2	0	0	0	0	109.3	Y185 S361 P365	Y185-S363 WeakPolarHBondContact CB-O 2.74Å; S361-S363 VanDerWaalsContact C-N 3.33Å; S361-S363 PolarHBondContact O-N 3.11Å; S361-S363 PolarHBondContact OG-O 3.39Å; S363-P365 WeakPolarHBondContact O-CD 3.18Å
364	C	87.6	Confident	80.7	Confident	39 Å²	39	70.4 Å²	70.4	26%	0.264	40%	0.402	S	S	.	.	P	Polyproline II helix	trans	-87.6	117.5	176.8	-170.1	0	0	0	0	110.6	V183 W272 C332	V183-C364 HydrophobicContact CG1-CB 3.87Å; W272-C364 HydrophobicContact CZ2-CB 4.42Å; C332-C364 HydrophobicContact CB-CB 3.8Å; C332-C364 WeakPolarHBondContact CB-SG 3.31Å; C332-C364 WeakPolarHBondContact SG-CA 3.38Å; C332-C364 WeakPolarHBondContact SG-CB 2.86Å; C332-C364 CovalentContact SG-SG 2.03Å; C332-C364 PolarHBondContact SG-SG 2.8Å
365	P	84.3	Confident	78.9	Confident	56 Å²	56	73.1 Å²	73.1	36%	0.364	42%	0.417	S	S	.	.	P	Polyproline II helix	trans	-64.5	141.3	178	25.1	-31.8	0	0	0	111.1	Y185 S363	Y185-P365 VanDerWaalsContact CD2-CD 3.4Å; Y185-P365 HydrophobicContact CD2-CG 3.7Å; Y185-P365 HydrophobicContact CE2-CG 3.51Å; Y185-P365 HydrophobicContact CG-CG 4.27Å; S363-P365 WeakPolarHBondContact O-CD 3.18Å
366	Q	72.9	Confident	77.2	Confident	118 Å²	118	70 Å²	70	55%	0.551	40%	0.403	S	S	*	.	P	Polyproline II helix	trans	-81.6	129.7	173.1	-71.7	-173.4	-3.1	0	0	110.2	D115	D115-Q366 PolarHBondContact O-NE2 2.96Å
367	P	66.8	Low	75.6	Confident	28 Å²	28	69.1 Å²	69.1	18%	0.182	40%	0.402	C	S	.	.	P	Polyproline II helix	trans	-68.8	137.9	179.1	23.3	-27.8	0	0	0	111.2	M215 Q270	M215-P367 HydrophobicContact SD-CB 4.46Å; Q270-P367 HydrophobicContact CB-CG 4.39Å
368	Q	66.8	Low	74.4	Confident	184 Å²	184	71 Å²	71	86%	0.86	41%	0.405	S	S	*	.	S	Bend	trans	-78.4	-24.4	179.2	-69.8	-172.5	-6.9	0	0	112.9
369	T	70.2	Confident	73.6	Confident	100 Å²	100	69.8 Å²	69.8	61%	0.613	39%	0.387	S	S	*	.			trans	-111.7	136.9	-179.4	52	0	0	0	0	110.7	Q270	Q270-T369 PolarHBondContact OE1-O 3.49Å
370	V	71.5	Confident	73.5	Confident	55 Å²	55	69.9 Å²	69.9	33%	0.333	38%	0.379	S	S	.	.			trans	-115	126.3	179.3	179.1	0	0	0	0	109.3	R118 N119	R118-V370 HydrophobicContact CB-CG2 3.7Å; N119-V370 HydrophobicContact CB-CG1 3.98Å; N119-V370 HydrophobicContact CB-CG2 4.17Å
371	P	78.3	Confident	73.5	Confident	40 Å²	40	72 Å²	72	26%	0.26	39%	0.389	S	S	.	.			trans	-73.2	139.2	177.5	30.1	-34	0	0	0	111.5	W453	P371-W453 HydrophobicContact CB-CH2 3.75Å; P371-W453 HydrophobicContact CB-CZ2 3.89Å
372	V	77.6	Confident	73.3	Confident	94 Å²	94	72.6 Å²	72.6	57%	0.57	40%	0.397	S	S	*	.			trans	-112.2	140.8	173.2	-178.5	0	0	0	0	109.1	F374	V372-F374 HydrophobicContact CG1-CE2 4.47Å
373	T	72.9	Confident	73	Confident	70 Å²	70	73.1 Å²	73.1	43%	0.429	40%	0.402	S	S	.	.			trans	-111.5	120.8	176.5	-55.2	0	0	0	0	109.9	L375 K792	T373-L375 HydrophobicContact CG2-CD2 3.84Å; T373-K792 PolarHBondContact OG1-NZ 2.9Å
374	F	72.5	Confident	72.9	Confident	87 Å²	87	74.8 Å²	74.8	38%	0.382	41%	0.411	S	S	.	.			trans	-84.6	110.3	168.3	-63.1	-95.5	0	0	0	108	V372 L381 F491	V372-F374 HydrophobicContact CG1-CE2 4.47Å; F374-L381 HydrophobicContact CE1-CB 3.87Å; F374-L381 HydrophobicContact CZ-CB 3.8Å; F374-F491 HydrophobicContact CE1-CB 4.17Å; F374-F491 WeakPolarHBondContact CE1-O 3.46Å; F374-F491 HydrophobicContact CE2-CB 4.37Å; F374-F491 HydrophobicContact CZ-CB 3.57Å
375	L	54.9	Low	72.5	Confident	75 Å²	75	73.5 Å²	73.5	39%	0.393	41%	0.405	S	S	.	.			trans	-79.1	-26.9	-173.2	-66.3	173.1	0	0	0	112.6	T373 M805	T373-L375 HydrophobicContact CG2-CD2 3.84Å; L375-M805 HydrophobicContact CD1-SD 4.49Å
376	S	53.3	Low	72.2	Confident	25 Å²	25	75.5 Å²	75.5	18%	0.175	41%	0.412	C	S	.	.	S	Bend	trans	-133.3	161.8	-179.8	89.8	0	0	0	0	113.5	R378 S379 E788	S376-R378 PolarHBondContact O-N 2.75Å; S376-R378 PolarHBondContact OG-N 2.93Å; S376-S379 PolarHBondContact N-OG 3.3Å; S376-S379 WeakPolarHBondContact O-CB 3.12Å; S376-S379 PolarHBondContact O-N 2.76Å; S376-S379 VanDerWaalsContact O-N 3.12Å; S376-S379 PolarHBondContact O-OG 3.26Å; S376-S379 PolarHBondContact OG-N 2.92Å; S376-S379 PolarHBondContact OG-OG 2.81Å; S376-S379 VanDerWaalsContact OG-OG 3.12Å; S376-E788 WeakPolarHBondContact CB-OE1 3.33Å
377	S	57.3	Low	72.1	Confident	39 Å²	39	73.3 Å²	73.3	27%	0.273	41%	0.41	S	S	.	.	T	Hydrogen-bonded Turn	trans	-52.7	-28.7	173	56.5	0	0	0	0	113.6	A493 S519 D722	S377-A493 WeakPolarHBondContact O-CB 3.28Å; S377-S519 VanDerWaalsContact C-OG 3.29Å; S377-S519 WeakPolarHBondContact CA-OG 3.47Å; S377-S519 WeakPolarHBondContact CB-OG 3.11Å; S377-S519 PolarHBondContact O-OG 2.04Å; S377-D722 PolarHBondContact OG-OD2 2.83Å
378	R	59.7	Low	72.1	Confident	98 Å²	98	74.7 Å²	74.7	37%	0.37	43%	0.429	S	S	.	.	T	Hydrogen-bonded Turn	trans	-102.1	0.5	-178	-53.4	-173.8	-171.8	-157.6	3.8	114.3	S376	S376-R378 PolarHBondContact O-N 2.75Å; S376-R378 PolarHBondContact OG-N 2.93Å
379	S	67.2	Low	72.5	Confident	40 Å²	40	69.1 Å²	69.1	28%	0.28	40%	0.403	S	S	.	.			trans	-74.2	137.2	177.4	-61.8	0	0	0	0	109.5	S376 G492	S376-S379 PolarHBondContact N-OG 3.3Å; S376-S379 WeakPolarHBondContact O-CB 3.12Å; S376-S379 PolarHBondContact O-N 2.76Å; S376-S379 VanDerWaalsContact O-N 3.12Å; S376-S379 PolarHBondContact O-OG 3.26Å; S376-S379 PolarHBondContact OG-N 2.92Å; S376-S379 PolarHBondContact OG-OG 2.81Å; S376-S379 VanDerWaalsContact OG-OG 3.12Å; S379-G492 WeakPolarHBondContact O-CA 3.16Å
380	Y	79	Confident	72.9	Confident	127 Å²	127	70.1 Å²	70.1	50%	0.498	41%	0.405	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.5	158.7	174.2	76.5	-85.8	0	0	0	113	A382 Y490 F491 L494	Y380-A382 HydrophobicContact CE2-CB 4.4Å; Y380-Y490 HydrophobicContact CD2-CD1 4.13Å; Y380-Y490 HydrophobicContact CE2-CD1 4.34Å; Y380-F491 CarbonylContact C-O 3.38Å; Y380-F491 WeakPolarHBondContact CA-O 2.96Å; Y380-F491 VanDerWaalsContact CB-O 3.29Å; Y380-F491 WeakPolarHBondContact CB-O 3.09Å; Y380-L494 HydrophobicContact CD1-CD1 4.19Å; Y380-L494 HydrophobicContact CD2-CD1 3.85Å; Y380-L494 HydrophobicContact CE1-CD1 3.95Å; Y380-L494 HydrophobicContact CE2-CD1 3.57Å; Y380-L494 HydrophobicContact CG-CD1 4.15Å
381	L	83.3	Confident	73.5	Confident	63 Å²	63	71.6 Å²	71.6	33%	0.33	41%	0.407	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	120.1	175.3	177.4	68.3	0	0	0	108.3	F374 L383 Y490 F491	F374-L381 HydrophobicContact CE1-CB 3.87Å; F374-L381 HydrophobicContact CZ-CB 3.8Å; L381-L383 HydrophobicContact CD1-CD2 4.34Å; L381-L383 HydrophobicContact CD2-CD1 4.16Å; L381-L383 HydrophobicContact CD2-CD2 4.1Å; L381-L383 HydrophobicContact CD2-CG 4.15Å; L381-L383 HydrophobicContact CG-CD2 4.06Å; L381-L383 HydrophobicContact CG-CG 4.08Å; L381-Y490 WeakPolarHBondContact O-CA 3.14Å; L381-F491 HydrophobicContact CB-CB 4.33Å; L381-F491 PolarHBondContact N-O 2.82Å; L381-F491 PolarHBondContact O-N 2.88Å
382	A	83.5	Confident	73.9	Confident	48 Å²	48	69.7 Å²	69.7	40%	0.397	39%	0.394	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.1	126.6	174.3	0	0	0	0	0	109.7	Y380 T488 Y489 Y490	Y380-A382 HydrophobicContact CE2-CB 4.4Å; A382-T488 HydrophobicContact CB-CG2 4.04Å; A382-Y489 CarbonylContact C-O 3.55Å; A382-Y489 WeakPolarHBondContact CA-O 3.38Å; A382-Y490 HydrophobicContact CB-CD1 3.82Å; A382-Y490 HydrophobicContact CB-CE1 3.79Å
383	L	85.5	Confident	74.4	Confident	73 Å²	73	68 Å²	68	38%	0.382	39%	0.387	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	144.2	178.3	-64	179.5	0	0	0	109.9	L381 G385 T488 Y489 F491	L381-L383 HydrophobicContact CD1-CD2 4.34Å; L381-L383 HydrophobicContact CD2-CD1 4.16Å; L381-L383 HydrophobicContact CD2-CD2 4.1Å; L381-L383 HydrophobicContact CD2-CG 4.15Å; L381-L383 HydrophobicContact CG-CD2 4.06Å; L381-L383 HydrophobicContact CG-CG 4.08Å; L383-G385 PolarHBondContact O-N 2.7Å; L383-T488 CarbonylContact O-C 3.6Å; L383-T488 WeakPolarHBondContact O-CA 3.34Å; L383-T488 WeakPolarHBondContact O-CG2 3.29Å; L383-Y489 PolarHBondContact N-O 2.99Å; L383-Y489 PolarHBondContact O-N 2.89Å; L383-F491 HydrophobicContact CD1-CD2 4.08Å; L383-F491 HydrophobicContact CD1-CE2 3.83Å
384	P	84.9	Confident	75.2	Confident	111 Å²	111	65.4 Å²	65.4	72%	0.721	37%	0.371	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-61.7	136.2	176.1	26	-33.1	0	0	0	110.9
385	G	79.6	Confident	76.1	Confident	13 Å²	13	65.8 Å²	65.8	13%	0.134	38%	0.381	C	S	.	.			trans	-92.2	167.4	172.9	0	0	0	0	0	112.2	L383 S387 D487	L383-G385 PolarHBondContact O-N 2.7Å; G385-S387 PolarHBondContact O-N 2.82Å; G385-D487 PolarHBondContact N-O 3.45Å
386	N	77.8	Confident	77.8	Confident	97 Å²	97	63.8 Å²	63.8	52%	0.519	37%	0.369	S	S	.	.			trans	-93.7	81.8	176.3	-73.7	7.8	0	0	0	109.6	E389	N386-E389 HydrophobicContact CB-CG 4.44Å; N386-E389 PolarHBondContact ND2-OE1 3.16Å; N386-E389 VanDerWaalsContact ND2-OE1 3.09Å
387	S	71.6	Confident	79.5	Confident	72 Å²	72	68.2 Å²	68.2	50%	0.503	39%	0.387	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.7	133.6	179.3	63.1	0	0	0	0	112.4	G385 S485 D487	G385-S387 PolarHBondContact O-N 2.82Å; S387-S485 WeakPolarHBondContact CA-O 3.05Å; S387-D487 WeakPolarHBondContact CB-OD1 3.34Å
388	G	65.8	Low	81.1	Confident	58 Å²	58	67.2 Å²	67.2	60%	0.598	38%	0.378	S	S	*	.	T	Hydrogen-bonded Turn	trans	90.1	10.3	175.8	0	0	0	0	0	115.3	D484	G388-D484 WeakPolarHBondContact CA-OD1 3.44Å; G388-D484 PolarHBondContact N-OD1 3.36Å
389	E	75.6	Confident	82.3	Confident	67 Å²	67	65.2 Å²	65.2	31%	0.313	37%	0.37	S	S	.	.			trans	-90.7	131.7	164.3	-73	-169	-148.8	0	0	110.5	N386 K391 S485	N386-E389 HydrophobicContact CB-CG 4.44Å; N386-E389 PolarHBondContact ND2-OE1 3.16Å; N386-E389 VanDerWaalsContact ND2-OE1 3.09Å; E389-K391 HydrophobicContact CB-CG 4.38Å; E389-K391 PolarHBondContact O-N 3.34Å; E389-K391 WeakPolarHBondContact OE2-CE 3.49Å; E389-K391 IonicContact OE2-NZ 3.9Å; E389-S485 PolarHBondContact O-N 3.08Å
390	D	78.4	Confident	83	Confident	121 Å²	121	64.8 Å²	64.8	65%	0.647	37%	0.366	S	S	*	.	S	Bend	trans	-70.1	23.1	173.9	-59.6	-21.1	0	0	0	113.6	I483	D390-I483 CarbonylContact C-O 3.5Å; D390-I483 WeakPolarHBondContact CA-O 3.39Å
391	K	84.4	Confident	82.6	Confident	85 Å²	85	63.4 Å²	63.4	37%	0.37	36%	0.36	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.9	146.8	177.5	68.4	179.7	-178.5	178.7	0	110.4	E389 A460 K461 I483	E389-K391 HydrophobicContact CB-CG 4.38Å; E389-K391 PolarHBondContact O-N 3.34Å; E389-K391 WeakPolarHBondContact OE2-CE 3.49Å; E389-K391 IonicContact OE2-NZ 3.9Å; K391-A460 CarbonylContact C-O 3.54Å; K391-A460 VanDerWaalsContact CA-O 3.26Å; K391-A460 WeakPolarHBondContact CA-O 3.36Å; K391-K461 HydrophobicContact CB-CG 3.85Å; K391-I483 PolarHBondContact N-O 2.92Å
392	V	87	Confident	81.9	Confident	0 Å²	0	63.9 Å²	63.9	0%	0	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.6	130	161.6	-179.6	0	0	0	0	107.2	V394 L412 F419 F458 S459 A460 I483 Y489	V392-V394 HydrophobicContact CG1-CG2 4.26Å; V392-L412 HydrophobicContact CG2-CD2 4.05Å; V392-F419 HydrophobicContact CB-CE1 4.45Å; V392-F419 HydrophobicContact CG1-CD1 4.28Å; V392-F419 HydrophobicContact CG1-CE1 3.71Å; V392-F419 HydrophobicContact CG1-CE2 4.18Å; V392-F419 HydrophobicContact CG1-CZ 3.65Å; V392-F419 HydrophobicContact CG2-CD1 4.14Å; V392-F419 HydrophobicContact CG2-CE1 3.91Å; V392-F458 HydrophobicContact CG1-CE2 3.77Å; V392-F458 HydrophobicContact CG1-CZ 4.25Å; V392-S459 CarbonylContact O-C 3.53Å; V392-S459 WeakPolarHBondContact O-CA 3.23Å; V392-S459 WeakPolarHBondContact O-CB 3.46Å; V392-A460 HydrophobicContact CB-CB 4.37Å; V392-A460 PolarHBondContact N-O 3Å; V392-A460 PolarHBondContact O-N 3.04Å; V392-I483 HydrophobicContact CG2-CG2 3.85Å; V392-Y489 HydrophobicContact CG1-CE1 4.5Å
393	S	88.8	Confident	81.3	Confident	58 Å²	58	70.5 Å²	70.5	41%	0.406	38%	0.377	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.5	117	174.7	-171.7	0	0	0	0	109.3	F458	S393-F458 WeakPolarHBondContact CA-O 3.42Å
394	V	90.1	Very high	80.8	Confident	16 Å²	16	69 Å²	69	10%	0.097	38%	0.375	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.2	133	-179.3	-175.2	0	0	0	0	109.3	V392 F396 L408 S457 F458 Y489 F491	V392-V394 HydrophobicContact CG1-CG2 4.26Å; V394-F396 HydrophobicContact CG1-CD1 4.18Å; V394-L408 HydrophobicContact CB-CD2 4.25Å; V394-L408 HydrophobicContact CG1-CD2 3.97Å; V394-L408 HydrophobicContact CG2-CD2 4.22Å; V394-S457 WeakPolarHBondContact O-CA 3.4Å; V394-F458 HydrophobicContact CB-CD1 4.26Å; V394-F458 HydrophobicContact CB-CE1 3.57Å; V394-F458 HydrophobicContact CB-CZ 3.76Å; V394-F458 HydrophobicContact CG1-CE1 4.26Å; V394-F458 HydrophobicContact CG2-CE1 4.1Å; V394-F458 HydrophobicContact CG2-CZ 3.77Å; V394-F458 PolarHBondContact N-O 3.01Å; V394-F458 PolarHBondContact O-N 2.82Å; V394-Y489 HydrophobicContact CG2-CD2 4.32Å; V394-Y489 HydrophobicContact CG2-CE2 3.92Å; V394-F491 HydrophobicContact CG1-CZ 4.31Å
395	T	90.7	Very high	80.3	Confident	96 Å²	96	64.3 Å²	64.3	59%	0.589	35%	0.347	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-127.4	128.9	177.9	-51.3	0	0	0	0	109.2	V456 S457	T395-V456 CarbonylContact C-O 3.55Å; T395-V456 VanDerWaalsContact CA-O 3.3Å; T395-V456 WeakPolarHBondContact CA-O 3.45Å; T395-S457 PolarHBondContact OG1-OG 3Å
396	F	90.6	Very high	80.3	Confident	33 Å²	33	64.7 Å²	64.7	15%	0.145	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.4	170.3	178.3	67.1	-81.5	0	0	0	110.6	V394 F398 L421 V456 F491	V394-F396 HydrophobicContact CG1-CD1 4.18Å; F396-F398 HydrophobicContact CD2-CB 4.26Å; F396-F398 HydrophobicContact CE2-CB 3.97Å; F396-F398 HydrophobicContact CE2-CD1 4.14Å; F396-F398 HydrophobicContact CE2-CG 4.29Å; F396-L421 HydrophobicContact CE1-CD2 3.64Å; F396-L421 HydrophobicContact CZ-CD2 3.55Å; F396-V456 HydrophobicContact CD1-CB 4.39Å; F396-V456 HydrophobicContact CE1-CB 4.07Å; F396-V456 HydrophobicContact CE1-CG1 3.93Å; F396-V456 HydrophobicContact CE2-CB 4.4Å; F396-V456 HydrophobicContact CE2-CG2 4.49Å; F396-V456 HydrophobicContact CZ-CB 4.07Å; F396-V456 HydrophobicContact CZ-CG1 4.06Å; F396-V456 HydrophobicContact CZ-CG2 4.41Å; F396-V456 PolarHBondContact N-O 3.45Å; F396-V456 PolarHBondContact O-N 2.81Å; F396-F491 HydrophobicContact CD1-CE1 4.14Å; F396-F491 HydrophobicContact CD2-CE1 4.25Å; F396-F491 HydrophobicContact CE1-CE1 4.37Å; F396-F491 HydrophobicContact CE2-CE1 4.47Å; F396-F491 HydrophobicContact CG-CE1 4.08Å
397	Q	89.7	Confident	80.7	Confident	118 Å²	118	61.7 Å²	61.7	55%	0.551	33%	0.329	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-116.4	144.1	170.1	-64.3	-178.9	-18.4	0	0	109.1	W453 H454	Q397-W453 HydrophobicContact CB-CE3 3.84Å; Q397-W453 HydrophobicContact CB-CZ3 4.17Å; Q397-H454 CarbonylContact C-O 3.53Å; Q397-H454 WeakPolarHBondContact CA-O 3.39Å
398	F	89.9	Confident	81.5	Confident	18 Å²	18	58.2 Å²	58.2	8%	0.079	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.5	158.1	174.3	81.4	-69.9	0	0	0	111.5	F396 T400 L407 L423 L428 L448 W453 H454 V456	F396-F398 HydrophobicContact CD2-CB 4.26Å; F396-F398 HydrophobicContact CE2-CB 3.97Å; F396-F398 HydrophobicContact CE2-CD1 4.14Å; F396-F398 HydrophobicContact CE2-CG 4.29Å; F398-T400 HydrophobicContact CD2-CG2 4.12Å; F398-T400 HydrophobicContact CE2-CG2 3.88Å; F398-L407 HydrophobicContact CD2-CD1 4.21Å; F398-L407 HydrophobicContact CE2-CD1 4.18Å; F398-L407 HydrophobicContact CG-CD1 4.47Å; F398-L407 HydrophobicContact CZ-CD1 4.42Å; F398-L423 HydrophobicContact CE2-CD1 4.48Å; F398-L423 HydrophobicContact CZ-CD1 4.45Å; F398-L428 HydrophobicContact CE1-CD1 3.71Å; F398-L428 HydrophobicContact CE1-CD2 4.46Å; F398-L428 HydrophobicContact CE1-CG 4.37Å; F398-L428 HydrophobicContact CZ-CD1 4.01Å; F398-L428 HydrophobicContact CZ-CD2 4.16Å; F398-L428 HydrophobicContact CZ-CG 4.19Å; F398-L448 HydrophobicContact CZ-CB 3.95Å; F398-L448 HydrophobicContact CZ-CD1 4.32Å; F398-W453 WeakPolarHBondContact O-CA 3.38Å; F398-H454 HydrophobicContact CD1-CB 4.25Å; F398-H454 HydrophobicContact CE1-CB 3.85Å; F398-H454 HydrophobicContact CZ-CB 4.49Å; F398-H454 PolarHBondContact N-O 2.96Å; F398-H454 PolarHBondContact O-N 2.71Å; F398-V456 HydrophobicContact CD1-CG2 3.46Å; F398-V456 VanDerWaalsContact CD1-CG2 3.46Å; F398-V456 HydrophobicContact CE1-CG2 3.36Å
399	R	84.4	Confident	82.5	Confident	56 Å²	56	55.7 Å²	55.7	21%	0.211	28%	0.278	C	S	.	.			trans	-140.8	138.7	167.4	64.2	177	176.2	-176	-4.3	109.2	D268 Q452 W453	D268-R399 VanDerWaalsContact CG-NH1 3.27Å; D268-R399 IonicContact OD1-CZ 2.67Å; D268-R399 IonicContact OD1-NH1 2.95Å; D268-R399 PolarHBondContact OD1-NH1 2.88Å; D268-R399 IonicContact OD1-NH2 2.66Å; D268-R399 PolarHBondContact OD1-NH2 3.49Å; D268-R399 IonicContact OD2-CZ 2.93Å; D268-R399 IonicContact OD2-NH1 3.71Å; D268-R399 PolarHBondContact OD2-NH1 2.94Å; R399-Q452 VanDerWaalsContact CA-O 3.31Å; R399-Q452 WeakPolarHBondContact CA-O 3.43Å; R399-Q452 WeakPolarHBondContact CB-O 3.23Å; R399-W453 HydrophobicContact CB-CD2 4.25Å; R399-W453 HydrophobicContact CB-CE3 4.25Å; R399-W453 HydrophobicContact CG-CD2 4.12Å; R399-W453 HydrophobicContact CG-CE3 4.2Å; R399-W453 HydrophobicContact CG-CH2 4.36Å; R399-W453 HydrophobicContact CG-CZ2 4.27Å; R399-W453 HydrophobicContact CG-CZ3 4.33Å
400	T	81.7	Confident	82.9	Confident	31 Å²	31	52.5 Å²	52.5	19%	0.19	26%	0.263	C	S	.	.			trans	-154.9	159.5	178.6	-171	0	0	0	0	111.4	F398 N402 L423 N449 G451	F398-T400 HydrophobicContact CD2-CG2 4.12Å; F398-T400 HydrophobicContact CE2-CG2 3.88Å; T400-N402 PolarHBondContact OG1-N 2.82Å; T400-N402 VanDerWaalsContact OG1-N 3.08Å; T400-L423 HydrophobicContact CG2-CD2 3.54Å; T400-N449 CarbonylContact O-C 3.59Å; T400-N449 WeakPolarHBondContact O-CA 3.16Å; T400-G451 PolarHBondContact O-N 3.08Å
401	W	71.5	Confident	83.1	Confident	98 Å²	98	50.4 Å²	50.4	37%	0.371	25%	0.249	S	C	.	.			trans	-103.4	-11.7	167.1	-64.7	105.7	0	0	0	112.1	D450 L719	W401-D450 WeakPolarHBondContact CH2-O 3.07Å; W401-D450 WeakPolarHBondContact CZ3-O 3.14Å; W401-L719 HydrophobicContact CB-CB 4.39Å; W401-L719 HydrophobicContact CB-CD1 3.93Å; W401-L719 HydrophobicContact CD2-CD1 3.57Å; W401-L719 HydrophobicContact CE3-CD1 3.49Å; W401-L719 VanDerWaalsContact CE3-CD1 3.49Å; W401-L719 HydrophobicContact CG-CD1 3.79Å; W401-L719 HydrophobicContact CZ3-CD1 4.17Å
402	N	68.9	Low	82.9	Confident	73 Å²	73	46.6 Å²	46.6	39%	0.39	23%	0.232	S	C	.	.			trans	-70.7	135	-177.8	-65.3	-4.1	0	0	0	109.8	T400 A404 L423 N449	T400-N402 PolarHBondContact OG1-N 2.82Å; T400-N402 VanDerWaalsContact OG1-N 3.08Å; N402-A404 VanDerWaalsContact C-N 3.34Å; N402-L423 WeakPolarHBondContact O-CD2 3.38Å; N402-N449 WeakPolarHBondContact O-CB 3.22Å
403	R	71.3	Confident	82.3	Confident	186 Å²	186	48.7 Å²	48.7	70%	0.702	24%	0.242	S	C	*	.	S	Bend	trans	-75.7	-24.7	179.8	-65.9	-175.2	-177.8	-176.2	3.2	113.1	K424 D425 G426	R403-K424 CarbonylContact O-C 3.43Å; R403-D425 WeakPolarHBondContact O-CA 3.35Å; R403-D425 PolarHBondContact O-N 2.97Å; R403-G426 PolarHBondContact O-N 3.4Å; R403-G426 VanDerWaalsContact O-N 3.1Å
404	A	73.4	Confident	81.3	Confident	41 Å²	41	56.9 Å²	56.9	34%	0.339	26%	0.264	S	S	.	.	S	Bend	trans	-140.8	155	176.2	0	0	0	0	0	110.4	N402 L423	N402-A404 VanDerWaalsContact C-N 3.34Å; A404-L423 CarbonylContact C-O 3.48Å; A404-L423 WeakPolarHBondContact CA-O 3.36Å
405	G	75.4	Confident	79.9	Confident	13 Å²	13	59.3 Å²	59.3	13%	0.134	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	167.5	143.1	176.6	0	0	0	0	0	113	L407 F422 L423 S519	G405-L407 PolarHBondContact O-N 2.75Å; G405-F422 WeakPolarHBondContact O-CA 3.16Å; G405-L423 PolarHBondContact N-O 3.2Å; G405-L423 PolarHBondContact O-N 2.87Å; G405-S519 WeakPolarHBondContact CA-O 3.11Å
406	H	79.3	Confident	78.8	Confident	22 Å²	22	56.8 Å²	56.8	10%	0.102	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.9	124.4	172.4	-168.7	-89.4	0	0	0	110.6	L408 F409 V420 G492	H406-L408 PolarHBondContact CE1-O 3.45Å; H406-F409 WeakPolarHBondContact CE1-CB 3.4Å; H406-F409 PolarHBondContact CE1-N 2.92Å; H406-V420 VanDerWaalsContact CD2-CG1 3.41Å; H406-V420 WeakPolarHBondContact CD2-CG1 3.42Å; H406-V420 WeakPolarHBondContact NE2-CG1 3.36Å; H406-G492 PolarHBondContact ND1-O 2.88Å
407	L	87	Confident	78.1	Confident	33 Å²	33	56 Å²	56	17%	0.173	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	-43.8	-176.9	-64.4	-178.5	0	0	0	112.5	F398 G405 L421 L423 L428 F491 G492	F398-L407 HydrophobicContact CD2-CD1 4.21Å; F398-L407 HydrophobicContact CE2-CD1 4.18Å; F398-L407 HydrophobicContact CG-CD1 4.47Å; F398-L407 HydrophobicContact CZ-CD1 4.42Å; G405-L407 PolarHBondContact O-N 2.75Å; L407-L421 WeakPolarHBondContact CB-O 3.46Å; L407-L421 PolarHBondContact N-O 3.19Å; L407-L423 HydrophobicContact CD1-CB 4.48Å; L407-L428 HydrophobicContact CD1-CD2 3.35Å; L407-F491 VanDerWaalsContact O-CA 3.23Å; L407-F491 WeakPolarHBondContact O-CA 3.27Å; L407-F491 WeakPolarHBondContact O-CD1 3.31Å; L407-G492 PolarHBondContact O-N 3.3Å
408	L	88.2	Confident	77.8	Confident	0 Å²	0	51.4 Å²	51.4	0%	0	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.3	134.3	-176.5	-178.7	67.5	0	0	0	111.7	V394 H406 F419 V420 L421 F458 Y490 F491	V394-L408 HydrophobicContact CB-CD2 4.25Å; V394-L408 HydrophobicContact CG1-CD2 3.97Å; V394-L408 HydrophobicContact CG2-CD2 4.22Å; H406-L408 PolarHBondContact CE1-O 3.45Å; L408-F419 HydrophobicContact CD2-CE2 4.04Å; L408-F419 HydrophobicContact CG-CE2 4.24Å; L408-V420 CarbonylContact O-C 3.5Å; L408-V420 WeakPolarHBondContact O-CA 3.44Å; L408-L421 HydrophobicContact CB-CB 4.12Å; L408-L421 PolarHBondContact N-O 3.07Å; L408-L421 PolarHBondContact O-N 2.89Å; L408-F458 HydrophobicContact CD2-CE1 3.46Å; L408-F458 VanDerWaalsContact CD2-CE1 3.46Å; L408-F458 HydrophobicContact CD2-CZ 3.57Å; L408-Y490 CarbonylContact C-O 3.58Å; L408-Y490 VanDerWaalsContact CA-O 3.31Å; L408-Y490 WeakPolarHBondContact CA-O 3.32Å; L408-Y490 WeakPolarHBondContact CD1-O 3.28Å; L408-F491 HydrophobicContact CB-CD1 4.46Å; L408-F491 HydrophobicContact CB-CE1 4.4Å; L408-F491 HydrophobicContact CD1-CD1 4.04Å; L408-F491 HydrophobicContact CD1-CD2 3.57Å; L408-F491 HydrophobicContact CD1-CE1 3.9Å; L408-F491 HydrophobicContact CD1-CE2 3.38Å; L408-F491 HydrophobicContact CD1-CG 3.89Å; L408-F491 HydrophobicContact CD1-CZ 3.57Å; L408-F491 HydrophobicContact CD2-CZ 4.31Å; L408-F491 HydrophobicContact CG-CZ 4.43Å
409	F	86.1	Confident	77.6	Confident	5 Å²	5	50.7 Å²	50.7	2%	0.022	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	143.1	171.7	165.4	-99.1	0	0	0	109.9	H406 E411 F419 V420 Y490 Y495 P524	H406-F409 WeakPolarHBondContact CE1-CB 3.4Å; H406-F409 PolarHBondContact CE1-N 2.92Å; F409-E411 HydrophobicContact CE1-CG 3.88Å; F409-E411 HydrophobicContact CZ-CG 3.65Å; F409-F419 WeakPolarHBondContact CA-O 3.3Å; F409-V420 HydrophobicContact CD2-CG2 4.09Å; F409-Y490 AromaticContact CD1-CD2 3.73Å; F409-Y490 HydrophobicContact CD1-CD2 3.73Å; F409-Y490 HydrophobicContact CD1-CE2 4.46Å; F409-Y490 HydrophobicContact CD1-CG 4.39Å; F409-Y490 HydrophobicContact CE1-CD2 4.2Å; F409-Y490 PolarHBondContact N-O 3.33Å; F409-Y490 PolarHBondContact O-N 3.01Å; F409-Y495 HydrophobicContact CD1-CE2 4.31Å; F409-Y495 AromaticContact CE1-CE2 3.89Å; F409-Y495 HydrophobicContact CE1-CE2 3.89Å; F409-Y495 WeakPolarHBondContact CE1-OH 3.48Å; F409-Y495 HydrophobicContact CZ-CE2 4.07Å; F409-P524 HydrophobicContact CD2-CG 4.34Å; F409-P524 HydrophobicContact CE2-CG 4.01Å; F409-P524 HydrophobicContact CZ-CG 4.46Å
410	G	83.4	Confident	77.6	Confident	0 Å²	0	48.1 Å²	48.1	0%	0	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.5	146.1	169.4	0	0	0	0	0	111.1	S418 F419	G410-S418 CarbonylContact O-C 3.57Å; G410-S418 WeakPolarHBondContact O-CA 3.26Å; G410-S418 WeakPolarHBondContact O-CB 3.22Å; G410-F419 PolarHBondContact N-O 2.76Å; G410-F419 VanDerWaalsContact N-O 3.08Å; G410-F419 PolarHBondContact O-N 3.18Å
411	E	82.3	Confident	78	Confident	77 Å²	77	46.6 Å²	46.6	36%	0.36	24%	0.24	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.4	151.3	170.4	-65.1	-174.6	173.4	0	0	110	F409 G486	F409-E411 HydrophobicContact CE1-CG 3.88Å; F409-E411 HydrophobicContact CZ-CG 3.65Å; E411-G486 WeakPolarHBondContact O-CA 3.4Å; E411-G486 PolarHBondContact O-N 3.41Å
412	L	81.9	Confident	78.7	Confident	4 Å²	4	42.4 Å²	42.4	2%	0.021	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.7	150	169.3	-58.6	176.3	0	0	0	109.3	V392 G415 S416 G417 F419 L432 I483 D484	V392-L412 HydrophobicContact CG2-CD2 4.05Å; L412-G415 PolarHBondContact O-N 3.02Å; L412-S416 WeakPolarHBondContact CB-OG 3.49Å; L412-G417 WeakPolarHBondContact CB-O 3.44Å; L412-G417 PolarHBondContact N-O 2.98Å; L412-F419 HydrophobicContact CD2-CD1 4.03Å; L412-L432 HydrophobicContact CD1-CD1 3.99Å; L412-I483 HydrophobicContact CD2-CG2 3.99Å; L412-D484 CarbonylContact C-O 3.57Å; L412-D484 VanDerWaalsContact CA-O 3.3Å; L412-D484 WeakPolarHBondContact CA-O 3.1Å
413	Q	74.6	Confident	79.6	Confident	45 Å²	45	39 Å²	39	21%	0.21	21%	0.206	C	C	.	.	G	3₁₀ helix	trans	-56.5	151.1	179.9	-73.4	-70.9	-20.9	0	0	112.3	G415 S416 D484 S485 D487	Q413-G415 PolarHBondContact O-N 2.85Å; Q413-S416 WeakPolarHBondContact O-CB 3.43Å; Q413-S416 PolarHBondContact O-N 3.2Å; Q413-S416 PolarHBondContact O-OG 3.15Å; Q413-D484 HydrophobicContact CB-CB 3.89Å; Q413-D484 WeakPolarHBondContact CB-OD2 3.46Å; Q413-D484 HydrophobicContact CG-CB 4.28Å; Q413-D484 PolarHBondContact N-O 3.37Å; Q413-S485 WeakPolarHBondContact CG-O 3.37Å; Q413-S485 PolarHBondContact NE2-O 3.06Å; Q413-D487 PolarHBondContact NE2-OD1 2.8Å
414	R	66.6	Low	80.1	Confident	229 Å²	229	34.7 Å²	34.7	86%	0.864	19%	0.192	S	C	*	.	G	3₁₀ helix	trans	60.2	21	179.7	-51.5	177.9	-175.8	-176.3	1.3	114.5	S416	R414-S416 PolarHBondContact O-N 3.07Å
415	G	60	Low	80.5	Confident	68 Å²	68	38.4 Å²	38.4	70%	0.701	21%	0.207	S	C	*	.	G	3₁₀ helix	trans	66.3	22.1	180	0	0	0	0	0	113.6	L412 Q413 G417	L412-G415 PolarHBondContact O-N 3.02Å; Q413-G415 PolarHBondContact O-N 2.85Å; G415-G417 PolarHBondContact O-N 2.97Å
416	S	67.7	Low	80.7	Confident	42 Å²	42	37.8 Å²	37.8	29%	0.294	20%	0.2	S	C	.	.			trans	-72.4	-11.5	-175.7	57.3	0	0	0	0	113.9	L412 Q413 R414	L412-S416 WeakPolarHBondContact CB-OG 3.49Å; Q413-S416 WeakPolarHBondContact O-CB 3.43Å; Q413-S416 PolarHBondContact O-N 3.2Å; Q413-S416 PolarHBondContact O-OG 3.15Å; R414-S416 PolarHBondContact O-N 3.07Å
417	G	77.3	Confident	81.2	Confident	18 Å²	18	41.6 Å²	41.6	19%	0.186	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	159.4	-165.9	-179.8	0	0	0	0	0	112.9	L412 G415 F433	L412-G417 WeakPolarHBondContact CB-O 3.44Å; L412-G417 PolarHBondContact N-O 2.98Å; G415-G417 PolarHBondContact O-N 2.97Å; G417-F433 CarbonylContact C-O 3.53Å; G417-F433 WeakPolarHBondContact CA-O 3.19Å
418	S	82	Confident	81.5	Confident	21 Å²	21	40 Å²	40	15%	0.147	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.8	162.3	175.8	60.6	0	0	0	0	110.7	G410 F433	G410-S418 CarbonylContact O-C 3.57Å; G410-S418 WeakPolarHBondContact O-CA 3.26Å; G410-S418 WeakPolarHBondContact O-CB 3.22Å; S418-F433 PolarHBondContact N-O 2.75Å; S418-F433 PolarHBondContact O-N 2.82Å
419	F	85.6	Confident	81.5	Confident	3 Å²	3	42.4 Å²	42.4	1%	0.013	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	149.3	169.9	68.7	-90.6	0	0	0	110.7	V392 L408 F409 G410 L412 L430 S431 L432 F458 Y489	V392-F419 HydrophobicContact CB-CE1 4.45Å; V392-F419 HydrophobicContact CG1-CD1 4.28Å; V392-F419 HydrophobicContact CG1-CE1 3.71Å; V392-F419 HydrophobicContact CG1-CE2 4.18Å; V392-F419 HydrophobicContact CG1-CZ 3.65Å; V392-F419 HydrophobicContact CG2-CD1 4.14Å; V392-F419 HydrophobicContact CG2-CE1 3.91Å; L408-F419 HydrophobicContact CD2-CE2 4.04Å; L408-F419 HydrophobicContact CG-CE2 4.24Å; F409-F419 WeakPolarHBondContact CA-O 3.3Å; G410-F419 PolarHBondContact N-O 2.76Å; G410-F419 VanDerWaalsContact N-O 3.08Å; G410-F419 PolarHBondContact O-N 3.18Å; L412-F419 HydrophobicContact CD2-CD1 4.03Å; F419-L430 HydrophobicContact CD2-CD1 4.32Å; F419-S431 CarbonylContact C-O 3.49Å; F419-S431 VanDerWaalsContact CA-O 3.31Å; F419-S431 WeakPolarHBondContact CA-O 3.41Å; F419-L432 HydrophobicContact CB-CD1 4.01Å; F419-F458 HydrophobicContact CD2-CE2 4.08Å; F419-F458 HydrophobicContact CD2-CZ 4.03Å; F419-F458 HydrophobicContact CE2-CE2 4.04Å; F419-F458 AromaticContact CE2-CZ 3.64Å; F419-F458 HydrophobicContact CE2-CZ 3.64Å; F419-F458 HydrophobicContact CZ-CZ 4.47Å; F419-Y489 HydrophobicContact CE1-CD1 4.33Å; F419-Y489 HydrophobicContact CE1-CE1 4.01Å; F419-Y489 AromaticContact CZ-CD1 3.68Å; F419-Y489 HydrophobicContact CZ-CD1 3.68Å; F419-Y489 AromaticContact CZ-CE1 3.61Å; F419-Y489 HydrophobicContact CZ-CE1 3.61Å
420	V	85.6	Confident	81.7	Confident	1 Å²	1	42.2 Å²	42.2	1%	0.006	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.2	122.5	-174	-176.9	0	0	0	0	108	H406 L408 F409 F422 L430 S431 F433	H406-V420 VanDerWaalsContact CD2-CG1 3.41Å; H406-V420 WeakPolarHBondContact CD2-CG1 3.42Å; H406-V420 WeakPolarHBondContact NE2-CG1 3.36Å; L408-V420 CarbonylContact O-C 3.5Å; L408-V420 WeakPolarHBondContact O-CA 3.44Å; F409-V420 HydrophobicContact CD2-CG2 4.09Å; V420-F422 HydrophobicContact CB-CD1 4.44Å; V420-F422 HydrophobicContact CG1-CD1 3.66Å; V420-F422 HydrophobicContact CG1-CE1 4.31Å; V420-L430 CarbonylContact O-C 3.37Å; V420-L430 WeakPolarHBondContact O-CA 3.42Å; V420-S431 PolarHBondContact N-O 2.83Å; V420-S431 PolarHBondContact O-N 2.92Å; V420-F433 HydrophobicContact CB-CE2 4.03Å; V420-F433 HydrophobicContact CG2-CD2 3.91Å; V420-F433 HydrophobicContact CG2-CE2 3.56Å
421	L	89.1	Confident	81.8	Confident	0 Å²	0	42.3 Å²	42.3	0%	0	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108	121.7	168.7	-178	71.7	0	0	0	108.6	F396 L407 L408 L428 L430 V456 F458	F396-L421 HydrophobicContact CE1-CD2 3.64Å; F396-L421 HydrophobicContact CZ-CD2 3.55Å; L407-L421 WeakPolarHBondContact CB-O 3.46Å; L407-L421 PolarHBondContact N-O 3.19Å; L408-L421 HydrophobicContact CB-CB 4.12Å; L408-L421 PolarHBondContact N-O 3.07Å; L408-L421 PolarHBondContact O-N 2.89Å; L421-L428 HydrophobicContact CD1-CD2 4.38Å; L421-L428 HydrophobicContact CG-CD2 4.41Å; L421-L430 HydrophobicContact CB-CD1 4.18Å; L421-L430 HydrophobicContact CD1-CB 3.89Å; L421-L430 HydrophobicContact CD1-CD1 4.43Å; L421-V456 HydrophobicContact CD2-CG1 4.23Å; L421-F458 HydrophobicContact CD2-CD1 4.02Å; L421-F458 HydrophobicContact CD2-CE1 4.09Å
422	F	86.9	Confident	81.9	Confident	9 Å²	9	38.9 Å²	38.9	4%	0.039	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.9	152.8	179.9	58.4	-86.1	0	0	0	111.4	G405 V420 K424 K429 S431 P521	G405-F422 WeakPolarHBondContact O-CA 3.16Å; V420-F422 HydrophobicContact CB-CD1 4.44Å; V420-F422 HydrophobicContact CG1-CD1 3.66Å; V420-F422 HydrophobicContact CG1-CE1 4.31Å; F422-K424 HydrophobicContact CD2-CB 4.05Å; F422-K424 HydrophobicContact CE2-CB 4.03Å; F422-K424 HydrophobicContact CE2-CD 4.32Å; F422-K429 WeakPolarHBondContact CD1-O 3.44Å; F422-K429 HydrophobicContact CD2-CB 4.28Å; F422-K429 HydrophobicContact CE1-CB 4.32Å; F422-K429 HydrophobicContact CE1-CD 4.37Å; F422-K429 HydrophobicContact CE1-CG 4.12Å; F422-K429 HydrophobicContact CE2-CB 3.83Å; F422-K429 HydrophobicContact CE2-CD 3.81Å; F422-K429 HydrophobicContact CE2-CG 4.08Å; F422-K429 HydrophobicContact CZ-CB 3.88Å; F422-K429 HydrophobicContact CZ-CD 3.47Å; F422-K429 VanDerWaalsContact CZ-CD 3.47Å; F422-K429 HydrophobicContact CZ-CG 3.66Å; F422-K429 PolarHBondContact N-O 3.19Å; F422-K429 PolarHBondContact O-N 2.75Å; F422-S431 WeakPolarHBondContact CE1-OG 3.44Å; F422-P521 HydrophobicContact CD2-CB 3.7Å; F422-P521 HydrophobicContact CE2-CB 3.75Å; F422-P521 WeakPolarHBondContact CE2-O 3.25Å; F422-P521 WeakPolarHBondContact CZ-O 3.18Å
423	L	86.9	Confident	81.6	Confident	2 Å²	2	40.8 Å²	40.8	1%	0.01	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86	132.1	169.8	-170.4	71	0	0	0	108.5	F398 T400 N402 A404 G405 L407 K427 L428 L448 N449	F398-L423 HydrophobicContact CE2-CD1 4.48Å; F398-L423 HydrophobicContact CZ-CD1 4.45Å; T400-L423 HydrophobicContact CG2-CD2 3.54Å; N402-L423 WeakPolarHBondContact O-CD2 3.38Å; A404-L423 CarbonylContact C-O 3.48Å; A404-L423 WeakPolarHBondContact CA-O 3.36Å; G405-L423 PolarHBondContact N-O 3.2Å; G405-L423 PolarHBondContact O-N 2.87Å; L407-L423 HydrophobicContact CD1-CB 4.48Å; L423-K427 WeakPolarHBondContact CA-O 3.49Å; L423-L428 HydrophobicContact CB-CD2 4.49Å; L423-L428 HydrophobicContact CD1-CD2 4.17Å; L423-L428 HydrophobicContact CD1-CG 4.4Å; L423-L448 HydrophobicContact CD1-CB 4.1Å; L423-L448 HydrophobicContact CD1-CD1 4.44Å; L423-N449 HydrophobicContact CD2-CB 4.37Å
424	K	82.6	Confident	81.6	Confident	95 Å²	95	40.1 Å²	40.1	41%	0.413	21%	0.208	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.8	120.2	174.5	-177.3	177.1	179.2	179.2	0	109.8	R403 F422 G426 K427 P521	R403-K424 CarbonylContact O-C 3.43Å; F422-K424 HydrophobicContact CD2-CB 4.05Å; F422-K424 HydrophobicContact CE2-CB 4.03Å; F422-K424 HydrophobicContact CE2-CD 4.32Å; K424-G426 PolarHBondContact O-N 2.73Å; K424-K427 PolarHBondContact N-O 2.85Å; K424-K427 PolarHBondContact O-N 2.88Å; K424-P521 HydrophobicContact CD-CB 4.29Å; K424-P521 HydrophobicContact CG-CB 4.45Å
425	D	81.1	Confident	81.4	Confident	120 Å²	120	33.6 Å²	33.6	64%	0.642	20%	0.203	S	C	*	.	T	Hydrogen-bonded Turn	trans	51.7	39.4	-179.1	-55.2	-49.4	0	0	0	112.6	R403 K427	R403-D425 WeakPolarHBondContact O-CA 3.35Å; R403-D425 PolarHBondContact O-N 2.97Å; D425-K427 VanDerWaalsContact C-N 3.29Å; D425-K427 PolarHBondContact O-N 3.25Å
426	G	81.4	Confident	81.4	Confident	0 Å²	0	34.7 Å²	34.7	0%	0	21%	0.214	C	C	.	.	T	Hydrogen-bonded Turn	trans	73.5	12.8	-178	0	0	0	0	0	115.2	R403 K424 A446 G447 L448 N449	R403-G426 PolarHBondContact O-N 3.4Å; R403-G426 VanDerWaalsContact O-N 3.1Å; K424-G426 PolarHBondContact O-N 2.73Å; G426-A446 CarbonylContact O-C 3.54Å; G426-G447 PolarHBondContact O-N 2.88Å; G426-L448 WeakPolarHBondContact O-CB 3.45Å; G426-L448 WeakPolarHBondContact O-CG 3.37Å; G426-L448 PolarHBondContact O-N 3.03Å; G426-N449 VanDerWaalsContact CA-OD1 3.29Å; G426-N449 WeakPolarHBondContact CA-OD1 3.2Å
427	K	89.8	Confident	81.3	Confident	101 Å²	101	37.5 Å²	37.5	44%	0.439	22%	0.222	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	145.4	174.7	-54.3	-171.5	177.5	-179.3	0	110.6	L423 K424 D425 T443 G445	L423-K427 WeakPolarHBondContact CA-O 3.49Å; K424-K427 PolarHBondContact N-O 2.85Å; K424-K427 PolarHBondContact O-N 2.88Å; D425-K427 VanDerWaalsContact C-N 3.29Å; D425-K427 PolarHBondContact O-N 3.25Å; K427-T443 HydrophobicContact CB-CG2 3.98Å; K427-T443 HydrophobicContact CD-CG2 4.35Å; K427-G445 WeakPolarHBondContact CG-O 3.48Å
428	L	91.7	Very high	80.6	Confident	0 Å²	0	40.2 Å²	40.2	0%	0	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.1	131.5	174.6	-80	175.7	0	0	0	110.5	F398 L407 L421 L423 T443 A444 L448 V456 V469	F398-L428 HydrophobicContact CE1-CD1 3.71Å; F398-L428 HydrophobicContact CE1-CD2 4.46Å; F398-L428 HydrophobicContact CE1-CG 4.37Å; F398-L428 HydrophobicContact CZ-CD1 4.01Å; F398-L428 HydrophobicContact CZ-CD2 4.16Å; F398-L428 HydrophobicContact CZ-CG 4.19Å; L407-L428 HydrophobicContact CD1-CD2 3.35Å; L421-L428 HydrophobicContact CD1-CD2 4.38Å; L421-L428 HydrophobicContact CG-CD2 4.41Å; L423-L428 HydrophobicContact CB-CD2 4.49Å; L423-L428 HydrophobicContact CD1-CD2 4.17Å; L423-L428 HydrophobicContact CD1-CG 4.4Å; L428-T443 CarbonylContact O-C 3.49Å; L428-T443 WeakPolarHBondContact O-CA 3.28Å; L428-T443 WeakPolarHBondContact O-CG2 3.45Å; L428-A444 PolarHBondContact N-O 3.3Å; L428-A444 PolarHBondContact O-N 3.13Å; L428-L448 HydrophobicContact CB-CD1 4.13Å; L428-L448 HydrophobicContact CD1-CD1 3.93Å; L428-L448 HydrophobicContact CG-CD1 3.61Å; L428-V456 HydrophobicContact CD1-CB 4.36Å; L428-V456 HydrophobicContact CD1-CG1 3.88Å; L428-V456 HydrophobicContact CD1-CG2 3.46Å; L428-V456 VanDerWaalsContact CD1-CG2 3.46Å; L428-V469 HydrophobicContact CB-CG2 4.35Å; L428-V469 HydrophobicContact CD1-CG1 4.38Å; L428-V469 HydrophobicContact CD1-CG2 3.67Å
429	K	89.2	Confident	80.2	Confident	50 Å²	50	41.6 Å²	41.6	22%	0.217	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	121.7	176.1	-177.3	169.8	172	-169	0	109.8	F422 N441 V442	F422-K429 WeakPolarHBondContact CD1-O 3.44Å; F422-K429 HydrophobicContact CD2-CB 4.28Å; F422-K429 HydrophobicContact CE1-CB 4.32Å; F422-K429 HydrophobicContact CE1-CD 4.37Å; F422-K429 HydrophobicContact CE1-CG 4.12Å; F422-K429 HydrophobicContact CE2-CB 3.83Å; F422-K429 HydrophobicContact CE2-CD 3.81Å; F422-K429 HydrophobicContact CE2-CG 4.08Å; F422-K429 HydrophobicContact CZ-CB 3.88Å; F422-K429 HydrophobicContact CZ-CD 3.47Å; F422-K429 VanDerWaalsContact CZ-CD 3.47Å; F422-K429 HydrophobicContact CZ-CG 3.66Å; F422-K429 PolarHBondContact N-O 3.19Å; F422-K429 PolarHBondContact O-N 2.75Å; K429-N441 WeakPolarHBondContact CE-ND2 3.03Å; K429-N441 PolarHBondContact NZ-ND2 2.92Å; K429-V442 WeakPolarHBondContact CA-O 3.13Å
430	L	89.7	Confident	80.1	Confident	1 Å²	1	45.5 Å²	45.5	1%	0.005	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.2	127.3	171	175.8	67.4	0	0	0	108.6	F419 V420 L421 N441 V442 F458 M465 V467	F419-L430 HydrophobicContact CD2-CD1 4.32Å; V420-L430 CarbonylContact O-C 3.37Å; V420-L430 WeakPolarHBondContact O-CA 3.42Å; L421-L430 HydrophobicContact CB-CD1 4.18Å; L421-L430 HydrophobicContact CD1-CB 3.89Å; L421-L430 HydrophobicContact CD1-CD1 4.43Å; L430-N441 CarbonylContact O-C 3.45Å; L430-N441 VanDerWaalsContact O-CA 3.28Å; L430-N441 WeakPolarHBondContact O-CA 3.46Å; L430-V442 HydrophobicContact CB-CG1 3.78Å; L430-V442 HydrophobicContact CD2-CG1 4.15Å; L430-V442 HydrophobicContact CG-CG1 4.37Å; L430-V442 PolarHBondContact N-O 2.76Å; L430-V442 PolarHBondContact O-N 2.58Å; L430-F458 HydrophobicContact CD1-CD2 4.05Å; L430-F458 HydrophobicContact CD1-CE2 4.06Å; L430-F458 HydrophobicContact CD2-CB 3.94Å; L430-F458 HydrophobicContact CD2-CD2 3.47Å; L430-F458 VanDerWaalsContact CD2-CD2 3.47Å; L430-F458 HydrophobicContact CD2-CE2 4.23Å; L430-F458 HydrophobicContact CD2-CG 3.89Å; L430-F458 HydrophobicContact CG-CD2 4.44Å; L430-M465 HydrophobicContact CB-SD 4.42Å; L430-M465 HydrophobicContact CD2-CG 3.48Å; L430-M465 VanDerWaalsContact CD2-CG 3.48Å; L430-M465 HydrophobicContact CD2-SD 3.37Å; L430-M465 WeakPolarHBondContact CD2-SD 3.22Å; L430-M465 HydrophobicContact CG-CG 4.33Å; L430-M465 HydrophobicContact CG-SD 3.56Å; L430-M465 VanDerWaalsContact CG-SD 3.56Å; L430-V467 HydrophobicContact CB-CG2 3.59Å; L430-V467 HydrophobicContact CD2-CG2 3.66Å; L430-V467 HydrophobicContact CG-CG2 4.3Å
431	S	84.9	Confident	80.1	Confident	3 Å²	3	48.2 Å²	48.2	2%	0.021	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	125.1	180	-72.6	0	0	0	0	110.1	F419 V420 F422 F433 R440 N441	F419-S431 CarbonylContact C-O 3.49Å; F419-S431 VanDerWaalsContact CA-O 3.31Å; F419-S431 WeakPolarHBondContact CA-O 3.41Å; V420-S431 PolarHBondContact N-O 2.83Å; V420-S431 PolarHBondContact O-N 2.92Å; F422-S431 WeakPolarHBondContact CE1-OG 3.44Å; S431-F433 VanDerWaalsContact CB-CE2 3.47Å; S431-R440 CarbonylContact C-O 3.6Å; S431-R440 WeakPolarHBondContact CA-O 3.47Å; S431-N441 WeakPolarHBondContact CB-OD1 3.27Å; S431-N441 PolarHBondContact OG-OD1 3.28Å
432	L	84.4	Confident	80.2	Confident	4 Å²	4	48.6 Å²	48.6	2%	0.021	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.4	124.2	172.3	-173.5	71	0	0	0	109.1	L412 F419 P439 R440 M465 L478 I483	L412-L432 HydrophobicContact CD1-CD1 3.99Å; F419-L432 HydrophobicContact CB-CD1 4.01Å; L432-P439 WeakPolarHBondContact O-CA 3.05Å; L432-R440 HydrophobicContact CB-CB 4.4Å; L432-R440 PolarHBondContact N-O 2.78Å; L432-R440 PolarHBondContact O-N 3.13Å; L432-M465 HydrophobicContact CB-SD 4.28Å; L432-L478 HydrophobicContact CD2-CD1 4.34Å; L432-I483 HydrophobicContact CD2-CD1 3.9Å
433	F	77.4	Confident	80.4	Confident	45 Å²	45	51.5 Å²	51.5	20%	0.197	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112	131.2	179.7	-62.7	-90.4	0	0	0	109.6	G417 S418 V420 S431 P439	G417-F433 CarbonylContact C-O 3.53Å; G417-F433 WeakPolarHBondContact CA-O 3.19Å; S418-F433 PolarHBondContact N-O 2.75Å; S418-F433 PolarHBondContact O-N 2.82Å; V420-F433 HydrophobicContact CB-CE2 4.03Å; V420-F433 HydrophobicContact CG2-CD2 3.91Å; V420-F433 HydrophobicContact CG2-CE2 3.56Å; S431-F433 VanDerWaalsContact CB-CE2 3.47Å; F433-P439 HydrophobicContact CD1-CB 3.85Å; F433-P439 HydrophobicContact CD1-CG 3.65Å; F433-P439 HydrophobicContact CE1-CB 3.67Å; F433-P439 HydrophobicContact CE1-CG 3.47Å; F433-P439 VanDerWaalsContact CE1-CG 3.47Å; F433-P439 HydrophobicContact CZ-CB 4.29Å; F433-P439 HydrophobicContact CZ-CG 4.47Å
434	Q	73.9	Confident	80.7	Confident	31 Å²	31	51.6 Å²	51.6	15%	0.145	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.4	148.7	176.9	-66.1	-171.2	-54.9	0	0	110.1	G436 Q437 L482	Q434-G436 PolarHBondContact O-N 3.44Å; Q434-Q437 PolarHBondContact O-N 3.38Å; Q434-L482 PolarHBondContact NE2-O 2.91Å
435	A	62.3	Low	81	Confident	92 Å²	92	47.9 Å²	47.9	76%	0.76	29%	0.287	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.6	124.6	-176.9	0	0	0	0	0	111.3	Q437	A435-Q437 VanDerWaalsContact C-N 3.33Å; A435-Q437 PolarHBondContact O-N 3.33Å
436	G	59.5	Low	81.4	Confident	90 Å²	90	45.6 Å²	45.6	93%	0.928	28%	0.284	S	S	*	.	T	Hydrogen-bonded Turn	trans	78	4.6	176.4	0	0	0	0	0	116.2	Q434	Q434-G436 PolarHBondContact O-N 3.44Å
437	Q	65.6	Low	81.7	Confident	102 Å²	102	47.5 Å²	47.5	48%	0.477	30%	0.304	S	S	.	.	S	Bend	trans	-119.3	152.8	178.4	-61.8	-167.7	24.6	0	0	112.8	Q434 A435	Q434-Q437 PolarHBondContact O-N 3.38Å; A435-Q437 VanDerWaalsContact C-N 3.33Å; A435-Q437 PolarHBondContact O-N 3.33Å
438	S	63.7	Low	81.7	Confident	75 Å²	75	43 Å²	43	52%	0.524	28%	0.284	S	S	.	.	P	Polyproline II helix	trans	-69.1	140.8	172.4	53.7	0	0	0	0	111.2	R440	S438-R440 PolarHBondContact O-N 2.87Å; S438-R440 PolarHBondContact O-NH1 2.68Å; S438-R440 PolarHBondContact OG-NH1 3.3Å
439	P	72.6	Confident	81.2	Confident	50 Å²	50	44.7 Å²	44.7	33%	0.325	29%	0.294	S	S	.	.	P	Polyproline II helix	trans	-57.9	130.8	-176.9	-22	31	0	0	0	111.7	L432 F433	L432-P439 WeakPolarHBondContact O-CA 3.05Å; F433-P439 HydrophobicContact CD1-CB 3.85Å; F433-P439 HydrophobicContact CD1-CG 3.65Å; F433-P439 HydrophobicContact CE1-CB 3.67Å; F433-P439 HydrophobicContact CE1-CG 3.47Å; F433-P439 VanDerWaalsContact CE1-CG 3.47Å; F433-P439 HydrophobicContact CZ-CB 4.29Å; F433-P439 HydrophobicContact CZ-CG 4.47Å
440	R	83.4	Confident	80.7	Confident	85 Å²	85	45 Å²	45	32%	0.321	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.2	127.4	175.7	-61.8	-68.5	179.7	-110.9	-1	108.5	S431 L432 S438 L478	S431-R440 CarbonylContact C-O 3.6Å; S431-R440 WeakPolarHBondContact CA-O 3.47Å; L432-R440 HydrophobicContact CB-CB 4.4Å; L432-R440 PolarHBondContact N-O 2.78Å; L432-R440 PolarHBondContact O-N 3.13Å; S438-R440 PolarHBondContact O-N 2.87Å; S438-R440 PolarHBondContact O-NH1 2.68Å; S438-R440 PolarHBondContact OG-NH1 3.3Å; R440-L478 HydrophobicContact CB-CD2 4.02Å; R440-L478 HydrophobicContact CG-CD2 3.98Å
441	N	86.8	Confident	79.9	Confident	58 Å²	58	45.3 Å²	45.3	31%	0.31	30%	0.301	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	141.8	-171.8	-60.9	-38.1	0	0	0	110.7	K429 L430 S431	K429-N441 WeakPolarHBondContact CE-ND2 3.03Å; K429-N441 PolarHBondContact NZ-ND2 2.92Å; L430-N441 CarbonylContact O-C 3.45Å; L430-N441 VanDerWaalsContact O-CA 3.28Å; L430-N441 WeakPolarHBondContact O-CA 3.46Å; S431-N441 WeakPolarHBondContact CB-OD1 3.27Å; S431-N441 PolarHBondContact OG-OD1 3.28Å
442	V	89.9	Confident	79.6	Confident	8 Å²	8	46.6 Å²	46.6	5%	0.048	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	140.5	163.4	67.6	0	0	0	0	108.2	K429 L430 M465 V467 A474 Q476	K429-V442 WeakPolarHBondContact CA-O 3.13Å; L430-V442 HydrophobicContact CB-CG1 3.78Å; L430-V442 HydrophobicContact CD2-CG1 4.15Å; L430-V442 HydrophobicContact CG-CG1 4.37Å; L430-V442 PolarHBondContact N-O 2.76Å; L430-V442 PolarHBondContact O-N 2.58Å; V442-M465 HydrophobicContact CB-CE 3.86Å; V442-M465 HydrophobicContact CG1-CE 3.63Å; V442-M465 HydrophobicContact CG1-CG 3.92Å; V442-M465 HydrophobicContact CG1-SD 4.12Å; V442-V467 HydrophobicContact CG1-CB 4.21Å; V442-V467 HydrophobicContact CG1-CG2 3.4Å; V442-A474 HydrophobicContact CG2-CB 3.6Å; V442-Q476 HydrophobicContact CB-CB 3.91Å; V442-Q476 HydrophobicContact CG2-CB 4.13Å
443	T	91.4	Very high	79.5	Confident	70 Å²	70	50.2 Å²	50.2	43%	0.429	32%	0.32	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	135.4	-177.9	-54.9	0	0	0	0	109.1	K427 L428 A474	K427-T443 HydrophobicContact CB-CG2 3.98Å; K427-T443 HydrophobicContact CD-CG2 4.35Å; L428-T443 CarbonylContact O-C 3.49Å; L428-T443 WeakPolarHBondContact O-CA 3.28Å; L428-T443 WeakPolarHBondContact O-CG2 3.45Å; T443-A474 VanDerWaalsContact O-CB 3.26Å; T443-A474 WeakPolarHBondContact O-CB 3.17Å
444	A	92.7	Very high	80.1	Confident	4 Å²	4	48.9 Å²	48.9	3%	0.033	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.8	153.4	-176.9	0	0	0	0	0	111.5	L428 V467 V469 A474	L428-A444 PolarHBondContact N-O 3.3Å; L428-A444 PolarHBondContact O-N 3.13Å; A444-V467 HydrophobicContact CB-CB 4.1Å; A444-V467 HydrophobicContact CB-CG1 3.79Å; A444-V469 HydrophobicContact CB-CG2 3.73Å; A444-A474 HydrophobicContact CB-CB 3.79Å
445	G	89.6	Confident	80.8	Confident	17 Å²	17	49.5 Å²	49.5	18%	0.175	32%	0.323	C	S	.	.			trans	71.2	173.9	177.8	0	0	0	0	0	115.4	K427 D472	K427-G445 WeakPolarHBondContact CG-O 3.48Å; G445-D472 PolarHBondContact N-OD2 2.98Å
446	A	90.5	Very high	82.3	Confident	71 Å²	71	45.1 Å²	45.1	59%	0.587	29%	0.286	S	S	*	.	S	Bend	trans	-156.4	143.1	175.6	0	0	0	0	0	111.5	G426 L448	G426-A446 CarbonylContact O-C 3.54Å; A446-L448 VanDerWaalsContact C-N 3.29Å; A446-L448 PolarHBondContact O-N 3.19Å
447	G	86.7	Confident	83.8	Confident	41 Å²	41	42.6 Å²	42.6	42%	0.423	25%	0.254	S	S	.	.			trans	68.8	24.6	177.6	0	0	0	0	0	114.3	G426 N449	G426-G447 PolarHBondContact O-N 2.88Å; G447-N449 PolarHBondContact O-N 3.36Å
448	L	89.3	Confident	85	Confident	5 Å²	5	37.8 Å²	37.8	3%	0.026	23%	0.232	C	C	.	.			trans	-70.7	7.1	-175	-54.6	171.7	0	0	0	114.3	F398 L423 G426 L428 A446 H454 V469	F398-L448 HydrophobicContact CZ-CB 3.95Å; F398-L448 HydrophobicContact CZ-CD1 4.32Å; L423-L448 HydrophobicContact CD1-CB 4.1Å; L423-L448 HydrophobicContact CD1-CD1 4.44Å; G426-L448 WeakPolarHBondContact O-CB 3.45Å; G426-L448 WeakPolarHBondContact O-CG 3.37Å; G426-L448 PolarHBondContact O-N 3.03Å; L428-L448 HydrophobicContact CB-CD1 4.13Å; L428-L448 HydrophobicContact CD1-CD1 3.93Å; L428-L448 HydrophobicContact CG-CD1 3.61Å; A446-L448 VanDerWaalsContact C-N 3.29Å; A446-L448 PolarHBondContact O-N 3.19Å; L448-H454 HydrophobicContact CD2-CB 4.48Å; L448-V469 HydrophobicContact CD1-CG1 3.91Å; L448-V469 HydrophobicContact CD2-CG1 3.65Å; L448-V469 HydrophobicContact CG-CG1 4.44Å
449	N	81.8	Confident	86.2	Confident	36 Å²	36	34.8 Å²	34.8	19%	0.193	21%	0.211	C	C	.	.			trans	-106	34.6	179	66.3	-70.3	0	0	0	111.7	T400 N402 L423 G426 G447	T400-N449 CarbonylContact O-C 3.59Å; T400-N449 WeakPolarHBondContact O-CA 3.16Å; N402-N449 WeakPolarHBondContact O-CB 3.22Å; L423-N449 HydrophobicContact CD2-CB 4.37Å; G426-N449 VanDerWaalsContact CA-OD1 3.29Å; G426-N449 WeakPolarHBondContact CA-OD1 3.2Å; G447-N449 PolarHBondContact O-N 3.36Å
450	D	78.8	Confident	86.9	Confident	57 Å²	57	32.6 Å²	32.6	31%	0.305	20%	0.197	S	C	.	.	S	Bend	trans	-95.5	6.7	-175.9	73.3	-9.3	0	0	0	113.7	W401 Q452 H454	W401-D450 WeakPolarHBondContact CH2-O 3.07Å; W401-D450 WeakPolarHBondContact CZ3-O 3.14Å; D450-Q452 PolarHBondContact O-N 3.12Å; D450-Q452 VanDerWaalsContact OD1-CB 3.3Å; D450-Q452 WeakPolarHBondContact OD1-CB 3.45Å; D450-Q452 PolarHBondContact OD1-N 3.33Å; D450-Q452 WeakPolarHBondContact OD2-CG 3.44Å; D450-H454 IonicContact OD1-CE1 3.68Å; D450-H454 IonicContact OD1-NE2 2.65Å; D450-H454 PolarHBondContact OD1-NE2 3.23Å; D450-H454 VanDerWaalsContact OD1-NE2 3.08Å; D450-H454 IonicContact OD2-NE2 2.76Å
451	G	72.1	Confident	86.9	Confident	7 Å²	7	32.3 Å²	32.3	7%	0.072	20%	0.198	C	C	.	.	S	Bend	trans	70.9	6.2	-177.1	0	0	0	0	0	115.4	T400	T400-G451 PolarHBondContact O-N 3.08Å
452	Q	79.7	Confident	86.6	Confident	31 Å²	31	37.4 Å²	37.4	15%	0.145	21%	0.213	C	C	.	.	S	Bend	trans	-89.6	159.3	173.5	-58.2	-53.5	-67.8	0	0	111.5	R399 D450 H454	R399-Q452 VanDerWaalsContact CA-O 3.31Å; R399-Q452 WeakPolarHBondContact CA-O 3.43Å; R399-Q452 WeakPolarHBondContact CB-O 3.23Å; D450-Q452 PolarHBondContact O-N 3.12Å; D450-Q452 VanDerWaalsContact OD1-CB 3.3Å; D450-Q452 WeakPolarHBondContact OD1-CB 3.45Å; D450-Q452 PolarHBondContact OD1-N 3.33Å; D450-Q452 WeakPolarHBondContact OD2-CG 3.44Å; Q452-H454 PolarHBondContact O-CD2 2.8Å
453	W	83.1	Confident	86.1	Confident	79 Å²	79	39 Å²	39	30%	0.299	22%	0.224	S	C	.	.			trans	-73.3	125.9	172.7	-74.1	109.2	0	0	0	110.2	D268 P371 Q397 F398 R399	D268-W453 PolarHBondContact OD2-NE1 3.15Å; P371-W453 HydrophobicContact CB-CH2 3.75Å; P371-W453 HydrophobicContact CB-CZ2 3.89Å; Q397-W453 HydrophobicContact CB-CE3 3.84Å; Q397-W453 HydrophobicContact CB-CZ3 4.17Å; F398-W453 WeakPolarHBondContact O-CA 3.38Å; R399-W453 HydrophobicContact CB-CD2 4.25Å; R399-W453 HydrophobicContact CB-CE3 4.25Å; R399-W453 HydrophobicContact CG-CD2 4.12Å; R399-W453 HydrophobicContact CG-CE3 4.2Å; R399-W453 HydrophobicContact CG-CH2 4.36Å; R399-W453 HydrophobicContact CG-CZ2 4.27Å; R399-W453 HydrophobicContact CG-CZ3 4.33Å
454	H	88.1	Confident	85.9	Confident	17 Å²	17	38.2 Å²	38.2	8%	0.079	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	135.5	171.8	-64.3	-74.7	0	0	0	109.8	Q397 F398 L448 D450 Q452 D470	Q397-H454 CarbonylContact C-O 3.53Å; Q397-H454 WeakPolarHBondContact CA-O 3.39Å; F398-H454 HydrophobicContact CD1-CB 4.25Å; F398-H454 HydrophobicContact CE1-CB 3.85Å; F398-H454 HydrophobicContact CZ-CB 4.49Å; F398-H454 PolarHBondContact N-O 2.96Å; F398-H454 PolarHBondContact O-N 2.71Å; L448-H454 HydrophobicContact CD2-CB 4.48Å; D450-H454 IonicContact OD1-CE1 3.68Å; D450-H454 IonicContact OD1-NE2 2.65Å; D450-H454 PolarHBondContact OD1-NE2 3.23Å; D450-H454 VanDerWaalsContact OD1-NE2 3.08Å; D450-H454 IonicContact OD2-NE2 2.76Å; Q452-H454 PolarHBondContact O-CD2 2.8Å; H454-D470 WeakPolarHBondContact CA-OD1 3.38Å; H454-D470 IonicContact CE1-OD2 3.25Å; H454-D470 IonicContact CG-OD2 2.76Å; H454-D470 IonicContact ND1-OD1 2.85Å; H454-D470 IonicContact ND1-OD2 2.87Å; H454-D470 PolarHBondContact ND1-OD2 3.18Å
455	S	89.6	Confident	85.7	Confident	45 Å²	45	38 Å²	38	32%	0.315	21%	0.214	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.4	129	173.9	-171.2	0	0	0	0	109.9	V469 D470	S455-V469 CarbonylContact O-C 3.56Å; S455-V469 VanDerWaalsContact O-CA 3.31Å; S455-V469 WeakPolarHBondContact O-CA 3.39Å; S455-D470 PolarHBondContact N-OD1 2.83Å; S455-D470 PolarHBondContact O-N 3.35Å
456	V	93.3	Very high	85.7	Confident	0 Å²	0	38.9 Å²	38.9	0%	0	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126	127.3	-179.4	-175.7	0	0	0	0	108.7	T395 F396 F398 L421 L428 V468	T395-V456 CarbonylContact C-O 3.55Å; T395-V456 VanDerWaalsContact CA-O 3.3Å; T395-V456 WeakPolarHBondContact CA-O 3.45Å; F396-V456 HydrophobicContact CD1-CB 4.39Å; F396-V456 HydrophobicContact CE1-CB 4.07Å; F396-V456 HydrophobicContact CE1-CG1 3.93Å; F396-V456 HydrophobicContact CE2-CB 4.4Å; F396-V456 HydrophobicContact CE2-CG2 4.49Å; F396-V456 HydrophobicContact CZ-CB 4.07Å; F396-V456 HydrophobicContact CZ-CG1 4.06Å; F396-V456 HydrophobicContact CZ-CG2 4.41Å; F396-V456 PolarHBondContact N-O 3.45Å; F396-V456 PolarHBondContact O-N 2.81Å; F398-V456 HydrophobicContact CD1-CG2 3.46Å; F398-V456 VanDerWaalsContact CD1-CG2 3.46Å; F398-V456 HydrophobicContact CE1-CG2 3.36Å; L421-V456 HydrophobicContact CD2-CG1 4.23Å; L428-V456 HydrophobicContact CD1-CB 4.36Å; L428-V456 HydrophobicContact CD1-CG1 3.88Å; L428-V456 HydrophobicContact CD1-CG2 3.46Å; L428-V456 VanDerWaalsContact CD1-CG2 3.46Å; V456-V468 WeakPolarHBondContact CA-O 3.15Å
457	S	91.3	Very high	85.8	Confident	37 Å²	37	35.5 Å²	35.5	26%	0.259	19%	0.187	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.4	126	168.5	-171.3	0	0	0	0	108.4	V394 T395 V468	V394-S457 WeakPolarHBondContact O-CA 3.4Å; T395-S457 PolarHBondContact OG1-OG 3Å; S457-V468 PolarHBondContact N-O 3.24Å; S457-V468 PolarHBondContact O-N 3.16Å
458	F	90.8	Very high	86.1	Confident	1 Å²	1	35.3 Å²	35.3	0%	0.004	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	149.3	170.3	76.9	-90.9	0	0	0	110.6	V392 S393 V394 L408 F419 L421 L430 N466 V467	V392-F458 HydrophobicContact CG1-CE2 3.77Å; V392-F458 HydrophobicContact CG1-CZ 4.25Å; S393-F458 WeakPolarHBondContact CA-O 3.42Å; V394-F458 HydrophobicContact CB-CD1 4.26Å; V394-F458 HydrophobicContact CB-CE1 3.57Å; V394-F458 HydrophobicContact CB-CZ 3.76Å; V394-F458 HydrophobicContact CG1-CE1 4.26Å; V394-F458 HydrophobicContact CG2-CE1 4.1Å; V394-F458 HydrophobicContact CG2-CZ 3.77Å; V394-F458 PolarHBondContact N-O 3.01Å; V394-F458 PolarHBondContact O-N 2.82Å; L408-F458 HydrophobicContact CD2-CE1 3.46Å; L408-F458 VanDerWaalsContact CD2-CE1 3.46Å; L408-F458 HydrophobicContact CD2-CZ 3.57Å; F419-F458 HydrophobicContact CD2-CE2 4.08Å; F419-F458 HydrophobicContact CD2-CZ 4.03Å; F419-F458 HydrophobicContact CE2-CE2 4.04Å; F419-F458 AromaticContact CE2-CZ 3.64Å; F419-F458 HydrophobicContact CE2-CZ 3.64Å; F419-F458 HydrophobicContact CZ-CZ 4.47Å; L421-F458 HydrophobicContact CD2-CD1 4.02Å; L421-F458 HydrophobicContact CD2-CE1 4.09Å; L430-F458 HydrophobicContact CD1-CD2 4.05Å; L430-F458 HydrophobicContact CD1-CE2 4.06Å; L430-F458 HydrophobicContact CD2-CB 3.94Å; L430-F458 HydrophobicContact CD2-CD2 3.47Å; L430-F458 VanDerWaalsContact CD2-CD2 3.47Å; L430-F458 HydrophobicContact CD2-CE2 4.23Å; L430-F458 HydrophobicContact CD2-CG 3.89Å; L430-F458 HydrophobicContact CG-CD2 4.44Å; F458-N466 CarbonylContact C-O 3.55Å; F458-N466 WeakPolarHBondContact CA-O 3.48Å; F458-N466 VanDerWaalsContact CB-O 3.25Å; F458-N466 WeakPolarHBondContact CB-O 3.42Å; F458-V467 HydrophobicContact CB-CB 4.35Å; F458-V467 HydrophobicContact CB-CG2 3.73Å
459	S	88.6	Confident	86.2	Confident	12 Å²	12	35.2 Å²	35.2	8%	0.084	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.7	140.2	169.8	78	0	0	0	0	111.5	V392 M465 N466	V392-S459 CarbonylContact O-C 3.53Å; V392-S459 WeakPolarHBondContact O-CA 3.23Å; V392-S459 WeakPolarHBondContact O-CB 3.46Å; S459-M465 CarbonylContact O-C 3.6Å; S459-M465 WeakPolarHBondContact O-CA 3.24Å; S459-N466 WeakPolarHBondContact CA-OD1 3.5Å; S459-N466 WeakPolarHBondContact CB-OD1 3.49Å; S459-N466 PolarHBondContact N-O 3.23Å; S459-N466 PolarHBondContact N-OD1 2.9Å; S459-N466 PolarHBondContact O-N 3.44Å; S459-N466 PolarHBondContact O-OD1 3.39Å; S459-N466 VanDerWaalsContact O-OD1 3.07Å; S459-N466 PolarHBondContact OG-OD1 2.78Å
460	A	87.3	Confident	86.5	Confident	3 Å²	3	36.8 Å²	36.8	3%	0.025	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	118.8	173.1	0	0	0	0	0	108.1	K391 V392 M465 I483	K391-A460 CarbonylContact C-O 3.54Å; K391-A460 VanDerWaalsContact CA-O 3.26Å; K391-A460 WeakPolarHBondContact CA-O 3.36Å; V392-A460 HydrophobicContact CB-CB 4.37Å; V392-A460 PolarHBondContact N-O 3Å; V392-A460 PolarHBondContact O-N 3.04Å; A460-M465 HydrophobicContact CB-CG 4.28Å; A460-I483 HydrophobicContact CB-CD1 3.9Å; A460-I483 HydrophobicContact CB-CG2 4.41Å
461	K	84.5	Confident	86.6	Confident	80 Å²	80	41.9 Å²	41.9	35%	0.348	21%	0.213	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	169.3	178.1	-63.9	-179.4	-177.1	174.1	0	109.3	K391 S463 H464 L478 I483	K391-K461 HydrophobicContact CB-CG 3.85Å; K461-S463 PolarHBondContact O-N 3.37Å; K461-H464 PolarHBondContact N-O 3.1Å; K461-H464 PolarHBondContact O-N 3.27Å; K461-H464 VanDerWaalsContact O-O 3.11Å; K461-L478 WeakPolarHBondContact O-CD1 2.97Å; K461-I483 WeakPolarHBondContact O-CD1 3.43Å
462	W	79.8	Confident	87.2	Confident	165 Å²	165	45.6 Å²	45.6	63%	0.625	23%	0.231	S	C	*	.	T	Hydrogen-bonded Turn	trans	-55.5	-24.8	-178.7	69.6	-86.4	0	0	0	116.3	V481	W462-V481 WeakPolarHBondContact CA-O 3.38Å; W462-V481 VanDerWaalsContact CB-O 3.3Å; W462-V481 WeakPolarHBondContact CB-O 3.31Å; W462-V481 PolarHBondContact O-N 3.01Å; W462-V481 VanDerWaalsContact O-N 3.15Å
463	S	80.1	Confident	87.7	Confident	41 Å²	41	47.9 Å²	47.9	29%	0.287	25%	0.247	S	C	.	.	T	Hydrogen-bonded Turn	trans	-108	-20.3	-176.5	61.4	0	0	0	0	115.2	K461 L478	K461-S463 PolarHBondContact O-N 3.37Å; S463-L478 PolarHBondContact O-N 3.12Å
464	H	85.8	Confident	88	Confident	53 Å²	53	45 Å²	45	25%	0.245	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-162.5	156.7	-177.7	61	-76.5	0	0	0	111.9	K461 V475 Q476	K461-H464 PolarHBondContact N-O 3.1Å; K461-H464 PolarHBondContact O-N 3.27Å; K461-H464 VanDerWaalsContact O-O 3.11Å; H464-V475 HydrophobicContact CB-CG1 4.11Å; H464-Q476 CarbonylContact C-O 3.57Å; H464-Q476 WeakPolarHBondContact CA-O 3.48Å
465	M	88.9	Confident	88	Confident	1 Å²	1	48 Å²	48	1%	0.005	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	132.9	169.6	-177.6	170.8	59.4	0	0	108.5	L430 L432 V442 S459 A460 V475 Q476 L478	L430-M465 HydrophobicContact CB-SD 4.42Å; L430-M465 HydrophobicContact CD2-CG 3.48Å; L430-M465 VanDerWaalsContact CD2-CG 3.48Å; L430-M465 HydrophobicContact CD2-SD 3.37Å; L430-M465 WeakPolarHBondContact CD2-SD 3.22Å; L430-M465 HydrophobicContact CG-CG 4.33Å; L430-M465 HydrophobicContact CG-SD 3.56Å; L430-M465 VanDerWaalsContact CG-SD 3.56Å; L432-M465 HydrophobicContact CB-SD 4.28Å; V442-M465 HydrophobicContact CB-CE 3.86Å; V442-M465 HydrophobicContact CG1-CE 3.63Å; V442-M465 HydrophobicContact CG1-CG 3.92Å; V442-M465 HydrophobicContact CG1-SD 4.12Å; S459-M465 CarbonylContact O-C 3.6Å; S459-M465 WeakPolarHBondContact O-CA 3.24Å; A460-M465 HydrophobicContact CB-CG 4.28Å; M465-V475 CarbonylContact O-C 3.41Å; M465-V475 WeakPolarHBondContact O-CA 3.34Å; M465-Q476 HydrophobicContact CE-CB 4.44Å; M465-Q476 PolarHBondContact N-O 3.18Å; M465-Q476 PolarHBondContact O-N 3.48Å; M465-L478 HydrophobicContact CB-CD1 4.24Å
466	N	90	Very high	87.8	Confident	34 Å²	34	49.4 Å²	49.4	18%	0.182	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	148	174.8	72.1	-11.9	0	0	0	111.7	F458 S459 A474 V475	F458-N466 CarbonylContact C-O 3.55Å; F458-N466 WeakPolarHBondContact CA-O 3.48Å; F458-N466 VanDerWaalsContact CB-O 3.25Å; F458-N466 WeakPolarHBondContact CB-O 3.42Å; S459-N466 WeakPolarHBondContact CA-OD1 3.5Å; S459-N466 WeakPolarHBondContact CB-OD1 3.49Å; S459-N466 PolarHBondContact N-O 3.23Å; S459-N466 PolarHBondContact N-OD1 2.9Å; S459-N466 PolarHBondContact O-N 3.44Å; S459-N466 PolarHBondContact O-OD1 3.39Å; S459-N466 VanDerWaalsContact O-OD1 3.07Å; S459-N466 PolarHBondContact OG-OD1 2.78Å; N466-A474 CarbonylContact C-O 3.24Å; N466-A474 WeakPolarHBondContact CA-O 3.41Å; N466-V475 HydrophobicContact CB-CG1 4.5Å; N466-V475 HydrophobicContact CB-CG2 3.94Å
467	V	92.6	Very high	87.2	Confident	0 Å²	0	53.8 Å²	53.8	0%	0	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130	124	169.1	176.9	0	0	0	0	106.8	L430 V442 A444 F458 V469 A474	L430-V467 HydrophobicContact CB-CG2 3.59Å; L430-V467 HydrophobicContact CD2-CG2 3.66Å; L430-V467 HydrophobicContact CG-CG2 4.3Å; V442-V467 HydrophobicContact CG1-CB 4.21Å; V442-V467 HydrophobicContact CG1-CG2 3.4Å; A444-V467 HydrophobicContact CB-CB 4.1Å; A444-V467 HydrophobicContact CB-CG1 3.79Å; F458-V467 HydrophobicContact CB-CB 4.35Å; F458-V467 HydrophobicContact CB-CG2 3.73Å; V467-V469 HydrophobicContact CG1-CG2 3.85Å; V467-A474 PolarHBondContact N-O 2.94Å; V467-A474 PolarHBondContact O-N 3.14Å
468	V	92.4	Very high	86.4	Confident	37 Å²	37	52.8 Å²	52.8	22%	0.224	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	124.1	173.9	-174.6	0	0	0	0	107.2	V456 S457 D472 T473	V456-V468 WeakPolarHBondContact CA-O 3.15Å; S457-V468 PolarHBondContact N-O 3.24Å; S457-V468 PolarHBondContact O-N 3.16Å; V468-D472 CarbonylContact C-O 3.53Å; V468-D472 VanDerWaalsContact CA-O 3.25Å; V468-D472 WeakPolarHBondContact CA-O 3.31Å; V468-T473 HydrophobicContact CG2-CG2 4Å
469	V	91.6	Very high	85.5	Confident	3 Å²	3	59 Å²	59	2%	0.018	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	115.2	175.4	-173.3	0	0	0	0	108.1	L428 A444 L448 S455 V467 D471 D472	L428-V469 HydrophobicContact CB-CG2 4.35Å; L428-V469 HydrophobicContact CD1-CG1 4.38Å; L428-V469 HydrophobicContact CD1-CG2 3.67Å; A444-V469 HydrophobicContact CB-CG2 3.73Å; L448-V469 HydrophobicContact CD1-CG1 3.91Å; L448-V469 HydrophobicContact CD2-CG1 3.65Å; L448-V469 HydrophobicContact CG-CG1 4.44Å; S455-V469 CarbonylContact O-C 3.56Å; S455-V469 VanDerWaalsContact O-CA 3.31Å; S455-V469 WeakPolarHBondContact O-CA 3.39Å; V467-V469 HydrophobicContact CG1-CG2 3.85Å; V469-D471 PolarHBondContact O-N 3.36Å; V469-D472 PolarHBondContact N-O 2.92Å; V469-D472 WeakPolarHBondContact O-CB 3.43Å; V469-D472 PolarHBondContact O-N 3.2Å
470	D	88.6	Confident	84.2	Confident	70 Å²	70	62.3 Å²	62.3	37%	0.374	35%	0.347	S	S	.	.	T	Hydrogen-bonded Turn	trans	51.9	-107.2	-169.1	-56.4	-38.8	0	0	0	110.2	H454 S455	H454-D470 WeakPolarHBondContact CA-OD1 3.38Å; H454-D470 IonicContact CE1-OD2 3.25Å; H454-D470 IonicContact CG-OD2 2.76Å; H454-D470 IonicContact ND1-OD1 2.85Å; H454-D470 IonicContact ND1-OD2 2.87Å; H454-D470 PolarHBondContact ND1-OD2 3.18Å; S455-D470 PolarHBondContact N-OD1 2.83Å; S455-D470 PolarHBondContact O-N 3.35Å
471	D	81.1	Confident	83.2	Confident	164 Å²	164	62.8 Å²	62.8	88%	0.877	35%	0.35	S	S	*	.	T	Hydrogen-bonded Turn	trans	-105.5	-3.8	176.3	-61.7	-48	0	0	0	113.4	V469	V469-D471 PolarHBondContact O-N 3.36Å
472	D	84.9	Confident	82.5	Confident	84 Å²	84	65.2 Å²	65.2	45%	0.449	37%	0.365	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.6	129.2	179.4	-175.9	24.8	0	0	0	110.8	G445 V468 V469	G445-D472 PolarHBondContact N-OD2 2.98Å; V468-D472 CarbonylContact C-O 3.53Å; V468-D472 VanDerWaalsContact CA-O 3.25Å; V468-D472 WeakPolarHBondContact CA-O 3.31Å; V469-D472 PolarHBondContact N-O 2.92Å; V469-D472 WeakPolarHBondContact O-CB 3.43Å; V469-D472 PolarHBondContact O-N 3.2Å
473	T	88.6	Confident	82.3	Confident	79 Å²	79	57.5 Å²	57.5	49%	0.485	34%	0.336	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	118.9	-177.9	-60.7	0	0	0	0	110.6	V468 V475	V468-T473 HydrophobicContact CG2-CG2 4Å; T473-V475 HydrophobicContact CG2-CG2 3.99Å
474	A	89.6	Confident	82.1	Confident	18 Å²	18	56.6 Å²	56.6	15%	0.149	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.4	134.1	171.4	0	0	0	0	0	110.4	V442 T443 A444 N466 V467	V442-A474 HydrophobicContact CG2-CB 3.6Å; T443-A474 VanDerWaalsContact O-CB 3.26Å; T443-A474 WeakPolarHBondContact O-CB 3.17Å; A444-A474 HydrophobicContact CB-CB 3.79Å; N466-A474 CarbonylContact C-O 3.24Å; N466-A474 WeakPolarHBondContact CA-O 3.41Å; V467-A474 PolarHBondContact N-O 2.94Å; V467-A474 PolarHBondContact O-N 3.14Å
475	V	87.8	Confident	81.9	Confident	82 Å²	82	54.1 Å²	54.1	50%	0.497	32%	0.317	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129	134.8	179.7	-173	0	0	0	0	109.8	H464 M465 N466 T473	H464-V475 HydrophobicContact CB-CG1 4.11Å; M465-V475 CarbonylContact O-C 3.41Å; M465-V475 WeakPolarHBondContact O-CA 3.34Å; N466-V475 HydrophobicContact CB-CG1 4.5Å; N466-V475 HydrophobicContact CB-CG2 3.94Å; T473-V475 HydrophobicContact CG2-CG2 3.99Å
476	Q	85.3	Confident	81.5	Confident	74 Å²	74	54.2 Å²	54.2	35%	0.346	32%	0.319	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	114.5	175.2	178.9	59.8	49.7	0	0	109.1	V442 H464 M465	V442-Q476 HydrophobicContact CB-CB 3.91Å; V442-Q476 HydrophobicContact CG2-CB 4.13Å; H464-Q476 CarbonylContact C-O 3.57Å; H464-Q476 WeakPolarHBondContact CA-O 3.48Å; M465-Q476 HydrophobicContact CE-CB 4.44Å; M465-Q476 PolarHBondContact N-O 3.18Å; M465-Q476 PolarHBondContact O-N 3.48Å
477	P	82.4	Confident	81.1	Confident	91 Å²	91	57.4 Å²	57.4	59%	0.591	34%	0.335	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-62.5	146.2	173.2	-19.8	31.4	0	0	0	111.8
478	L	74.9	Confident	80.7	Confident	16 Å²	16	59.5 Å²	59.5	8%	0.084	35%	0.349	C	S	.	.			trans	-120	147.8	177.3	-63.7	175.5	0	0	0	110.5	L432 R440 K461 S463 M465 A480 V481 I483	L432-L478 HydrophobicContact CD2-CD1 4.34Å; R440-L478 HydrophobicContact CB-CD2 4.02Å; R440-L478 HydrophobicContact CG-CD2 3.98Å; K461-L478 WeakPolarHBondContact O-CD1 2.97Å; S463-L478 PolarHBondContact O-N 3.12Å; M465-L478 HydrophobicContact CB-CD1 4.24Å; L478-A480 PolarHBondContact O-N 3.19Å; L478-V481 HydrophobicContact CB-CG2 4.43Å; L478-I483 HydrophobicContact CD1-CD1 3.87Å
479	V	70.7	Confident	80.4	Confident	131 Å²	131	58.7 Å²	58.7	79%	0.794	34%	0.342	S	S	*	.	S	Bend	trans	-91.3	94.6	175.6	-177.6	0	0	0	0	108.3	V481	V479-V481 VanDerWaalsContact O-CG2 3.22Å; V479-V481 WeakPolarHBondContact O-CG2 3.47Å; V479-V481 PolarHBondContact O-N 3.49Å
480	A	61.4	Low	80.1	Confident	82 Å²	82	61.3 Å²	61.3	68%	0.678	35%	0.351	S	S	*	.	S	Bend	trans	30.3	71.4	172.9	0	0	0	0	0	114.7	L478	L478-A480 PolarHBondContact O-N 3.19Å
481	V	66.4	Low	80	Confident	14 Å²	14	59.3 Å²	59.3	9%	0.085	34%	0.339	C	S	.	.			trans	-106.2	130.8	-176.3	176.7	0	0	0	0	110.1	W462 L478 V479 I483	W462-V481 WeakPolarHBondContact CA-O 3.38Å; W462-V481 VanDerWaalsContact CB-O 3.3Å; W462-V481 WeakPolarHBondContact CB-O 3.31Å; W462-V481 PolarHBondContact O-N 3.01Å; W462-V481 VanDerWaalsContact O-N 3.15Å; L478-V481 HydrophobicContact CB-CG2 4.43Å; V479-V481 VanDerWaalsContact O-CG2 3.22Å; V479-V481 WeakPolarHBondContact O-CG2 3.47Å; V479-V481 PolarHBondContact O-N 3.49Å; V481-I483 HydrophobicContact CB-CG1 4.44Å; V481-I483 HydrophobicContact CG1-CD1 4.5Å; V481-I483 HydrophobicContact CG1-CG1 3.89Å; V481-I483 PolarHBondContact O-N 2.81Å
482	L	70.1	Confident	79.7	Confident	130 Å²	130	52.1 Å²	52.1	68%	0.681	30%	0.304	S	S	*	.			trans	-73.2	120.9	169.7	-152	107	0	0	0	109	Q434	Q434-L482 PolarHBondContact NE2-O 2.91Å
483	I	74.3	Confident	78.8	Confident	3 Å²	3	48.7 Å²	48.7	2%	0.015	29%	0.288	C	S	.	.			trans	-124.2	106.8	178	-58.3	-175.7	0	0	0	106.8	D390 K391 V392 L412 L432 A460 K461 L478 V481	D390-I483 CarbonylContact C-O 3.5Å; D390-I483 WeakPolarHBondContact CA-O 3.39Å; K391-I483 PolarHBondContact N-O 2.92Å; V392-I483 HydrophobicContact CG2-CG2 3.85Å; L412-I483 HydrophobicContact CD2-CG2 3.99Å; L432-I483 HydrophobicContact CD2-CD1 3.9Å; A460-I483 HydrophobicContact CB-CD1 3.9Å; A460-I483 HydrophobicContact CB-CG2 4.41Å; K461-I483 WeakPolarHBondContact O-CD1 3.43Å; L478-I483 HydrophobicContact CD1-CD1 3.87Å; V481-I483 HydrophobicContact CB-CG1 4.44Å; V481-I483 HydrophobicContact CG1-CD1 4.5Å; V481-I483 HydrophobicContact CG1-CG1 3.89Å; V481-I483 PolarHBondContact O-N 2.81Å
484	D	77.7	Confident	77.7	Confident	23 Å²	23	47.4 Å²	47.4	12%	0.123	28%	0.277	C	S	.	.			trans	-119.7	123.5	176.9	-176.2	3.4	0	0	0	108.2	G388 L412 Q413	G388-D484 WeakPolarHBondContact CA-OD1 3.44Å; G388-D484 PolarHBondContact N-OD1 3.36Å; L412-D484 CarbonylContact C-O 3.57Å; L412-D484 VanDerWaalsContact CA-O 3.3Å; L412-D484 WeakPolarHBondContact CA-O 3.1Å; Q413-D484 HydrophobicContact CB-CB 3.89Å; Q413-D484 WeakPolarHBondContact CB-OD2 3.46Å; Q413-D484 HydrophobicContact CG-CB 4.28Å; Q413-D484 PolarHBondContact N-O 3.37Å
485	S	81.1	Confident	77.1	Confident	0 Å²	0	49 Å²	49	0%	0	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.5	134.9	-170.5	-165	0	0	0	0	112.5	S387 E389 Q413 Y489	S387-S485 WeakPolarHBondContact CA-O 3.05Å; E389-S485 PolarHBondContact O-N 3.08Å; Q413-S485 WeakPolarHBondContact CG-O 3.37Å; Q413-S485 PolarHBondContact NE2-O 3.06Å; S485-Y489 WeakPolarHBondContact OG-CE1 3.23Å; S485-Y489 PolarHBondContact OG-OH 2.86Å
486	G	80.7	Confident	76.8	Confident	4 Å²	4	46.8 Å²	46.8	4%	0.041	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.1	172.5	177.7	0	0	0	0	0	115	E411 T488	E411-G486 WeakPolarHBondContact O-CA 3.4Å; E411-G486 PolarHBondContact O-N 3.41Å; G486-T488 VanDerWaalsContact C-N 3.29Å; G486-T488 PolarHBondContact O-N 3.04Å
487	D	81.4	Confident	76.7	Confident	100 Å²	100	45.1 Å²	45.1	54%	0.535	26%	0.257	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.3	-15.9	-176.9	-61.6	-19.7	0	0	0	113.6	G385 S387 Q413	G385-D487 PolarHBondContact N-O 3.45Å; S387-D487 WeakPolarHBondContact CB-OD1 3.34Å; Q413-D487 PolarHBondContact NE2-OD1 2.8Å
488	T	83.3	Confident	77.1	Confident	45 Å²	45	41 Å²	41	28%	0.276	23%	0.23	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.3	137.3	-172.5	-55.7	0	0	0	0	112	A382 L383 G486 Y490	A382-T488 HydrophobicContact CB-CG2 4.04Å; L383-T488 CarbonylContact O-C 3.6Å; L383-T488 WeakPolarHBondContact O-CA 3.34Å; L383-T488 WeakPolarHBondContact O-CG2 3.29Å; G486-T488 VanDerWaalsContact C-N 3.29Å; G486-T488 PolarHBondContact O-N 3.04Å; T488-Y490 HydrophobicContact CG2-CD1 4.47Å; T488-Y490 HydrophobicContact CG2-CD2 4.28Å; T488-Y490 HydrophobicContact CG2-CE1 3.98Å; T488-Y490 HydrophobicContact CG2-CE2 3.78Å
489	Y	87.8	Confident	77.9	Confident	20 Å²	20	40.3 Å²	40.3	8%	0.078	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	136.3	170.4	-56.1	-42.8	0	0	0	110.5	A382 L383 V392 V394 F419 S485	A382-Y489 CarbonylContact C-O 3.55Å; A382-Y489 WeakPolarHBondContact CA-O 3.38Å; L383-Y489 PolarHBondContact N-O 2.99Å; L383-Y489 PolarHBondContact O-N 2.89Å; V392-Y489 HydrophobicContact CG1-CE1 4.5Å; V394-Y489 HydrophobicContact CG2-CD2 4.32Å; V394-Y489 HydrophobicContact CG2-CE2 3.92Å; F419-Y489 HydrophobicContact CE1-CD1 4.33Å; F419-Y489 HydrophobicContact CE1-CE1 4.01Å; F419-Y489 AromaticContact CZ-CD1 3.68Å; F419-Y489 HydrophobicContact CZ-CD1 3.68Å; F419-Y489 AromaticContact CZ-CE1 3.61Å; F419-Y489 HydrophobicContact CZ-CE1 3.61Å; S485-Y489 WeakPolarHBondContact OG-CE1 3.23Å; S485-Y489 PolarHBondContact OG-OH 2.86Å
490	Y	85.3	Confident	78.8	Confident	57 Å²	57	34.5 Å²	34.5	22%	0.224	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	117.9	-178.9	-60.6	-89.4	0	0	0	110.3	Y380 L381 A382 L408 F409 T488 L494	Y380-Y490 HydrophobicContact CD2-CD1 4.13Å; Y380-Y490 HydrophobicContact CE2-CD1 4.34Å; L381-Y490 WeakPolarHBondContact O-CA 3.14Å; A382-Y490 HydrophobicContact CB-CD1 3.82Å; A382-Y490 HydrophobicContact CB-CE1 3.79Å; L408-Y490 CarbonylContact C-O 3.58Å; L408-Y490 VanDerWaalsContact CA-O 3.31Å; L408-Y490 WeakPolarHBondContact CA-O 3.32Å; L408-Y490 WeakPolarHBondContact CD1-O 3.28Å; F409-Y490 AromaticContact CD1-CD2 3.73Å; F409-Y490 HydrophobicContact CD1-CD2 3.73Å; F409-Y490 HydrophobicContact CD1-CE2 4.46Å; F409-Y490 HydrophobicContact CD1-CG 4.39Å; F409-Y490 HydrophobicContact CE1-CD2 4.2Å; F409-Y490 PolarHBondContact N-O 3.33Å; F409-Y490 PolarHBondContact O-N 3.01Å; T488-Y490 HydrophobicContact CG2-CD1 4.47Å; T488-Y490 HydrophobicContact CG2-CD2 4.28Å; T488-Y490 HydrophobicContact CG2-CE1 3.98Å; T488-Y490 HydrophobicContact CG2-CE2 3.78Å; Y490-L494 HydrophobicContact CD1-CD1 4.01Å; Y490-L494 HydrophobicContact CD1-CD2 3.64Å; Y490-L494 HydrophobicContact CD1-CG 4.36Å; Y490-L494 HydrophobicContact CD2-CD2 4.12Å; Y490-L494 HydrophobicContact CE1-CD1 4.03Å; Y490-L494 HydrophobicContact CE1-CD2 3.58Å; Y490-L494 HydrophobicContact CE1-CG 4.46Å; Y490-L494 HydrophobicContact CE2-CD2 4.05Å; Y490-L494 HydrophobicContact CG-CD2 3.9Å
491	F	86.3	Confident	80	Confident	28 Å²	28	31 Å²	31	12%	0.123	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.7	127.8	169.4	-71.1	-100.1	0	0	0	109.2	F374 Y380 L381 L383 V394 F396 L407 L408	F374-F491 HydrophobicContact CE1-CB 4.17Å; F374-F491 WeakPolarHBondContact CE1-O 3.46Å; F374-F491 HydrophobicContact CE2-CB 4.37Å; F374-F491 HydrophobicContact CZ-CB 3.57Å; Y380-F491 CarbonylContact C-O 3.38Å; Y380-F491 WeakPolarHBondContact CA-O 2.96Å; Y380-F491 VanDerWaalsContact CB-O 3.29Å; Y380-F491 WeakPolarHBondContact CB-O 3.09Å; L381-F491 HydrophobicContact CB-CB 4.33Å; L381-F491 PolarHBondContact N-O 2.82Å; L381-F491 PolarHBondContact O-N 2.88Å; L383-F491 HydrophobicContact CD1-CD2 4.08Å; L383-F491 HydrophobicContact CD1-CE2 3.83Å; V394-F491 HydrophobicContact CG1-CZ 4.31Å; F396-F491 HydrophobicContact CD1-CE1 4.14Å; F396-F491 HydrophobicContact CD2-CE1 4.25Å; F396-F491 HydrophobicContact CE1-CE1 4.37Å; F396-F491 HydrophobicContact CE2-CE1 4.47Å; F396-F491 HydrophobicContact CG-CE1 4.08Å; L407-F491 VanDerWaalsContact O-CA 3.23Å; L407-F491 WeakPolarHBondContact O-CA 3.27Å; L407-F491 WeakPolarHBondContact O-CD1 3.31Å; L408-F491 HydrophobicContact CB-CD1 4.46Å; L408-F491 HydrophobicContact CB-CE1 4.4Å; L408-F491 HydrophobicContact CD1-CD1 4.04Å; L408-F491 HydrophobicContact CD1-CD2 3.57Å; L408-F491 HydrophobicContact CD1-CE1 3.9Å; L408-F491 HydrophobicContact CD1-CE2 3.38Å; L408-F491 HydrophobicContact CD1-CG 3.89Å; L408-F491 HydrophobicContact CD1-CZ 3.57Å; L408-F491 HydrophobicContact CD2-CZ 4.31Å; L408-F491 HydrophobicContact CG-CZ 4.43Å
492	G	74.7	Confident	80.9	Confident	13 Å²	13	31.3 Å²	31.3	13%	0.134	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	95.8	-163.5	-174.3	0	0	0	0	0	114.7	S379 H406 L407	S379-G492 WeakPolarHBondContact O-CA 3.16Å; H406-G492 PolarHBondContact ND1-O 2.88Å; L407-G492 PolarHBondContact O-N 3.3Å
493	A	65.9	Low	81.7	Confident	13 Å²	13	25.5 Å²	25.5	11%	0.107	13%	0.132	C	C	.	.			trans	-103.1	132.8	-176.9	0	0	0	0	0	112.7	S377	S377-A493 WeakPolarHBondContact O-CB 3.28Å
494	L	66	Low	82.1	Confident	51 Å²	51	26.3 Å²	26.3	27%	0.267	14%	0.135	S	C	.	.			trans	-114.5	-31.6	-170.3	-176	66.5	0	0	0	114.7	Y380 Y490	Y380-L494 HydrophobicContact CD1-CD1 4.19Å; Y380-L494 HydrophobicContact CD2-CD1 3.85Å; Y380-L494 HydrophobicContact CE1-CD1 3.95Å; Y380-L494 HydrophobicContact CE2-CD1 3.57Å; Y380-L494 HydrophobicContact CG-CD1 4.15Å; Y490-L494 HydrophobicContact CD1-CD1 4.01Å; Y490-L494 HydrophobicContact CD1-CD2 3.64Å; Y490-L494 HydrophobicContact CD1-CG 4.36Å; Y490-L494 HydrophobicContact CD2-CD2 4.12Å; Y490-L494 HydrophobicContact CE1-CD1 4.03Å; Y490-L494 HydrophobicContact CE1-CD2 3.58Å; Y490-L494 HydrophobicContact CE1-CG 4.46Å; Y490-L494 HydrophobicContact CE2-CD2 4.05Å; Y490-L494 HydrophobicContact CG-CD2 3.9Å
495	Y	75.4	Confident	82.2	Confident	51 Å²	51	33.1 Å²	33.1	20%	0.2	16%	0.159	C	C	.	.	S	Bend	trans	-103.8	157	-165.7	-60.6	-73.9	0	0	0	113.2	F409 Y513 P524	F409-Y495 HydrophobicContact CD1-CE2 4.31Å; F409-Y495 AromaticContact CE1-CE2 3.89Å; F409-Y495 HydrophobicContact CE1-CE2 3.89Å; F409-Y495 WeakPolarHBondContact CE1-OH 3.48Å; F409-Y495 HydrophobicContact CZ-CE2 4.07Å; Y495-Y513 VanDerWaalsContact CD1-CB 3.44Å; Y495-Y513 HydrophobicContact CD1-CG 4.44Å; Y495-Y513 VanDerWaalsContact CE1-CB 3.49Å; Y495-Y513 HydrophobicContact CE1-CD2 4.23Å; Y495-Y513 HydrophobicContact CE1-CG 4.02Å; Y495-P524 HydrophobicContact CD2-CB 3.39Å; Y495-P524 HydrophobicContact CD2-CG 3.48Å; Y495-P524 VanDerWaalsContact CD2-CG 3.48Å; Y495-P524 HydrophobicContact CE2-CB 3.84Å; Y495-P524 HydrophobicContact CE2-CG 3.49Å; Y495-P524 VanDerWaalsContact CE2-CG 3.49Å; Y495-P524 HydrophobicContact CG-CB 4.01Å
496	E	81.6	Confident	82.1	Confident	36 Å²	36	34 Å²	34	17%	0.168	17%	0.168	C	C	.	.	B	Isolated β-bridge	trans	-78	155.6	175.2	-65.5	-62.5	143.5	0	0	111.4	S498 A501 R505 I514 D515	E496-S498 PolarHBondContact O-N 3.3Å; E496-A501 HydrophobicContact CB-CB 4.15Å; E496-R505 IonicContact OE1-CZ 3.36Å; E496-R505 IonicContact OE1-NE 3.96Å; E496-R505 PolarHBondContact OE1-NE 3.23Å; E496-R505 IonicContact OE1-NH1 3.73Å; E496-R505 IonicContact OE1-NH2 3.91Å; E496-R505 PolarHBondContact OE1-NH2 3.37Å; E496-I514 CarbonylContact O-C 3.56Å; E496-I514 VanDerWaalsContact O-CA 3.29Å; E496-I514 WeakPolarHBondContact O-CA 3.48Å; E496-D515 PolarHBondContact O-N 2.69Å
497	Q	83.4	Confident	82.1	Confident	40 Å²	40	36 Å²	36	19%	0.187	18%	0.178	C	C	.	.	S	Bend	trans	-76.4	-23.7	-173.4	-62.4	179.8	-7.5	0	0	114.2	D515 A516 L578	Q497-D515 VanDerWaalsContact CA-O 3.26Å; Q497-D515 WeakPolarHBondContact CA-O 3.47Å; Q497-D515 WeakPolarHBondContact CG-O 3.31Å; Q497-A516 WeakPolarHBondContact O-CA 3.4Å; Q497-L578 HydrophobicContact CB-CD2 4.37Å; Q497-L578 WeakPolarHBondContact O-CD2 3.33Å
498	S	90.3	Very high	82.2	Confident	5 Å²	5	35.4 Å²	35.4	4%	0.035	18%	0.179	C	C	.	.			trans	-155.1	162.6	-174.9	70	0	0	0	0	113.6	E496 E500 A501 H502 D694	E496-S498 PolarHBondContact O-N 3.3Å; S498-E500 PolarHBondContact O-N 3.15Å; S498-E500 PolarHBondContact OG-N 3.36Å; S498-A501 WeakPolarHBondContact O-CB 2.99Å; S498-A501 PolarHBondContact O-N 3.29Å; S498-A501 PolarHBondContact OG-N 3.34Å; S498-A501 VanDerWaalsContact OG-N 3.12Å; S498-H502 PolarHBondContact O-N 3.21Å; S498-D694 VanDerWaalsContact CB-OD2 3.27Å; S498-D694 WeakPolarHBondContact CB-OD2 3.41Å; S498-D694 PolarHBondContact OG-OD2 2.95Å
499	C	92.3	Very high	82.4	Confident	0 Å²	0	35.5 Å²	35.5	0%	0	18%	0.182	C	C	.	.	H	α-helix	trans	-61.1	-31	169.4	-68.5	0	0	0	0	112.2	H502 K503 C529 M531 A535 T537	C499-H502 PolarHBondContact O-N 3.43Å; C499-K503 PolarHBondContact O-N 2.92Å; C499-C529 VanDerWaalsContact CA-SG 3.5Å; C499-C529 HydrophobicContact CB-CB 3.61Å; C499-C529 WeakPolarHBondContact CB-SG 3.49Å; C499-C529 WeakPolarHBondContact SG-CA 3.4Å; C499-C529 WeakPolarHBondContact SG-CB 3.19Å; C499-C529 CovalentContact SG-SG 2.03Å; C499-C529 PolarHBondContact SG-SG 3.49Å; C499-M531 HydrophobicContact CB-CE 4.39Å; C499-M531 VanDerWaalsContact O-CE 3.3Å; C499-M531 WeakPolarHBondContact O-CE 3.41Å; C499-A535 HydrophobicContact CB-CB 4.04Å; C499-T537 PolarHBondContact SG-OG1 3.35Å; C499-T537 VanDerWaalsContact SG-OG1 3.34Å
500	E	89.9	Confident	82.2	Confident	10 Å²	10	35.3 Å²	35.3	5%	0.047	19%	0.186	C	C	.	.	H	α-helix	trans	-65.4	-40.8	175.8	-168.5	70.6	-173.6	0	0	110.9	S498 H502 K503 H504 A535 D694 F697 W698	S498-E500 PolarHBondContact O-N 3.15Å; S498-E500 PolarHBondContact OG-N 3.36Å; E500-H502 PolarHBondContact O-N 2.91Å; E500-K503 WeakPolarHBondContact O-CB 3.3Å; E500-K503 PolarHBondContact O-N 2.9Å; E500-H504 PolarHBondContact O-N 2.78Å; E500-H504 PolarHBondContact O-ND1 2.92Å; E500-H504 IonicContact OE1-CE1 3.77Å; E500-H504 PolarHBondContact OE1-CE1 2.89Å; E500-H504 IonicContact OE1-ND1 2.75Å; E500-A535 HydrophobicContact CB-CB 4.31Å; E500-A535 WeakPolarHBondContact OE2-CB 3.45Å; E500-A535 PolarHBondContact OE2-N 3.36Å; E500-D694 HydrophobicContact CB-CB 3.56Å; E500-D694 HydrophobicContact CG-CB 3.93Å; E500-F697 HydrophobicContact CG-CD1 4.33Å; E500-F697 HydrophobicContact CG-CG 4.44Å; E500-W698 PolarHBondContact OE1-NE1 2.92Å
501	A	86.3	Confident	82	Confident	9 Å²	9	38.1 Å²	38.1	7%	0.074	20%	0.204	C	C	.	.	H	α-helix	trans	-61.9	-42.5	174.2	0	0	0	0	0	112	E496 S498 H504 R505	E496-A501 HydrophobicContact CB-CB 4.15Å; S498-A501 WeakPolarHBondContact O-CB 2.99Å; S498-A501 PolarHBondContact O-N 3.29Å; S498-A501 PolarHBondContact OG-N 3.34Å; S498-A501 VanDerWaalsContact OG-N 3.12Å; A501-H504 PolarHBondContact O-N 2.84Å; A501-R505 PolarHBondContact O-N 2.73Å
502	H	85.2	Confident	81.8	Confident	20 Å²	20	38.9 Å²	38.9	9%	0.093	21%	0.207	C	C	.	.	H	α-helix	trans	-62.8	-42.6	174	-80.7	-62.5	0	0	0	112.9	S498 C499 E500 H504 R505 N507 Y512 M531	S498-H502 PolarHBondContact O-N 3.21Å; C499-H502 PolarHBondContact O-N 3.43Å; E500-H502 PolarHBondContact O-N 2.91Å; H502-H504 VanDerWaalsContact C-N 3.26Å; H502-H504 PolarHBondContact O-N 2.98Å; H502-R505 PolarHBondContact O-N 2.82Å; H502-R505 VanDerWaalsContact O-N 3.1Å; H502-N507 HydrophobicContact CB-CB 4.4Å; H502-N507 PolarHBondContact ND1-ND2 3.07Å; H502-N507 WeakPolarHBondContact O-CB 3.43Å; H502-N507 PolarHBondContact O-N 2.57Å; H502-Y512 AromaticContact CE1-CD1 3.98Å; H502-M531 HydrophobicContact CB-CE 3.7Å
503	K	86.9	Confident	82.2	Confident	8 Å²	8	42.3 Å²	42.3	4%	0.035	22%	0.216	C	C	.	.	H	α-helix	trans	-55.1	-43.1	176.3	-176.7	-179.7	166.9	175.9	0	111.4	C499 E500 R505 G506 M531 T532 D533 A535 F901	C499-K503 PolarHBondContact O-N 2.92Å; E500-K503 WeakPolarHBondContact O-CB 3.3Å; E500-K503 PolarHBondContact O-N 2.9Å; K503-R505 PolarHBondContact O-N 3.3Å; K503-G506 WeakPolarHBondContact O-CA 3.42Å; K503-G506 PolarHBondContact O-N 2.92Å; K503-M531 HydrophobicContact CB-CE 4.3Å; K503-M531 HydrophobicContact CB-SD 3.75Å; K503-M531 HydrophobicContact CG-SD 4.34Å; K503-T532 PolarHBondContact NZ-O 2.79Å; K503-D533 PolarHBondContact NZ-O 3.4Å; K503-A535 HydrophobicContact CB-CB 4.13Å; K503-A535 HydrophobicContact CD-CB 4.06Å; K503-F901 HydrophobicContact CG-CZ 3.73Å; K503-F901 WeakPolarHBondContact O-CZ 3.32Å
504	H	82.4	Confident	83.1	Confident	20 Å²	20	41.8 Å²	41.8	9%	0.093	21%	0.212	C	C	.	.	T	Hydrogen-bonded Turn	trans	-74.8	-5	-177.9	-71.9	82	0	0	0	114.9	E500 A501 H502 F697 W698 Y871	E500-H504 PolarHBondContact O-N 2.78Å; E500-H504 PolarHBondContact O-ND1 2.92Å; E500-H504 IonicContact OE1-CE1 3.77Å; E500-H504 PolarHBondContact OE1-CE1 2.89Å; E500-H504 IonicContact OE1-ND1 2.75Å; A501-H504 PolarHBondContact O-N 2.84Å; H502-H504 VanDerWaalsContact C-N 3.26Å; H502-H504 PolarHBondContact O-N 2.98Å; H504-F697 HydrophobicContact CB-CE1 4.13Å; H504-F697 HydrophobicContact CB-CE2 4.38Å; H504-F697 HydrophobicContact CB-CZ 3.57Å; H504-F697 AromaticContact CD2-CE1 3.96Å; H504-F697 AromaticContact CG-CE1 3.51Å; H504-F697 AromaticContact CG-CZ 3.48Å; H504-F697 VanDerWaalsContact CG-CZ 3.48Å; H504-F697 AromaticContact ND1-CE1 3.58Å; H504-F697 AromaticContact ND1-CZ 3.82Å; H504-W698 AromaticContact CD2-CH2 3.86Å; H504-W698 AromaticContact CD2-CZ2 3.84Å; H504-W698 AromaticContact CE1-CZ2 3.33Å; H504-W698 WeakPolarHBondContact CE1-CZ2 3.25Å; H504-W698 AromaticContact NE2-CH2 3.53Å; H504-W698 AromaticContact NE2-CZ2 3.13Å; H504-W698 WeakPolarHBondContact NE2-CZ2 3.21Å; H504-Y871 HydrophobicContact CB-CD1 4.37Å; H504-Y871 HydrophobicContact CB-CE1 3.98Å; H504-Y871 AromaticContact CD2-CD1 3.71Å; H504-Y871 AromaticContact CD2-CE1 3.77Å; H504-Y871 AromaticContact CD2-CG 3.97Å
505	R	80.1	Confident	84	Confident	166 Å²	166	39.7 Å²	39.7	63%	0.626	20%	0.2	S	C	*	.	T	Hydrogen-bonded Turn	trans	-89.3	-3.2	165.2	-67.2	-175.6	170.2	-139.7	-1.3	113	E496 A501 H502 K503	E496-R505 IonicContact OE1-CZ 3.36Å; E496-R505 IonicContact OE1-NE 3.96Å; E496-R505 PolarHBondContact OE1-NE 3.23Å; E496-R505 IonicContact OE1-NH1 3.73Å; E496-R505 IonicContact OE1-NH2 3.91Å; E496-R505 PolarHBondContact OE1-NH2 3.37Å; A501-R505 PolarHBondContact O-N 2.73Å; H502-R505 PolarHBondContact O-N 2.82Å; H502-R505 VanDerWaalsContact O-N 3.1Å; K503-R505 PolarHBondContact O-N 3.3Å
506	G	79.8	Confident	84.4	Confident	18 Å²	18	37.8 Å²	37.8	19%	0.186	20%	0.196	C	C	.	.	T	Hydrogen-bonded Turn	trans	82.3	20	-175.1	0	0	0	0	0	113.8	K503	K503-G506 WeakPolarHBondContact O-CA 3.42Å; K503-G506 PolarHBondContact O-N 2.92Å
507	N	80.9	Confident	84.1	Confident	46 Å²	46	38.2 Å²	38.2	25%	0.246	20%	0.199	C	C	.	.			trans	-73.9	139.3	176.9	-69.5	7.5	0	0	0	110.9	H502 Y512	H502-N507 HydrophobicContact CB-CB 4.4Å; H502-N507 PolarHBondContact ND1-ND2 3.07Å; H502-N507 WeakPolarHBondContact O-CB 3.43Å; H502-N507 PolarHBondContact O-N 2.57Å; N507-Y512 HydrophobicContact CB-CE1 4.31Å
508	P	82.1	Confident	83.5	Confident	87 Å²	87	36.7 Å²	36.7	57%	0.565	19%	0.194	S	C	*	.			trans	-76.2	178.6	176.4	33.2	-36.3	0	0	0	112.4	Y512 M531	P508-Y512 WeakPolarHBondContact O-CE2 3.43Å; P508-Y512 PolarHBondContact O-OH 3.31Å; P508-M531 WeakPolarHBondContact O-CG 3.25Å
509	S	87.4	Confident	81.9	Confident	47 Å²	47	38.4 Å²	38.4	33%	0.329	21%	0.206	S	C	.	.	S	Bend	trans	-63.3	141.4	170.2	-60.1	0	0	0	0	111.6	C529 N530 M531	S509-C529 CarbonylContact C-O 3.57Å; S509-C529 VanDerWaalsContact CA-O 3.23Å; S509-C529 WeakPolarHBondContact CA-O 3.45Å; S509-N530 PolarHBondContact OG-OD1 2.82Å; S509-M531 PolarHBondContact OG-N 2.84Å; S509-M531 PolarHBondContact OG-O 3.19Å
510	G	84.3	Confident	80.5	Confident	16 Å²	16	39 Å²	39	17%	0.165	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	169.2	-174.5	-176.8	0	0	0	0	0	113.8	Y512 Y528 C529	G510-Y512 VanDerWaalsContact O-CD2 3.31Å; G510-Y512 WeakPolarHBondContact O-CD2 3.5Å; G510-Y528 CarbonylContact O-C 3.27Å; G510-C529 PolarHBondContact N-O 3.47Å; G510-C529 PolarHBondContact O-N 3.33Å
511	L	81.4	Confident	79.1	Confident	117 Å²	117	40.4 Å²	40.4	61%	0.613	22%	0.222	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-85.4	129.5	173.2	-71.7	168.4	0	0	0	110.1	L526 V527 Y528	L511-L526 HydrophobicContact CB-CD1 4.16Å; L511-L526 HydrophobicContact CD2-CD2 4.4Å; L511-L526 HydrophobicContact CD2-CG 4.33Å; L511-V527 WeakPolarHBondContact CA-O 3.43Å; L511-Y528 HydrophobicContact CD2-CD2 4.16Å; L511-Y528 HydrophobicContact CG-CD2 4.26Å
512	Y	81.3	Confident	78.3	Confident	43 Å²	43	42.3 Å²	42.3	17%	0.169	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.7	144.3	-179.9	-65.3	-85.1	0	0	0	110.6	H502 N507 P508 G510 V527 C529 M531	H502-Y512 AromaticContact CE1-CD1 3.98Å; N507-Y512 HydrophobicContact CB-CE1 4.31Å; P508-Y512 WeakPolarHBondContact O-CE2 3.43Å; P508-Y512 PolarHBondContact O-OH 3.31Å; G510-Y512 VanDerWaalsContact O-CD2 3.31Å; G510-Y512 WeakPolarHBondContact O-CD2 3.5Å; Y512-V527 PolarHBondContact N-O 3.45Å; Y512-V527 WeakPolarHBondContact O-CG2 3.37Å; Y512-V527 PolarHBondContact O-N 3.04Å; Y512-C529 HydrophobicContact CD2-CB 3.62Å; Y512-C529 HydrophobicContact CE2-CB 4.1Å; Y512-M531 HydrophobicContact CE2-CE 4.29Å
513	Y	82.6	Confident	77.5	Confident	86 Å²	86	41.5 Å²	41.5	34%	0.337	23%	0.228	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.8	126.2	162.7	-77	-85.8	0	0	0	108.8	Y495 P524 F525 L526	Y495-Y513 VanDerWaalsContact CD1-CB 3.44Å; Y495-Y513 HydrophobicContact CD1-CG 4.44Å; Y495-Y513 VanDerWaalsContact CE1-CB 3.49Å; Y495-Y513 HydrophobicContact CE1-CD2 4.23Å; Y495-Y513 HydrophobicContact CE1-CG 4.02Å; Y513-P524 HydrophobicContact CD1-CB 4.41Å; Y513-F525 WeakPolarHBondContact CA-O 3.3Å; Y513-L526 HydrophobicContact CD1-CB 4.39Å; Y513-L526 HydrophobicContact CD2-CD1 3.95Å; Y513-L526 HydrophobicContact CE1-CB 4.11Å; Y513-L526 HydrophobicContact CE1-CD1 4.47Å; Y513-L526 HydrophobicContact CE2-CD1 3.83Å; Y513-L526 HydrophobicContact CG-CD1 4.31Å
514	I	86.1	Confident	77.1	Confident	2 Å²	2	41.8 Å²	41.8	1%	0.01	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	147.5	172.8	64.2	167.2	0	0	0	110.5	E496 P524 F525 V527 T537	E496-I514 CarbonylContact O-C 3.56Å; E496-I514 VanDerWaalsContact O-CA 3.29Å; E496-I514 WeakPolarHBondContact O-CA 3.48Å; I514-P524 CarbonylContact O-C 3.48Å; I514-P524 VanDerWaalsContact O-CA 3.25Å; I514-P524 WeakPolarHBondContact O-CA 3.34Å; I514-F525 HydrophobicContact CD1-CE1 4.02Å; I514-F525 HydrophobicContact CD1-CE2 4.31Å; I514-F525 HydrophobicContact CD1-CZ 3.67Å; I514-F525 HydrophobicContact CG1-CD1 4.26Å; I514-F525 HydrophobicContact CG1-CE1 3.78Å; I514-F525 HydrophobicContact CG1-CE2 4.34Å; I514-F525 HydrophobicContact CG1-CZ 3.82Å; I514-F525 PolarHBondContact N-O 3.49Å; I514-F525 PolarHBondContact O-N 2.76Å; I514-V527 HydrophobicContact CB-CG2 4.44Å; I514-V527 HydrophobicContact CD1-CG1 3.96Å; I514-V527 HydrophobicContact CD1-CG2 3.86Å; I514-V527 HydrophobicContact CG1-CG1 4.06Å; I514-V527 HydrophobicContact CG1-CG2 3.82Å; I514-V527 HydrophobicContact CG2-CG2 3.84Å; I514-T537 HydrophobicContact CD1-CG2 4Å
515	D	84.4	Confident	77	Confident	6 Å²	6	41.3 Å²	41.3	3%	0.032	23%	0.228	C	C	.	.			trans	-121.2	79.4	-179.1	-176.1	9.6	0	0	0	110	E496 Q497 D517 G518 P524	E496-D515 PolarHBondContact O-N 2.69Å; Q497-D515 VanDerWaalsContact CA-O 3.26Å; Q497-D515 WeakPolarHBondContact CA-O 3.47Å; Q497-D515 WeakPolarHBondContact CG-O 3.31Å; D515-D517 PolarHBondContact O-N 3.2Å; D515-D517 VanDerWaalsContact O-N 3.11Å; D515-G518 PolarHBondContact O-N 3.12Å; D515-G518 PolarHBondContact OD1-N 2.95Å; D515-P524 HydrophobicContact CB-CB 4.35Å
516	A	84.8	Confident	77.1	Confident	12 Å²	12	37.3 Å²	37.3	10%	0.099	22%	0.219	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.6	-17.9	-164.5	0	0	0	0	0	115.3	Q497 F525 A574 A575	Q497-A516 WeakPolarHBondContact O-CA 3.4Å; A516-F525 HydrophobicContact CB-CE1 4.33Å; A516-A574 HydrophobicContact CB-CB 3.81Å; A516-A575 HydrophobicContact CB-CB 4.11Å
517	D	74	Confident	77.6	Confident	45 Å²	45	36.6 Å²	36.6	24%	0.241	21%	0.211	C	C	.	.	T	Hydrogen-bonded Turn	trans	-108.5	2.2	173.3	64.8	-34.6	0	0	0	113.2	D515 S519 G520 P521 L522	D515-D517 PolarHBondContact O-N 3.2Å; D515-D517 VanDerWaalsContact O-N 3.11Å; D517-S519 PolarHBondContact O-N 3.27Å; D517-G520 PolarHBondContact O-N 3.01Å; D517-G520 VanDerWaalsContact O-N 3.1Å; D517-G520 WeakPolarHBondContact OD2-CA 3.34Å; D517-P521 VanDerWaalsContact OD2-CD 3.28Å; D517-P521 WeakPolarHBondContact OD2-CD 3.34Å; D517-P521 VanDerWaalsContact OD2-N 3.14Å; D517-L522 HydrophobicContact CB-CD1 4.33Å; D517-L522 WeakPolarHBondContact OD1-CB 3.4Å; D517-L522 VanDerWaalsContact OD2-CB 3.32Å; D517-L522 WeakPolarHBondContact OD2-CB 3.31Å; D517-L522 VanDerWaalsContact OD2-CG 3.25Å; D517-L522 WeakPolarHBondContact OD2-CG 3.48Å; D517-L522 PolarHBondContact OD2-N 2.78Å
518	G	71.8	Confident	78	Confident	7 Å²	7	38.9 Å²	38.9	7%	0.072	22%	0.217	C	C	.	.	T	Hydrogen-bonded Turn	trans	57.5	-117.6	179.7	0	0	0	0	0	111.7	D515 G520	D515-G518 PolarHBondContact O-N 3.12Å; D515-G518 PolarHBondContact OD1-N 2.95Å; G518-G520 PolarHBondContact O-N 2.79Å
519	S	56.5	Low	78.6	Confident	41 Å²	41	34.8 Å²	34.8	29%	0.287	19%	0.19	S	C	.	.	T	Hydrogen-bonded Turn	trans	-76.6	14.1	179.3	-50.3	0	0	0	0	114.5	S377 G405 D517	S377-S519 VanDerWaalsContact C-OG 3.29Å; S377-S519 WeakPolarHBondContact CA-OG 3.47Å; S377-S519 WeakPolarHBondContact CB-OG 3.11Å; S377-S519 PolarHBondContact O-OG 2.04Å; G405-S519 WeakPolarHBondContact CA-O 3.11Å; D517-S519 PolarHBondContact O-N 3.27Å
520	G	61.9	Low	78.8	Confident	14 Å²	14	35.3 Å²	35.3	14%	0.144	19%	0.189	C	C	.	.	S	Bend	trans	-69.3	-176.5	171.9	0	0	0	0	0	113.1	D517 G518 L522	D517-G520 PolarHBondContact O-N 3.01Å; D517-G520 VanDerWaalsContact O-N 3.1Å; D517-G520 WeakPolarHBondContact OD2-CA 3.34Å; G518-G520 PolarHBondContact O-N 2.79Å; G520-L522 VanDerWaalsContact C-N 3.35Å
521	P	60.4	Low	79	Confident	38 Å²	38	34.7 Å²	34.7	25%	0.247	18%	0.182	C	C	.	.	S	Bend	trans	-84.1	-2.4	-174.9	34.7	-37.1	0	0	0	114.3	F422 K424 D517	F422-P521 HydrophobicContact CD2-CB 3.7Å; F422-P521 HydrophobicContact CE2-CB 3.75Å; F422-P521 WeakPolarHBondContact CE2-O 3.25Å; F422-P521 WeakPolarHBondContact CZ-O 3.18Å; K424-P521 HydrophobicContact CD-CB 4.29Å; K424-P521 HydrophobicContact CG-CB 4.45Å; D517-P521 VanDerWaalsContact OD2-CD 3.28Å; D517-P521 WeakPolarHBondContact OD2-CD 3.34Å; D517-P521 VanDerWaalsContact OD2-N 3.14Å
522	L	70.6	Confident	79.1	Confident	49 Å²	49	31.6 Å²	31.6	26%	0.257	17%	0.168	S	C	.	.	S	Bend	trans	-85.9	146.9	178.1	-48.4	170.5	0	0	0	109.7	D517 G520 G570 Q571 A574	D517-L522 HydrophobicContact CB-CD1 4.33Å; D517-L522 WeakPolarHBondContact OD1-CB 3.4Å; D517-L522 VanDerWaalsContact OD2-CB 3.32Å; D517-L522 WeakPolarHBondContact OD2-CB 3.31Å; D517-L522 VanDerWaalsContact OD2-CG 3.25Å; D517-L522 WeakPolarHBondContact OD2-CG 3.48Å; D517-L522 PolarHBondContact OD2-N 2.78Å; G520-L522 VanDerWaalsContact C-N 3.35Å; L522-G570 WeakPolarHBondContact CD1-O 3.46Å; L522-Q571 HydrophobicContact CB-CG 4.24Å; L522-A574 HydrophobicContact CD1-CB 3.76Å
523	G	67.4	Low	79	Confident	3 Å²	3	33.7 Å²	33.7	3%	0.031	18%	0.182	C	C	.	.	P	Polyproline II helix	trans	-80	163.8	171.7	0	0	0	0	0	111.2	Q571	G523-Q571 PolarHBondContact O-NE2 3.49Å
524	P	77.9	Confident	79	Confident	15 Å²	15	30.5 Å²	30.5	10%	0.097	17%	0.173	C	C	.	.	P	Polyproline II helix	trans	-65.2	156.5	169.6	30.9	-37.4	0	0	0	111.1	F409 Y495 Y513 I514 D515 Q571	F409-P524 HydrophobicContact CD2-CG 4.34Å; F409-P524 HydrophobicContact CE2-CG 4.01Å; F409-P524 HydrophobicContact CZ-CG 4.46Å; Y495-P524 HydrophobicContact CD2-CB 3.39Å; Y495-P524 HydrophobicContact CD2-CG 3.48Å; Y495-P524 VanDerWaalsContact CD2-CG 3.48Å; Y495-P524 HydrophobicContact CE2-CB 3.84Å; Y495-P524 HydrophobicContact CE2-CG 3.49Å; Y495-P524 VanDerWaalsContact CE2-CG 3.49Å; Y495-P524 HydrophobicContact CG-CB 4.01Å; Y513-P524 HydrophobicContact CD1-CB 4.41Å; I514-P524 CarbonylContact O-C 3.48Å; I514-P524 VanDerWaalsContact O-CA 3.25Å; I514-P524 WeakPolarHBondContact O-CA 3.34Å; D515-P524 HydrophobicContact CB-CB 4.35Å; P524-Q571 PolarHBondContact O-NE2 2.93Å
525	F	80.8	Confident	79.2	Confident	9 Å²	9	30.5 Å²	30.5	4%	0.039	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.5	152.3	175.6	68.2	-75.8	0	0	0	112.3	Y513 I514 A516 V527 A567 Q571 A575	Y513-F525 WeakPolarHBondContact CA-O 3.3Å; I514-F525 HydrophobicContact CD1-CE1 4.02Å; I514-F525 HydrophobicContact CD1-CE2 4.31Å; I514-F525 HydrophobicContact CD1-CZ 3.67Å; I514-F525 HydrophobicContact CG1-CD1 4.26Å; I514-F525 HydrophobicContact CG1-CE1 3.78Å; I514-F525 HydrophobicContact CG1-CE2 4.34Å; I514-F525 HydrophobicContact CG1-CZ 3.82Å; I514-F525 PolarHBondContact N-O 3.49Å; I514-F525 PolarHBondContact O-N 2.76Å; A516-F525 HydrophobicContact CB-CE1 4.33Å; F525-V527 HydrophobicContact CD2-CG1 3.61Å; F525-V527 HydrophobicContact CE2-CG1 3.22Å; F525-V527 HydrophobicContact CZ-CG1 4.02Å; F525-A567 HydrophobicContact CB-CB 4.27Å; F525-A567 HydrophobicContact CD2-CB 3.45Å; F525-A567 VanDerWaalsContact CD2-CB 3.45Å; F525-A567 HydrophobicContact CE2-CB 3.93Å; F525-A567 HydrophobicContact CG-CB 3.98Å; F525-Q571 HydrophobicContact CD1-CB 3.67Å; F525-Q571 HydrophobicContact CD1-CG 3.91Å; F525-Q571 HydrophobicContact CE1-CB 3.87Å; F525-Q571 HydrophobicContact CE1-CG 4.48Å; F525-Q571 HydrophobicContact CG-CB 4.13Å; F525-Q571 HydrophobicContact CG-CG 4.42Å; F525-Q571 HydrophobicContact CZ-CB 4.45Å; F525-A575 HydrophobicContact CE1-CB 4.3Å; F525-A575 HydrophobicContact CZ-CB 3.65Å
526	L	82.1	Confident	79.7	Confident	82 Å²	82	32.6 Å²	32.6	43%	0.429	18%	0.18	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.4	129.5	-175.4	-168.3	70.6	0	0	0	111.1	L511 Y513	L511-L526 HydrophobicContact CB-CD1 4.16Å; L511-L526 HydrophobicContact CD2-CD2 4.4Å; L511-L526 HydrophobicContact CD2-CG 4.33Å; Y513-L526 HydrophobicContact CD1-CB 4.39Å; Y513-L526 HydrophobicContact CD2-CD1 3.95Å; Y513-L526 HydrophobicContact CE1-CB 4.11Å; Y513-L526 HydrophobicContact CE1-CD1 4.47Å; Y513-L526 HydrophobicContact CE2-CD1 3.83Å; Y513-L526 HydrophobicContact CG-CD1 4.31Å
527	V	90.3	Very high	80.2	Confident	3 Å²	3	32.4 Å²	32.4	2%	0.018	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.4	156.9	174.8	-61.6	0	0	0	0	110.3	L511 Y512 I514 F525 T537 V539	L511-V527 WeakPolarHBondContact CA-O 3.43Å; Y512-V527 PolarHBondContact N-O 3.45Å; Y512-V527 WeakPolarHBondContact O-CG2 3.37Å; Y512-V527 PolarHBondContact O-N 3.04Å; I514-V527 HydrophobicContact CB-CG2 4.44Å; I514-V527 HydrophobicContact CD1-CG1 3.96Å; I514-V527 HydrophobicContact CD1-CG2 3.86Å; I514-V527 HydrophobicContact CG1-CG1 4.06Å; I514-V527 HydrophobicContact CG1-CG2 3.82Å; I514-V527 HydrophobicContact CG2-CG2 3.84Å; F525-V527 HydrophobicContact CD2-CG1 3.61Å; F525-V527 HydrophobicContact CE2-CG1 3.22Å; F525-V527 HydrophobicContact CZ-CG1 4.02Å; V527-T537 HydrophobicContact CB-CG2 3.97Å; V527-T537 HydrophobicContact CG1-CG2 3.89Å; V527-T537 HydrophobicContact CG2-CG2 4.08Å; V527-V539 HydrophobicContact CG1-CG2 4.05Å
528	Y	90.3	Very high	81.2	Confident	95 Å²	95	31.2 Å²	31.2	37%	0.373	17%	0.172	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-91	115.8	165.7	-176.7	-92.2	0	0	0	108.9	G510 L511 N530 V538	G510-Y528 CarbonylContact O-C 3.27Å; L511-Y528 HydrophobicContact CD2-CD2 4.16Å; L511-Y528 HydrophobicContact CG-CD2 4.26Å; Y528-N530 HydrophobicContact CD1-CB 4.19Å; Y528-N530 HydrophobicContact CE1-CB 3.82Å; Y528-V538 HydrophobicContact CD1-CB 4.32Å; Y528-V538 HydrophobicContact CD1-CG2 4.19Å; Y528-V538 PolarHBondContact N-O 2.69Å; Y528-V538 VanDerWaalsContact N-O 3.15Å; Y528-V538 WeakPolarHBondContact O-CB 3.38Å; Y528-V538 PolarHBondContact O-N 3.32Å
529	C	93.6	Very high	82.2	Confident	0 Å²	0	31.3 Å²	31.3	0%	0	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.2	112.1	172.5	-60.9	0	0	0	0	109.2	C499 S509 G510 Y512 M531 W536	C499-C529 VanDerWaalsContact CA-SG 3.5Å; C499-C529 HydrophobicContact CB-CB 3.61Å; C499-C529 WeakPolarHBondContact CB-SG 3.49Å; C499-C529 WeakPolarHBondContact SG-CA 3.4Å; C499-C529 WeakPolarHBondContact SG-CB 3.19Å; C499-C529 CovalentContact SG-SG 2.03Å; C499-C529 PolarHBondContact SG-SG 3.49Å; S509-C529 CarbonylContact C-O 3.57Å; S509-C529 VanDerWaalsContact CA-O 3.23Å; S509-C529 WeakPolarHBondContact CA-O 3.45Å; G510-C529 PolarHBondContact N-O 3.47Å; G510-C529 PolarHBondContact O-N 3.33Å; Y512-C529 HydrophobicContact CD2-CB 3.62Å; Y512-C529 HydrophobicContact CE2-CB 4.1Å; C529-M531 HydrophobicContact CB-CE 3.37Å; C529-M531 HydrophobicContact CB-SD 3.94Å; C529-W536 CarbonylContact C-O 3.59Å; C529-W536 WeakPolarHBondContact CA-O 3.15Å
530	N	92.4	Very high	83.7	Confident	58 Å²	58	38.9 Å²	38.9	31%	0.31	19%	0.193	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.2	100.1	170.5	-168.5	4.7	0	0	0	109.3	S509 Y528 T532 W536 V538	S509-N530 PolarHBondContact OG-OD1 2.82Å; Y528-N530 HydrophobicContact CD1-CB 4.19Å; Y528-N530 HydrophobicContact CE1-CB 3.82Å; N530-T532 PolarHBondContact O-N 2.91Å; N530-W536 HydrophobicContact CB-CB 4.17Å; N530-W536 PolarHBondContact N-O 3.01Å; N530-W536 PolarHBondContact O-N 3.31Å; N530-V538 HydrophobicContact CB-CG2 4.39Å
531	M	88	Confident	85	Confident	4 Å²	4	39.7 Å²	39.7	2%	0.02	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.6	95	179.1	-50.9	-50.8	-170	0	0	108.9	C499 H502 K503 P508 S509 Y512 C529 A535 P900	C499-M531 HydrophobicContact CB-CE 4.39Å; C499-M531 VanDerWaalsContact O-CE 3.3Å; C499-M531 WeakPolarHBondContact O-CE 3.41Å; H502-M531 HydrophobicContact CB-CE 3.7Å; K503-M531 HydrophobicContact CB-CE 4.3Å; K503-M531 HydrophobicContact CB-SD 3.75Å; K503-M531 HydrophobicContact CG-SD 4.34Å; P508-M531 WeakPolarHBondContact O-CG 3.25Å; S509-M531 PolarHBondContact OG-N 2.84Å; S509-M531 PolarHBondContact OG-O 3.19Å; Y512-M531 HydrophobicContact CE2-CE 4.29Å; C529-M531 HydrophobicContact CB-CE 3.37Å; C529-M531 HydrophobicContact CB-SD 3.94Å; M531-A535 HydrophobicContact SD-CB 3.76Å; M531-P900 WeakPolarHBondContact O-CG 3.38Å
532	T	85	Confident	85.9	Confident	51 Å²	51	41.3 Å²	41.3	31%	0.313	22%	0.217	S	C	.	.	S	Bend	trans	-110.6	-155.3	169.8	63.7	0	0	0	0	108.6	K503 N530 S534	K503-T532 PolarHBondContact NZ-O 2.79Å; N530-T532 PolarHBondContact O-N 2.91Å; T532-S534 CarbonylContact C-O 3.52Å; T532-S534 PolarHBondContact N-O 2.84Å; T532-S534 VanDerWaalsContact N-O 3.14Å; T532-S534 PolarHBondContact O-N 3.21Å; T532-S534 PolarHBondContact OG1-N 3Å; T532-S534 PolarHBondContact OG1-O 3.49Å
533	D	77.8	Confident	86.3	Confident	87 Å²	87	39.7 Å²	39.7	47%	0.465	21%	0.212	S	C	.	.	S	Bend	trans	-45.5	-29.3	165.2	-96.4	28	0	0	0	113.8	K503 K884	K503-D533 PolarHBondContact NZ-O 3.4Å; D533-K884 IonicContact OD2-NZ 3.94Å; D533-K884 PolarHBondContact OD2-NZ 2.04Å
534	S	83.5	Confident	86.9	Confident	20 Å²	20	42.5 Å²	42.5	14%	0.14	23%	0.23	C	C	.	.	S	Bend	trans	-131.2	154.3	163	-66.5	0	0	0	0	110.9	T532 R692	T532-S534 CarbonylContact C-O 3.52Å; T532-S534 PolarHBondContact N-O 2.84Å; T532-S534 VanDerWaalsContact N-O 3.14Å; T532-S534 PolarHBondContact O-N 3.21Å; T532-S534 PolarHBondContact OG1-N 3Å; T532-S534 PolarHBondContact OG1-O 3.49Å; S534-R692 VanDerWaalsContact OG-CZ 3.25Å; S534-R692 PolarHBondContact OG-NE 2.04Å; S534-R692 PolarHBondContact OG-NH2 2.9Å
535	A	90.6	Very high	87	Confident	1 Å²	1	49 Å²	49	1%	0.008	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.8	127.5	173.7	0	0	0	0	0	110	C499 E500 K503 M531 G693	C499-A535 HydrophobicContact CB-CB 4.04Å; E500-A535 HydrophobicContact CB-CB 4.31Å; E500-A535 WeakPolarHBondContact OE2-CB 3.45Å; E500-A535 PolarHBondContact OE2-N 3.36Å; K503-A535 HydrophobicContact CB-CB 4.13Å; K503-A535 HydrophobicContact CD-CB 4.06Å; M531-A535 HydrophobicContact SD-CB 3.76Å; A535-G693 PolarHBondContact O-N 2.91Å
536	W	94.3	Very high	87.1	Confident	50 Å²	50	51 Å²	51	19%	0.189	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	124.7	172.2	-68.2	85.5	0	0	0	110.2	C529 N530 V538 E583 L690 C691 R692	C529-W536 CarbonylContact C-O 3.59Å; C529-W536 WeakPolarHBondContact CA-O 3.15Å; N530-W536 HydrophobicContact CB-CB 4.17Å; N530-W536 PolarHBondContact N-O 3.01Å; N530-W536 PolarHBondContact O-N 3.31Å; W536-V538 HydrophobicContact CB-CG2 4.4Å; W536-E583 HydrophobicContact CZ3-CG 4.21Å; W536-L690 HydrophobicContact CE3-CB 3.85Å; W536-L690 HydrophobicContact CZ3-CB 3.81Å; W536-C691 CarbonylContact C-O 3Å; W536-C691 WeakPolarHBondContact CA-O 3.42Å; W536-R692 HydrophobicContact CD2-CB 3.84Å; W536-R692 HydrophobicContact CD2-CG 4.08Å; W536-R692 HydrophobicContact CE3-CB 3.71Å; W536-R692 HydrophobicContact CE3-CG 4.44Å; W536-R692 HydrophobicContact CH2-CB 4.1Å; W536-R692 HydrophobicContact CZ2-CB 4.21Å; W536-R692 HydrophobicContact CZ2-CG 4.21Å; W536-R692 HydrophobicContact CZ3-CB 3.84Å
537	T	95.6	Very high	87.1	Confident	9 Å²	9	47.8 Å²	47.8	6%	0.055	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84	109.5	166.6	-53.7	0	0	0	0	108.4	C499 I514 V527 V539 C691	C499-T537 PolarHBondContact SG-OG1 3.35Å; C499-T537 VanDerWaalsContact SG-OG1 3.34Å; I514-T537 HydrophobicContact CD1-CG2 4Å; V527-T537 HydrophobicContact CB-CG2 3.97Å; V527-T537 HydrophobicContact CG1-CG2 3.89Å; V527-T537 HydrophobicContact CG2-CG2 4.08Å; T537-V539 HydrophobicContact CG2-CG2 4.16Å; T537-C691 PolarHBondContact N-O 2.78Å; T537-C691 PolarHBondContact O-N 3.17Å
538	V	94.6	Very high	86.7	Confident	19 Å²	19	51.5 Å²	51.5	12%	0.115	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.5	116.5	-179.6	-176.3	0	0	0	0	109.3	Y528 N530 W536 P688 L690	Y528-V538 HydrophobicContact CD1-CB 4.32Å; Y528-V538 HydrophobicContact CD1-CG2 4.19Å; Y528-V538 PolarHBondContact N-O 2.69Å; Y528-V538 VanDerWaalsContact N-O 3.15Å; Y528-V538 WeakPolarHBondContact O-CB 3.38Å; Y528-V538 PolarHBondContact O-N 3.32Å; N530-V538 HydrophobicContact CB-CG2 4.39Å; W536-V538 HydrophobicContact CB-CG2 4.4Å; V538-P688 HydrophobicContact CG1-CB 3.83Å; V538-P688 HydrophobicContact CG1-CG 3.94Å; V538-L690 HydrophobicContact CB-CD2 4.14Å; V538-L690 HydrophobicContact CG1-CD2 3.8Å; V538-L690 HydrophobicContact CG2-CD2 3.66Å
539	V	92.6	Very high	85.9	Confident	9 Å²	9	48.1 Å²	48.1	6%	0.055	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	117.3	179.6	-164.6	0	0	0	0	110	V527 T537 Y565 L572 P688 L689	V527-V539 HydrophobicContact CG1-CG2 4.05Å; T537-V539 HydrophobicContact CG2-CG2 4.16Å; V539-Y565 HydrophobicContact CG1-CD1 4.07Å; V539-L572 HydrophobicContact CG1-CD2 3.88Å; V539-P688 WeakPolarHBondContact O-CA 3.39Å; V539-P688 WeakPolarHBondContact O-CB 3.47Å; V539-L689 HydrophobicContact CB-CB 4.28Å; V539-L689 HydrophobicContact CG2-CD2 4.48Å; V539-L689 PolarHBondContact N-O 3.1Å; V539-L689 PolarHBondContact O-N 2.82Å
540	R	89.1	Confident	84.9	Confident	200 Å²	200	56.8 Å²	56.8	76%	0.755	31%	0.309	S	S	*	.			trans	-87.6	150.7	-179.7	-67.4	-177.8	170.7	-176.4	-3.8	111.7	P688	R540-P688 HydrophobicContact CG-CB 4.3Å
541	H	87.6	Confident	83.4	Confident	32 Å²	32	55 Å²	55	15%	0.148	31%	0.305	C	S	.	.	B	Isolated β-bridge	trans	-104.7	158.8	169.2	61.8	58.6	0	0	0	111.2	G543 F563 A564 Y565 L686	H541-G543 PolarHBondContact ND1-N 2.84Å; H541-F563 HydrophobicContact CB-CB 4.12Å; H541-F563 AromaticContact CD2-CD1 3.8Å; H541-F563 AromaticContact CE1-CD1 3.48Å; H541-F563 VanDerWaalsContact CE1-CD1 3.48Å; H541-F563 WeakPolarHBondContact CE1-CD1 3.19Å; H541-F563 AromaticContact CE1-CE1 3.73Å; H541-F563 AromaticContact CG-CD1 3.76Å; H541-F563 AromaticContact ND1-CD1 3.58Å; H541-F563 AromaticContact NE2-CD1 3.63Å; H541-F563 AromaticContact NE2-CE1 3.93Å; H541-A564 CarbonylContact C-O 3.57Å; H541-A564 VanDerWaalsContact CA-O 3.28Å; H541-A564 WeakPolarHBondContact CA-O 3.08Å; H541-A564 WeakPolarHBondContact CB-O 3.09Å; H541-Y565 HydrophobicContact CB-CD1 4.05Å; H541-Y565 HydrophobicContact CB-CE1 3.82Å; H541-Y565 HydrophobicContact CB-CE2 4.31Å; H541-Y565 HydrophobicContact CB-CG 4.4Å; H541-L686 PolarHBondContact NE2-O 3.27Å; H541-L686 VanDerWaalsContact NE2-O 3.12Å
542	G	80.4	Confident	82	Confident	72 Å²	72	56.3 Å²	56.3	74%	0.742	32%	0.316	S	S	*	.			trans	-95.1	18.7	175.6	0	0	0	0	0	115	A564	G542-A564 PolarHBondContact N-O 2.82Å
543	G	78.8	Confident	80.5	Confident	14 Å²	14	60.1 Å²	60.1	14%	0.144	34%	0.342	C	S	.	.	S	Bend	trans	-74.8	170.7	171.2	0	0	0	0	0	113.3	H541	H541-G543 PolarHBondContact ND1-N 2.84Å
544	P	80.1	Confident	79.4	Confident	63 Å²	63	61.1 Å²	61.1	41%	0.409	36%	0.355	S	S	.	.			trans	-62.7	143.9	179.5	26.1	-34.1	0	0	0	112.3	A546 V547 V561	P544-A546 VanDerWaalsContact C-N 3.3Å; P544-A546 PolarHBondContact O-N 2.92Å; P544-V547 HydrophobicContact CB-CG2 4.38Å; P544-V547 HydrophobicContact CG-CG2 3.62Å; P544-V561 HydrophobicContact CG-CG1 3.77Å
545	D	79.1	Confident	78	Confident	151 Å²	151	62.5 Å²	62.5	81%	0.807	37%	0.373	S	S	*	.	S	Bend	trans	-63.6	-35.3	-179.2	-68.3	-38.1	0	0	0	112.4	T685	D545-T685 WeakPolarHBondContact O-CB 3.23Å; D545-T685 VanDerWaalsContact O-CG2 3.26Å; D545-T685 WeakPolarHBondContact O-CG2 3.13Å
546	A	83.1	Confident	76.4	Confident	51 Å²	51	69.4 Å²	69.4	42%	0.421	41%	0.405	S	S	.	.			trans	-145.4	143.6	174.6	0	0	0	0	0	110.6	P544 Y684 T685	P544-A546 VanDerWaalsContact C-N 3.3Å; P544-A546 PolarHBondContact O-N 2.92Å; A546-Y684 WeakPolarHBondContact CA-O 3.01Å; A546-T685 HydrophobicContact CB-CG2 3.84Å
547	V	83.4	Confident	74.5	Confident	15 Å²	15	70.1 Å²	70.1	9%	0.091	42%	0.416	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	115.7	177	-179.4	0	0	0	0	108.6	P544 V561 D683 Y684	P544-V547 HydrophobicContact CB-CG2 4.38Å; P544-V547 HydrophobicContact CG-CG2 3.62Å; V547-V561 HydrophobicContact CG1-CG2 4.01Å; V547-V561 HydrophobicContact CG2-CB 4.49Å; V547-V561 HydrophobicContact CG2-CG1 4.28Å; V547-V561 HydrophobicContact CG2-CG2 3.93Å; V547-D683 CarbonylContact O-C 3.57Å; V547-D683 VanDerWaalsContact O-CA 3.22Å; V547-D683 WeakPolarHBondContact O-CA 3.34Å; V547-Y684 HydrophobicContact CB-CD1 3.98Å; V547-Y684 HydrophobicContact CB-CD2 4.32Å; V547-Y684 HydrophobicContact CB-CE1 3.55Å; V547-Y684 HydrophobicContact CB-CE2 3.91Å; V547-Y684 HydrophobicContact CB-CG 4.36Å; V547-Y684 HydrophobicContact CG1-CD1 4.31Å; V547-Y684 HydrophobicContact CG1-CE1 3.54Å; V547-Y684 HydrophobicContact CG2-CE1 4.29Å; V547-Y684 HydrophobicContact CG2-CE2 3.83Å; V547-Y684 PolarHBondContact N-O 3.26Å; V547-Y684 PolarHBondContact O-N 3.03Å
548	T	80.1	Confident	72.9	Confident	80 Å²	80	74.3 Å²	74.3	49%	0.491	44%	0.438	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.3	133	177.2	-47.9	0	0	0	0	110.9	R550 E681 A682	T548-R550 HydrophobicContact CG2-CG 4.36Å; T548-E681 HydrophobicContact CG2-CG 3.89Å; T548-A682 CarbonylContact C-O 3.48Å
549	L	75.3	Confident	71.8	Confident	25 Å²	25	74.8 Å²	74.8	13%	0.131	44%	0.442	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110	130.8	175.5	-56.3	174.8	0	0	0	108.2	M672 E681 A682 Y684	L549-M672 HydrophobicContact CD1-CB 3.73Å; L549-M672 HydrophobicContact CD1-CG 4.25Å; L549-M672 HydrophobicContact CD1-SD 3.57Å; L549-M672 VanDerWaalsContact CD1-SD 3.57Å; L549-M672 HydrophobicContact CD2-CB 4.47Å; L549-E681 WeakPolarHBondContact O-CA 3.45Å; L549-A682 HydrophobicContact CB-CB 4.49Å; L549-A682 PolarHBondContact N-O 2.75Å; L549-A682 PolarHBondContact O-N 2.95Å; L549-Y684 HydrophobicContact CD1-CD1 4.31Å; L549-Y684 HydrophobicContact CD1-CE1 4.42Å; L549-Y684 HydrophobicContact CD2-CE1 4.48Å
550	R	70.8	Confident	71.2	Confident	181 Å²	181	77 Å²	77	68%	0.683	46%	0.461	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-126.9	134.5	178.1	-69	-176.4	172.8	-172.5	-2.5	110	T548 E681	T548-R550 HydrophobicContact CG2-CG 4.36Å; R550-E681 HydrophobicContact CG-CG 4.28Å; R550-E681 IonicContact CZ-OE1 3.38Å; R550-E681 IonicContact NE-OE1 2.96Å; R550-E681 PolarHBondContact NE-OE1 3.21Å; R550-E681 IonicContact NH2-OE1 2.94Å; R550-E681 PolarHBondContact NH2-OE1 3.1Å
551	G	61	Low	71.1	Confident	21 Å²	21	68.6 Å²	68.6	22%	0.216	43%	0.432	C	S	.	.			trans	-64.3	131.1	178.1	0	0	0	0	0	113.5	D674 S680	G551-D674 VanDerWaalsContact CA-OD1 3.31Å; G551-D674 WeakPolarHBondContact CA-OD1 3.45Å; G551-S680 PolarHBondContact N-O 3.01Å
552	A	58.7	Low	71	Confident	31 Å²	31	71 Å²	71	26%	0.256	45%	0.453	S	S	.	.			trans	-107.6	145.3	177.9	0	0	0	0	0	111.8	S554 P557 D674	A552-S554 PolarHBondContact O-N 2.79Å; A552-S554 VanDerWaalsContact O-N 3.17Å; A552-P557 HydrophobicContact CB-CG 3.96Å; A552-D674 PolarHBondContact N-OD2 2.93Å
553	P	54.5	Low	71.4	Confident	131 Å²	131	67.9 Å²	67.9	85%	0.851	42%	0.419	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68	-15.1	-175.4	-17	28.7	0	0	0	115.7
554	S	54.3	Low	71.7	Confident	108 Å²	108	70.7 Å²	70.7	76%	0.755	44%	0.44	S	S	*	.	T	Hydrogen-bonded Turn	trans	-127.9	26.6	-161.7	64.6	0	0	0	0	115.5	A552	A552-S554 PolarHBondContact O-N 2.79Å; A552-S554 VanDerWaalsContact O-N 3.17Å
555	G	54.8	Low	71.9	Confident	50 Å²	50	69.1 Å²	69.1	52%	0.515	43%	0.426	S	S	.	.	S	Bend	trans	69	116.2	171.2	0	0	0	0	0	115.3
556	H	57.1	Low	71.8	Confident	145 Å²	145	66.9 Å²	66.9	67%	0.671	43%	0.429	S	S	*	.			trans	71.7	70.8	164.2	-45.1	-58.4	0	0	0	119.8
557	P	53.3	Low	71.7	Confident	65 Å²	65	64.9 Å²	64.9	42%	0.422	41%	0.412	S	S	.	.			trans	-76.8	114.4	138.4	29.3	-27.3	0	0	0	109.5	A552 D674	A552-P557 HydrophobicContact CB-CG 3.96Å; P557-D674 HydrophobicContact CG-CB 4.13Å
558	L	62.5	Low	71.6	Confident	98 Å²	98	65.3 Å²	65.3	51%	0.513	42%	0.42	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.6	121	165.6	-103.2	88	0	0	0	108.7	W606 V671 T673	L558-W606 HydrophobicContact CD2-CH2 4.1Å; L558-V671 HydrophobicContact CD2-CG1 3.74Å; L558-V671 HydrophobicContact CG-CG1 4.37Å; L558-T673 HydrophobicContact CD1-CG2 4.09Å; L558-T673 HydrophobicContact CG-CG2 4.06Å
559	S	72.1	Confident	71.7	Confident	29 Å²	29	65.6 Å²	65.6	20%	0.203	43%	0.43	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.8	109.3	165.7	-173.5	0	0	0	0	108.6	V671 M672	S559-V671 WeakPolarHBondContact O-CA 3.45Å; S559-M672 PolarHBondContact N-O 2.75Å; S559-M672 PolarHBondContact O-N 3.08Å
560	A	80.2	Confident	72	Confident	56 Å²	56	66 Å²	66	46%	0.463	44%	0.441	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	109.9	175.4	0	0	0	0	0	108.8	V671	A560-V671 HydrophobicContact CB-CG2 4.06Å
561	V	85.4	Confident	72.8	Confident	23 Å²	23	58 Å²	58	14%	0.139	41%	0.411	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	126.6	-178	-179.4	0	0	0	0	109.6	P544 V547 F563 Q669 I670 Y684	P544-V561 HydrophobicContact CG-CG1 3.77Å; V547-V561 HydrophobicContact CG1-CG2 4.01Å; V547-V561 HydrophobicContact CG2-CB 4.49Å; V547-V561 HydrophobicContact CG2-CG1 4.28Å; V547-V561 HydrophobicContact CG2-CG2 3.93Å; V561-F563 HydrophobicContact CB-CE2 4.34Å; V561-F563 HydrophobicContact CB-CZ 4.43Å; V561-F563 HydrophobicContact CG1-CE1 4.26Å; V561-F563 HydrophobicContact CG1-CE2 4.03Å; V561-F563 HydrophobicContact CG1-CZ 3.82Å; V561-Q669 WeakPolarHBondContact O-CA 3.34Å; V561-Q669 WeakPolarHBondContact O-CG 3.48Å; V561-I670 PolarHBondContact N-O 2.62Å; V561-I670 PolarHBondContact O-N 2.03Å; V561-Y684 WeakPolarHBondContact CB-OH 3.4Å; V561-Y684 WeakPolarHBondContact CG2-OH 3.38Å
562	S	86.4	Confident	74.1	Confident	83 Å²	83	57.7 Å²	57.7	58%	0.58	40%	0.404	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-100.2	137.5	177.4	-58.4	0	0	0	0	110.8	T668	S562-T668 CarbonylContact C-O 3.55Å; S562-T668 WeakPolarHBondContact CA-O 3.43Å
563	F	87.8	Confident	75.6	Confident	6 Å²	6	63 Å²	63	3%	0.026	42%	0.417	C	S	.	.			trans	-110.8	101.9	-178.4	-63.7	-84.2	0	0	0	109.6	H541 V561 Y565 T668 I670 Y684 L686	H541-F563 HydrophobicContact CB-CB 4.12Å; H541-F563 AromaticContact CD2-CD1 3.8Å; H541-F563 AromaticContact CE1-CD1 3.48Å; H541-F563 VanDerWaalsContact CE1-CD1 3.48Å; H541-F563 WeakPolarHBondContact CE1-CD1 3.19Å; H541-F563 AromaticContact CE1-CE1 3.73Å; H541-F563 AromaticContact CG-CD1 3.76Å; H541-F563 AromaticContact ND1-CD1 3.58Å; H541-F563 AromaticContact NE2-CD1 3.63Å; H541-F563 AromaticContact NE2-CE1 3.93Å; V561-F563 HydrophobicContact CB-CE2 4.34Å; V561-F563 HydrophobicContact CB-CZ 4.43Å; V561-F563 HydrophobicContact CG1-CE1 4.26Å; V561-F563 HydrophobicContact CG1-CE2 4.03Å; V561-F563 HydrophobicContact CG1-CZ 3.82Å; F563-Y565 HydrophobicContact CB-CE2 4.47Å; F563-Y565 WeakPolarHBondContact O-CE2 3.2Å; F563-T668 PolarHBondContact N-O 3.01Å; F563-I670 HydrophobicContact CE2-CB 4.13Å; F563-I670 HydrophobicContact CE2-CD1 3.84Å; F563-I670 HydrophobicContact CE2-CG1 3.88Å; F563-I670 HydrophobicContact CZ-CD1 4.32Å; F563-Y684 HydrophobicContact CZ-CE2 4.25Å; F563-L686 HydrophobicContact CB-CD2 4.24Å; F563-L686 HydrophobicContact CD1-CB 4.44Å; F563-L686 HydrophobicContact CD1-CD2 3.67Å; F563-L686 HydrophobicContact CD2-CD2 3.56Å; F563-L686 HydrophobicContact CE1-CB 3.83Å; F563-L686 HydrophobicContact CE1-CD2 3.83Å; F563-L686 HydrophobicContact CE1-CG 4.46Å; F563-L686 HydrophobicContact CE2-CB 4.48Å; F563-L686 HydrophobicContact CE2-CD2 3.73Å; F563-L686 HydrophobicContact CG-CD2 3.53Å; F563-L686 HydrophobicContact CZ-CB 3.85Å; F563-L686 HydrophobicContact CZ-CD2 3.85Å
564	A	84.9	Confident	77.2	Confident	72 Å²	72	57.6 Å²	57.6	60%	0.595	38%	0.384	S	S	*	.			trans	-82.8	135.1	175.9	0	0	0	0	0	110.6	H541 G542	H541-A564 CarbonylContact C-O 3.57Å; H541-A564 VanDerWaalsContact CA-O 3.28Å; H541-A564 WeakPolarHBondContact CA-O 3.08Å; H541-A564 WeakPolarHBondContact CB-O 3.09Å; G542-A564 PolarHBondContact N-O 2.82Å
565	Y	86.1	Confident	78.9	Confident	30 Å²	30	53 Å²	53	12%	0.118	35%	0.353	C	S	.	.	B	Isolated β-bridge	trans	-102.3	148.7	174.5	-66.2	-96.4	0	0	0	109.9	V539 H541 F563 A567 L572 Q584 P666 V667 L689	V539-Y565 HydrophobicContact CG1-CD1 4.07Å; H541-Y565 HydrophobicContact CB-CD1 4.05Å; H541-Y565 HydrophobicContact CB-CE1 3.82Å; H541-Y565 HydrophobicContact CB-CE2 4.31Å; H541-Y565 HydrophobicContact CB-CG 4.4Å; F563-Y565 HydrophobicContact CB-CE2 4.47Å; F563-Y565 WeakPolarHBondContact O-CE2 3.2Å; Y565-A567 PolarHBondContact O-N 3.37Å; Y565-L572 HydrophobicContact CD1-CD2 4.45Å; Y565-L572 HydrophobicContact CD2-CD1 4.13Å; Y565-L572 HydrophobicContact CG-CD1 3.93Å; Y565-L572 HydrophobicContact CG-CD2 4.49Å; Y565-Q584 PolarHBondContact OH-NE2 2.82Å; Y565-P666 HydrophobicContact CE1-CB 4.14Å; Y565-P666 HydrophobicContact CE2-CB 3.93Å; Y565-P666 HydrophobicContact CE2-CG 4.11Å; Y565-P666 WeakPolarHBondContact OH-CB 3.07Å; Y565-V667 VanDerWaalsContact CE2-O 3.25Å; Y565-V667 WeakPolarHBondContact CE2-O 3.33Å; Y565-V667 PolarHBondContact OH-O 2.98Å; Y565-L689 HydrophobicContact CE1-CB 4.41Å
566	A	76.1	Confident	80.7	Confident	104 Å²	104	50.7 Å²	50.7	86%	0.86	33%	0.329	S	S	*	.	S	Bend	trans	-65.3	-30.1	175	0	0	0	0	0	112.2
567	A	81.6	Confident	82.2	Confident	9 Å²	9	47.6 Å²	47.6	7%	0.074	32%	0.317	C	S	.	.	S	Bend	trans	-82.5	142.2	174.4	0	0	0	0	0	111.4	F525 Y565 Q571 L572	F525-A567 HydrophobicContact CB-CB 4.27Å; F525-A567 HydrophobicContact CD2-CB 3.45Å; F525-A567 VanDerWaalsContact CD2-CB 3.45Å; F525-A567 HydrophobicContact CE2-CB 3.93Å; F525-A567 HydrophobicContact CG-CB 3.98Å; Y565-A567 PolarHBondContact O-N 3.37Å; A567-Q571 HydrophobicContact CB-CB 4.29Å; A567-L572 HydrophobicContact CB-CD2 3.92Å; A567-L572 HydrophobicContact CB-CG 3.96Å
568	G	80.3	Confident	83.8	Confident	25 Å²	25	45.9 Å²	45.9	26%	0.258	30%	0.304	S	S	.	.			trans	-67.5	157.1	175.6	0	0	0	0	0	112.7	G570 Q571 L572	G568-G570 PolarHBondContact O-N 2.99Å; G568-G570 VanDerWaalsContact O-N 3.14Å; G568-Q571 WeakPolarHBondContact O-CB 3.04Å; G568-Q571 PolarHBondContact O-N 3.45Å; G568-L572 PolarHBondContact O-N 2.79Å
569	A	82.9	Confident	85.2	Confident	85 Å²	85	41.4 Å²	41.4	70%	0.702	28%	0.281	S	S	*	.	H	α-helix	trans	-55.3	-36.2	-178.1	0	0	0	0	0	113.7	R573	A569-R573 VanDerWaalsContact O-CB 3.31Å; A569-R573 WeakPolarHBondContact O-CB 3.47Å; A569-R573 PolarHBondContact O-N 3.41Å
570	G	81.7	Confident	85.9	Confident	34 Å²	34	43.1 Å²	43.1	35%	0.351	29%	0.286	S	S	.	.	H	α-helix	trans	-65.9	-44.4	175.3	0	0	0	0	0	113.2	L522 G568 R573 A574	L522-G570 WeakPolarHBondContact CD1-O 3.46Å; G568-G570 PolarHBondContact O-N 2.99Å; G568-G570 VanDerWaalsContact O-N 3.14Å; G570-R573 PolarHBondContact O-N 3.06Å; G570-A574 WeakPolarHBondContact O-CB 3.47Å; G570-A574 PolarHBondContact O-N 2.79Å
571	Q	87.3	Confident	86.4	Confident	14 Å²	14	47.4 Å²	47.4	7%	0.065	29%	0.29	C	S	.	.	H	α-helix	trans	-63.2	-46.3	177.7	-71.2	167.2	-38.1	0	0	111.1	L522 G523 P524 F525 A567 G568 R573 A574 A575	L522-Q571 HydrophobicContact CB-CG 4.24Å; G523-Q571 PolarHBondContact O-NE2 3.49Å; P524-Q571 PolarHBondContact O-NE2 2.93Å; F525-Q571 HydrophobicContact CD1-CB 3.67Å; F525-Q571 HydrophobicContact CD1-CG 3.91Å; F525-Q571 HydrophobicContact CE1-CB 3.87Å; F525-Q571 HydrophobicContact CE1-CG 4.48Å; F525-Q571 HydrophobicContact CG-CB 4.13Å; F525-Q571 HydrophobicContact CG-CG 4.42Å; F525-Q571 HydrophobicContact CZ-CB 4.45Å; A567-Q571 HydrophobicContact CB-CB 4.29Å; G568-Q571 WeakPolarHBondContact O-CB 3.04Å; G568-Q571 PolarHBondContact O-N 3.45Å; Q571-R573 VanDerWaalsContact C-N 3.34Å; Q571-R573 PolarHBondContact O-N 2.78Å; Q571-A574 PolarHBondContact O-N 2.79Å; Q571-A575 WeakPolarHBondContact O-CB 3.24Å; Q571-A575 PolarHBondContact O-N 3.22Å
572	L	89.3	Confident	86.8	Confident	13 Å²	13	46.3 Å²	46.3	7%	0.068	28%	0.284	C	S	.	.	H	α-helix	trans	-59	-45.9	174.3	-68.8	169.5	0	0	0	111.3	V539 Y565 A567 G568 A574 A575 V576 P666 L689	V539-L572 HydrophobicContact CG1-CD2 3.88Å; Y565-L572 HydrophobicContact CD1-CD2 4.45Å; Y565-L572 HydrophobicContact CD2-CD1 4.13Å; Y565-L572 HydrophobicContact CG-CD1 3.93Å; Y565-L572 HydrophobicContact CG-CD2 4.49Å; A567-L572 HydrophobicContact CB-CD2 3.92Å; A567-L572 HydrophobicContact CB-CG 3.96Å; G568-L572 PolarHBondContact O-N 2.79Å; L572-A574 PolarHBondContact O-N 3.44Å; L572-A575 PolarHBondContact O-N 3.1Å; L572-V576 VanDerWaalsContact O-CB 3.27Å; L572-V576 WeakPolarHBondContact O-CB 3.31Å; L572-V576 WeakPolarHBondContact O-CG2 3.13Å; L572-V576 PolarHBondContact O-N 3.5Å; L572-P666 HydrophobicContact CD1-CG 4.12Å; L572-L689 HydrophobicContact CD2-CD2 4.48Å
573	R	89.1	Confident	87.2	Confident	142 Å²	142	44.1 Å²	44.1	54%	0.536	26%	0.264	S	S	.	.	H	α-helix	trans	-61.4	-44	178.7	-165	-178.7	-144.9	162.8	7.2	111.7	A569 G570 Q571 N577	A569-R573 VanDerWaalsContact O-CB 3.31Å; A569-R573 WeakPolarHBondContact O-CB 3.47Å; A569-R573 PolarHBondContact O-N 3.41Å; G570-R573 PolarHBondContact O-N 3.06Å; Q571-R573 VanDerWaalsContact C-N 3.34Å; Q571-R573 PolarHBondContact O-N 2.78Å; R573-N577 WeakPolarHBondContact O-CB 3.36Å; R573-N577 PolarHBondContact O-N 3.31Å; R573-N577 PolarHBondContact O-ND2 2.93Å; R573-N577 PolarHBondContact O-OD1 3.35Å
574	A	87.6	Confident	87.4	Confident	19 Å²	19	43.9 Å²	43.9	16%	0.157	26%	0.263	C	S	.	.	H	α-helix	trans	-61.8	-50	177.5	0	0	0	0	0	111.4	A516 L522 G570 Q571 L572 N577 L578	A516-A574 HydrophobicContact CB-CB 3.81Å; L522-A574 HydrophobicContact CD1-CB 3.76Å; G570-A574 WeakPolarHBondContact O-CB 3.47Å; G570-A574 PolarHBondContact O-N 2.79Å; Q571-A574 PolarHBondContact O-N 2.79Å; L572-A574 PolarHBondContact O-N 3.44Å; A574-N577 PolarHBondContact O-N 3.08Å; A574-L578 WeakPolarHBondContact O-CB 3.36Å; A574-L578 PolarHBondContact O-N 2.91Å
575	A	91	Very high	87.7	Confident	12 Å²	12	47.3 Å²	47.3	10%	0.099	26%	0.261	C	S	.	.	H	α-helix	trans	-66.6	-40.7	-179.7	0	0	0	0	0	113.4	A516 F525 Q571 L572 L578 A579	A516-A575 HydrophobicContact CB-CB 4.11Å; F525-A575 HydrophobicContact CE1-CB 4.3Å; F525-A575 HydrophobicContact CZ-CB 3.65Å; Q571-A575 WeakPolarHBondContact O-CB 3.24Å; Q571-A575 PolarHBondContact O-N 3.22Å; L572-A575 PolarHBondContact O-N 3.1Å; A575-L578 PolarHBondContact O-N 2.79Å; A575-A579 WeakPolarHBondContact O-CB 3.25Å; A575-A579 PolarHBondContact O-N 3.22Å
576	V	92.3	Very high	87.7	Confident	1 Å²	1	46 Å²	46	1%	0.006	26%	0.255	C	S	.	.	H	α-helix	trans	-60.1	-48.8	172.7	171	0	0	0	0	109.5	L572 L578 A579 R610 K662 L689	L572-V576 VanDerWaalsContact O-CB 3.27Å; L572-V576 WeakPolarHBondContact O-CB 3.31Å; L572-V576 WeakPolarHBondContact O-CG2 3.13Å; L572-V576 PolarHBondContact O-N 3.5Å; V576-L578 VanDerWaalsContact C-N 3.31Å; V576-L578 PolarHBondContact O-N 2.81Å; V576-A579 PolarHBondContact O-N 2.81Å; V576-R610 VanDerWaalsContact CG1-NH1 3.29Å; V576-K662 HydrophobicContact CG1-CD 4.29Å; V576-K662 HydrophobicContact CG1-CG 3.42Å; V576-K662 VanDerWaalsContact CG1-CG 3.42Å; V576-K662 WeakPolarHBondContact CG1-O 3.39Å; V576-K662 WeakPolarHBondContact O-CD 3.25Å; V576-K662 WeakPolarHBondContact O-CE 3.44Å; V576-K662 PolarHBondContact O-NZ 2.99Å; V576-L689 HydrophobicContact CG2-CD2 3.75Å
577	N	88.7	Confident	88.1	Confident	79 Å²	79	42.4 Å²	42.4	42%	0.422	23%	0.226	S	C	.	.	H	α-helix	trans	-62.7	-35	-179.9	-73.6	-4.3	0	0	0	113.1	R573 A574 R610 K662	R573-N577 WeakPolarHBondContact O-CB 3.36Å; R573-N577 PolarHBondContact O-N 3.31Å; R573-N577 PolarHBondContact O-ND2 2.93Å; R573-N577 PolarHBondContact O-OD1 3.35Å; A574-N577 PolarHBondContact O-N 3.08Å; N577-R610 PolarHBondContact OD1-NH1 3.18Å; N577-R610 PolarHBondContact OD1-NH2 3.29Å; N577-K662 VanDerWaalsContact C-NZ 3.26Å; N577-K662 PolarHBondContact O-NZ 3.24Å
578	L	87.3	Confident	88.1	Confident	30 Å²	30	43.7 Å²	43.7	16%	0.157	23%	0.231	C	C	.	.	H	α-helix	trans	-71.9	-36.3	176.4	-174.1	62.3	0	0	0	112.7	Q497 A574 A575 V576 D694 K695	Q497-L578 HydrophobicContact CB-CD2 4.37Å; Q497-L578 WeakPolarHBondContact O-CD2 3.33Å; A574-L578 WeakPolarHBondContact O-CB 3.36Å; A574-L578 PolarHBondContact O-N 2.91Å; A575-L578 PolarHBondContact O-N 2.79Å; V576-L578 VanDerWaalsContact C-N 3.31Å; V576-L578 PolarHBondContact O-N 2.81Å; L578-D694 WeakPolarHBondContact CD1-OD1 3.38Å; L578-K695 WeakPolarHBondContact O-CB 3.42Å; L578-K695 PolarHBondContact O-N 3.43Å
579	A	91	Very high	88.1	Confident	3 Å²	3	48 Å²	48	3%	0.025	24%	0.24	C	C	.	.	S	Bend	trans	-66.4	151.9	-178.6	0	0	0	0	0	113.2	A575 V576 K662 C691	A575-A579 WeakPolarHBondContact O-CB 3.25Å; A575-A579 PolarHBondContact O-N 3.22Å; V576-A579 PolarHBondContact O-N 2.81Å; A579-K662 PolarHBondContact O-NZ 3.14Å; A579-C691 HydrophobicContact CB-CB 3.62Å
580	E	87.9	Confident	87.7	Confident	65 Å²	65	44.2 Å²	44.2	30%	0.304	21%	0.208	S	C	.	.	S	Bend	trans	-73.1	-46.1	178.7	-60.5	-176.1	146.5	0	0	111.6	R692 R886	E580-R692 PolarHBondContact N-O 2.6Å; E580-R886 VanDerWaalsContact CD-NH1 3.32Å; E580-R886 WeakPolarHBondContact OE1-CD 3.06Å; E580-R886 IonicContact OE1-CZ 2.76Å; E580-R886 IonicContact OE1-NE 3.19Å; E580-R886 IonicContact OE1-NH1 2.92Å; E580-R886 PolarHBondContact OE1-NH1 3.43Å
581	R	90.7	Very high	87.2	Confident	146 Å²	146	42.9 Å²	42.9	55%	0.551	20%	0.195	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-139.7	142.7	178	-174.8	173.8	178.9	171	0.3	108.6	C691 R692	R581-C691 CarbonylContact O-C 3.57Å; R581-C691 WeakPolarHBondContact O-CA 3.45Å; R581-R692 PolarHBondContact N-O 2.85Å; R581-R692 PolarHBondContact O-N 3.22Å
582	C	93.7	Very high	85.9	Confident	0 Å²	0	45.1 Å²	45.1	0%	0	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	146.3	168.9	-63.8	0	0	0	0	109.5	S660 L665 L689 L690 C691	C582-S660 WeakPolarHBondContact O-CA 3.26Å; C582-L665 HydrophobicContact CB-CD1 4.1Å; C582-L689 HydrophobicContact CB-CD1 4.23Å; C582-L690 CarbonylContact C-O 3.49Å; C582-L690 VanDerWaalsContact CA-O 3.24Å; C582-L690 WeakPolarHBondContact CA-O 3.26Å; C582-C691 HydrophobicContact CB-CB 4.19Å; C582-C691 WeakPolarHBondContact CB-SG 3.24Å; C582-C691 WeakPolarHBondContact SG-CB 3.35Å; C582-C691 CovalentContact SG-SG 2.05Å; C582-C691 PolarHBondContact SG-SG 3.24Å
583	E	93.6	Very high	84.1	Confident	38 Å²	38	44.9 Å²	44.9	18%	0.178	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.5	155.3	174.4	64.6	-174	-151.1	0	0	111.7	W536 V658 L659 L690	W536-E583 HydrophobicContact CZ3-CG 4.21Å; E583-V658 HydrophobicContact CB-CG1 4.09Å; E583-L659 CarbonylContact C-O 3.46Å; E583-L659 WeakPolarHBondContact CA-O 3.41Å; E583-L690 HydrophobicContact CG-CB 4.01Å; E583-L690 PolarHBondContact N-O 2.9Å; E583-L690 PolarHBondContact O-N 3.22Å
584	Q	92.4	Very high	82.4	Confident	0 Å²	0	46.3 Å²	46.3	0%	0	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.6	129.6	174.1	-165.5	161.8	21.1	0	0	109.2	Y565 L659 L665 L686 G687	Y565-Q584 PolarHBondContact OH-NE2 2.82Å; Q584-L659 PolarHBondContact N-O 2.83Å; Q584-L659 PolarHBondContact O-N 3.04Å; Q584-L665 HydrophobicContact CB-CD2 3.76Å; Q584-L686 HydrophobicContact CG-CD1 3.86Å; Q584-L686 HydrophobicContact CG-CG 4.49Å; Q584-G687 WeakPolarHBondContact CG-O 3.33Å; Q584-G687 PolarHBondContact NE2-O 2.83Å
585	R	90.2	Very high	80.6	Confident	145 Å²	145	50.8 Å²	50.8	55%	0.547	23%	0.228	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.6	132.4	-178.8	-89.1	179.1	172.1	-149.7	-3.7	110.7	T656 I657 V658 G687	R585-T656 HydrophobicContact CG-CG2 4.43Å; R585-I657 WeakPolarHBondContact CA-O 3.07Å; R585-V658 HydrophobicContact CG-CG2 4.02Å; R585-G687 PolarHBondContact O-N 3.34Å
586	L	86.6	Confident	78.5	Confident	1 Å²	1	52.6 Å²	52.6	1%	0.005	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	120.9	165	175.1	68.5	0	0	0	107.2	W618 I657 I670 M672 Y684 T685 L686	L586-W618 HydrophobicContact CD2-CE3 3.79Å; L586-W618 HydrophobicContact CD2-CH2 3.95Å; L586-W618 HydrophobicContact CD2-CZ3 3.27Å; L586-I657 HydrophobicContact CB-CB 4.24Å; L586-I657 HydrophobicContact CD2-CD1 4.14Å; L586-I657 PolarHBondContact N-O 3.41Å; L586-I657 PolarHBondContact O-N 3.28Å; L586-I670 HydrophobicContact CD1-CD1 3.77Å; L586-I670 HydrophobicContact CD2-CD1 4.28Å; L586-M672 HydrophobicContact CD2-CE 4.41Å; L586-Y684 HydrophobicContact CD1-CD2 3.76Å; L586-Y684 HydrophobicContact CD1-CG 4.31Å; L586-T685 WeakPolarHBondContact CA-O 3.4Å; L586-L686 HydrophobicContact CB-CD1 4.45Å; L586-L686 HydrophobicContact CD1-CD1 4.5Å
587	A	86.1	Confident	76.2	Confident	29 Å²	29	59.5 Å²	59.5	24%	0.24	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	125.3	170.3	0	0	0	0	0	108.3	Y684 T685	A587-Y684 CarbonylContact O-C 3.56Å; A587-Y684 WeakPolarHBondContact O-CA 3.19Å; A587-T685 PolarHBondContact N-O 3.26Å; A587-T685 PolarHBondContact O-N 3.34Å
588	L	80	Confident	74	Confident	36 Å²	36	57.4 Å²	57.4	19%	0.188	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	132	173.1	179	67.4	0	0	0	107.9	S654 D655 M672	L588-S654 CarbonylContact O-C 3.56Å; L588-S654 VanDerWaalsContact O-CA 3.24Å; L588-S654 WeakPolarHBondContact O-CA 3.15Å; L588-D655 HydrophobicContact CB-CB 4.49Å; L588-D655 PolarHBondContact N-O 2.84Å; L588-D655 PolarHBondContact O-N 2.83Å; L588-M672 HydrophobicContact CD1-CE 4.35Å; L588-M672 HydrophobicContact CD1-SD 4.37Å
589	R	81.4	Confident	72	Confident	116 Å²	116	67.6 Å²	67.6	44%	0.438	30%	0.303	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123	137.6	176.5	-73.4	-178.9	74.2	-145.5	2.8	108.1	W652 T653 A682 D683	R589-W652 HydrophobicContact CB-CE3 4.3Å; R589-W652 HydrophobicContact CB-CZ3 4.32Å; R589-T653 WeakPolarHBondContact CA-O 3.3Å; R589-A682 CarbonylContact O-C 3.6Å; R589-A682 WeakPolarHBondContact O-CA 3.34Å; R589-A682 WeakPolarHBondContact O-CB 3.46Å; R589-D683 WeakPolarHBondContact CB-OD1 3.43Å; R589-D683 PolarHBondContact N-O 3.21Å; R589-D683 IonicContact NH1-OD1 3.46Å; R589-D683 IonicContact NH1-OD2 3.73Å; R589-D683 PolarHBondContact NH1-OD2 2.76Å; R589-D683 PolarHBondContact O-N 2.86Å
590	C	74.4	Confident	70	Confident	5 Å²	5	74.5 Å²	74.5	3%	0.034	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.7	142.6	-169.2	54.4	0	0	0	0	110.3	C645 W652 T653	C590-C645 HydrophobicContact CB-CB 3.8Å; C590-C645 WeakPolarHBondContact CB-SG 3.37Å; C590-C645 WeakPolarHBondContact SG-CA 3.44Å; C590-C645 WeakPolarHBondContact SG-CB 3.22Å; C590-C645 CovalentContact SG-SG 2.02Å; C590-C645 PolarHBondContact SG-SG 2.82Å; C590-W652 VanDerWaalsContact C-CE3 3.48Å; C590-W652 WeakPolarHBondContact O-CA 3.22Å; C590-T653 PolarHBondContact N-O 2.84Å; C590-T653 PolarHBondContact O-N 2.97Å; C590-T653 PolarHBondContact SG-OG1 2.66Å
591	G	70.1	Confident	68.3	Low	7 Å²	7	74.6 Å²	74.6	7%	0.072	36%	0.358	C	S	.	.	S	Bend	trans	-101.6	-130.3	170.8	0	0	0	0	0	112.1	A593 E681	G591-A593 PolarHBondContact O-N 2.75Å; G591-E681 PolarHBondContact N-O 3.11Å
592	T	59.8	Low	66.6	Low	61 Å²	61	71.8 Å²	71.8	37%	0.374	36%	0.357	S	S	.	.	S	Bend	trans	-60.3	16.4	-179	42.5	0	0	0	0	116.4	N650 Q677 H679	T592-N650 WeakPolarHBondContact CG2-OD1 3.46Å; T592-Q677 PolarHBondContact O-OE1 2.83Å; T592-H679 PolarHBondContact OG1-O 3.44Å
593	A	51.8	Low	64.9	Low	8 Å²	8	75 Å²	75	7%	0.066	38%	0.378	C	S	.	.	P	Polyproline II helix	trans	-88.8	118.4	-176.7	0	0	0	0	0	111.4	G591 T675	G591-A593 PolarHBondContact O-N 2.75Å; A593-T675 HydrophobicContact CB-CG2 3.85Å
594	R	53.1	Low	63.6	Low	171 Å²	171	75.9 Å²	75.9	65%	0.645	38%	0.384	S	S	*	.	P	Polyproline II helix	trans	-88.9	130.5	159.5	-171.3	175.4	-178.6	-178.4	0.5	108.5
595	R	50.3	Low	62.7	Low	113 Å²	113	76.9 Å²	76.9	43%	0.426	39%	0.391	S	S	.	.	P	Polyproline II helix	trans	-55.4	128.7	177.5	-151.1	-179.9	-166.9	179.3	4.7	109.7	D597	R595-D597 PolarHBondContact O-N 2.96Å
596	P	46.1	Very low	62.2	Low	51 Å²	51	73 Å²	73	33%	0.331	38%	0.376	S	S	.	.	P	Polyproline II helix	trans	-68.1	126.9	174.6	-7.8	21	0	0	0	108.5	L604 T675	P596-L604 HydrophobicContact CB-CD1 3.72Å; P596-L604 HydrophobicContact CG-CD1 3.94Å; P596-L604 WeakPolarHBondContact O-CD1 3.17Å; P596-T675 WeakPolarHBondContact CG-O 3.47Å
597	D	44.1	Very low	62.3	Low	146 Å²	146	73.2 Å²	73.2	78%	0.781	38%	0.377	S	S	*	.	P	Polyproline II helix	trans	-75.3	125.9	169.2	-149.3	-2	0	0	0	108.1	R595 R599	R595-D597 PolarHBondContact O-N 2.96Å; D597-R599 PolarHBondContact O-N 2.77Å; D597-R599 VanDerWaalsContact O-N 3.1Å
598	S	43.8	Very low	62.4	Low	35 Å²	35	72.1 Å²	72.1	25%	0.245	37%	0.367	C	S	.	.			trans	-72.7	104.3	-179.9	-178.7	0	0	0	0	108.9	D600 G601 T602	S598-D600 PolarHBondContact O-N 3.2Å; S598-G601 PolarHBondContact O-N 2.91Å; S598-G601 PolarHBondContact OG-N 2.8Å; S598-T602 WeakPolarHBondContact CB-O 3.23Å; S598-T602 PolarHBondContact OG-N 2.98Å; S598-T602 PolarHBondContact OG-O 2.79Å
599	R	45.3	Very low	62.8	Low	244 Å²	244	70.5 Å²	70.5	92%	0.921	36%	0.359	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.4	-16.8	-179.7	-68.8	-173.2	177.4	-169	-0.2	113.6	D597	D597-R599 PolarHBondContact O-N 2.77Å; D597-R599 VanDerWaalsContact O-N 3.1Å
600	D	49.5	Very low	63.1	Low	148 Å²	148	68 Å²	68	79%	0.791	35%	0.35	S	S	*	.	T	Hydrogen-bonded Turn	trans	-119.6	7.7	-177.1	-65.2	-29.4	0	0	0	114	S598 T602	S598-D600 PolarHBondContact O-N 3.2Å; D600-T602 VanDerWaalsContact C-N 3.29Å; D600-T602 PolarHBondContact O-N 2.84Å
601	G	51.3	Low	63.6	Low	66 Å²	66	70 Å²	70	68%	0.68	36%	0.362	S	S	*	.			trans	74.7	9	179.3	0	0	0	0	0	115.7	S598	S598-G601 PolarHBondContact O-N 2.91Å; S598-G601 PolarHBondContact OG-N 2.8Å
602	T	54.4	Low	64.3	Low	88 Å²	88	76 Å²	76	54%	0.54	39%	0.393	S	S	.	.			trans	-77.4	126.2	174.2	-9	0	0	0	0	110.9	S598 D600 L604	S598-T602 WeakPolarHBondContact CB-O 3.23Å; S598-T602 PolarHBondContact OG-N 2.98Å; S598-T602 PolarHBondContact OG-O 2.79Å; D600-T602 VanDerWaalsContact C-N 3.29Å; D600-T602 PolarHBondContact O-N 2.84Å; T602-L604 PolarHBondContact O-N 2.9Å
603	P	58.8	Low	65.6	Low	68 Å²	68	78 Å²	78	44%	0.442	40%	0.398	S	S	.	.			trans	-71.8	125.4	-178.4	25.7	-31.6	0	0	0	112	T616	P603-T616 HydrophobicContact CB-CG2 3.6Å; P603-T616 HydrophobicContact CG-CG2 3.62Å
604	L	65.4	Low	67.1	Low	55 Å²	55	82 Å²	82	29%	0.288	42%	0.421	S	S	.	.	S	Bend	trans	-83.1	-9.2	-174.6	-67.8	173.2	0	0	0	114.4	P596 T602 T673	P596-L604 HydrophobicContact CB-CD1 3.72Å; P596-L604 HydrophobicContact CG-CD1 3.94Å; P596-L604 WeakPolarHBondContact O-CD1 3.17Å; T602-L604 PolarHBondContact O-N 2.9Å; L604-T673 WeakPolarHBondContact CA-OG1 3.3Å; L604-T673 WeakPolarHBondContact CB-OG1 3.43Å; L604-T673 VanDerWaalsContact O-CB 3.31Å; L604-T673 WeakPolarHBondContact O-CB 3.42Å; L604-T673 VanDerWaalsContact O-CG2 3.29Å; L604-T673 WeakPolarHBondContact O-CG2 3.47Å; L604-T673 PolarHBondContact O-N 3.08Å; L604-T673 PolarHBondContact O-OG1 3.05Å
605	S	74.1	Confident	68.4	Low	22 Å²	22	74.8 Å²	74.8	15%	0.154	39%	0.394	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.2	138.9	179	59.2	0	0	0	0	110.2	V671	S605-V671 CarbonylContact C-O 3.56Å; S605-V671 VanDerWaalsContact CA-O 3.29Å; S605-V671 WeakPolarHBondContact CA-O 3.36Å
606	W	80.3	Confident	69.6	Low	64 Å²	64	73 Å²	73	24%	0.242	40%	0.396	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.1	167.9	178	64.2	90.4	0	0	0	111.3	L558 T614 H615 T616 V671	L558-W606 HydrophobicContact CD2-CH2 4.1Å; W606-T614 HydrophobicContact CB-CG2 3.69Å; W606-T614 HydrophobicContact CD2-CG2 4.4Å; W606-T614 HydrophobicContact CG-CG2 3.54Å; W606-H615 CarbonylContact C-O 3.59Å; W606-H615 VanDerWaalsContact CA-O 3.29Å; W606-H615 WeakPolarHBondContact CA-O 3.31Å; W606-H615 VanDerWaalsContact CB-O 3.31Å; W606-H615 WeakPolarHBondContact CB-O 3.4Å; W606-T616 HydrophobicContact CB-CG2 4.11Å; W606-V671 HydrophobicContact CD2-CB 3.92Å; W606-V671 HydrophobicContact CD2-CG1 4.3Å; W606-V671 HydrophobicContact CE3-CB 4.44Å; W606-V671 HydrophobicContact CE3-CG1 4.43Å; W606-V671 HydrophobicContact CG-CB 4.36Å; W606-V671 HydrophobicContact CH2-CB 4.28Å; W606-V671 HydrophobicContact CH2-CG1 3.62Å; W606-V671 HydrophobicContact CZ2-CB 3.75Å; W606-V671 HydrophobicContact CZ2-CG1 3.45Å; W606-V671 VanDerWaalsContact CZ2-CG1 3.45Å; W606-V671 HydrophobicContact CZ2-CG2 3.99Å; W606-V671 HydrophobicContact CZ3-CG1 4.11Å; W606-V671 PolarHBondContact N-O 3.21Å; W606-V671 PolarHBondContact O-N 3.48Å
607	W	87.1	Confident	70.6	Confident	5 Å²	5	72 Å²	72	2%	0.019	39%	0.391	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.7	157.5	173.1	62.1	-81.8	0	0	0	111	H615 S617 W618 L659 H664 V667 Q669 I670	W607-H615 VanDerWaalsContact CD1-O 3.29Å; W607-H615 HydrophobicContact CD2-CB 3.82Å; W607-H615 AromaticContact CE2-CG 3.93Å; W607-H615 HydrophobicContact CE3-CB 4.45Å; W607-H615 AromaticContact CE3-CD2 3.98Å; W607-H615 HydrophobicContact CG-CB 4.2Å; W607-H615 HydrophobicContact CH2-CB 4.34Å; W607-H615 AromaticContact CH2-CD2 3.75Å; W607-H615 HydrophobicContact CZ2-CB 3.64Å; W607-H615 AromaticContact CZ2-CD2 3.95Å; W607-H615 AromaticContact CZ2-CG 3.76Å; W607-H615 AromaticContact CZ3-CD2 3.76Å; W607-H615 PolarHBondContact N-O 3.21Å; W607-H615 PolarHBondContact O-N 2.96Å; W607-S617 PolarHBondContact NE1-O 2.89Å; W607-W618 HydrophobicContact CB-CH2 3.74Å; W607-W618 HydrophobicContact CB-CZ3 4.04Å; W607-W618 AromaticContact CD1-CE3 3.69Å; W607-W618 AromaticContact CD1-CH2 3.58Å; W607-W618 AromaticContact CD1-CZ2 3.93Å; W607-W618 AromaticContact CD1-CZ3 3.42Å; W607-W618 VanDerWaalsContact CD1-CZ3 3.42Å; W607-W618 AromaticContact CG-CH2 3.98Å; W607-W618 HydrophobicContact CG-CH2 3.98Å; W607-W618 AromaticContact CG-CZ3 3.9Å; W607-W618 HydrophobicContact CG-CZ3 3.9Å; W607-L659 HydrophobicContact CD2-CD1 4.19Å; W607-L659 HydrophobicContact CE3-CD1 4.42Å; W607-L659 HydrophobicContact CH2-CD1 4.38Å; W607-L659 HydrophobicContact CZ2-CD1 4.19Å; W607-L659 HydrophobicContact CZ2-CD2 4.02Å; W607-H664 HydrophobicContact CH2-CB 3.51Å; W607-H664 HydrophobicContact CZ3-CB 4.04Å; W607-V667 HydrophobicContact CB-CG1 4.42Å; W607-V667 HydrophobicContact CD2-CG2 4.46Å; W607-V667 HydrophobicContact CE3-CG1 4.46Å; W607-V667 HydrophobicContact CE3-CG2 3.83Å; W607-V667 HydrophobicContact CZ3-CG2 4.12Å; W607-Q669 CarbonylContact C-O 3.51Å; W607-Q669 VanDerWaalsContact CA-O 3.29Å; W607-Q669 WeakPolarHBondContact CA-O 3.48Å; W607-Q669 WeakPolarHBondContact CB-O 3.39Å; W607-I670 HydrophobicContact CB-CG1 4.25Å
608	V	89.3	Confident	71.9	Confident	6 Å²	6	66.3 Å²	66.3	4%	0.036	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	132.1	177.8	-174	0	0	0	0	108.6	T668 Q669	V608-T668 PolarHBondContact O-N 2.94Å; V608-T668 PolarHBondContact O-OG1 2.84Å; V608-T668 VanDerWaalsContact O-OG1 3.11Å; V608-Q669 HydrophobicContact CB-CB 3.94Å; V608-Q669 HydrophobicContact CG2-CB 4.14Å; V608-Q669 PolarHBondContact N-O 3.34Å; V608-Q669 PolarHBondContact O-N 3.43Å
609	G	89	Confident	72.5	Confident	2 Å²	2	65 Å²	65	2%	0.021	35%	0.35	C	S	.	.			trans	-97.8	-159.6	-178.7	0	0	0	0	0	114	T611 N612 H664 P666 T668	G609-T611 VanDerWaalsContact C-N 3.31Å; G609-T611 PolarHBondContact O-N 3.5Å; G609-N612 PolarHBondContact O-N 2.97Å; G609-H664 CarbonylContact C-O 3.53Å; G609-H664 WeakPolarHBondContact CA-O 3.44Å; G609-P666 CarbonylContact C-O 3.51Å; G609-P666 WeakPolarHBondContact CA-O 3.19Å; G609-T668 PolarHBondContact O-OG1 3.36Å; G609-T668 VanDerWaalsContact O-OG1 3.08Å
610	R	86.8	Confident	73	Confident	64 Å²	64	55.4 Å²	55.4	24%	0.242	33%	0.328	C	S	.	.	T	Hydrogen-bonded Turn	trans	-72.4	-19.5	175.6	68.6	163.5	178.3	-179.3	12.4	114.5	V576 N577 N612 E663 H664 L665 P666	V576-R610 VanDerWaalsContact CG1-NH1 3.29Å; N577-R610 PolarHBondContact OD1-NH1 3.18Å; N577-R610 PolarHBondContact OD1-NH2 3.29Å; R610-N612 VanDerWaalsContact C-N 3.28Å; R610-E663 PolarHBondContact NE-O 3.28Å; R610-E663 PolarHBondContact NH2-O 2.95Å; R610-H664 PolarHBondContact N-O 2.78Å; R610-L665 WeakPolarHBondContact CD-O 3.36Å; R610-L665 WeakPolarHBondContact CG-O 3.22Å; R610-L665 PolarHBondContact NE-O 2.86Å; R610-P666 PolarHBondContact N-O 3.05Å
611	T	85	Confident	73.1	Confident	47 Å²	47	48.6 Å²	48.6	29%	0.288	29%	0.292	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.2	-3.9	178.2	51.2	0	0	0	0	112.3	G609 E613	G609-T611 VanDerWaalsContact C-N 3.31Å; G609-T611 PolarHBondContact O-N 3.5Å; T611-E613 WeakPolarHBondContact CB-OE2 3.4Å; T611-E613 PolarHBondContact O-N 3.08Å; T611-E613 PolarHBondContact OG1-OE2 2.84Å
612	N	85.1	Confident	73.2	Confident	133 Å²	133	52 Å²	52	71%	0.711	29%	0.294	S	S	*	.			trans	59.3	21.9	-172.2	-157.8	49.4	0	0	0	113.3	G609 R610	G609-N612 PolarHBondContact O-N 2.97Å; R610-N612 VanDerWaalsContact C-N 3.28Å
613	E	85.9	Confident	72.9	Confident	103 Å²	103	52.2 Å²	52.2	48%	0.481	30%	0.297	S	S	.	.			trans	-90.2	147.6	173.1	-67.2	163.9	162.7	0	0	109.7	T611 H615	T611-E613 WeakPolarHBondContact CB-OE2 3.4Å; T611-E613 PolarHBondContact O-N 3.08Å; T611-E613 PolarHBondContact OG1-OE2 2.84Å; E613-H615 PolarHBondContact O-CD2 3.3Å
614	T	84.4	Confident	72.4	Confident	90 Å²	90	56.7 Å²	56.7	55%	0.552	32%	0.317	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-87.8	123.8	178.3	-62.3	0	0	0	0	110	W606	W606-T614 HydrophobicContact CB-CG2 3.69Å; W606-T614 HydrophobicContact CD2-CG2 4.4Å; W606-T614 HydrophobicContact CG-CG2 3.54Å
615	H	81.3	Confident	71.8	Confident	20 Å²	20	55.8 Å²	55.8	9%	0.093	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	123.7	178.3	-59.3	-77.3	0	0	0	110.5	W606 W607 E613 H664	W606-H615 CarbonylContact C-O 3.59Å; W606-H615 VanDerWaalsContact CA-O 3.29Å; W606-H615 WeakPolarHBondContact CA-O 3.31Å; W606-H615 VanDerWaalsContact CB-O 3.31Å; W606-H615 WeakPolarHBondContact CB-O 3.4Å; W607-H615 VanDerWaalsContact CD1-O 3.29Å; W607-H615 HydrophobicContact CD2-CB 3.82Å; W607-H615 AromaticContact CE2-CG 3.93Å; W607-H615 HydrophobicContact CE3-CB 4.45Å; W607-H615 AromaticContact CE3-CD2 3.98Å; W607-H615 HydrophobicContact CG-CB 4.2Å; W607-H615 HydrophobicContact CH2-CB 4.34Å; W607-H615 AromaticContact CH2-CD2 3.75Å; W607-H615 HydrophobicContact CZ2-CB 3.64Å; W607-H615 AromaticContact CZ2-CD2 3.95Å; W607-H615 AromaticContact CZ2-CG 3.76Å; W607-H615 AromaticContact CZ3-CD2 3.76Å; W607-H615 PolarHBondContact N-O 3.21Å; W607-H615 PolarHBondContact O-N 2.96Å; E613-H615 PolarHBondContact O-CD2 3.3Å; H615-H664 AromaticContact CE1-CD2 3.28Å; H615-H664 PolarHBondContact CE1-CD2 3.22Å; H615-H664 AromaticContact CE1-CE1 3.58Å; H615-H664 AromaticContact CE1-CG 3.29Å; H615-H664 AromaticContact CE1-ND1 3.46Å; H615-H664 PolarHBondContact CE1-ND1 3.12Å; H615-H664 AromaticContact CE1-NE2 3.49Å; H615-H664 PolarHBondContact CE1-NE2 2.84Å; H615-H664 AromaticContact ND1-ND1 3.85Å; H615-H664 AromaticContact NE2-CD2 3.62Å; H615-H664 AromaticContact NE2-CG 3.5Å
616	T	74.2	Confident	71.1	Confident	76 Å²	76	61.5 Å²	61.5	47%	0.466	34%	0.341	S	S	.	.			trans	-101.7	-12.4	178.9	54.1	0	0	0	0	112.5	P603 W606 W618	P603-T616 HydrophobicContact CB-CG2 3.6Å; P603-T616 HydrophobicContact CG-CG2 3.62Å; W606-T616 HydrophobicContact CB-CG2 4.11Å; T616-W618 PolarHBondContact O-NE1 2.87Å
617	S	67.8	Low	70.4	Confident	31 Å²	31	62 Å²	62	22%	0.217	35%	0.345	C	S	.	.			trans	-81.7	144.4	173.5	55.3	0	0	0	0	111.3	W607	W607-S617 PolarHBondContact NE1-O 2.89Å
618	W	70.7	Confident	69.5	Low	25 Å²	25	62 Å²	62	10%	0.095	35%	0.346	C	S	.	.			trans	-127	138.1	-177.6	-64.2	98	0	0	0	109.5	L586 W607 T616 S621 I657 I670	L586-W618 HydrophobicContact CD2-CE3 3.79Å; L586-W618 HydrophobicContact CD2-CH2 3.95Å; L586-W618 HydrophobicContact CD2-CZ3 3.27Å; W607-W618 HydrophobicContact CB-CH2 3.74Å; W607-W618 HydrophobicContact CB-CZ3 4.04Å; W607-W618 AromaticContact CD1-CE3 3.69Å; W607-W618 AromaticContact CD1-CH2 3.58Å; W607-W618 AromaticContact CD1-CZ2 3.93Å; W607-W618 AromaticContact CD1-CZ3 3.42Å; W607-W618 VanDerWaalsContact CD1-CZ3 3.42Å; W607-W618 AromaticContact CG-CH2 3.98Å; W607-W618 HydrophobicContact CG-CH2 3.98Å; W607-W618 AromaticContact CG-CZ3 3.9Å; W607-W618 HydrophobicContact CG-CZ3 3.9Å; T616-W618 PolarHBondContact O-NE1 2.87Å; W618-S621 PolarHBondContact O-OG 2.8Å; W618-I657 HydrophobicContact CB-CD1 4.17Å; W618-I657 HydrophobicContact CB-CG2 3.95Å; W618-I657 HydrophobicContact CD2-CD1 4.38Å; W618-I657 HydrophobicContact CE3-CD1 4.23Å; W618-I657 HydrophobicContact CE3-CG2 4.22Å; W618-I657 HydrophobicContact CG-CD1 4.4Å; W618-I670 HydrophobicContact CH2-CG2 4.28Å
619	G	56.2	Low	68.6	Low	7 Å²	7	63 Å²	63	7%	0.072	35%	0.352	C	S	.	.	T	Hydrogen-bonded Turn	trans	81.9	22.2	163.9	0	0	0	0	0	117.2	S621 L632 V658	G619-S621 PolarHBondContact O-N 2.81Å; G619-L632 WeakPolarHBondContact O-CD1 3.47Å; G619-V658 CarbonylContact C-O 3.35Å; G619-V658 WeakPolarHBondContact CA-O 3.2Å
620	G	56	Low	67.8	Low	44 Å²	44	63.5 Å²	63.5	45%	0.454	36%	0.355	S	S	.	.	T	Hydrogen-bonded Turn	trans	75.4	9.7	177.8	0	0	0	0	0	114.6
621	S	52.1	Low	67.1	Low	5 Å²	5	61.1 Å²	61.1	4%	0.035	35%	0.35	C	S	.	.	P	Polyproline II helix	trans	-68.6	153.5	171	70.4	0	0	0	0	111.4	W618 G619 A625	W618-S621 PolarHBondContact O-OG 2.8Å; G619-S621 PolarHBondContact O-N 2.81Å; S621-A625 VanDerWaalsContact CB-O 3.32Å; S621-A625 WeakPolarHBondContact CB-O 3.29Å; S621-A625 PolarHBondContact OG-O 2.85Å
622	L	52.8	Low	66.5	Low	137 Å²	137	63 Å²	63	72%	0.717	36%	0.358	S	S	*	.	P	Polyproline II helix	trans	-53.2	149.3	170.4	-81.1	155.6	0	0	0	109.7	D624 A625	L622-D624 PolarHBondContact O-N 2.8Å; L622-D624 VanDerWaalsContact O-N 3.12Å; L622-A625 HydrophobicContact CB-CB 4.45Å; L622-A625 PolarHBondContact O-N 3.46Å
623	P	48.1	Very low	66.1	Low	93 Å²	93	62.8 Å²	62.8	60%	0.604	35%	0.353	S	S	*	.	T	Hydrogen-bonded Turn	trans	-48.3	126.1	163	-16.9	28.9	0	0	0	107.3
624	D	49	Very low	65.6	Low	161 Å²	161	61.2 Å²	61.2	86%	0.861	36%	0.364	S	S	*	.	T	Hydrogen-bonded Turn	trans	92.6	-12.4	-175.8	-46.8	-33.8	0	0	0	117.9	L622 Q626	L622-D624 PolarHBondContact O-N 2.8Å; L622-D624 VanDerWaalsContact O-N 3.12Å; D624-Q626 PolarHBondContact O-N 3.02Å
625	A	52.4	Low	65.4	Low	36 Å²	36	61.4 Å²	61.4	30%	0.298	36%	0.362	S	S	.	.			trans	-85.9	92.6	175.1	0	0	0	0	0	111	S621 L622 K627	S621-A625 VanDerWaalsContact CB-O 3.32Å; S621-A625 WeakPolarHBondContact CB-O 3.29Å; S621-A625 PolarHBondContact OG-O 2.85Å; L622-A625 HydrophobicContact CB-CB 4.45Å; L622-A625 PolarHBondContact O-N 3.46Å; A625-K627 PolarHBondContact O-N 2.81Å
626	Q	60.2	Low	65.3	Low	142 Å²	142	61.3 Å²	61.3	66%	0.664	36%	0.363	S	S	*	.			trans	-71.7	54.8	177.1	-60.7	-167.7	-3.8	0	0	113.4	D624 Y642	D624-Q626 PolarHBondContact O-N 3.02Å; Q626-Y642 WeakPolarHBondContact O-CB 3.31Å
627	K	65.2	Low	65.5	Low	76 Å²	76	63.3 Å²	63.3	33%	0.33	37%	0.369	S	S	.	.			trans	-120.6	143.2	-178.6	-56.7	-168.4	173.1	-168.7	0	112.7	A625 L632 Y642	A625-K627 PolarHBondContact O-N 2.81Å; K627-L632 HydrophobicContact CB-CD2 4.25Å; K627-L632 HydrophobicContact CB-CG 4.3Å; K627-L632 HydrophobicContact CD-CD2 4.44Å; K627-Y642 HydrophobicContact CD-CD1 4.06Å; K627-Y642 HydrophobicContact CG-CD1 4.01Å; K627-Y642 HydrophobicContact CG-CG 3.98Å
628	C	67.3	Low	65.8	Low	4 Å²	4	64 Å²	64	3%	0.027	37%	0.371	C	S	.	.			trans	-73.4	174.5	168	63.7	0	0	0	0	111.1	C630 G631 L632 Y642 C643 D655	C628-C630 WeakPolarHBondContact CB-SG 3.25Å; C628-C630 PolarHBondContact O-N 3.34Å; C628-C630 VanDerWaalsContact SG-CA 3.55Å; C628-C630 WeakPolarHBondContact SG-CB 3.43Å; C628-C630 PolarHBondContact SG-N 2.82Å; C628-C630 CovalentContact SG-SG 2.07Å; C628-C630 PolarHBondContact SG-SG 2.85Å; C628-G631 PolarHBondContact O-N 2.84Å; C628-G631 VanDerWaalsContact O-N 3.11Å; C628-G631 PolarHBondContact SG-N 3.35Å; C628-L632 WeakPolarHBondContact O-CG 3.33Å; C628-L632 PolarHBondContact O-N 3.08Å; C628-Y642 PolarHBondContact N-O 3.37Å; C628-Y642 PolarHBondContact SG-O 3.15Å; C628-C643 HydrophobicContact CB-CB 3.77Å; C628-C643 VanDerWaalsContact CB-SG 3.55Å; C628-C643 PolarHBondContact N-SG 3.23Å; C628-C643 WeakPolarHBondContact SG-CA 3.13Å; C628-D655 HydrophobicContact CB-CB 4.48Å
629	T	71.6	Confident	65.9	Low	27 Å²	27	68.4 Å²	68.4	17%	0.166	41%	0.406	C	S	.	.	H	α-helix	trans	-53.1	-43.4	168.9	-61.7	0	0	0	0	111.9	G631 L632 E633 T656	T629-G631 PolarHBondContact O-N 2.91Å; T629-L632 PolarHBondContact O-N 2.66Å; T629-E633 WeakPolarHBondContact O-CG 3.17Å; T629-E633 PolarHBondContact O-N 3.01Å; T629-T656 VanDerWaalsContact CB-O 3.22Å; T629-T656 WeakPolarHBondContact CB-O 3.39Å; T629-T656 PolarHBondContact OG1-O 3Å
630	C	71.4	Confident	66.7	Low	13 Å²	13	75.6 Å²	75.6	9%	0.088	44%	0.437	C	S	.	.	H	α-helix	trans	-60.4	-37.7	176.3	36.2	0	0	0	0	114.8	C628 E633 G634 N635 C636 D655	C628-C630 WeakPolarHBondContact CB-SG 3.25Å; C628-C630 PolarHBondContact O-N 3.34Å; C628-C630 VanDerWaalsContact SG-CA 3.55Å; C628-C630 WeakPolarHBondContact SG-CB 3.43Å; C628-C630 PolarHBondContact SG-N 2.82Å; C628-C630 CovalentContact SG-SG 2.07Å; C628-C630 PolarHBondContact SG-SG 2.85Å; C630-E633 PolarHBondContact O-N 2.89Å; C630-G634 PolarHBondContact O-N 2.76Å; C630-N635 WeakPolarHBondContact CA-OD1 3.18Å; C630-N635 PolarHBondContact O-N 2.75Å; C630-N635 PolarHBondContact O-OD1 2.93Å; C630-C636 HydrophobicContact CB-CB 4.46Å; C630-C636 VanDerWaalsContact CB-SG 3.53Å; C630-D655 PolarHBondContact SG-OD1 3.4Å
631	G	72.9	Confident	67.4	Low	13 Å²	13	77.3 Å²	77.3	13%	0.134	43%	0.431	C	S	.	.	H	α-helix	trans	-79.6	-22.1	179.8	0	0	0	0	0	112.8	C628 T629 C636 Y642	C628-G631 PolarHBondContact O-N 2.84Å; C628-G631 VanDerWaalsContact O-N 3.11Å; C628-G631 PolarHBondContact SG-N 3.35Å; T629-G631 PolarHBondContact O-N 2.91Å; G631-C636 VanDerWaalsContact CA-SG 3.53Å; G631-C636 PolarHBondContact N-SG 2.62Å; G631-Y642 WeakPolarHBondContact CA-O 3.41Å
632	L	72.8	Confident	68.4	Low	86 Å²	86	83.6 Å²	83.6	45%	0.45	45%	0.454	S	S	.	.	H	α-helix	trans	-75.8	-39.4	167.6	-67.2	173.4	0	0	0	111.3	G619 K627 C628 T629	G619-L632 WeakPolarHBondContact O-CD1 3.47Å; K627-L632 HydrophobicContact CB-CD2 4.25Å; K627-L632 HydrophobicContact CB-CG 4.3Å; K627-L632 HydrophobicContact CD-CD2 4.44Å; C628-L632 WeakPolarHBondContact O-CG 3.33Å; C628-L632 PolarHBondContact O-N 3.08Å; T629-L632 PolarHBondContact O-N 2.66Å
633	E	75.5	Confident	69.4	Low	130 Å²	130	77.5 Å²	77.5	61%	0.607	42%	0.423	S	S	*	.	H	α-helix	trans	-80.2	-15.9	178.8	-70.3	178.9	-177	0	0	113.5	T629 C630 N635	T629-E633 WeakPolarHBondContact O-CG 3.17Å; T629-E633 PolarHBondContact O-N 3.01Å; C630-E633 PolarHBondContact O-N 2.89Å; E633-N635 PolarHBondContact OE2-ND2 2.8Å
634	G	76.8	Confident	70.6	Confident	69 Å²	69	74.1 Å²	74.1	71%	0.711	40%	0.4	S	S	*	.	T	Hydrogen-bonded Turn	trans	74.7	23.1	-179.6	0	0	0	0	0	113.9	C630	C630-G634 PolarHBondContact O-N 2.76Å
635	N	79.6	Confident	71.8	Confident	95 Å²	95	67 Å²	67	51%	0.508	36%	0.363	S	S	.	.			trans	-120.5	22	-175.3	65.3	5.5	0	0	0	113.2	C630 E633	C630-N635 WeakPolarHBondContact CA-OD1 3.18Å; C630-N635 PolarHBondContact O-N 2.75Å; C630-N635 PolarHBondContact O-OD1 2.93Å; E633-N635 PolarHBondContact OE2-ND2 2.8Å
636	C	77.9	Confident	72.5	Confident	18 Å²	18	66.9 Å²	66.9	12%	0.122	36%	0.357	C	S	.	.			trans	-53.3	149	169.1	-68.1	0	0	0	0	111.1	C630 G631 D638	C630-C636 HydrophobicContact CB-CB 4.46Å; C630-C636 VanDerWaalsContact CB-SG 3.53Å; G631-C636 VanDerWaalsContact CA-SG 3.53Å; G631-C636 PolarHBondContact N-SG 2.62Å; C636-D638 WeakPolarHBondContact CB-O 3.03Å; C636-D638 PolarHBondContact O-N 3.07Å
637	I	78.4	Confident	72.7	Confident	117 Å²	117	61.1 Å²	61.1	60%	0.6	33%	0.334	S	S	*	.	S	Bend	trans	-54.3	-38.5	175.9	-65.9	169.9	0	0	0	110.6	N644 T653	I637-N644 HydrophobicContact CD1-CB 4.4Å; I637-N644 PolarHBondContact N-OD1 2.9Å; I637-T653 HydrophobicContact CD1-CG2 4.21Å
638	D	74.1	Confident	72.6	Confident	46 Å²	46	59 Å²	59	25%	0.246	33%	0.334	C	S	.	.	S	Bend	trans	-122.7	115.5	172.1	-173.3	-18.5	0	0	0	109.7	C636 Q640 Y641	C636-D638 WeakPolarHBondContact CB-O 3.03Å; C636-D638 PolarHBondContact O-N 3.07Å; D638-Q640 PolarHBondContact O-N 2.67Å; D638-Q640 VanDerWaalsContact O-N 3.14Å; D638-Q640 WeakPolarHBondContact OD1-CB 3.41Å; D638-Q640 WeakPolarHBondContact OD1-CG 3.41Å; D638-Q640 PolarHBondContact OD1-N 2.94Å; D638-Y641 HydrophobicContact CB-CD2 3.84Å; D638-Y641 HydrophobicContact CB-CE2 4.42Å; D638-Y641 PolarHBondContact O-N 2.81Å; D638-Y641 VanDerWaalsContact O-N 3.17Å; D638-Y641 WeakPolarHBondContact OD2-CE2 3.16Å
639	S	74.5	Confident	72.5	Confident	118 Å²	118	62.1 Å²	62.1	83%	0.825	35%	0.348	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.4	-12.3	179.6	60.3	0	0	0	0	114.8	Y641	S639-Y641 VanDerWaalsContact C-N 3.31Å
640	Q	72.9	Confident	72	Confident	157 Å²	157	67.9 Å²	67.9	73%	0.734	38%	0.378	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.5	-16.1	176	-60.8	-173.5	7.8	0	0	113.1	D638	D638-Q640 PolarHBondContact O-N 2.67Å; D638-Q640 VanDerWaalsContact O-N 3.14Å; D638-Q640 WeakPolarHBondContact OD1-CB 3.41Å; D638-Q640 WeakPolarHBondContact OD1-CG 3.41Å; D638-Q640 PolarHBondContact OD1-N 2.94Å
641	Y	70.5	Confident	72	Confident	81 Å²	81	74.4 Å²	74.4	32%	0.318	41%	0.407	S	S	.	.	S	Bend	trans	-113.3	149.8	-176.2	-63.7	-81.2	0	0	0	112	D638 S639 D646 A647	D638-Y641 HydrophobicContact CB-CD2 3.84Å; D638-Y641 HydrophobicContact CB-CE2 4.42Å; D638-Y641 PolarHBondContact O-N 2.81Å; D638-Y641 VanDerWaalsContact O-N 3.17Å; D638-Y641 WeakPolarHBondContact OD2-CE2 3.16Å; S639-Y641 VanDerWaalsContact C-N 3.31Å; Y641-D646 HydrophobicContact CD1-CB 3.97Å; Y641-D646 WeakPolarHBondContact CE1-O 3.06Å; Y641-D646 HydrophobicContact CG-CB 4.41Å; Y641-A647 HydrophobicContact CD2-CB 3.7Å; Y641-A647 HydrophobicContact CE2-CB 3.84Å; Y641-A647 HydrophobicContact CG-CB 4.11Å
642	Y	72.8	Confident	72.1	Confident	136 Å²	136	79.4 Å²	79.4	53%	0.533	42%	0.422	S	S	.	.	S	Bend	trans	-82.4	-18.1	179.4	-65.4	-39.6	0	0	0	113.5	Q626 K627 C628 G631	Q626-Y642 WeakPolarHBondContact O-CB 3.31Å; K627-Y642 HydrophobicContact CD-CD1 4.06Å; K627-Y642 HydrophobicContact CG-CD1 4.01Å; K627-Y642 HydrophobicContact CG-CG 3.98Å; C628-Y642 PolarHBondContact N-O 3.37Å; C628-Y642 PolarHBondContact SG-O 3.15Å; G631-Y642 WeakPolarHBondContact CA-O 3.41Å
643	C	73.2	Confident	72.2	Confident	10 Å²	10	76 Å²	76	7%	0.068	40%	0.404	C	S	.	.	S	Bend	trans	-142.2	155.2	171.5	-39	0	0	0	0	112.5	C628 C645 D646 D655	C628-C643 HydrophobicContact CB-CB 3.77Å; C628-C643 VanDerWaalsContact CB-SG 3.55Å; C628-C643 PolarHBondContact N-SG 3.23Å; C628-C643 WeakPolarHBondContact SG-CA 3.13Å; C643-C645 PolarHBondContact O-N 2.89Å; C643-D646 VanDerWaalsContact CB-OD2 3.25Å; C643-D646 WeakPolarHBondContact CB-OD2 3.37Å; C643-D646 PolarHBondContact N-OD2 3.12Å; C643-D646 WeakPolarHBondContact O-CB 3.48Å; C643-D646 PolarHBondContact O-N 3.36Å; C643-D646 PolarHBondContact SG-OD2 3.31Å; C643-D655 VanDerWaalsContact CB-OD2 3.32Å; C643-D655 WeakPolarHBondContact CB-OD2 3.46Å
644	N	74.6	Confident	72.4	Confident	22 Å²	22	72.5 Å²	72.5	12%	0.118	40%	0.395	C	S	.	.	G	3₁₀ helix	trans	-65.9	-30.2	178.1	-65	-36.4	0	0	0	111.7	I637 D646 T653 S654 D655	I637-N644 HydrophobicContact CD1-CB 4.4Å; I637-N644 PolarHBondContact N-OD1 2.9Å; N644-D646 VanDerWaalsContact C-N 3.26Å; N644-D646 PolarHBondContact O-N 2.72Å; N644-T653 PolarHBondContact O-OG1 2.79Å; N644-T653 VanDerWaalsContact O-OG1 3.13Å; N644-S654 PolarHBondContact ND2-O 3.41Å; N644-S654 VanDerWaalsContact ND2-O 3.09Å; N644-D655 VanDerWaalsContact CB-OD1 3.31Å; N644-D655 WeakPolarHBondContact CB-OD1 3.42Å; N644-D655 PolarHBondContact N-OD1 3.15Å
645	C	72.9	Confident	72.3	Confident	12 Å²	12	69.5 Å²	69.5	8%	0.081	36%	0.362	C	S	.	.	G	3₁₀ helix	trans	-76.3	-8.6	173.5	-69.3	0	0	0	0	114.4	C590 C643 A647 D655	C590-C645 HydrophobicContact CB-CB 3.8Å; C590-C645 WeakPolarHBondContact CB-SG 3.37Å; C590-C645 WeakPolarHBondContact SG-CA 3.44Å; C590-C645 WeakPolarHBondContact SG-CB 3.22Å; C590-C645 CovalentContact SG-SG 2.02Å; C590-C645 PolarHBondContact SG-SG 2.82Å; C643-C645 PolarHBondContact O-N 2.89Å; C645-A647 VanDerWaalsContact C-N 3.34Å; C645-D655 WeakPolarHBondContact CB-OD2 3.39Å; C645-D655 PolarHBondContact N-OD2 3.47Å; C645-D655 PolarHBondContact SG-OD2 2.78Å
646	D	68.2	Low	72.2	Confident	32 Å²	32	67.4 Å²	67.4	17%	0.171	35%	0.353	C	S	.	.	G	3₁₀ helix	trans	-82.4	-17	178.1	-62.6	-31.2	0	0	0	112.2	Y641 C643 N644	Y641-D646 HydrophobicContact CD1-CB 3.97Å; Y641-D646 WeakPolarHBondContact CE1-O 3.06Å; Y641-D646 HydrophobicContact CG-CB 4.41Å; C643-D646 VanDerWaalsContact CB-OD2 3.25Å; C643-D646 WeakPolarHBondContact CB-OD2 3.37Å; C643-D646 PolarHBondContact N-OD2 3.12Å; C643-D646 WeakPolarHBondContact O-CB 3.48Å; C643-D646 PolarHBondContact O-N 3.36Å; C643-D646 PolarHBondContact SG-OD2 3.31Å; N644-D646 VanDerWaalsContact C-N 3.26Å; N644-D646 PolarHBondContact O-N 2.72Å
647	A	64.4	Low	72.3	Confident	21 Å²	21	67.2 Å²	67.2	17%	0.174	35%	0.351	C	S	.	.	S	Bend	trans	-77.6	-17.3	-176.3	0	0	0	0	0	114.2	Y641 C645 Q649	Y641-A647 HydrophobicContact CD2-CB 3.7Å; Y641-A647 HydrophobicContact CE2-CB 3.84Å; Y641-A647 HydrophobicContact CG-CB 4.11Å; C645-A647 VanDerWaalsContact C-N 3.34Å; A647-Q649 HydrophobicContact CB-CG 4.16Å; A647-Q649 PolarHBondContact O-N 2.82Å
648	G	61.7	Low	72.6	Confident	32 Å²	32	63 Å²	63	33%	0.33	33%	0.33	S	S	.	.			trans	58.3	40.1	174.4	0	0	0	0	0	114.8
649	Q	64.8	Low	73.2	Confident	70 Å²	70	61.1 Å²	61.1	33%	0.327	32%	0.32	S	S	.	.			trans	-76.6	156.9	-179.2	-61.7	-172.4	9.8	0	0	112	A647 E651	A647-Q649 HydrophobicContact CB-CG 4.16Å; A647-Q649 PolarHBondContact O-N 2.82Å; Q649-E651 PolarHBondContact O-N 3.17Å
650	N	63.2	Low	73.8	Confident	148 Å²	148	57.3 Å²	57.3	79%	0.791	29%	0.294	S	S	*	.	S	Bend	trans	-73.5	-14.9	175.6	-79.1	-12.3	0	0	0	113.1	T592	T592-N650 WeakPolarHBondContact CG2-OD1 3.46Å
651	E	70.6	Confident	74.5	Confident	150 Å²	150	53 Å²	53	70%	0.701	27%	0.273	S	S	*	.	S	Bend	trans	-92.3	145.4	173.6	-66.8	-172.9	171.5	0	0	110.6	Q649 T653	Q649-E651 PolarHBondContact O-N 3.17Å; E651-T653 PolarHBondContact O-N 2.89Å
652	W	74.8	Confident	75.4	Confident	117 Å²	117	51 Å²	51	44%	0.443	27%	0.267	S	S	.	.			trans	-65.1	119.3	178.6	-80.6	89.5	0	0	0	111	R589 C590 E681 D683	R589-W652 HydrophobicContact CB-CE3 4.3Å; R589-W652 HydrophobicContact CB-CZ3 4.32Å; C590-W652 VanDerWaalsContact C-CE3 3.48Å; C590-W652 WeakPolarHBondContact O-CA 3.22Å; W652-E681 HydrophobicContact CH2-CB 3.98Å; W652-E681 HydrophobicContact CH2-CG 3.98Å; W652-E681 HydrophobicContact CZ2-CB 4.21Å; W652-E681 HydrophobicContact CZ2-CG 4.36Å; W652-D683 WeakPolarHBondContact CZ3-OD1 3.17Å
653	T	75.5	Confident	76.1	Confident	14 Å²	14	49 Å²	49	9%	0.086	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	165.9	172.5	61.4	0	0	0	0	110.9	R589 C590 I637 N644 E651	R589-T653 WeakPolarHBondContact CA-O 3.3Å; C590-T653 PolarHBondContact N-O 2.84Å; C590-T653 PolarHBondContact O-N 2.97Å; C590-T653 PolarHBondContact SG-OG1 2.66Å; I637-T653 HydrophobicContact CD1-CG2 4.21Å; N644-T653 PolarHBondContact O-OG1 2.79Å; N644-T653 VanDerWaalsContact O-OG1 3.13Å; E651-T653 PolarHBondContact O-N 2.89Å
654	S	79.5	Confident	76.8	Confident	58 Å²	58	50.1 Å²	50.1	41%	0.406	27%	0.266	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.6	138.3	-179.4	67.3	0	0	0	0	112	L588 N644	L588-S654 CarbonylContact O-C 3.56Å; L588-S654 VanDerWaalsContact O-CA 3.24Å; L588-S654 WeakPolarHBondContact O-CA 3.15Å; N644-S654 PolarHBondContact ND2-O 3.41Å; N644-S654 VanDerWaalsContact ND2-O 3.09Å
655	D	73.5	Confident	77.6	Confident	5 Å²	5	49 Å²	49	3%	0.027	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	127.8	167.8	-71.8	-46.5	0	0	0	109.6	L588 C628 C630 C643 N644 C645	L588-D655 HydrophobicContact CB-CB 4.49Å; L588-D655 PolarHBondContact N-O 2.84Å; L588-D655 PolarHBondContact O-N 2.83Å; C628-D655 HydrophobicContact CB-CB 4.48Å; C630-D655 PolarHBondContact SG-OD1 3.4Å; C643-D655 VanDerWaalsContact CB-OD2 3.32Å; C643-D655 WeakPolarHBondContact CB-OD2 3.46Å; N644-D655 VanDerWaalsContact CB-OD1 3.31Å; N644-D655 WeakPolarHBondContact CB-OD1 3.42Å; N644-D655 PolarHBondContact N-OD1 3.15Å; C645-D655 WeakPolarHBondContact CB-OD2 3.39Å; C645-D655 PolarHBondContact N-OD2 3.47Å; C645-D655 PolarHBondContact SG-OD2 2.78Å
656	T	78.7	Confident	78.6	Confident	52 Å²	52	48.6 Å²	48.6	32%	0.319	26%	0.257	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.6	129.9	167.7	-59.7	0	0	0	0	108.4	R585 T629 V658	R585-T656 HydrophobicContact CG-CG2 4.43Å; T629-T656 VanDerWaalsContact CB-O 3.22Å; T629-T656 WeakPolarHBondContact CB-O 3.39Å; T629-T656 PolarHBondContact OG1-O 3Å; T656-V658 HydrophobicContact CG2-CG2 4.48Å
657	I	80.2	Confident	79.7	Confident	14 Å²	14	47.1 Å²	47.1	7%	0.072	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	119.4	179.4	-60.3	168.3	0	0	0	107.4	R585 L586 W618 L659	R585-I657 WeakPolarHBondContact CA-O 3.07Å; L586-I657 HydrophobicContact CB-CB 4.24Å; L586-I657 HydrophobicContact CD2-CD1 4.14Å; L586-I657 PolarHBondContact N-O 3.41Å; L586-I657 PolarHBondContact O-N 3.28Å; W618-I657 HydrophobicContact CB-CD1 4.17Å; W618-I657 HydrophobicContact CB-CG2 3.95Å; W618-I657 HydrophobicContact CD2-CD1 4.38Å; W618-I657 HydrophobicContact CE3-CD1 4.23Å; W618-I657 HydrophobicContact CE3-CG2 4.22Å; W618-I657 HydrophobicContact CG-CD1 4.4Å; I657-L659 HydrophobicContact CG2-CD2 4.16Å
658	V	84.3	Confident	81	Confident	27 Å²	27	48.4 Å²	48.4	16%	0.164	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	112.8	174.8	-173.9	0	0	0	0	109.4	E583 R585 G619 T656	E583-V658 HydrophobicContact CB-CG1 4.09Å; R585-V658 HydrophobicContact CG-CG2 4.02Å; G619-V658 CarbonylContact C-O 3.35Å; G619-V658 WeakPolarHBondContact CA-O 3.2Å; T656-V658 HydrophobicContact CG2-CG2 4.48Å
659	L	87.1	Confident	82.4	Confident	7 Å²	7	49.7 Å²	49.7	4%	0.037	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.3	120.9	171.3	-57.6	176.2	0	0	0	108	E583 Q584 W607 I657 L665 V667	E583-L659 CarbonylContact C-O 3.46Å; E583-L659 WeakPolarHBondContact CA-O 3.41Å; Q584-L659 PolarHBondContact N-O 2.83Å; Q584-L659 PolarHBondContact O-N 3.04Å; W607-L659 HydrophobicContact CD2-CD1 4.19Å; W607-L659 HydrophobicContact CE3-CD1 4.42Å; W607-L659 HydrophobicContact CH2-CD1 4.38Å; W607-L659 HydrophobicContact CZ2-CD1 4.19Å; W607-L659 HydrophobicContact CZ2-CD2 4.02Å; I657-L659 HydrophobicContact CG2-CD2 4.16Å; L659-L665 HydrophobicContact CB-CD2 3.94Å; L659-L665 HydrophobicContact CD1-CD2 4.48Å; L659-V667 HydrophobicContact CD1-CG2 3.34Å
660	S	87	Confident	83.4	Confident	39 Å²	39	46.4 Å²	46.4	27%	0.273	24%	0.237	S	C	.	.			trans	-128	2.4	-176.7	62	0	0	0	0	114.8	C582 K662	C582-S660 WeakPolarHBondContact O-CA 3.26Å; S660-K662 PolarHBondContact O-N 2.94Å; S660-K662 VanDerWaalsContact O-N 3.16Å
661	Q	87.8	Confident	84.4	Confident	65 Å²	65	39.5 Å²	39.5	30%	0.304	20%	0.201	S	C	.	.			trans	-75.1	98.8	174.7	-79.2	-178.1	-0.3	0	0	109.7	E663 H664 L665	Q661-E663 HydrophobicContact CB-CG 4.49Å; Q661-E663 WeakPolarHBondContact CB-OE1 3.45Å; Q661-E663 VanDerWaalsContact CG-OE1 3.27Å; Q661-E663 WeakPolarHBondContact CG-OE1 3.21Å; Q661-E663 PolarHBondContact O-N 3.38Å; Q661-H664 PolarHBondContact O-N 2.84Å; Q661-H664 VanDerWaalsContact O-N 3.12Å; Q661-H664 PolarHBondContact OE1-CE1 3.29Å; Q661-H664 PolarHBondContact OE1-ND1 3.49Å; Q661-L665 PolarHBondContact O-N 2.93Å
662	K	88.8	Confident	84.8	Confident	41 Å²	41	33.2 Å²	33.2	18%	0.178	17%	0.171	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.2	-34	-173	178.3	179.2	145.5	160.5	0	112.7	V576 N577 A579 S660 H664	V576-K662 HydrophobicContact CG1-CD 4.29Å; V576-K662 HydrophobicContact CG1-CG 3.42Å; V576-K662 VanDerWaalsContact CG1-CG 3.42Å; V576-K662 WeakPolarHBondContact CG1-O 3.39Å; V576-K662 WeakPolarHBondContact O-CD 3.25Å; V576-K662 WeakPolarHBondContact O-CE 3.44Å; V576-K662 PolarHBondContact O-NZ 2.99Å; N577-K662 VanDerWaalsContact C-NZ 3.26Å; N577-K662 PolarHBondContact O-NZ 3.24Å; A579-K662 PolarHBondContact O-NZ 3.14Å; S660-K662 PolarHBondContact O-N 2.94Å; S660-K662 VanDerWaalsContact O-N 3.16Å; K662-H664 PolarHBondContact O-N 3.21Å
663	E	86.6	Confident	84.5	Confident	92 Å²	92	28.8 Å²	28.8	43%	0.43	16%	0.157	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58	-31.8	178.2	53.6	-79	-179.4	0	0	112.8	R610 Q661	R610-E663 PolarHBondContact NE-O 3.28Å; R610-E663 PolarHBondContact NH2-O 2.95Å; Q661-E663 HydrophobicContact CB-CG 4.49Å; Q661-E663 WeakPolarHBondContact CB-OE1 3.45Å; Q661-E663 VanDerWaalsContact CG-OE1 3.27Å; Q661-E663 WeakPolarHBondContact CG-OE1 3.21Å; Q661-E663 PolarHBondContact O-N 3.38Å
664	H	89.1	Confident	83.9	Confident	34 Å²	34	29.1 Å²	29.1	16%	0.157	16%	0.159	C	C	.	.	T	Hydrogen-bonded Turn	trans	-101.6	-22.9	-176	-54.6	145.7	0	0	0	113.4	W607 G609 R610 H615 Q661 K662	W607-H664 HydrophobicContact CH2-CB 3.51Å; W607-H664 HydrophobicContact CZ3-CB 4.04Å; G609-H664 CarbonylContact C-O 3.53Å; G609-H664 WeakPolarHBondContact CA-O 3.44Å; R610-H664 PolarHBondContact N-O 2.78Å; H615-H664 AromaticContact CE1-CD2 3.28Å; H615-H664 PolarHBondContact CE1-CD2 3.22Å; H615-H664 AromaticContact CE1-CE1 3.58Å; H615-H664 AromaticContact CE1-CG 3.29Å; H615-H664 AromaticContact CE1-ND1 3.46Å; H615-H664 PolarHBondContact CE1-ND1 3.12Å; H615-H664 AromaticContact CE1-NE2 3.49Å; H615-H664 PolarHBondContact CE1-NE2 2.84Å; H615-H664 AromaticContact ND1-ND1 3.85Å; H615-H664 AromaticContact NE2-CD2 3.62Å; H615-H664 AromaticContact NE2-CG 3.5Å; Q661-H664 PolarHBondContact O-N 2.84Å; Q661-H664 VanDerWaalsContact O-N 3.12Å; Q661-H664 PolarHBondContact OE1-CE1 3.29Å; Q661-H664 PolarHBondContact OE1-ND1 3.49Å; K662-H664 PolarHBondContact O-N 3.21Å
665	L	91.3	Very high	82.8	Confident	0 Å²	0	27.6 Å²	27.6	0%	0	15%	0.147	C	C	.	.	P	Polyproline II helix	trans	-76.5	153.3	-179.7	-71	175.6	0	0	0	113.9	C582 Q584 R610 L659 Q661 V667 L689	C582-L665 HydrophobicContact CB-CD1 4.1Å; Q584-L665 HydrophobicContact CB-CD2 3.76Å; R610-L665 WeakPolarHBondContact CD-O 3.36Å; R610-L665 WeakPolarHBondContact CG-O 3.22Å; R610-L665 PolarHBondContact NE-O 2.86Å; L659-L665 HydrophobicContact CB-CD2 3.94Å; L659-L665 HydrophobicContact CD1-CD2 4.48Å; Q661-L665 PolarHBondContact O-N 2.93Å; L665-V667 HydrophobicContact CD2-CG2 4.21Å; L665-L689 HydrophobicContact CB-CD1 4.01Å; L665-L689 HydrophobicContact CD1-CD1 4.25Å
666	P	93.6	Very high	81.8	Confident	2 Å²	2	30.1 Å²	30.1	1%	0.013	17%	0.174	C	C	.	.	S	Bend	cis	-77.3	161.9	-1.8	26.9	-33.6	0	0	0	114.7	Y565 L572 G609 R610 T668 L689	Y565-P666 HydrophobicContact CE1-CB 4.14Å; Y565-P666 HydrophobicContact CE2-CB 3.93Å; Y565-P666 HydrophobicContact CE2-CG 4.11Å; Y565-P666 WeakPolarHBondContact OH-CB 3.07Å; L572-P666 HydrophobicContact CD1-CG 4.12Å; G609-P666 CarbonylContact C-O 3.51Å; G609-P666 WeakPolarHBondContact CA-O 3.19Å; R610-P666 PolarHBondContact N-O 3.05Å; P666-T668 PolarHBondContact O-N 2.78Å; P666-L689 HydrophobicContact CB-CB 4.33Å; P666-L689 HydrophobicContact CB-CD1 4.14Å; P666-L689 HydrophobicContact CB-CD2 4.03Å; P666-L689 HydrophobicContact CB-CG 4.39Å; P666-L689 HydrophobicContact CG-CD2 4.21Å
667	V	92.4	Very high	80.9	Confident	1 Å²	1	31.5 Å²	31.5	1%	0.006	18%	0.177	C	C	.	.	P	Polyproline II helix	trans	-68.2	125.7	168.8	-179.4	0	0	0	0	109.5	Y565 W607 L659 L665 I670 L686	Y565-V667 VanDerWaalsContact CE2-O 3.25Å; Y565-V667 WeakPolarHBondContact CE2-O 3.33Å; Y565-V667 PolarHBondContact OH-O 2.98Å; W607-V667 HydrophobicContact CB-CG1 4.42Å; W607-V667 HydrophobicContact CD2-CG2 4.46Å; W607-V667 HydrophobicContact CE3-CG1 4.46Å; W607-V667 HydrophobicContact CE3-CG2 3.83Å; W607-V667 HydrophobicContact CZ3-CG2 4.12Å; L659-V667 HydrophobicContact CD1-CG2 3.34Å; L665-V667 HydrophobicContact CD2-CG2 4.21Å; V667-I670 HydrophobicContact CG1-CD1 4.18Å; V667-I670 HydrophobicContact CG1-CG1 3.74Å; V667-L686 HydrophobicContact CB-CD1 4.35Å; V667-L686 HydrophobicContact CB-CD2 4.03Å; V667-L686 HydrophobicContact CG1-CD2 4.03Å; V667-L686 HydrophobicContact CG2-CD1 4.37Å
668	T	90.7	Very high	79.7	Confident	49 Å²	49	35.2 Å²	35.2	30%	0.301	20%	0.202	S	C	.	.			trans	-109.5	-22.4	179.3	58.4	0	0	0	0	112.4	S562 F563 V608 G609 P666	S562-T668 CarbonylContact C-O 3.55Å; S562-T668 WeakPolarHBondContact CA-O 3.43Å; F563-T668 PolarHBondContact N-O 3.01Å; V608-T668 PolarHBondContact O-N 2.94Å; V608-T668 PolarHBondContact O-OG1 2.84Å; V608-T668 VanDerWaalsContact O-OG1 3.11Å; G609-T668 PolarHBondContact O-OG1 3.36Å; G609-T668 VanDerWaalsContact O-OG1 3.08Å; P666-T668 PolarHBondContact O-N 2.78Å
669	Q	90.4	Very high	78.5	Confident	58 Å²	58	42.2 Å²	42.2	27%	0.271	23%	0.233	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.7	144.4	177	-165.5	-179.3	-2	0	0	111.2	V561 W607 V608 V671	V561-Q669 WeakPolarHBondContact O-CA 3.34Å; V561-Q669 WeakPolarHBondContact O-CG 3.48Å; W607-Q669 CarbonylContact C-O 3.51Å; W607-Q669 VanDerWaalsContact CA-O 3.29Å; W607-Q669 WeakPolarHBondContact CA-O 3.48Å; W607-Q669 WeakPolarHBondContact CB-O 3.39Å; V608-Q669 HydrophobicContact CB-CB 3.94Å; V608-Q669 HydrophobicContact CG2-CB 4.14Å; V608-Q669 PolarHBondContact N-O 3.34Å; V608-Q669 PolarHBondContact O-N 3.43Å; Q669-V671 HydrophobicContact CG-CG2 4.27Å
670	I	87.2	Confident	77.3	Confident	1 Å²	1	42 Å²	42	1%	0.005	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	134.3	168.3	-64.6	176.5	0	0	0	108.3	V561 F563 L586 W607 W618 V667 M672 Y684 L686	V561-I670 PolarHBondContact N-O 2.62Å; V561-I670 PolarHBondContact O-N 2.03Å; F563-I670 HydrophobicContact CE2-CB 4.13Å; F563-I670 HydrophobicContact CE2-CD1 3.84Å; F563-I670 HydrophobicContact CE2-CG1 3.88Å; F563-I670 HydrophobicContact CZ-CD1 4.32Å; L586-I670 HydrophobicContact CD1-CD1 3.77Å; L586-I670 HydrophobicContact CD2-CD1 4.28Å; W607-I670 HydrophobicContact CB-CG1 4.25Å; W618-I670 HydrophobicContact CH2-CG2 4.28Å; V667-I670 HydrophobicContact CG1-CD1 4.18Å; V667-I670 HydrophobicContact CG1-CG1 3.74Å; I670-M672 HydrophobicContact CG2-CE 3.83Å; I670-M672 HydrophobicContact CG2-CG 4.05Å; I670-Y684 HydrophobicContact CB-CE2 4.26Å; I670-Y684 HydrophobicContact CD1-CD2 4.35Å; I670-Y684 HydrophobicContact CD1-CE2 4.02Å; I670-Y684 HydrophobicContact CG2-CE2 4.02Å; I670-L686 HydrophobicContact CD1-CB 4.48Å; I670-L686 HydrophobicContact CD1-CD1 4.25Å; I670-L686 HydrophobicContact CD1-CD2 4.4Å
671	V	83.7	Confident	76.6	Confident	4 Å²	4	43.1 Å²	43.1	2%	0.024	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	123.8	174.9	-173.6	0	0	0	0	109.2	L558 S559 A560 S605 W606 Q669	L558-V671 HydrophobicContact CD2-CG1 3.74Å; L558-V671 HydrophobicContact CG-CG1 4.37Å; S559-V671 WeakPolarHBondContact O-CA 3.45Å; A560-V671 HydrophobicContact CB-CG2 4.06Å; S605-V671 CarbonylContact C-O 3.56Å; S605-V671 VanDerWaalsContact CA-O 3.29Å; S605-V671 WeakPolarHBondContact CA-O 3.36Å; W606-V671 HydrophobicContact CD2-CB 3.92Å; W606-V671 HydrophobicContact CD2-CG1 4.3Å; W606-V671 HydrophobicContact CE3-CB 4.44Å; W606-V671 HydrophobicContact CE3-CG1 4.43Å; W606-V671 HydrophobicContact CG-CB 4.36Å; W606-V671 HydrophobicContact CH2-CB 4.28Å; W606-V671 HydrophobicContact CH2-CG1 3.62Å; W606-V671 HydrophobicContact CZ2-CB 3.75Å; W606-V671 HydrophobicContact CZ2-CG1 3.45Å; W606-V671 VanDerWaalsContact CZ2-CG1 3.45Å; W606-V671 HydrophobicContact CZ2-CG2 3.99Å; W606-V671 HydrophobicContact CZ3-CG1 4.11Å; W606-V671 PolarHBondContact N-O 3.21Å; W606-V671 PolarHBondContact O-N 3.48Å; Q669-V671 HydrophobicContact CG-CG2 4.27Å
672	M	77.8	Confident	76	Confident	17 Å²	17	40.4 Å²	40.4	8%	0.084	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	133.2	173.9	-60.7	-163	-173.9	0	0	109.3	L549 S559 L586 L588 I670 Y684	L549-M672 HydrophobicContact CD1-CB 3.73Å; L549-M672 HydrophobicContact CD1-CG 4.25Å; L549-M672 HydrophobicContact CD1-SD 3.57Å; L549-M672 VanDerWaalsContact CD1-SD 3.57Å; L549-M672 HydrophobicContact CD2-CB 4.47Å; S559-M672 PolarHBondContact N-O 2.75Å; S559-M672 PolarHBondContact O-N 3.08Å; L586-M672 HydrophobicContact CD2-CE 4.41Å; L588-M672 HydrophobicContact CD1-CE 4.35Å; L588-M672 HydrophobicContact CD1-SD 4.37Å; I670-M672 HydrophobicContact CG2-CE 3.83Å; I670-M672 HydrophobicContact CG2-CG 4.05Å; M672-Y684 HydrophobicContact CE-CD1 3.47Å; M672-Y684 VanDerWaalsContact CE-CD1 3.47Å; M672-Y684 HydrophobicContact CE-CD2 4.22Å; M672-Y684 HydrophobicContact CE-CE1 3.89Å; M672-Y684 HydrophobicContact CE-CG 3.64Å; M672-Y684 HydrophobicContact CG-CD1 4.49Å; M672-Y684 HydrophobicContact CG-CE1 4.17Å; M672-Y684 HydrophobicContact SD-CD1 3.48Å; M672-Y684 WeakPolarHBondContact SD-CD1 3.45Å; M672-Y684 HydrophobicContact SD-CE1 3.73Å; M672-Y684 HydrophobicContact SD-CG 4.25Å
673	T	69.9	Low	75.7	Confident	24 Å²	24	39.6 Å²	39.6	15%	0.147	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.6	157.5	171.2	64.1	0	0	0	0	110.4	L558 L604	L558-T673 HydrophobicContact CD1-CG2 4.09Å; L558-T673 HydrophobicContact CG-CG2 4.06Å; L604-T673 WeakPolarHBondContact CA-OG1 3.3Å; L604-T673 WeakPolarHBondContact CB-OG1 3.43Å; L604-T673 VanDerWaalsContact O-CB 3.31Å; L604-T673 WeakPolarHBondContact O-CB 3.42Å; L604-T673 VanDerWaalsContact O-CG2 3.29Å; L604-T673 WeakPolarHBondContact O-CG2 3.47Å; L604-T673 PolarHBondContact O-N 3.08Å; L604-T673 PolarHBondContact O-OG1 3.05Å
674	D	61.8	Low	75.6	Confident	21 Å²	21	35.2 Å²	35.2	11%	0.112	20%	0.199	C	C	.	.			trans	-58	134.8	-179.3	-174.3	-7.5	0	0	0	112.8	G551 A552 P557 G676	G551-D674 VanDerWaalsContact CA-OD1 3.31Å; G551-D674 WeakPolarHBondContact CA-OD1 3.45Å; A552-D674 PolarHBondContact N-OD2 2.93Å; P557-D674 HydrophobicContact CG-CB 4.13Å; D674-G676 PolarHBondContact O-N 2.84Å; D674-G676 VanDerWaalsContact O-N 3.07Å; D674-G676 PolarHBondContact OD1-N 2.85Å
675	T	56.2	Low	75.6	Confident	26 Å²	26	36.1 Å²	36.1	16%	0.16	21%	0.207	C	C	.	.			trans	-53.2	-10.5	168.3	48.6	0	0	0	0	116.2	A593 P596 Q677 S680	A593-T675 HydrophobicContact CB-CG2 3.85Å; P596-T675 WeakPolarHBondContact CG-O 3.47Å; T675-Q677 PolarHBondContact O-N 3.37Å; T675-Q677 VanDerWaalsContact O-N 3.08Å; T675-S680 WeakPolarHBondContact CB-OG 3.35Å; T675-S680 WeakPolarHBondContact OG1-CB 3.48Å; T675-S680 PolarHBondContact OG1-OG 2.95Å
676	G	54.2	Low	75.6	Confident	59 Å²	59	36.7 Å²	36.7	61%	0.608	21%	0.21	S	C	*	.	S	Bend	trans	70.4	6.9	167.1	0	0	0	0	0	115.7	D674	D674-G676 PolarHBondContact O-N 2.84Å; D674-G676 VanDerWaalsContact O-N 3.07Å; D674-G676 PolarHBondContact OD1-N 2.85Å
677	Q	58	Low	75.5	Confident	81 Å²	81	37.5 Å²	37.5	38%	0.379	22%	0.218	S	C	.	.	S	Bend	trans	-113.5	137.9	174.5	-70.5	-174	-25.6	0	0	110.5	T592 T675 H679 S680	T592-Q677 PolarHBondContact O-OE1 2.83Å; T675-Q677 PolarHBondContact O-N 3.37Å; T675-Q677 VanDerWaalsContact O-N 3.08Å; Q677-H679 PolarHBondContact O-N 3.15Å; Q677-S680 PolarHBondContact O-OG 3.46Å
678	P	55.1	Low	75.5	Confident	92 Å²	92	39.6 Å²	39.6	60%	0.597	23%	0.232	S	C	*	.	T	Hydrogen-bonded Turn	trans	-62.4	131	169.4	-14.9	28.1	0	0	0	109.3
679	H	59.3	Low	75.7	Confident	174 Å²	174	37.3 Å²	37.3	81%	0.806	22%	0.218	S	C	*	.	T	Hydrogen-bonded Turn	trans	77.3	12.1	177.3	-42.6	-55.1	0	0	0	117.6	T592 Q677	T592-H679 PolarHBondContact OG1-O 3.44Å; Q677-H679 PolarHBondContact O-N 3.15Å
680	S	63.5	Low	76	Confident	3 Å²	3	36.5 Å²	36.5	2%	0.021	22%	0.215	C	C	.	.			trans	-77	131.6	166	43.9	0	0	0	0	111.1	G551 T675 Q677	G551-S680 PolarHBondContact N-O 3.01Å; T675-S680 WeakPolarHBondContact CB-OG 3.35Å; T675-S680 WeakPolarHBondContact OG1-CB 3.48Å; T675-S680 PolarHBondContact OG1-OG 2.95Å; Q677-S680 PolarHBondContact O-OG 3.46Å
681	E	71.3	Confident	76.4	Confident	62 Å²	62	36.6 Å²	36.6	29%	0.29	22%	0.216	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	135.3	174.1	-162.6	168.1	-148.2	0	0	109.2	T548 L549 R550 G591 W652	T548-E681 HydrophobicContact CG2-CG 3.89Å; L549-E681 WeakPolarHBondContact O-CA 3.45Å; R550-E681 HydrophobicContact CG-CG 4.28Å; R550-E681 IonicContact CZ-OE1 3.38Å; R550-E681 IonicContact NE-OE1 2.96Å; R550-E681 PolarHBondContact NE-OE1 3.21Å; R550-E681 IonicContact NH2-OE1 2.94Å; R550-E681 PolarHBondContact NH2-OE1 3.1Å; G591-E681 PolarHBondContact N-O 3.11Å; W652-E681 HydrophobicContact CH2-CB 3.98Å; W652-E681 HydrophobicContact CH2-CG 3.98Å; W652-E681 HydrophobicContact CZ2-CB 4.21Å; W652-E681 HydrophobicContact CZ2-CG 4.36Å
682	A	75.8	Confident	76.7	Confident	8 Å²	8	40.7 Å²	40.7	7%	0.066	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.6	145.3	173.8	0	0	0	0	0	109.5	T548 L549 R589	T548-A682 CarbonylContact C-O 3.48Å; L549-A682 HydrophobicContact CB-CB 4.49Å; L549-A682 PolarHBondContact N-O 2.75Å; L549-A682 PolarHBondContact O-N 2.95Å; R589-A682 CarbonylContact O-C 3.6Å; R589-A682 WeakPolarHBondContact O-CA 3.34Å; R589-A682 WeakPolarHBondContact O-CB 3.46Å
683	D	82.7	Confident	77.2	Confident	23 Å²	23	40.1 Å²	40.1	12%	0.123	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	144.8	173.5	60.7	-46.4	0	0	0	111	V547 R589 W652	V547-D683 CarbonylContact O-C 3.57Å; V547-D683 VanDerWaalsContact O-CA 3.22Å; V547-D683 WeakPolarHBondContact O-CA 3.34Å; R589-D683 WeakPolarHBondContact CB-OD1 3.43Å; R589-D683 PolarHBondContact N-O 3.21Å; R589-D683 IonicContact NH1-OD1 3.46Å; R589-D683 IonicContact NH1-OD2 3.73Å; R589-D683 PolarHBondContact NH1-OD2 2.76Å; R589-D683 PolarHBondContact O-N 2.86Å; W652-D683 WeakPolarHBondContact CZ3-OD1 3.17Å
684	Y	84.6	Confident	78	Confident	0 Å²	0	39.2 Å²	39.2	0%	0	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	148	173.4	71.8	-96	0	0	0	112.6	A546 V547 L549 V561 F563 L586 A587 I670 M672	A546-Y684 WeakPolarHBondContact CA-O 3.01Å; V547-Y684 HydrophobicContact CB-CD1 3.98Å; V547-Y684 HydrophobicContact CB-CD2 4.32Å; V547-Y684 HydrophobicContact CB-CE1 3.55Å; V547-Y684 HydrophobicContact CB-CE2 3.91Å; V547-Y684 HydrophobicContact CB-CG 4.36Å; V547-Y684 HydrophobicContact CG1-CD1 4.31Å; V547-Y684 HydrophobicContact CG1-CE1 3.54Å; V547-Y684 HydrophobicContact CG2-CE1 4.29Å; V547-Y684 HydrophobicContact CG2-CE2 3.83Å; V547-Y684 PolarHBondContact N-O 3.26Å; V547-Y684 PolarHBondContact O-N 3.03Å; L549-Y684 HydrophobicContact CD1-CD1 4.31Å; L549-Y684 HydrophobicContact CD1-CE1 4.42Å; L549-Y684 HydrophobicContact CD2-CE1 4.48Å; V561-Y684 WeakPolarHBondContact CB-OH 3.4Å; V561-Y684 WeakPolarHBondContact CG2-OH 3.38Å; F563-Y684 HydrophobicContact CZ-CE2 4.25Å; L586-Y684 HydrophobicContact CD1-CD2 3.76Å; L586-Y684 HydrophobicContact CD1-CG 4.31Å; A587-Y684 CarbonylContact O-C 3.56Å; A587-Y684 WeakPolarHBondContact O-CA 3.19Å; I670-Y684 HydrophobicContact CB-CE2 4.26Å; I670-Y684 HydrophobicContact CD1-CD2 4.35Å; I670-Y684 HydrophobicContact CD1-CE2 4.02Å; I670-Y684 HydrophobicContact CG2-CE2 4.02Å; M672-Y684 HydrophobicContact CE-CD1 3.47Å; M672-Y684 VanDerWaalsContact CE-CD1 3.47Å; M672-Y684 HydrophobicContact CE-CD2 4.22Å; M672-Y684 HydrophobicContact CE-CE1 3.89Å; M672-Y684 HydrophobicContact CE-CG 3.64Å; M672-Y684 HydrophobicContact CG-CD1 4.49Å; M672-Y684 HydrophobicContact CG-CE1 4.17Å; M672-Y684 HydrophobicContact SD-CD1 3.48Å; M672-Y684 WeakPolarHBondContact SD-CD1 3.45Å; M672-Y684 HydrophobicContact SD-CE1 3.73Å; M672-Y684 HydrophobicContact SD-CG 4.25Å
685	T	88.8	Confident	79	Confident	53 Å²	53	42 Å²	42	33%	0.325	24%	0.235	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	126.1	178.2	66.1	0	0	0	0	110	D545 A546 L586 A587	D545-T685 WeakPolarHBondContact O-CB 3.23Å; D545-T685 VanDerWaalsContact O-CG2 3.26Å; D545-T685 WeakPolarHBondContact O-CG2 3.13Å; A546-T685 HydrophobicContact CB-CG2 3.84Å; L586-T685 WeakPolarHBondContact CA-O 3.4Å; A587-T685 PolarHBondContact N-O 3.26Å; A587-T685 PolarHBondContact O-N 3.34Å
686	L	91.3	Very high	80.2	Confident	13 Å²	13	41.2 Å²	41.2	7%	0.068	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.5	129	173.1	-175.4	66.6	0	0	0	109.7	H541 F563 Q584 L586 V667 I670	H541-L686 PolarHBondContact NE2-O 3.27Å; H541-L686 VanDerWaalsContact NE2-O 3.12Å; F563-L686 HydrophobicContact CB-CD2 4.24Å; F563-L686 HydrophobicContact CD1-CB 4.44Å; F563-L686 HydrophobicContact CD1-CD2 3.67Å; F563-L686 HydrophobicContact CD2-CD2 3.56Å; F563-L686 HydrophobicContact CE1-CB 3.83Å; F563-L686 HydrophobicContact CE1-CD2 3.83Å; F563-L686 HydrophobicContact CE1-CG 4.46Å; F563-L686 HydrophobicContact CE2-CB 4.48Å; F563-L686 HydrophobicContact CE2-CD2 3.73Å; F563-L686 HydrophobicContact CG-CD2 3.53Å; F563-L686 HydrophobicContact CZ-CB 3.85Å; F563-L686 HydrophobicContact CZ-CD2 3.85Å; Q584-L686 HydrophobicContact CG-CD1 3.86Å; Q584-L686 HydrophobicContact CG-CG 4.49Å; L586-L686 HydrophobicContact CB-CD1 4.45Å; L586-L686 HydrophobicContact CD1-CD1 4.5Å; V667-L686 HydrophobicContact CB-CD1 4.35Å; V667-L686 HydrophobicContact CB-CD2 4.03Å; V667-L686 HydrophobicContact CG1-CD2 4.03Å; V667-L686 HydrophobicContact CG2-CD1 4.37Å; I670-L686 HydrophobicContact CD1-CB 4.48Å; I670-L686 HydrophobicContact CD1-CD1 4.25Å; I670-L686 HydrophobicContact CD1-CD2 4.4Å
687	G	90.9	Very high	81.5	Confident	19 Å²	19	40 Å²	40	20%	0.196	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.6	171.2	175.2	0	0	0	0	0	113.2	Q584 R585	Q584-G687 WeakPolarHBondContact CG-O 3.33Å; Q584-G687 PolarHBondContact NE2-O 2.83Å; R585-G687 PolarHBondContact O-N 3.34Å
688	P	93.4	Very high	82.7	Confident	44 Å²	44	36.3 Å²	36.3	29%	0.286	19%	0.191	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-63.7	159.3	174.7	29.8	-36	0	0	0	111.7	V538 V539 R540 L690	V538-P688 HydrophobicContact CG1-CB 3.83Å; V538-P688 HydrophobicContact CG1-CG 3.94Å; V539-P688 WeakPolarHBondContact O-CA 3.39Å; V539-P688 WeakPolarHBondContact O-CB 3.47Å; R540-P688 HydrophobicContact CG-CB 4.3Å; P688-L690 HydrophobicContact CG-CD2 4.03Å; P688-L690 HydrophobicContact CG-CG 4.41Å; P688-L690 PolarHBondContact O-N 2.87Å
689	L	94.9	Very high	84.2	Confident	2 Å²	2	32.2 Å²	32.2	1%	0.01	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.1	121.9	165.7	175.9	70.9	0	0	0	108.5	V539 Y565 L572 V576 C582 L665 P666	V539-L689 HydrophobicContact CB-CB 4.28Å; V539-L689 HydrophobicContact CG2-CD2 4.48Å; V539-L689 PolarHBondContact N-O 3.1Å; V539-L689 PolarHBondContact O-N 2.82Å; Y565-L689 HydrophobicContact CE1-CB 4.41Å; L572-L689 HydrophobicContact CD2-CD2 4.48Å; V576-L689 HydrophobicContact CG2-CD2 3.75Å; C582-L689 HydrophobicContact CB-CD1 4.23Å; L665-L689 HydrophobicContact CB-CD1 4.01Å; L665-L689 HydrophobicContact CD1-CD1 4.25Å; P666-L689 HydrophobicContact CB-CB 4.33Å; P666-L689 HydrophobicContact CB-CD1 4.14Å; P666-L689 HydrophobicContact CB-CD2 4.03Å; P666-L689 HydrophobicContact CB-CG 4.39Å; P666-L689 HydrophobicContact CG-CD2 4.21Å
690	L	95.3	Very high	85.8	Confident	40 Å²	40	24 Å²	24	21%	0.209	13%	0.126	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	109.5	179.6	-61.4	176.3	0	0	0	109.1	W536 V538 C582 E583 P688	W536-L690 HydrophobicContact CE3-CB 3.85Å; W536-L690 HydrophobicContact CZ3-CB 3.81Å; V538-L690 HydrophobicContact CB-CD2 4.14Å; V538-L690 HydrophobicContact CG1-CD2 3.8Å; V538-L690 HydrophobicContact CG2-CD2 3.66Å; C582-L690 CarbonylContact C-O 3.49Å; C582-L690 VanDerWaalsContact CA-O 3.24Å; C582-L690 WeakPolarHBondContact CA-O 3.26Å; E583-L690 HydrophobicContact CG-CB 4.01Å; E583-L690 PolarHBondContact N-O 2.9Å; E583-L690 PolarHBondContact O-N 3.22Å; P688-L690 HydrophobicContact CG-CD2 4.03Å; P688-L690 HydrophobicContact CG-CG 4.41Å; P688-L690 PolarHBondContact O-N 2.87Å
691	C	95.3	Very high	87.2	Confident	4 Å²	4	23.8 Å²	23.8	3%	0.027	13%	0.125	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	126.1	177.9	-73.4	0	0	0	0	110.2	W536 T537 A579 R581 C582	W536-C691 CarbonylContact C-O 3Å; W536-C691 WeakPolarHBondContact CA-O 3.42Å; T537-C691 PolarHBondContact N-O 2.78Å; T537-C691 PolarHBondContact O-N 3.17Å; A579-C691 HydrophobicContact CB-CB 3.62Å; R581-C691 CarbonylContact O-C 3.57Å; R581-C691 WeakPolarHBondContact O-CA 3.45Å; C582-C691 HydrophobicContact CB-CB 4.19Å; C582-C691 WeakPolarHBondContact CB-SG 3.24Å; C582-C691 WeakPolarHBondContact SG-CB 3.35Å; C582-C691 CovalentContact SG-SG 2.05Å; C582-C691 PolarHBondContact SG-SG 3.24Å
692	R	91.3	Very high	88.2	Confident	89 Å²	89	21.6 Å²	21.6	34%	0.336	12%	0.117	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	139.3	-175.9	-174	-176.1	173.5	161.9	5	111.5	S534 W536 E580 R581	S534-R692 VanDerWaalsContact OG-CZ 3.25Å; S534-R692 PolarHBondContact OG-NE 2.04Å; S534-R692 PolarHBondContact OG-NH2 2.9Å; W536-R692 HydrophobicContact CD2-CB 3.84Å; W536-R692 HydrophobicContact CD2-CG 4.08Å; W536-R692 HydrophobicContact CE3-CB 3.71Å; W536-R692 HydrophobicContact CE3-CG 4.44Å; W536-R692 HydrophobicContact CH2-CB 4.1Å; W536-R692 HydrophobicContact CZ2-CB 4.21Å; W536-R692 HydrophobicContact CZ2-CG 4.21Å; W536-R692 HydrophobicContact CZ3-CB 3.84Å; E580-R692 PolarHBondContact N-O 2.6Å; R581-R692 PolarHBondContact N-O 2.85Å; R581-R692 PolarHBondContact O-N 3.22Å
693	G	87.3	Confident	89.1	Confident	5 Å²	5	21.3 Å²	21.3	5%	0.052	11%	0.114	C	C	.	.	S	Bend	trans	71.9	-172.5	170.6	0	0	0	0	0	114.2	A535	A535-G693 PolarHBondContact O-N 2.91Å
694	D	87.3	Confident	89.5	Confident	5 Å²	5	24.2 Å²	24.2	3%	0.027	13%	0.129	C	C	.	.			trans	-142.7	113.7	179.7	-179.4	-34.1	0	0	0	108.6	S498 E500 L578 S696 F697	S498-D694 VanDerWaalsContact CB-OD2 3.27Å; S498-D694 WeakPolarHBondContact CB-OD2 3.41Å; S498-D694 PolarHBondContact OG-OD2 2.95Å; E500-D694 HydrophobicContact CB-CB 3.56Å; E500-D694 HydrophobicContact CG-CB 3.93Å; L578-D694 WeakPolarHBondContact CD1-OD1 3.38Å; D694-S696 PolarHBondContact O-N 3.02Å; D694-S696 WeakPolarHBondContact OD1-CA 3.13Å; D694-S696 WeakPolarHBondContact OD1-CB 3.31Å; D694-S696 PolarHBondContact OD1-N 2.9Å; D694-F697 HydrophobicContact CB-CB 3.79Å; D694-F697 PolarHBondContact O-N 3.41Å; D694-F697 PolarHBondContact OD1-N 3Å
695	K	82.8	Confident	89.6	Confident	79 Å²	79	27 Å²	27	34%	0.343	15%	0.146	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.8	-27.8	-177.1	-167.2	-177.2	176	-165.4	0	111.2	L578 N699 D849	L578-K695 WeakPolarHBondContact O-CB 3.42Å; L578-K695 PolarHBondContact O-N 3.43Å; K695-N699 VanDerWaalsContact O-CB 3.26Å; K695-N699 WeakPolarHBondContact O-CB 3.34Å; K695-D849 WeakPolarHBondContact CE-OD2 3.27Å; K695-D849 IonicContact NZ-OD2 3.32Å; K695-D849 PolarHBondContact NZ-OD2 2.9Å
696	S	81.7	Confident	89.3	Confident	10 Å²	10	30.4 Å²	30.4	7%	0.07	16%	0.158	C	C	.	.	T	Hydrogen-bonded Turn	trans	-81.6	-34.5	178.9	179.7	0	0	0	0	112.9	D694 N699 A847	D694-S696 PolarHBondContact O-N 3.02Å; D694-S696 WeakPolarHBondContact OD1-CA 3.13Å; D694-S696 WeakPolarHBondContact OD1-CB 3.31Å; D694-S696 PolarHBondContact OD1-N 2.9Å; S696-N699 WeakPolarHBondContact O-CB 3.04Å; S696-A847 VanDerWaalsContact OG-CB 3.23Å; S696-A847 WeakPolarHBondContact OG-CB 3.19Å
697	F	81.1	Confident	89.1	Confident	35 Å²	35	33.5 Å²	33.5	15%	0.154	18%	0.178	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68.5	-38.9	-170	-168.7	-89.4	0	0	0	113.5	E500 H504 D694 R839	E500-F697 HydrophobicContact CG-CD1 4.33Å; E500-F697 HydrophobicContact CG-CG 4.44Å; H504-F697 HydrophobicContact CB-CE1 4.13Å; H504-F697 HydrophobicContact CB-CE2 4.38Å; H504-F697 HydrophobicContact CB-CZ 3.57Å; H504-F697 AromaticContact CD2-CE1 3.96Å; H504-F697 AromaticContact CG-CE1 3.51Å; H504-F697 AromaticContact CG-CZ 3.48Å; H504-F697 VanDerWaalsContact CG-CZ 3.48Å; H504-F697 AromaticContact ND1-CE1 3.58Å; H504-F697 AromaticContact ND1-CZ 3.82Å; D694-F697 HydrophobicContact CB-CB 3.79Å; D694-F697 PolarHBondContact O-N 3.41Å; D694-F697 PolarHBondContact OD1-N 3Å; F697-R839 PolarHBondContact O-NH1 3.16Å
698	W	82.6	Confident	88.9	Confident	3 Å²	3	32.8 Å²	32.8	1%	0.011	17%	0.17	C	C	.	.	S	Bend	trans	-97.9	-9.9	179.3	-62.9	116.6	0	0	0	114.6	E500 H504 S700 R839 H867 Y871 R886	E500-W698 PolarHBondContact OE1-NE1 2.92Å; H504-W698 AromaticContact CD2-CH2 3.86Å; H504-W698 AromaticContact CD2-CZ2 3.84Å; H504-W698 AromaticContact CE1-CZ2 3.33Å; H504-W698 WeakPolarHBondContact CE1-CZ2 3.25Å; H504-W698 AromaticContact NE2-CH2 3.53Å; H504-W698 AromaticContact NE2-CZ2 3.13Å; H504-W698 WeakPolarHBondContact NE2-CZ2 3.21Å; W698-S700 PolarHBondContact O-N 3.33Å; W698-S700 PolarHBondContact O-OG 3.07Å; W698-R839 VanDerWaalsContact CE3-NH1 3.29Å; W698-H867 AromaticContact CE3-CE1 3.84Å; W698-H867 HydrophobicContact CZ3-CB 4.34Å; W698-H867 AromaticContact CZ3-CE1 3.9Å; W698-H867 AromaticContact CZ3-CG 3.85Å; W698-H867 AromaticContact CZ3-ND1 3.62Å; W698-Y871 HydrophobicContact CH2-CD2 4.04Å; W698-Y871 AromaticContact CH2-CE2 3.71Å; W698-Y871 HydrophobicContact CH2-CE2 3.71Å; W698-Y871 HydrophobicContact CZ3-CD2 4.47Å; W698-Y871 AromaticContact CZ3-CE2 3.9Å; W698-Y871 HydrophobicContact CZ3-CE2 3.9Å; W698-R886 HydrophobicContact CB-CB 3.86Å; W698-R886 HydrophobicContact CB-CG 3.87Å; W698-R886 HydrophobicContact CG-CB 3.85Å; W698-R886 HydrophobicContact CG-CG 4.42Å
699	N	87.8	Confident	88.7	Confident	6 Å²	6	32.7 Å²	32.7	3%	0.032	16%	0.164	C	C	.	.			trans	-50.7	107.9	179.6	177.7	22.2	0	0	0	111.6	K695 S696 R839 S840 L848 L850 E851	K695-N699 VanDerWaalsContact O-CB 3.26Å; K695-N699 WeakPolarHBondContact O-CB 3.34Å; S696-N699 WeakPolarHBondContact O-CB 3.04Å; N699-R839 CarbonylContact O-C 3.56Å; N699-R839 VanDerWaalsContact O-CA 3.26Å; N699-R839 WeakPolarHBondContact O-CA 3.04Å; N699-R839 WeakPolarHBondContact O-CG 3.46Å; N699-S840 PolarHBondContact O-N 2.84Å; N699-L848 PolarHBondContact ND2-O 3Å; N699-L850 PolarHBondContact ND2-N 3.3Å; N699-L850 WeakPolarHBondContact OD1-CA 3.46Å; N699-L850 WeakPolarHBondContact OD1-CB 3.03Å; N699-L850 PolarHBondContact OD1-N 3.15Å; N699-E851 PolarHBondContact OD1-N 3.11Å; N699-E851 VanDerWaalsContact OD1-N 3.09Å
700	S	91.8	Very high	88.4	Confident	0 Å²	0	32.6 Å²	32.6	0%	0	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.2	154	-174.9	49.9	0	0	0	0	112.9	W698 I838 E851 G863 C864	W698-S700 PolarHBondContact O-N 3.33Å; W698-S700 PolarHBondContact O-OG 3.07Å; S700-I838 CarbonylContact C-O 3.59Å; S700-I838 WeakPolarHBondContact CA-O 3.27Å; S700-I838 WeakPolarHBondContact CB-O 3.43Å; S700-E851 WeakPolarHBondContact O-CG 3.37Å; S700-G863 PolarHBondContact O-N 2.87Å; S700-G863 VanDerWaalsContact OG-CA 3.28Å; S700-G863 WeakPolarHBondContact OG-CA 3.25Å; S700-C864 PolarHBondContact OG-N 2.94Å
701	A	92.9	Very high	88.1	Confident	0 Å²	0	33.1 Å²	33.1	0%	0	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.1	139.7	174.1	0	0	0	0	0	109.9	F703 L710 C837 I838 L850 A854 V860 E861	A701-F703 HydrophobicContact CB-CE2 3.99Å; A701-F703 HydrophobicContact CB-CZ 4.2Å; A701-L710 HydrophobicContact CB-CD1 3.83Å; A701-C837 VanDerWaalsContact O-CA 3.29Å; A701-C837 WeakPolarHBondContact O-CA 3.44Å; A701-I838 PolarHBondContact N-O 3.45Å; A701-I838 PolarHBondContact O-N 2.97Å; A701-L850 HydrophobicContact CB-CB 3.98Å; A701-A854 HydrophobicContact CB-CB 4.22Å; A701-V860 HydrophobicContact CB-CG1 3.77Å; A701-E861 CarbonylContact C-O 3.39Å; A701-E861 WeakPolarHBondContact CA-O 3.22Å
702	S	93.8	Very high	87.7	Confident	16 Å²	16	34.2 Å²	34.2	11%	0.112	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	120.6	174	-65.1	0	0	0	0	109.7	G836 C837 V860 E861 G863 C864	S702-G836 CarbonylContact C-O 3.56Å; S702-G836 WeakPolarHBondContact CA-O 3.39Å; S702-C837 PolarHBondContact OG-SG 2.79Å; S702-C837 VanDerWaalsContact OG-SG 3.37Å; S702-V860 CarbonylContact O-C 3.45Å; S702-V860 VanDerWaalsContact O-CA 3.27Å; S702-V860 WeakPolarHBondContact O-CA 3.36Å; S702-V860 WeakPolarHBondContact O-CG1 3.44Å; S702-E861 PolarHBondContact N-O 3.39Å; S702-E861 PolarHBondContact O-N 2.71Å; S702-G863 PolarHBondContact OG-O 2.01Å; S702-C864 WeakPolarHBondContact OG-CB 3.38Å
703	F	94.1	Very high	87.3	Confident	2 Å²	2	35.1 Å²	35.1	1%	0.009	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.6	110.4	179.2	-61.3	-94.2	0	0	0	108.5	A701 L710 I824 F834 G836 I838 V860	A701-F703 HydrophobicContact CB-CE2 3.99Å; A701-F703 HydrophobicContact CB-CZ 4.2Å; F703-L710 HydrophobicContact CE1-CD1 4.45Å; F703-L710 HydrophobicContact CE1-CG 3.97Å; F703-L710 HydrophobicContact CZ-CD1 4Å; F703-L710 HydrophobicContact CZ-CG 4.01Å; F703-I824 VanDerWaalsContact CE1-O 3.3Å; F703-I824 WeakPolarHBondContact CE1-O 3.44Å; F703-I824 HydrophobicContact CZ-CG2 4.14Å; F703-F834 WeakPolarHBondContact CB-O 3.14Å; F703-F834 HydrophobicContact CD2-CD1 4.07Å; F703-F834 HydrophobicContact CD2-CE1 4.43Å; F703-F834 HydrophobicContact CG-CD1 4.46Å; F703-G836 PolarHBondContact N-O 2.98Å; F703-G836 PolarHBondContact O-N 2.67Å; F703-G836 VanDerWaalsContact O-N 3.1Å; F703-I838 HydrophobicContact CD2-CG1 4.44Å; F703-I838 HydrophobicContact CE2-CB 4.08Å; F703-I838 HydrophobicContact CE2-CD1 3.83Å; F703-I838 HydrophobicContact CE2-CG1 3.91Å; F703-I838 HydrophobicContact CZ-CD1 4.31Å; F703-V860 HydrophobicContact CD1-CG1 4.17Å; F703-V860 HydrophobicContact CD1-CG2 3.82Å; F703-V860 HydrophobicContact CE1-CG1 4.08Å; F703-V860 HydrophobicContact CE1-CG2 3.99Å; F703-V860 HydrophobicContact CZ-CG1 4.36Å
704	N	90.5	Very high	87	Confident	84 Å²	84	36.3 Å²	36.3	45%	0.449	20%	0.196	S	C	.	.			trans	-99.8	-12.2	-170.2	-65.6	-17.6	0	0	0	112.6	L835 G859 E861	N704-L835 WeakPolarHBondContact O-CD2 3.48Å; N704-G859 PolarHBondContact N-O 3.37Å; N704-E861 PolarHBondContact ND2-OE1 2.65Å; N704-E861 PolarHBondContact ND2-OE2 2.76Å
705	T	87.1	Confident	86.8	Confident	57 Å²	57	36.9 Å²	36.9	35%	0.35	20%	0.198	S	C	.	.	S	Bend	trans	-131.8	146.9	175.7	73.5	0	0	0	0	111.6	T707 S708 L835	T705-T707 PolarHBondContact O-N 3.1Å; T705-T707 PolarHBondContact OG1-OG1 3.33Å; T705-S708 WeakPolarHBondContact O-CB 3.32Å; T705-S708 PolarHBondContact O-N 2.81Å; T705-S708 PolarHBondContact O-OG 2.94Å; T705-S708 WeakPolarHBondContact OG1-CB 3.36Å; T705-S708 PolarHBondContact OG1-N 3.3Å; T705-L835 VanDerWaalsContact CA-CD2 3.48Å
706	E	83.3	Confident	86.5	Confident	125 Å²	125	39.8 Å²	39.8	58%	0.584	21%	0.213	S	C	*	.	T	Hydrogen-bonded Turn	trans	-66.5	-8.1	177.6	-61.8	-178.5	171.3	0	0	113.5	G833 L835	E706-G833 WeakPolarHBondContact O-CA 3.49Å; E706-G833 PolarHBondContact O-N 3.31Å; E706-G833 VanDerWaalsContact O-N 3.15Å; E706-L835 HydrophobicContact CG-CD1 3.49Å; E706-L835 VanDerWaalsContact CG-CD1 3.49Å; E706-L835 HydrophobicContact CG-CD2 4.29Å; E706-L835 HydrophobicContact CG-CG 3.75Å
707	T	85.6	Confident	85.9	Confident	79 Å²	79	39.4 Å²	39.4	49%	0.485	21%	0.211	S	C	.	.	T	Hydrogen-bonded Turn	trans	-101.6	-7.4	176.1	55.9	0	0	0	0	112.7	T705 Y709 R830	T705-T707 PolarHBondContact O-N 3.1Å; T705-T707 PolarHBondContact OG1-OG1 3.33Å; T707-Y709 WeakPolarHBondContact O-CD1 3.26Å; T707-R830 HydrophobicContact CG2-CB 4.48Å
708	S	86.8	Confident	85.6	Confident	4 Å²	4	42.2 Å²	42.2	3%	0.028	22%	0.224	C	C	.	.			trans	-77.7	141.9	179	69.8	0	0	0	0	110.9	T705 G859	T705-S708 WeakPolarHBondContact O-CB 3.32Å; T705-S708 PolarHBondContact O-N 2.81Å; T705-S708 PolarHBondContact O-OG 2.94Å; T705-S708 WeakPolarHBondContact OG1-CB 3.36Å; T705-S708 PolarHBondContact OG1-N 3.3Å; S708-G859 WeakPolarHBondContact CB-O 3.37Å; S708-G859 PolarHBondContact OG-O 3.49Å
709	Y	89.9	Confident	84.9	Confident	41 Å²	41	43.5 Å²	43.5	16%	0.161	23%	0.231	C	C	.	.			trans	-158	151	175.1	60.4	-88.1	0	0	0	109.4	T707 H711 F823 I824 R830 T857	T707-Y709 WeakPolarHBondContact O-CD1 3.26Å; Y709-H711 HydrophobicContact CD2-CB 4.31Å; Y709-H711 HydrophobicContact CE2-CB 4.3Å; Y709-F823 AromaticContact CD2-CD1 3.46Å; Y709-F823 HydrophobicContact CD2-CD1 3.46Å; Y709-F823 VanDerWaalsContact CD2-CD1 3.46Å; Y709-F823 AromaticContact CD2-CE1 3.92Å; Y709-F823 HydrophobicContact CD2-CE1 3.92Å; Y709-F823 AromaticContact CE2-CD1 3.66Å; Y709-F823 HydrophobicContact CE2-CD1 3.66Å; Y709-F823 AromaticContact CE2-CE1 3.58Å; Y709-F823 HydrophobicContact CE2-CE1 3.58Å; Y709-F823 HydrophobicContact CG-CD1 4.11Å; Y709-I824 CarbonylContact C-O 3.58Å; Y709-I824 WeakPolarHBondContact CA-O 3.27Å; Y709-R830 HydrophobicContact CD1-CG 4.38Å; Y709-R830 HydrophobicContact CE1-CG 3.89Å; Y709-R830 PolarHBondContact OH-NH2 2.82Å; Y709-T857 WeakPolarHBondContact O-CG2 3.43Å
710	L	89.3	Confident	84.2	Confident	0 Å²	0	45.2 Å²	45.2	0%	0	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95	149.3	164.2	-57.8	175.8	0	0	0	108.6	A701 F703 F712 F823 I824 L850 R853 A854 T857 V860	A701-L710 HydrophobicContact CB-CD1 3.83Å; F703-L710 HydrophobicContact CE1-CD1 4.45Å; F703-L710 HydrophobicContact CE1-CG 3.97Å; F703-L710 HydrophobicContact CZ-CD1 4Å; F703-L710 HydrophobicContact CZ-CG 4.01Å; L710-F712 HydrophobicContact CB-CE2 3.99Å; L710-F823 CarbonylContact O-C 3.49Å; L710-F823 WeakPolarHBondContact O-CA 3.32Å; L710-I824 HydrophobicContact CB-CB 4.28Å; L710-I824 PolarHBondContact N-O 3.3Å; L710-I824 PolarHBondContact O-N 3.49Å; L710-L850 HydrophobicContact CD1-CB 4.17Å; L710-L850 HydrophobicContact CD1-CD2 3.98Å; L710-R853 HydrophobicContact CB-CG 4.23Å; L710-R853 HydrophobicContact CD1-CB 4.46Å; L710-R853 HydrophobicContact CD2-CB 4.1Å; L710-R853 HydrophobicContact CD2-CG 3.85Å; L710-R853 HydrophobicContact CG-CG 4.49Å; L710-A854 HydrophobicContact CD2-CB 4.42Å; L710-T857 HydrophobicContact CD2-CG2 4.07Å; L710-V860 HydrophobicContact CD1-CG1 4.4Å; L710-V860 HydrophobicContact CD2-CB 4.15Å; L710-V860 HydrophobicContact CD2-CG1 3.95Å; L710-V860 HydrophobicContact CD2-CG2 4.11Å; L710-V860 HydrophobicContact CG-CG1 4.21Å
711	H	88.3	Confident	83.7	Confident	52 Å²	52	45.3 Å²	45.3	24%	0.241	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	145.5	173.6	69	-85.8	0	0	0	112.4	Y709 Q821 L822 F823 R853	Y709-H711 HydrophobicContact CD2-CB 4.31Å; Y709-H711 HydrophobicContact CE2-CB 4.3Å; H711-Q821 PolarHBondContact CD2-OE1 3.29Å; H711-Q821 VanDerWaalsContact CD2-OE1 3.3Å; H711-L822 CarbonylContact C-O 3.05Å; H711-L822 WeakPolarHBondContact CA-O 3.49Å; H711-F823 HydrophobicContact CB-CD1 4.43Å; H711-R853 PolarHBondContact CE1-NH2 2.78Å; H711-R853 PolarHBondContact NE2-NH2 2.84Å; H711-R853 PolarHBondContact O-NE 2.78Å
712	F	87	Confident	83.2	Confident	26 Å²	26	46.7 Å²	46.7	11%	0.114	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.2	167.7	-177.7	-65.2	-86.3	0	0	0	110.4	L710 Q821 L822 I824 L848 L850 R853	L710-F712 HydrophobicContact CB-CE2 3.99Å; F712-Q821 WeakPolarHBondContact O-CB 3.31Å; F712-L822 HydrophobicContact CB-CB 4.27Å; F712-L822 HydrophobicContact CB-CD2 4.27Å; F712-L822 PolarHBondContact N-O 3.34Å; F712-L822 PolarHBondContact O-N 3.41Å; F712-I824 HydrophobicContact CD2-CG1 3.94Å; F712-I824 HydrophobicContact CE2-CG1 3.96Å; F712-L848 HydrophobicContact CD1-CD1 4.29Å; F712-L848 HydrophobicContact CD1-CD2 4.22Å; F712-L848 HydrophobicContact CD2-CD1 3.89Å; F712-L848 HydrophobicContact CE1-CB 4.1Å; F712-L848 HydrophobicContact CE2-CD1 4.14Å; F712-L848 HydrophobicContact CG-CD1 3.98Å; F712-L848 HydrophobicContact CZ-CB 4.1Å; F712-L848 HydrophobicContact CZ-CD1 4.45Å; F712-L850 HydrophobicContact CE2-CD2 4.09Å; F712-L850 HydrophobicContact CZ-CD2 4.02Å; F712-R853 HydrophobicContact CE1-CB 4.45Å; F712-R853 HydrophobicContact CZ-CB 4.12Å; F712-R853 HydrophobicContact CZ-CG 4.24Å
713	P	82.6	Confident	83	Confident	108 Å²	108	45.9 Å²	45.9	70%	0.701	25%	0.245	S	C	*	.	S	Bend	trans	-53.3	158.7	168.9	-25.9	35.9	0	0	0	112.6	F715 L822	P713-F715 PolarHBondContact O-N 2.91Å; P713-L822 WeakPolarHBondContact O-CB 3.48Å
714	A	81.1	Confident	82.7	Confident	30 Å²	30	46.3 Å²	46.3	25%	0.248	25%	0.248	C	C	.	.	P	Polyproline II helix	trans	-54.7	138.7	-179.9	0	0	0	0	0	111.6	H716 S820	A714-H716 PolarHBondContact O-N 2.98Å; A714-S820 WeakPolarHBondContact CA-O 3.45Å; A714-S820 VanDerWaalsContact CB-O 3.22Å; A714-S820 WeakPolarHBondContact CB-O 3.46Å
715	F	82.9	Confident	82.9	Confident	17 Å²	17	42.4 Å²	42.4	8%	0.075	23%	0.227	C	C	.	.	P	Polyproline II helix	trans	-75.3	124.4	-179.8	173.5	-124.7	0	0	0	111.2	P713 G717 A721 M737 N739 I746 L818 L843 N844	P713-F715 PolarHBondContact O-N 2.91Å; F715-G717 PolarHBondContact O-N 2.98Å; F715-A721 HydrophobicContact CE1-CB 3.58Å; F715-A721 HydrophobicContact CZ-CB 3.72Å; F715-M737 HydrophobicContact CD1-CE 4.24Å; F715-M737 HydrophobicContact CG-CE 4.36Å; F715-N739 WeakPolarHBondContact CB-OD1 3.34Å; F715-N739 PolarHBondContact N-OD1 2.81Å; F715-I746 HydrophobicContact CE1-CD1 4.2Å; F715-L818 HydrophobicContact CB-CD1 4.17Å; F715-L818 HydrophobicContact CD1-CD1 3.95Å; F715-L843 HydrophobicContact CD2-CB 4.09Å; F715-L843 HydrophobicContact CD2-CD1 4.01Å; F715-L843 HydrophobicContact CE2-CB 3.81Å; F715-L843 HydrophobicContact CE2-CD1 4.49Å; F715-N844 WeakPolarHBondContact CE2-ND2 3.22Å
716	H	76.1	Confident	83.1	Confident	140 Å²	140	41.5 Å²	41.5	65%	0.648	22%	0.218	S	C	*	.			trans	-88.5	85.9	176.2	-66.1	-65.9	0	0	0	110.9	A714 E718 N844	A714-H716 PolarHBondContact O-N 2.98Å; H716-E718 IonicContact ND1-OE1 2.69Å; H716-N844 PolarHBondContact O-ND2 2.95Å
717	G	68.8	Low	83.7	Confident	2 Å²	2	35.5 Å²	35.5	2%	0.021	19%	0.19	C	C	.	.			trans	-131.1	40.2	-178.4	0	0	0	0	0	114	F715 L719 T720 R789	F715-G717 PolarHBondContact O-N 2.98Å; G717-L719 PolarHBondContact O-N 2.84Å; G717-T720 CarbonylContact C-O 3.57Å; G717-T720 VanDerWaalsContact CA-O 3.25Å; G717-T720 WeakPolarHBondContact CA-O 3.28Å; G717-R789 PolarHBondContact O-NH1 3.12Å
718	E	75.6	Confident	84	Confident	94 Å²	94	32.8 Å²	32.8	44%	0.439	17%	0.172	S	C	.	.	S	Bend	trans	-57.8	-50.3	-167.7	-61.6	89.3	174.2	0	0	112.3	H716 R789 R815 L816	H716-E718 IonicContact ND1-OE1 2.69Å; E718-R789 PolarHBondContact O-NH1 2.93Å; E718-R815 CarbonylContact O-C 3.53Å; E718-R815 VanDerWaalsContact O-CA 3.32Å; E718-R815 WeakPolarHBondContact O-CA 3.09Å; E718-L816 WeakPolarHBondContact CA-O 3.25Å; E718-L816 PolarHBondContact O-N 2.9Å
719	L	67	Low	84.4	Confident	30 Å²	30	32.7 Å²	32.7	16%	0.157	17%	0.171	C	C	.	.	S	Bend	trans	-106.2	-25.4	-177	-63.6	175.6	0	0	0	113.5	W401 G717 N790 V791 V814 R815	W401-L719 HydrophobicContact CB-CB 4.39Å; W401-L719 HydrophobicContact CB-CD1 3.93Å; W401-L719 HydrophobicContact CD2-CD1 3.57Å; W401-L719 HydrophobicContact CE3-CD1 3.49Å; W401-L719 VanDerWaalsContact CE3-CD1 3.49Å; W401-L719 HydrophobicContact CG-CD1 3.79Å; W401-L719 HydrophobicContact CZ3-CD1 4.17Å; G717-L719 PolarHBondContact O-N 2.84Å; L719-N790 WeakPolarHBondContact O-CA 3.39Å; L719-V791 HydrophobicContact CD2-CG1 4.49Å; L719-V814 HydrophobicContact CD2-CB 4.22Å; L719-V814 HydrophobicContact CD2-CG2 3.73Å; L719-R815 HydrophobicContact CD2-CG 3.8Å
720	T	74.5	Confident	84.5	Confident	42 Å²	42	35.2 Å²	35.2	26%	0.258	19%	0.19	S	C	.	.			trans	-141.6	138.4	-179.5	54.4	0	0	0	0	110.2	G717 R789 N790	G717-T720 CarbonylContact C-O 3.57Å; G717-T720 VanDerWaalsContact CA-O 3.25Å; G717-T720 WeakPolarHBondContact CA-O 3.28Å; T720-R789 CarbonylContact C-O 3.54Å; T720-R789 WeakPolarHBondContact CA-O 3.3Å; T720-N790 HydrophobicContact CG2-CB 4.12Å
721	A	81.5	Confident	84.8	Confident	3 Å²	3	36.8 Å²	36.8	3%	0.025	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130	131.8	169.3	0	0	0	0	0	109	F715 I746 E788 R789 N844	F715-A721 HydrophobicContact CE1-CB 3.58Å; F715-A721 HydrophobicContact CZ-CB 3.72Å; A721-I746 HydrophobicContact CB-CD1 4.13Å; A721-E788 CarbonylContact O-C 3.56Å; A721-E788 WeakPolarHBondContact O-CA 3.15Å; A721-R789 HydrophobicContact CB-CB 4.07Å; A721-R789 PolarHBondContact N-O 2.97Å; A721-R789 PolarHBondContact O-N 2.9Å; A721-N844 WeakPolarHBondContact CA-OD1 3.19Å
722	D	81.6	Confident	85.1	Confident	28 Å²	28	37.3 Å²	37.3	15%	0.15	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	110	172.1	178.3	1.5	0	0	0	107	S377 L843 N844	S377-D722 PolarHBondContact OG-OD2 2.83Å; D722-L843 CarbonylContact O-C 3.58Å; D722-L843 WeakPolarHBondContact O-CA 3.41Å; D722-N844 PolarHBondContact N-OD1 3.28Å; D722-N844 PolarHBondContact O-N 3.32Å
723	V	89.6	Confident	85.5	Confident	0 Å²	0	39 Å²	39	0%	0	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	122.1	-176.7	-178	0	0	0	0	108.5	F725 M737 I748 R786 A787 L841 Q842 L843	V723-F725 HydrophobicContact CG1-CD1 4.05Å; V723-F725 HydrophobicContact CG1-CE1 4.22Å; V723-M737 HydrophobicContact CG1-SD 3.86Å; V723-M737 HydrophobicContact CG2-CE 4.33Å; V723-M737 HydrophobicContact CG2-SD 4.15Å; V723-I748 HydrophobicContact CB-CD1 4Å; V723-I748 HydrophobicContact CG1-CD1 3.64Å; V723-I748 HydrophobicContact CG2-CD1 4.49Å; V723-R786 CarbonylContact O-C 3.46Å; V723-R786 WeakPolarHBondContact O-CA 3.44Å; V723-A787 HydrophobicContact CB-CB 4.4Å; V723-A787 PolarHBondContact N-O 3.39Å; V723-A787 PolarHBondContact O-N 3.43Å; V723-L841 HydrophobicContact CG1-CD1 4.19Å; V723-Q842 WeakPolarHBondContact CA-O 3.45Å; V723-L843 HydrophobicContact CB-CD2 4.02Å; V723-L843 HydrophobicContact CG1-CD2 3.61Å; V723-L843 HydrophobicContact CG2-CD2 3.56Å
724	C	88.8	Confident	86.1	Confident	10 Å²	10	34.1 Å²	34.1	7%	0.068	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.7	142.2	171.4	68	0	0	0	0	112	V785 R786 L841 Q842	C724-V785 VanDerWaalsContact CA-O 3.25Å; C724-V785 WeakPolarHBondContact CA-O 3.41Å; C724-R786 HydrophobicContact CB-CG 4.09Å; C724-L841 WeakPolarHBondContact O-CA 3.32Å; C724-Q842 PolarHBondContact N-O 3.25Å; C724-Q842 PolarHBondContact O-N 2.88Å
725	F	92.9	Very high	86.8	Confident	3 Å²	3	32.7 Å²	32.7	1%	0.013	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-163.3	165.8	178.4	60.5	-85	0	0	0	110.4	V723 F727 F736 I748 H784 V785 I838 L841	V723-F725 HydrophobicContact CG1-CD1 4.05Å; V723-F725 HydrophobicContact CG1-CE1 4.22Å; F725-F727 HydrophobicContact CD2-CB 4.36Å; F725-F727 HydrophobicContact CE2-CB 4.15Å; F725-F727 HydrophobicContact CE2-CD1 4.18Å; F725-F736 HydrophobicContact CE2-CB 3.93Å; F725-F736 HydrophobicContact CE2-CD1 4.06Å; F725-F736 HydrophobicContact CE2-CD2 4.16Å; F725-F736 AromaticContact CE2-CG 3.82Å; F725-F736 HydrophobicContact CE2-CG 3.82Å; F725-F736 HydrophobicContact CZ-CB 3.69Å; F725-F736 AromaticContact CZ-CD2 3.89Å; F725-F736 HydrophobicContact CZ-CD2 3.89Å; F725-F736 AromaticContact CZ-CG 3.81Å; F725-F736 HydrophobicContact CZ-CG 3.81Å; F725-I748 HydrophobicContact CE1-CD1 3.98Å; F725-I748 HydrophobicContact CE1-CG2 4.29Å; F725-I748 HydrophobicContact CZ-CG2 4.06Å; F725-H784 PolarHBondContact O-CD2 3.27Å; F725-V785 HydrophobicContact CD1-CB 4.3Å; F725-V785 HydrophobicContact CD2-CB 4.45Å; F725-V785 HydrophobicContact CE1-CB 3.91Å; F725-V785 HydrophobicContact CE1-CG1 3.85Å; F725-V785 HydrophobicContact CE2-CB 4.07Å; F725-V785 HydrophobicContact CE2-CG2 4.03Å; F725-V785 HydrophobicContact CZ-CB 3.77Å; F725-V785 HydrophobicContact CZ-CG1 3.89Å; F725-V785 HydrophobicContact CZ-CG2 4Å; F725-V785 PolarHBondContact N-O 3.48Å; F725-V785 PolarHBondContact O-N 3.09Å; F725-I838 HydrophobicContact CB-CG2 4.25Å; F725-I838 HydrophobicContact CD2-CG2 4.04Å; F725-I838 HydrophobicContact CG-CG2 4.39Å; F725-L841 HydrophobicContact CB-CB 4.16Å; F725-L841 HydrophobicContact CB-CD1 3.74Å; F725-L841 HydrophobicContact CD1-CD1 3.79Å; F725-L841 HydrophobicContact CG-CD1 4.03Å
726	F	91.9	Very high	87.5	Confident	37 Å²	37	32 Å²	32	16%	0.162	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	144.4	165.9	-64	-101	0	0	0	110	W782 H783 H784 I838 R839	F726-W782 HydrophobicContact CB-CE3 3.68Å; F726-W782 HydrophobicContact CB-CZ3 4.12Å; F726-H783 CarbonylContact C-O 3.58Å; F726-H783 WeakPolarHBondContact CA-O 3.08Å; F726-H784 HydrophobicContact CD1-CB 3.75Å; F726-H784 HydrophobicContact CE1-CB 3.53Å; F726-H784 AromaticContact CE1-CG 3.73Å; F726-H784 HydrophobicContact CZ-CB 4.14Å; F726-H784 AromaticContact CZ-CG 3.8Å; F726-H784 AromaticContact CZ-ND1 3.83Å; F726-I838 CarbonylContact O-C 3.4Å; F726-I838 WeakPolarHBondContact O-CA 3.16Å; F726-R839 HydrophobicContact CB-CB 4.25Å; F726-R839 PolarHBondContact N-O 3.3Å; F726-R839 PolarHBondContact O-N 3.2Å
727	F	95.1	Very high	88.4	Confident	0 Å²	0	25.3 Å²	25.3	0%	0	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	157.7	168.7	75.9	-86.6	0	0	0	111.7	F725 T729 F736 V756 F777 W782 H783 V785 V798 F834 C837	F725-F727 HydrophobicContact CD2-CB 4.36Å; F725-F727 HydrophobicContact CE2-CB 4.15Å; F725-F727 HydrophobicContact CE2-CD1 4.18Å; F727-T729 HydrophobicContact CD2-CG2 4.09Å; F727-T729 HydrophobicContact CE2-CG2 4.07Å; F727-F736 HydrophobicContact CB-CD1 4.17Å; F727-F736 HydrophobicContact CB-CE1 3.61Å; F727-F736 HydrophobicContact CB-CZ 4.21Å; F727-F736 HydrophobicContact CD1-CE1 4.05Å; F727-F736 HydrophobicContact CD1-CE2 4.38Å; F727-F736 AromaticContact CD1-CZ 3.75Å; F727-F736 HydrophobicContact CD1-CZ 3.75Å; F727-F736 AromaticContact CD2-CE1 3.62Å; F727-F736 HydrophobicContact CD2-CE1 3.62Å; F727-F736 AromaticContact CD2-CZ 3.6Å; F727-F736 HydrophobicContact CD2-CZ 3.6Å; F727-F736 HydrophobicContact CE1-CE2 4.43Å; F727-F736 AromaticContact CE1-CZ 3.94Å; F727-F736 HydrophobicContact CE1-CZ 3.94Å; F727-F736 HydrophobicContact CE2-CE1 4.28Å; F727-F736 AromaticContact CE2-CZ 3.8Å; F727-F736 HydrophobicContact CE2-CZ 3.8Å; F727-F736 HydrophobicContact CG-CD1 4.42Å; F727-F736 AromaticContact CG-CE1 3.48Å; F727-F736 HydrophobicContact CG-CE1 3.48Å; F727-F736 VanDerWaalsContact CG-CE1 3.48Å; F727-F736 AromaticContact CG-CZ 3.57Å; F727-F736 HydrophobicContact CG-CZ 3.57Å; F727-F736 AromaticContact CZ-CZ 3.95Å; F727-F736 HydrophobicContact CZ-CZ 3.95Å; F727-V756 HydrophobicContact CE1-CG2 4.23Å; F727-V756 HydrophobicContact CZ-CG2 4.05Å; F727-F777 HydrophobicContact CE2-CB 4.08Å; F727-F777 HydrophobicContact CZ-CB 3.84Å; F727-F777 HydrophobicContact CZ-CG 4.24Å; F727-W782 CarbonylContact O-C 3.58Å; F727-W782 WeakPolarHBondContact O-CA 3.4Å; F727-H783 HydrophobicContact CD1-CB 4.01Å; F727-H783 HydrophobicContact CE1-CB 3.52Å; F727-H783 HydrophobicContact CE2-CB 4.24Å; F727-H783 AromaticContact CE2-CD2 3.98Å; F727-H783 HydrophobicContact CZ-CB 3.67Å; F727-H783 PolarHBondContact N-O 2.85Å; F727-H783 PolarHBondContact O-N 2.84Å; F727-V785 HydrophobicContact CD1-CG2 3.51Å; F727-V785 HydrophobicContact CE1-CG2 3.42Å; F727-V785 VanDerWaalsContact CE1-CG2 3.42Å; F727-V798 HydrophobicContact CE1-CG1 4.43Å; F727-F834 HydrophobicContact CB-CZ 4.27Å; F727-F834 HydrophobicContact CD2-CZ 4.5Å; F727-C837 CarbonylContact C-O 3.5Å; F727-C837 WeakPolarHBondContact CA-O 3Å
728	K	93.3	Very high	89.6	Confident	22 Å²	22	25.5 Å²	25.5	10%	0.096	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.4	130.1	172.5	-176.1	-174	75.3	152.8	0	108.8	N780 Q781 W782 G836 C837 C864 A865	K728-N780 WeakPolarHBondContact CD-O 3.44Å; K728-N780 WeakPolarHBondContact CE-OD1 3.48Å; K728-Q781 WeakPolarHBondContact CA-O 3.4Å; K728-Q781 WeakPolarHBondContact CG-O 3.48Å; K728-W782 HydrophobicContact CB-CD2 3.94Å; K728-W782 HydrophobicContact CB-CE3 3.8Å; K728-W782 HydrophobicContact CB-CG 4.47Å; K728-W782 HydrophobicContact CB-CH2 4.47Å; K728-W782 HydrophobicContact CB-CZ3 4.09Å; K728-G836 CarbonylContact O-C 3.33Å; K728-G836 WeakPolarHBondContact O-CA 3.16Å; K728-C837 HydrophobicContact CB-CB 4.33Å; K728-C837 PolarHBondContact N-O 2.82Å; K728-C837 PolarHBondContact O-N 3.41Å; K728-C864 WeakPolarHBondContact CE-SG 3.2Å; K728-A865 PolarHBondContact NZ-O 3.27Å
729	T	94.3	Very high	90.4	Very high	2 Å²	2	21 Å²	21	1%	0.012	13%	0.128	C	C	.	.			trans	-154	164.1	-177	-171.3	0	0	0	0	112.8	F727 V731 L750 N778 N780 F834 L835	F727-T729 HydrophobicContact CD2-CG2 4.09Å; F727-T729 HydrophobicContact CE2-CG2 4.07Å; T729-V731 WeakPolarHBondContact OG1-CG2 3.07Å; T729-V731 PolarHBondContact OG1-N 3.37Å; T729-V731 VanDerWaalsContact OG1-N 3.08Å; T729-L750 HydrophobicContact CG2-CD2 3.86Å; T729-N778 HydrophobicContact CG2-CB 4.09Å; T729-N778 CarbonylContact O-C 3.51Å; T729-N778 VanDerWaalsContact O-CA 3.25Å; T729-N778 WeakPolarHBondContact O-CA 3.42Å; T729-N780 WeakPolarHBondContact O-CA 3.46Å; T729-N780 PolarHBondContact O-N 3.43Å; T729-F834 HydrophobicContact CG2-CE2 3.99Å; T729-F834 HydrophobicContact CG2-CZ 4.49Å; T729-L835 WeakPolarHBondContact CB-O 3.26Å; T729-L835 PolarHBondContact OG1-O 2.7Å
730	T	93.4	Very high	91.5	Very high	93 Å²	93	22.2 Å²	22.2	57%	0.571	13%	0.134	S	C	*	.	S	Bend	trans	-115.5	-11.1	167.9	52.2	0	0	0	0	112.2	N778 N780	T730-N778 PolarHBondContact O-ND2 3.41Å; T730-N780 HydrophobicContact CG2-CB 3.82Å
731	V	94.5	Very high	92	Very high	33 Å²	33	21 Å²	21	20%	0.2	13%	0.129	C	C	.	.	S	Bend	trans	-82.8	152.1	-179.6	-60.3	0	0	0	0	111.7	T729 S733 L750 N778 L835	T729-V731 WeakPolarHBondContact OG1-CG2 3.07Å; T729-V731 PolarHBondContact OG1-N 3.37Å; T729-V731 VanDerWaalsContact OG1-N 3.08Å; V731-S733 VanDerWaalsContact C-N 3.35Å; V731-S733 WeakPolarHBondContact CG2-O 3.41Å; V731-L750 WeakPolarHBondContact O-CD2 3.42Å; V731-N778 WeakPolarHBondContact O-CB 3.45Å; V731-L835 HydrophobicContact CG1-CB 3.74Å; V731-L835 HydrophobicContact CG1-CD1 3.85Å; V731-L835 HydrophobicContact CG1-CG 4.4Å; V731-L835 HydrophobicContact CG2-CB 4.01Å
732	S	95	Very high	91.7	Very high	64 Å²	64	28.2 Å²	28.2	45%	0.448	17%	0.166	S	C	.	.	S	Bend	trans	-78.1	-16.7	-175.3	51.8	0	0	0	0	114.4	A752 P753	S732-A752 CarbonylContact O-C 3.51Å; S732-A752 WeakPolarHBondContact O-CA 3.48Å; S732-P753 WeakPolarHBondContact O-CD 3.15Å
733	S	95.2	Very high	91.5	Very high	60 Å²	60	31.3 Å²	31.3	42%	0.42	19%	0.186	S	C	.	.			trans	-157.3	153.7	-178.3	60.3	0	0	0	0	111.8	V731 L750	V731-S733 VanDerWaalsContact C-N 3.35Å; V731-S733 WeakPolarHBondContact CG2-O 3.41Å; S733-L750 CarbonylContact C-O 3.53Å; S733-L750 WeakPolarHBondContact CA-O 3.49Å; S733-L750 WeakPolarHBondContact CB-O 3.47Å
734	G	94.8	Very high	91.4	Very high	6 Å²	6	31.7 Å²	31.7	6%	0.062	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	172.4	154.8	174.3	0	0	0	0	0	112.7	E749 L750	G734-E749 CarbonylContact O-C 3.5Å; G734-E749 WeakPolarHBondContact O-CA 3.46Å; G734-E749 WeakPolarHBondContact O-CB 3.29Å; G734-L750 PolarHBondContact N-O 3.16Å; G734-L750 PolarHBondContact O-N 3.13Å
735	V	96.3	Very high	91.6	Very high	0 Å²	0	32.9 Å²	32.9	0%	0	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.5	119	179.4	179.5	0	0	0	0	110.5	E738 R747 E749 G825 G826 T827 R832 F834	V735-E738 HydrophobicContact CG1-CB 4.09Å; V735-R747 HydrophobicContact CG1-CG 3.91Å; V735-E749 HydrophobicContact CG2-CB 4.2Å; V735-G825 CarbonylContact O-C 3.52Å; V735-G825 VanDerWaalsContact O-C 3.24Å; V735-G825 WeakPolarHBondContact O-CA 3.43Å; V735-G826 PolarHBondContact O-N 3.04Å; V735-T827 HydrophobicContact CB-CG2 3.99Å; V735-T827 HydrophobicContact CG1-CG2 4.07Å; V735-T827 HydrophobicContact CG2-CG2 3.8Å; V735-R832 WeakPolarHBondContact CB-O 3.49Å; V735-R832 HydrophobicContact CG2-CB 4.06Å; V735-R832 WeakPolarHBondContact CG2-O 3.47Å; V735-R832 PolarHBondContact N-O 2.75Å; V735-F834 VanDerWaalsContact O-CB 3.32Å; V735-F834 WeakPolarHBondContact O-CB 3.47Å
736	F	96.9	Very high	91.6	Very high	2 Å²	2	32.8 Å²	32.8	1%	0.009	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.7	-41.8	178.3	-56.8	-64.6	0	0	0	112	F725 F727 I748 L750 V756 I824 G825 F834 I838	F725-F736 HydrophobicContact CE2-CB 3.93Å; F725-F736 HydrophobicContact CE2-CD1 4.06Å; F725-F736 HydrophobicContact CE2-CD2 4.16Å; F725-F736 AromaticContact CE2-CG 3.82Å; F725-F736 HydrophobicContact CE2-CG 3.82Å; F725-F736 HydrophobicContact CZ-CB 3.69Å; F725-F736 AromaticContact CZ-CD2 3.89Å; F725-F736 HydrophobicContact CZ-CD2 3.89Å; F725-F736 AromaticContact CZ-CG 3.81Å; F725-F736 HydrophobicContact CZ-CG 3.81Å; F727-F736 HydrophobicContact CB-CD1 4.17Å; F727-F736 HydrophobicContact CB-CE1 3.61Å; F727-F736 HydrophobicContact CB-CZ 4.21Å; F727-F736 HydrophobicContact CD1-CE1 4.05Å; F727-F736 HydrophobicContact CD1-CE2 4.38Å; F727-F736 AromaticContact CD1-CZ 3.75Å; F727-F736 HydrophobicContact CD1-CZ 3.75Å; F727-F736 AromaticContact CD2-CE1 3.62Å; F727-F736 HydrophobicContact CD2-CE1 3.62Å; F727-F736 AromaticContact CD2-CZ 3.6Å; F727-F736 HydrophobicContact CD2-CZ 3.6Å; F727-F736 HydrophobicContact CE1-CE2 4.43Å; F727-F736 AromaticContact CE1-CZ 3.94Å; F727-F736 HydrophobicContact CE1-CZ 3.94Å; F727-F736 HydrophobicContact CE2-CE1 4.28Å; F727-F736 AromaticContact CE2-CZ 3.8Å; F727-F736 HydrophobicContact CE2-CZ 3.8Å; F727-F736 HydrophobicContact CG-CD1 4.42Å; F727-F736 AromaticContact CG-CE1 3.48Å; F727-F736 HydrophobicContact CG-CE1 3.48Å; F727-F736 VanDerWaalsContact CG-CE1 3.48Å; F727-F736 AromaticContact CG-CZ 3.57Å; F727-F736 HydrophobicContact CG-CZ 3.57Å; F727-F736 AromaticContact CZ-CZ 3.95Å; F727-F736 HydrophobicContact CZ-CZ 3.95Å; F736-I748 WeakPolarHBondContact CB-O 3.38Å; F736-I748 HydrophobicContact CD2-CG2 4.05Å; F736-I748 PolarHBondContact N-O 2.79Å; F736-L750 HydrophobicContact CE2-CB 3.88Å; F736-L750 VanDerWaalsContact CE2-N 3.28Å; F736-L750 HydrophobicContact CZ-CB 3.71Å; F736-V756 HydrophobicContact CE2-CG1 4.23Å; F736-I824 CarbonylContact O-C 3.49Å; F736-I824 WeakPolarHBondContact O-CA 3.25Å; F736-G825 PolarHBondContact O-N 3.44Å; F736-F834 HydrophobicContact CD1-CD1 4.33Å; F736-F834 AromaticContact CD1-CD2 3.81Å; F736-F834 HydrophobicContact CD1-CD2 3.81Å; F736-F834 HydrophobicContact CD1-CE1 4.35Å; F736-F834 AromaticContact CD1-CE2 3.86Å; F736-F834 HydrophobicContact CD1-CE2 3.86Å; F736-F834 HydrophobicContact CD1-CG 4.06Å; F736-F834 HydrophobicContact CD1-CZ 4.11Å; F736-F834 AromaticContact CE1-CD2 3.61Å; F736-F834 HydrophobicContact CE1-CD2 3.61Å; F736-F834 HydrophobicContact CE1-CE1 4.37Å; F736-F834 AromaticContact CE1-CE2 3.28Å; F736-F834 HydrophobicContact CE1-CE2 3.28Å; F736-F834 HydrophobicContact CE1-CG 4.3Å; F736-F834 AromaticContact CE1-CZ 3.69Å; F736-F834 HydrophobicContact CE1-CZ 3.69Å; F736-F834 HydrophobicContact CZ-CE2 4.25Å; F736-I838 HydrophobicContact CB-CD1 4.36Å; F736-I838 HydrophobicContact CD1-CD1 4.33Å
737	M	95.6	Very high	91.7	Very high	1 Å²	1	33.4 Å²	33.4	1%	0.005	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.5	136.8	-174.3	-179.5	-173.1	174.5	0	0	109.7	F715 V723 R747 I748 L822 F823 I824 L843	F715-M737 HydrophobicContact CD1-CE 4.24Å; F715-M737 HydrophobicContact CG-CE 4.36Å; V723-M737 HydrophobicContact CG1-SD 3.86Å; V723-M737 HydrophobicContact CG2-CE 4.33Å; V723-M737 HydrophobicContact CG2-SD 4.15Å; M737-R747 CarbonylContact O-C 3.55Å; M737-R747 VanDerWaalsContact O-CA 3.23Å; M737-R747 WeakPolarHBondContact O-CA 3.38Å; M737-R747 WeakPolarHBondContact O-CG 3.39Å; M737-I748 HydrophobicContact CB-CB 4.43Å; M737-I748 PolarHBondContact N-O 3.49Å; M737-I748 PolarHBondContact O-N 2.95Å; M737-I748 HydrophobicContact SD-CD1 4.21Å; M737-L822 HydrophobicContact CE-CD1 3.4Å; M737-L822 HydrophobicContact CE-CD2 4.36Å; M737-L822 HydrophobicContact CG-CD1 3.7Å; M737-L822 HydrophobicContact SD-CD1 4.33Å; M737-F823 CarbonylContact C-O 3.47Å; M737-F823 WeakPolarHBondContact CA-O 3.37Å; M737-I824 HydrophobicContact CB-CD1 4.05Å; M737-I824 HydrophobicContact CG-CD1 3.8Å; M737-L843 HydrophobicContact CE-CD1 4.25Å; M737-L843 HydrophobicContact CE-CD2 3.71Å; M737-L843 HydrophobicContact SD-CD2 3.96Å
738	E	94.6	Very high	91.8	Very high	6 Å²	6	33.4 Å²	33.4	3%	0.028	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.9	133.4	172.4	177.2	173.5	87.5	0	0	111.4	V735 L740 I746 R747 F823 T827 A828	V735-E738 HydrophobicContact CG1-CB 4.09Å; E738-L740 HydrophobicContact CG-CD2 3.79Å; E738-L740 HydrophobicContact CG-CG 4.11Å; E738-I746 WeakPolarHBondContact CA-O 2.99Å; E738-R747 IonicContact OE2-CZ 3.98Å; E738-R747 IonicContact OE2-NE 2.97Å; E738-R747 PolarHBondContact OE2-NE 3.01Å; E738-R747 IonicContact OE2-NH2 3.76Å; E738-R747 PolarHBondContact OE2-NH2 2.85Å; E738-F823 PolarHBondContact N-O 3.4Å; E738-F823 PolarHBondContact O-N 2.99Å; E738-T827 WeakPolarHBondContact OE1-CA 3.43Å; E738-T827 WeakPolarHBondContact OE1-CB 2.82Å; E738-A828 PolarHBondContact OE1-N 2.88Å
739	N	92.3	Very high	92	Very high	0 Å²	0	32.5 Å²	32.5	0%	0	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.6	129.5	165.1	-163.1	177.9	0	0	0	108.8	F715 F745 I746 L818 S820 Q821 L822	F715-N739 WeakPolarHBondContact CB-OD1 3.34Å; F715-N739 PolarHBondContact N-OD1 2.81Å; N739-F745 WeakPolarHBondContact O-CA 3.46Å; N739-I746 HydrophobicContact CB-CG2 3.89Å; N739-I746 PolarHBondContact N-O 2.65Å; N739-I746 PolarHBondContact O-N 3.31Å; N739-L818 HydrophobicContact CB-CD1 4.09Å; N739-L818 WeakPolarHBondContact O-CD2 3.35Å; N739-S820 PolarHBondContact ND2-O 2.82Å; N739-S820 PolarHBondContact ND2-OG 2.79Å; N739-Q821 PolarHBondContact ND2-O 2.98Å; N739-Q821 VanDerWaalsContact ND2-O 3.12Å; N739-L822 HydrophobicContact CB-CD1 3.85Å
740	L	89.1	Confident	92.1	Very high	55 Å²	55	32.4 Å²	32.4	29%	0.288	19%	0.188	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	146.2	-175.7	-51.4	176.3	0	0	0	111.4	E738 F745 N819 S820	E738-L740 HydrophobicContact CG-CD2 3.79Å; E738-L740 HydrophobicContact CG-CG 4.11Å; L740-F745 HydrophobicContact CD2-CB 3.8Å; L740-N819 PolarHBondContact O-N 3.45Å; L740-N819 VanDerWaalsContact O-N 3.16Å; L740-N819 PolarHBondContact O-OD1 2.99Å; L740-N819 VanDerWaalsContact O-OD1 3.13Å; L740-S820 VanDerWaalsContact CA-OG 3.3Å; L740-S820 WeakPolarHBondContact CA-OG 3.2Å; L740-S820 WeakPolarHBondContact CB-OG 3.28Å; L740-S820 PolarHBondContact N-OG 2.69Å; L740-S820 WeakPolarHBondContact O-CB 3.18Å; L740-S820 PolarHBondContact O-N 2.95Å; L740-S820 PolarHBondContact O-OG 3.46Å
741	G	84.4	Confident	92.2	Very high	15 Å²	15	32.2 Å²	32.2	16%	0.155	18%	0.177	C	C	.	.	B	Isolated β-bridge	trans	-108.5	-160.6	165	0	0	0	0	0	110.9	D744 Q817 N819	G741-D744 VanDerWaalsContact CA-O 3.27Å; G741-D744 WeakPolarHBondContact CA-O 3.34Å; G741-D744 PolarHBondContact N-O 3.36Å; G741-Q817 VanDerWaalsContact CA-O 3.32Å; G741-Q817 WeakPolarHBondContact CA-O 3.42Å; G741-N819 VanDerWaalsContact CA-OD1 3.3Å; G741-N819 WeakPolarHBondContact CA-OD1 3.26Å
742	I	75.8	Confident	92.2	Very high	155 Å²	155	31.9 Å²	31.9	80%	0.795	18%	0.178	S	C	*	.	S	Bend	trans	-73.7	-54.1	174.3	-58.1	177.1	0	0	0	110	N819	I742-N819 WeakPolarHBondContact CG1-ND2 3.27Å
743	T	78	Confident	92.2	Very high	93 Å²	93	31 Å²	31	57%	0.571	17%	0.171	S	C	*	.	S	Bend	trans	-110.1	-25.7	173	45.5	0	0	0	0	111.6
744	D	87.6	Confident	92.2	Very high	9 Å²	9	30.3 Å²	30.3	5%	0.048	16%	0.164	C	C	.	.			trans	-86.2	154.6	-170.4	-65.3	22.5	0	0	0	110.5	G741 D761 L816 Q817	G741-D744 VanDerWaalsContact CA-O 3.27Å; G741-D744 WeakPolarHBondContact CA-O 3.34Å; G741-D744 PolarHBondContact N-O 3.36Å; D744-D761 WeakPolarHBondContact CA-O 3.46Å; D744-D761 VanDerWaalsContact CB-O 3.25Å; D744-D761 WeakPolarHBondContact CB-O 3.26Å; D744-L816 HydrophobicContact CB-CD1 4.14Å; D744-Q817 PolarHBondContact OD2-N 2.81Å
745	F	91.6	Very high	92.3	Very high	35 Å²	35	32.3 Å²	32.3	15%	0.154	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-155.4	164.7	166.1	69.1	-90.1	0	0	0	110.8	N739 L740 R747 F760 D761 P766	N739-F745 WeakPolarHBondContact O-CA 3.46Å; L740-F745 HydrophobicContact CD2-CB 3.8Å; F745-R747 HydrophobicContact CD2-CB 4.19Å; F745-R747 HydrophobicContact CE2-CB 4.4Å; F745-F760 CarbonylContact O-C 3.53Å; F745-F760 WeakPolarHBondContact O-CA 3.37Å; F745-F760 VanDerWaalsContact O-CB 3.24Å; F745-F760 WeakPolarHBondContact O-CB 2.91Å; F745-D761 HydrophobicContact CD1-CB 3.64Å; F745-D761 HydrophobicContact CE1-CB 3.56Å; F745-D761 HydrophobicContact CZ-CB 4.4Å; F745-D761 PolarHBondContact N-O 2.78Å; F745-D761 PolarHBondContact O-N 3.29Å; F745-P766 HydrophobicContact CE1-CB 4.25Å; F745-P766 HydrophobicContact CZ-CB 3.97Å
746	I	93.1	Very high	92.4	Very high	0 Å²	0	32.3 Å²	32.3	0%	0	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.3	131	166.7	-170.4	170.5	0	0	0	108.8	F715 A721 E738 N739 F758 S759 F760 L816 L818	F715-I746 HydrophobicContact CE1-CD1 4.2Å; A721-I746 HydrophobicContact CB-CD1 4.13Å; E738-I746 WeakPolarHBondContact CA-O 2.99Å; N739-I746 HydrophobicContact CB-CG2 3.89Å; N739-I746 PolarHBondContact N-O 2.65Å; N739-I746 PolarHBondContact O-N 3.31Å; I746-F758 HydrophobicContact CD1-CE2 3.78Å; I746-F758 HydrophobicContact CD1-CZ 4Å; I746-F758 HydrophobicContact CG1-CE2 3.57Å; I746-F758 HydrophobicContact CG1-CZ 4.22Å; I746-S759 CarbonylContact C-O 3.59Å; I746-F760 HydrophobicContact CB-CB 4.4Å; I746-F760 HydrophobicContact CG1-CB 4.32Å; I746-L816 HydrophobicContact CB-CD2 4.05Å; I746-L816 HydrophobicContact CD1-CD2 4Å; I746-L816 HydrophobicContact CG2-CD2 4.35Å; I746-L818 HydrophobicContact CG2-CD1 3.61Å; I746-L818 HydrophobicContact CG2-CD2 4.17Å
747	R	95.3	Very high	92.4	Very high	51 Å²	51	32.2 Å²	32.2	19%	0.192	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147	137.4	-176.2	-176.9	-171.4	-64.8	143.3	1.1	111.7	V735 M737 E738 F745 S759	V735-R747 HydrophobicContact CG1-CG 3.91Å; M737-R747 CarbonylContact O-C 3.55Å; M737-R747 VanDerWaalsContact O-CA 3.23Å; M737-R747 WeakPolarHBondContact O-CA 3.38Å; M737-R747 WeakPolarHBondContact O-CG 3.39Å; E738-R747 IonicContact OE2-CZ 3.98Å; E738-R747 IonicContact OE2-NE 2.97Å; E738-R747 PolarHBondContact OE2-NE 3.01Å; E738-R747 IonicContact OE2-NH2 3.76Å; E738-R747 PolarHBondContact OE2-NH2 2.85Å; F745-R747 HydrophobicContact CD2-CB 4.19Å; F745-R747 HydrophobicContact CE2-CB 4.4Å; R747-S759 PolarHBondContact N-O 3.03Å; R747-S759 PolarHBondContact O-N 3.46Å; R747-S759 PolarHBondContact O-OG 2.92Å
748	I	97.4	Very high	92.5	Very high	0 Å²	0	32.1 Å²	32.1	0%	0	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	127.5	169	-52	169.3	0	0	0	107.6	V723 F725 F736 M737 V756 T757 F758 V785 A787	V723-I748 HydrophobicContact CB-CD1 4Å; V723-I748 HydrophobicContact CG1-CD1 3.64Å; V723-I748 HydrophobicContact CG2-CD1 4.49Å; F725-I748 HydrophobicContact CE1-CD1 3.98Å; F725-I748 HydrophobicContact CE1-CG2 4.29Å; F725-I748 HydrophobicContact CZ-CG2 4.06Å; F736-I748 WeakPolarHBondContact CB-O 3.38Å; F736-I748 HydrophobicContact CD2-CG2 4.05Å; F736-I748 PolarHBondContact N-O 2.79Å; M737-I748 HydrophobicContact CB-CB 4.43Å; M737-I748 PolarHBondContact N-O 3.49Å; M737-I748 PolarHBondContact O-N 2.95Å; M737-I748 HydrophobicContact SD-CD1 4.21Å; I748-V756 HydrophobicContact CG2-CG1 4.36Å; I748-T757 WeakPolarHBondContact CA-O 3.36Å; I748-F758 HydrophobicContact CD1-CD2 4.33Å; I748-F758 HydrophobicContact CG1-CD2 3.6Å; I748-F758 HydrophobicContact CG1-CE2 4.18Å; I748-F758 HydrophobicContact CG1-CG 4.4Å; I748-V785 HydrophobicContact CG2-CG1 4.27Å; I748-A787 HydrophobicContact CD1-CB 3.67Å; I748-A787 HydrophobicContact CG1-CB 4.36Å
749	E	96.7	Very high	92.4	Very high	3 Å²	3	31.9 Å²	31.9	1%	0.014	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.1	152.1	-175.1	64.1	179.7	-176.4	0	0	112.4	G734 V735 R751 V756 T757 R832	G734-E749 CarbonylContact O-C 3.5Å; G734-E749 WeakPolarHBondContact O-CA 3.46Å; G734-E749 WeakPolarHBondContact O-CB 3.29Å; V735-E749 HydrophobicContact CG2-CB 4.2Å; E749-R751 IonicContact OE1-CZ 3.88Å; E749-R751 IonicContact OE1-NE 3.86Å; E749-R751 PolarHBondContact OE1-NE 2.72Å; E749-R751 IonicContact OE1-NH2 3.68Å; E749-R751 PolarHBondContact OE1-NH2 2.98Å; E749-V756 WeakPolarHBondContact O-CA 3.37Å; E749-T757 PolarHBondContact N-O 2.99Å; E749-T757 PolarHBondContact O-N 2.92Å; E749-R832 IonicContact OE1-NH2 3.78Å; E749-R832 IonicContact OE2-CZ 3.3Å; E749-R832 IonicContact OE2-NH1 3.72Å; E749-R832 IonicContact OE2-NH2 3.68Å; E749-R832 PolarHBondContact OE2-NH2 3.48Å
750	L	97.2	Very high	92.4	Very high	0 Å²	0	32.2 Å²	32.2	0%	0	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.1	108.1	158	-174.5	71.2	0	0	0	106.5	T729 V731 S733 G734 F736 A752 V756 F777	T729-L750 HydrophobicContact CG2-CD2 3.86Å; V731-L750 WeakPolarHBondContact O-CD2 3.42Å; S733-L750 CarbonylContact C-O 3.53Å; S733-L750 WeakPolarHBondContact CA-O 3.49Å; S733-L750 WeakPolarHBondContact CB-O 3.47Å; G734-L750 PolarHBondContact N-O 3.16Å; G734-L750 PolarHBondContact O-N 3.13Å; F736-L750 HydrophobicContact CE2-CB 3.88Å; F736-L750 VanDerWaalsContact CE2-N 3.28Å; F736-L750 HydrophobicContact CZ-CB 3.71Å; L750-A752 WeakPolarHBondContact CD1-O 3.46Å; L750-A752 WeakPolarHBondContact CG-O 3.29Å; L750-V756 HydrophobicContact CD1-CG2 3.88Å; L750-F777 HydrophobicContact CD1-CB 4.16Å; L750-F777 HydrophobicContact CD1-CD2 4.26Å
751	R	94.9	Very high	92.3	Very high	88 Å²	88	30.6 Å²	30.6	33%	0.332	16%	0.163	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.1	-37.5	-178.1	-176.9	170.3	-70.6	-171.5	-0.2	111.4	E749 E755 E768	E749-R751 IonicContact OE1-CZ 3.88Å; E749-R751 IonicContact OE1-NE 3.86Å; E749-R751 PolarHBondContact OE1-NE 2.72Å; E749-R751 IonicContact OE1-NH2 3.68Å; E749-R751 PolarHBondContact OE1-NH2 2.98Å; R751-E755 PolarHBondContact N-O 3.41Å; R751-E768 IonicContact CZ-OE1 3.04Å; R751-E768 IonicContact CZ-OE2 3.86Å; R751-E768 IonicContact NH1-OE1 3.53Å; R751-E768 IonicContact NH1-OE2 3.9Å; R751-E768 PolarHBondContact NH1-OE2 3.38Å; R751-E768 VanDerWaalsContact NH2-CD 3.31Å; R751-E768 IonicContact NH2-OE1 3.53Å; R751-E768 PolarHBondContact NH2-OE1 2.89Å; R751-E768 IonicContact NH2-OE2 3.86Å; R751-E768 PolarHBondContact NH2-OE2 3.09Å
752	A	95.3	Very high	92.2	Very high	27 Å²	27	30.3 Å²	30.3	22%	0.223	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.3	167.2	177.2	0	0	0	0	0	109.4	S732 L750 T754 E755	S732-A752 CarbonylContact O-C 3.51Å; S732-A752 WeakPolarHBondContact O-CA 3.48Å; L750-A752 WeakPolarHBondContact CD1-O 3.46Å; L750-A752 WeakPolarHBondContact CG-O 3.29Å; A752-T754 PolarHBondContact O-N 3.27Å; A752-E755 HydrophobicContact CB-CB 4.08Å; A752-E755 HydrophobicContact CB-CG 3.98Å; A752-E755 PolarHBondContact N-O 2.95Å; A752-E755 PolarHBondContact O-N 2.93Å
753	P	94.9	Very high	92	Very high	45 Å²	45	24.9 Å²	24.9	29%	0.292	14%	0.14	S	C	.	.	T	Hydrogen-bonded Turn	trans	-51.2	-32	-177	-30.6	36.6	0	0	0	114.3	S732 P776 F777 N778	S732-P753 WeakPolarHBondContact O-CD 3.15Å; P753-P776 HydrophobicContact CB-CB 4.1Å; P753-P776 CarbonylContact O-C 3.59Å; P753-P776 WeakPolarHBondContact O-CA 3.3Å; P753-F777 PolarHBondContact O-N 3.48Å; P753-N778 WeakPolarHBondContact CB-OD1 3.38Å
754	T	95.1	Very high	91.6	Very high	46 Å²	46	23.2 Å²	23.2	28%	0.282	13%	0.128	S	C	.	.	T	Hydrogen-bonded Turn	trans	-107.2	6.3	-177.9	50.5	0	0	0	0	113.3	A752 Q772 S773 P776 F777	A752-T754 PolarHBondContact O-N 3.27Å; T754-Q772 CarbonylContact O-C 3.46Å; T754-Q772 VanDerWaalsContact O-CA 3.28Å; T754-Q772 WeakPolarHBondContact O-CA 3.43Å; T754-S773 WeakPolarHBondContact CB-O 3.32Å; T754-S773 PolarHBondContact O-N 3.41Å; T754-P776 HydrophobicContact CG2-CB 4.29Å; T754-P776 HydrophobicContact CG2-CG 4.2Å; T754-F777 WeakPolarHBondContact O-CE2 3.21Å
755	E	96.2	Very high	91	Very high	47 Å²	47	24.2 Å²	24.2	22%	0.22	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.7	114.1	-167.8	-51.8	-163.3	152.7	0	0	112.8	R751 A752 T770 V771 Q772	R751-E755 PolarHBondContact N-O 3.41Å; A752-E755 HydrophobicContact CB-CB 4.08Å; A752-E755 HydrophobicContact CB-CG 3.98Å; A752-E755 PolarHBondContact N-O 2.95Å; A752-E755 PolarHBondContact O-N 2.93Å; E755-T770 HydrophobicContact CB-CG2 4.16Å; E755-V771 WeakPolarHBondContact CA-O 3.28Å; E755-Q772 HydrophobicContact CG-CG 4.05Å; E755-Q772 PolarHBondContact OE1-NE2 3.37Å
756	V	97.7	Very high	90.6	Very high	0 Å²	0	26.9 Å²	26.9	0%	0	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	131	168.7	179.5	0	0	0	0	108.4	F727 F736 I748 E749 L750 T770 V771 F777 V785 L796 V798	F727-V756 HydrophobicContact CE1-CG2 4.23Å; F727-V756 HydrophobicContact CZ-CG2 4.05Å; F736-V756 HydrophobicContact CE2-CG1 4.23Å; I748-V756 HydrophobicContact CG2-CG1 4.36Å; E749-V756 WeakPolarHBondContact O-CA 3.37Å; L750-V756 HydrophobicContact CD1-CG2 3.88Å; V756-T770 CarbonylContact O-C 3.57Å; V756-T770 WeakPolarHBondContact O-CA 3.32Å; V756-V771 PolarHBondContact N-O 3.25Å; V756-V771 PolarHBondContact O-N 3.34Å; V756-F777 HydrophobicContact CG2-CD2 3.79Å; V756-F777 HydrophobicContact CG2-CE2 3.82Å; V756-F777 HydrophobicContact CG2-CG 4.41Å; V756-F777 HydrophobicContact CG2-CZ 4.45Å; V756-V785 HydrophobicContact CG1-CG2 4.43Å; V756-L796 HydrophobicContact CG1-CD2 4.14Å; V756-L796 VanDerWaalsContact O-CD2 3.23Å; V756-L796 WeakPolarHBondContact O-CD2 3.16Å; V756-V798 HydrophobicContact CB-CG2 3.86Å; V756-V798 HydrophobicContact CG1-CG2 4.06Å; V756-V798 HydrophobicContact CG2-CG2 4.12Å
757	T	97.4	Very high	90.3	Very high	0 Å²	0	27.5 Å²	27.5	0%	0	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	134.2	-176.9	-59.2	0	0	0	0	110.9	I748 E749 E768 V769 T770	I748-T757 WeakPolarHBondContact CA-O 3.36Å; E749-T757 PolarHBondContact N-O 2.99Å; E749-T757 PolarHBondContact O-N 2.92Å; T757-E768 HydrophobicContact CG2-CB 4.2Å; T757-V769 WeakPolarHBondContact CA-O 3.41Å; T757-T770 WeakPolarHBondContact CG2-OG1 3.39Å; T757-T770 WeakPolarHBondContact OG1-CG2 3.23Å; T757-T770 PolarHBondContact OG1-OG1 3.11Å
758	F	96.9	Very high	90.1	Very high	0 Å²	0	28.7 Å²	28.7	0%	0	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	120.6	167.6	173	-140	0	0	0	108.5	I746 I748 F760 E768 V769 A787 R789 A794 L796	I746-F758 HydrophobicContact CD1-CE2 3.78Å; I746-F758 HydrophobicContact CD1-CZ 4Å; I746-F758 HydrophobicContact CG1-CE2 3.57Å; I746-F758 HydrophobicContact CG1-CZ 4.22Å; I748-F758 HydrophobicContact CD1-CD2 4.33Å; I748-F758 HydrophobicContact CG1-CD2 3.6Å; I748-F758 HydrophobicContact CG1-CE2 4.18Å; I748-F758 HydrophobicContact CG1-CG 4.4Å; F758-F760 HydrophobicContact CE1-CD1 4.2Å; F758-F760 HydrophobicContact CE1-CE1 4.41Å; F758-F760 HydrophobicContact CZ-CD1 4.13Å; F758-E768 CarbonylContact O-C 3.56Å; F758-E768 WeakPolarHBondContact O-CA 3.41Å; F758-V769 HydrophobicContact CB-CB 4.39Å; F758-V769 HydrophobicContact CD1-CG2 4.27Å; F758-V769 PolarHBondContact N-O 3.31Å; F758-V769 PolarHBondContact O-N 3.23Å; F758-A787 HydrophobicContact CB-CB 4.37Å; F758-A787 HydrophobicContact CD1-CB 3.97Å; F758-A787 HydrophobicContact CD2-CB 4.19Å; F758-A787 HydrophobicContact CE1-CB 4.24Å; F758-A787 HydrophobicContact CE2-CB 4.43Å; F758-A787 HydrophobicContact CG-CB 3.94Å; F758-A787 HydrophobicContact CZ-CB 4.46Å; F758-R789 HydrophobicContact CE1-CB 4.24Å; F758-R789 HydrophobicContact CZ-CB 4.15Å; F758-A794 HydrophobicContact CD1-CB 4.17Å; F758-A794 HydrophobicContact CE1-CB 3.8Å; F758-L796 HydrophobicContact CB-CB 4.21Å; F758-L796 HydrophobicContact CB-CD1 4.11Å; F758-L796 HydrophobicContact CB-CD2 4.02Å; F758-L796 HydrophobicContact CB-CG 4.34Å
759	S	94.3	Very high	89.9	Confident	0 Å²	0	28.9 Å²	28.9	0%	0	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130	142.7	-174.2	57.8	0	0	0	0	110.8	I746 R747 C767	I746-S759 CarbonylContact C-O 3.59Å; R747-S759 PolarHBondContact N-O 3.03Å; R747-S759 PolarHBondContact O-N 3.46Å; R747-S759 PolarHBondContact O-OG 2.92Å; S759-C767 CarbonylContact C-O 3.59Å; S759-C767 VanDerWaalsContact CA-O 3.26Å; S759-C767 WeakPolarHBondContact CA-O 3.34Å
760	F	91.6	Very high	89.8	Confident	7 Å²	7	30.6 Å²	30.6	3%	0.031	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-154.9	155.6	175.6	62.5	-81.6	0	0	0	111.4	F745 I746 F758 V762 C767 R789 A794	F745-F760 CarbonylContact O-C 3.53Å; F745-F760 WeakPolarHBondContact O-CA 3.37Å; F745-F760 VanDerWaalsContact O-CB 3.24Å; F745-F760 WeakPolarHBondContact O-CB 2.91Å; I746-F760 HydrophobicContact CB-CB 4.4Å; I746-F760 HydrophobicContact CG1-CB 4.32Å; F758-F760 HydrophobicContact CE1-CD1 4.2Å; F758-F760 HydrophobicContact CE1-CE1 4.41Å; F758-F760 HydrophobicContact CZ-CD1 4.13Å; F760-V762 HydrophobicContact CD2-CG1 3.97Å; F760-V762 HydrophobicContact CE2-CG1 4.36Å; F760-C767 HydrophobicContact CD1-CB 4.36Å; F760-C767 HydrophobicContact CD2-CB 4.3Å; F760-C767 HydrophobicContact CE1-CB 3.84Å; F760-C767 HydrophobicContact CE2-CB 3.83Å; F760-C767 HydrophobicContact CZ-CB 3.58Å; F760-C767 WeakPolarHBondContact CZ-SG 3.3Å; F760-C767 PolarHBondContact N-O 3.24Å; F760-C767 PolarHBondContact O-N 3.33Å; F760-R789 HydrophobicContact CE2-CG 4.42Å; F760-R789 HydrophobicContact CZ-CG 4.4Å; F760-A794 HydrophobicContact CD1-CB 4.26Å; F760-A794 HydrophobicContact CE1-CB 3.23Å; F760-A794 HydrophobicContact CZ-CB 3.65Å
761	D	87	Confident	89.6	Confident	21 Å²	21	30.6 Å²	30.6	11%	0.112	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	137.5	171.5	-164.8	-19.8	0	0	0	109.1	D744 F745 G763 N764 G765 L816	D744-D761 WeakPolarHBondContact CA-O 3.46Å; D744-D761 VanDerWaalsContact CB-O 3.25Å; D744-D761 WeakPolarHBondContact CB-O 3.26Å; F745-D761 HydrophobicContact CD1-CB 3.64Å; F745-D761 HydrophobicContact CE1-CB 3.56Å; F745-D761 HydrophobicContact CZ-CB 4.4Å; F745-D761 PolarHBondContact N-O 2.78Å; F745-D761 PolarHBondContact O-N 3.29Å; D761-G763 PolarHBondContact OD1-N 2.74Å; D761-N764 PolarHBondContact OD1-N 3.41Å; D761-G765 PolarHBondContact OD1-N 2.94Å; D761-G765 VanDerWaalsContact OD1-N 3.08Å; D761-G765 WeakPolarHBondContact OD2-CA 3.41Å; D761-G765 PolarHBondContact OD2-N 3.4Å; D761-L816 WeakPolarHBondContact O-CD1 3.16Å
762	V	82.2	Confident	89.5	Confident	9 Å²	9	32.3 Å²	32.3	6%	0.055	20%	0.197	C	C	.	.	S	Bend	trans	-123.8	18.6	-178.1	-65.3	0	0	0	0	111.5	F760 H813 L816	F760-V762 HydrophobicContact CD2-CG1 3.97Å; F760-V762 HydrophobicContact CE2-CG1 4.36Å; V762-H813 HydrophobicContact CG2-CB 4.24Å; V762-H813 WeakPolarHBondContact CG2-O 3.49Å; V762-L816 HydrophobicContact CG1-CB 4.12Å; V762-L816 HydrophobicContact CG1-CD1 3.88Å
763	G	71.3	Confident	89.2	Confident	41 Å²	41	31.7 Å²	31.7	42%	0.423	19%	0.191	S	C	.	.	S	Bend	trans	104.4	0.1	-180	0	0	0	0	0	115.2	D761	D761-G763 PolarHBondContact OD1-N 2.74Å
764	N	69.4	Low	88.9	Confident	58 Å²	58	35.5 Å²	35.5	31%	0.31	22%	0.216	S	C	.	.	S	Bend	trans	-113.8	9.9	-177.9	-68.1	-8.5	0	0	0	113.2	D761 D811 H813	D761-N764 PolarHBondContact OD1-N 3.41Å; N764-D811 WeakPolarHBondContact ND2-CB 3.27Å; N764-H813 PolarHBondContact OD1-CD2 3.14Å; N764-H813 VanDerWaalsContact OD1-CG 3.32Å
765	G	74.9	Confident	88.6	Confident	31 Å²	31	37.5 Å²	37.5	32%	0.32	23%	0.228	S	C	.	.			trans	96.5	165.1	-172.1	0	0	0	0	0	112.4	D761 C767	D761-G765 PolarHBondContact OD1-N 2.94Å; D761-G765 VanDerWaalsContact OD1-N 3.08Å; D761-G765 WeakPolarHBondContact OD2-CA 3.41Å; D761-G765 PolarHBondContact OD2-N 3.4Å; G765-C767 PolarHBondContact O-N 2.83Å
766	P	82.9	Confident	88.5	Confident	90 Å²	90	38.1 Å²	38.1	58%	0.584	24%	0.237	S	C	*	.			trans	-70.9	128	-171.6	28	-34.7	0	0	0	111.5	F745	F745-P766 HydrophobicContact CE1-CB 4.25Å; F745-P766 HydrophobicContact CZ-CB 3.97Å
767	C	86.8	Confident	88.4	Confident	14 Å²	14	38.2 Å²	38.2	10%	0.095	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	128.2	171.1	-176.5	0	0	0	0	108.8	S759 F760 G765 Q806	S759-C767 CarbonylContact C-O 3.59Å; S759-C767 VanDerWaalsContact CA-O 3.26Å; S759-C767 WeakPolarHBondContact CA-O 3.34Å; F760-C767 HydrophobicContact CD1-CB 4.36Å; F760-C767 HydrophobicContact CD2-CB 4.3Å; F760-C767 HydrophobicContact CE1-CB 3.84Å; F760-C767 HydrophobicContact CE2-CB 3.83Å; F760-C767 HydrophobicContact CZ-CB 3.58Å; F760-C767 WeakPolarHBondContact CZ-SG 3.3Å; F760-C767 PolarHBondContact N-O 3.24Å; F760-C767 PolarHBondContact O-N 3.33Å; G765-C767 PolarHBondContact O-N 2.83Å; C767-Q806 WeakPolarHBondContact SG-CG 3.46Å
768	E	92.4	Very high	88.3	Confident	76 Å²	76	40.1 Å²	40.1	36%	0.355	25%	0.247	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	139.5	-176.3	-57	-164.8	150.2	0	0	112.2	R751 T757 F758	R751-E768 IonicContact CZ-OE1 3.04Å; R751-E768 IonicContact CZ-OE2 3.86Å; R751-E768 IonicContact NH1-OE1 3.53Å; R751-E768 IonicContact NH1-OE2 3.9Å; R751-E768 PolarHBondContact NH1-OE2 3.38Å; R751-E768 VanDerWaalsContact NH2-CD 3.31Å; R751-E768 IonicContact NH2-OE1 3.53Å; R751-E768 PolarHBondContact NH2-OE1 2.89Å; R751-E768 IonicContact NH2-OE2 3.86Å; R751-E768 PolarHBondContact NH2-OE2 3.09Å; T757-E768 HydrophobicContact CG2-CB 4.2Å; F758-E768 CarbonylContact O-C 3.56Å; F758-E768 WeakPolarHBondContact O-CA 3.41Å
769	V	92.6	Very high	88.1	Confident	4 Å²	4	43.4 Å²	43.4	2%	0.024	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	112.2	174.5	-163.2	0	0	0	0	108	T757 F758 A794 L796 K804 Q806	T757-V769 WeakPolarHBondContact CA-O 3.41Å; F758-V769 HydrophobicContact CB-CB 4.39Å; F758-V769 HydrophobicContact CD1-CG2 4.27Å; F758-V769 PolarHBondContact N-O 3.31Å; F758-V769 PolarHBondContact O-N 3.23Å; V769-A794 HydrophobicContact CG2-CB 3.75Å; V769-L796 HydrophobicContact CB-CB 4.14Å; V769-L796 HydrophobicContact CG1-CB 3.82Å; V769-L796 WeakPolarHBondContact O-CD2 3.23Å; V769-K804 HydrophobicContact CG1-CB 3.4Å; V769-K804 HydrophobicContact CG1-CG 4.45Å; V769-Q806 HydrophobicContact CG2-CB 3.5Å
770	T	94.9	Very high	87.9	Confident	38 Å²	38	47 Å²	47	23%	0.233	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	125.9	-176.9	-59	0	0	0	0	111.7	E755 V756 T757 Q772 K804	E755-T770 HydrophobicContact CB-CG2 4.16Å; V756-T770 CarbonylContact O-C 3.57Å; V756-T770 WeakPolarHBondContact O-CA 3.32Å; T757-T770 WeakPolarHBondContact CG2-OG1 3.39Å; T757-T770 WeakPolarHBondContact OG1-CG2 3.23Å; T757-T770 PolarHBondContact OG1-OG1 3.11Å; T770-Q772 HydrophobicContact CG2-CG 4.36Å; T770-K804 WeakPolarHBondContact O-CE 3.4Å; T770-K804 WeakPolarHBondContact O-CG 3.35Å
771	V	93	Very high	87.7	Confident	1 Å²	1	50.1 Å²	50.1	1%	0.006	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.5	122.6	169.6	173.4	0	0	0	0	108.5	E755 V756 F777 L796 V798 L801 K804	E755-V771 WeakPolarHBondContact CA-O 3.28Å; V756-V771 PolarHBondContact N-O 3.25Å; V756-V771 PolarHBondContact O-N 3.34Å; V771-F777 HydrophobicContact CG1-CZ 4.45Å; V771-L796 HydrophobicContact CB-CD2 4.24Å; V771-L796 HydrophobicContact CG2-CB 4.1Å; V771-L796 HydrophobicContact CG2-CD2 3.87Å; V771-L796 HydrophobicContact CG2-CG 3.73Å; V771-L796 WeakPolarHBondContact CG2-O 3.18Å; V771-V798 HydrophobicContact CB-CG2 3.95Å; V771-V798 HydrophobicContact CG1-CB 4.05Å; V771-V798 HydrophobicContact CG1-CG2 4Å; V771-V798 HydrophobicContact CG2-CG2 4.24Å; V771-L801 HydrophobicContact CG1-CB 4.36Å; V771-L801 HydrophobicContact CG1-CD1 3.76Å; V771-K804 HydrophobicContact CB-CG 4.48Å; V771-K804 HydrophobicContact CG2-CB 4.17Å; V771-K804 HydrophobicContact CG2-CG 3.59Å
772	Q	92.1	Very high	87.8	Confident	123 Å²	123	49.8 Å²	49.8	58%	0.575	30%	0.296	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-103.7	134.1	173.1	-65.7	-176.7	-23.5	0	0	109.9	T754 E755 T770	T754-Q772 CarbonylContact O-C 3.46Å; T754-Q772 VanDerWaalsContact O-CA 3.28Å; T754-Q772 WeakPolarHBondContact O-CA 3.43Å; E755-Q772 HydrophobicContact CG-CG 4.05Å; E755-Q772 PolarHBondContact OE1-NE2 3.37Å; T770-Q772 HydrophobicContact CG2-CG 4.36Å
773	S	89.9	Confident	88.2	Confident	15 Å²	15	50 Å²	50	11%	0.105	30%	0.296	C	S	.	.			trans	-106.7	143.7	176.2	178.8	0	0	0	0	111.9	T754 T775	T754-S773 WeakPolarHBondContact CB-O 3.32Å; T754-S773 PolarHBondContact O-N 3.41Å; S773-T775 WeakPolarHBondContact CB-O 3.32Å; S773-T775 PolarHBondContact O-N 3.05Å; S773-T775 PolarHBondContact OG-N 3.21Å; S773-T775 PolarHBondContact OG-O 3.25Å; S773-T775 PolarHBondContact OG-OG1 2.67Å
774	P	88.1	Confident	89	Confident	124 Å²	124	49.6 Å²	49.6	81%	0.805	28%	0.283	S	S	*	.	S	Bend	trans	-62.3	-26.7	169.7	-20	32.2	0	0	0	113.4
775	T	88.7	Confident	90.2	Very high	89 Å²	89	46.9 Å²	46.9	55%	0.546	27%	0.269	S	S	.	.	S	Bend	trans	-114.3	144	177.4	54.5	0	0	0	0	110.4	S773	S773-T775 WeakPolarHBondContact CB-O 3.32Å; S773-T775 PolarHBondContact O-N 3.05Å; S773-T775 PolarHBondContact OG-N 3.21Å; S773-T775 PolarHBondContact OG-O 3.25Å; S773-T775 PolarHBondContact OG-OG1 2.67Å
776	P	94.8	Very high	90.7	Very high	60 Å²	60	49.1 Å²	49.1	39%	0.39	27%	0.268	S	S	.	.			trans	-61.5	141.6	177.9	-20	31.8	0	0	0	112.6	P753 T754 N778	P753-P776 HydrophobicContact CB-CB 4.1Å; P753-P776 CarbonylContact O-C 3.59Å; P753-P776 WeakPolarHBondContact O-CA 3.3Å; T754-P776 HydrophobicContact CG2-CB 4.29Å; T754-P776 HydrophobicContact CG2-CG 4.2Å; P776-N778 VanDerWaalsContact C-N 3.32Å; P776-N778 WeakPolarHBondContact CB-OD1 3.41Å
777	F	95.7	Very high	91.1	Very high	1 Å²	1	44.9 Å²	44.9	0%	0.004	24%	0.24	C	C	.	.	S	Bend	trans	-83.4	-5.4	174	-64	-61.9	0	0	0	113.8	F727 L750 P753 T754 V756 V771 D779 H783 V798 L801	F727-F777 HydrophobicContact CE2-CB 4.08Å; F727-F777 HydrophobicContact CZ-CB 3.84Å; F727-F777 HydrophobicContact CZ-CG 4.24Å; L750-F777 HydrophobicContact CD1-CB 4.16Å; L750-F777 HydrophobicContact CD1-CD2 4.26Å; P753-F777 PolarHBondContact O-N 3.48Å; T754-F777 WeakPolarHBondContact O-CE2 3.21Å; V756-F777 HydrophobicContact CG2-CD2 3.79Å; V756-F777 HydrophobicContact CG2-CE2 3.82Å; V756-F777 HydrophobicContact CG2-CG 4.41Å; V756-F777 HydrophobicContact CG2-CZ 4.45Å; V771-F777 HydrophobicContact CG1-CZ 4.45Å; F777-D779 VanDerWaalsContact C-N 3.26Å; F777-D779 PolarHBondContact O-N 3.02Å; F777-H783 WeakPolarHBondContact CA-NE2 3.27Å; F777-H783 AromaticContact CD1-CE1 3.86Å; F777-H783 AromaticContact CD1-CG 3.89Å; F777-H783 AromaticContact CD1-ND1 3.68Å; F777-H783 PolarHBondContact O-CD2 2.65Å; F777-H783 PolarHBondContact O-NE2 3.36Å; F777-V798 HydrophobicContact CD1-CG1 4.13Å; F777-V798 HydrophobicContact CE1-CB 4.16Å; F777-V798 HydrophobicContact CE1-CG1 3.45Å; F777-V798 VanDerWaalsContact CE1-CG1 3.45Å; F777-V798 HydrophobicContact CZ-CB 3.97Å; F777-V798 HydrophobicContact CZ-CG1 3.7Å; F777-L801 HydrophobicContact CE1-CD1 3.95Å; F777-L801 HydrophobicContact CZ-CD1 3.64Å
778	N	94.6	Very high	91.1	Very high	40 Å²	40	45 Å²	45	21%	0.214	24%	0.239	C	C	.	.			trans	-96.5	36	176.2	71.8	-37.1	0	0	0	111.6	T729 T730 V731 P753 P776 N780	T729-N778 HydrophobicContact CG2-CB 4.09Å; T729-N778 CarbonylContact O-C 3.51Å; T729-N778 VanDerWaalsContact O-CA 3.25Å; T729-N778 WeakPolarHBondContact O-CA 3.42Å; T730-N778 PolarHBondContact O-ND2 3.41Å; V731-N778 WeakPolarHBondContact O-CB 3.45Å; P753-N778 WeakPolarHBondContact CB-OD1 3.38Å; P776-N778 VanDerWaalsContact C-N 3.32Å; P776-N778 WeakPolarHBondContact CB-OD1 3.41Å; N778-N780 VanDerWaalsContact C-N 3.25Å; N778-N780 PolarHBondContact O-N 2.82Å
779	D	92.3	Very high	90.9	Very high	69 Å²	69	41.9 Å²	41.9	37%	0.369	22%	0.224	S	C	.	.	S	Bend	trans	-87.6	10.7	-177.8	65.9	-0.5	0	0	0	113.2	F777 Q781 H783	F777-D779 VanDerWaalsContact C-N 3.26Å; F777-D779 PolarHBondContact O-N 3.02Å; D779-Q781 HydrophobicContact CB-CG 4.36Å; D779-Q781 VanDerWaalsContact CG-CG 3.46Å; D779-Q781 PolarHBondContact O-N 3.06Å; D779-Q781 PolarHBondContact O-NE2 3.14Å; D779-Q781 WeakPolarHBondContact OD1-CA 3.48Å; D779-Q781 WeakPolarHBondContact OD1-CB 3.35Å; D779-Q781 WeakPolarHBondContact OD1-CG 3.39Å; D779-Q781 PolarHBondContact OD1-N 3.15Å; D779-Q781 WeakPolarHBondContact OD2-CG 3.34Å; D779-H783 IonicContact OD1-CD2 3.15Å; D779-H783 IonicContact OD1-CE1 2.66Å; D779-H783 IonicContact OD1-NE2 2.84Å; D779-H783 PolarHBondContact OD1-NE2 2.85Å; D779-H783 IonicContact OD2-CE1 3.54Å; D779-H783 IonicContact OD2-NE2 2.72Å
780	N	89.8	Confident	90	Very high	77 Å²	77	43.3 Å²	43.3	41%	0.412	23%	0.231	S	C	.	.	S	Bend	trans	57.5	28.7	-172.9	-162.7	27.5	0	0	0	113.6	K728 T729 T730 N778	K728-N780 WeakPolarHBondContact CD-O 3.44Å; K728-N780 WeakPolarHBondContact CE-OD1 3.48Å; T729-N780 WeakPolarHBondContact O-CA 3.46Å; T729-N780 PolarHBondContact O-N 3.43Å; T730-N780 HydrophobicContact CG2-CB 3.82Å; N778-N780 VanDerWaalsContact C-N 3.25Å; N778-N780 PolarHBondContact O-N 2.82Å
781	Q	88.7	Confident	88.7	Confident	71 Å²	71	42.5 Å²	42.5	33%	0.332	23%	0.226	S	C	.	.	S	Bend	trans	-107.4	158.9	170.9	-50.9	-51.5	-38.2	0	0	111.5	K728 D779 H783 S869	K728-Q781 WeakPolarHBondContact CA-O 3.4Å; K728-Q781 WeakPolarHBondContact CG-O 3.48Å; D779-Q781 HydrophobicContact CB-CG 4.36Å; D779-Q781 VanDerWaalsContact CG-CG 3.46Å; D779-Q781 PolarHBondContact O-N 3.06Å; D779-Q781 PolarHBondContact O-NE2 3.14Å; D779-Q781 WeakPolarHBondContact OD1-CA 3.48Å; D779-Q781 WeakPolarHBondContact OD1-CB 3.35Å; D779-Q781 WeakPolarHBondContact OD1-CG 3.39Å; D779-Q781 PolarHBondContact OD1-N 3.15Å; D779-Q781 WeakPolarHBondContact OD2-CG 3.34Å; Q781-H783 PolarHBondContact O-CD2 3.08Å; Q781-H783 VanDerWaalsContact O-CD2 3.31Å; Q781-H783 PolarHBondContact O-N 3.17Å; Q781-S869 PolarHBondContact OE1-OG 3.09Å
782	W	88.4	Confident	87.3	Confident	14 Å²	14	46.5 Å²	46.5	5%	0.053	24%	0.244	C	C	.	.			trans	-76.6	123	175.4	-72.9	104.1	0	0	0	110.8	F726 F727 K728 C837 R839 C864 G866 H867	F726-W782 HydrophobicContact CB-CE3 3.68Å; F726-W782 HydrophobicContact CB-CZ3 4.12Å; F727-W782 CarbonylContact O-C 3.58Å; F727-W782 WeakPolarHBondContact O-CA 3.4Å; K728-W782 HydrophobicContact CB-CD2 3.94Å; K728-W782 HydrophobicContact CB-CE3 3.8Å; K728-W782 HydrophobicContact CB-CG 4.47Å; K728-W782 HydrophobicContact CB-CH2 4.47Å; K728-W782 HydrophobicContact CB-CZ3 4.09Å; W782-C837 HydrophobicContact CH2-CB 3.53Å; W782-C837 HydrophobicContact CZ2-CB 4.26Å; W782-C837 HydrophobicContact CZ3-CB 4.03Å; W782-R839 HydrophobicContact CE3-CB 4.38Å; W782-R839 HydrophobicContact CH2-CB 3.59Å; W782-R839 HydrophobicContact CZ2-CB 4.5Å; W782-R839 HydrophobicContact CZ3-CB 3.53Å; W782-C864 HydrophobicContact CH2-CB 3.94Å; W782-C864 HydrophobicContact CZ2-CB 3.85Å; W782-G866 PolarHBondContact NE1-O 2.94Å; W782-H867 AromaticContact NE1-ND1 3.77Å
783	H	90.4	Very high	86.6	Confident	13 Å²	13	41.1 Å²	41.1	6%	0.06	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	139.4	172.8	-61.8	-71.5	0	0	0	110.7	F726 F727 F777 D779 Q781 V798 D799	F726-H783 CarbonylContact C-O 3.58Å; F726-H783 WeakPolarHBondContact CA-O 3.08Å; F727-H783 HydrophobicContact CD1-CB 4.01Å; F727-H783 HydrophobicContact CE1-CB 3.52Å; F727-H783 HydrophobicContact CE2-CB 4.24Å; F727-H783 AromaticContact CE2-CD2 3.98Å; F727-H783 HydrophobicContact CZ-CB 3.67Å; F727-H783 PolarHBondContact N-O 2.85Å; F727-H783 PolarHBondContact O-N 2.84Å; F777-H783 WeakPolarHBondContact CA-NE2 3.27Å; F777-H783 AromaticContact CD1-CE1 3.86Å; F777-H783 AromaticContact CD1-CG 3.89Å; F777-H783 AromaticContact CD1-ND1 3.68Å; F777-H783 PolarHBondContact O-CD2 2.65Å; F777-H783 PolarHBondContact O-NE2 3.36Å; D779-H783 IonicContact OD1-CD2 3.15Å; D779-H783 IonicContact OD1-CE1 2.66Å; D779-H783 IonicContact OD1-NE2 2.84Å; D779-H783 PolarHBondContact OD1-NE2 2.85Å; D779-H783 IonicContact OD2-CE1 3.54Å; D779-H783 IonicContact OD2-NE2 2.72Å; Q781-H783 PolarHBondContact O-CD2 3.08Å; Q781-H783 VanDerWaalsContact O-CD2 3.31Å; Q781-H783 PolarHBondContact O-N 3.17Å; H783-V798 HydrophobicContact CB-CG1 4.36Å; H783-D799 WeakPolarHBondContact CA-OD1 3.2Å; H783-D799 IonicContact CE1-OD2 3.43Å; H783-D799 IonicContact CG-OD2 3.15Å; H783-D799 IonicContact ND1-OD1 3.77Å; H783-D799 IonicContact ND1-OD2 3.76Å; H783-D799 PolarHBondContact ND1-OD2 2.76Å
784	H	89.2	Confident	86.3	Confident	34 Å²	34	40.5 Å²	40.5	16%	0.157	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.1	120.4	179.8	-173.5	-178	0	0	0	110.6	F725 F726 R786 V798 D799	F725-H784 PolarHBondContact O-CD2 3.27Å; F726-H784 HydrophobicContact CD1-CB 3.75Å; F726-H784 HydrophobicContact CE1-CB 3.53Å; F726-H784 AromaticContact CE1-CG 3.73Å; F726-H784 HydrophobicContact CZ-CB 4.14Å; F726-H784 AromaticContact CZ-CG 3.8Å; F726-H784 AromaticContact CZ-ND1 3.83Å; H784-R786 PolarHBondContact CE1-NE 2.85Å; H784-R786 PolarHBondContact CE1-NH2 3.05Å; H784-R786 VanDerWaalsContact CE1-NH2 3.33Å; H784-R786 PolarHBondContact NE2-NE 3.38Å; H784-V798 CarbonylContact O-C 3.59Å; H784-V798 VanDerWaalsContact O-CA 3.24Å; H784-V798 WeakPolarHBondContact O-CA 3.43Å; H784-D799 PolarHBondContact N-OD1 2.86Å; H784-D799 PolarHBondContact O-N 3.4Å
785	V	93.6	Very high	86.2	Confident	0 Å²	0	34.9 Å²	34.9	0%	0	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.4	134.3	174.7	-179.6	0	0	0	0	109.9	C724 F725 F727 I748 V756 L796 V798	C724-V785 VanDerWaalsContact CA-O 3.25Å; C724-V785 WeakPolarHBondContact CA-O 3.41Å; F725-V785 HydrophobicContact CD1-CB 4.3Å; F725-V785 HydrophobicContact CD2-CB 4.45Å; F725-V785 HydrophobicContact CE1-CB 3.91Å; F725-V785 HydrophobicContact CE1-CG1 3.85Å; F725-V785 HydrophobicContact CE2-CB 4.07Å; F725-V785 HydrophobicContact CE2-CG2 4.03Å; F725-V785 HydrophobicContact CZ-CB 3.77Å; F725-V785 HydrophobicContact CZ-CG1 3.89Å; F725-V785 HydrophobicContact CZ-CG2 4Å; F725-V785 PolarHBondContact N-O 3.48Å; F725-V785 PolarHBondContact O-N 3.09Å; F727-V785 HydrophobicContact CD1-CG2 3.51Å; F727-V785 HydrophobicContact CE1-CG2 3.42Å; F727-V785 VanDerWaalsContact CE1-CG2 3.42Å; I748-V785 HydrophobicContact CG2-CG1 4.27Å; V756-V785 HydrophobicContact CG1-CG2 4.43Å; V785-L796 HydrophobicContact CG1-CD1 3.71Å; V785-V798 HydrophobicContact CG2-CG1 4.3Å; V785-V798 HydrophobicContact CG2-CG2 4.28Å
786	R	86.1	Confident	86.3	Confident	79 Å²	79	30.7 Å²	30.7	30%	0.298	16%	0.155	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.7	116.8	168	-59.2	-175.3	-175.3	-159.2	6.5	109.2	V723 C724 H784 L796 Q797	V723-R786 CarbonylContact O-C 3.46Å; V723-R786 WeakPolarHBondContact O-CA 3.44Å; C724-R786 HydrophobicContact CB-CG 4.09Å; H784-R786 PolarHBondContact CE1-NE 2.85Å; H784-R786 PolarHBondContact CE1-NH2 3.05Å; H784-R786 VanDerWaalsContact CE1-NH2 3.33Å; H784-R786 PolarHBondContact NE2-NE 3.38Å; R786-L796 CarbonylContact O-C 3.48Å; R786-L796 WeakPolarHBondContact O-CA 3.43Å; R786-Q797 HydrophobicContact CB-CB 4.37Å; R786-Q797 PolarHBondContact N-O 3.38Å; R786-Q797 PolarHBondContact O-N 3.39Å
787	A	91.8	Very high	86	Confident	0 Å²	0	30.2 Å²	30.2	0%	0	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	126.7	177.2	0	0	0	0	0	109.1	V723 I748 F758 S795 L796	V723-A787 HydrophobicContact CB-CB 4.4Å; V723-A787 PolarHBondContact N-O 3.39Å; V723-A787 PolarHBondContact O-N 3.43Å; I748-A787 HydrophobicContact CD1-CB 3.67Å; I748-A787 HydrophobicContact CG1-CB 4.36Å; F758-A787 HydrophobicContact CB-CB 4.37Å; F758-A787 HydrophobicContact CD1-CB 3.97Å; F758-A787 HydrophobicContact CD2-CB 4.19Å; F758-A787 HydrophobicContact CE1-CB 4.24Å; F758-A787 HydrophobicContact CE2-CB 4.43Å; F758-A787 HydrophobicContact CG-CB 3.94Å; F758-A787 HydrophobicContact CZ-CB 4.46Å; A787-S795 CarbonylContact C-O 3.53Å; A787-S795 VanDerWaalsContact CA-O 3.31Å; A787-S795 WeakPolarHBondContact CA-O 3.33Å; A787-L796 HydrophobicContact CB-CD1 3.89Å
788	E	86.9	Confident	85.8	Confident	18 Å²	18	30.1 Å²	30.1	8%	0.084	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	143	179.7	-59.7	172.5	-177.3	0	0	109.7	S376 A721 A794 S795	S376-E788 WeakPolarHBondContact CB-OE1 3.33Å; A721-E788 CarbonylContact O-C 3.56Å; A721-E788 WeakPolarHBondContact O-CA 3.15Å; E788-A794 CarbonylContact O-C 3.53Å; E788-A794 WeakPolarHBondContact O-CA 3.23Å; E788-S795 WeakPolarHBondContact CB-OG 3.44Å; E788-S795 PolarHBondContact N-O 2.82Å; E788-S795 PolarHBondContact O-N 2.75Å
789	R	86.4	Confident	85.4	Confident	10 Å²	10	30.9 Å²	30.9	4%	0.038	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.9	136.4	170.6	178.8	-173	168.8	-87.6	-11.5	108.2	G717 E718 T720 A721 F758 F760 A794 V814	G717-R789 PolarHBondContact O-NH1 3.12Å; E718-R789 PolarHBondContact O-NH1 2.93Å; T720-R789 CarbonylContact C-O 3.54Å; T720-R789 WeakPolarHBondContact CA-O 3.3Å; A721-R789 HydrophobicContact CB-CB 4.07Å; A721-R789 PolarHBondContact N-O 2.97Å; A721-R789 PolarHBondContact O-N 2.9Å; F758-R789 HydrophobicContact CE1-CB 4.24Å; F758-R789 HydrophobicContact CZ-CB 4.15Å; F760-R789 HydrophobicContact CE2-CG 4.42Å; F760-R789 HydrophobicContact CZ-CG 4.4Å; R789-A794 HydrophobicContact CB-CB 4.48Å; R789-V814 PolarHBondContact NH2-O 2.78Å
790	N	73.8	Confident	84.7	Confident	33 Å²	33	36.1 Å²	36.1	18%	0.176	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.5	-176.9	170.2	63.6	45.4	0	0	0	110.2	L719 T720 K792 G793	L719-N790 WeakPolarHBondContact O-CA 3.39Å; T720-N790 HydrophobicContact CG2-CB 4.12Å; N790-K792 PolarHBondContact O-N 2.67Å; N790-K792 VanDerWaalsContact O-N 3.16Å; N790-K792 WeakPolarHBondContact OD1-CA 3.08Å; N790-K792 VanDerWaalsContact OD1-CB 3.31Å; N790-K792 WeakPolarHBondContact OD1-CB 3.43Å; N790-K792 PolarHBondContact OD1-N 2.61Å; N790-G793 PolarHBondContact N-O 2.98Å; N790-G793 PolarHBondContact O-N 2.78Å; N790-G793 VanDerWaalsContact O-O 3.08Å; N790-G793 PolarHBondContact OD1-N 3.49Å; N790-G793 VanDerWaalsContact OD1-N 3.15Å; N790-G793 PolarHBondContact OD1-O 2.64Å
791	V	68.6	Low	84	Confident	21 Å²	21	34.2 Å²	34.2	13%	0.127	16%	0.163	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.1	-15	-179	-58.7	0	0	0	0	114.8	L266 L719 A808 V814	L266-V791 HydrophobicContact CD1-CG2 4.06Å; L719-V791 HydrophobicContact CD2-CG1 4.49Å; V791-A808 WeakPolarHBondContact O-CB 3.09Å; V791-V814 HydrophobicContact CB-CG1 4.33Å; V791-V814 HydrophobicContact CG1-CB 4.21Å; V791-V814 HydrophobicContact CG1-CG1 4.34Å
792	K	62.8	Low	83.1	Confident	86 Å²	86	34.2 Å²	34.2	37%	0.374	17%	0.169	S	C	.	.	T	Hydrogen-bonded Turn	trans	-94.2	-20.5	176.8	-70.8	-176.1	175.6	-173.4	0	112.8	L266 T373 N790 A808	L266-K792 HydrophobicContact CD1-CD 3.9Å; L266-K792 HydrophobicContact CD1-CG 3.45Å; L266-K792 VanDerWaalsContact CD1-CG 3.45Å; T373-K792 PolarHBondContact OG1-NZ 2.9Å; N790-K792 PolarHBondContact O-N 2.67Å; N790-K792 VanDerWaalsContact O-N 3.16Å; N790-K792 WeakPolarHBondContact OD1-CA 3.08Å; N790-K792 VanDerWaalsContact OD1-CB 3.31Å; N790-K792 WeakPolarHBondContact OD1-CB 3.43Å; N790-K792 PolarHBondContact OD1-N 2.61Å; K792-A808 PolarHBondContact O-N 2.83Å
793	G	77.1	Confident	82.5	Confident	9 Å²	9	36.5 Å²	36.5	9%	0.093	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	158.2	-174.2	-178.9	0	0	0	0	0	113.5	N790 Q806	N790-G793 PolarHBondContact N-O 2.98Å; N790-G793 PolarHBondContact O-N 2.78Å; N790-G793 VanDerWaalsContact O-O 3.08Å; N790-G793 PolarHBondContact OD1-N 3.49Å; N790-G793 VanDerWaalsContact OD1-N 3.15Å; N790-G793 PolarHBondContact OD1-O 2.64Å; G793-Q806 CarbonylContact C-O 3.56Å; G793-Q806 WeakPolarHBondContact CA-O 3.24Å
794	A	85.3	Confident	81.9	Confident	3 Å²	3	37.5 Å²	37.5	3%	0.025	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	158.4	173.6	0	0	0	0	0	110.8	F758 F760 V769 E788 R789 M805 Q806	F758-A794 HydrophobicContact CD1-CB 4.17Å; F758-A794 HydrophobicContact CE1-CB 3.8Å; F760-A794 HydrophobicContact CD1-CB 4.26Å; F760-A794 HydrophobicContact CE1-CB 3.23Å; F760-A794 HydrophobicContact CZ-CB 3.65Å; V769-A794 HydrophobicContact CG2-CB 3.75Å; E788-A794 CarbonylContact O-C 3.53Å; E788-A794 WeakPolarHBondContact O-CA 3.23Å; R789-A794 HydrophobicContact CB-CB 4.48Å; A794-M805 CarbonylContact O-C 3.58Å; A794-M805 WeakPolarHBondContact O-CA 3.42Å; A794-Q806 PolarHBondContact N-O 3.28Å; A794-Q806 PolarHBondContact O-N 3.4Å
795	S	85.3	Confident	81.1	Confident	6 Å²	6	37.5 Å²	37.5	4%	0.042	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.8	153.7	174.6	78.3	0	0	0	0	112.1	A787 E788 Q803 K804	A787-S795 CarbonylContact C-O 3.53Å; A787-S795 VanDerWaalsContact CA-O 3.31Å; A787-S795 WeakPolarHBondContact CA-O 3.33Å; E788-S795 WeakPolarHBondContact CB-OG 3.44Å; E788-S795 PolarHBondContact N-O 2.82Å; E788-S795 PolarHBondContact O-N 2.75Å; S795-Q803 VanDerWaalsContact CB-NE2 3.31Å; S795-Q803 PolarHBondContact OG-NE2 2.05Å; S795-K804 CarbonylContact C-O 3.54Å; S795-K804 WeakPolarHBondContact CA-O 3.22Å; S795-K804 WeakPolarHBondContact CB-O 3.47Å
796	L	91.9	Very high	80.4	Confident	0 Å²	0	41 Å²	41	0%	0	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.7	125.9	177.1	179.8	66	0	0	0	109.3	V756 F758 V769 V771 V785 R786 A787 V798 Q803 K804	V756-L796 HydrophobicContact CG1-CD2 4.14Å; V756-L796 VanDerWaalsContact O-CD2 3.23Å; V756-L796 WeakPolarHBondContact O-CD2 3.16Å; F758-L796 HydrophobicContact CB-CB 4.21Å; F758-L796 HydrophobicContact CB-CD1 4.11Å; F758-L796 HydrophobicContact CB-CD2 4.02Å; F758-L796 HydrophobicContact CB-CG 4.34Å; V769-L796 HydrophobicContact CB-CB 4.14Å; V769-L796 HydrophobicContact CG1-CB 3.82Å; V769-L796 WeakPolarHBondContact O-CD2 3.23Å; V771-L796 HydrophobicContact CB-CD2 4.24Å; V771-L796 HydrophobicContact CG2-CB 4.1Å; V771-L796 HydrophobicContact CG2-CD2 3.87Å; V771-L796 HydrophobicContact CG2-CG 3.73Å; V771-L796 WeakPolarHBondContact CG2-O 3.18Å; V785-L796 HydrophobicContact CG1-CD1 3.71Å; R786-L796 CarbonylContact O-C 3.48Å; R786-L796 WeakPolarHBondContact O-CA 3.43Å; A787-L796 HydrophobicContact CB-CD1 3.89Å; L796-V798 HydrophobicContact CG-CG2 4.45Å; L796-Q803 CarbonylContact O-C 3.59Å; L796-K804 PolarHBondContact N-O 3.26Å; L796-K804 PolarHBondContact O-N 3.01Å
797	Q	87.3	Confident	79.6	Confident	50 Å²	50	40 Å²	40	23%	0.234	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	137.6	170.3	-173.7	173.1	31.1	0	0	109	R786 L801 Q803	R786-Q797 HydrophobicContact CB-CB 4.37Å; R786-Q797 PolarHBondContact N-O 3.38Å; R786-Q797 PolarHBondContact O-N 3.39Å; Q797-L801 WeakPolarHBondContact CG-O 3.35Å; Q797-L801 PolarHBondContact NE2-O 2.91Å; Q797-Q803 HydrophobicContact CB-CB 3.89Å; Q797-Q803 HydrophobicContact CB-CG 4.14Å; Q797-Q803 HydrophobicContact CG-CB 4.23Å
798	V	90.9	Very high	78.4	Confident	0 Å²	0	41.4 Å²	41.4	0%	0	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	126.1	170.5	-170.4	0	0	0	0	108.6	F727 V756 V771 F777 H783 H784 V785 L796 L801	F727-V798 HydrophobicContact CE1-CG1 4.43Å; V756-V798 HydrophobicContact CB-CG2 3.86Å; V756-V798 HydrophobicContact CG1-CG2 4.06Å; V756-V798 HydrophobicContact CG2-CG2 4.12Å; V771-V798 HydrophobicContact CB-CG2 3.95Å; V771-V798 HydrophobicContact CG1-CB 4.05Å; V771-V798 HydrophobicContact CG1-CG2 4Å; V771-V798 HydrophobicContact CG2-CG2 4.24Å; F777-V798 HydrophobicContact CD1-CG1 4.13Å; F777-V798 HydrophobicContact CE1-CB 4.16Å; F777-V798 HydrophobicContact CE1-CG1 3.45Å; F777-V798 VanDerWaalsContact CE1-CG1 3.45Å; F777-V798 HydrophobicContact CZ-CB 3.97Å; F777-V798 HydrophobicContact CZ-CG1 3.7Å; H783-V798 HydrophobicContact CB-CG1 4.36Å; H784-V798 CarbonylContact O-C 3.59Å; H784-V798 VanDerWaalsContact O-CA 3.24Å; H784-V798 WeakPolarHBondContact O-CA 3.43Å; V785-V798 HydrophobicContact CG2-CG1 4.3Å; V785-V798 HydrophobicContact CG2-CG2 4.28Å; L796-V798 HydrophobicContact CG-CG2 4.45Å; V798-L801 WeakPolarHBondContact O-CB 3.48Å; V798-L801 WeakPolarHBondContact O-CG 3.39Å; V798-L801 PolarHBondContact O-N 2.87Å
799	D	86.1	Confident	77.3	Confident	55 Å²	55	42.7 Å²	42.7	29%	0.294	23%	0.227	S	C	.	.	T	Hydrogen-bonded Turn	trans	53.3	-135.5	-174.3	-59.3	-37.9	0	0	0	113	H783 H784 L801	H783-D799 WeakPolarHBondContact CA-OD1 3.2Å; H783-D799 IonicContact CE1-OD2 3.43Å; H783-D799 IonicContact CG-OD2 3.15Å; H783-D799 IonicContact ND1-OD1 3.77Å; H783-D799 IonicContact ND1-OD2 3.76Å; H783-D799 PolarHBondContact ND1-OD2 2.76Å; H784-D799 PolarHBondContact N-OD1 2.86Å; H784-D799 PolarHBondContact O-N 3.4Å; D799-L801 VanDerWaalsContact C-N 3.3Å
800	Q	77.7	Confident	75.8	Confident	179 Å²	179	42.7 Å²	42.7	84%	0.836	23%	0.229	S	C	*	.	T	Hydrogen-bonded Turn	trans	-95.2	10.1	171.5	-57.7	-175.2	23.1	0	0	111.8
801	L	74.9	Confident	74.8	Confident	38 Å²	38	44.1 Å²	44.1	20%	0.199	24%	0.236	C	C	.	.	S	Bend	trans	-57.8	153.2	166.5	-56.3	172.3	0	0	0	106.9	V771 F777 Q797 V798 D799	V771-L801 HydrophobicContact CG1-CB 4.36Å; V771-L801 HydrophobicContact CG1-CD1 3.76Å; F777-L801 HydrophobicContact CE1-CD1 3.95Å; F777-L801 HydrophobicContact CZ-CD1 3.64Å; Q797-L801 WeakPolarHBondContact CG-O 3.35Å; Q797-L801 PolarHBondContact NE2-O 2.91Å; V798-L801 WeakPolarHBondContact O-CB 3.48Å; V798-L801 WeakPolarHBondContact O-CG 3.39Å; V798-L801 PolarHBondContact O-N 2.87Å; D799-L801 VanDerWaalsContact C-N 3.3Å
802	P	71.6	Confident	74	Confident	71 Å²	71	43.8 Å²	43.8	46%	0.461	24%	0.237	S	C	.	.			trans	-47.8	158.5	171.5	-30.2	40.8	0	0	0	110.4	W130	W130-P802 HydrophobicContact CD2-CB 3.58Å; W130-P802 HydrophobicContact CD2-CG 4.46Å; W130-P802 HydrophobicContact CE3-CB 3.02Å; W130-P802 HydrophobicContact CE3-CG 4.22Å; W130-P802 HydrophobicContact CH2-CB 3.36Å; W130-P802 WeakPolarHBondContact CH2-O 3Å; W130-P802 HydrophobicContact CZ2-CB 3.74Å; W130-P802 WeakPolarHBondContact CZ2-O 3.45Å; W130-P802 HydrophobicContact CZ3-CB 2.92Å; W130-P802 HydrophobicContact CZ3-CG 4.36Å; W130-P802 WeakPolarHBondContact CZ3-O 3.28Å
803	Q	75.2	Confident	73.9	Confident	61 Å²	61	44.6 Å²	44.6	29%	0.285	24%	0.242	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-88	113.4	165.3	179.2	-171.3	15.8	0	0	119	W130 S795 L796 Q797 M805	W130-Q803 WeakPolarHBondContact CH2-O 3.22Å; W130-Q803 HydrophobicContact CZ3-CB 4.46Å; W130-Q803 WeakPolarHBondContact CZ3-O 3.47Å; S795-Q803 VanDerWaalsContact CB-NE2 3.31Å; S795-Q803 PolarHBondContact OG-NE2 2.05Å; L796-Q803 CarbonylContact O-C 3.59Å; Q797-Q803 HydrophobicContact CB-CB 3.89Å; Q797-Q803 HydrophobicContact CB-CG 4.14Å; Q797-Q803 HydrophobicContact CG-CB 4.23Å; Q803-M805 HydrophobicContact CG-CG 4.49Å
804	K	77.9	Confident	73.4	Confident	34 Å²	34	45.4 Å²	45.4	15%	0.148	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.2	142.2	-175.5	-74.5	-73.9	-171.3	173.3	0	106.3	I129 W130 V769 T770 V771 S795 L796	I129-K804 HydrophobicContact CD1-CD 4.4Å; W130-K804 VanDerWaalsContact CD1-NZ 3.34Å; W130-K804 HydrophobicContact CD2-CD 4.14Å; W130-K804 VanDerWaalsContact CH2-CA 3.45Å; W130-K804 HydrophobicContact CH2-CB 3.99Å; W130-K804 HydrophobicContact CH2-CD 3.85Å; W130-K804 HydrophobicContact CH2-CG 3.53Å; W130-K804 HydrophobicContact CZ2-CB 4.18Å; W130-K804 HydrophobicContact CZ2-CD 3.25Å; W130-K804 HydrophobicContact CZ2-CG 3.23Å; W130-K804 VanDerWaalsContact CZ3-N 3.31Å; V769-K804 HydrophobicContact CG1-CB 3.4Å; V769-K804 HydrophobicContact CG1-CG 4.45Å; T770-K804 WeakPolarHBondContact O-CE 3.4Å; T770-K804 WeakPolarHBondContact O-CG 3.35Å; V771-K804 HydrophobicContact CB-CG 4.48Å; V771-K804 HydrophobicContact CG2-CB 4.17Å; V771-K804 HydrophobicContact CG2-CG 3.59Å; S795-K804 CarbonylContact C-O 3.54Å; S795-K804 WeakPolarHBondContact CA-O 3.22Å; S795-K804 WeakPolarHBondContact CB-O 3.47Å; L796-K804 PolarHBondContact N-O 3.26Å; L796-K804 PolarHBondContact O-N 3.01Å
805	M	72.6	Confident	72.9	Confident	35 Å²	35	53.1 Å²	53.1	17%	0.172	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.4	123.3	173	-48	-174.8	-75.7	0	0	112.2	I129 L375 A794 Q803	I129-M805 WeakPolarHBondContact CD1-O 3.44Å; I129-M805 WeakPolarHBondContact CG1-O 3.26Å; I129-M805 HydrophobicContact CG2-CB 3.81Å; I129-M805 HydrophobicContact CG2-CE 3.91Å; I129-M805 HydrophobicContact CG2-CG 4.09Å; L375-M805 HydrophobicContact CD1-SD 4.49Å; A794-M805 CarbonylContact O-C 3.58Å; A794-M805 WeakPolarHBondContact O-CA 3.42Å; Q803-M805 HydrophobicContact CG-CG 4.49Å
806	Q	79.3	Confident	72.6	Confident	74 Å²	74	52.9 Å²	52.9	35%	0.346	27%	0.272	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.2	122.3	170.4	-175.3	57.8	34	0	0	109.4	C767 V769 G793 A794	C767-Q806 WeakPolarHBondContact SG-CG 3.46Å; V769-Q806 HydrophobicContact CG2-CB 3.5Å; G793-Q806 CarbonylContact C-O 3.56Å; G793-Q806 WeakPolarHBondContact CA-O 3.24Å; A794-Q806 PolarHBondContact N-O 3.28Å; A794-Q806 PolarHBondContact O-N 3.4Å
807	P	68.7	Low	72	Confident	58 Å²	58	59.3 Å²	59.3	38%	0.377	30%	0.302	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-58.9	149	174.9	-19.2	30.3	0	0	0	111.7
808	A	66.8	Low	71.7	Confident	29 Å²	29	58.1 Å²	58.1	24%	0.24	30%	0.297	C	S	.	.	P	Polyproline II helix	trans	-66.5	139.8	172.9	0	0	0	0	0	109.5	V791 K792	V791-A808 WeakPolarHBondContact O-CB 3.09Å; K792-A808 PolarHBondContact O-N 2.83Å
809	P	63.3	Low	71.1	Confident	45 Å²	45	63 Å²	63	29%	0.292	32%	0.323	S	S	.	.	P	Polyproline II helix	trans	-54.7	140.2	172	-24.2	33.5	0	0	0	111.2	D811	P809-D811 PolarHBondContact O-N 2.9Å
810	A	54.5	Low	70.9	Confident	10 Å²	10	61.9 Å²	61.9	8%	0.083	32%	0.32	C	S	.	.	T	Hydrogen-bonded Turn	trans	-71.1	-11.8	-175.5	0	0	0	0	0	114.6	G264 H291 G812	G264-A810 PolarHBondContact N-O 2.89Å; H291-A810 HydrophobicContact CB-CB 3.41Å; H291-A810 VanDerWaalsContact CB-CB 3.41Å; H291-A810 WeakPolarHBondContact ND1-CB 3.37Å; A810-G812 PolarHBondContact O-N 3.12Å
811	D	54.1	Low	71.2	Confident	62 Å²	62	58 Å²	58	33%	0.332	30%	0.302	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.2	7.2	-174.8	-41.6	-47.4	0	0	0	113.6	N764 P809 H813	N764-D811 WeakPolarHBondContact ND2-CB 3.27Å; P809-D811 PolarHBondContact O-N 2.9Å; D811-H813 VanDerWaalsContact C-N 3.25Å; D811-H813 PolarHBondContact O-CD2 3.42Å; D811-H813 PolarHBondContact O-N 2.86Å; D811-H813 VanDerWaalsContact O-N 3.1Å
812	G	51.6	Low	71.9	Confident	15 Å²	15	56.3 Å²	56.3	16%	0.155	29%	0.293	C	S	.	.			trans	76.4	-0.4	164.8	0	0	0	0	0	116.4	A810 V814	A810-G812 PolarHBondContact O-N 3.12Å; G812-V814 PolarHBondContact O-N 2.88Å
813	H	59.9	Low	72.9	Confident	103 Å²	103	53.7 Å²	53.7	48%	0.477	27%	0.274	S	S	.	.			trans	-70.8	104.1	167.9	-71.2	-101.4	0	0	0	109.7	V762 N764 D811	V762-H813 HydrophobicContact CG2-CB 4.24Å; V762-H813 WeakPolarHBondContact CG2-O 3.49Å; N764-H813 PolarHBondContact OD1-CD2 3.14Å; N764-H813 VanDerWaalsContact OD1-CG 3.32Å; D811-H813 VanDerWaalsContact C-N 3.25Å; D811-H813 PolarHBondContact O-CD2 3.42Å; D811-H813 PolarHBondContact O-N 2.86Å; D811-H813 VanDerWaalsContact O-N 3.1Å
814	V	67.6	Low	73.9	Confident	26 Å²	26	50.8 Å²	50.8	16%	0.158	26%	0.261	C	S	.	.			trans	-116.4	-9.1	-174.4	-66	0	0	0	0	113.2	L719 R789 V791 G812	L719-V814 HydrophobicContact CD2-CB 4.22Å; L719-V814 HydrophobicContact CD2-CG2 3.73Å; R789-V814 PolarHBondContact NH2-O 2.78Å; V791-V814 HydrophobicContact CB-CG1 4.33Å; V791-V814 HydrophobicContact CG1-CB 4.21Å; V791-V814 HydrophobicContact CG1-CG1 4.34Å; G812-V814 PolarHBondContact O-N 2.88Å
815	R	73.9	Confident	74.6	Confident	164 Å²	164	49.2 Å²	49.2	62%	0.619	25%	0.254	S	S	*	.			trans	-98	120.5	-175.2	-69.2	-176.8	179	-179.5	-0.8	110	E718 L719	E718-R815 CarbonylContact O-C 3.53Å; E718-R815 VanDerWaalsContact O-CA 3.32Å; E718-R815 WeakPolarHBondContact O-CA 3.09Å; L719-R815 HydrophobicContact CD2-CG 3.8Å
816	L	79.6	Confident	75.3	Confident	2 Å²	2	47.6 Å²	47.6	1%	0.01	25%	0.246	C	C	.	.			trans	-90.7	111.5	171.9	-177.6	70.9	0	0	0	108.9	E718 D744 I746 D761 V762 L818	E718-L816 WeakPolarHBondContact CA-O 3.25Å; E718-L816 PolarHBondContact O-N 2.9Å; D744-L816 HydrophobicContact CB-CD1 4.14Å; I746-L816 HydrophobicContact CB-CD2 4.05Å; I746-L816 HydrophobicContact CD1-CD2 4Å; I746-L816 HydrophobicContact CG2-CD2 4.35Å; D761-L816 WeakPolarHBondContact O-CD1 3.16Å; V762-L816 HydrophobicContact CG1-CB 4.12Å; V762-L816 HydrophobicContact CG1-CD1 3.88Å; L816-L818 HydrophobicContact CD1-CD2 4.11Å; L816-L818 HydrophobicContact CD2-CD1 3.88Å; L816-L818 HydrophobicContact CD2-CD2 4.37Å; L816-L818 HydrophobicContact CD2-CG 4.2Å; L816-L818 HydrophobicContact CG-CD1 4.18Å; L816-L818 HydrophobicContact CG-CD2 3.99Å; L816-L818 HydrophobicContact CG-CG 3.93Å
817	Q	77.8	Confident	75.7	Confident	134 Å²	134	44.2 Å²	44.2	63%	0.626	23%	0.23	S	C	*	.			trans	-103.9	94.7	-176.5	-63.1	-170.3	-49	0	0	111.2	G741 D744	G741-Q817 VanDerWaalsContact CA-O 3.32Å; G741-Q817 WeakPolarHBondContact CA-O 3.42Å; D744-Q817 PolarHBondContact OD2-N 2.81Å
818	L	81.3	Confident	76.2	Confident	26 Å²	26	43.6 Å²	43.6	14%	0.136	23%	0.231	C	C	.	.	B	Isolated β-bridge	trans	-97.7	135.1	179.7	-53.9	173	0	0	0	109.9	F715 N739 I746 L816	F715-L818 HydrophobicContact CB-CD1 4.17Å; F715-L818 HydrophobicContact CD1-CD1 3.95Å; N739-L818 HydrophobicContact CB-CD1 4.09Å; N739-L818 WeakPolarHBondContact O-CD2 3.35Å; I746-L818 HydrophobicContact CG2-CD1 3.61Å; I746-L818 HydrophobicContact CG2-CD2 4.17Å; L816-L818 HydrophobicContact CD1-CD2 4.11Å; L816-L818 HydrophobicContact CD2-CD1 3.88Å; L816-L818 HydrophobicContact CD2-CD2 4.37Å; L816-L818 HydrophobicContact CD2-CG 4.2Å; L816-L818 HydrophobicContact CG-CD1 4.18Å; L816-L818 HydrophobicContact CG-CD2 3.99Å; L816-L818 HydrophobicContact CG-CG 3.93Å
819	N	78.3	Confident	76.8	Confident	102 Å²	102	46.7 Å²	46.7	55%	0.545	25%	0.246	S	C	.	.			trans	-128.4	-17.8	-177.7	65.8	-2	0	0	0	113.8	L740 G741 I742	L740-N819 PolarHBondContact O-N 3.45Å; L740-N819 VanDerWaalsContact O-N 3.16Å; L740-N819 PolarHBondContact O-OD1 2.99Å; L740-N819 VanDerWaalsContact O-OD1 3.13Å; G741-N819 VanDerWaalsContact CA-OD1 3.3Å; G741-N819 WeakPolarHBondContact CA-OD1 3.26Å; I742-N819 WeakPolarHBondContact CG1-ND2 3.27Å
820	S	81.9	Confident	77.6	Confident	31 Å²	31	51 Å²	51	22%	0.217	26%	0.257	C	S	.	.	S	Bend	trans	-81.8	170.5	175.8	65.8	0	0	0	0	111.9	A714 N739 L740	A714-S820 WeakPolarHBondContact CA-O 3.45Å; A714-S820 VanDerWaalsContact CB-O 3.22Å; A714-S820 WeakPolarHBondContact CB-O 3.46Å; N739-S820 PolarHBondContact ND2-O 2.82Å; N739-S820 PolarHBondContact ND2-OG 2.79Å; L740-S820 VanDerWaalsContact CA-OG 3.3Å; L740-S820 WeakPolarHBondContact CA-OG 3.2Å; L740-S820 WeakPolarHBondContact CB-OG 3.28Å; L740-S820 PolarHBondContact N-OG 2.69Å; L740-S820 WeakPolarHBondContact O-CB 3.18Å; L740-S820 PolarHBondContact O-N 2.95Å; L740-S820 PolarHBondContact O-OG 3.46Å
821	Q	84.9	Confident	78.6	Confident	98 Å²	98	58.4 Å²	58.4	46%	0.458	29%	0.29	S	S	.	.	P	Polyproline II helix	trans	-64.2	152.6	167	-68.5	178.5	-21.3	0	0	110.6	H711 F712 N739 F823	H711-Q821 PolarHBondContact CD2-OE1 3.29Å; H711-Q821 VanDerWaalsContact CD2-OE1 3.3Å; F712-Q821 WeakPolarHBondContact O-CB 3.31Å; N739-Q821 PolarHBondContact ND2-O 2.98Å; N739-Q821 VanDerWaalsContact ND2-O 3.12Å; Q821-F823 HydrophobicContact CB-CE2 4.21Å; Q821-F823 HydrophobicContact CB-CZ 4.35Å; Q821-F823 WeakPolarHBondContact O-CD2 3.28Å; Q821-F823 VanDerWaalsContact O-CE2 3.23Å; Q821-F823 WeakPolarHBondContact O-CE2 3.49Å
822	L	89.5	Confident	79.7	Confident	2 Å²	2	60.9 Å²	60.9	1%	0.01	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.7	124.9	172.2	171	67.5	0	0	0	109.4	H711 F712 P713 M737 N739 I824 L843 L848	H711-L822 CarbonylContact C-O 3.05Å; H711-L822 WeakPolarHBondContact CA-O 3.49Å; F712-L822 HydrophobicContact CB-CB 4.27Å; F712-L822 HydrophobicContact CB-CD2 4.27Å; F712-L822 PolarHBondContact N-O 3.34Å; F712-L822 PolarHBondContact O-N 3.41Å; P713-L822 WeakPolarHBondContact O-CB 3.48Å; M737-L822 HydrophobicContact CE-CD1 3.4Å; M737-L822 HydrophobicContact CE-CD2 4.36Å; M737-L822 HydrophobicContact CG-CD1 3.7Å; M737-L822 HydrophobicContact SD-CD1 4.33Å; N739-L822 HydrophobicContact CB-CD1 3.85Å; L822-I824 HydrophobicContact CD1-CD1 4.2Å; L822-I824 HydrophobicContact CD2-CD1 4.18Å; L822-I824 HydrophobicContact CG-CD1 4.08Å; L822-I824 HydrophobicContact CG-CG1 4.47Å; L822-L843 HydrophobicContact CD2-CD1 3.32Å; L822-L848 HydrophobicContact CD2-CD1 3.88Å
823	F	93	Very high	81.3	Confident	16 Å²	16	60.6 Å²	60.6	7%	0.07	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104	133.4	177.3	-62.7	-93.4	0	0	0	110.7	Y709 L710 H711 M737 E738 Q821 G826 A828	Y709-F823 AromaticContact CD2-CD1 3.46Å; Y709-F823 HydrophobicContact CD2-CD1 3.46Å; Y709-F823 VanDerWaalsContact CD2-CD1 3.46Å; Y709-F823 AromaticContact CD2-CE1 3.92Å; Y709-F823 HydrophobicContact CD2-CE1 3.92Å; Y709-F823 AromaticContact CE2-CD1 3.66Å; Y709-F823 HydrophobicContact CE2-CD1 3.66Å; Y709-F823 AromaticContact CE2-CE1 3.58Å; Y709-F823 HydrophobicContact CE2-CE1 3.58Å; Y709-F823 HydrophobicContact CG-CD1 4.11Å; L710-F823 CarbonylContact O-C 3.49Å; L710-F823 WeakPolarHBondContact O-CA 3.32Å; H711-F823 HydrophobicContact CB-CD1 4.43Å; M737-F823 CarbonylContact C-O 3.47Å; M737-F823 WeakPolarHBondContact CA-O 3.37Å; E738-F823 PolarHBondContact N-O 3.4Å; E738-F823 PolarHBondContact O-N 2.99Å; Q821-F823 HydrophobicContact CB-CE2 4.21Å; Q821-F823 HydrophobicContact CB-CZ 4.35Å; Q821-F823 WeakPolarHBondContact O-CD2 3.28Å; Q821-F823 VanDerWaalsContact O-CE2 3.23Å; Q821-F823 WeakPolarHBondContact O-CE2 3.49Å; F823-G826 WeakPolarHBondContact CB-O 3.31Å; F823-A828 HydrophobicContact CD2-CB 4.29Å; F823-A828 HydrophobicContact CE1-CB 4.2Å; F823-A828 HydrophobicContact CE2-CB 3.7Å; F823-A828 HydrophobicContact CZ-CB 3.66Å
824	I	95.6	Very high	82.9	Confident	1 Å²	1	55.7 Å²	55.7	1%	0.005	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	131.7	178.1	-56.3	-58.5	0	0	0	109.2	F703 Y709 L710 F712 F736 M737 L822 G826 I838 L841 L850	F703-I824 VanDerWaalsContact CE1-O 3.3Å; F703-I824 WeakPolarHBondContact CE1-O 3.44Å; F703-I824 HydrophobicContact CZ-CG2 4.14Å; Y709-I824 CarbonylContact C-O 3.58Å; Y709-I824 WeakPolarHBondContact CA-O 3.27Å; L710-I824 HydrophobicContact CB-CB 4.28Å; L710-I824 PolarHBondContact N-O 3.3Å; L710-I824 PolarHBondContact O-N 3.49Å; F712-I824 HydrophobicContact CD2-CG1 3.94Å; F712-I824 HydrophobicContact CE2-CG1 3.96Å; F736-I824 CarbonylContact O-C 3.49Å; F736-I824 WeakPolarHBondContact O-CA 3.25Å; M737-I824 HydrophobicContact CB-CD1 4.05Å; M737-I824 HydrophobicContact CG-CD1 3.8Å; L822-I824 HydrophobicContact CD1-CD1 4.2Å; L822-I824 HydrophobicContact CD2-CD1 4.18Å; L822-I824 HydrophobicContact CG-CD1 4.08Å; L822-I824 HydrophobicContact CG-CG1 4.47Å; I824-G826 PolarHBondContact O-N 3.43Å; I824-I838 HydrophobicContact CG2-CD1 3.78Å; I824-L841 HydrophobicContact CD1-CD2 3.44Å; I824-L841 VanDerWaalsContact CD1-CD2 3.44Å; I824-L841 HydrophobicContact CG1-CD2 3.74Å; I824-L841 HydrophobicContact CG2-CD2 3.99Å; I824-L850 HydrophobicContact CG2-CD2 4.43Å
825	G	91.9	Very high	84.2	Confident	0 Å²	0	56.3 Å²	56.3	0%	0	27%	0.271	C	S	.	.	S	Bend	trans	72.9	9.2	-176.5	0	0	0	0	0	114.4	V735 F736 F834	V735-G825 CarbonylContact O-C 3.52Å; V735-G825 VanDerWaalsContact O-C 3.24Å; V735-G825 WeakPolarHBondContact O-CA 3.43Å; F736-G825 PolarHBondContact O-N 3.44Å; G825-F834 PolarHBondContact O-N 3Å
826	G	88.4	Confident	85.1	Confident	1 Å²	1	49.5 Å²	49.5	1%	0.01	25%	0.251	C	S	.	.	S	Bend	trans	-178.4	-167.1	173.2	0	0	0	0	0	113.8	V735 F823 I824	V735-G826 PolarHBondContact O-N 3.04Å; F823-G826 WeakPolarHBondContact CB-O 3.31Å; I824-G826 PolarHBondContact O-N 3.43Å
827	T	87.1	Confident	85.8	Confident	3 Å²	3	49.8 Å²	49.8	2%	0.018	25%	0.253	C	S	.	.			trans	-120	160.8	-174.4	64.3	0	0	0	0	111.2	V735 E738 T829 R830 R832	V735-T827 HydrophobicContact CB-CG2 3.99Å; V735-T827 HydrophobicContact CG1-CG2 4.07Å; V735-T827 HydrophobicContact CG2-CG2 3.8Å; E738-T827 WeakPolarHBondContact OE1-CA 3.43Å; E738-T827 WeakPolarHBondContact OE1-CB 2.82Å; T827-T829 PolarHBondContact O-N 3.08Å; T827-T829 VanDerWaalsContact O-N 3.14Å; T827-T829 PolarHBondContact OG1-OG1 3.06Å; T827-R830 PolarHBondContact O-N 3.43Å; T827-R830 VanDerWaalsContact O-N 3.08Å; T827-R830 PolarHBondContact OG1-N 3.34Å; T827-R832 HydrophobicContact CG2-CB 4.12Å
828	A	78.9	Confident	86.6	Confident	46 Å²	46	43.4 Å²	43.4	38%	0.38	22%	0.224	S	C	.	.	T	Hydrogen-bonded Turn	trans	-56.5	-30.4	173.6	0	0	0	0	0	112.6	E738 F823	E738-A828 PolarHBondContact OE1-N 2.88Å; F823-A828 HydrophobicContact CD2-CB 4.29Å; F823-A828 HydrophobicContact CE1-CB 4.2Å; F823-A828 HydrophobicContact CE2-CB 3.7Å; F823-A828 HydrophobicContact CZ-CB 3.66Å
829	T	80.8	Confident	87.1	Confident	93 Å²	93	42.2 Å²	42.2	57%	0.571	22%	0.218	S	C	*	.	T	Hydrogen-bonded Turn	trans	-82.6	-11.6	-178.8	59.1	0	0	0	0	114.5	T827 Q831	T827-T829 PolarHBondContact O-N 3.08Å; T827-T829 VanDerWaalsContact O-N 3.14Å; T827-T829 PolarHBondContact OG1-OG1 3.06Å; T829-Q831 PolarHBondContact O-N 3.21Å
830	R	78.9	Confident	87.5	Confident	137 Å²	137	38 Å²	38	52%	0.517	20%	0.196	S	C	.	.	S	Bend	trans	57.9	20.2	-176.8	-52.1	-178.3	-179.9	-162.2	-10.3	115.5	T707 Y709 T827	T707-R830 HydrophobicContact CG2-CB 4.48Å; Y709-R830 HydrophobicContact CD1-CG 4.38Å; Y709-R830 HydrophobicContact CE1-CG 3.89Å; Y709-R830 PolarHBondContact OH-NH2 2.82Å; T827-R830 PolarHBondContact O-N 3.43Å; T827-R830 VanDerWaalsContact O-N 3.08Å; T827-R830 PolarHBondContact OG1-N 3.34Å
831	Q	75.1	Confident	87.9	Confident	164 Å²	164	36.6 Å²	36.6	77%	0.766	19%	0.186	S	C	*	.	S	Bend	trans	-101.3	-10.5	-177.8	-72.4	-178.2	-12.3	0	0	113.8	T829	T829-Q831 PolarHBondContact O-N 3.21Å
832	R	78.7	Confident	87.9	Confident	115 Å²	115	32.6 Å²	32.6	43%	0.434	17%	0.167	S	C	.	.	S	Bend	trans	-140.1	46.4	-173.9	-61.6	-175.3	67.4	-155.3	-8.9	112	V735 E749 T827	V735-R832 WeakPolarHBondContact CB-O 3.49Å; V735-R832 HydrophobicContact CG2-CB 4.06Å; V735-R832 WeakPolarHBondContact CG2-O 3.47Å; V735-R832 PolarHBondContact N-O 2.75Å; E749-R832 IonicContact OE1-NH2 3.78Å; E749-R832 IonicContact OE2-CZ 3.3Å; E749-R832 IonicContact OE2-NH1 3.72Å; E749-R832 IonicContact OE2-NH2 3.68Å; E749-R832 PolarHBondContact OE2-NH2 3.48Å; T827-R832 HydrophobicContact CG2-CB 4.12Å
833	G	83.8	Confident	87.4	Confident	9 Å²	9	33 Å²	33	9%	0.093	17%	0.169	C	C	.	.			trans	-69.6	161.5	179.5	0	0	0	0	0	113.8	E706	E706-G833 WeakPolarHBondContact O-CA 3.49Å; E706-G833 PolarHBondContact O-N 3.31Å; E706-G833 VanDerWaalsContact O-N 3.15Å
834	F	94.1	Very high	86.4	Confident	0 Å²	0	35.3 Å²	35.3	0%	0	18%	0.183	C	C	.	.			trans	-97.7	134.1	174.7	170.9	-106.4	0	0	0	109.5	F703 F727 T729 V735 F736 G825 I838	F703-F834 WeakPolarHBondContact CB-O 3.14Å; F703-F834 HydrophobicContact CD2-CD1 4.07Å; F703-F834 HydrophobicContact CD2-CE1 4.43Å; F703-F834 HydrophobicContact CG-CD1 4.46Å; F727-F834 HydrophobicContact CB-CZ 4.27Å; F727-F834 HydrophobicContact CD2-CZ 4.5Å; T729-F834 HydrophobicContact CG2-CE2 3.99Å; T729-F834 HydrophobicContact CG2-CZ 4.49Å; V735-F834 VanDerWaalsContact O-CB 3.32Å; V735-F834 WeakPolarHBondContact O-CB 3.47Å; F736-F834 HydrophobicContact CD1-CD1 4.33Å; F736-F834 AromaticContact CD1-CD2 3.81Å; F736-F834 HydrophobicContact CD1-CD2 3.81Å; F736-F834 HydrophobicContact CD1-CE1 4.35Å; F736-F834 AromaticContact CD1-CE2 3.86Å; F736-F834 HydrophobicContact CD1-CE2 3.86Å; F736-F834 HydrophobicContact CD1-CG 4.06Å; F736-F834 HydrophobicContact CD1-CZ 4.11Å; F736-F834 AromaticContact CE1-CD2 3.61Å; F736-F834 HydrophobicContact CE1-CD2 3.61Å; F736-F834 HydrophobicContact CE1-CE1 4.37Å; F736-F834 AromaticContact CE1-CE2 3.28Å; F736-F834 HydrophobicContact CE1-CE2 3.28Å; F736-F834 HydrophobicContact CE1-CG 4.3Å; F736-F834 AromaticContact CE1-CZ 3.69Å; F736-F834 HydrophobicContact CE1-CZ 3.69Å; F736-F834 HydrophobicContact CZ-CE2 4.25Å; G825-F834 PolarHBondContact O-N 3Å; F834-I838 HydrophobicContact CD1-CD1 4.03Å; F834-I838 HydrophobicContact CD1-CG1 4.03Å; F834-I838 HydrophobicContact CE1-CD1 4.24Å; F834-I838 HydrophobicContact CE1-CG1 3.73Å
835	L	94	Very high	85.1	Confident	39 Å²	39	37.4 Å²	37.4	20%	0.204	20%	0.204	C	C	.	.			trans	-107.3	127.3	171.1	-73.5	174.7	0	0	0	109.1	N704 T705 E706 T729 V731	N704-L835 WeakPolarHBondContact O-CD2 3.48Å; T705-L835 VanDerWaalsContact CA-CD2 3.48Å; E706-L835 HydrophobicContact CG-CD1 3.49Å; E706-L835 VanDerWaalsContact CG-CD1 3.49Å; E706-L835 HydrophobicContact CG-CD2 4.29Å; E706-L835 HydrophobicContact CG-CG 3.75Å; T729-L835 WeakPolarHBondContact CB-O 3.26Å; T729-L835 PolarHBondContact OG1-O 2.7Å; V731-L835 HydrophobicContact CG1-CB 3.74Å; V731-L835 HydrophobicContact CG1-CD1 3.85Å; V731-L835 HydrophobicContact CG1-CG 4.4Å; V731-L835 HydrophobicContact CG2-CB 4.01Å
836	G	93.8	Very high	84.1	Confident	20 Å²	20	41.9 Å²	41.9	21%	0.206	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	133.5	-152.2	-176.4	0	0	0	0	0	111.8	S702 F703 K728	S702-G836 CarbonylContact C-O 3.56Å; S702-G836 WeakPolarHBondContact CA-O 3.39Å; F703-G836 PolarHBondContact N-O 2.98Å; F703-G836 PolarHBondContact O-N 2.67Å; F703-G836 VanDerWaalsContact O-N 3.1Å; K728-G836 CarbonylContact O-C 3.33Å; K728-G836 WeakPolarHBondContact O-CA 3.16Å
837	C	93.6	Very high	83.7	Confident	8 Å²	8	43.8 Å²	43.8	5%	0.054	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	143.1	-174.2	-53.9	0	0	0	0	112.4	A701 S702 F727 K728 W782 C864	A701-C837 VanDerWaalsContact O-CA 3.29Å; A701-C837 WeakPolarHBondContact O-CA 3.44Å; S702-C837 PolarHBondContact OG-SG 2.79Å; S702-C837 VanDerWaalsContact OG-SG 3.37Å; F727-C837 CarbonylContact C-O 3.5Å; F727-C837 WeakPolarHBondContact CA-O 3Å; K728-C837 HydrophobicContact CB-CB 4.33Å; K728-C837 PolarHBondContact N-O 2.82Å; K728-C837 PolarHBondContact O-N 3.41Å; W782-C837 HydrophobicContact CH2-CB 3.53Å; W782-C837 HydrophobicContact CZ2-CB 4.26Å; W782-C837 HydrophobicContact CZ3-CB 4.03Å; C837-C864 HydrophobicContact CB-CB 3.42Å; C837-C864 VanDerWaalsContact CB-CB 3.42Å; C837-C864 WeakPolarHBondContact CB-SG 3.48Å; C837-C864 WeakPolarHBondContact SG-CB 3.17Å; C837-C864 CovalentContact SG-SG 2.01Å; C837-C864 PolarHBondContact SG-SG 2.85Å
838	I	95	Very high	83.6	Confident	1 Å²	1	45 Å²	45	1%	0.005	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121	136.2	168.4	-59.6	176.6	0	0	0	108	S700 A701 F703 F725 F726 F736 I824 F834 L841 L850	S700-I838 CarbonylContact C-O 3.59Å; S700-I838 WeakPolarHBondContact CA-O 3.27Å; S700-I838 WeakPolarHBondContact CB-O 3.43Å; A701-I838 PolarHBondContact N-O 3.45Å; A701-I838 PolarHBondContact O-N 2.97Å; F703-I838 HydrophobicContact CD2-CG1 4.44Å; F703-I838 HydrophobicContact CE2-CB 4.08Å; F703-I838 HydrophobicContact CE2-CD1 3.83Å; F703-I838 HydrophobicContact CE2-CG1 3.91Å; F703-I838 HydrophobicContact CZ-CD1 4.31Å; F725-I838 HydrophobicContact CB-CG2 4.25Å; F725-I838 HydrophobicContact CD2-CG2 4.04Å; F725-I838 HydrophobicContact CG-CG2 4.39Å; F726-I838 CarbonylContact O-C 3.4Å; F726-I838 WeakPolarHBondContact O-CA 3.16Å; F736-I838 HydrophobicContact CB-CD1 4.36Å; F736-I838 HydrophobicContact CD1-CD1 4.33Å; I824-I838 HydrophobicContact CG2-CD1 3.78Å; F834-I838 HydrophobicContact CD1-CD1 4.03Å; F834-I838 HydrophobicContact CD1-CG1 4.03Å; F834-I838 HydrophobicContact CE1-CD1 4.24Å; F834-I838 HydrophobicContact CE1-CG1 3.73Å; I838-L841 HydrophobicContact CG2-CB 4.45Å; I838-L850 HydrophobicContact CB-CD1 4.47Å; I838-L850 HydrophobicContact CG2-CD1 4.08Å
839	R	91.2	Very high	83.9	Confident	1 Å²	1	44.8 Å²	44.8	0%	0.004	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.8	148.6	-177.9	-179.3	176.1	70.3	124.5	-1	112.2	F697 W698 N699 F726 W782 L841 Y871	F697-R839 PolarHBondContact O-NH1 3.16Å; W698-R839 VanDerWaalsContact CE3-NH1 3.29Å; N699-R839 CarbonylContact O-C 3.56Å; N699-R839 VanDerWaalsContact O-CA 3.26Å; N699-R839 WeakPolarHBondContact O-CA 3.04Å; N699-R839 WeakPolarHBondContact O-CG 3.46Å; F726-R839 HydrophobicContact CB-CB 4.25Å; F726-R839 PolarHBondContact N-O 3.3Å; F726-R839 PolarHBondContact O-N 3.2Å; W782-R839 HydrophobicContact CE3-CB 4.38Å; W782-R839 HydrophobicContact CH2-CB 3.59Å; W782-R839 HydrophobicContact CZ2-CB 4.5Å; W782-R839 HydrophobicContact CZ3-CB 3.53Å; R839-L841 VanDerWaalsContact C-N 3.28Å; R839-L841 PolarHBondContact O-N 2.88Å; R839-Y871 PolarHBondContact NH1-OH 3.02Å; R839-Y871 PolarHBondContact NH2-OH 3.4Å
840	S	87.8	Confident	84.4	Confident	12 Å²	12	40.3 Å²	40.3	8%	0.084	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	52	44.4	172.6	-177.6	0	0	0	0	112.5	N699 Q842	N699-S840 PolarHBondContact O-N 2.84Å; S840-Q842 PolarHBondContact O-N 3.29Å
841	L	89.6	Confident	84.9	Confident	2 Å²	2	34.6 Å²	34.6	1%	0.01	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.9	116.9	178.4	178.1	65.4	0	0	0	110.6	V723 C724 F725 I824 I838 R839 L843 L848 L850	V723-L841 HydrophobicContact CG1-CD1 4.19Å; C724-L841 WeakPolarHBondContact O-CA 3.32Å; F725-L841 HydrophobicContact CB-CB 4.16Å; F725-L841 HydrophobicContact CB-CD1 3.74Å; F725-L841 HydrophobicContact CD1-CD1 3.79Å; F725-L841 HydrophobicContact CG-CD1 4.03Å; I824-L841 HydrophobicContact CD1-CD2 3.44Å; I824-L841 VanDerWaalsContact CD1-CD2 3.44Å; I824-L841 HydrophobicContact CG1-CD2 3.74Å; I824-L841 HydrophobicContact CG2-CD2 3.99Å; I838-L841 HydrophobicContact CG2-CB 4.45Å; R839-L841 VanDerWaalsContact C-N 3.28Å; R839-L841 PolarHBondContact O-N 2.88Å; L841-L843 HydrophobicContact CD1-CD2 4.34Å; L841-L848 HydrophobicContact CD2-CD1 3.89Å; L841-L848 HydrophobicContact CG-CD1 4.43Å; L841-L848 PolarHBondContact O-N 2.88Å; L841-L850 HydrophobicContact CB-CD1 4.03Å; L841-L850 HydrophobicContact CB-CD2 4.37Å; L841-L850 HydrophobicContact CB-CG 4.47Å; L841-L850 HydrophobicContact CD2-CD2 4.1Å
842	Q	84.8	Confident	85.5	Confident	14 Å²	14	32.7 Å²	32.7	7%	0.065	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	137.9	175.1	-56.9	-178.3	-9.7	0	0	110.3	V723 C724 S840 V846 A847	V723-Q842 WeakPolarHBondContact CA-O 3.45Å; C724-Q842 PolarHBondContact N-O 3.25Å; C724-Q842 PolarHBondContact O-N 2.88Å; S840-Q842 PolarHBondContact O-N 3.29Å; Q842-V846 CarbonylContact C-O 3.57Å; Q842-V846 VanDerWaalsContact CA-O 3.31Å; Q842-V846 WeakPolarHBondContact CA-O 3.47Å; Q842-A847 HydrophobicContact CG-CB 4.27Å
843	L	80.3	Confident	85.9	Confident	11 Å²	11	31.1 Å²	31.1	6%	0.058	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	118	175.8	-59.8	179.7	0	0	0	109.2	F715 D722 V723 M737 L822 L841 G845 V846 L848	F715-L843 HydrophobicContact CD2-CB 4.09Å; F715-L843 HydrophobicContact CD2-CD1 4.01Å; F715-L843 HydrophobicContact CE2-CB 3.81Å; F715-L843 HydrophobicContact CE2-CD1 4.49Å; D722-L843 CarbonylContact O-C 3.58Å; D722-L843 WeakPolarHBondContact O-CA 3.41Å; V723-L843 HydrophobicContact CB-CD2 4.02Å; V723-L843 HydrophobicContact CG1-CD2 3.61Å; V723-L843 HydrophobicContact CG2-CD2 3.56Å; M737-L843 HydrophobicContact CE-CD1 4.25Å; M737-L843 HydrophobicContact CE-CD2 3.71Å; M737-L843 HydrophobicContact SD-CD2 3.96Å; L822-L843 HydrophobicContact CD2-CD1 3.32Å; L841-L843 HydrophobicContact CD1-CD2 4.34Å; L843-G845 PolarHBondContact O-N 3.28Å; L843-V846 PolarHBondContact N-O 3.44Å; L843-V846 WeakPolarHBondContact O-CB 3.39Å; L843-V846 PolarHBondContact O-N 3.48Å; L843-L848 HydrophobicContact CD1-CD1 3.5Å; L843-L848 HydrophobicContact CD1-CG 4.14Å; L843-L848 HydrophobicContact CG-CD1 4.16Å; L843-L848 HydrophobicContact CG-CG 4.45Å
844	N	72	Confident	86.2	Confident	65 Å²	65	30.8 Å²	30.8	35%	0.348	18%	0.179	S	C	.	.	T	Hydrogen-bonded Turn	trans	50.3	40.2	-175.7	-64.7	-16.2	0	0	0	112.6	F715 H716 A721 D722 V846	F715-N844 WeakPolarHBondContact CE2-ND2 3.22Å; H716-N844 PolarHBondContact O-ND2 2.95Å; A721-N844 WeakPolarHBondContact CA-OD1 3.19Å; D722-N844 PolarHBondContact N-OD1 3.28Å; D722-N844 PolarHBondContact O-N 3.32Å; N844-V846 VanDerWaalsContact C-N 3.26Å; N844-V846 PolarHBondContact O-N 3.47Å
845	G	67.9	Low	86	Confident	44 Å²	44	35.4 Å²	35.4	45%	0.454	21%	0.207	S	C	.	.	T	Hydrogen-bonded Turn	trans	79.8	-4.8	-176.9	0	0	0	0	0	115.4	L843	L843-G845 PolarHBondContact O-N 3.28Å
846	V	71.1	Confident	85.5	Confident	94 Å²	94	38.1 Å²	38.1	57%	0.57	23%	0.225	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-93.4	120.5	177.4	-176.6	0	0	0	0	110.1	Q842 L843 N844	Q842-V846 CarbonylContact C-O 3.57Å; Q842-V846 VanDerWaalsContact CA-O 3.31Å; Q842-V846 WeakPolarHBondContact CA-O 3.47Å; L843-V846 PolarHBondContact N-O 3.44Å; L843-V846 WeakPolarHBondContact O-CB 3.39Å; L843-V846 PolarHBondContact O-N 3.48Å; N844-V846 VanDerWaalsContact C-N 3.26Å; N844-V846 PolarHBondContact O-N 3.47Å
847	A	79.7	Confident	84.9	Confident	42 Å²	42	38.3 Å²	38.3	35%	0.347	22%	0.222	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.3	128.9	173.7	0	0	0	0	0	111.3	S696 Q842	S696-A847 VanDerWaalsContact OG-CB 3.23Å; S696-A847 WeakPolarHBondContact OG-CB 3.19Å; Q842-A847 HydrophobicContact CG-CB 4.27Å
848	L	84.6	Confident	84.3	Confident	29 Å²	29	43.6 Å²	43.6	15%	0.152	26%	0.257	C	S	.	.	P	Polyproline II helix	trans	-90.5	127.7	174.6	-65.5	-174.1	0	0	0	110.6	N699 F712 L822 L841 L843 L850	N699-L848 PolarHBondContact ND2-O 3Å; F712-L848 HydrophobicContact CD1-CD1 4.29Å; F712-L848 HydrophobicContact CD1-CD2 4.22Å; F712-L848 HydrophobicContact CD2-CD1 3.89Å; F712-L848 HydrophobicContact CE1-CB 4.1Å; F712-L848 HydrophobicContact CE2-CD1 4.14Å; F712-L848 HydrophobicContact CG-CD1 3.98Å; F712-L848 HydrophobicContact CZ-CB 4.1Å; F712-L848 HydrophobicContact CZ-CD1 4.45Å; L822-L848 HydrophobicContact CD2-CD1 3.88Å; L841-L848 HydrophobicContact CD2-CD1 3.89Å; L841-L848 HydrophobicContact CG-CD1 4.43Å; L841-L848 PolarHBondContact O-N 2.88Å; L843-L848 HydrophobicContact CD1-CD1 3.5Å; L843-L848 HydrophobicContact CD1-CG 4.14Å; L843-L848 HydrophobicContact CG-CD1 4.16Å; L843-L848 HydrophobicContact CG-CG 4.45Å; L848-L850 PolarHBondContact O-N 2.86Å
849	D	86.1	Confident	83.8	Confident	40 Å²	40	45 Å²	45	21%	0.214	27%	0.271	C	S	.	.			trans	-72.8	97.7	179.5	-158.6	-36	0	0	0	111.6	K695 E851 E852	K695-D849 WeakPolarHBondContact CE-OD2 3.27Å; K695-D849 IonicContact NZ-OD2 3.32Å; K695-D849 PolarHBondContact NZ-OD2 2.9Å; D849-E851 PolarHBondContact OD1-N 3.44Å; D849-E852 HydrophobicContact CB-CB 4.3Å; D849-E852 VanDerWaalsContact OD1-CB 3.31Å; D849-E852 WeakPolarHBondContact OD1-CB 3.17Å; D849-E852 PolarHBondContact OD1-N 2.89Å
850	L	91	Very high	83.8	Confident	0 Å²	0	45.3 Å²	45.3	0%	0	27%	0.273	C	S	.	.	H	α-helix	trans	-80.2	-40.1	-177.5	-56.9	179.5	0	0	0	110.7	N699 A701 L710 F712 I824 I838 L841 L848 R853 A854	N699-L850 PolarHBondContact ND2-N 3.3Å; N699-L850 WeakPolarHBondContact OD1-CA 3.46Å; N699-L850 WeakPolarHBondContact OD1-CB 3.03Å; N699-L850 PolarHBondContact OD1-N 3.15Å; A701-L850 HydrophobicContact CB-CB 3.98Å; L710-L850 HydrophobicContact CD1-CB 4.17Å; L710-L850 HydrophobicContact CD1-CD2 3.98Å; F712-L850 HydrophobicContact CE2-CD2 4.09Å; F712-L850 HydrophobicContact CZ-CD2 4.02Å; I824-L850 HydrophobicContact CG2-CD2 4.43Å; I838-L850 HydrophobicContact CB-CD1 4.47Å; I838-L850 HydrophobicContact CG2-CD1 4.08Å; L841-L850 HydrophobicContact CB-CD1 4.03Å; L841-L850 HydrophobicContact CB-CD2 4.37Å; L841-L850 HydrophobicContact CB-CG 4.47Å; L841-L850 HydrophobicContact CD2-CD2 4.1Å; L848-L850 PolarHBondContact O-N 2.86Å; L850-R853 PolarHBondContact O-N 3.08Å; L850-A854 VanDerWaalsContact O-CB 3.23Å; L850-A854 WeakPolarHBondContact O-CB 3.02Å; L850-A854 PolarHBondContact O-N 3.46Å
851	E	89.8	Confident	84	Confident	16 Å²	16	50.2 Å²	50.2	8%	0.075	30%	0.295	C	S	.	.	H	α-helix	trans	-64	-48.3	-178.1	-76.4	-171.3	-148.6	0	0	111.8	N699 S700 D849 R853 A854 T855 P862 R886	N699-E851 PolarHBondContact OD1-N 3.11Å; N699-E851 VanDerWaalsContact OD1-N 3.09Å; S700-E851 WeakPolarHBondContact O-CG 3.37Å; D849-E851 PolarHBondContact OD1-N 3.44Å; E851-R853 VanDerWaalsContact C-N 3.3Å; E851-R853 PolarHBondContact O-N 2.81Å; E851-A854 PolarHBondContact O-N 3.28Å; E851-T855 WeakPolarHBondContact O-CG2 3.18Å; E851-T855 PolarHBondContact O-N 2.81Å; E851-T855 VanDerWaalsContact O-N 3.08Å; E851-P862 HydrophobicContact CB-CB 4.08Å; E851-P862 HydrophobicContact CG-CB 4.11Å; E851-R886 IonicContact OE1-CZ 3.66Å; E851-R886 IonicContact OE1-NE 3.72Å; E851-R886 PolarHBondContact OE1-NE 3.49Å; E851-R886 IonicContact OE1-NH2 3.25Å; E851-R886 IonicContact OE2-CZ 3.85Å; E851-R886 IonicContact OE2-NE 2.58Å; E851-R886 PolarHBondContact OE2-NE 3.24Å; E851-R886 IonicContact OE2-NH2 3.61Å; E851-R886 PolarHBondContact OE2-NH2 3.02Å
852	E	87.3	Confident	84	Confident	124 Å²	124	51.8 Å²	51.8	58%	0.579	31%	0.305	S	S	*	.	H	α-helix	trans	-59.9	-44.4	177.3	-172.7	176.7	163.5	0	0	110.4	D849 A854 T855	D849-E852 HydrophobicContact CB-CB 4.3Å; D849-E852 VanDerWaalsContact OD1-CB 3.31Å; D849-E852 WeakPolarHBondContact OD1-CB 3.17Å; D849-E852 PolarHBondContact OD1-N 2.89Å; E852-A854 VanDerWaalsContact C-N 3.34Å; E852-A854 PolarHBondContact O-N 3.12Å; E852-T855 PolarHBondContact O-N 3.02Å; E852-T855 PolarHBondContact O-OG1 2.76Å
853	R	87.7	Confident	84.2	Confident	83 Å²	83	51.4 Å²	51.4	31%	0.313	31%	0.305	S	S	.	.	H	α-helix	trans	-66.9	-34.8	178.5	-162.5	62.3	174.3	157.2	-0	112.8	L710 H711 F712 L850 E851 V856 T857	L710-R853 HydrophobicContact CB-CG 4.23Å; L710-R853 HydrophobicContact CD1-CB 4.46Å; L710-R853 HydrophobicContact CD2-CB 4.1Å; L710-R853 HydrophobicContact CD2-CG 3.85Å; L710-R853 HydrophobicContact CG-CG 4.49Å; H711-R853 PolarHBondContact CE1-NH2 2.78Å; H711-R853 PolarHBondContact NE2-NH2 2.84Å; H711-R853 PolarHBondContact O-NE 2.78Å; F712-R853 HydrophobicContact CE1-CB 4.45Å; F712-R853 HydrophobicContact CZ-CB 4.12Å; F712-R853 HydrophobicContact CZ-CG 4.24Å; L850-R853 PolarHBondContact O-N 3.08Å; E851-R853 VanDerWaalsContact C-N 3.3Å; E851-R853 PolarHBondContact O-N 2.81Å; R853-V856 VanDerWaalsContact O-CG2 3.27Å; R853-V856 WeakPolarHBondContact O-CG2 3.24Å; R853-V856 PolarHBondContact O-N 3.03Å; R853-T857 WeakPolarHBondContact O-CB 3.39Å; R853-T857 PolarHBondContact O-N 2.87Å; R853-T857 PolarHBondContact O-OG1 2.83Å
854	A	89.3	Confident	84.5	Confident	2 Å²	2	51.4 Å²	51.4	2%	0.017	31%	0.306	C	S	.	.	H	α-helix	trans	-65.7	-38	177.2	0	0	0	0	0	112.2	A701 L710 L850 E851 E852 V856 T857 V860 P862	A701-A854 HydrophobicContact CB-CB 4.22Å; L710-A854 HydrophobicContact CD2-CB 4.42Å; L850-A854 VanDerWaalsContact O-CB 3.23Å; L850-A854 WeakPolarHBondContact O-CB 3.02Å; L850-A854 PolarHBondContact O-N 3.46Å; E851-A854 PolarHBondContact O-N 3.28Å; E852-A854 VanDerWaalsContact C-N 3.34Å; E852-A854 PolarHBondContact O-N 3.12Å; A854-V856 PolarHBondContact O-N 3.28Å; A854-T857 PolarHBondContact O-N 2.8Å; A854-V860 HydrophobicContact CB-CB 4.32Å; A854-V860 HydrophobicContact CB-CG1 3.76Å; A854-P862 HydrophobicContact CB-CB 4.26Å
855	T	88.8	Confident	84.8	Confident	96 Å²	96	51.6 Å²	51.6	59%	0.589	32%	0.316	S	S	*	.	H	α-helix	trans	-57.5	-27.6	179.9	60.8	0	0	0	0	114.2	E851 E852 P862	E851-T855 WeakPolarHBondContact O-CG2 3.18Å; E851-T855 PolarHBondContact O-N 2.81Å; E851-T855 VanDerWaalsContact O-N 3.08Å; E852-T855 PolarHBondContact O-N 3.02Å; E852-T855 PolarHBondContact O-OG1 2.76Å; T855-P862 HydrophobicContact CG2-CB 4.33Å; T855-P862 HydrophobicContact CG2-CG 3.99Å
856	V	84.9	Confident	85.2	Confident	97 Å²	97	50.4 Å²	50.4	59%	0.588	30%	0.304	S	S	*	.	T	Hydrogen-bonded Turn	trans	-104.7	1.5	-178.7	-60.1	0	0	0	0	113.4	R853 A854	R853-V856 VanDerWaalsContact O-CG2 3.27Å; R853-V856 WeakPolarHBondContact O-CG2 3.24Å; R853-V856 PolarHBondContact O-N 3.03Å; A854-V856 PolarHBondContact O-N 3.28Å
857	T	80.9	Confident	85.7	Confident	24 Å²	24	46 Å²	46	15%	0.147	28%	0.277	C	S	.	.	S	Bend	trans	-112.9	115.8	-173.7	-57	0	0	0	0	111.3	Y709 L710 R853 A854 V860	Y709-T857 WeakPolarHBondContact O-CG2 3.43Å; L710-T857 HydrophobicContact CD2-CG2 4.07Å; R853-T857 WeakPolarHBondContact O-CB 3.39Å; R853-T857 PolarHBondContact O-N 2.87Å; R853-T857 PolarHBondContact O-OG1 2.83Å; A854-T857 PolarHBondContact O-N 2.8Å; T857-V860 HydrophobicContact CG2-CB 4.42Å; T857-V860 HydrophobicContact CG2-CG2 3.92Å; T857-V860 PolarHBondContact O-N 2.97Å
858	P	81.5	Confident	85.9	Confident	119 Å²	119	45.2 Å²	45.2	77%	0.773	27%	0.269	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.9	138	177	-23.4	33.7	0	0	0	112.9	V860	P858-V860 VanDerWaalsContact C-N 3.25Å; P858-V860 PolarHBondContact O-N 2.85Å
859	G	84.3	Confident	85.5	Confident	30 Å²	30	46.8 Å²	46.8	31%	0.309	28%	0.283	S	S	.	.	T	Hydrogen-bonded Turn	trans	80.8	-0.3	179.6	0	0	0	0	0	114.9	N704 S708	N704-G859 PolarHBondContact N-O 3.37Å; S708-G859 WeakPolarHBondContact CB-O 3.37Å; S708-G859 PolarHBondContact OG-O 3.49Å
860	V	90.8	Very high	85	Confident	8 Å²	8	47 Å²	47	5%	0.048	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	131.9	173.2	-167.3	0	0	0	0	109.5	A701 S702 F703 L710 A854 T857 P858	A701-V860 HydrophobicContact CB-CG1 3.77Å; S702-V860 CarbonylContact O-C 3.45Å; S702-V860 VanDerWaalsContact O-CA 3.27Å; S702-V860 WeakPolarHBondContact O-CA 3.36Å; S702-V860 WeakPolarHBondContact O-CG1 3.44Å; F703-V860 HydrophobicContact CD1-CG1 4.17Å; F703-V860 HydrophobicContact CD1-CG2 3.82Å; F703-V860 HydrophobicContact CE1-CG1 4.08Å; F703-V860 HydrophobicContact CE1-CG2 3.99Å; F703-V860 HydrophobicContact CZ-CG1 4.36Å; L710-V860 HydrophobicContact CD1-CG1 4.4Å; L710-V860 HydrophobicContact CD2-CB 4.15Å; L710-V860 HydrophobicContact CD2-CG1 3.95Å; L710-V860 HydrophobicContact CD2-CG2 4.11Å; L710-V860 HydrophobicContact CG-CG1 4.21Å; A854-V860 HydrophobicContact CB-CB 4.32Å; A854-V860 HydrophobicContact CB-CG1 3.76Å; T857-V860 HydrophobicContact CG2-CB 4.42Å; T857-V860 HydrophobicContact CG2-CG2 3.92Å; T857-V860 PolarHBondContact O-N 2.97Å; P858-V860 VanDerWaalsContact C-N 3.25Å; P858-V860 PolarHBondContact O-N 2.85Å
861	E	91.1	Very high	84.6	Confident	115 Å²	115	47.8 Å²	47.8	54%	0.537	29%	0.288	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	142.9	179.1	-70.2	178	-179.7	0	0	111.5	A701 S702 N704	A701-E861 CarbonylContact C-O 3.39Å; A701-E861 WeakPolarHBondContact CA-O 3.22Å; S702-E861 PolarHBondContact N-O 3.39Å; S702-E861 PolarHBondContact O-N 2.71Å; N704-E861 PolarHBondContact ND2-OE1 2.65Å; N704-E861 PolarHBondContact ND2-OE2 2.76Å
862	P	90.7	Very high	84.3	Confident	34 Å²	34	47.9 Å²	47.9	22%	0.221	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.2	130.6	177.7	29.9	-34.8	0	0	0	112.4	E851 A854 T855	E851-P862 HydrophobicContact CB-CB 4.08Å; E851-P862 HydrophobicContact CG-CB 4.11Å; A854-P862 HydrophobicContact CB-CB 4.26Å; T855-P862 HydrophobicContact CG2-CB 4.33Å; T855-P862 HydrophobicContact CG2-CG 3.99Å
863	G	88	Confident	84.1	Confident	7 Å²	7	48.6 Å²	48.6	7%	0.072	30%	0.297	C	S	.	.			trans	94.6	168.3	-177.6	0	0	0	0	0	113.1	S700 S702	S700-G863 PolarHBondContact O-N 2.87Å; S700-G863 VanDerWaalsContact OG-CA 3.28Å; S700-G863 WeakPolarHBondContact OG-CA 3.25Å; S702-G863 PolarHBondContact OG-O 2.01Å
864	C	86.4	Confident	84.1	Confident	10 Å²	10	45.2 Å²	45.2	7%	0.068	29%	0.285	C	S	.	.			trans	-158.2	126	169.6	177.7	0	0	0	0	111.9	S700 S702 K728 W782 C837 H867	S700-C864 PolarHBondContact OG-N 2.94Å; S702-C864 WeakPolarHBondContact OG-CB 3.38Å; K728-C864 WeakPolarHBondContact CE-SG 3.2Å; W782-C864 HydrophobicContact CH2-CB 3.94Å; W782-C864 HydrophobicContact CZ2-CB 3.85Å; C837-C864 HydrophobicContact CB-CB 3.42Å; C837-C864 VanDerWaalsContact CB-CB 3.42Å; C837-C864 WeakPolarHBondContact CB-SG 3.48Å; C837-C864 WeakPolarHBondContact SG-CB 3.17Å; C837-C864 CovalentContact SG-SG 2.01Å; C837-C864 PolarHBondContact SG-SG 2.85Å; C864-H867 PolarHBondContact O-CE1 2.99Å; C864-H867 PolarHBondContact O-NE2 3.16Å
865	A	79.8	Confident	84.1	Confident	69 Å²	69	45.9 Å²	45.9	57%	0.57	29%	0.289	S	S	*	.			trans	-70.8	165.6	179.8	0	0	0	0	0	113.3	K728	K728-A865 PolarHBondContact NZ-O 3.27Å
866	G	76.2	Confident	84.1	Confident	19 Å²	19	48.2 Å²	48.2	20%	0.196	29%	0.287	C	S	.	.			trans	100.9	40.6	173	0	0	0	0	0	114	W782 S869 E883	W782-G866 PolarHBondContact NE1-O 2.94Å; G866-S869 PolarHBondContact O-OG 3.27Å; G866-E883 VanDerWaalsContact C-OE1 3.24Å; G866-E883 WeakPolarHBondContact CA-OE1 3.23Å
867	H	80.8	Confident	84.2	Confident	1 Å²	1	47.4 Å²	47.4	1%	0.005	28%	0.28	C	S	.	.			trans	-82.7	-25.8	177.7	-54.3	-55.3	0	0	0	113.1	W698 W782 C864 S869 T870 Y871 E883 K884 G887 V888	W698-H867 AromaticContact CE3-CE1 3.84Å; W698-H867 HydrophobicContact CZ3-CB 4.34Å; W698-H867 AromaticContact CZ3-CE1 3.9Å; W698-H867 AromaticContact CZ3-CG 3.85Å; W698-H867 AromaticContact CZ3-ND1 3.62Å; W782-H867 AromaticContact NE1-ND1 3.77Å; C864-H867 PolarHBondContact O-CE1 2.99Å; C864-H867 PolarHBondContact O-NE2 3.16Å; H867-S869 PolarHBondContact O-N 2.96Å; H867-T870 PolarHBondContact O-N 2.96Å; H867-T870 VanDerWaalsContact O-N 3.17Å; H867-Y871 HydrophobicContact CB-CD2 4.24Å; H867-Y871 VanDerWaalsContact O-CD2 3.31Å; H867-Y871 WeakPolarHBondContact O-CD2 3.48Å; H867-Y871 PolarHBondContact O-N 3.25Å; H867-E883 WeakPolarHBondContact CB-OE2 2.89Å; H867-E883 IonicContact CD2-OE2 2.61Å; H867-E883 IonicContact CG-OE2 3.94Å; H867-E883 PolarHBondContact N-OE1 3.22Å; H867-E883 PolarHBondContact N-OE2 3.21Å; H867-K884 PolarHBondContact CD2-O 2.94Å; H867-K884 VanDerWaalsContact CD2-O 3.31Å; H867-G887 PolarHBondContact CD2-O 2.75Å; H867-V888 HydrophobicContact CB-CG1 3.39Å
868	C	83.9	Confident	84.3	Confident	26 Å²	26	49.9 Å²	49.9	18%	0.176	31%	0.31	C	S	.	.	H	α-helix	trans	-65.8	-22.3	-177.3	-80.7	0	0	0	0	113.6	T870 G872 C881 E883	C868-T870 VanDerWaalsContact C-N 3.32Å; C868-G872 WeakPolarHBondContact O-CA 3.2Å; C868-G872 PolarHBondContact O-N 3.42Å; C868-C881 WeakPolarHBondContact CA-SG 3.29Å; C868-C881 HydrophobicContact CB-CB 3.8Å; C868-C881 WeakPolarHBondContact CB-SG 3.32Å; C868-C881 WeakPolarHBondContact SG-CB 3.05Å; C868-C881 CovalentContact SG-SG 2.04Å; C868-C881 PolarHBondContact SG-SG 2.95Å; C868-E883 HydrophobicContact CB-CG 4.48Å; C868-E883 WeakPolarHBondContact CB-OE1 3.37Å; C868-E883 PolarHBondContact N-OE1 3.03Å; C868-E883 PolarHBondContact N-OE2 2.86Å
869	S	77.2	Confident	84.7	Confident	63 Å²	63	44.9 Å²	44.9	44%	0.441	28%	0.28	S	S	.	.	H	α-helix	trans	-68.9	-34.2	174.3	57	0	0	0	0	113.2	Q781 G866 H867	Q781-S869 PolarHBondContact OE1-OG 3.09Å; G866-S869 PolarHBondContact O-OG 3.27Å; H867-S869 PolarHBondContact O-N 2.96Å
870	T	73.9	Confident	85	Confident	43 Å²	43	51.5 Å²	51.5	26%	0.264	30%	0.296	S	S	.	.	H	α-helix	trans	-81.5	-46.7	175.8	-47.5	0	0	0	0	111.3	H867 C868 H873	H867-T870 PolarHBondContact O-N 2.96Å; H867-T870 VanDerWaalsContact O-N 3.17Å; C868-T870 VanDerWaalsContact C-N 3.32Å; T870-H873 PolarHBondContact O-CE1 2.07Å; T870-H873 PolarHBondContact O-ND1 3.11Å
871	Y	82.5	Confident	85	Confident	17 Å²	17	52.6 Å²	52.6	7%	0.067	30%	0.304	C	S	.	.	H	α-helix	trans	-106.2	-3.7	-168.2	-55.5	-69	0	0	0	114.4	H504 W698 R839 H867 H873 L874	H504-Y871 HydrophobicContact CB-CD1 4.37Å; H504-Y871 HydrophobicContact CB-CE1 3.98Å; H504-Y871 AromaticContact CD2-CD1 3.71Å; H504-Y871 AromaticContact CD2-CE1 3.77Å; H504-Y871 AromaticContact CD2-CG 3.97Å; W698-Y871 HydrophobicContact CH2-CD2 4.04Å; W698-Y871 AromaticContact CH2-CE2 3.71Å; W698-Y871 HydrophobicContact CH2-CE2 3.71Å; W698-Y871 HydrophobicContact CZ3-CD2 4.47Å; W698-Y871 AromaticContact CZ3-CE2 3.9Å; W698-Y871 HydrophobicContact CZ3-CE2 3.9Å; R839-Y871 PolarHBondContact NH1-OH 3.02Å; R839-Y871 PolarHBondContact NH2-OH 3.4Å; H867-Y871 HydrophobicContact CB-CD2 4.24Å; H867-Y871 VanDerWaalsContact O-CD2 3.31Å; H867-Y871 WeakPolarHBondContact O-CD2 3.48Å; H867-Y871 PolarHBondContact O-N 3.25Å; Y871-H873 PolarHBondContact O-N 3.03Å; Y871-L874 HydrophobicContact CD1-CD1 4.32Å; Y871-L874 VanDerWaalsContact O-CB 3.24Å; Y871-L874 WeakPolarHBondContact O-CB 3.42Å; Y871-L874 WeakPolarHBondContact O-CG 3.28Å; Y871-L874 PolarHBondContact O-N 3.3Å
872	G	83.9	Confident	84.9	Confident	19 Å²	19	53.8 Å²	53.8	20%	0.196	30%	0.303	C	S	.	.	G	3₁₀ helix	trans	-63.3	-26.2	-176	0	0	0	0	0	113.8	C868 L874 C875	C868-G872 WeakPolarHBondContact O-CA 3.2Å; C868-G872 PolarHBondContact O-N 3.42Å; G872-L874 PolarHBondContact O-N 3.27Å; G872-L874 VanDerWaalsContact O-N 3.15Å; G872-C875 WeakPolarHBondContact O-CB 3.42Å; G872-C875 PolarHBondContact O-N 3.31Å
873	H	84.3	Confident	84.7	Confident	139 Å²	139	56 Å²	56	64%	0.644	31%	0.311	S	S	*	.	G	3₁₀ helix	trans	-63.4	-15.4	173.6	74.5	-84.3	0	0	0	113.6	T870 Y871 C875	T870-H873 PolarHBondContact O-CE1 2.07Å; T870-H873 PolarHBondContact O-ND1 3.11Å; Y871-H873 PolarHBondContact O-N 3.03Å; H873-C875 VanDerWaalsContact C-N 3.3Å
874	L	87.4	Confident	84.2	Confident	12 Å²	12	59.1 Å²	59.1	6%	0.063	32%	0.322	C	S	.	.	G	3₁₀ helix	trans	-74.3	-21	174.4	-60.2	178.5	0	0	0	112.4	Y871 G872 R876 F901	Y871-L874 HydrophobicContact CD1-CD1 4.32Å; Y871-L874 VanDerWaalsContact O-CB 3.24Å; Y871-L874 WeakPolarHBondContact O-CB 3.42Å; Y871-L874 WeakPolarHBondContact O-CG 3.28Å; Y871-L874 PolarHBondContact O-N 3.3Å; G872-L874 PolarHBondContact O-N 3.27Å; G872-L874 VanDerWaalsContact O-N 3.15Å; L874-R876 PolarHBondContact O-N 3.04Å; L874-F901 HydrophobicContact CB-CD1 3.83Å; L874-F901 HydrophobicContact CB-CE1 3.98Å; L874-F901 HydrophobicContact CD1-CE1 4.09Å; L874-F901 WeakPolarHBondContact O-CB 3.31Å
875	C	89.7	Confident	83.6	Confident	15 Å²	15	66.7 Å²	66.7	10%	0.101	35%	0.349	C	S	.	.			trans	-75.8	104.3	173.7	-56.7	0	0	0	0	109.6	G872 H873 G879 C890	G872-C875 WeakPolarHBondContact O-CB 3.42Å; G872-C875 PolarHBondContact O-N 3.31Å; H873-C875 VanDerWaalsContact C-N 3.3Å; C875-G879 WeakPolarHBondContact CB-O 3.31Å; C875-C890 WeakPolarHBondContact CA-SG 3.25Å; C875-C890 HydrophobicContact CB-CB 3.72Å; C875-C890 WeakPolarHBondContact CB-SG 3.43Å; C875-C890 WeakPolarHBondContact SG-CA 3.44Å; C875-C890 WeakPolarHBondContact SG-CB 3.45Å; C875-C890 CovalentContact SG-SG 2.04Å; C875-C890 PolarHBondContact SG-SG 2.9Å
876	R	87.7	Confident	83.4	Confident	145 Å²	145	67.4 Å²	67.4	55%	0.547	34%	0.337	S	S	.	.			trans	-88.3	173.3	-176	-58	-167.3	178.7	179.6	0.6	111.5	L874 G878 G879 F901 C902	L874-R876 PolarHBondContact O-N 3.04Å; R876-G878 PolarHBondContact O-N 3.17Å; R876-G878 VanDerWaalsContact O-N 3.08Å; R876-G879 PolarHBondContact O-N 2.92Å; R876-F901 WeakPolarHBondContact CB-O 3.4Å; R876-F901 PolarHBondContact N-O 3.35Å; R876-C902 WeakPolarHBondContact O-CB 3.49Å
877	N	87.3	Confident	83.5	Confident	81 Å²	81	66.6 Å²	66.6	43%	0.433	33%	0.329	S	S	.	.	T	Hydrogen-bonded Turn	trans	52.7	35.9	169.9	-55.7	-44.4	0	0	0	115.3	G879 S895 Y897 C902	N877-G879 VanDerWaalsContact C-N 3.31Å; N877-G879 PolarHBondContact O-N 3.21Å; N877-S895 WeakPolarHBondContact O-CB 3.46Å; N877-Y897 HydrophobicContact CB-CD2 3.37Å; N877-Y897 HydrophobicContact CB-CE2 3.67Å; N877-Y897 HydrophobicContact CB-CG 3.95Å; N877-C902 PolarHBondContact ND2-O 3.13Å
878	G	83.6	Confident	83.7	Confident	76 Å²	76	67.3 Å²	67.3	78%	0.784	33%	0.333	S	S	*	.	T	Hydrogen-bonded Turn	trans	79.6	8	179.3	0	0	0	0	0	115	R876	R876-G878 PolarHBondContact O-N 3.17Å; R876-G878 VanDerWaalsContact O-N 3.08Å
879	G	89.3	Confident	83.9	Confident	14 Å²	14	67 Å²	67	14%	0.144	33%	0.33	C	S	.	.	P	Polyproline II helix	trans	-60.8	140.3	172.6	0	0	0	0	0	112.6	C875 R876 N877 D891	C875-G879 WeakPolarHBondContact CB-O 3.31Å; R876-G879 PolarHBondContact O-N 2.92Å; N877-G879 VanDerWaalsContact C-N 3.31Å; N877-G879 PolarHBondContact O-N 3.21Å; G879-D891 WeakPolarHBondContact CA-O 3.44Å
880	R	90.9	Very high	84.5	Confident	169 Å²	169	64.8 Å²	64.8	64%	0.638	32%	0.315	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-94.9	126.2	-178.8	-179.4	-179.7	-73.7	163.2	-2.3	110.9	D891	R880-D891 HydrophobicContact CB-CB 4.37Å; R880-D891 PolarHBondContact N-O 2.83Å; R880-D891 WeakPolarHBondContact O-CB 3.32Å; R880-D891 PolarHBondContact O-N 2.81Å
881	C	90.6	Very high	85.3	Confident	31 Å²	31	64 Å²	64	21%	0.209	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.4	132.8	174.4	-171.5	0	0	0	0	111.7	C868 T889	C868-C881 WeakPolarHBondContact CA-SG 3.29Å; C868-C881 HydrophobicContact CB-CB 3.8Å; C868-C881 WeakPolarHBondContact CB-SG 3.32Å; C868-C881 WeakPolarHBondContact SG-CB 3.05Å; C868-C881 CovalentContact SG-SG 2.04Å; C868-C881 PolarHBondContact SG-SG 2.95Å; C881-T889 CarbonylContact C-O 3.55Å
882	R	89.4	Confident	85.7	Confident	140 Å²	140	63.8 Å²	63.8	53%	0.528	31%	0.31	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	132.7	173.6	-65.6	-169.3	179.5	-161	3.6	110.3	V888 T889 D891	R882-V888 WeakPolarHBondContact O-CA 3.47Å; R882-T889 PolarHBondContact N-O 3.37Å; R882-T889 PolarHBondContact O-N 3.5Å; R882-T889 PolarHBondContact O-OG1 2.91Å; R882-D891 HydrophobicContact CG-CB 4.11Å; R882-D891 IonicContact CZ-OD2 3.36Å; R882-D891 IonicContact NE-OD2 3.81Å; R882-D891 PolarHBondContact NE-OD2 3.07Å; R882-D891 IonicContact NH2-OD2 3.27Å; R882-D891 PolarHBondContact NH2-OD2 3.03Å
883	E	85.5	Confident	85.7	Confident	81 Å²	81	66.6 Å²	66.6	38%	0.379	33%	0.331	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.3	142	179	-65.7	-70.5	178.5	0	0	112.2	G866 H867 C868	G866-E883 VanDerWaalsContact C-OE1 3.24Å; G866-E883 WeakPolarHBondContact CA-OE1 3.23Å; H867-E883 WeakPolarHBondContact CB-OE2 2.89Å; H867-E883 IonicContact CD2-OE2 2.61Å; H867-E883 IonicContact CG-OE2 3.94Å; H867-E883 PolarHBondContact N-OE1 3.22Å; H867-E883 PolarHBondContact N-OE2 3.21Å; C868-E883 HydrophobicContact CB-CG 4.48Å; C868-E883 WeakPolarHBondContact CB-OE1 3.37Å; C868-E883 PolarHBondContact N-OE1 3.03Å; C868-E883 PolarHBondContact N-OE2 2.86Å
884	K	78.3	Confident	85.4	Confident	72 Å²	72	66.6 Å²	66.6	31%	0.313	33%	0.33	S	S	.	.			trans	-122.8	163	165.7	-67.2	-176.7	169	176.9	0	109.4	D533 H867 R886 G887 T889	D533-K884 IonicContact OD2-NZ 3.94Å; D533-K884 PolarHBondContact OD2-NZ 2.04Å; H867-K884 PolarHBondContact CD2-O 2.94Å; H867-K884 VanDerWaalsContact CD2-O 3.31Å; K884-R886 PolarHBondContact O-N 3.09Å; K884-G887 WeakPolarHBondContact CA-O 3.31Å; K884-G887 WeakPolarHBondContact CB-O 3.29Å; K884-G887 PolarHBondContact N-O 2.02Å; K884-T889 HydrophobicContact CD-CG2 4.01Å; K884-T889 WeakPolarHBondContact CE-OG1 3.29Å
885	R	73.1	Confident	85.1	Confident	169 Å²	169	67 Å²	67	64%	0.638	33%	0.334	S	S	*	.	S	Bend	trans	-57.2	-36.3	172.4	-173	-180	-175.1	-174.1	2.3	112.1
886	R	75.3	Confident	84.7	Confident	83 Å²	83	67.9 Å²	67.9	31%	0.313	34%	0.342	S	S	.	.	S	Bend	trans	-129.4	94.4	172	-65.2	-168.9	-179.2	173.3	4.5	108.1	E580 W698 E851 K884	E580-R886 VanDerWaalsContact CD-NH1 3.32Å; E580-R886 WeakPolarHBondContact OE1-CD 3.06Å; E580-R886 IonicContact OE1-CZ 2.76Å; E580-R886 IonicContact OE1-NE 3.19Å; E580-R886 IonicContact OE1-NH1 2.92Å; E580-R886 PolarHBondContact OE1-NH1 3.43Å; W698-R886 HydrophobicContact CB-CB 3.86Å; W698-R886 HydrophobicContact CB-CG 3.87Å; W698-R886 HydrophobicContact CG-CB 3.85Å; W698-R886 HydrophobicContact CG-CG 4.42Å; E851-R886 IonicContact OE1-CZ 3.66Å; E851-R886 IonicContact OE1-NE 3.72Å; E851-R886 PolarHBondContact OE1-NE 3.49Å; E851-R886 IonicContact OE1-NH2 3.25Å; E851-R886 IonicContact OE2-CZ 3.85Å; E851-R886 IonicContact OE2-NE 2.58Å; E851-R886 PolarHBondContact OE2-NE 3.24Å; E851-R886 IonicContact OE2-NH2 3.61Å; E851-R886 PolarHBondContact OE2-NH2 3.02Å; K884-R886 PolarHBondContact O-N 3.09Å
887	G	78.9	Confident	84.6	Confident	3 Å²	3	64.5 Å²	64.5	3%	0.031	33%	0.33	C	S	.	.	S	Bend	trans	100	-163.5	172.5	0	0	0	0	0	117.3	H867 K884	H867-G887 PolarHBondContact CD2-O 2.75Å; K884-G887 WeakPolarHBondContact CA-O 3.31Å; K884-G887 WeakPolarHBondContact CB-O 3.29Å; K884-G887 PolarHBondContact N-O 2.02Å
888	V	84.3	Confident	84.5	Confident	15 Å²	15	65.2 Å²	65.2	9%	0.091	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	157.8	-176.6	-61.5	0	0	0	0	111.1	H867 R882	H867-V888 HydrophobicContact CB-CG1 3.39Å; R882-V888 WeakPolarHBondContact O-CA 3.47Å
889	T	88.4	Confident	84.6	Confident	19 Å²	19	62.2 Å²	62.2	12%	0.117	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.4	147.6	168.6	31.6	0	0	0	0	111.2	C881 R882 K884	C881-T889 CarbonylContact C-O 3.55Å; R882-T889 PolarHBondContact N-O 3.37Å; R882-T889 PolarHBondContact O-N 3.5Å; R882-T889 PolarHBondContact O-OG1 2.91Å; K884-T889 HydrophobicContact CD-CG2 4.01Å; K884-T889 WeakPolarHBondContact CE-OG1 3.29Å
890	C	90.1	Very high	84.4	Confident	18 Å²	18	62.9 Å²	62.9	12%	0.122	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97	120.9	173.3	-58.9	0	0	0	0	109.6	C875 C892 P900 C902	C875-C890 WeakPolarHBondContact CA-SG 3.25Å; C875-C890 HydrophobicContact CB-CB 3.72Å; C875-C890 WeakPolarHBondContact CB-SG 3.43Å; C875-C890 WeakPolarHBondContact SG-CA 3.44Å; C875-C890 WeakPolarHBondContact SG-CB 3.45Å; C875-C890 CovalentContact SG-SG 2.04Å; C875-C890 PolarHBondContact SG-SG 2.9Å; C890-C892 PolarHBondContact O-N 2.98Å; C890-P900 WeakPolarHBondContact CB-O 3.44Å; C890-P900 PolarHBondContact SG-O 3.33Å; C890-P900 VanDerWaalsContact SG-O 3.36Å; C890-C902 VanDerWaalsContact CB-SG 3.55Å
891	D	91.5	Very high	84.3	Confident	25 Å²	25	55.9 Å²	55.9	13%	0.134	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.9	107.9	171.7	177.7	7.6	0	0	0	109.1	G879 R880 R882 A893	G879-D891 WeakPolarHBondContact CA-O 3.44Å; R880-D891 HydrophobicContact CB-CB 4.37Å; R880-D891 PolarHBondContact N-O 2.83Å; R880-D891 WeakPolarHBondContact O-CB 3.32Å; R880-D891 PolarHBondContact O-N 2.81Å; R882-D891 HydrophobicContact CG-CB 4.11Å; R882-D891 IonicContact CZ-OD2 3.36Å; R882-D891 IonicContact NE-OD2 3.81Å; R882-D891 PolarHBondContact NE-OD2 3.07Å; R882-D891 IonicContact NH2-OD2 3.27Å; R882-D891 PolarHBondContact NH2-OD2 3.03Å; D891-A893 WeakPolarHBondContact OD1-CB 3.39Å; D891-A893 PolarHBondContact OD1-N 3.2Å; D891-A893 VanDerWaalsContact OD1-N 3.12Å
892	C	89.6	Confident	84.3	Confident	13 Å²	13	54.4 Å²	54.4	9%	0.088	27%	0.269	C	S	.	.			trans	-96.6	4.1	-176.9	-44.1	0	0	0	0	113.1	C890 F894 S895 Y897 G899 C902	C890-C892 PolarHBondContact O-N 2.98Å; C892-F894 PolarHBondContact O-N 3.14Å; C892-S895 PolarHBondContact O-N 3.17Å; C892-S895 PolarHBondContact O-OG 3.2Å; C892-Y897 WeakPolarHBondContact CB-O 3.49Å; C892-G899 PolarHBondContact SG-O 3Å; C892-G899 VanDerWaalsContact SG-O 3.4Å; C892-C902 WeakPolarHBondContact CA-SG 3.49Å; C892-C902 HydrophobicContact CB-CB 3.82Å; C892-C902 WeakPolarHBondContact CB-SG 3.32Å; C892-C902 WeakPolarHBondContact SG-CA 3.25Å; C892-C902 WeakPolarHBondContact SG-CB 3.46Å; C892-C902 CovalentContact SG-SG 2.04Å; C892-C902 PolarHBondContact SG-SG 3.02Å
893	A	85.6	Confident	84.2	Confident	78 Å²	78	50 Å²	50	65%	0.645	26%	0.26	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.7	-25	-171.1	0	0	0	0	0	114.5	D891	D891-A893 WeakPolarHBondContact OD1-CB 3.39Å; D891-A893 PolarHBondContact OD1-N 3.2Å; D891-A893 VanDerWaalsContact OD1-N 3.12Å
894	F	77.9	Confident	84.1	Confident	140 Å²	140	50.8 Å²	50.8	61%	0.614	27%	0.266	S	S	*	.	T	Hydrogen-bonded Turn	trans	-106.3	21.3	178.2	-57.1	-74.7	0	0	0	113.1	C892	C892-F894 PolarHBondContact O-N 3.14Å
895	S	79.4	Confident	84.2	Confident	21 Å²	21	53.7 Å²	53.7	15%	0.147	28%	0.281	C	S	.	.	S	Bend	trans	-123.8	158	177.7	77.6	0	0	0	0	111.1	N877 C892 Y897	N877-S895 WeakPolarHBondContact O-CB 3.46Å; C892-S895 PolarHBondContact O-N 3.17Å; C892-S895 PolarHBondContact O-OG 3.2Å; S895-Y897 PolarHBondContact O-N 3.24Å; S895-Y897 PolarHBondContact OG-N 3.05Å; S895-Y897 PolarHBondContact OG-O 3.47Å
896	A	81.3	Confident	84.5	Confident	32 Å²	32	50.9 Å²	50.9	26%	0.264	28%	0.277	S	S	.	.	S	Bend	trans	-80.3	20.6	172.2	0	0	0	0	0	112.9	I906	A896-I906 PolarHBondContact O-N 2.97Å
897	Y	86	Confident	84.5	Confident	75 Å²	75	50.9 Å²	50.9	29%	0.294	29%	0.291	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.2	155.3	-172.9	-61.5	-92.6	0	0	0	110.4	N877 C892 S895 C902 N904 E905	N877-Y897 HydrophobicContact CB-CD2 3.37Å; N877-Y897 HydrophobicContact CB-CE2 3.67Å; N877-Y897 HydrophobicContact CB-CG 3.95Å; C892-Y897 WeakPolarHBondContact CB-O 3.49Å; S895-Y897 PolarHBondContact O-N 3.24Å; S895-Y897 PolarHBondContact OG-N 3.05Å; S895-Y897 PolarHBondContact OG-O 3.47Å; Y897-C902 VanDerWaalsContact CB-O 3.28Å; Y897-C902 WeakPolarHBondContact CB-O 3.31Å; Y897-N904 CarbonylContact C-O 3.57Å; Y897-N904 WeakPolarHBondContact CA-O 3.29Å; Y897-N904 WeakPolarHBondContact CB-O 3.33Å; Y897-E905 HydrophobicContact CD1-CB 4.22Å; Y897-E905 HydrophobicContact CE1-CB 4.11Å; Y897-E905 HydrophobicContact CE1-CG 4.27Å
898	D	86.4	Confident	84.4	Confident	95 Å²	95	54.1 Å²	54.1	51%	0.508	32%	0.317	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	-175.4	175.6	-161	6.2	0	0	0	110.7	C902 S903 N904 I906	D898-C902 CarbonylContact O-C 3.53Å; D898-C902 WeakPolarHBondContact O-CA 3.32Å; D898-S903 PolarHBondContact O-N 2.77Å; D898-N904 PolarHBondContact N-O 3.29Å; D898-N904 WeakPolarHBondContact O-CB 3.48Å; D898-N904 PolarHBondContact O-N 3.31Å; D898-I906 HydrophobicContact CB-CD1 3.78Å; D898-I906 HydrophobicContact CB-CG1 3.76Å
899	G	83.9	Confident	84.3	Confident	14 Å²	14	63.4 Å²	63.4	14%	0.144	35%	0.352	C	S	.	.	T	Hydrogen-bonded Turn	trans	91.7	174.8	176	0	0	0	0	0	112.8	C892 F901 C902	C892-G899 PolarHBondContact SG-O 3Å; C892-G899 VanDerWaalsContact SG-O 3.4Å; G899-F901 PolarHBondContact O-N 2.85Å; G899-C902 PolarHBondContact O-N 3.21Å; G899-C902 VanDerWaalsContact O-N 3.08Å
900	P	85.8	Confident	84	Confident	28 Å²	28	67.8 Å²	67.8	18%	0.182	37%	0.369	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62.1	-20.1	-169.7	28.6	-39.6	0	0	0	114.2	M531 C890	M531-P900 WeakPolarHBondContact O-CG 3.38Å; C890-P900 WeakPolarHBondContact CB-O 3.44Å; C890-P900 PolarHBondContact SG-O 3.33Å; C890-P900 VanDerWaalsContact SG-O 3.36Å
901	F	89.6	Confident	83.6	Confident	21 Å²	21	69 Å²	69	9%	0.092	38%	0.381	C	S	.	.	T	Hydrogen-bonded Turn	trans	-125.3	15.6	-177.5	-57.6	-57.2	0	0	0	112.6	K503 L874 R876 G899 S903	K503-F901 HydrophobicContact CG-CZ 3.73Å; K503-F901 WeakPolarHBondContact O-CZ 3.32Å; L874-F901 HydrophobicContact CB-CD1 3.83Å; L874-F901 HydrophobicContact CB-CE1 3.98Å; L874-F901 HydrophobicContact CD1-CE1 4.09Å; L874-F901 WeakPolarHBondContact O-CB 3.31Å; R876-F901 WeakPolarHBondContact CB-O 3.4Å; R876-F901 PolarHBondContact N-O 3.35Å; G899-F901 PolarHBondContact O-N 2.85Å; F901-S903 VanDerWaalsContact C-N 3.28Å; F901-S903 PolarHBondContact O-N 2.97Å; F901-S903 PolarHBondContact O-OG 3.12Å; F901-S903 VanDerWaalsContact O-OG 3.13Å
902	C	89.9	Confident	83	Confident	0 Å²	0	73.2 Å²	73.2	0%	0	41%	0.407	C	S	.	.	T	Hydrogen-bonded Turn	trans	49.9	47.4	-174.6	-47.9	0	0	0	0	112.6	R876 N877 C890 C892 Y897 D898 G899	R876-C902 WeakPolarHBondContact O-CB 3.49Å; N877-C902 PolarHBondContact ND2-O 3.13Å; C890-C902 VanDerWaalsContact CB-SG 3.55Å; C892-C902 WeakPolarHBondContact CA-SG 3.49Å; C892-C902 HydrophobicContact CB-CB 3.82Å; C892-C902 WeakPolarHBondContact CB-SG 3.32Å; C892-C902 WeakPolarHBondContact SG-CA 3.25Å; C892-C902 WeakPolarHBondContact SG-CB 3.46Å; C892-C902 CovalentContact SG-SG 2.04Å; C892-C902 PolarHBondContact SG-SG 3.02Å; Y897-C902 VanDerWaalsContact CB-O 3.28Å; Y897-C902 WeakPolarHBondContact CB-O 3.31Å; D898-C902 CarbonylContact O-C 3.53Å; D898-C902 WeakPolarHBondContact O-CA 3.32Å; G899-C902 PolarHBondContact O-N 3.21Å; G899-C902 VanDerWaalsContact O-N 3.08Å
903	S	87.4	Confident	82.7	Confident	49 Å²	49	76.5 Å²	76.5	34%	0.343	44%	0.444	S	S	.	.			trans	-118.9	-12.9	-173.7	-63.4	0	0	0	0	113.4	D898 F901	D898-S903 PolarHBondContact O-N 2.77Å; F901-S903 VanDerWaalsContact C-N 3.28Å; F901-S903 PolarHBondContact O-N 2.97Å; F901-S903 PolarHBondContact O-OG 3.12Å; F901-S903 VanDerWaalsContact O-OG 3.13Å
904	N	84.4	Confident	82.7	Confident	96 Å²	96	76.1 Å²	76.1	51%	0.513	44%	0.436	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.7	120.4	177.8	-58.9	-15.4	0	0	0	108	Y897 D898 I906	Y897-N904 CarbonylContact C-O 3.57Å; Y897-N904 WeakPolarHBondContact CA-O 3.29Å; Y897-N904 WeakPolarHBondContact CB-O 3.33Å; D898-N904 PolarHBondContact N-O 3.29Å; D898-N904 WeakPolarHBondContact O-CB 3.48Å; D898-N904 PolarHBondContact O-N 3.31Å; N904-I906 PolarHBondContact O-N 3.03Å
905	E	80.3	Confident	83	Confident	134 Å²	134	74.3 Å²	74.3	63%	0.626	44%	0.441	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-68.3	128.1	-179.5	-170.2	-177.7	163.6	0	0	110.9	Y897 S907	Y897-E905 HydrophobicContact CD1-CB 4.22Å; Y897-E905 HydrophobicContact CE1-CB 4.11Å; Y897-E905 HydrophobicContact CE1-CG 4.27Å; E905-S907 VanDerWaalsContact OE1-CB 3.26Å; E905-S907 WeakPolarHBondContact OE1-CB 3.19Å; E905-S907 PolarHBondContact OE1-OG 2.63Å
906	I	78.2	Confident	83.2	Confident	109 Å²	109	80.5 Å²	80.5	56%	0.559	47%	0.47	S	S	*	.			trans	-94.2	93.1	167.4	-50	174.8	0	0	0	106.5	A896 D898 N904	A896-I906 PolarHBondContact O-N 2.97Å; D898-I906 HydrophobicContact CB-CD1 3.78Å; D898-I906 HydrophobicContact CB-CG1 3.76Å; N904-I906 PolarHBondContact O-N 3.03Å
907	S	76.1	Confident	83.4	Confident	84 Å²	84	83.6 Å²	83.6	59%	0.587	49%	0.485	S	S	*	.			trans	-125.1	148.3	-179.9	58.3	0	0	0	0	112.5	E905	E905-S907 VanDerWaalsContact OE1-CB 3.26Å; E905-S907 WeakPolarHBondContact OE1-CB 3.19Å; E905-S907 PolarHBondContact OE1-OG 2.63Å
908	A	76.9	Confident	83	Confident	70 Å²	70	88.4 Å²	88.4	58%	0.579	50%	0.504	S	S	*	.			trans	-125.8	134	171.6	0	0	0	0	0	108.4	F910	A908-F910 HydrophobicContact CB-CD2 4.43Å; A908-F910 HydrophobicContact CB-CE2 3.71Å; A908-F910 HydrophobicContact CB-CZ 4.17Å
909	Y	81.9	Confident	82.7	Confident	211 Å²	211	91.2 Å²	91.2	83%	0.827	51%	0.514	S	S	*	.			trans	-93.4	124.1	174.9	176.4	-95.7	0	0	0	109.9	A911	Y909-A911 HydrophobicContact CE1-CB 4.15Å
910	F	81.8	Confident	82.1	Confident	110 Å²	110	97.9 Å²	97.9	48%	0.482	54%	0.539	S	S	.	.			trans	-106.3	115	176.7	-67.8	-90.7	0	0	0	110.1	A908 M916	A908-F910 HydrophobicContact CB-CD2 4.43Å; A908-F910 HydrophobicContact CB-CE2 3.71Å; A908-F910 HydrophobicContact CB-CZ 4.17Å; F910-M916 HydrophobicContact CE1-CB 3.85Å; F910-M916 HydrophobicContact CZ-CB 4.07Å
911	A	80.8	Confident	80.8	Confident	45 Å²	45	104.5 Å²	104.5	37%	0.372	57%	0.568	S	S	.	*			trans	-73.8	167.2	168.8	0	0	0	0	0	110.7	Y909 G913 S914	Y909-A911 HydrophobicContact CE1-CB 4.15Å; A911-G913 PolarHBondContact O-N 2.59Å; A911-S914 WeakPolarHBondContact O-CB 3.18Å; A911-S914 PolarHBondContact O-N 3.46Å; A911-S914 VanDerWaalsContact O-N 3.11Å; A911-S914 PolarHBondContact O-OG 2.86Å
912	T	79.7	Confident	79	Confident	112 Å²	112	111.1 Å²	111.1	69%	0.687	60%	0.599	S	S	*	*	T	Hydrogen-bonded Turn	trans	-61.8	125.3	178.7	-52.2	0	0	0	0	110	R956	T912-R956 PolarHBondContact OG1-NH1 3.04Å
913	G	82.4	Confident	76.6	Confident	83 Å²	83	119.2 Å²	119.2	86%	0.856	64%	0.636	S	S	*	*	T	Hydrogen-bonded Turn	trans	86.7	-0.2	-179	0	0	0	0	0	115	A911	A911-G913 PolarHBondContact O-N 2.59Å
914	S	85.8	Confident	74.2	Confident	69 Å²	69	126.6 Å²	126.6	48%	0.483	66%	0.658	S	S	.	*			trans	-87.2	139.2	174.7	-54.1	0	0	0	0	111.6	A911	A911-S914 WeakPolarHBondContact O-CB 3.18Å; A911-S914 PolarHBondContact O-N 3.46Å; A911-S914 VanDerWaalsContact O-N 3.11Å; A911-S914 PolarHBondContact O-OG 2.86Å
915	S	85.9	Confident	71.7	Confident	102 Å²	102	128.7 Å²	128.7	71%	0.713	67%	0.674	S	S	*	*			trans	-139.9	147	174.7	58.5	0	0	0	0	110.8
916	M	83.5	Confident	69.6	Low	152 Å²	152	130 Å²	130	75%	0.749	69%	0.685	S	S	*	*			trans	-109.6	130.8	169.8	-179.2	175.7	-178.7	0	0	108.4	F910	F910-M916 HydrophobicContact CE1-CB 3.85Å; F910-M916 HydrophobicContact CZ-CB 4.07Å
917	T	83.8	Confident	67.4	Low	97 Å²	97	130 Å²	130	60%	0.595	70%	0.695	S	S	*	*			trans	-120.4	127.6	180	-49.4	0	0	0	0	108.5
918	Y	78.1	Confident	65.7	Low	176 Å²	176	134.7 Å²	134.7	69%	0.69	71%	0.707	S	S	*	*			trans	-107.5	124.1	172.8	-176	-98.3	0	0	0	108.3	F920	Y918-F920 HydrophobicContact CD1-CD1 4.4Å; Y918-F920 HydrophobicContact CD1-CE1 4.34Å; Y918-F920 HydrophobicContact CE1-CD1 4.04Å; Y918-F920 HydrophobicContact CE1-CE1 4.16Å
919	H	79.8	Confident	63.5	Low	153 Å²	153	138.9 Å²	138.9	71%	0.708	72%	0.72	S	S	*	*			trans	-97.8	120.9	177.7	-66.8	-76.6	0	0	0	109.3	Q921	H919-Q921 PolarHBondContact O-N 2.95Å
920	F	71.8	Confident	61.1	Low	154 Å²	154	134.2 Å²	134.2	68%	0.675	72%	0.718	S	S	*	*			trans	-68	124.4	172.9	-65.5	-81.5	0	0	0	109.4	Y918 E922	Y918-F920 HydrophobicContact CD1-CD1 4.4Å; Y918-F920 HydrophobicContact CD1-CE1 4.34Å; Y918-F920 HydrophobicContact CE1-CD1 4.04Å; Y918-F920 HydrophobicContact CE1-CE1 4.16Å; F920-E922 PolarHBondContact O-N 3.37Å
921	Q	59.3	Low	58.8	Low	167 Å²	167	134 Å²	134	78%	0.78	73%	0.73	S	S	*	*			trans	-88.6	105.3	-177.2	-142.8	175.8	1.3	0	0	109.5	H919 H923	H919-Q921 PolarHBondContact O-N 2.95Å; Q921-H923 PolarHBondContact O-N 2.82Å; Q921-H923 PolarHBondContact O-ND1 3.07Å
922	E	51.4	Low	56.6	Low	160 Å²	160	137 Å²	137	75%	0.748	75%	0.748	S	S	*	*			trans	-64.3	115.8	169.8	-74.2	-174.2	159.7	0	0	109.5	F920 Y924	F920-E922 PolarHBondContact O-N 3.37Å; E922-Y924 PolarHBondContact O-N 3.08Å; E922-Y924 VanDerWaalsContact O-N 3.11Å
923	H	38.7	Very low	54.6	Low	171 Å²	171	139.9 Å²	139.9	79%	0.792	76%	0.759	S	S	*	*			trans	-74.7	100.1	175.3	-81.8	50.7	0	0	0	109.8	Q921	Q921-H923 PolarHBondContact O-N 2.82Å; Q921-H923 PolarHBondContact O-ND1 3.07Å
924	Y	37	Very low	52.1	Low	204 Å²	204	142.9 Å²	142.9	80%	0.8	76%	0.76	S	S	*	*	P	Polyproline II helix	trans	-75	122	164.4	-95.4	-92.1	0	0	0	110.3	E922 L926	E922-Y924 PolarHBondContact O-N 3.08Å; E922-Y924 VanDerWaalsContact O-N 3.11Å; Y924-L926 PolarHBondContact O-N 3.17Å
925	T	33.5	Very low	49.5	Very low	139 Å²	139	145.1 Å²	145.1	85%	0.853	78%	0.776	S	S	*	*	P	Polyproline II helix	trans	-67.6	122.2	170.4	47.2	0	0	0	0	110.8
926	L	34.9	Very low	47	Very low	163 Å²	163	144.9 Å²	144.9	85%	0.853	77%	0.774	S	S	*	*	P	Polyproline II helix	trans	-100.4	122.1	172.2	-98.9	159.4	0	0	0	111.7	Y924	Y924-L926 PolarHBondContact O-N 3.17Å
927	S	32.2	Very low	44.6	Very low	108 Å²	108	145.2 Å²	145.2	76%	0.755	78%	0.778	S	S	*	*			trans	52.9	118.6	155.8	76.4	0	0	0	0	121
928	E	39.9	Very low	42.2	Very low	183 Å²	183	150.2 Å²	150.2	86%	0.855	79%	0.794	S	S	*	*			trans	-49	125.9	156.3	-65.1	176.6	135.5	0	0	112.9
929	N	31.7	Very low	40	Very low	158 Å²	158	152.1 Å²	152.1	85%	0.845	80%	0.8	S	S	*	*				-175.1	138.3	123.6	-97.7	-32.9	0	0	0	112.3
930	S	31.2	Very low	37.8	Very low	112 Å²	112	152.1 Å²	152.1	78%	0.783	81%	0.805	S	S	*	*	S	Bend	trans	89.7	90.3	169.8	75.1	0	0	0	0	120
931	S	32.7	Very low	36.2	Very low	106 Å²	106	150.2 Å²	150.2	74%	0.741	81%	0.806	S	S	*	*			trans	56.5	90.4	132.6	58.5	0	0	0	0	121.4
932	S	35.4	Very low	35.4	Very low	108 Å²	108	147.5 Å²	147.5	76%	0.755	80%	0.801	S	S	*	*				35.5	104.1	124.7	65.6	0	0	0	0	120.6
933	L	37.9	Very low	35.3	Very low	172 Å²	172	145.4 Å²	145.4	90%	0.901	80%	0.795	S	S	*	*				-178.6	62.4	117.1	-97.2	160.9	0	0	0	112.1
934	V	29.3	Very low	36	Very low	146 Å²	146	143.8 Å²	143.8	89%	0.885	80%	0.797	S	S	*	*			trans	-144.7	79.4	153.2	-171.7	0	0	0	0	108.7
935	S	31.1	Very low	36.7	Very low	116 Å²	116	144 Å²	144	81%	0.811	80%	0.796	S	S	*	*			trans	-89.9	100.6	162.7	152.5	0	0	0	0	107.7
936	S	33.6	Very low	38.1	Very low	97 Å²	97	142.9 Å²	142.9	68%	0.678	78%	0.781	S	S	*	*			trans	161.3	98.1	138.4	46	0	0	0	0	110.1
937	L	33.3	Very low	39.5	Very low	159 Å²	159	141.5 Å²	141.5	83%	0.832	77%	0.772	S	S	*	*			trans	171	58.5	145.8	-89.3	158.2	0	0	0	108.2	R939	L937-R939 PolarHBondContact O-N 2.89Å
938	H	33.8	Very low	41.2	Very low	202 Å²	202	141 Å²	141	94%	0.935	76%	0.76	S	S	*	*			trans	-80.2	102.9	153.9	-85.1	21.3	0	0	0	106.6
939	R	31.2	Very low	42.6	Very low	216 Å²	216	136.8 Å²	136.8	82%	0.815	75%	0.747	S	S	*	*			trans	-102.2	110.6	159.5	-105.1	-176.3	173.9	179.8	-1.4	106.5	L937 V941	L937-R939 PolarHBondContact O-N 2.89Å; R939-V941 PolarHBondContact O-N 3.36Å; R939-V941 VanDerWaalsContact O-N 3.09Å
940	D	34.1	Very low	44.5	Very low	153 Å²	153	133.2 Å²	133.2	82%	0.818	73%	0.727	S	S	*	*			trans	-48.7	113.1	152.3	-83.3	-38.9	0	0	0	107.6	T942	D940-T942 PolarHBondContact O-N 3.35Å
941	V	38.3	Very low	46.5	Very low	114 Å²	114	132.6 Å²	132.6	69%	0.691	72%	0.723	S	S	*	*			trans	-83.7	74.8	171.9	-178.9	0	0	0	0	106.8	R939 L943	R939-V941 PolarHBondContact O-N 3.36Å; R939-V941 VanDerWaalsContact O-N 3.09Å; V941-L943 HydrophobicContact CG1-CD2 4.37Å; V941-L943 HydrophobicContact CG1-CG 3.93Å; V941-L943 PolarHBondContact O-N 2.78Å; V941-L943 VanDerWaalsContact O-N 3.15Å
942	T	42.9	Very low	48.8	Very low	110 Å²	110	133.6 Å²	133.6	68%	0.675	71%	0.714	S	S	*	*			trans	-70.5	100.6	155	48.4	0	0	0	0	106.5	D940 T944	D940-T942 PolarHBondContact O-N 3.35Å; T942-T944 PolarHBondContact O-N 3.35Å
943	L	49.3	Very low	51.1	Low	117 Å²	117	140.1 Å²	140.1	61%	0.613	72%	0.722	S	S	*	*			trans	-62.5	95.3	173.1	-81.1	153.9	0	0	0	108.5	V941 R945 E946	V941-L943 HydrophobicContact CG1-CD2 4.37Å; V941-L943 HydrophobicContact CG1-CG 3.93Å; V941-L943 PolarHBondContact O-N 2.78Å; V941-L943 VanDerWaalsContact O-N 3.15Å; L943-R945 PolarHBondContact O-N 2.89Å; L943-E946 HydrophobicContact CB-CG 4.46Å
944	T	52.3	Low	53.3	Low	136 Å²	136	135 Å²	135	83%	0.834	70%	0.698	S	S	*	*			trans	-75.9	-9.2	-178.5	48.2	0	0	0	0	113.2	T942	T942-T944 PolarHBondContact O-N 3.35Å
945	R	51.8	Low	55.9	Low	209 Å²	209	134.6 Å²	134.6	79%	0.789	70%	0.696	S	S	*	*			trans	-162	120.4	178.7	-159.2	173.5	179.5	-177	-0.5	111.5	L943	L943-R945 PolarHBondContact O-N 2.89Å
946	E	64.2	Low	58.2	Low	115 Å²	115	136.2 Å²	136.2	54%	0.537	69%	0.685	S	S	.	*			trans	-103.3	136.7	170.2	-63.3	-174	166.7	0	0	109.7	L943	L943-E946 HydrophobicContact CB-CG 4.46Å
947	M	62.4	Low	60.4	Low	135 Å²	135	138 Å²	138	67%	0.665	69%	0.692	S	S	*	*			trans	-125	118.5	176	-176.5	178.4	-70.8	0	0	108.2
948	I	69.5	Low	62.8	Low	96 Å²	96	136.8 Å²	136.8	49%	0.492	69%	0.693	S	S	.	*			trans	-122.4	123.1	-178.8	-62.6	172	0	0	0	107.8	L962 F964	I948-L962 HydrophobicContact CG2-CD2 4.03Å; I948-F964 HydrophobicContact CD1-CE1 3.7Å; I948-F964 HydrophobicContact CD1-CE2 4.34Å; I948-F964 HydrophobicContact CD1-CZ 3.26Å
949	T	67.9	Low	65.2	Low	95 Å²	95	130 Å²	130	58%	0.583	67%	0.668	S	S	*	*			trans	-115.2	122.4	-179.5	-52.4	0	0	0	0	108.1
950	L	72.6	Confident	67.7	Low	84 Å²	84	126.5 Å²	126.5	44%	0.44	67%	0.665	S	S	.	*			trans	-135.5	143.5	175.1	71	93.4	0	0	0	110.4	F952 L962	L950-F952 HydrophobicContact CD1-CB 4.32Å; L950-F952 HydrophobicContact CD1-CD1 3.84Å; L950-F952 HydrophobicContact CD1-CG 4.48Å; L950-L962 HydrophobicContact CD2-CB 4.25Å; L950-L962 HydrophobicContact CD2-CD2 4.01Å
951	S	73.1	Confident	70.1	Confident	99 Å²	99	123.4 Å²	123.4	69%	0.692	65%	0.648	S	S	*	*			trans	-113.3	136	171.1	-67.8	0	0	0	0	108.3
952	F	81.4	Confident	72.4	Confident	127 Å²	127	122 Å²	122	56%	0.557	64%	0.637	S	S	*	*			trans	-140.5	156.3	-179.3	74.5	-81.7	0	0	0	111.9	L950 T954 L961	L950-F952 HydrophobicContact CD1-CB 4.32Å; L950-F952 HydrophobicContact CD1-CD1 3.84Å; L950-F952 HydrophobicContact CD1-CG 4.48Å; F952-T954 HydrophobicContact CD2-CG2 4.08Å; F952-T954 HydrophobicContact CE2-CG2 3.84Å; F952-L961 HydrophobicContact CB-CD1 4.42Å; F952-L961 HydrophobicContact CB-CD2 4.37Å; F952-L961 HydrophobicContact CD1-CD1 3.44Å; F952-L961 VanDerWaalsContact CD1-CD1 3.44Å; F952-L961 HydrophobicContact CD2-CD1 3.58Å; F952-L961 HydrophobicContact CD2-CD2 3.86Å; F952-L961 HydrophobicContact CD2-CG 4.39Å; F952-L961 HydrophobicContact CE1-CD1 3.4Å; F952-L961 VanDerWaalsContact CE1-CD1 3.4Å; F952-L961 HydrophobicContact CE2-CD1 3.55Å; F952-L961 HydrophobicContact CE2-CD2 4.38Å; F952-L961 HydrophobicContact CG-CD1 3.54Å; F952-L961 HydrophobicContact CG-CD2 4.1Å; F952-L961 HydrophobicContact CG-CG 4.47Å; F952-L961 HydrophobicContact CZ-CD1 3.46Å; F952-L961 VanDerWaalsContact CZ-CD1 3.46Å
953	R	82.4	Confident	74.4	Confident	244 Å²	244	124.2 Å²	124.2	92%	0.921	64%	0.637	S	S	*	*			trans	-133.9	122.3	170.3	179.7	178.7	169.5	-175.2	-3.5	108.4
954	T	84.2	Confident	75.8	Confident	65 Å²	65	124.2 Å²	124.2	40%	0.399	63%	0.632	S	S	.	*			trans	-132.9	150	178.5	-175.4	0	0	0	0	111	F952 R956	F952-T954 HydrophobicContact CD2-CG2 4.08Å; F952-T954 HydrophobicContact CE2-CG2 3.84Å; T954-R956 PolarHBondContact OG1-N 3.1Å; T954-R956 VanDerWaalsContact OG1-N 3.15Å; T954-R956 PolarHBondContact OG1-O 3.23Å
955	T	85.2	Confident	76.7	Confident	138 Å²	138	121.5 Å²	121.5	85%	0.847	62%	0.623	S	S	*	*	S	Bend	trans	-105.5	0.8	171.6	54.8	0	0	0	0	112.5
956	R	78.4	Confident	77	Confident	149 Å²	149	123.1 Å²	123.1	56%	0.562	65%	0.647	S	S	*	*	S	Bend	trans	-116.6	141.1	-176.8	-69	-173	169.4	-176.9	2.3	111.6	T912 T954 S959	T912-R956 PolarHBondContact OG1-NH1 3.04Å; T954-R956 PolarHBondContact OG1-N 3.1Å; T954-R956 VanDerWaalsContact OG1-N 3.15Å; T954-R956 PolarHBondContact OG1-O 3.23Å; R956-S959 PolarHBondContact O-OG 3.26Å; R956-S959 VanDerWaalsContact O-OG 3.06Å
957	T	81.1	Confident	77.7	Confident	135 Å²	135	123.5 Å²	123.5	83%	0.828	65%	0.653	S	S	*	*	S	Bend	trans	-137.9	129.9	176.6	48.6	0	0	0	0	110.1
958	P	83.7	Confident	78.5	Confident	134 Å²	134	122.9 Å²	122.9	87%	0.87	65%	0.652	S	S	*	*	S	Bend	cis	-76.4	158.9	-3.7	32.7	-34.5	0	0	0	113.2
959	S	83.1	Confident	79	Confident	58 Å²	58	124.4 Å²	124.4	41%	0.406	66%	0.661	S	S	.	*			trans	-141.1	131.1	173.1	-70	0	0	0	0	110.1	R956	R956-S959 PolarHBondContact O-OG 3.26Å; R956-S959 VanDerWaalsContact O-OG 3.06Å
960	L	84.8	Confident	79.6	Confident	143 Å²	143	126.1 Å²	126.1	75%	0.749	67%	0.666	S	S	*	*			trans	-85.9	121	174	-178.7	68.3	0	0	0	108.9	K963	L960-K963 HydrophobicContact CD2-CB 4.37Å
961	L	84.5	Confident	80.1	Confident	89 Å²	89	128.8 Å²	128.8	47%	0.466	68%	0.68	S	S	.	*			trans	-102.1	-36.5	-173.7	-60	172.7	0	0	0	113.5	F952	F952-L961 HydrophobicContact CB-CD1 4.42Å; F952-L961 HydrophobicContact CB-CD2 4.37Å; F952-L961 HydrophobicContact CD1-CD1 3.44Å; F952-L961 VanDerWaalsContact CD1-CD1 3.44Å; F952-L961 HydrophobicContact CD2-CD1 3.58Å; F952-L961 HydrophobicContact CD2-CD2 3.86Å; F952-L961 HydrophobicContact CD2-CG 4.39Å; F952-L961 HydrophobicContact CE1-CD1 3.4Å; F952-L961 VanDerWaalsContact CE1-CD1 3.4Å; F952-L961 HydrophobicContact CE2-CD1 3.55Å; F952-L961 HydrophobicContact CE2-CD2 4.38Å; F952-L961 HydrophobicContact CG-CD1 3.54Å; F952-L961 HydrophobicContact CG-CD2 4.1Å; F952-L961 HydrophobicContact CG-CG 4.47Å; F952-L961 HydrophobicContact CZ-CD1 3.46Å; F952-L961 VanDerWaalsContact CZ-CD1 3.46Å
962	L	85.5	Confident	80.6	Confident	85 Å²	85	130.7 Å²	130.7	45%	0.445	68%	0.679	S	S	.	*			trans	-149.7	138.7	-179.7	-173.5	65.5	0	0	0	109	I948 L950 F964	I948-L962 HydrophobicContact CG2-CD2 4.03Å; L950-L962 HydrophobicContact CD2-CB 4.25Å; L950-L962 HydrophobicContact CD2-CD2 4.01Å; L962-F964 HydrophobicContact CD2-CE2 3.64Å; L962-F964 HydrophobicContact CD2-CZ 3.59Å; L962-F964 HydrophobicContact CG-CE2 3.92Å; L962-F964 HydrophobicContact CG-CZ 4.03Å
963	K	84.3	Confident	80.5	Confident	155 Å²	155	131 Å²	131	67%	0.674	69%	0.688	S	S	*	*			trans	-136.9	128.9	175	-179.2	-174.5	176.1	-169.2	0	108.8	L960	L960-K963 HydrophobicContact CD2-CB 4.37Å
964	F	78.9	Confident	80.4	Confident	118 Å²	118	122.3 Å²	122.3	52%	0.518	67%	0.67	S	S	.	*			trans	-90.9	134	164.3	-60.7	-85	0	0	0	108	I948 L962	I948-F964 HydrophobicContact CD1-CE1 3.7Å; I948-F964 HydrophobicContact CD1-CE2 4.34Å; I948-F964 HydrophobicContact CD1-CZ 3.26Å; L962-F964 HydrophobicContact CD2-CE2 3.64Å; L962-F964 HydrophobicContact CD2-CZ 3.59Å; L962-F964 HydrophobicContact CG-CE2 3.92Å; L962-F964 HydrophobicContact CG-CZ 4.03Å
965	A	71.4	Confident	80	Confident	79 Å²	79	127.1 Å²	127.1	65%	0.653	69%	0.693	S	S	*	*			trans	-131.4	127.1	173.9	0	0	0	0	0	106.6
966	D	59.6	Low	79.6	Confident	242 Å²	242	126.1 Å²	126.1	100%	1.294	68%	0.679	S	S	*	*			trans	-76.1	0	172.8	-64.6	-31	0	0	0	111.1

Retrieved 966 of 966 residues in 5823.4 ms (Link to these results)

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