A0A5K4FC39_SCHMA Loading...

Helicase, putative

AlphaFold DB , UniProt , Accession A0A5K4FC39, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 1,051 aa.

						>A0A5K4FC39_SCHMA|A0A5K4FC39
MEFLDINLDEVASAFHEAKRFGKRCKEAPDGSIEVKRCLKKFPKFQTYVLLSGSGCIHEVVYPADCALNELKNLAHPARNYPFTLDPFQQRAILCIENEQSVMVSAHTSAGKTVVAEYAVAKSLNQNQRVIYTTPIKALSNQKFREFSEIFKDVGLMTGDITINQEATVLIMTTEILRSMLYRSSDVTREVGWVIFDEIHYMREKERGVIWEETIILLPDSVGLVFLSATIPNAREFAEWIVFLHRKPCHVVYTDCRPVPLQHYVYPCGGDGIHLVVNQNREFIESNFNLALNTLQNAAGNSISDTKSRGRNGGSTRPQPYCSKLVKLVMDQNLEPLIVFSFSKMDCEFYAMQLNKMDFSTESEKAAIELVFNNAIESLSVDDRNLPQVQILLPVLRRGIGIHHGGLLPILKEIVEVLFAEGFIKVLYATETFAMGLNMPARSVLFTSTRKFDGRDFRLLSPGEYIQMSGRAGRRGKDTRGTVIMMLDDRISADEARRLLLGEPDRLDSSFYLTNNMILNLLRVEDINPEIMLVKNFQQFQCRSELPYLEKRLNDTESLIKNICFPEDIDMGQLGAYVKLHHAVAVCEAERWALVSQRKSVIPFFQAGRVVRIRNLDDWDFGWGIVVHVDRSDSPITHSGHQKSNRMSVICLMEVAEDHILRNSDSTRKPIPFSFVKPADGVDFQTDTFTSVIQLVSVPLDCLSGISSVCLKLNSLLECDNQNTEQLCNKLSVQPDHVKRRIWEGVDRAKAKLGGILPVLDPIKDLNIKDDRVKQQCEAINLLKARMAMNPISKRADLDSLIDRFNWKASNLRKLEDIRERISRTDSLSHFDELRARKRLLRRLCFCSEDDTVALKGRIACEISTGDELMLTELLLDGFFSQFSPVQLAGVMSCFVAEKQTKHHMINLSPVMKKAIKTIHDKARYLAKMSAECNINTGHSNSEKQLTTLVQNLENNRNNLLDDEQAYVDRFVGDLMDVVCAWAEGVSFSRLCELTSAFEGSVIRCIRRLEELLCQMHNAAKVAGNSELENKFLEAVILIKRDIIFCASLYL
					

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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	37.9	Very low	31.5	Very low	245 Å²	245	154.2 Å²	154.2	100%	1.207	78%	0.777	S	S	*	*				0	57.3	0	-78	-155	-80.5	0	0	110.4
2	E	25.5	Very low	31.6	Very low	181 Å²	181	146.7 Å²	146.7	85%	0.846	76%	0.756	S	S	*	*			trans	-151.5	8.1	176.9	-117.5	176	-160.8	0	0	115.1
3	F	30.4	Very low	31.4	Very low	203 Å²	203	140.8 Å²	140.8	89%	0.89	74%	0.736	S	S	*	*	S	Bend	trans	-125	22.4	-174	-81.1	-80.9	0	0	0	114.8
4	L	28.9	Very low	31.2	Very low	174 Å²	174	136.5 Å²	136.5	91%	0.911	73%	0.731	S	S	*	*			trans	-122.3	78.3	169.5	-88.1	162	0	0	0	108.2
5	D	27.4	Very low	31.3	Very low	152 Å²	152	139.9 Å²	139.9	81%	0.813	74%	0.737	S	S	*	*			trans	-152.9	149.1	164.6	-122	-14.3	0	0	0	109.2
6	I	29.5	Very low	31.3	Very low	149 Å²	149	141.5 Å²	141.5	76%	0.764	74%	0.739	S	S	*	*			trans	95	86.9	161	-53.3	151.9	0	0	0	116.4
7	N	34.2	Very low	31.1	Very low	95 Å²	95	141.6 Å²	141.6	51%	0.508	74%	0.735	S	S	.	*				99.1	96.1	106.9	-149	-3.6	0	0	0	118.8	D9	N7-D9 VanDerWaalsContact C-N 3.28Å; N7-D9 PolarHBondContact O-N 2.74Å; N7-D9 WeakPolarHBondContact OD1-CB 3.28Å; N7-D9 PolarHBondContact OD1-N 3.16Å
8	L	33.8	Very low	31.1	Very low	125 Å²	125	139.8 Å²	139.8	65%	0.654	74%	0.744	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73.1	-10.2	176.5	-84.3	138.6	0	0	0	114.2
9	D	33.8	Very low	31.1	Very low	120 Å²	120	143.1 Å²	143.1	64%	0.642	75%	0.751	S	S	*	*	H	α-helix	trans	-76.7	-23.8	-177.9	-70.7	-27.7	0	0	0	113.4	N7 V11 A12 S13	N7-D9 VanDerWaalsContact C-N 3.28Å; N7-D9 PolarHBondContact O-N 2.74Å; N7-D9 WeakPolarHBondContact OD1-CB 3.28Å; N7-D9 PolarHBondContact OD1-N 3.16Å; D9-V11 VanDerWaalsContact C-N 3.34Å; D9-V11 PolarHBondContact O-N 2.89Å; D9-A12 PolarHBondContact O-N 2.97Å; D9-S13 PolarHBondContact O-N 3.08Å
10	E	31	Very low	30.8	Very low	156 Å²	156	146 Å²	146	73%	0.729	75%	0.752	S	S	*	*	H	α-helix	trans	-71.1	-29.2	176.6	-76	-170.7	159.5	0	0	112.8
11	V	34.2	Very low	30.6	Very low	96 Å²	96	149 Å²	149	58%	0.582	76%	0.759	S	S	*	*	H	α-helix	trans	-76.3	-27.1	178.4	-176.1	0	0	0	0	111.5	D9	D9-V11 VanDerWaalsContact C-N 3.34Å; D9-V11 PolarHBondContact O-N 2.89Å
12	A	31.9	Very low	30	Very low	64 Å²	64	140.6 Å²	140.6	53%	0.529	74%	0.736	S	S	.	*	H	α-helix	trans	-77.1	-31.2	176.3	0	0	0	0	0	112.6	D9 F15	D9-A12 PolarHBondContact O-N 2.97Å; A12-F15 PolarHBondContact O-N 3.24Å
13	S	28.8	Very low	30	Very low	71 Å²	71	140.2 Å²	140.2	50%	0.497	73%	0.732	S	S	.	*	H	α-helix	trans	-65.3	-36.5	175	175.1	0	0	0	0	112.8	D9 F15 H16	D9-S13 PolarHBondContact O-N 3.08Å; S13-F15 PolarHBondContact O-N 3.08Å; S13-H16 PolarHBondContact O-N 3.49Å
14	A	29.9	Very low	29.7	Very low	80 Å²	80	143 Å²	143	66%	0.661	74%	0.736	S	S	*	*	T	Hydrogen-bonded Turn	trans	-62.3	-17.7	179.5	0	0	0	0	0	114.3
15	F	32.6	Very low	29.4	Very low	187 Å²	187	139 Å²	139	82%	0.82	72%	0.722	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.5	-12.8	-178.9	-104.8	-89.5	0	0	0	114.7	A12 S13	A12-F15 PolarHBondContact O-N 3.24Å; S13-F15 PolarHBondContact O-N 3.08Å
16	H	30.4	Very low	29.2	Very low	166 Å²	166	141.6 Å²	141.6	77%	0.769	73%	0.726	S	S	*	*	T	Hydrogen-bonded Turn	trans	-114.7	-14.7	-168.3	-109.8	-67.1	0	0	0	116.7	S13	S13-H16 PolarHBondContact O-N 3.49Å
17	E	28	Very low	28.9	Very low	143 Å²	143	143.7 Å²	143.7	67%	0.668	73%	0.733	S	S	*	*			trans	-105.9	0.1	-169.9	-100.3	-174.4	158.7	0	0	118.1	K19	E17-K19 PolarHBondContact O-N 3.49Å
18	A	32	Very low	28.4	Very low	110 Å²	110	143.3 Å²	143.3	91%	0.909	74%	0.742	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68.9	10.9	171.4	0	0	0	0	0	114.6
19	K	30	Very low	28	Very low	201 Å²	201	142.4 Å²	142.4	87%	0.874	74%	0.744	S	S	*	*	T	Hydrogen-bonded Turn	trans	-93.6	5.6	178.8	-115.2	-178.5	-177	176.9	0	114.8	E17	E17-K19 PolarHBondContact O-N 3.49Å
20	R	24.7	Very low	27.6	Very low	201 Å²	201	143.4 Å²	143.4	76%	0.758	75%	0.749	S	S	*	*			trans	-135	100.8	178.8	-74.7	-178.8	173.6	174.1	-1.5	110.4
21	F	27.1	Very low	27.5	Very low	209 Å²	209	139.4 Å²	139.4	92%	0.917	75%	0.75	S	S	*	*				167.6	63.3	128.2	-100.7	-83.9	0	0	0	111.3
22	G	25.8	Very low	27	Very low	70 Å²	70	140.3 Å²	140.3	72%	0.722	76%	0.761	S	S	*	*			trans	-122.4	111.6	132.1	0	0	0	0	0	105.9
23	K	25.8	Very low	26.8	Very low	173 Å²	173	144.5 Å²	144.5	75%	0.752	77%	0.773	S	S	*	*			trans	171.6	93.3	155.3	-97.4	169.5	-175.6	-169.8	0	112.2	C25	K23-C25 HydrophobicContact CD-CB 4.46Å; K23-C25 HydrophobicContact CG-CB 4.01Å
24	R	23.9	Very low	26.5	Very low	261 Å²	261	147.6 Å²	147.6	99%	0.985	78%	0.78	S	S	*	*				-91.3	93.5	121.6	-90	-177.7	170.1	177.3	-2.3	106.3
25	C	21.8	Very low	26.4	Very low	91 Å²	91	150 Å²	150	62%	0.615	79%	0.786	S	S	*	*	P	Polyproline II helix	trans	-96.2	131.2	160.3	-90.6	0	0	0	0	107.8	K23	K23-C25 HydrophobicContact CD-CB 4.46Å; K23-C25 HydrophobicContact CG-CB 4.01Å
26	K	23.3	Very low	26.1	Very low	205 Å²	205	148.4 Å²	148.4	89%	0.891	78%	0.778	S	S	*	*	P	Polyproline II helix	trans	-69.9	151.2	148.1	-78.8	-178.5	172.5	-178.1	0	108.7
27	E	24.1	Very low	26.5	Very low	194 Å²	194	150.2 Å²	150.2	91%	0.907	78%	0.778	S	S	*	*	P	Polyproline II helix	trans	-51.4	142.7	-179.5	-60.5	159.8	150.4	0	0	114.1
28	A	22.8	Very low	26.4	Very low	86 Å²	86	149.6 Å²	149.6	71%	0.711	79%	0.788	S	S	*	*				178.8	148.5	128.5	0	0	0	0	0	109.5
29	P	25.2	Very low	26.7	Very low	107 Å²	107	148.8 Å²	148.8	70%	0.695	77%	0.768	S	S	*	*			trans	-75	169.8	-173.9	34.6	-34	0	0	0	110.5
30	D	25.8	Very low	27.8	Very low	140 Å²	140	147.5 Å²	147.5	75%	0.749	76%	0.763	S	S	*	*	S	Bend	trans	98.9	116.9	170.2	-38.6	-10.1	0	0	0	112.6
31	G	30.4	Very low	29.5	Very low	72 Å²	72	147.1 Å²	147.1	74%	0.742	77%	0.767	S	S	*	*	S	Bend	trans	-56.3	155.8	173.6	0	0	0	0	0	112
32	S	23.5	Very low	31.5	Very low	116 Å²	116	139.5 Å²	139.5	81%	0.811	73%	0.733	S	S	*	*			trans	86.3	106.3	-168.1	79.8	0	0	0	0	114.2
33	I	26.4	Very low	33.7	Very low	152 Å²	152	138.2 Å²	138.2	78%	0.779	71%	0.712	S	S	*	*			trans	-135	107.8	160.9	-60.9	-178.4	0	0	0	109.3
34	E	23.7	Very low	36.2	Very low	136 Å²	136	137.9 Å²	137.9	64%	0.636	71%	0.711	S	S	*	*			trans	-60.5	141.9	158.2	-66.4	178.1	129.8	0	0	110.6	K36	E34-K36 VanDerWaalsContact OE1-CE 3.24Å; E34-K36 WeakPolarHBondContact OE1-CE 3.41Å; E34-K36 IonicContact OE1-NZ 2.88Å; E34-K36 PolarHBondContact OE1-NZ 2.6Å; E34-K36 IonicContact OE2-NZ 3.83Å; E34-K36 PolarHBondContact OE2-NZ 3.24Å
35	V	26.5	Very low	39	Very low	130 Å²	130	127.5 Å²	127.5	79%	0.788	67%	0.672	S	S	*	*			trans	-114.1	90.2	148.1	-176.2	0	0	0	0	106.3	R37	V35-R37 PolarHBondContact O-N 3.48Å
36	K	27.1	Very low	42	Very low	154 Å²	154	126.8 Å²	126.8	67%	0.67	66%	0.66	S	S	*	*			trans	-61.6	110.8	170.2	-81.1	175.8	168.7	121.8	0	107.6	E34	E34-K36 VanDerWaalsContact OE1-CE 3.24Å; E34-K36 WeakPolarHBondContact OE1-CE 3.41Å; E34-K36 IonicContact OE1-NZ 2.88Å; E34-K36 PolarHBondContact OE1-NZ 2.6Å; E34-K36 IonicContact OE2-NZ 3.83Å; E34-K36 PolarHBondContact OE2-NZ 3.24Å
37	R	38.7	Very low	44.9	Very low	203 Å²	203	119.6 Å²	119.6	77%	0.766	63%	0.633	S	S	*	*				60.9	93.5	58.6	-73.1	-176.2	170.6	171.4	-3.6	113.8	V35	V35-R37 PolarHBondContact O-N 3.48Å
38	C	24.9	Very low	47.9	Very low	130 Å²	130	113.4 Å²	113.4	88%	0.878	60%	0.602	S	S	*	*			trans	-117.2	88.3	134.4	-92.9	0	0	0	0	106.9	K40	C38-K40 PolarHBondContact O-N 3Å; C38-K40 VanDerWaalsContact O-N 3.13Å
39	L	39.9	Very low	50.9	Low	93 Å²	93	114.3 Å²	114.3	49%	0.487	60%	0.599	S	S	.	*			trans	-60.8	111.4	165.7	-72.5	159.3	0	0	0	106.7	K41 D826	L39-K41 PolarHBondContact O-N 3.36Å; L39-K41 VanDerWaalsContact O-N 3.17Å; L39-D826 WeakPolarHBondContact CD2-OD2 3.38Å
40	K	52.8	Low	53.6	Low	175 Å²	175	111 Å²	111	76%	0.761	58%	0.575	S	S	*	*			trans	-69.5	110.5	175.1	-75.4	-175.9	178.4	179.4	0	107.3	C38	C38-K40 PolarHBondContact O-N 3Å; C38-K40 VanDerWaalsContact O-N 3.13Å
41	K	59.9	Low	55.9	Low	193 Å²	193	112 Å²	112	84%	0.839	58%	0.58	S	S	*	*	P	Polyproline II helix	trans	-61.8	142.2	178.7	-69	-179.1	177.1	177.3	0	110.7	L39	L39-K41 PolarHBondContact O-N 3.36Å; L39-K41 VanDerWaalsContact O-N 3.17Å
42	F	69.9	Low	57.7	Low	49 Å²	49	110.3 Å²	110.3	22%	0.215	56%	0.556	C	S	.	*	P	Polyproline II helix	trans	-55.7	136	171.1	-171.2	-105.1	0	0	0	110.3	K44 F45 F540 R543	F42-K44 PolarHBondContact O-N 3.33Å; F42-F45 HydrophobicContact CE1-CD2 4.43Å; F42-F45 AromaticContact CE1-CE2 3.98Å; F42-F45 HydrophobicContact CE1-CE2 3.98Å; F42-F45 HydrophobicContact CZ-CE2 4.24Å; F42-F540 HydrophobicContact CZ-CE2 4.34Å; F42-F540 HydrophobicContact CZ-CZ 4.19Å; F42-R543 HydrophobicContact CD2-CB 3.79Å; F42-R543 WeakPolarHBondContact CD2-O 3.44Å; F42-R543 VanDerWaalsContact CE2-C 3.45Å; F42-R543 HydrophobicContact CE2-CB 3.85Å
43	P	70.7	Confident	59.8	Low	42 Å²	42	106.3 Å²	106.3	27%	0.273	53%	0.533	S	S	.	.	P	Polyproline II helix	trans	-57.5	136.8	175.1	24.6	-34.1	0	0	0	110.1	F45 F243	P43-F45 HydrophobicContact CB-CE1 4.21Å; P43-F45 HydrophobicContact CB-CE2 4.12Å; P43-F45 HydrophobicContact CB-CZ 3.62Å; P43-F45 HydrophobicContact CG-CE2 3.9Å; P43-F45 HydrophobicContact CG-CZ 3.58Å; P43-F45 WeakPolarHBondContact O-CE2 3.32Å; P43-F243 HydrophobicContact CB-CD2 4.31Å; P43-F243 HydrophobicContact CG-CD2 3.89Å; P43-F243 HydrophobicContact CG-CE2 4.3Å
44	K	78	Confident	62	Low	167 Å²	167	104.8 Å²	104.8	73%	0.726	54%	0.536	S	S	*	.	P	Polyproline II helix	trans	-92.1	142.1	176.5	-66.5	-176	177.7	-174.5	0	109.1	F42 A64	F42-K44 PolarHBondContact O-N 3.33Å; K44-A64 HydrophobicContact CB-CB 4Å; K44-A64 VanDerWaalsContact O-CB 3.22Å; K44-A64 WeakPolarHBondContact O-CB 3.2Å; K44-A64 PolarHBondContact O-N 3.38Å
45	F	84.2	Confident	64.5	Low	42 Å²	42	100.5 Å²	100.5	18%	0.184	53%	0.529	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	158	176.3	-52.2	-71.3	0	0	0	109.9	F42 P43 V61 E239 V242 F243 F540	F42-F45 HydrophobicContact CE1-CD2 4.43Å; F42-F45 AromaticContact CE1-CE2 3.98Å; F42-F45 HydrophobicContact CE1-CE2 3.98Å; F42-F45 HydrophobicContact CZ-CE2 4.24Å; P43-F45 HydrophobicContact CB-CE1 4.21Å; P43-F45 HydrophobicContact CB-CE2 4.12Å; P43-F45 HydrophobicContact CB-CZ 3.62Å; P43-F45 HydrophobicContact CG-CE2 3.9Å; P43-F45 HydrophobicContact CG-CZ 3.58Å; P43-F45 WeakPolarHBondContact O-CE2 3.32Å; F45-V61 HydrophobicContact CB-CG1 3.95Å; F45-V61 HydrophobicContact CD1-CG1 4.44Å; F45-V61 HydrophobicContact CG-CG1 4.33Å; F45-E239 HydrophobicContact CD2-CB 4.22Å; F45-E239 HydrophobicContact CD2-CG 4.23Å; F45-E239 HydrophobicContact CE2-CB 4.29Å; F45-E239 HydrophobicContact CG-CG 4.45Å; F45-V242 HydrophobicContact CD1-CB 4.46Å; F45-V242 HydrophobicContact CD1-CG1 3.96Å; F45-V242 HydrophobicContact CE1-CB 4.46Å; F45-V242 HydrophobicContact CE1-CG1 4.14Å; F45-F243 HydrophobicContact CE1-CB 4.2Å; F45-F243 HydrophobicContact CZ-CB 3.96Å; F45-F540 HydrophobicContact CE2-CE2 4.04Å; F45-F540 AromaticContact CE2-CZ 3.87Å; F45-F540 HydrophobicContact CE2-CZ 3.87Å; F45-F540 AromaticContact CZ-CE2 3.91Å; F45-F540 HydrophobicContact CZ-CE2 3.91Å; F45-F540 HydrophobicContact CZ-CZ 4.1Å
46	Q	83.6	Confident	67.4	Low	77 Å²	77	95 Å²	95	36%	0.36	50%	0.495	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	124.4	169.4	-64.6	-173.7	8.1	0	0	108.7	Y48 Y62	Q46-Y48 HydrophobicContact CB-CE2 4.02Å; Q46-Y48 PolarHBondContact OE1-OH 3.46Å; Q46-Y62 PolarHBondContact N-O 3.18Å; Q46-Y62 VanDerWaalsContact N-O 3.15Å; Q46-Y62 PolarHBondContact O-N 2.94Å
47	T	85.5	Confident	70.3	Confident	53 Å²	53	91.6 Å²	91.6	33%	0.325	48%	0.484	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	127.8	-179	-55.2	0	0	0	0	109.5	V60 V61 R235	T47-V60 WeakPolarHBondContact CA-O 3.4Å; T47-V61 HydrophobicContact CG2-CG2 4.41Å; T47-R235 HydrophobicContact CG2-CG 4.47Å
48	Y	87.1	Confident	72.9	Confident	65 Å²	65	81.9 Å²	81.9	26%	0.255	45%	0.447	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	134	177.2	-56.1	-89.8	0	0	0	109.9	Q46 E59 V60 Y62 L68	Q46-Y48 HydrophobicContact CB-CE2 4.02Å; Q46-Y48 PolarHBondContact OE1-OH 3.46Å; Y48-E59 CarbonylContact O-C 3.53Å; Y48-E59 VanDerWaalsContact O-CA 3.31Å; Y48-E59 WeakPolarHBondContact O-CA 3.33Å; Y48-V60 HydrophobicContact CD2-CG1 4.2Å; Y48-V60 HydrophobicContact CG-CG1 4.49Å; Y48-V60 PolarHBondContact N-O 2.98Å; Y48-V60 PolarHBondContact O-N 3.39Å; Y48-Y62 AromaticContact CD2-CD2 3.99Å; Y48-Y62 HydrophobicContact CD2-CD2 3.99Å; Y48-Y62 HydrophobicContact CD2-CE2 4.48Å; Y48-Y62 HydrophobicContact CE2-CD2 4.01Å; Y48-L68 HydrophobicContact CD1-CB 4.37Å; Y48-L68 HydrophobicContact CD1-CD2 4.24Å; Y48-L68 HydrophobicContact CD2-CB 4.34Å; Y48-L68 HydrophobicContact CD2-CD1 4.02Å; Y48-L68 HydrophobicContact CE1-CB 4.15Å; Y48-L68 HydrophobicContact CE2-CB 4.09Å; Y48-L68 HydrophobicContact CG-CB 4.45Å; Y48-L68 HydrophobicContact CG-CD1 4.13Å; Y48-L68 HydrophobicContact CG-CD2 4.32Å
49	V	85.3	Confident	76.2	Confident	104 Å²	104	76.8 Å²	76.8	63%	0.63	41%	0.41	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-95.8	120.5	172.2	-175.9	0	0	0	0	107.9	E59	V49-E59 HydrophobicContact CG2-CG 4.34Å
50	L	81.9	Confident	78.8	Confident	39 Å²	39	72.4 Å²	72.4	20%	0.204	39%	0.387	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.6	143.7	-177.3	-59.2	176.3	0	0	0	110.4	S52 H58 V60 L68	L50-S52 PolarHBondContact O-N 2.85Å; L50-S52 VanDerWaalsContact O-N 3.08Å; L50-S52 PolarHBondContact O-OG 3.47Å; L50-H58 HydrophobicContact CB-CB 4.18Å; L50-H58 PolarHBondContact N-O 3.39Å; L50-V60 HydrophobicContact CD1-CG1 4.09Å; L50-V60 HydrophobicContact CG-CG1 4.37Å; L50-L68 HydrophobicContact CD2-CD1 4.44Å; L50-L68 HydrophobicContact CD2-CD2 4.13Å
51	L	72.9	Confident	80.7	Confident	161 Å²	161	64 Å²	64	84%	0.843	35%	0.351	S	S	*	.			trans	-59.3	115.5	175.9	-76.2	163.4	0	0	0	110.1	R91	L51-R91 VanDerWaalsContact O-CZ 3.24Å; L51-R91 PolarHBondContact O-NH2 3.31Å
52	S	69.8	Low	82.2	Confident	36 Å²	36	55.1 Å²	55.1	25%	0.252	31%	0.312	S	S	.	.			trans	-112.3	154.7	177.6	16.1	0	0	0	0	109.5	L50 C56 H58	L50-S52 PolarHBondContact O-N 2.85Å; L50-S52 VanDerWaalsContact O-N 3.08Å; L50-S52 PolarHBondContact O-OG 3.47Å; S52-C56 VanDerWaalsContact CB-O 3.23Å; S52-C56 WeakPolarHBondContact CB-O 3.47Å; S52-C56 PolarHBondContact OG-O 3.08Å; S52-H58 PolarHBondContact OG-N 2.82Å; S52-H58 VanDerWaalsContact OG-N 3.12Å
53	G	67.1	Low	83	Confident	32 Å²	32	54.1 Å²	54.1	33%	0.33	31%	0.31	S	S	.	.			trans	-62.6	170.6	173.7	0	0	0	0	0	111.5	G55 C56	G53-G55 PolarHBondContact O-N 2.82Å; G53-C56 PolarHBondContact O-N 3.26Å
54	S	72	Confident	83.3	Confident	120 Å²	120	53.9 Å²	53.9	84%	0.839	31%	0.312	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.6	130.6	178.9	45.3	0	0	0	0	112.1
55	G	77.4	Confident	83.3	Confident	46 Å²	46	53.3 Å²	53.3	47%	0.474	32%	0.317	S	S	.	.	T	Hydrogen-bonded Turn	trans	79.3	13.6	177.3	0	0	0	0	0	115.8	G53 T254	G53-G55 PolarHBondContact O-N 2.82Å; G55-T254 WeakPolarHBondContact O-CB 3.48Å; G55-T254 PolarHBondContact O-OG1 3.23Å
56	C	86	Confident	83.1	Confident	13 Å²	13	53.7 Å²	53.7	9%	0.088	32%	0.324	C	S	.	.			trans	-127.2	142.4	175.6	-178.5	0	0	0	0	109.4	S52 G53 F88 Y253	S52-C56 VanDerWaalsContact CB-O 3.23Å; S52-C56 WeakPolarHBondContact CB-O 3.47Å; S52-C56 PolarHBondContact OG-O 3.08Å; G53-C56 PolarHBondContact O-N 3.26Å; C56-F88 HydrophobicContact CB-CB 4.47Å; C56-Y253 CarbonylContact C-O 3.59Å; C56-Y253 WeakPolarHBondContact CA-O 3.3Å
57	I	89.8	Confident	82.9	Confident	83 Å²	83	53.5 Å²	53.5	43%	0.426	34%	0.336	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	126.6	170	-60.3	171.6	0	0	0	106.8	E59 Y253	I57-E59 HydrophobicContact CG2-CG 3.98Å; I57-Y253 HydrophobicContact CD1-CD1 4.25Å; I57-Y253 PolarHBondContact N-O 3.2Å; I57-Y253 PolarHBondContact O-N 2.83Å
58	H	93.3	Very high	82.7	Confident	0 Å²	0	54 Å²	54	0%	0	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	117.7	177.2	-174.8	-175.3	0	0	0	109.6	L50 S52 H250 V251	L50-H58 HydrophobicContact CB-CB 4.18Å; L50-H58 PolarHBondContact N-O 3.39Å; S52-H58 PolarHBondContact OG-N 2.82Å; S52-H58 VanDerWaalsContact OG-N 3.12Å; H58-H250 AromaticContact CE1-ND1 3.96Å; H58-H250 AromaticContact NE2-CG 3.82Å; H58-H250 AromaticContact NE2-ND1 3.17Å; H58-H250 PolarHBondContact NE2-ND1 2.97Å; H58-H250 VanDerWaalsContact NE2-ND1 3.17Å; H58-V251 CarbonylContact C-O 3.52Å; H58-V251 WeakPolarHBondContact CA-O 3.17Å
59	E	93.1	Very high	82.3	Confident	23 Å²	23	55.7 Å²	55.7	11%	0.107	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	157.2	175.5	-52.8	-177.4	161.7	0	0	109.6	Y48 V49 I57 R235 H250 V251	Y48-E59 CarbonylContact O-C 3.53Å; Y48-E59 VanDerWaalsContact O-CA 3.31Å; Y48-E59 WeakPolarHBondContact O-CA 3.33Å; V49-E59 HydrophobicContact CG2-CG 4.34Å; I57-E59 HydrophobicContact CG2-CG 3.98Å; E59-R235 IonicContact OE1-CZ 2.66Å; E59-R235 IonicContact OE1-NE 3.37Å; E59-R235 IonicContact OE1-NH2 2.96Å; E59-R235 PolarHBondContact OE1-NH2 3.25Å; E59-R235 IonicContact OE2-CZ 3.41Å; E59-R235 IonicContact OE2-NE 3.39Å; E59-R235 PolarHBondContact OE2-NE 3.48Å; E59-R235 IonicContact OE2-NH2 2.66Å; E59-R235 PolarHBondContact OE2-NH2 2.89Å; E59-R235 VanDerWaalsContact OE2-NH2 3.15Å; E59-H250 CarbonylContact O-C 3.45Å; E59-H250 WeakPolarHBondContact O-CA 3.45Å; E59-V251 HydrophobicContact CB-CB 4.37Å; E59-V251 PolarHBondContact N-O 3.37Å; E59-V251 PolarHBondContact O-N 3.26Å
60	V	93.8	Very high	82.1	Confident	0 Å²	0	59.1 Å²	59.1	0%	0	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.3	135.4	171.9	60.6	0	0	0	0	109.8	T47 Y48 L50 Y62 L68 P248 H250	T47-V60 WeakPolarHBondContact CA-O 3.4Å; Y48-V60 HydrophobicContact CD2-CG1 4.2Å; Y48-V60 HydrophobicContact CG-CG1 4.49Å; Y48-V60 PolarHBondContact N-O 2.98Å; Y48-V60 PolarHBondContact O-N 3.39Å; L50-V60 HydrophobicContact CD1-CG1 4.09Å; L50-V60 HydrophobicContact CG-CG1 4.37Å; V60-Y62 HydrophobicContact CB-CE2 4.23Å; V60-Y62 HydrophobicContact CG1-CD2 4.17Å; V60-Y62 HydrophobicContact CG1-CE2 3.79Å; V60-Y62 HydrophobicContact CG2-CD2 3.77Å; V60-Y62 HydrophobicContact CG2-CE2 3.38Å; V60-L68 HydrophobicContact CG1-CD1 3.87Å; V60-P248 HydrophobicContact CG2-CB 4.33Å; V60-H250 WeakPolarHBondContact CB-ND1 3.32Å; V60-H250 WeakPolarHBondContact CG2-CE1 3.35Å; V60-H250 WeakPolarHBondContact CG2-ND1 3.38Å
61	V	93.2	Very high	82.2	Confident	0 Å²	0	58.9 Å²	58.9	0%	0	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	129.5	175.8	-171.9	0	0	0	0	108.6	F45 T47 R235 A238 E239 V242 P248 C249	F45-V61 HydrophobicContact CB-CG1 3.95Å; F45-V61 HydrophobicContact CD1-CG1 4.44Å; F45-V61 HydrophobicContact CG-CG1 4.33Å; T47-V61 HydrophobicContact CG2-CG2 4.41Å; V61-R235 HydrophobicContact CG2-CG 4.38Å; V61-A238 HydrophobicContact CG2-CB 3.9Å; V61-E239 HydrophobicContact CG1-CB 4.42Å; V61-E239 HydrophobicContact CG1-CG 3.75Å; V61-E239 HydrophobicContact CG2-CG 4.04Å; V61-V242 HydrophobicContact CB-CG2 3.82Å; V61-V242 HydrophobicContact CG1-CB 4.27Å; V61-V242 HydrophobicContact CG1-CG2 3.79Å; V61-V242 WeakPolarHBondContact O-CG2 3.38Å; V61-P248 VanDerWaalsContact O-CA 3.32Å; V61-P248 WeakPolarHBondContact O-CA 3.34Å; V61-C249 PolarHBondContact N-O 2.84Å; V61-C249 PolarHBondContact O-N 3.02Å; V61-C249 VanDerWaalsContact O-N 3.13Å
62	Y	91.4	Very high	82.7	Confident	6 Å²	6	59 Å²	59	2%	0.024	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	151.4	174.7	-82.8	-97.6	0	0	0	111.1	Q46 Y48 V60 C66 L68 N69 Q100 P248	Q46-Y62 PolarHBondContact N-O 3.18Å; Q46-Y62 VanDerWaalsContact N-O 3.15Å; Q46-Y62 PolarHBondContact O-N 2.94Å; Y48-Y62 AromaticContact CD2-CD2 3.99Å; Y48-Y62 HydrophobicContact CD2-CD2 3.99Å; Y48-Y62 HydrophobicContact CD2-CE2 4.48Å; Y48-Y62 HydrophobicContact CE2-CD2 4.01Å; V60-Y62 HydrophobicContact CB-CE2 4.23Å; V60-Y62 HydrophobicContact CG1-CD2 4.17Å; V60-Y62 HydrophobicContact CG1-CE2 3.79Å; V60-Y62 HydrophobicContact CG2-CD2 3.77Å; V60-Y62 HydrophobicContact CG2-CE2 3.38Å; Y62-C66 HydrophobicContact CD1-CB 3.74Å; Y62-C66 HydrophobicContact CG-CB 4.37Å; Y62-L68 HydrophobicContact CE2-CD1 3.76Å; Y62-N69 PolarHBondContact OH-N 3.4Å; Y62-Q100 PolarHBondContact OH-NE2 3.4Å; Y62-Q100 VanDerWaalsContact OH-NE2 3.15Å; Y62-P248 HydrophobicContact CD1-CB 3.88Å; Y62-P248 HydrophobicContact CD1-CG 4.45Å; Y62-P248 HydrophobicContact CD2-CB 4.35Å; Y62-P248 HydrophobicContact CE1-CB 3.66Å; Y62-P248 HydrophobicContact CE1-CG 3.96Å; Y62-P248 HydrophobicContact CE2-CB 4.15Å; Y62-P248 HydrophobicContact CG-CB 4.23Å
63	P	87.5	Confident	83.1	Confident	27 Å²	27	64.3 Å²	64.3	18%	0.175	38%	0.377	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-54.7	149.5	164.4	-19.6	30.4	0	0	0	110.6	D65 C66 V242 R246	P63-D65 PolarHBondContact O-N 3.33Å; P63-C66 PolarHBondContact O-N 2.81Å; P63-V242 HydrophobicContact CB-CG1 4.29Å; P63-V242 HydrophobicContact CG-CG1 3.77Å; P63-R246 WeakPolarHBondContact CG-O 3.4Å
64	A	76.6	Confident	83.7	Confident	37 Å²	37	66 Å²	66	31%	0.306	38%	0.378	S	S	.	.	T	Hydrogen-bonded Turn	trans	-50.4	141.8	169.4	0	0	0	0	0	110.7	K44 C66	K44-A64 HydrophobicContact CB-CB 4Å; K44-A64 VanDerWaalsContact O-CB 3.22Å; K44-A64 WeakPolarHBondContact O-CB 3.2Å; K44-A64 PolarHBondContact O-N 3.38Å; A64-C66 PolarHBondContact O-N 3.12Å
65	D	77.7	Confident	83.8	Confident	155 Å²	155	64.1 Å²	64.1	83%	0.829	37%	0.37	S	S	*	.	T	Hydrogen-bonded Turn	trans	79.1	0.5	178.6	-44.4	-38.9	0	0	0	116.8	P63	P63-D65 PolarHBondContact O-N 3.33Å
66	C	80.2	Confident	84	Confident	51 Å²	51	69.6 Å²	69.6	35%	0.345	38%	0.383	S	S	.	.	P	Polyproline II helix	trans	-91.3	129.2	173.5	-62.7	0	0	0	0	111.7	Y62 P63 A64	Y62-C66 HydrophobicContact CD1-CB 3.74Å; Y62-C66 HydrophobicContact CG-CB 4.37Å; P63-C66 PolarHBondContact O-N 2.81Å; A64-C66 PolarHBondContact O-N 3.12Å
67	A	78.7	Confident	84.1	Confident	73 Å²	73	71.8 Å²	71.8	60%	0.603	40%	0.396	S	S	*	.	P	Polyproline II helix	trans	-74.9	152.1	169.7	0	0	0	0	0	111.1	N69	A67-N69 PolarHBondContact O-N 2.98Å
68	L	82	Confident	84.1	Confident	63 Å²	63	68.9 Å²	68.9	33%	0.33	39%	0.385	S	S	.	.	P	Polyproline II helix	trans	-61.4	118.5	174.8	179.1	65.4	0	0	0	110.5	Y48 L50 V60 Y62	Y48-L68 HydrophobicContact CD1-CB 4.37Å; Y48-L68 HydrophobicContact CD1-CD2 4.24Å; Y48-L68 HydrophobicContact CD2-CB 4.34Å; Y48-L68 HydrophobicContact CD2-CD1 4.02Å; Y48-L68 HydrophobicContact CE1-CB 4.15Å; Y48-L68 HydrophobicContact CE2-CB 4.09Å; Y48-L68 HydrophobicContact CG-CB 4.45Å; Y48-L68 HydrophobicContact CG-CD1 4.13Å; Y48-L68 HydrophobicContact CG-CD2 4.32Å; L50-L68 HydrophobicContact CD2-CD1 4.44Å; L50-L68 HydrophobicContact CD2-CD2 4.13Å; V60-L68 HydrophobicContact CG1-CD1 3.87Å; Y62-L68 HydrophobicContact CE2-CD1 3.76Å
69	N	79.5	Confident	84	Confident	101 Å²	101	71.9 Å²	71.9	54%	0.54	40%	0.396	S	S	.	.	P	Polyproline II helix	trans	-84.2	121.1	168.1	-68.4	-22.8	0	0	0	109.2	Y62 A67 L71	Y62-N69 PolarHBondContact OH-N 3.4Å; A67-N69 PolarHBondContact O-N 2.98Å; N69-L71 PolarHBondContact O-N 3.14Å
70	E	79.6	Confident	83.8	Confident	176 Å²	176	77.1 Å²	77.1	82%	0.822	43%	0.425	S	S	*	.	P	Polyproline II helix	trans	-66.1	130.5	174.2	-69.2	-173.5	172.8	0	0	110.7	K72	E70-K72 PolarHBondContact O-N 3.17Å
71	L	85.6	Confident	83.7	Confident	33 Å²	33	78.9 Å²	78.9	17%	0.173	43%	0.432	C	S	.	.	P	Polyproline II helix	trans	-67.8	120.5	178	-67.1	172.8	0	0	0	110	N69 L94 N98	N69-L71 PolarHBondContact O-N 3.14Å; L71-L94 HydrophobicContact CB-CD2 3.77Å; L71-L94 HydrophobicContact CB-CG 3.94Å; L71-L94 HydrophobicContact CD1-CD2 3.84Å; L71-L94 HydrophobicContact CD1-CG 4.11Å; L71-L94 HydrophobicContact CG-CD2 4.44Å; L71-N98 HydrophobicContact CD2-CB 3.69Å
72	K	82.2	Confident	83.6	Confident	165 Å²	165	85 Å²	85	72%	0.717	47%	0.472	S	S	*	.	P	Polyproline II helix	trans	-70.5	135.5	176.6	-64.3	178.1	-176.7	173.2	0	110	E70 L94 N98	E70-K72 PolarHBondContact O-N 3.17Å; K72-L94 WeakPolarHBondContact O-CD1 3.35Å; K72-N98 PolarHBondContact N-ND2 3.49Å; K72-N98 PolarHBondContact N-OD1 2.72Å; K72-N98 PolarHBondContact O-ND2 3.28Å; K72-N98 VanDerWaalsContact O-ND2 3.08Å
73	N	79.4	Confident	83.5	Confident	146 Å²	146	89.7 Å²	89.7	78%	0.781	49%	0.492	S	S	*	.	P	Polyproline II helix	trans	-62.9	149.8	177.5	-71.7	-35	0	0	0	112.3	A75	N73-A75 PolarHBondContact O-N 3.13Å; N73-A75 VanDerWaalsContact O-N 3.14Å
74	L	77.9	Confident	83.7	Confident	68 Å²	68	94.2 Å²	94.2	36%	0.356	52%	0.52	S	S	.	.			trans	-65.7	105.8	177	-72.2	139.3	0	0	0	110.7	P77 I93 L94 E97 Y118	L74-P77 HydrophobicContact CD2-CB 4.43Å; L74-I93 HydrophobicContact CD1-CG2 4.21Å; L74-I93 HydrophobicContact CD2-CG2 4.09Å; L74-L94 HydrophobicContact CD1-CD1 4.24Å; L74-L94 HydrophobicContact CG-CD1 4.24Å; L74-E97 HydrophobicContact CD2-CB 4.03Å; L74-E97 HydrophobicContact CD2-CG 3.76Å; L74-E97 HydrophobicContact CG-CG 4.37Å; L74-Y118 WeakPolarHBondContact CD2-OH 3.41Å
75	A	74	Confident	84.4	Confident	81 Å²	81	94.2 Å²	94.2	67%	0.669	51%	0.514	S	S	*	.	S	Bend	trans	-82.1	-42.4	172	0	0	0	0	0	111.8	N73	N73-A75 PolarHBondContact O-N 3.13Å; N73-A75 VanDerWaalsContact O-N 3.14Å
76	H	82.8	Confident	84.9	Confident	161 Å²	161	89.1 Å²	89.1	75%	0.745	49%	0.487	S	S	*	.	S	Bend	trans	-138.2	95.5	-178.9	-61.9	-54	0	0	0	109.4	A78	H76-A78 PolarHBondContact O-N 3.46Å
77	P	87.2	Confident	85.4	Confident	58 Å²	58	89.1 Å²	89.1	38%	0.377	49%	0.486	S	S	.	.			trans	-63.8	137.2	-177.6	27.2	-34.8	0	0	0	110.8	L74 R79 N80 Y118	L74-P77 HydrophobicContact CD2-CB 4.43Å; P77-R79 PolarHBondContact O-N 2.65Å; P77-N80 VanDerWaalsContact CG-OD1 3.3Å; P77-N80 WeakPolarHBondContact CG-OD1 3.5Å; P77-Y118 HydrophobicContact CB-CE2 4.32Å
78	A	89.6	Confident	86.1	Confident	22 Å²	22	86.1 Å²	86.1	18%	0.182	46%	0.46	C	S	.	.	S	Bend	trans	-62.2	-23.8	178.7	0	0	0	0	0	113.1	H76 Y118 A121 K122	H76-A78 PolarHBondContact O-N 3.46Å; A78-Y118 HydrophobicContact CB-CE1 4.24Å; A78-Y118 HydrophobicContact CB-CE2 4.01Å; A78-Y118 PolarHBondContact N-OH 3.18Å; A78-Y118 VanDerWaalsContact N-OH 3.08Å; A78-A121 HydrophobicContact CB-CB 4.23Å; A78-K122 HydrophobicContact CB-CB 4.18Å
79	R	91.7	Very high	86.6	Confident	63 Å²	63	83.1 Å²	83.1	24%	0.238	44%	0.444	C	S	.	.	S	Bend	trans	-149.2	135.9	179.3	-175.3	173.5	173.9	98.8	-6	110.6	P77 Y81 E117 Y118 A121 I150	P77-R79 PolarHBondContact O-N 2.65Å; R79-Y81 HydrophobicContact CB-CE2 4.47Å; R79-Y81 WeakPolarHBondContact CD-OH 3.27Å; R79-Y81 HydrophobicContact CG-CE1 4.24Å; R79-Y81 HydrophobicContact CG-CE2 4.35Å; R79-E117 IonicContact CZ-OE2 3.64Å; R79-E117 VanDerWaalsContact CZ-OE2 3.29Å; R79-E117 IonicContact NE-OE2 3.85Å; R79-E117 PolarHBondContact NE-OE2 3.33Å; R79-E117 VanDerWaalsContact NE-OE2 3.12Å; R79-E117 IonicContact NH2-OE2 3.65Å; R79-E117 PolarHBondContact NH2-OE2 3Å; R79-Y118 HydrophobicContact CB-CD2 4.37Å; R79-A121 HydrophobicContact CB-CB 3.88Å; R79-I150 VanDerWaalsContact CZ-CG2 3.43Å
80	N	90.1	Very high	87.2	Confident	134 Å²	134	82.8 Å²	82.8	72%	0.717	44%	0.439	S	S	*	.			trans	-99	143.6	173.9	-66.2	-50.8	0	0	0	110.3	P77	P77-N80 VanDerWaalsContact CG-OD1 3.3Å; P77-N80 WeakPolarHBondContact CG-OD1 3.5Å
81	Y	91.4	Very high	87.9	Confident	37 Å²	37	78.5 Å²	78.5	15%	0.145	42%	0.416	C	S	.	.			trans	-117.2	144.5	-179.4	-62.2	-83.1	0	0	0	111.1	R79 F83 L85 I93 V114 Y118	R79-Y81 HydrophobicContact CB-CE2 4.47Å; R79-Y81 WeakPolarHBondContact CD-OH 3.27Å; R79-Y81 HydrophobicContact CG-CE1 4.24Å; R79-Y81 HydrophobicContact CG-CE2 4.35Å; Y81-F83 HydrophobicContact CD1-CE1 4.38Å; Y81-F83 HydrophobicContact CD1-CE2 4.43Å; Y81-F83 AromaticContact CD1-CZ 3.84Å; Y81-F83 HydrophobicContact CD1-CZ 3.84Å; Y81-F83 HydrophobicContact CG-CE2 4.38Å; Y81-F83 HydrophobicContact CG-CZ 4.19Å; Y81-F83 PolarHBondContact O-N 3.17Å; Y81-F83 VanDerWaalsContact O-N 3.12Å; Y81-L85 HydrophobicContact CD2-CD1 4.15Å; Y81-L85 HydrophobicContact CD2-CD2 3.68Å; Y81-L85 HydrophobicContact CD2-CG 4.21Å; Y81-L85 HydrophobicContact CE2-CD1 4.48Å; Y81-L85 HydrophobicContact CE2-CD2 4.1Å; Y81-L85 HydrophobicContact CG-CD2 4.09Å; Y81-I93 HydrophobicContact CE2-CD1 4.28Å; Y81-V114 HydrophobicContact CD1-CG1 4.28Å; Y81-V114 HydrophobicContact CD2-CG1 4.45Å; Y81-V114 HydrophobicContact CE1-CG1 3.79Å; Y81-V114 HydrophobicContact CE2-CG1 3.96Å; Y81-V114 PolarHBondContact OH-O 3.28Å; Y81-Y118 HydrophobicContact CE2-CD2 4.44Å; Y81-Y118 PolarHBondContact OH-N 3.37Å
82	P	90.6	Very high	88.3	Confident	129 Å²	129	76.9 Å²	76.9	84%	0.838	41%	0.407	S	S	*	.	S	Bend	trans	-77.9	12.6	-179.6	32.6	-35.2	0	0	0	113.8
83	F	89.9	Confident	88.9	Confident	103 Å²	103	69.2 Å²	69.2	45%	0.452	37%	0.374	S	S	.	.	S	Bend	trans	-142.1	158.3	-179.3	50.7	-98.1	0	0	0	110.1	Y81 L85 V114	Y81-F83 HydrophobicContact CD1-CE1 4.38Å; Y81-F83 HydrophobicContact CD1-CE2 4.43Å; Y81-F83 AromaticContact CD1-CZ 3.84Å; Y81-F83 HydrophobicContact CD1-CZ 3.84Å; Y81-F83 HydrophobicContact CG-CE2 4.38Å; Y81-F83 HydrophobicContact CG-CZ 4.19Å; Y81-F83 PolarHBondContact O-N 3.17Å; Y81-F83 VanDerWaalsContact O-N 3.12Å; F83-L85 HydrophobicContact CE2-CD2 4.08Å; F83-L85 PolarHBondContact O-N 2.93Å; F83-V114 HydrophobicContact CE2-CG2 4.27Å; F83-V114 HydrophobicContact CZ-CG2 4.01Å
84	T	90.3	Very high	89.6	Confident	122 Å²	122	62.8 Å²	62.8	75%	0.748	34%	0.34	S	S	*	.	P	Polyproline II helix	trans	-69.3	126.2	174	-51.2	0	0	0	0	109.8
85	L	91	Very high	90.4	Very high	37 Å²	37	59.6 Å²	59.6	19%	0.194	32%	0.323	C	S	.	.	P	Polyproline II helix	trans	-66.9	135	175.5	-67.2	174.1	0	0	0	110.7	Y81 F83 Q89 Q90 I93 V114	Y81-L85 HydrophobicContact CD2-CD1 4.15Å; Y81-L85 HydrophobicContact CD2-CD2 3.68Å; Y81-L85 HydrophobicContact CD2-CG 4.21Å; Y81-L85 HydrophobicContact CE2-CD1 4.48Å; Y81-L85 HydrophobicContact CE2-CD2 4.1Å; Y81-L85 HydrophobicContact CG-CD2 4.09Å; F83-L85 HydrophobicContact CE2-CD2 4.08Å; F83-L85 PolarHBondContact O-N 2.93Å; L85-Q89 HydrophobicContact CB-CB 4.32Å; L85-Q89 HydrophobicContact CD2-CB 4.34Å; L85-Q90 HydrophobicContact CB-CG 3.54Å; L85-Q90 HydrophobicContact CD1-CG 4.37Å; L85-Q90 PolarHBondContact O-NE2 3.32Å; L85-I93 HydrophobicContact CD1-CD1 3.76Å; L85-I93 HydrophobicContact CD2-CD1 4.35Å; L85-V114 HydrophobicContact CD2-CG1 3.53Å
86	D	89.7	Confident	91.4	Very high	48 Å²	48	55.7 Å²	55.7	26%	0.257	29%	0.291	S	S	.	.	P	Polyproline II helix	trans	-64.8	152.2	174.5	-69.3	-39.3	0	0	0	110.1	F88 Q89 Q90 R475	D86-F88 VanDerWaalsContact C-N 3.26Å; D86-F88 HydrophobicContact CB-CD1 3.74Å; D86-F88 HydrophobicContact CB-CE1 3.66Å; D86-F88 PolarHBondContact O-N 3.12Å; D86-F88 VanDerWaalsContact O-N 3.12Å; D86-Q89 HydrophobicContact CB-CG 4.2Å; D86-Q89 WeakPolarHBondContact O-CA 3.35Å; D86-Q89 WeakPolarHBondContact O-CB 3.28Å; D86-Q89 PolarHBondContact O-N 2.78Å; D86-Q90 PolarHBondContact O-N 2.71Å; D86-R475 IonicContact OD1-NH2 2.8Å; D86-R475 IonicContact OD2-CZ 2.72Å; D86-R475 IonicContact OD2-NH1 3.66Å; D86-R475 IonicContact OD2-NH2 3.97Å; D86-R475 PolarHBondContact OD2-NH2 3.33Å
87	P	90.8	Very high	91.9	Very high	51 Å²	51	50.8 Å²	50.8	33%	0.331	27%	0.268	S	S	.	.	H	α-helix	trans	-53.2	-39.4	-174.9	-29.2	35.2	0	0	0	114.4	Q90 R91	P87-Q90 PolarHBondContact O-N 2.96Å; P87-R91 WeakPolarHBondContact O-CG 3.34Å; P87-R91 PolarHBondContact O-N 3.28Å; P87-R91 VanDerWaalsContact O-N 3.11Å
88	F	92.2	Very high	92.2	Very high	10 Å²	10	49.9 Å²	49.9	4%	0.044	26%	0.26	C	S	.	.	H	α-helix	trans	-67.5	-36.2	177.6	85	-88.5	0	0	0	112	C56 D86 R91 A92 V104 A106 A110 V252 T254	C56-F88 HydrophobicContact CB-CB 4.47Å; D86-F88 VanDerWaalsContact C-N 3.26Å; D86-F88 HydrophobicContact CB-CD1 3.74Å; D86-F88 HydrophobicContact CB-CE1 3.66Å; D86-F88 PolarHBondContact O-N 3.12Å; D86-F88 VanDerWaalsContact O-N 3.12Å; F88-R91 PolarHBondContact O-N 3.34Å; F88-A92 WeakPolarHBondContact O-CB 3.49Å; F88-A92 PolarHBondContact O-N 3.07Å; F88-V104 HydrophobicContact CD2-CG1 3.9Å; F88-V104 HydrophobicContact CE2-CG1 3.97Å; F88-A106 HydrophobicContact CE2-CB 4.24Å; F88-A110 HydrophobicContact CE1-CB 4.06Å; F88-A110 HydrophobicContact CZ-CB 3.75Å; F88-A110 WeakPolarHBondContact CZ-O 3.37Å; F88-V252 HydrophobicContact CB-CG1 3.8Å; F88-V252 WeakPolarHBondContact O-CG1 3.22Å; F88-T254 HydrophobicContact CB-CG2 3.99Å; F88-T254 HydrophobicContact CD1-CG2 3.83Å; F88-T254 HydrophobicContact CD2-CG2 4.2Å; F88-T254 HydrophobicContact CE1-CG2 4.38Å; F88-T254 HydrophobicContact CG-CG2 3.73Å
89	Q	93.3	Very high	92.3	Very high	1 Å²	1	54.9 Å²	54.9	1%	0.005	28%	0.28	C	S	.	.	H	α-helix	trans	-66.4	-45.1	176.9	-63.3	173.2	-29.5	0	0	110.4	L85 D86 R91 A92 I93 G111	L85-Q89 HydrophobicContact CB-CB 4.32Å; L85-Q89 HydrophobicContact CD2-CB 4.34Å; D86-Q89 HydrophobicContact CB-CG 4.2Å; D86-Q89 WeakPolarHBondContact O-CA 3.35Å; D86-Q89 WeakPolarHBondContact O-CB 3.28Å; D86-Q89 PolarHBondContact O-N 2.78Å; Q89-R91 VanDerWaalsContact C-N 3.34Å; Q89-R91 PolarHBondContact O-N 3.16Å; Q89-A92 PolarHBondContact O-N 3.44Å; Q89-I93 VanDerWaalsContact O-CB 3.32Å; Q89-I93 WeakPolarHBondContact O-CB 3.43Å; Q89-I93 VanDerWaalsContact O-CG1 3.27Å; Q89-I93 WeakPolarHBondContact O-CG1 3.18Å; Q89-I93 PolarHBondContact O-N 3.32Å; Q89-G111 PolarHBondContact NE2-O 3.27Å
90	Q	92.4	Very high	92.4	Very high	94 Å²	94	52.7 Å²	52.7	44%	0.439	27%	0.272	S	S	.	.	H	α-helix	trans	-58.7	-45	177.1	-64	179.9	10.2	0	0	111.6	L85 D86 P87 L94	L85-Q90 HydrophobicContact CB-CG 3.54Å; L85-Q90 HydrophobicContact CD1-CG 4.37Å; L85-Q90 PolarHBondContact O-NE2 3.32Å; D86-Q90 PolarHBondContact O-N 2.71Å; P87-Q90 PolarHBondContact O-N 2.96Å; Q90-L94 WeakPolarHBondContact O-CB 3.44Å; Q90-L94 PolarHBondContact O-N 3.07Å
91	R	93	Very high	92.8	Very high	85 Å²	85	46.7 Å²	46.7	32%	0.321	24%	0.241	S	C	.	.	H	α-helix	trans	-65.8	-44.2	178.5	-67.5	-64.3	-179.6	-173.6	2.1	112.2	L51 P87 F88 Q89 L94 C95 V252	L51-R91 VanDerWaalsContact O-CZ 3.24Å; L51-R91 PolarHBondContact O-NH2 3.31Å; P87-R91 WeakPolarHBondContact O-CG 3.34Å; P87-R91 PolarHBondContact O-N 3.28Å; P87-R91 VanDerWaalsContact O-N 3.11Å; F88-R91 PolarHBondContact O-N 3.34Å; Q89-R91 VanDerWaalsContact C-N 3.34Å; Q89-R91 PolarHBondContact O-N 3.16Å; R91-L94 WeakPolarHBondContact O-CB 3.41Å; R91-L94 PolarHBondContact O-N 3.24Å; R91-C95 PolarHBondContact O-N 3.1Å; R91-C95 VanDerWaalsContact O-N 3.16Å; R91-C95 PolarHBondContact O-SG 3.42Å; R91-V252 HydrophobicContact CB-CG1 4.36Å; R91-V252 HydrophobicContact CB-CG2 4.33Å
92	A	94.9	Very high	93	Very high	0 Å²	0	44.9 Å²	44.9	0%	0	23%	0.234	C	C	.	.	H	α-helix	trans	-64.3	-42	178.1	0	0	0	0	0	112.3	F88 Q89 L94 C95 I96 V102 V104 V115 V252	F88-A92 WeakPolarHBondContact O-CB 3.49Å; F88-A92 PolarHBondContact O-N 3.07Å; Q89-A92 PolarHBondContact O-N 3.44Å; A92-L94 VanDerWaalsContact C-N 3.32Å; A92-L94 PolarHBondContact O-N 3.25Å; A92-C95 WeakPolarHBondContact O-CB 3.35Å; A92-C95 PolarHBondContact O-N 2.86Å; A92-I96 PolarHBondContact O-N 3.05Å; A92-I96 VanDerWaalsContact O-N 3.15Å; A92-V102 HydrophobicContact CB-CG2 4.28Å; A92-V104 HydrophobicContact CB-CG2 3.6Å; A92-V115 HydrophobicContact CB-CB 4.49Å; A92-V115 HydrophobicContact CB-CG1 3.8Å; A92-V115 HydrophobicContact CB-CG2 3.81Å; A92-V252 HydrophobicContact CB-CG2 4.38Å
93	I	95.4	Very high	93.3	Very high	3 Å²	3	38.8 Å²	38.8	2%	0.015	19%	0.194	C	C	.	.	H	α-helix	trans	-61.1	-41.1	174.6	-75.8	170.8	0	0	0	111.1	L74 Y81 L85 Q89 C95 I96 E97 V114 Y118	L74-I93 HydrophobicContact CD1-CG2 4.21Å; L74-I93 HydrophobicContact CD2-CG2 4.09Å; Y81-I93 HydrophobicContact CE2-CD1 4.28Å; L85-I93 HydrophobicContact CD1-CD1 3.76Å; L85-I93 HydrophobicContact CD2-CD1 4.35Å; Q89-I93 VanDerWaalsContact O-CB 3.32Å; Q89-I93 WeakPolarHBondContact O-CB 3.43Å; Q89-I93 VanDerWaalsContact O-CG1 3.27Å; Q89-I93 WeakPolarHBondContact O-CG1 3.18Å; Q89-I93 PolarHBondContact O-N 3.32Å; I93-C95 VanDerWaalsContact C-N 3.32Å; I93-C95 PolarHBondContact O-N 3.01Å; I93-I96 PolarHBondContact O-N 3.5Å; I93-E97 WeakPolarHBondContact O-CB 3.44Å; I93-E97 PolarHBondContact O-N 2.92Å; I93-V114 HydrophobicContact CD1-CG1 4.39Å; I93-Y118 HydrophobicContact CB-CD1 4.35Å; I93-Y118 HydrophobicContact CB-CG 4.31Å; I93-Y118 HydrophobicContact CD1-CD2 4.03Å; I93-Y118 HydrophobicContact CD1-CG 4.15Å; I93-Y118 HydrophobicContact CG1-CD1 4.2Å; I93-Y118 HydrophobicContact CG1-CD2 4.08Å; I93-Y118 HydrophobicContact CG1-CG 3.76Å; I93-Y118 HydrophobicContact CG2-CD1 3.79Å; I93-Y118 HydrophobicContact CG2-CD2 3.69Å; I93-Y118 HydrophobicContact CG2-CE1 3.67Å; I93-Y118 HydrophobicContact CG2-CE2 3.54Å; I93-Y118 HydrophobicContact CG2-CG 3.81Å
94	L	93.7	Very high	93.7	Very high	12 Å²	12	33.9 Å²	33.9	6%	0.063	17%	0.172	C	C	.	.	H	α-helix	trans	-61.2	-39.3	176.9	-171.7	67.5	0	0	0	112.3	L71 K72 L74 Q90 R91 A92 E97 N98	L71-L94 HydrophobicContact CB-CD2 3.77Å; L71-L94 HydrophobicContact CB-CG 3.94Å; L71-L94 HydrophobicContact CD1-CD2 3.84Å; L71-L94 HydrophobicContact CD1-CG 4.11Å; L71-L94 HydrophobicContact CG-CD2 4.44Å; K72-L94 WeakPolarHBondContact O-CD1 3.35Å; L74-L94 HydrophobicContact CD1-CD1 4.24Å; L74-L94 HydrophobicContact CG-CD1 4.24Å; Q90-L94 WeakPolarHBondContact O-CB 3.44Å; Q90-L94 PolarHBondContact O-N 3.07Å; R91-L94 WeakPolarHBondContact O-CB 3.41Å; R91-L94 PolarHBondContact O-N 3.24Å; A92-L94 VanDerWaalsContact C-N 3.32Å; A92-L94 PolarHBondContact O-N 3.25Å; L94-E97 PolarHBondContact O-N 3.07Å; L94-N98 PolarHBondContact O-N 2.97Å; L94-N98 VanDerWaalsContact O-N 3.14Å; L94-N98 PolarHBondContact O-ND2 3.49Å
95	C	94.4	Very high	93.9	Very high	0 Å²	0	28 Å²	28	0%	0	14%	0.137	C	C	.	.	H	α-helix	trans	-63.2	-46.2	174.7	-58.3	0	0	0	0	111.5	R91 A92 I93 E97 N98 E99 Q100 V102 H250	R91-C95 PolarHBondContact O-N 3.1Å; R91-C95 VanDerWaalsContact O-N 3.16Å; R91-C95 PolarHBondContact O-SG 3.42Å; A92-C95 WeakPolarHBondContact O-CB 3.35Å; A92-C95 PolarHBondContact O-N 2.86Å; I93-C95 VanDerWaalsContact C-N 3.32Å; I93-C95 PolarHBondContact O-N 3.01Å; C95-E97 VanDerWaalsContact C-N 3.33Å; C95-E97 PolarHBondContact O-N 3.48Å; C95-N98 CarbonylContact O-C 3.43Å; C95-N98 PolarHBondContact O-N 3.44Å; C95-N98 VanDerWaalsContact O-N 3.15Å; C95-E99 PolarHBondContact O-N 3.3Å; C95-Q100 PolarHBondContact O-N 2.84Å; C95-Q100 VanDerWaalsContact O-N 3.09Å; C95-V102 HydrophobicContact CB-CB 3.96Å; C95-V102 HydrophobicContact CB-CG1 4.48Å; C95-V102 HydrophobicContact CB-CG2 4.21Å; C95-H250 HydrophobicContact CB-CB 4.42Å
96	I	95	Very high	93.8	Very high	0 Å²	0	26.3 Å²	26.3	0%	0	13%	0.128	C	C	.	.	H	α-helix	trans	-61.4	-43.8	177.8	-67.6	161.6	0	0	0	110.3	A92 I93 N98 E99 V102 V115 Y118 A119 K122 W193 V225	A92-I96 PolarHBondContact O-N 3.05Å; A92-I96 VanDerWaalsContact O-N 3.15Å; I93-I96 PolarHBondContact O-N 3.5Å; I96-N98 PolarHBondContact O-N 3.49Å; I96-E99 PolarHBondContact O-N 3.24Å; I96-V102 HydrophobicContact CD1-CG1 4.17Å; I96-V102 HydrophobicContact CG1-CG1 3.84Å; I96-V115 HydrophobicContact CD1-CG1 3.47Å; I96-V115 VanDerWaalsContact CD1-CG1 3.47Å; I96-Y118 HydrophobicContact CB-CD1 4.35Å; I96-Y118 HydrophobicContact CG2-CD1 3.96Å; I96-Y118 HydrophobicContact CG2-CE1 4.33Å; I96-A119 HydrophobicContact CD1-CB 4.16Å; I96-A119 HydrophobicContact CG2-CB 4.27Å; I96-K122 HydrophobicContact CG2-CD 3.88Å; I96-K122 WeakPolarHBondContact O-CD 3.39Å; I96-K122 PolarHBondContact O-NZ 3.45Å; I96-W193 HydrophobicContact CB-CH2 4.46Å; I96-W193 HydrophobicContact CG1-CH2 4.49Å; I96-W193 HydrophobicContact CG1-CZ3 4.43Å; I96-W193 HydrophobicContact CG2-CH2 4.23Å; I96-W193 HydrophobicContact CG2-CZ2 4.26Å; I96-V225 HydrophobicContact CD1-CG2 3.99Å; I96-V225 HydrophobicContact CG1-CG2 4.03Å
97	E	93.8	Very high	93.6	Very high	57 Å²	57	25 Å²	25	27%	0.266	12%	0.12	S	C	.	.	H	α-helix	trans	-57.5	-37	176.8	-169.3	64.5	-167.7	0	0	112	L74 I93 L94 C95 E99 Y118 K122	L74-E97 HydrophobicContact CD2-CB 4.03Å; L74-E97 HydrophobicContact CD2-CG 3.76Å; L74-E97 HydrophobicContact CG-CG 4.37Å; I93-E97 WeakPolarHBondContact O-CB 3.44Å; I93-E97 PolarHBondContact O-N 2.92Å; L94-E97 PolarHBondContact O-N 3.07Å; C95-E97 VanDerWaalsContact C-N 3.33Å; C95-E97 PolarHBondContact O-N 3.48Å; E97-E99 VanDerWaalsContact C-N 3.29Å; E97-E99 PolarHBondContact O-N 3.48Å; E97-Y118 WeakPolarHBondContact OE2-CE1 3.49Å; E97-Y118 PolarHBondContact OE2-OH 3.44Å; E97-K122 VanDerWaalsContact C-NZ 3.27Å; E97-K122 PolarHBondContact O-NZ 2.92Å
98	N	92.2	Very high	93	Very high	40 Å²	40	24.8 Å²	24.8	21%	0.214	12%	0.118	C	C	.	.	T	Hydrogen-bonded Turn	trans	-86.4	10.4	177.6	-74.1	-90.6	0	0	0	114.2	L71 K72 L94 C95 I96 Q100	L71-N98 HydrophobicContact CD2-CB 3.69Å; K72-N98 PolarHBondContact N-ND2 3.49Å; K72-N98 PolarHBondContact N-OD1 2.72Å; K72-N98 PolarHBondContact O-ND2 3.28Å; K72-N98 VanDerWaalsContact O-ND2 3.08Å; L94-N98 PolarHBondContact O-N 2.97Å; L94-N98 VanDerWaalsContact O-N 3.14Å; L94-N98 PolarHBondContact O-ND2 3.49Å; C95-N98 CarbonylContact O-C 3.43Å; C95-N98 PolarHBondContact O-N 3.44Å; C95-N98 VanDerWaalsContact O-N 3.15Å; I96-N98 PolarHBondContact O-N 3.49Å; N98-Q100 VanDerWaalsContact C-N 3.29Å; N98-Q100 PolarHBondContact O-N 3.08Å
99	E	92.8	Very high	92.2	Very high	126 Å²	126	25.6 Å²	25.6	59%	0.589	13%	0.125	S	C	*	.	T	Hydrogen-bonded Turn	trans	63	32.2	177.2	-57.5	-178	167.9	0	0	114	C95 I96 E97 K122 Q126	C95-E99 PolarHBondContact O-N 3.3Å; I96-E99 PolarHBondContact O-N 3.24Å; E97-E99 VanDerWaalsContact C-N 3.29Å; E97-E99 PolarHBondContact O-N 3.48Å; E99-K122 IonicContact OE1-NZ 2.77Å; E99-Q126 PolarHBondContact OE1-NE2 2.84Å
100	Q	94.1	Very high	91.7	Very high	17 Å²	17	25.6 Å²	25.6	8%	0.079	13%	0.125	C	C	.	.			trans	-112.3	138.7	178.6	-60.4	-176.2	-50.7	0	0	110.6	Y62 C95 N98 P248 H250	Y62-Q100 PolarHBondContact OH-NE2 3.4Å; Y62-Q100 VanDerWaalsContact OH-NE2 3.15Å; C95-Q100 PolarHBondContact O-N 2.84Å; C95-Q100 VanDerWaalsContact O-N 3.09Å; N98-Q100 VanDerWaalsContact C-N 3.29Å; N98-Q100 PolarHBondContact O-N 3.08Å; Q100-P248 HydrophobicContact CB-CG 4.48Å; Q100-P248 HydrophobicContact CG-CG 4.05Å; Q100-H250 WeakPolarHBondContact CB-NE2 3.16Å; Q100-H250 PolarHBondContact OE1-CE1 3.08Å; Q100-H250 PolarHBondContact OE1-NE2 3.36Å
101	S	96.9	Very high	91.4	Very high	8 Å²	8	22.1 Å²	22.1	6%	0.056	11%	0.114	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-64.1	144.2	179	-64.8	0	0	0	0	110.8	L224 C249 H250	S101-L224 CarbonylContact C-O 3.49Å; S101-L224 WeakPolarHBondContact CA-O 3.25Å; S101-L224 WeakPolarHBondContact CB-O 3.35Å; S101-L224 PolarHBondContact OG-N 2.75Å; S101-L224 VanDerWaalsContact OG-N 3.13Å; S101-C249 WeakPolarHBondContact O-CA 3.41Å; S101-H250 PolarHBondContact O-CD2 3.3Å; S101-H250 PolarHBondContact O-N 2.84Å
102	V	97.4	Very high	91.3	Very high	0 Å²	0	18.4 Å²	18.4	0%	0	10%	0.1	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.9	136.4	-175.6	63.2	0	0	0	0	112.2	A92 C95 I96 V104 L224 V225 F226 H250 V252	A92-V102 HydrophobicContact CB-CG2 4.28Å; C95-V102 HydrophobicContact CB-CB 3.96Å; C95-V102 HydrophobicContact CB-CG1 4.48Å; C95-V102 HydrophobicContact CB-CG2 4.21Å; I96-V102 HydrophobicContact CD1-CG1 4.17Å; I96-V102 HydrophobicContact CG1-CG1 3.84Å; V102-V104 HydrophobicContact CG2-CG2 4.23Å; V102-L224 PolarHBondContact N-O 3.14Å; V102-V225 HydrophobicContact CG1-CG1 4.35Å; V102-V225 HydrophobicContact CG1-CG2 4.24Å; V102-V225 CarbonylContact O-C 3.51Å; V102-V225 WeakPolarHBondContact O-CA 3.33Å; V102-F226 PolarHBondContact O-N 2.64Å; V102-H250 CarbonylContact C-O 3.51Å; V102-H250 WeakPolarHBondContact CA-O 3.43Å; V102-H250 HydrophobicContact CB-CB 4.3Å; V102-H250 HydrophobicContact CG2-CB 4.04Å; V102-V252 HydrophobicContact CG2-CG2 3.91Å
103	M	97	Very high	91	Very high	0 Å²	0	20.1 Å²	20.1	0%	0	11%	0.111	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	119.3	168.9	-179.9	176.6	-162.2	0	0	109.9	I199 F226 I231 A234 F237 H250 V252	M103-I199 HydrophobicContact CE-CG2 4.37Å; M103-F226 HydrophobicContact CB-CB 4.26Å; M103-F226 HydrophobicContact CB-CD2 4.43Å; M103-F226 HydrophobicContact CG-CB 4.18Å; M103-I231 HydrophobicContact CE-CD1 3.16Å; M103-I231 HydrophobicContact CE-CG1 3.95Å; M103-I231 HydrophobicContact SD-CD1 4.47Å; M103-A234 HydrophobicContact CE-CB 4.27Å; M103-A234 HydrophobicContact SD-CB 3.9Å; M103-F237 HydrophobicContact CE-CD1 4.06Å; M103-F237 HydrophobicContact CE-CG 4.39Å; M103-F237 HydrophobicContact SD-CB 4.26Å; M103-F237 HydrophobicContact SD-CD1 3.55Å; M103-F237 VanDerWaalsContact SD-CD1 3.55Å; M103-F237 HydrophobicContact SD-CE1 4.28Å; M103-F237 HydrophobicContact SD-CG 4.2Å; M103-H250 PolarHBondContact N-O 2.83Å; M103-V252 PolarHBondContact O-N 2.96Å
104	V	96.8	Very high	90.9	Very high	0 Å²	0	20.6 Å²	20.6	0%	0	11%	0.114	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	112.7	175.2	-177.3	0	0	0	0	109.1	F88 A92 V102 A106 K112 V115 F226 L227 S228 V252	F88-V104 HydrophobicContact CD2-CG1 3.9Å; F88-V104 HydrophobicContact CE2-CG1 3.97Å; A92-V104 HydrophobicContact CB-CG2 3.6Å; V102-V104 HydrophobicContact CG2-CG2 4.23Å; V104-A106 HydrophobicContact CG1-CB 4.44Å; V104-K112 HydrophobicContact CG1-CG 4.38Å; V104-V115 HydrophobicContact CG2-CG1 4.11Å; V104-V115 HydrophobicContact CG2-CG2 4.38Å; V104-F226 PolarHBondContact N-O 2.97Å; V104-L227 HydrophobicContact CB-CD2 4.14Å; V104-L227 HydrophobicContact CG2-CD2 4.34Å; V104-S228 PolarHBondContact O-N 3.29Å; V104-V252 WeakPolarHBondContact CA-O 3.41Å
105	S	94.5	Very high	91	Very high	0 Å²	0	20 Å²	20	0%	0	11%	0.111	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	102.8	177.4	-172.6	0	0	0	0	109.5	A229 T230 I231 V252 Y253 T254	S105-A229 PolarHBondContact OG-O 3.01Å; S105-T230 VanDerWaalsContact OG-CA 3.28Å; S105-T230 WeakPolarHBondContact OG-CA 3.26Å; S105-I231 PolarHBondContact OG-N 3.33Å; S105-V252 PolarHBondContact N-O 2.87Å; S105-Y253 WeakPolarHBondContact O-CA 3.44Å; S105-T254 PolarHBondContact O-N 2.94Å
106	A	90.7	Very high	91	Very high	0 Å²	0	20 Å²	20	0%	0	11%	0.111	C	C	.	.			trans	-151	157.2	-174.7	0	0	0	0	0	111.5	F88 V104 A110 K112 S228 A229 T254	F88-A106 HydrophobicContact CE2-CB 4.24Å; V104-A106 HydrophobicContact CG1-CB 4.44Å; A106-A110 HydrophobicContact CB-CB 3.78Å; A106-K112 HydrophobicContact CB-CD 4.23Å; A106-K112 HydrophobicContact CB-CG 4.11Å; A106-K112 PolarHBondContact O-NZ 3.25Å; A106-S228 PolarHBondContact N-O 3.48Å; A106-A229 WeakPolarHBondContact O-CA 3.14Å; A106-T254 HydrophobicContact CB-CG2 3.52Å
107	H	83.8	Confident	91.1	Very high	22 Å²	22	21.3 Å²	21.3	10%	0.102	12%	0.117	C	C	.	.			trans	-55.5	152.7	173.8	-71	-64.3	0	0	0	112.1	S109 A110 K112 D255 R281	H107-S109 PolarHBondContact O-N 2.68Å; H107-A110 WeakPolarHBondContact O-CB 3.21Å; H107-A110 PolarHBondContact O-N 2.95Å; H107-K112 PolarHBondContact O-NZ 3.3Å; H107-D255 PolarHBondContact CD2-O 3.22Å; H107-D255 PolarHBondContact NE2-O 3.31Å; H107-R281 PolarHBondContact NE2-NH2 2.79Å
108	T	78	Confident	91.2	Very high	46 Å²	46	18.7 Å²	18.7	28%	0.282	10%	0.104	S	C	.	.	G	3₁₀ helix	trans	-55.8	-38.3	179.4	47.5	0	0	0	0	112.5	A110	T108-A110 VanDerWaalsContact C-N 3.28Å; T108-A110 PolarHBondContact O-N 3.44Å
109	S	76.8	Confident	91.4	Very high	27 Å²	27	16.8 Å²	16.8	19%	0.189	9%	0.094	C	C	.	.	G	3₁₀ helix	trans	-75.9	-6.1	178.1	57	0	0	0	0	115.2	H107 G111 P258	H107-S109 PolarHBondContact O-N 2.68Å; S109-G111 PolarHBondContact O-N 3.42Å; S109-P258 WeakPolarHBondContact O-CG 3.3Å
110	A	82.8	Confident	91.5	Very high	1 Å²	1	10.8 Å²	10.8	1%	0.008	7%	0.066	C	C	.	.	G	3₁₀ helix	trans	-67.6	-19.8	-176.8	0	0	0	0	0	113.3	F88 A106 H107 T108 R475	F88-A110 HydrophobicContact CE1-CB 4.06Å; F88-A110 HydrophobicContact CZ-CB 3.75Å; F88-A110 WeakPolarHBondContact CZ-O 3.37Å; A106-A110 HydrophobicContact CB-CB 3.78Å; H107-A110 WeakPolarHBondContact O-CB 3.21Å; H107-A110 PolarHBondContact O-N 2.95Å; T108-A110 VanDerWaalsContact C-N 3.28Å; T108-A110 PolarHBondContact O-N 3.44Å; A110-R475 PolarHBondContact O-NH1 3.21Å
111	G	85.3	Confident	91.6	Very high	20 Å²	20	10.3 Å²	10.3	21%	0.206	7%	0.065	C	C	.	.			trans	89.1	43.6	-177.6	0	0	0	0	0	113	Q89 S109 T113 V114	Q89-G111 PolarHBondContact NE2-O 3.27Å; S109-G111 PolarHBondContact O-N 3.42Å; G111-T113 PolarHBondContact O-N 3.24Å; G111-V114 WeakPolarHBondContact O-CB 3.16Å; G111-V114 PolarHBondContact O-N 2.91Å
112	K	90.4	Very high	91.4	Very high	7 Å²	7	10.4 Å²	10.4	3%	0.03	7%	0.065	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.9	-30.4	177	-63.8	-168.9	-68.5	-89.9	0	113.2	V104 A106 H107 V114 V115 E198 L227 S228	V104-K112 HydrophobicContact CG1-CG 4.38Å; A106-K112 HydrophobicContact CB-CD 4.23Å; A106-K112 HydrophobicContact CB-CG 4.11Å; A106-K112 PolarHBondContact O-NZ 3.25Å; H107-K112 PolarHBondContact O-NZ 3.3Å; K112-V114 PolarHBondContact O-N 3.3Å; K112-V114 VanDerWaalsContact O-N 3.17Å; K112-V115 WeakPolarHBondContact O-CB 3.45Å; K112-V115 PolarHBondContact O-N 3.45Å; K112-E198 IonicContact NZ-OE1 3.57Å; K112-L227 HydrophobicContact CB-CD1 4.36Å; K112-L227 HydrophobicContact CB-CD2 4.38Å; K112-L227 HydrophobicContact CD-CB 4.31Å; K112-S228 VanDerWaalsContact CD-O 3.26Å; K112-S228 WeakPolarHBondContact CD-O 3.42Å; K112-S228 WeakPolarHBondContact CE-O 3.42Å; K112-S228 PolarHBondContact NZ-O 3.02Å
113	T	89.9	Confident	91.2	Very high	37 Å²	37	10.4 Å²	10.4	23%	0.227	7%	0.065	C	C	.	.	H	α-helix	trans	-57	-30.4	-180	-53.8	0	0	0	0	113	G111 V115 A116 E117 K143 F147	G111-T113 PolarHBondContact O-N 3.24Å; T113-V115 PolarHBondContact O-N 3.09Å; T113-A116 WeakPolarHBondContact O-CB 3.22Å; T113-A116 PolarHBondContact O-N 3.48Å; T113-E117 HydrophobicContact CG2-CG 4.4Å; T113-E117 PolarHBondContact O-N 3.39Å; T113-K143 PolarHBondContact OG1-NZ 3.21Å; T113-F147 HydrophobicContact CG2-CE2 4.41Å
114	V	93.3	Very high	91	Very high	12 Å²	12	12.9 Å²	12.9	7%	0.073	8%	0.077	C	C	.	.	H	α-helix	trans	-57.6	-36.1	175	176.1	0	0	0	0	112	Y81 F83 L85 I93 G111 K112 Y118	Y81-V114 HydrophobicContact CD1-CG1 4.28Å; Y81-V114 HydrophobicContact CD2-CG1 4.45Å; Y81-V114 HydrophobicContact CE1-CG1 3.79Å; Y81-V114 HydrophobicContact CE2-CG1 3.96Å; Y81-V114 PolarHBondContact OH-O 3.28Å; F83-V114 HydrophobicContact CE2-CG2 4.27Å; F83-V114 HydrophobicContact CZ-CG2 4.01Å; L85-V114 HydrophobicContact CD2-CG1 3.53Å; I93-V114 HydrophobicContact CD1-CG1 4.39Å; G111-V114 WeakPolarHBondContact O-CB 3.16Å; G111-V114 PolarHBondContact O-N 2.91Å; K112-V114 PolarHBondContact O-N 3.3Å; K112-V114 VanDerWaalsContact O-N 3.17Å; V114-Y118 PolarHBondContact O-N 3.13Å; V114-Y118 VanDerWaalsContact O-N 3.16Å
115	V	95	Very high	90.8	Very high	0 Å²	0	18 Å²	18	0%	0	11%	0.105	C	C	.	.	H	α-helix	trans	-69.2	-40.1	177.9	-179	0	0	0	0	110.7	A92 I96 V104 K112 T113 Y118 A119 V225 L227	A92-V115 HydrophobicContact CB-CB 4.49Å; A92-V115 HydrophobicContact CB-CG1 3.8Å; A92-V115 HydrophobicContact CB-CG2 3.81Å; I96-V115 HydrophobicContact CD1-CG1 3.47Å; I96-V115 VanDerWaalsContact CD1-CG1 3.47Å; V104-V115 HydrophobicContact CG2-CG1 4.11Å; V104-V115 HydrophobicContact CG2-CG2 4.38Å; K112-V115 WeakPolarHBondContact O-CB 3.45Å; K112-V115 PolarHBondContact O-N 3.45Å; T113-V115 PolarHBondContact O-N 3.09Å; V115-Y118 PolarHBondContact O-N 3.46Å; V115-A119 PolarHBondContact O-N 3.38Å; V115-A119 VanDerWaalsContact O-N 3.13Å; V115-V225 HydrophobicContact CG1-CG1 4.2Å; V115-L227 HydrophobicContact CB-CD2 4.38Å
116	A	95.3	Very high	90.7	Very high	0 Å²	0	21.3 Å²	21.3	0%	0	12%	0.12	C	C	.	.	H	α-helix	trans	-67.7	-42.7	175.8	0	0	0	0	0	112.8	T113 Y118 A119 V120 Y132 I195 L227	T113-A116 WeakPolarHBondContact O-CB 3.22Å; T113-A116 PolarHBondContact O-N 3.48Å; A116-Y118 PolarHBondContact O-N 3.05Å; A116-A119 PolarHBondContact O-N 3.23Å; A116-A119 VanDerWaalsContact O-N 3.14Å; A116-V120 WeakPolarHBondContact O-CG2 3.46Å; A116-V120 PolarHBondContact O-N 2.77Å; A116-Y132 HydrophobicContact CB-CD2 4.19Å; A116-Y132 HydrophobicContact CB-CE2 3.6Å; A116-I195 HydrophobicContact CB-CD1 4Å; A116-I195 HydrophobicContact CB-CG2 3.95Å; A116-L227 HydrophobicContact CB-CD1 4.09Å
117	E	95.6	Very high	90.7	Very high	28 Å²	28	28.7 Å²	28.7	13%	0.131	16%	0.16	C	C	.	.	H	α-helix	trans	-56.8	-38.4	174.6	-74.5	176.1	-138.3	0	0	111.6	R79 T113 A121 I150	R79-E117 IonicContact CZ-OE2 3.64Å; R79-E117 VanDerWaalsContact CZ-OE2 3.29Å; R79-E117 IonicContact NE-OE2 3.85Å; R79-E117 PolarHBondContact NE-OE2 3.33Å; R79-E117 VanDerWaalsContact NE-OE2 3.12Å; R79-E117 IonicContact NH2-OE2 3.65Å; R79-E117 PolarHBondContact NH2-OE2 3Å; T113-E117 HydrophobicContact CG2-CG 4.4Å; T113-E117 PolarHBondContact O-N 3.39Å; E117-A121 WeakPolarHBondContact O-CB 3.46Å; E117-A121 PolarHBondContact O-N 3.43Å; E117-I150 HydrophobicContact CG-CD1 4.49Å
118	Y	96.2	Very high	91.2	Very high	2 Å²	2	30.9 Å²	30.9	1%	0.008	17%	0.17	C	C	.	.	H	α-helix	trans	-66.7	-44.4	175.8	-165.6	-86.7	0	0	0	112.3	L74 P77 A78 R79 Y81 I93 I96 E97 V114 V115 A116 V120 A121 K122	L74-Y118 WeakPolarHBondContact CD2-OH 3.41Å; P77-Y118 HydrophobicContact CB-CE2 4.32Å; A78-Y118 HydrophobicContact CB-CE1 4.24Å; A78-Y118 HydrophobicContact CB-CE2 4.01Å; A78-Y118 PolarHBondContact N-OH 3.18Å; A78-Y118 VanDerWaalsContact N-OH 3.08Å; R79-Y118 HydrophobicContact CB-CD2 4.37Å; Y81-Y118 HydrophobicContact CE2-CD2 4.44Å; Y81-Y118 PolarHBondContact OH-N 3.37Å; I93-Y118 HydrophobicContact CB-CD1 4.35Å; I93-Y118 HydrophobicContact CB-CG 4.31Å; I93-Y118 HydrophobicContact CD1-CD2 4.03Å; I93-Y118 HydrophobicContact CD1-CG 4.15Å; I93-Y118 HydrophobicContact CG1-CD1 4.2Å; I93-Y118 HydrophobicContact CG1-CD2 4.08Å; I93-Y118 HydrophobicContact CG1-CG 3.76Å; I93-Y118 HydrophobicContact CG2-CD1 3.79Å; I93-Y118 HydrophobicContact CG2-CD2 3.69Å; I93-Y118 HydrophobicContact CG2-CE1 3.67Å; I93-Y118 HydrophobicContact CG2-CE2 3.54Å; I93-Y118 HydrophobicContact CG2-CG 3.81Å; I96-Y118 HydrophobicContact CB-CD1 4.35Å; I96-Y118 HydrophobicContact CG2-CD1 3.96Å; I96-Y118 HydrophobicContact CG2-CE1 4.33Å; E97-Y118 WeakPolarHBondContact OE2-CE1 3.49Å; E97-Y118 PolarHBondContact OE2-OH 3.44Å; V114-Y118 PolarHBondContact O-N 3.13Å; V114-Y118 VanDerWaalsContact O-N 3.16Å; V115-Y118 PolarHBondContact O-N 3.46Å; A116-Y118 PolarHBondContact O-N 3.05Å; Y118-V120 VanDerWaalsContact C-N 3.31Å; Y118-V120 PolarHBondContact O-N 2.95Å; Y118-A121 PolarHBondContact O-N 3.03Å; Y118-K122 WeakPolarHBondContact O-CB 3.08Å; Y118-K122 PolarHBondContact O-N 3.4Å
119	A	95.9	Very high	92	Very high	0 Å²	0	30 Å²	30	0%	0	16%	0.162	C	C	.	.	H	α-helix	trans	-60.8	-40	176.7	0	0	0	0	0	112.4	I96 V115 A116 S123 I195 V225	I96-A119 HydrophobicContact CD1-CB 4.16Å; I96-A119 HydrophobicContact CG2-CB 4.27Å; V115-A119 PolarHBondContact O-N 3.38Å; V115-A119 VanDerWaalsContact O-N 3.13Å; A116-A119 PolarHBondContact O-N 3.23Å; A116-A119 VanDerWaalsContact O-N 3.14Å; A119-S123 WeakPolarHBondContact O-CB 3.49Å; A119-S123 PolarHBondContact O-N 3.17Å; A119-S123 PolarHBondContact O-OG 3.02Å; A119-I195 HydrophobicContact CB-CD1 3.97Å; A119-I195 HydrophobicContact CB-CG1 4.29Å; A119-V225 HydrophobicContact CB-CG2 4.11Å
120	V	96.2	Very high	92.9	Very high	0 Å²	0	28.8 Å²	28.8	0%	0	15%	0.153	C	C	.	.	H	α-helix	trans	-64	-50.6	173.3	172.2	0	0	0	0	111	A116 Y118 K122 S123 L124 V130 F147 F151 V169 I195	A116-V120 WeakPolarHBondContact O-CG2 3.46Å; A116-V120 PolarHBondContact O-N 2.77Å; Y118-V120 VanDerWaalsContact C-N 3.31Å; Y118-V120 PolarHBondContact O-N 2.95Å; V120-K122 VanDerWaalsContact C-N 3.29Å; V120-K122 PolarHBondContact O-N 3Å; V120-S123 PolarHBondContact O-N 3.03Å; V120-S123 VanDerWaalsContact O-N 3.15Å; V120-L124 HydrophobicContact CG1-CD1 3.99Å; V120-L124 HydrophobicContact CG1-CG 4.34Å; V120-L124 WeakPolarHBondContact O-CG 3.42Å; V120-L124 PolarHBondContact O-N 2.83Å; V120-V130 HydrophobicContact CB-CG1 4.33Å; V120-V130 HydrophobicContact CG1-CG1 4.12Å; V120-V130 HydrophobicContact CG2-CG1 3.92Å; V120-V130 HydrophobicContact CG2-CG2 4.02Å; V120-F147 HydrophobicContact CG2-CD1 4.4Å; V120-F147 HydrophobicContact CG2-CE1 3.8Å; V120-F151 HydrophobicContact CB-CE2 4.11Å; V120-F151 HydrophobicContact CB-CZ 3.94Å; V120-F151 HydrophobicContact CG1-CD1 4.15Å; V120-F151 HydrophobicContact CG1-CD2 3.94Å; V120-F151 HydrophobicContact CG1-CE1 3.85Å; V120-F151 HydrophobicContact CG1-CE2 3.63Å; V120-F151 HydrophobicContact CG1-CG 4.19Å; V120-F151 HydrophobicContact CG1-CZ 3.57Å; V120-V169 HydrophobicContact CG1-CG1 4.22Å; V120-V169 HydrophobicContact CG1-CG2 3.6Å; V120-V169 HydrophobicContact CG2-CG1 4.42Å; V120-I195 HydrophobicContact CG2-CD1 3.83Å
121	A	95	Very high	93.6	Very high	7 Å²	7	28.8 Å²	28.8	6%	0.058	15%	0.153	C	C	.	.	H	α-helix	trans	-58.9	-39.8	178.6	0	0	0	0	0	112.6	A78 R79 E117 Y118 L124 N125 F151	A78-A121 HydrophobicContact CB-CB 4.23Å; R79-A121 HydrophobicContact CB-CB 3.88Å; E117-A121 WeakPolarHBondContact O-CB 3.46Å; E117-A121 PolarHBondContact O-N 3.43Å; Y118-A121 PolarHBondContact O-N 3.03Å; A121-L124 PolarHBondContact O-N 2.82Å; A121-N125 VanDerWaalsContact O-CG 3.29Å; A121-N125 PolarHBondContact O-N 3.41Å; A121-F151 HydrophobicContact CB-CE1 4.36Å
122	K	93.5	Very high	94.2	Very high	10 Å²	10	27.9 Å²	27.9	4%	0.043	14%	0.143	C	C	.	.	H	α-helix	trans	-63.4	-45.4	175.6	-179.8	173.2	175.8	174.5	0	111.8	A78 I96 E97 E99 Y118 V120 L124 N125 Q126	A78-K122 HydrophobicContact CB-CB 4.18Å; I96-K122 HydrophobicContact CG2-CD 3.88Å; I96-K122 WeakPolarHBondContact O-CD 3.39Å; I96-K122 PolarHBondContact O-NZ 3.45Å; E97-K122 VanDerWaalsContact C-NZ 3.27Å; E97-K122 PolarHBondContact O-NZ 2.92Å; E99-K122 IonicContact OE1-NZ 2.77Å; Y118-K122 WeakPolarHBondContact O-CB 3.08Å; Y118-K122 PolarHBondContact O-N 3.4Å; V120-K122 VanDerWaalsContact C-N 3.29Å; V120-K122 PolarHBondContact O-N 3Å; K122-L124 VanDerWaalsContact C-N 3.34Å; K122-L124 PolarHBondContact O-N 3.25Å; K122-N125 PolarHBondContact O-N 3.28Å; K122-Q126 PolarHBondContact O-N 3.48Å; K122-Q126 VanDerWaalsContact O-N 3.09Å
123	S	93.5	Very high	94.5	Very high	0 Å²	0	27.6 Å²	27.6	0%	0	14%	0.142	C	C	.	.	H	α-helix	trans	-62.9	-42.1	179.5	-60	0	0	0	0	111.4	A119 V120 N125 Q126 N127 Q128	A119-S123 WeakPolarHBondContact O-CB 3.49Å; A119-S123 PolarHBondContact O-N 3.17Å; A119-S123 PolarHBondContact O-OG 3.02Å; V120-S123 PolarHBondContact O-N 3.03Å; V120-S123 VanDerWaalsContact O-N 3.15Å; S123-N125 PolarHBondContact O-N 3Å; S123-Q126 CarbonylContact O-C 3.51Å; S123-Q126 PolarHBondContact O-N 3.36Å; S123-Q126 VanDerWaalsContact O-N 3.11Å; S123-N127 PolarHBondContact O-N 3.21Å; S123-N127 VanDerWaalsContact O-N 3.11Å; S123-Q128 PolarHBondContact O-N 3.5Å
124	L	93.4	Very high	94.7	Very high	51 Å²	51	25.8 Å²	25.8	27%	0.267	13%	0.131	S	C	.	.	H	α-helix	trans	-61	-42.9	174.2	-67.7	176	0	0	0	112	V120 A121 K122 Q126 N127 F151 T168 V169	V120-L124 HydrophobicContact CG1-CD1 3.99Å; V120-L124 HydrophobicContact CG1-CG 4.34Å; V120-L124 WeakPolarHBondContact O-CG 3.42Å; V120-L124 PolarHBondContact O-N 2.83Å; A121-L124 PolarHBondContact O-N 2.82Å; K122-L124 VanDerWaalsContact C-N 3.34Å; K122-L124 PolarHBondContact O-N 3.25Å; L124-Q126 PolarHBondContact O-N 3.42Å; L124-N127 PolarHBondContact O-N 2.98Å; L124-N127 VanDerWaalsContact O-N 3.16Å; L124-F151 HydrophobicContact CD1-CD1 3.51Å; L124-F151 HydrophobicContact CD1-CE1 3.93Å; L124-F151 HydrophobicContact CD1-CG 4.27Å; L124-T168 HydrophobicContact CD2-CG2 3.57Å; L124-V169 HydrophobicContact CD1-CG2 4.38Å; L124-V169 HydrophobicContact CD2-CG2 4.07Å; L124-V169 HydrophobicContact CG-CG2 4.45Å
125	N	92	Very high	94.5	Very high	109 Å²	109	25.2 Å²	25.2	58%	0.583	13%	0.128	S	C	*	.	H	α-helix	trans	-64.3	-25.5	175.7	-71.8	-11.2	0	0	0	113	A121 K122 S123	A121-N125 VanDerWaalsContact O-CG 3.29Å; A121-N125 PolarHBondContact O-N 3.41Å; K122-N125 PolarHBondContact O-N 3.28Å; S123-N125 PolarHBondContact O-N 3Å
126	Q	91.3	Very high	94	Very high	69 Å²	69	27.3 Å²	27.3	32%	0.322	14%	0.138	S	C	.	.	T	Hydrogen-bonded Turn	trans	-94.8	4.1	178	-68.3	-177.5	-35.5	0	0	113.3	E99 K122 S123 L124 Q128	E99-Q126 PolarHBondContact OE1-NE2 2.84Å; K122-Q126 PolarHBondContact O-N 3.48Å; K122-Q126 VanDerWaalsContact O-N 3.09Å; S123-Q126 CarbonylContact O-C 3.51Å; S123-Q126 PolarHBondContact O-N 3.36Å; S123-Q126 VanDerWaalsContact O-N 3.11Å; L124-Q126 PolarHBondContact O-N 3.42Å; Q126-Q128 HydrophobicContact CB-CG 4.13Å; Q126-Q128 PolarHBondContact O-N 3.26Å
127	N	91.8	Very high	93.5	Very high	155 Å²	155	30.9 Å²	30.9	83%	0.829	15%	0.154	S	C	*	.	T	Hydrogen-bonded Turn	trans	53.4	38.4	-173.2	-57.8	-49.4	0	0	0	113.2	S123 L124	S123-N127 PolarHBondContact O-N 3.21Å; S123-N127 VanDerWaalsContact O-N 3.11Å; L124-N127 PolarHBondContact O-N 2.98Å; L124-N127 VanDerWaalsContact O-N 3.16Å
128	Q	93	Very high	92.8	Very high	67 Å²	67	30.5 Å²	30.5	31%	0.313	16%	0.155	S	C	.	.			trans	-107.3	147.8	177.1	-68.2	179.5	-19.2	0	0	110.7	S123 Q126 T168	S123-Q128 PolarHBondContact O-N 3.5Å; Q126-Q128 HydrophobicContact CB-CG 4.13Å; Q126-Q128 PolarHBondContact O-N 3.26Å; Q128-T168 WeakPolarHBondContact O-CG2 3.36Å
129	R	95	Very high	92.3	Very high	29 Å²	29	30.8 Å²	30.8	11%	0.109	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.4	145	171.5	-164.7	-177.9	-84.1	-116.1	-8.8	109.6	Q165 E166 A167 T168 L170 E190 V191 G192	R129-Q165 PolarHBondContact NH1-O 3.44Å; R129-E166 PolarHBondContact NH2-O 3.03Å; R129-A167 VanDerWaalsContact CZ-O 3.3Å; R129-A167 PolarHBondContact NH1-O 3.22Å; R129-T168 WeakPolarHBondContact CA-O 3.49Å; R129-T168 VanDerWaalsContact CG-O 3.24Å; R129-T168 WeakPolarHBondContact CG-O 3.3Å; R129-L170 VanDerWaalsContact NH1-CD1 3.27Å; R129-E190 HydrophobicContact CB-CB 4.22Å; R129-E190 IonicContact CZ-OE2 2.83Å; R129-E190 PolarHBondContact N-O 3.31Å; R129-E190 IonicContact NE-OE2 2.66Å; R129-E190 PolarHBondContact NE-OE2 3.28Å; R129-E190 IonicContact NH2-OE2 3.07Å; R129-V191 WeakPolarHBondContact O-CA 3.41Å; R129-G192 PolarHBondContact O-N 3.01Å
130	V	97	Very high	92	Very high	1 Å²	1	30.8 Å²	30.8	1%	0.006	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	136.1	177.8	59.5	0	0	0	0	110.4	V120 T168 V169 L170 W193 I195	V120-V130 HydrophobicContact CB-CG1 4.33Å; V120-V130 HydrophobicContact CG1-CG1 4.12Å; V120-V130 HydrophobicContact CG2-CG1 3.92Å; V120-V130 HydrophobicContact CG2-CG2 4.02Å; V130-T168 PolarHBondContact N-O 2.98Å; V130-V169 HydrophobicContact CG1-CB 4.16Å; V130-V169 HydrophobicContact CG1-CG1 4.1Å; V130-V169 HydrophobicContact CG1-CG2 3.83Å; V130-L170 PolarHBondContact O-N 3.31Å; V130-W193 WeakPolarHBondContact CA-O 3.25Å; V130-W193 HydrophobicContact CG2-CB 4.08Å; V130-I195 HydrophobicContact CG2-CD1 4.01Å; V130-I195 HydrophobicContact CG2-CG1 4.47Å
131	I	97.6	Very high	91.6	Very high	1 Å²	1	31.4 Å²	31.4	1%	0.005	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	127.6	176.9	-63.4	-178	0	0	0	109.5	T133 L170 M172 L177 V191 W193 V194 I195	I131-T133 HydrophobicContact CG2-CG2 3.81Å; I131-L170 CarbonylContact C-O 3.56Å; I131-L170 WeakPolarHBondContact CA-O 3.29Å; I131-L170 HydrophobicContact CG1-CB 4.43Å; I131-M172 HydrophobicContact CD1-CE 3.95Å; I131-M172 HydrophobicContact CD1-SD 4.39Å; I131-M172 HydrophobicContact CG1-CE 4.11Å; I131-M172 HydrophobicContact CG2-CE 3.81Å; I131-M172 HydrophobicContact CG2-CG 3.81Å; I131-M172 HydrophobicContact CG2-SD 3.7Å; I131-L177 HydrophobicContact CD1-CD1 3.84Å; I131-L177 HydrophobicContact CG2-CD2 4.39Å; I131-V191 HydrophobicContact CD1-CG1 4.37Å; I131-V191 HydrophobicContact CD1-CG2 3.56Å; I131-V191 HydrophobicContact CG1-CG1 4.21Å; I131-V191 HydrophobicContact CG1-CG2 3.92Å; I131-W193 PolarHBondContact N-O 3.17Å; I131-V194 HydrophobicContact CB-CG2 4.32Å; I131-V194 WeakPolarHBondContact O-CA 3.3Å; I131-I195 PolarHBondContact O-N 3.45Å
132	Y	97.6	Very high	91.2	Very high	1 Å²	1	32.3 Å²	32.3	0%	0.004	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	112.8	171.4	-169.8	-70.7	0	0	0	109.2	A116 T134 K143 F147 L170 I171 M172 I195 D197	A116-Y132 HydrophobicContact CB-CD2 4.19Å; A116-Y132 HydrophobicContact CB-CE2 3.6Å; Y132-T134 HydrophobicContact CD1-CG2 3.8Å; Y132-T134 HydrophobicContact CE1-CG2 3.51Å; Y132-K143 HydrophobicContact CE1-CB 4.48Å; Y132-K143 HydrophobicContact CE1-CD 4.21Å; Y132-K143 HydrophobicContact CE1-CG 3.98Å; Y132-F147 HydrophobicContact CD2-CE1 4.18Å; Y132-F147 AromaticContact CD2-CZ 3.86Å; Y132-F147 HydrophobicContact CD2-CZ 3.86Å; Y132-F147 HydrophobicContact CE2-CE1 4.49Å; Y132-F147 HydrophobicContact CE2-CE2 4.31Å; Y132-F147 AromaticContact CE2-CZ 3.73Å; Y132-F147 HydrophobicContact CE2-CZ 3.73Å; Y132-L170 PolarHBondContact N-O 2.86Å; Y132-I171 WeakPolarHBondContact O-CA 3.43Å; Y132-M172 PolarHBondContact O-N 2.91Å; Y132-I195 HydrophobicContact CD2-CB 4Å; Y132-I195 HydrophobicContact CD2-CD1 3.91Å; Y132-I195 HydrophobicContact CD2-CG2 3.79Å; Y132-I195 HydrophobicContact CE2-CG2 3.86Å; Y132-I195 HydrophobicContact CG-CB 4.44Å; Y132-I195 HydrophobicContact CG-CG2 4.49Å; Y132-D197 HydrophobicContact CE1-CB 3.69Å; Y132-D197 PolarHBondContact OH-OD2 2.85Å
133	T	97	Very high	91	Very high	0 Å²	0	32.1 Å²	32.1	0%	0	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.5	142.8	-179.4	62.2	0	0	0	0	111.4	I131 M172 L177 V194 I195 F196 D197	I131-T133 HydrophobicContact CG2-CG2 3.81Å; T133-M172 CarbonylContact C-O 3.56Å; T133-M172 WeakPolarHBondContact CA-O 3.37Å; T133-M172 HydrophobicContact CG2-CG 4.32Å; T133-L177 HydrophobicContact CG2-CB 4.34Å; T133-L177 HydrophobicContact CG2-CD2 3.59Å; T133-V194 HydrophobicContact CG2-CG1 4.34Å; T133-I195 PolarHBondContact N-O 3.42Å; T133-I195 PolarHBondContact OG1-O 3.14Å; T133-F196 HydrophobicContact CG2-CE1 4.49Å; T133-F196 WeakPolarHBondContact OG1-CA 3.14Å; T133-F196 WeakPolarHBondContact OG1-CD1 3.18Å; T133-D197 VanDerWaalsContact O-CB 3.25Å; T133-D197 WeakPolarHBondContact O-CB 3.27Å; T133-D197 PolarHBondContact O-N 3.28Å; T133-D197 VanDerWaalsContact O-N 3.13Å
134	T	93.6	Very high	91	Very high	0 Å²	0	33.6 Å²	33.6	0%	0	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.1	148.3	179.8	50.6	0	0	0	0	111	Y132 I136 L139 S140 K143 M172 T173	Y132-T134 HydrophobicContact CD1-CG2 3.8Å; Y132-T134 HydrophobicContact CE1-CG2 3.51Å; T134-I136 VanDerWaalsContact C-N 3.32Å; T134-I136 PolarHBondContact O-N 3.45Å; T134-L139 HydrophobicContact CG2-CB 4.42Å; T134-L139 HydrophobicContact CG2-CD2 4.08Å; T134-L139 HydrophobicContact CG2-CG 3.8Å; T134-S140 WeakPolarHBondContact OG1-CB 3.43Å; T134-S140 PolarHBondContact OG1-OG 3.43Å; T134-K143 HydrophobicContact CG2-CG 4.37Å; T134-M172 PolarHBondContact N-O 2.88Å; T134-M172 PolarHBondContact OG1-O 2.84Å; T134-T173 WeakPolarHBondContact O-CA 3.27Å
135	P	89.3	Confident	90.8	Very high	0 Å²	0	37.2 Å²	37.2	0%	0	18%	0.179	C	C	.	.	S	Bend	trans	-70.3	-23.2	178.3	27.5	-37.6	0	0	0	113.8	L139 E198 Y201 R207 W211	P135-L139 HydrophobicContact CG-CD2 4.34Å; P135-E198 HydrophobicContact CG-CB 4.09Å; P135-E198 HydrophobicContact CG-CG 4.47Å; P135-Y201 HydrophobicContact CB-CD1 4.48Å; P135-Y201 HydrophobicContact CB-CD2 3.55Å; P135-Y201 HydrophobicContact CB-CE2 3.88Å; P135-Y201 HydrophobicContact CB-CG 3.91Å; P135-Y201 HydrophobicContact CG-CD2 3.66Å; P135-Y201 HydrophobicContact CG-CE2 3.66Å; P135-Y201 HydrophobicContact CG-CG 4.5Å; P135-R207 VanDerWaalsContact O-CZ 3.24Å; P135-R207 PolarHBondContact O-NH1 3.34Å; P135-R207 PolarHBondContact O-NH2 3.06Å; P135-W211 HydrophobicContact CB-CZ2 3.96Å
136	I	85.4	Confident	90.7	Very high	43 Å²	43	34.3 Å²	34.3	22%	0.221	16%	0.162	C	C	.	.	S	Bend	trans	-141.4	145.7	-173.4	60.8	172.1	0	0	0	111.7	T134 A138 L139 S140 M435	T134-I136 VanDerWaalsContact C-N 3.32Å; T134-I136 PolarHBondContact O-N 3.45Å; I136-A138 VanDerWaalsContact C-N 3.3Å; I136-A138 HydrophobicContact CD1-CB 4.45Å; I136-A138 PolarHBondContact O-N 3.42Å; I136-L139 HydrophobicContact CD1-CB 4.3Å; I136-L139 HydrophobicContact CG1-CB 3.64Å; I136-L139 PolarHBondContact O-N 3.38Å; I136-L139 VanDerWaalsContact O-N 3.12Å; I136-S140 PolarHBondContact O-N 2.99Å; I136-S140 PolarHBondContact O-OG 3.21Å; I136-S140 VanDerWaalsContact O-OG 3.05Å; I136-M435 WeakPolarHBondContact CD1-O 3.49Å
137	K	84.5	Confident	90.8	Very high	76 Å²	76	31 Å²	31	33%	0.33	15%	0.146	S	C	.	.	H	α-helix	trans	-56.8	-39.9	-179.8	-59.4	-176.5	176.6	-160.7	0	113.4	L139 S140 N141 T158 D160 T173	K137-L139 VanDerWaalsContact C-N 3.29Å; K137-L139 PolarHBondContact O-N 2.89Å; K137-S140 WeakPolarHBondContact CA-OG 3.23Å; K137-S140 WeakPolarHBondContact O-CA 3.39Å; K137-S140 VanDerWaalsContact O-CB 3.3Å; K137-S140 WeakPolarHBondContact O-CB 3.36Å; K137-S140 PolarHBondContact O-N 2.94Å; K137-S140 VanDerWaalsContact O-N 3.1Å; K137-N141 PolarHBondContact O-N 3.4Å; K137-N141 PolarHBondContact O-OD1 2.87Å; K137-T158 HydrophobicContact CG-CG2 4.45Å; K137-D160 WeakPolarHBondContact CD-OD1 3.48Å; K137-D160 WeakPolarHBondContact CE-OD1 3.42Å; K137-D160 IonicContact NZ-OD1 3.51Å; K137-D160 PolarHBondContact NZ-OD1 3.34Å; K137-D160 IonicContact NZ-OD2 2.69Å; K137-D160 PolarHBondContact NZ-OD2 3.46Å; K137-T173 HydrophobicContact CG-CG2 4.12Å
138	A	79.9	Confident	90.9	Very high	19 Å²	19	26 Å²	26	16%	0.157	12%	0.124	C	C	.	.	H	α-helix	trans	-62.3	-38	179.7	0	0	0	0	0	112.1	I136 N141 Q142 L437	I136-A138 VanDerWaalsContact C-N 3.3Å; I136-A138 HydrophobicContact CD1-CB 4.45Å; I136-A138 PolarHBondContact O-N 3.42Å; A138-N141 PolarHBondContact O-N 3.45Å; A138-Q142 WeakPolarHBondContact O-CB 3.49Å; A138-Q142 PolarHBondContact O-N 3.27Å; A138-L437 HydrophobicContact CB-CD2 4.09Å
139	L	85.8	Confident	90.8	Very high	8 Å²	8	29.6 Å²	29.6	4%	0.042	14%	0.14	C	C	.	.	H	α-helix	trans	-71.3	-37.5	173.4	-178.6	52.6	0	0	0	111.1	T134 P135 I136 K137 N141 Q142 K143 G436	T134-L139 HydrophobicContact CG2-CB 4.42Å; T134-L139 HydrophobicContact CG2-CD2 4.08Å; T134-L139 HydrophobicContact CG2-CG 3.8Å; P135-L139 HydrophobicContact CG-CD2 4.34Å; I136-L139 HydrophobicContact CD1-CB 4.3Å; I136-L139 HydrophobicContact CG1-CB 3.64Å; I136-L139 PolarHBondContact O-N 3.38Å; I136-L139 VanDerWaalsContact O-N 3.12Å; K137-L139 VanDerWaalsContact C-N 3.29Å; K137-L139 PolarHBondContact O-N 2.89Å; L139-N141 VanDerWaalsContact C-N 3.33Å; L139-N141 PolarHBondContact O-N 2.75Å; L139-Q142 PolarHBondContact O-N 3.06Å; L139-K143 HydrophobicContact CD1-CD 4.36Å; L139-K143 HydrophobicContact CD1-CG 3.72Å; L139-K143 HydrophobicContact CG-CG 4.19Å; L139-K143 WeakPolarHBondContact O-CB 3.44Å; L139-K143 VanDerWaalsContact O-CG 3.26Å; L139-K143 WeakPolarHBondContact O-CG 3.44Å; L139-K143 PolarHBondContact O-N 3.3Å; L139-G436 VanDerWaalsContact CB-O 3.29Å; L139-G436 WeakPolarHBondContact CB-O 3.39Å; L139-G436 VanDerWaalsContact CD1-O 3.23Å; L139-G436 WeakPolarHBondContact CD1-O 3.35Å; L139-G436 WeakPolarHBondContact CD2-O 3.49Å; L139-G436 WeakPolarHBondContact CG-O 3.34Å
140	S	90.8	Very high	90.7	Very high	0 Å²	0	31.2 Å²	31.2	0%	0	15%	0.151	C	C	.	.	H	α-helix	trans	-56.5	-47.6	172.5	-37.6	0	0	0	0	111.1	T134 I136 K137 K143 F144 I171	T134-S140 WeakPolarHBondContact OG1-CB 3.43Å; T134-S140 PolarHBondContact OG1-OG 3.43Å; I136-S140 PolarHBondContact O-N 2.99Å; I136-S140 PolarHBondContact O-OG 3.21Å; I136-S140 VanDerWaalsContact O-OG 3.05Å; K137-S140 WeakPolarHBondContact CA-OG 3.23Å; K137-S140 WeakPolarHBondContact O-CA 3.39Å; K137-S140 VanDerWaalsContact O-CB 3.3Å; K137-S140 WeakPolarHBondContact O-CB 3.36Å; K137-S140 PolarHBondContact O-N 2.94Å; K137-S140 VanDerWaalsContact O-N 3.1Å; S140-K143 PolarHBondContact O-N 3.13Å; S140-F144 VanDerWaalsContact O-CB 3.3Å; S140-F144 WeakPolarHBondContact O-CB 3.17Å; S140-F144 PolarHBondContact O-N 3.02Å; S140-I171 WeakPolarHBondContact O-CG2 3.41Å
141	N	87	Confident	90.5	Very high	13 Å²	13	32.1 Å²	32.1	7%	0.07	15%	0.154	C	C	.	.	H	α-helix	trans	-64.7	-44.3	179.1	-65.5	0.8	0	0	0	111.7	K137 A138 L139 F144 R145 L156 Y1050	K137-N141 PolarHBondContact O-N 3.4Å; K137-N141 PolarHBondContact O-OD1 2.87Å; A138-N141 PolarHBondContact O-N 3.45Å; L139-N141 VanDerWaalsContact C-N 3.33Å; L139-N141 PolarHBondContact O-N 2.75Å; N141-F144 WeakPolarHBondContact O-CB 3.5Å; N141-F144 PolarHBondContact O-N 2.84Å; N141-R145 PolarHBondContact O-N 3.47Å; N141-R145 VanDerWaalsContact O-N 3.09Å; N141-L156 WeakPolarHBondContact OD1-CD2 3.23Å; N141-Y1050 HydrophobicContact CB-CG 4.43Å
142	Q	85.3	Confident	90.2	Very high	27 Å²	27	42.5 Å²	42.5	13%	0.126	20%	0.2	C	C	.	.	H	α-helix	trans	-59.7	-48	175.3	177.3	173.8	0.5	0	0	111.4	A138 L139 F144 R145 E146	A138-Q142 WeakPolarHBondContact O-CB 3.49Å; A138-Q142 PolarHBondContact O-N 3.27Å; L139-Q142 PolarHBondContact O-N 3.06Å; Q142-F144 VanDerWaalsContact C-N 3.31Å; Q142-F144 PolarHBondContact O-N 2.9Å; Q142-R145 PolarHBondContact O-N 3.19Å; Q142-E146 HydrophobicContact CG-CG 4.5Å; Q142-E146 WeakPolarHBondContact CG-OE1 3.42Å; Q142-E146 PolarHBondContact NE2-OE1 2.87Å; Q142-E146 WeakPolarHBondContact O-CG 3.27Å; Q142-E146 PolarHBondContact O-N 3.43Å
143	K	90.3	Very high	90	Very high	6 Å²	6	45.3 Å²	45.3	3%	0.026	22%	0.215	C	C	.	.	H	α-helix	trans	-65.6	-36.2	178.7	-69.7	-70.8	164	-156.1	0	111.6	T113 Y132 T134 L139 S140 R145 E146 F147 I171	T113-K143 PolarHBondContact OG1-NZ 3.21Å; Y132-K143 HydrophobicContact CE1-CB 4.48Å; Y132-K143 HydrophobicContact CE1-CD 4.21Å; Y132-K143 HydrophobicContact CE1-CG 3.98Å; T134-K143 HydrophobicContact CG2-CG 4.37Å; L139-K143 HydrophobicContact CD1-CD 4.36Å; L139-K143 HydrophobicContact CD1-CG 3.72Å; L139-K143 HydrophobicContact CG-CG 4.19Å; L139-K143 WeakPolarHBondContact O-CB 3.44Å; L139-K143 VanDerWaalsContact O-CG 3.26Å; L139-K143 WeakPolarHBondContact O-CG 3.44Å; L139-K143 PolarHBondContact O-N 3.3Å; S140-K143 PolarHBondContact O-N 3.13Å; K143-R145 VanDerWaalsContact C-N 3.34Å; K143-R145 PolarHBondContact O-N 3.35Å; K143-E146 IonicContact NZ-OE2 2.73Å; K143-E146 PolarHBondContact NZ-OE2 3.11Å; K143-E146 PolarHBondContact O-N 2.89Å; K143-F147 HydrophobicContact CB-CD2 4.43Å; K143-F147 HydrophobicContact CD-CD2 4.37Å; K143-F147 HydrophobicContact CD-CE2 3.88Å; K143-F147 VanDerWaalsContact O-CB 3.29Å; K143-F147 WeakPolarHBondContact O-CB 3.41Å; K143-F147 WeakPolarHBondContact O-CD2 3.38Å; K143-F147 PolarHBondContact O-N 3.5Å; K143-I171 HydrophobicContact CB-CD1 4.17Å; K143-I171 HydrophobicContact CB-CG2 4.27Å; K143-I171 WeakPolarHBondContact O-CD1 3.07Å
144	F	92.9	Very high	89.9	Confident	30 Å²	30	45.6 Å²	45.6	13%	0.132	22%	0.217	C	C	.	.	H	α-helix	trans	-58.7	-47.1	174.8	173.6	-105.6	0	0	0	111.4	S140 N141 Q142 S148 V154 L156 I163 I171 L1051	S140-F144 VanDerWaalsContact O-CB 3.3Å; S140-F144 WeakPolarHBondContact O-CB 3.17Å; S140-F144 PolarHBondContact O-N 3.02Å; N141-F144 WeakPolarHBondContact O-CB 3.5Å; N141-F144 PolarHBondContact O-N 2.84Å; Q142-F144 VanDerWaalsContact C-N 3.31Å; Q142-F144 PolarHBondContact O-N 2.9Å; F144-S148 WeakPolarHBondContact O-CB 3.42Å; F144-S148 PolarHBondContact O-N 2.98Å; F144-S148 PolarHBondContact O-OG 3.22Å; F144-V154 HydrophobicContact CD2-CG1 3.83Å; F144-V154 HydrophobicContact CE2-CB 4.43Å; F144-V154 HydrophobicContact CE2-CG1 4.13Å; F144-L156 HydrophobicContact CB-CB 4.35Å; F144-L156 HydrophobicContact CB-CD1 4.17Å; F144-L156 HydrophobicContact CB-CD2 4.33Å; F144-L156 HydrophobicContact CD1-CD2 4.33Å; F144-L156 HydrophobicContact CD2-CB 3.66Å; F144-L156 HydrophobicContact CE2-CB 4.07Å; F144-L156 HydrophobicContact CG-CB 3.93Å; F144-L156 HydrophobicContact CG-CD2 4.23Å; F144-L156 HydrophobicContact CG-CG 4.49Å; F144-I163 HydrophobicContact CE1-CD1 4.35Å; F144-I163 HydrophobicContact CZ-CD1 4.48Å; F144-I163 HydrophobicContact CZ-CG2 4.08Å; F144-I171 VanDerWaalsContact CA-CD1 3.48Å; F144-I171 HydrophobicContact CB-CD1 4.26Å; F144-L1051 HydrophobicContact CD1-CD2 4.14Å; F144-L1051 HydrophobicContact CE1-CD2 4.36Å
145	R	89.5	Confident	90	Very high	127 Å²	127	45.6 Å²	45.6	48%	0.479	22%	0.217	S	C	.	.	H	α-helix	trans	-62.6	-51.2	175.1	-176.9	174.9	172.5	174.7	-1	112.3	N141 Q142 K143 F147 S148 E149	N141-R145 PolarHBondContact O-N 3.47Å; N141-R145 VanDerWaalsContact O-N 3.09Å; Q142-R145 PolarHBondContact O-N 3.19Å; K143-R145 VanDerWaalsContact C-N 3.34Å; K143-R145 PolarHBondContact O-N 3.35Å; R145-F147 VanDerWaalsContact C-N 3.33Å; R145-F147 PolarHBondContact O-N 2.87Å; R145-S148 PolarHBondContact O-N 3.17Å; R145-E149 IonicContact NE-OE1 3.56Å; R145-E149 WeakPolarHBondContact O-CG 3.17Å; R145-E149 PolarHBondContact O-N 3.09Å
146	E	90.2	Very high	90.3	Very high	48 Å²	48	45.6 Å²	45.6	22%	0.224	22%	0.217	C	C	.	.	H	α-helix	trans	-57.4	-44	179.4	-72.5	174.5	-173.1	0	0	111.9	Q142 K143 I150	Q142-E146 HydrophobicContact CG-CG 4.5Å; Q142-E146 WeakPolarHBondContact CG-OE1 3.42Å; Q142-E146 PolarHBondContact NE2-OE1 2.87Å; Q142-E146 WeakPolarHBondContact O-CG 3.27Å; Q142-E146 PolarHBondContact O-N 3.43Å; K143-E146 IonicContact NZ-OE2 2.73Å; K143-E146 PolarHBondContact NZ-OE2 3.11Å; K143-E146 PolarHBondContact O-N 2.89Å; E146-I150 WeakPolarHBondContact O-CD1 3.48Å; E146-I150 VanDerWaalsContact O-CG1 3.27Å; E146-I150 WeakPolarHBondContact O-CG1 3.47Å; E146-I150 PolarHBondContact O-N 2.78Å
147	F	93.6	Very high	90.7	Very high	0 Å²	0	44.6 Å²	44.6	0%	0	21%	0.211	C	C	.	.	H	α-helix	trans	-76.4	-31	-179	-80.3	-120	0	0	0	111.8	T113 V120 Y132 K143 R145 E149 I150 F151 V154 V169 I171	T113-F147 HydrophobicContact CG2-CE2 4.41Å; V120-F147 HydrophobicContact CG2-CD1 4.4Å; V120-F147 HydrophobicContact CG2-CE1 3.8Å; Y132-F147 HydrophobicContact CD2-CE1 4.18Å; Y132-F147 AromaticContact CD2-CZ 3.86Å; Y132-F147 HydrophobicContact CD2-CZ 3.86Å; Y132-F147 HydrophobicContact CE2-CE1 4.49Å; Y132-F147 HydrophobicContact CE2-CE2 4.31Å; Y132-F147 AromaticContact CE2-CZ 3.73Å; Y132-F147 HydrophobicContact CE2-CZ 3.73Å; K143-F147 HydrophobicContact CB-CD2 4.43Å; K143-F147 HydrophobicContact CD-CD2 4.37Å; K143-F147 HydrophobicContact CD-CE2 3.88Å; K143-F147 VanDerWaalsContact O-CB 3.29Å; K143-F147 WeakPolarHBondContact O-CB 3.41Å; K143-F147 WeakPolarHBondContact O-CD2 3.38Å; K143-F147 PolarHBondContact O-N 3.5Å; R145-F147 VanDerWaalsContact C-N 3.33Å; R145-F147 PolarHBondContact O-N 2.87Å; F147-E149 VanDerWaalsContact C-N 3.3Å; F147-E149 PolarHBondContact O-N 2.88Å; F147-I150 PolarHBondContact O-N 2.7Å; F147-I150 VanDerWaalsContact O-N 3.16Å; F147-F151 HydrophobicContact CB-CD2 4.27Å; F147-F151 AromaticContact CD1-CD2 3.81Å; F147-F151 HydrophobicContact CD1-CD2 3.81Å; F147-F151 AromaticContact CD1-CE2 3.76Å; F147-F151 HydrophobicContact CD1-CE2 3.76Å; F147-F151 HydrophobicContact CE1-CE2 4.09Å; F147-F151 HydrophobicContact CG-CD2 4.34Å; F147-F151 HydrophobicContact CG-CE2 4.5Å; F147-F151 WeakPolarHBondContact O-CA 2.99Å; F147-F151 WeakPolarHBondContact O-CB 3.17Å; F147-F151 PolarHBondContact O-N 3.21Å; F147-V154 HydrophobicContact CB-CG1 4.17Å; F147-V154 HydrophobicContact CB-CG2 4.29Å; F147-V169 HydrophobicContact CD1-CG1 4.32Å; F147-I171 HydrophobicContact CB-CD1 3.83Å; F147-I171 HydrophobicContact CD2-CD1 4.38Å; F147-I171 HydrophobicContact CG-CD1 3.99Å
148	S	93.5	Very high	90.9	Very high	51 Å²	51	41.1 Å²	41.1	36%	0.357	20%	0.196	S	C	.	.	H	α-helix	trans	-69.6	-27.8	175.3	-60.6	0	0	0	0	112.5	F144 R145 I150 F151	F144-S148 WeakPolarHBondContact O-CB 3.42Å; F144-S148 PolarHBondContact O-N 2.98Å; F144-S148 PolarHBondContact O-OG 3.22Å; R145-S148 PolarHBondContact O-N 3.17Å; S148-I150 VanDerWaalsContact C-N 3.3Å; S148-F151 CarbonylContact C-O 3.53Å; S148-F151 WeakPolarHBondContact CA-O 3.39Å; S148-F151 VanDerWaalsContact O-O 3.11Å
149	E	91.6	Very high	90.8	Very high	141 Å²	141	41.9 Å²	41.9	66%	0.659	21%	0.206	S	C	*	.	H	α-helix	trans	-71.2	-28.8	171.1	-71.3	173.7	-168	0	0	111.8	R145 F147	R145-E149 IonicContact NE-OE1 3.56Å; R145-E149 WeakPolarHBondContact O-CG 3.17Å; R145-E149 PolarHBondContact O-N 3.09Å; F147-E149 VanDerWaalsContact C-N 3.3Å; F147-E149 PolarHBondContact O-N 2.88Å
150	I	92.1	Very high	90.2	Very high	64 Å²	64	45.1 Å²	45.1	33%	0.328	22%	0.223	S	C	.	.	H	α-helix	trans	-94.1	-40.9	-175.1	-67	170.6	0	0	0	112.8	R79 E117 E146 F147 S148	R79-I150 VanDerWaalsContact CZ-CG2 3.43Å; E117-I150 HydrophobicContact CG-CD1 4.49Å; E146-I150 WeakPolarHBondContact O-CD1 3.48Å; E146-I150 VanDerWaalsContact O-CG1 3.27Å; E146-I150 WeakPolarHBondContact O-CG1 3.47Å; E146-I150 PolarHBondContact O-N 2.78Å; F147-I150 PolarHBondContact O-N 2.7Å; F147-I150 VanDerWaalsContact O-N 3.16Å; S148-I150 VanDerWaalsContact C-N 3.3Å
151	F	93.7	Very high	89.8	Confident	19 Å²	19	47.3 Å²	47.3	8%	0.083	23%	0.234	C	C	.	.			trans	-125	143.5	-173	-55.6	-74.3	0	0	0	109	V120 A121 L124 F147 S148 V154	V120-F151 HydrophobicContact CB-CE2 4.11Å; V120-F151 HydrophobicContact CB-CZ 3.94Å; V120-F151 HydrophobicContact CG1-CD1 4.15Å; V120-F151 HydrophobicContact CG1-CD2 3.94Å; V120-F151 HydrophobicContact CG1-CE1 3.85Å; V120-F151 HydrophobicContact CG1-CE2 3.63Å; V120-F151 HydrophobicContact CG1-CG 4.19Å; V120-F151 HydrophobicContact CG1-CZ 3.57Å; A121-F151 HydrophobicContact CB-CE1 4.36Å; L124-F151 HydrophobicContact CD1-CD1 3.51Å; L124-F151 HydrophobicContact CD1-CE1 3.93Å; L124-F151 HydrophobicContact CD1-CG 4.27Å; F147-F151 HydrophobicContact CB-CD2 4.27Å; F147-F151 AromaticContact CD1-CD2 3.81Å; F147-F151 HydrophobicContact CD1-CD2 3.81Å; F147-F151 AromaticContact CD1-CE2 3.76Å; F147-F151 HydrophobicContact CD1-CE2 3.76Å; F147-F151 HydrophobicContact CE1-CE2 4.09Å; F147-F151 HydrophobicContact CG-CD2 4.34Å; F147-F151 HydrophobicContact CG-CE2 4.5Å; F147-F151 WeakPolarHBondContact O-CA 2.99Å; F147-F151 WeakPolarHBondContact O-CB 3.17Å; F147-F151 PolarHBondContact O-N 3.21Å; S148-F151 CarbonylContact C-O 3.53Å; S148-F151 WeakPolarHBondContact CA-O 3.39Å; S148-F151 VanDerWaalsContact O-O 3.11Å; F151-V154 HydrophobicContact CB-CG2 3.85Å
152	K	90.3	Very high	89.9	Confident	220 Å²	220	50 Å²	50	96%	0.957	25%	0.251	S	S	*	.	S	Bend	trans	-79.3	-36.6	-174.7	-65.7	-176.1	179.3	-179.1	0	113.9
153	D	93.4	Very high	90.2	Very high	59 Å²	59	51.4 Å²	51.4	32%	0.316	26%	0.259	S	S	.	.	S	Bend	trans	-108.5	81.1	-170.5	-175	31.4	0	0	0	111.1	N164 A167 T168 V169	D153-N164 PolarHBondContact OD1-ND2 3.23Å; D153-A167 WeakPolarHBondContact OD1-CA 3.47Å; D153-A167 WeakPolarHBondContact OD1-CB 3.44Å; D153-T168 VanDerWaalsContact OD2-CB 3.26Å; D153-T168 WeakPolarHBondContact OD2-CB 3.33Å; D153-T168 PolarHBondContact OD2-N 2.95Å; D153-T168 PolarHBondContact OD2-OG1 3.01Å; D153-V169 WeakPolarHBondContact O-CB 3.29Å; D153-V169 PolarHBondContact O-N 3.23Å
154	V	96	Very high	90.2	Very high	7 Å²	7	54.7 Å²	54.7	4%	0.042	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	137.1	-176.3	-171.5	0	0	0	0	109.7	F144 F147 F151 N164 V169 I171	F144-V154 HydrophobicContact CD2-CG1 3.83Å; F144-V154 HydrophobicContact CE2-CB 4.43Å; F144-V154 HydrophobicContact CE2-CG1 4.13Å; F147-V154 HydrophobicContact CB-CG1 4.17Å; F147-V154 HydrophobicContact CB-CG2 4.29Å; F151-V154 HydrophobicContact CB-CG2 3.85Å; V154-N164 PolarHBondContact O-ND2 2.99Å; V154-V169 CarbonylContact C-O 3.6Å; V154-V169 WeakPolarHBondContact CA-O 3.18Å; V154-V169 HydrophobicContact CG1-CB 4.48Å; V154-V169 HydrophobicContact CG1-CG1 4.34Å; V154-V169 HydrophobicContact CG2-CB 4.23Å; V154-I171 HydrophobicContact CG1-CD1 3.81Å
155	G	95.9	Very high	90.2	Very high	0 Å²	0	58.5 Å²	58.5	0%	0	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	159.4	175	0	0	0	0	0	111.9	I163 N164 A167 V169 I171	G155-I163 CarbonylContact C-O 3.55Å; G155-I163 VanDerWaalsContact CA-O 3.26Å; G155-I163 WeakPolarHBondContact CA-O 3.4Å; G155-N164 WeakPolarHBondContact CA-O 3.28Å; G155-A167 VanDerWaalsContact N-CB 3.27Å; G155-V169 PolarHBondContact N-O 2.86Å; G155-I171 PolarHBondContact O-N 3.22Å
156	L	95.1	Very high	90.3	Very high	0 Å²	0	60.4 Å²	60.4	0%	0	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	128.9	178.7	177.1	65.3	0	0	0	109.6	N141 F144 T158 T162 I163 I171 L1051	N141-L156 WeakPolarHBondContact OD1-CD2 3.23Å; F144-L156 HydrophobicContact CB-CB 4.35Å; F144-L156 HydrophobicContact CB-CD1 4.17Å; F144-L156 HydrophobicContact CB-CD2 4.33Å; F144-L156 HydrophobicContact CD1-CD2 4.33Å; F144-L156 HydrophobicContact CD2-CB 3.66Å; F144-L156 HydrophobicContact CE2-CB 4.07Å; F144-L156 HydrophobicContact CG-CB 3.93Å; F144-L156 HydrophobicContact CG-CD2 4.23Å; F144-L156 HydrophobicContact CG-CG 4.49Å; L156-T158 HydrophobicContact CD1-CG2 3.83Å; L156-T158 HydrophobicContact CG-CG2 4.2Å; L156-T162 CarbonylContact O-C 3.51Å; L156-T162 WeakPolarHBondContact O-CA 3.26Å; L156-I163 HydrophobicContact CB-CB 4.28Å; L156-I163 HydrophobicContact CD2-CD1 4.32Å; L156-I163 PolarHBondContact N-O 3.12Å; L156-I163 PolarHBondContact O-N 2.73Å; L156-I171 CarbonylContact C-O 3.57Å; L156-I171 VanDerWaalsContact CA-O 3.3Å; L156-I171 WeakPolarHBondContact CA-O 3.46Å; L156-I171 HydrophobicContact CD1-CB 4.44Å; L156-I171 HydrophobicContact CD1-CG2 4.09Å; L156-L1051 HydrophobicContact CD2-CD2 3.79Å
157	M	93.1	Very high	90.5	Very high	22 Å²	22	58.1 Å²	58.1	11%	0.108	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.5	102.4	173.7	-56.3	-178.8	69.4	0	0	110.3	T162 Q165 L170 I171 M172 T173 I176 M180	M157-T162 HydrophobicContact CE-CG2 4.46Å; M157-T162 HydrophobicContact CG-CG2 3.9Å; M157-Q165 HydrophobicContact CE-CG 4.25Å; M157-Q165 HydrophobicContact SD-CG 4.4Å; M157-L170 HydrophobicContact SD-CD1 4.14Å; M157-L170 HydrophobicContact SD-CD2 4.42Å; M157-I171 PolarHBondContact N-O 3.03Å; M157-M172 HydrophobicContact CB-CB 4Å; M157-M172 WeakPolarHBondContact O-CA 3.44Å; M157-M172 WeakPolarHBondContact O-CB 3.5Å; M157-M172 HydrophobicContact SD-CE 4.11Å; M157-T173 PolarHBondContact O-N 3.39Å; M157-I176 HydrophobicContact CB-CG2 4.11Å; M157-I176 HydrophobicContact CE-CG2 4.36Å; M157-M180 HydrophobicContact CE-SD 4.21Å; M157-M180 HydrophobicContact SD-SD 4.48Å
158	T	88.3	Confident	90.5	Very high	3 Å²	3	60.2 Å²	60.2	2%	0.018	31%	0.312	C	S	.	.			trans	-115.1	168.8	170.2	66.5	0	0	0	0	109.5	K137 L156 D160 I161 T173	K137-T158 HydrophobicContact CG-CG2 4.45Å; L156-T158 HydrophobicContact CD1-CG2 3.83Å; L156-T158 HydrophobicContact CG-CG2 4.2Å; T158-D160 WeakPolarHBondContact CB-OD1 3.49Å; T158-D160 PolarHBondContact O-N 3.27Å; T158-D160 VanDerWaalsContact O-N 3.1Å; T158-D160 PolarHBondContact OG1-OD1 3.05Å; T158-I161 PolarHBondContact N-O 2.92Å; T158-I161 VanDerWaalsContact O-O 3.09Å; T158-I161 PolarHBondContact OG1-N 3.39Å; T158-I161 PolarHBondContact OG1-O 3.33Å; T158-T173 HydrophobicContact CG2-CG2 4.31Å
159	G	77.9	Confident	90.7	Very high	34 Å²	34	57.8 Å²	57.8	35%	0.351	30%	0.295	S	S	.	.	S	Bend	trans	-62.6	-16	179.6	0	0	0	0	0	115.4
160	D	73.7	Confident	90.9	Very high	76 Å²	76	51.1 Å²	51.1	41%	0.406	26%	0.263	S	S	.	.	S	Bend	trans	-112.7	-27.6	-178.1	48.5	-22.3	0	0	0	114	K137 T158	K137-D160 WeakPolarHBondContact CD-OD1 3.48Å; K137-D160 WeakPolarHBondContact CE-OD1 3.42Å; K137-D160 IonicContact NZ-OD1 3.51Å; K137-D160 PolarHBondContact NZ-OD1 3.34Å; K137-D160 IonicContact NZ-OD2 2.69Å; K137-D160 PolarHBondContact NZ-OD2 3.46Å; T158-D160 WeakPolarHBondContact CB-OD1 3.49Å; T158-D160 PolarHBondContact O-N 3.27Å; T158-D160 VanDerWaalsContact O-N 3.1Å; T158-D160 PolarHBondContact OG1-OD1 3.05Å
161	I	81.9	Confident	91.2	Very high	47 Å²	47	48 Å²	48	24%	0.241	25%	0.248	C	C	.	.			trans	-135.9	138.6	-173	-60.9	178.4	0	0	0	109	T158 I163 L1051	T158-I161 PolarHBondContact N-O 2.92Å; T158-I161 VanDerWaalsContact O-O 3.09Å; T158-I161 PolarHBondContact OG1-N 3.39Å; T158-I161 PolarHBondContact OG1-O 3.33Å; I161-I163 HydrophobicContact CG2-CD1 3.98Å; I161-I163 HydrophobicContact CG2-CG1 3.85Å; I161-L1051 HydrophobicContact CD1-CD1 3.27Å; I161-L1051 HydrophobicContact CG1-CD1 4.46Å; I161-L1051 HydrophobicContact CG2-CD1 4.04Å
162	T	89.4	Confident	91.3	Very high	68 Å²	68	47.1 Å²	47.1	42%	0.417	24%	0.244	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.3	123.9	172.8	-57.1	0	0	0	0	110.8	L156 M157 Q165	L156-T162 CarbonylContact O-C 3.51Å; L156-T162 WeakPolarHBondContact O-CA 3.26Å; M157-T162 HydrophobicContact CE-CG2 4.46Å; M157-T162 HydrophobicContact CG-CG2 3.9Å; T162-Q165 HydrophobicContact CG2-CG 3.13Å
163	I	91.5	Very high	91.5	Very high	58 Å²	58	37 Å²	37	30%	0.297	20%	0.2	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	129.6	-176.1	-57.7	173.3	0	0	0	107.8	F144 G155 L156 I161 Q165 L1051	F144-I163 HydrophobicContact CE1-CD1 4.35Å; F144-I163 HydrophobicContact CZ-CD1 4.48Å; F144-I163 HydrophobicContact CZ-CG2 4.08Å; G155-I163 CarbonylContact C-O 3.55Å; G155-I163 VanDerWaalsContact CA-O 3.26Å; G155-I163 WeakPolarHBondContact CA-O 3.4Å; L156-I163 HydrophobicContact CB-CB 4.28Å; L156-I163 HydrophobicContact CD2-CD1 4.32Å; L156-I163 PolarHBondContact N-O 3.12Å; L156-I163 PolarHBondContact O-N 2.73Å; I161-I163 HydrophobicContact CG2-CD1 3.98Å; I161-I163 HydrophobicContact CG2-CG1 3.85Å; I163-Q165 PolarHBondContact O-N 3.39Å; I163-L1051 HydrophobicContact CD1-CD1 4.5Å; I163-L1051 HydrophobicContact CD1-CD2 3.89Å
164	N	91.7	Very high	91.5	Very high	74 Å²	74	34.1 Å²	34.1	40%	0.396	19%	0.185	S	C	.	.			trans	47.7	61.2	174.3	-166.6	17.6	0	0	0	114	D153 V154 G155 E166 A167	D153-N164 PolarHBondContact OD1-ND2 3.23Å; V154-N164 PolarHBondContact O-ND2 2.99Å; G155-N164 WeakPolarHBondContact CA-O 3.28Å; N164-E166 PolarHBondContact O-N 3.34Å; N164-E166 VanDerWaalsContact O-N 3.15Å; N164-A167 HydrophobicContact CB-CB 4.44Å; N164-A167 WeakPolarHBondContact ND2-CB 3.3Å; N164-A167 VanDerWaalsContact O-CB 3.26Å; N164-A167 WeakPolarHBondContact O-CB 3.33Å; N164-A167 PolarHBondContact O-N 3.49Å; N164-A167 VanDerWaalsContact O-N 3.11Å
165	Q	91.6	Very high	91.3	Very high	111 Å²	111	35.7 Å²	35.7	52%	0.519	19%	0.192	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.9	-24	179	-63.6	-178.3	-1.2	0	0	113.4	R129 M157 T162 I163 A167	R129-Q165 PolarHBondContact NH1-O 3.44Å; M157-Q165 HydrophobicContact CE-CG 4.25Å; M157-Q165 HydrophobicContact SD-CG 4.4Å; T162-Q165 HydrophobicContact CG2-CG 3.13Å; I163-Q165 PolarHBondContact O-N 3.39Å; Q165-A167 VanDerWaalsContact C-N 3.26Å; Q165-A167 PolarHBondContact O-N 3.3Å
166	E	91.6	Very high	91.2	Very high	167 Å²	167	37.4 Å²	37.4	78%	0.78	20%	0.2	S	C	*	.	T	Hydrogen-bonded Turn	trans	-81.5	-6.7	-178	-63.9	-178.3	177.6	0	0	112.5	R129 N164	R129-E166 PolarHBondContact NH2-O 3.03Å; N164-E166 PolarHBondContact O-N 3.34Å; N164-E166 VanDerWaalsContact O-N 3.15Å
167	A	94.2	Very high	91.2	Very high	0 Å²	0	37.4 Å²	37.4	0%	0	20%	0.201	C	C	.	.			trans	-58.5	148.4	-178.8	0	0	0	0	0	113.9	R129 D153 G155 N164 Q165 V169 L170	R129-A167 VanDerWaalsContact CZ-O 3.3Å; R129-A167 PolarHBondContact NH1-O 3.22Å; D153-A167 WeakPolarHBondContact OD1-CA 3.47Å; D153-A167 WeakPolarHBondContact OD1-CB 3.44Å; G155-A167 VanDerWaalsContact N-CB 3.27Å; N164-A167 HydrophobicContact CB-CB 4.44Å; N164-A167 WeakPolarHBondContact ND2-CB 3.3Å; N164-A167 VanDerWaalsContact O-CB 3.26Å; N164-A167 WeakPolarHBondContact O-CB 3.33Å; N164-A167 PolarHBondContact O-N 3.49Å; N164-A167 VanDerWaalsContact O-N 3.11Å; Q165-A167 VanDerWaalsContact C-N 3.26Å; Q165-A167 PolarHBondContact O-N 3.3Å; A167-V169 VanDerWaalsContact C-N 3.35Å; A167-L170 HydrophobicContact CB-CD2 4.1Å
168	T	94.6	Very high	91.2	Very high	44 Å²	44	38 Å²	38	27%	0.27	20%	0.202	S	C	.	.	S	Bend	trans	-69	-33.8	173.8	-48.4	0	0	0	0	111.9	L124 Q128 R129 V130 D153	L124-T168 HydrophobicContact CD2-CG2 3.57Å; Q128-T168 WeakPolarHBondContact O-CG2 3.36Å; R129-T168 WeakPolarHBondContact CA-O 3.49Å; R129-T168 VanDerWaalsContact CG-O 3.24Å; R129-T168 WeakPolarHBondContact CG-O 3.3Å; V130-T168 PolarHBondContact N-O 2.98Å; D153-T168 VanDerWaalsContact OD2-CB 3.26Å; D153-T168 WeakPolarHBondContact OD2-CB 3.33Å; D153-T168 PolarHBondContact OD2-N 2.95Å; D153-T168 PolarHBondContact OD2-OG1 3.01Å
169	V	96.9	Very high	91.2	Very high	0 Å²	0	39.7 Å²	39.7	0%	0	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	111.8	174.4	-174.9	0	0	0	0	109.1	V120 L124 V130 F147 D153 V154 G155 A167	V120-V169 HydrophobicContact CG1-CG1 4.22Å; V120-V169 HydrophobicContact CG1-CG2 3.6Å; V120-V169 HydrophobicContact CG2-CG1 4.42Å; L124-V169 HydrophobicContact CD1-CG2 4.38Å; L124-V169 HydrophobicContact CD2-CG2 4.07Å; L124-V169 HydrophobicContact CG-CG2 4.45Å; V130-V169 HydrophobicContact CG1-CB 4.16Å; V130-V169 HydrophobicContact CG1-CG1 4.1Å; V130-V169 HydrophobicContact CG1-CG2 3.83Å; F147-V169 HydrophobicContact CD1-CG1 4.32Å; D153-V169 WeakPolarHBondContact O-CB 3.29Å; D153-V169 PolarHBondContact O-N 3.23Å; V154-V169 CarbonylContact C-O 3.6Å; V154-V169 WeakPolarHBondContact CA-O 3.18Å; V154-V169 HydrophobicContact CG1-CB 4.48Å; V154-V169 HydrophobicContact CG1-CG1 4.34Å; V154-V169 HydrophobicContact CG2-CB 4.23Å; G155-V169 PolarHBondContact N-O 2.86Å; A167-V169 VanDerWaalsContact C-N 3.35Å
170	L	97	Very high	91.9	Very high	0 Å²	0	38.9 Å²	38.9	0%	0	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	119.2	177	-68.2	-178.8	0	0	0	111.5	R129 V130 I131 Y132 M157 A167 M172 V187	R129-L170 VanDerWaalsContact NH1-CD1 3.27Å; V130-L170 PolarHBondContact O-N 3.31Å; I131-L170 CarbonylContact C-O 3.56Å; I131-L170 WeakPolarHBondContact CA-O 3.29Å; I131-L170 HydrophobicContact CG1-CB 4.43Å; Y132-L170 PolarHBondContact N-O 2.86Å; M157-L170 HydrophobicContact SD-CD1 4.14Å; M157-L170 HydrophobicContact SD-CD2 4.42Å; A167-L170 HydrophobicContact CB-CD2 4.1Å; L170-M172 HydrophobicContact CB-CE 3.68Å; L170-M172 HydrophobicContact CD1-CE 3.82Å; L170-M172 HydrophobicContact CG-CE 4.42Å; L170-V187 HydrophobicContact CD1-CG1 3.69Å
171	I	96.8	Very high	92.8	Very high	0 Å²	0	36 Å²	36	0%	0	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.9	125.8	169.8	-67	162.3	0	0	0	108.4	Y132 S140 K143 F144 F147 V154 G155 L156 M157	Y132-I171 WeakPolarHBondContact O-CA 3.43Å; S140-I171 WeakPolarHBondContact O-CG2 3.41Å; K143-I171 HydrophobicContact CB-CD1 4.17Å; K143-I171 HydrophobicContact CB-CG2 4.27Å; K143-I171 WeakPolarHBondContact O-CD1 3.07Å; F144-I171 VanDerWaalsContact CA-CD1 3.48Å; F144-I171 HydrophobicContact CB-CD1 4.26Å; F147-I171 HydrophobicContact CB-CD1 3.83Å; F147-I171 HydrophobicContact CD2-CD1 4.38Å; F147-I171 HydrophobicContact CG-CD1 3.99Å; V154-I171 HydrophobicContact CG1-CD1 3.81Å; G155-I171 PolarHBondContact O-N 3.22Å; L156-I171 CarbonylContact C-O 3.57Å; L156-I171 VanDerWaalsContact CA-O 3.3Å; L156-I171 WeakPolarHBondContact CA-O 3.46Å; L156-I171 HydrophobicContact CD1-CB 4.44Å; L156-I171 HydrophobicContact CD1-CG2 4.09Å; M157-I171 PolarHBondContact N-O 3.03Å
172	M	96	Very high	93.2	Very high	0 Å²	0	34.3 Å²	34.3	0%	0	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.3	170.2	-177.4	63.6	-177.6	70	0	0	112.8	I131 Y132 T133 T134 M157 L170 I176 L177 M180	I131-M172 HydrophobicContact CD1-CE 3.95Å; I131-M172 HydrophobicContact CD1-SD 4.39Å; I131-M172 HydrophobicContact CG1-CE 4.11Å; I131-M172 HydrophobicContact CG2-CE 3.81Å; I131-M172 HydrophobicContact CG2-CG 3.81Å; I131-M172 HydrophobicContact CG2-SD 3.7Å; Y132-M172 PolarHBondContact O-N 2.91Å; T133-M172 CarbonylContact C-O 3.56Å; T133-M172 WeakPolarHBondContact CA-O 3.37Å; T133-M172 HydrophobicContact CG2-CG 4.32Å; T134-M172 PolarHBondContact N-O 2.88Å; T134-M172 PolarHBondContact OG1-O 2.84Å; M157-M172 HydrophobicContact CB-CB 4Å; M157-M172 WeakPolarHBondContact O-CA 3.44Å; M157-M172 WeakPolarHBondContact O-CB 3.5Å; M157-M172 HydrophobicContact SD-CE 4.11Å; L170-M172 HydrophobicContact CB-CE 3.68Å; L170-M172 HydrophobicContact CD1-CE 3.82Å; L170-M172 HydrophobicContact CG-CE 4.42Å; M172-I176 HydrophobicContact CB-CB 4.43Å; M172-I176 HydrophobicContact CB-CG2 4.46Å; M172-I176 HydrophobicContact SD-CG2 4.32Å; M172-L177 HydrophobicContact SD-CB 3.82Å; M172-L177 HydrophobicContact SD-CD1 4.26Å; M172-M180 HydrophobicContact CE-SD 4.23Å; M172-M180 HydrophobicContact SD-SD 4.24Å
173	T	94.5	Very high	93	Very high	6 Å²	6	38.2 Å²	38.2	4%	0.037	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.4	155.9	167.4	71.4	0	0	0	0	110.8	T134 K137 M157 T158 E175 I176 L177	T134-T173 WeakPolarHBondContact O-CA 3.27Å; K137-T173 HydrophobicContact CG-CG2 4.12Å; M157-T173 PolarHBondContact O-N 3.39Å; T158-T173 HydrophobicContact CG2-CG2 4.31Å; T173-E175 WeakPolarHBondContact CB-OE2 3.35Å; T173-E175 PolarHBondContact O-N 3.3Å; T173-E175 PolarHBondContact OG1-OE2 2.91Å; T173-I176 PolarHBondContact O-N 3.31Å; T173-I176 VanDerWaalsContact O-N 3.13Å; T173-L177 PolarHBondContact O-N 3.2Å
174	T	94.2	Very high	92.6	Very high	0 Å²	0	39 Å²	39	0%	0	19%	0.194	C	C	.	.	H	α-helix	trans	-59.5	-33.7	-179.5	-47	0	0	0	0	112.4	I176 L177 R178 I210 W211	T174-I176 VanDerWaalsContact C-N 3.33Å; T174-I176 PolarHBondContact O-N 3.43Å; T174-L177 PolarHBondContact O-N 3.01Å; T174-R178 PolarHBondContact O-N 3.35Å; T174-I210 HydrophobicContact CG2-CG2 4.2Å; T174-W211 HydrophobicContact CG2-CD2 3.94Å; T174-W211 HydrophobicContact CG2-CE3 4.19Å; T174-W211 HydrophobicContact CG2-CG 4.2Å; T174-W211 WeakPolarHBondContact OG1-CH2 3.27Å; T174-W211 VanDerWaalsContact OG1-CZ2 3.23Å; T174-W211 WeakPolarHBondContact OG1-CZ2 3.42Å
175	E	91.6	Very high	92.3	Very high	39 Å²	39	37.2 Å²	37.2	18%	0.182	19%	0.187	C	C	.	.	H	α-helix	trans	-61.6	-38.5	176.5	-67.1	79.1	-175.2	0	0	113	T173 S179 R207 I210	T173-E175 WeakPolarHBondContact CB-OE2 3.35Å; T173-E175 PolarHBondContact O-N 3.3Å; T173-E175 PolarHBondContact OG1-OE2 2.91Å; E175-S179 WeakPolarHBondContact O-CB 3.41Å; E175-S179 PolarHBondContact O-N 3.38Å; E175-S179 PolarHBondContact O-OG 3.14Å; E175-R207 IonicContact OE1-CZ 3.03Å; E175-R207 VanDerWaalsContact OE1-CZ 3.25Å; E175-R207 IonicContact OE1-NE 2.88Å; E175-R207 PolarHBondContact OE1-NE 2.78Å; E175-R207 IonicContact OE1-NH2 3.83Å; E175-R207 PolarHBondContact OE1-NH2 3.27Å; E175-R207 IonicContact OE2-NH2 3.59Å; E175-R207 PolarHBondContact OE2-NH2 2.82Å; E175-I210 HydrophobicContact CG-CD1 3.85Å; E175-I210 HydrophobicContact CG-CG2 4.24Å
176	I	92.8	Very high	92	Very high	36 Å²	36	37 Å²	37	19%	0.185	19%	0.189	C	C	.	.	H	α-helix	trans	-68.7	-45.9	179.4	-62.4	-59.9	0	0	0	109.4	M157 M172 T173 T174 R178 S179 M180	M157-I176 HydrophobicContact CB-CG2 4.11Å; M157-I176 HydrophobicContact CE-CG2 4.36Å; M172-I176 HydrophobicContact CB-CB 4.43Å; M172-I176 HydrophobicContact CB-CG2 4.46Å; M172-I176 HydrophobicContact SD-CG2 4.32Å; T173-I176 PolarHBondContact O-N 3.31Å; T173-I176 VanDerWaalsContact O-N 3.13Å; T174-I176 VanDerWaalsContact C-N 3.33Å; T174-I176 PolarHBondContact O-N 3.43Å; I176-R178 VanDerWaalsContact C-N 3.35Å; I176-R178 PolarHBondContact O-N 3.44Å; I176-S179 PolarHBondContact O-N 3.29Å; I176-S179 VanDerWaalsContact O-N 3.13Å; I176-M180 HydrophobicContact CG2-CG 4.46Å; I176-M180 HydrophobicContact CG2-SD 4.05Å; I176-M180 VanDerWaalsContact O-CG 3.31Å; I176-M180 WeakPolarHBondContact O-CG 3.46Å; I176-M180 PolarHBondContact O-N 3.26Å
177	L	95.1	Very high	91.8	Very high	1 Å²	1	30.5 Å²	30.5	1%	0.005	16%	0.161	C	C	.	.	H	α-helix	trans	-58.4	-46.4	175.9	-177.7	56.4	0	0	0	111.5	I131 T133 M172 T173 T174 S179 M180 L181 V194 F196 T214	I131-L177 HydrophobicContact CD1-CD1 3.84Å; I131-L177 HydrophobicContact CG2-CD2 4.39Å; T133-L177 HydrophobicContact CG2-CB 4.34Å; T133-L177 HydrophobicContact CG2-CD2 3.59Å; M172-L177 HydrophobicContact SD-CB 3.82Å; M172-L177 HydrophobicContact SD-CD1 4.26Å; T173-L177 PolarHBondContact O-N 3.2Å; T174-L177 PolarHBondContact O-N 3.01Å; L177-S179 VanDerWaalsContact C-N 3.3Å; L177-S179 PolarHBondContact O-N 3.21Å; L177-M180 WeakPolarHBondContact O-CB 3.29Å; L177-M180 PolarHBondContact O-N 2.93Å; L177-L181 HydrophobicContact CD1-CG 4.48Å; L177-L181 HydrophobicContact CG-CD1 4.27Å; L177-L181 WeakPolarHBondContact O-CG 3.29Å; L177-L181 PolarHBondContact O-N 2.99Å; L177-V194 HydrophobicContact CD2-CG1 4.01Å; L177-F196 HydrophobicContact CD2-CZ 4.46Å; L177-T214 HydrophobicContact CB-CG2 4.3Å; L177-T214 HydrophobicContact CD2-CG2 3.62Å; L177-T214 HydrophobicContact CG-CG2 3.75Å
178	R	93.2	Very high	91.4	Very high	34 Å²	34	31.3 Å²	31.3	13%	0.128	17%	0.166	C	C	.	.	H	α-helix	trans	-55	-47.4	174.4	-175.2	-169	60	173.3	3.4	111.8	T174 I176 M180 L181 Y182 I210 E213 T214	T174-R178 PolarHBondContact O-N 3.35Å; I176-R178 VanDerWaalsContact C-N 3.35Å; I176-R178 PolarHBondContact O-N 3.44Å; R178-M180 VanDerWaalsContact C-N 3.29Å; R178-M180 PolarHBondContact O-N 3.37Å; R178-L181 PolarHBondContact O-N 2.9Å; R178-Y182 HydrophobicContact CG-CD2 3.97Å; R178-Y182 HydrophobicContact CG-CE2 3.93Å; R178-Y182 PolarHBondContact O-N 3.04Å; R178-I210 HydrophobicContact CB-CG2 4.26Å; R178-E213 WeakPolarHBondContact CD-OE2 3.47Å; R178-E213 HydrophobicContact CG-CG 4.27Å; R178-E213 IonicContact CZ-OE2 2.7Å; R178-E213 IonicContact NE-OE2 3.61Å; R178-E213 IonicContact NH1-OE2 2.78Å; R178-E213 PolarHBondContact NH1-OE2 3.4Å; R178-T214 WeakPolarHBondContact CB-OG1 3.43Å
179	S	89.8	Confident	91	Very high	39 Å²	39	38.2 Å²	38.2	27%	0.273	19%	0.187	S	C	.	.	H	α-helix	trans	-64.5	-36.2	-177.7	-55.9	0	0	0	0	111.6	E175 I176 L177 Y182 R183	E175-S179 WeakPolarHBondContact O-CB 3.41Å; E175-S179 PolarHBondContact O-N 3.38Å; E175-S179 PolarHBondContact O-OG 3.14Å; I176-S179 PolarHBondContact O-N 3.29Å; I176-S179 VanDerWaalsContact O-N 3.13Å; L177-S179 VanDerWaalsContact C-N 3.3Å; L177-S179 PolarHBondContact O-N 3.21Å; S179-Y182 PolarHBondContact O-N 3.34Å; S179-R183 WeakPolarHBondContact O-CB 3.42Å; S179-R183 WeakPolarHBondContact O-CG 3.4Å; S179-R183 PolarHBondContact O-N 3.29Å
180	M	91.2	Very high	90.6	Very high	16 Å²	16	43.7 Å²	43.7	8%	0.079	21%	0.213	C	C	.	.	H	α-helix	trans	-66.9	-38.5	173.8	-69.4	176.1	73.6	0	0	112.3	M157 M172 I176 L177 R178 R183 S184 S185 V187 T188	M157-M180 HydrophobicContact CE-SD 4.21Å; M157-M180 HydrophobicContact SD-SD 4.48Å; M172-M180 HydrophobicContact CE-SD 4.23Å; M172-M180 HydrophobicContact SD-SD 4.24Å; I176-M180 HydrophobicContact CG2-CG 4.46Å; I176-M180 HydrophobicContact CG2-SD 4.05Å; I176-M180 VanDerWaalsContact O-CG 3.31Å; I176-M180 WeakPolarHBondContact O-CG 3.46Å; I176-M180 PolarHBondContact O-N 3.26Å; L177-M180 WeakPolarHBondContact O-CB 3.29Å; L177-M180 PolarHBondContact O-N 2.93Å; R178-M180 VanDerWaalsContact C-N 3.29Å; R178-M180 PolarHBondContact O-N 3.37Å; M180-R183 CarbonylContact O-C 3.56Å; M180-R183 PolarHBondContact O-N 3.03Å; M180-S184 PolarHBondContact O-N 3.2Å; M180-S185 PolarHBondContact O-N 3.06Å; M180-V187 HydrophobicContact CE-CB 3.47Å; M180-V187 VanDerWaalsContact CE-CB 3.47Å; M180-V187 HydrophobicContact CE-CG1 3.66Å; M180-V187 HydrophobicContact CE-CG2 3.92Å; M180-T188 HydrophobicContact CB-CG2 4.17Å
181	L	92.5	Very high	90.4	Very high	16 Å²	16	44.3 Å²	44.3	8%	0.084	22%	0.217	C	C	.	.	H	α-helix	trans	-65.7	-42	174.6	-67.5	168	0	0	0	111.5	L177 R178 R183 S184 T188 T214 L217 L218	L177-L181 HydrophobicContact CD1-CG 4.48Å; L177-L181 HydrophobicContact CG-CD1 4.27Å; L177-L181 WeakPolarHBondContact O-CG 3.29Å; L177-L181 PolarHBondContact O-N 2.99Å; R178-L181 PolarHBondContact O-N 2.9Å; L181-R183 PolarHBondContact O-N 3.14Å; L181-S184 PolarHBondContact O-N 3.41Å; L181-T188 HydrophobicContact CD2-CG2 4.05Å; L181-T214 HydrophobicContact CD1-CG2 3.82Å; L181-L217 HydrophobicContact CB-CB 4.2Å; L181-L217 HydrophobicContact CB-CD1 4.34Å; L181-L217 HydrophobicContact CD1-CB 3.93Å; L181-L218 HydrophobicContact CD1-CD2 4.23Å; L181-L218 HydrophobicContact CD1-CG 4.3Å; L181-L218 HydrophobicContact CD2-CD2 4.21Å
182	Y	90	Very high	90.3	Very high	12 Å²	12	44.9 Å²	44.9	5%	0.047	22%	0.222	C	C	.	.	H	α-helix	trans	-66	-23.4	175.4	-85.4	-44.2	0	0	0	115.5	R178 S179 E213 L217 N520 L521 R523 V524	R178-Y182 HydrophobicContact CG-CD2 3.97Å; R178-Y182 HydrophobicContact CG-CE2 3.93Å; R178-Y182 PolarHBondContact O-N 3.04Å; S179-Y182 PolarHBondContact O-N 3.34Å; Y182-E213 HydrophobicContact CE2-CG 4.42Å; Y182-E213 WeakPolarHBondContact CE2-OE1 3.06Å; Y182-E213 PolarHBondContact OH-OE1 2.82Å; Y182-L217 HydrophobicContact CD1-CD1 4.25Å; Y182-L217 HydrophobicContact CE1-CD1 3.91Å; Y182-N520 HydrophobicContact CD1-CB 3.75Å; Y182-N520 HydrophobicContact CD2-CB 4.29Å; Y182-N520 HydrophobicContact CE1-CB 3.6Å; Y182-N520 HydrophobicContact CE2-CB 4.13Å; Y182-N520 HydrophobicContact CG-CB 4.1Å; Y182-L521 HydrophobicContact CE1-CD2 3.94Å; Y182-L521 HydrophobicContact CE1-CG 4.37Å; Y182-R523 PolarHBondContact O-NH2 3.29Å; Y182-V524 HydrophobicContact CD1-CG2 4.1Å
183	R	85.6	Confident	90.4	Very high	150 Å²	150	45.2 Å²	45.2	57%	0.566	22%	0.223	S	C	*	.	T	Hydrogen-bonded Turn	trans	-98.7	0.8	177.8	-69.4	176.7	173.8	170	-2.4	112.6	S179 M180 L181 S185 E862	S179-R183 WeakPolarHBondContact O-CB 3.42Å; S179-R183 WeakPolarHBondContact O-CG 3.4Å; S179-R183 PolarHBondContact O-N 3.29Å; M180-R183 CarbonylContact O-C 3.56Å; M180-R183 PolarHBondContact O-N 3.03Å; L181-R183 PolarHBondContact O-N 3.14Å; R183-S185 VanDerWaalsContact C-N 3.26Å; R183-S185 PolarHBondContact O-N 3.49Å; R183-E862 IonicContact NH2-OE2 3.29Å; R183-E862 PolarHBondContact NH2-OE2 3.23Å
184	S	84	Confident	90.5	Very high	75 Å²	75	45 Å²	45	52%	0.524	22%	0.222	S	C	.	.	T	Hydrogen-bonded Turn	trans	49	45.9	-175.4	-56.8	0	0	0	0	113	M180 L181	M180-S184 PolarHBondContact O-N 3.2Å; L181-S184 PolarHBondContact O-N 3.41Å
185	S	84.1	Confident	90.7	Very high	35 Å²	35	45 Å²	45	25%	0.245	22%	0.222	C	C	.	.			trans	-57	137.9	-177.9	179.1	0	0	0	0	112	M180 R183 V187 T188	M180-S185 PolarHBondContact O-N 3.06Å; R183-S185 VanDerWaalsContact C-N 3.26Å; R183-S185 PolarHBondContact O-N 3.49Å; S185-V187 PolarHBondContact O-N 2.87Å; S185-V187 VanDerWaalsContact O-N 3.11Å; S185-T188 PolarHBondContact O-N 3.35Å; S185-T188 PolarHBondContact O-OG1 3.18Å
186	D	85.6	Confident	91	Very high	107 Å²	107	43.1 Å²	43.1	57%	0.572	21%	0.213	S	C	*	.	G	3₁₀ helix	trans	-57.5	-29.4	179.1	-70.7	-48.1	0	0	0	113.2	T188 R189	D186-T188 PolarHBondContact O-N 2.94Å; D186-R189 WeakPolarHBondContact O-CB 3.45Å; D186-R189 PolarHBondContact O-N 2.95Å; D186-R189 VanDerWaalsContact O-N 3.08Å; D186-R189 IonicContact OD1-CZ 3.91Å; D186-R189 IonicContact OD1-NH1 2.92Å; D186-R189 PolarHBondContact OD1-NH1 3.32Å
187	V	87.9	Confident	91.1	Very high	30 Å²	30	41.8 Å²	41.8	18%	0.182	21%	0.206	C	C	.	.	G	3₁₀ helix	trans	-56	-36.6	176.9	175.7	0	0	0	0	112	L170 M180 S185 R189 E190 V191	L170-V187 HydrophobicContact CD1-CG1 3.69Å; M180-V187 HydrophobicContact CE-CB 3.47Å; M180-V187 VanDerWaalsContact CE-CB 3.47Å; M180-V187 HydrophobicContact CE-CG1 3.66Å; M180-V187 HydrophobicContact CE-CG2 3.92Å; S185-V187 PolarHBondContact O-N 2.87Å; S185-V187 VanDerWaalsContact O-N 3.11Å; V187-R189 PolarHBondContact O-N 3.03Å; V187-E190 PolarHBondContact O-N 3.33Å; V187-V191 VanDerWaalsContact O-CG2 3.31Å; V187-V191 WeakPolarHBondContact O-CG2 3.48Å
188	T	85.8	Confident	90.9	Very high	17 Å²	17	42.4 Å²	42.4	10%	0.104	21%	0.209	C	C	.	.	G	3₁₀ helix	trans	-72.4	-15.9	-176.4	64.8	0	0	0	0	113	M180 L181 S185 D186	M180-T188 HydrophobicContact CB-CG2 4.17Å; L181-T188 HydrophobicContact CD2-CG2 4.05Å; S185-T188 PolarHBondContact O-N 3.35Å; S185-T188 PolarHBondContact O-OG1 3.18Å; D186-T188 PolarHBondContact O-N 2.94Å
189	R	86	Confident	90.9	Very high	189 Å²	189	40.8 Å²	40.8	71%	0.713	20%	0.203	S	C	*	.	G	3₁₀ helix	trans	-77	-25.5	177.7	-62.4	176.6	170.3	164.1	-8.1	113	D186 V187	D186-R189 WeakPolarHBondContact O-CB 3.45Å; D186-R189 PolarHBondContact O-N 2.95Å; D186-R189 VanDerWaalsContact O-N 3.08Å; D186-R189 IonicContact OD1-CZ 3.91Å; D186-R189 IonicContact OD1-NH1 2.92Å; D186-R189 PolarHBondContact OD1-NH1 3.32Å; V187-R189 PolarHBondContact O-N 3.03Å
190	E	88.6	Confident	91	Very high	116 Å²	116	39.7 Å²	39.7	54%	0.542	19%	0.194	S	C	.	.	S	Bend	trans	-92.3	-4.6	-176.7	-61.4	178.7	173.7	0	0	113.4	R129 V187 G192	R129-E190 HydrophobicContact CB-CB 4.22Å; R129-E190 IonicContact CZ-OE2 2.83Å; R129-E190 PolarHBondContact N-O 3.31Å; R129-E190 IonicContact NE-OE2 2.66Å; R129-E190 PolarHBondContact NE-OE2 3.28Å; R129-E190 IonicContact NH2-OE2 3.07Å; V187-E190 PolarHBondContact O-N 3.33Å; E190-G192 PolarHBondContact O-N 3.24Å
191	V	93.7	Very high	90.9	Very high	13 Å²	13	39.6 Å²	39.6	8%	0.079	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.4	120.2	-172.3	-176.3	0	0	0	0	110.6	R129 I131 V187 W193 V194 V222	R129-V191 WeakPolarHBondContact O-CA 3.41Å; I131-V191 HydrophobicContact CD1-CG1 4.37Å; I131-V191 HydrophobicContact CD1-CG2 3.56Å; I131-V191 HydrophobicContact CG1-CG1 4.21Å; I131-V191 HydrophobicContact CG1-CG2 3.92Å; V187-V191 VanDerWaalsContact O-CG2 3.31Å; V187-V191 WeakPolarHBondContact O-CG2 3.48Å; V191-W193 VanDerWaalsContact CG1-O 3.24Å; V191-W193 WeakPolarHBondContact CG1-O 3.47Å; V191-V194 HydrophobicContact CG1-CG2 3.73Å; V191-V222 HydrophobicContact CG1-CG1 4.32Å
192	G	94.3	Very high	90.9	Very high	11 Å²	11	38.9 Å²	38.9	11%	0.113	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.8	-40.2	170.6	0	0	0	0	0	112.4	R129 E190 G223	R129-G192 PolarHBondContact O-N 3.01Å; E190-G192 PolarHBondContact O-N 3.24Å; G192-G223 PolarHBondContact O-N 2.88Å
193	W	97.3	Very high	90.9	Very high	7 Å²	7	41.5 Å²	41.5	3%	0.027	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.4	140.1	-174.7	-70.4	84.7	0	0	0	112.9	I96 V130 I131 V191 G223 V225	I96-W193 HydrophobicContact CB-CH2 4.46Å; I96-W193 HydrophobicContact CG1-CH2 4.49Å; I96-W193 HydrophobicContact CG1-CZ3 4.43Å; I96-W193 HydrophobicContact CG2-CH2 4.23Å; I96-W193 HydrophobicContact CG2-CZ2 4.26Å; V130-W193 WeakPolarHBondContact CA-O 3.25Å; V130-W193 HydrophobicContact CG2-CB 4.08Å; I131-W193 PolarHBondContact N-O 3.17Å; V191-W193 VanDerWaalsContact CG1-O 3.24Å; V191-W193 WeakPolarHBondContact CG1-O 3.47Å; W193-G223 VanDerWaalsContact CA-O 3.3Å; W193-G223 WeakPolarHBondContact CA-O 3.4Å; W193-V225 HydrophobicContact CE3-CG2 3.78Å; W193-V225 HydrophobicContact CZ3-CG2 3.87Å
194	V	97.8	Very high	90.8	Very high	1 Å²	1	37.1 Å²	37.1	1%	0.006	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	125.5	169	179.6	0	0	0	0	109.3	I131 T133 L177 V191 F196 L218 V222 G223 L224 V225	I131-V194 HydrophobicContact CB-CG2 4.32Å; I131-V194 WeakPolarHBondContact O-CA 3.3Å; T133-V194 HydrophobicContact CG2-CG1 4.34Å; L177-V194 HydrophobicContact CD2-CG1 4.01Å; V191-V194 HydrophobicContact CG1-CG2 3.73Å; V194-F196 HydrophobicContact CB-CE2 4.21Å; V194-F196 HydrophobicContact CG1-CD2 3.88Å; V194-F196 HydrophobicContact CG1-CE1 4.33Å; V194-F196 HydrophobicContact CG1-CE2 3.47Å; V194-F196 VanDerWaalsContact CG1-CE2 3.47Å; V194-F196 HydrophobicContact CG1-CG 4.49Å; V194-F196 HydrophobicContact CG1-CZ 3.74Å; V194-L218 HydrophobicContact CB-CD1 4.44Å; V194-L218 HydrophobicContact CG1-CD1 4.43Å; V194-L218 HydrophobicContact CG2-CD1 4.37Å; V194-L218 HydrophobicContact CG2-CD2 4.09Å; V194-V222 HydrophobicContact CB-CG1 4.19Å; V194-V222 HydrophobicContact CG2-CG1 3.65Å; V194-G223 PolarHBondContact N-O 3.29Å; V194-L224 HydrophobicContact CB-CD2 4.27Å; V194-V225 PolarHBondContact O-N 2.84Å
195	I	98	Very high	90.7	Very high	0 Å²	0	41.8 Å²	41.8	0%	0	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	120	176.7	-56.3	163	0	0	0	107.9	A116 A119 V120 V130 I131 Y132 T133 V225 L227	A116-I195 HydrophobicContact CB-CD1 4Å; A116-I195 HydrophobicContact CB-CG2 3.95Å; A119-I195 HydrophobicContact CB-CD1 3.97Å; A119-I195 HydrophobicContact CB-CG1 4.29Å; V120-I195 HydrophobicContact CG2-CD1 3.83Å; V130-I195 HydrophobicContact CG2-CD1 4.01Å; V130-I195 HydrophobicContact CG2-CG1 4.47Å; I131-I195 PolarHBondContact O-N 3.45Å; Y132-I195 HydrophobicContact CD2-CB 4Å; Y132-I195 HydrophobicContact CD2-CD1 3.91Å; Y132-I195 HydrophobicContact CD2-CG2 3.79Å; Y132-I195 HydrophobicContact CE2-CG2 3.86Å; Y132-I195 HydrophobicContact CG-CB 4.44Å; Y132-I195 HydrophobicContact CG-CG2 4.49Å; T133-I195 PolarHBondContact N-O 3.42Å; T133-I195 PolarHBondContact OG1-O 3.14Å; I195-V225 CarbonylContact C-O 3.59Å; I195-V225 WeakPolarHBondContact CA-O 3.35Å; I195-V225 HydrophobicContact CG1-CB 4.15Å; I195-V225 HydrophobicContact CG2-CB 4.45Å; I195-V225 HydrophobicContact CG2-CG1 4.4Å; I195-L227 HydrophobicContact CG2-CD1 4.26Å; I195-L227 HydrophobicContact CG2-CG 4.44Å
196	F	97.5	Very high	90.4	Very high	0 Å²	0	47.1 Å²	47.1	0%	0	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	98.7	175.6	-74.4	-77.3	0	0	0	109.8	T133 L177 V194 I199 W211 T214 I215 L218 L224 V225 F226 L227	T133-F196 HydrophobicContact CG2-CE1 4.49Å; T133-F196 WeakPolarHBondContact OG1-CA 3.14Å; T133-F196 WeakPolarHBondContact OG1-CD1 3.18Å; L177-F196 HydrophobicContact CD2-CZ 4.46Å; V194-F196 HydrophobicContact CB-CE2 4.21Å; V194-F196 HydrophobicContact CG1-CD2 3.88Å; V194-F196 HydrophobicContact CG1-CE1 4.33Å; V194-F196 HydrophobicContact CG1-CE2 3.47Å; V194-F196 VanDerWaalsContact CG1-CE2 3.47Å; V194-F196 HydrophobicContact CG1-CG 4.49Å; V194-F196 HydrophobicContact CG1-CZ 3.74Å; F196-I199 HydrophobicContact CB-CD1 4.35Å; F196-W211 HydrophobicContact CB-CZ3 4.01Å; F196-W211 AromaticContact CD1-CE3 3.72Å; F196-W211 HydrophobicContact CD1-CE3 3.72Å; F196-W211 AromaticContact CD1-CZ3 3.52Å; F196-W211 HydrophobicContact CD1-CZ3 3.52Å; F196-W211 HydrophobicContact CE1-CE3 4.32Å; F196-W211 HydrophobicContact CE1-CZ3 4.46Å; F196-W211 HydrophobicContact CG-CZ3 4.22Å; F196-T214 HydrophobicContact CE1-CG2 4.11Å; F196-T214 HydrophobicContact CZ-CG2 4.09Å; F196-I215 HydrophobicContact CE1-CG1 4.34Å; F196-I215 HydrophobicContact CE2-CG1 4.11Å; F196-I215 HydrophobicContact CZ-CG1 3.85Å; F196-L218 HydrophobicContact CE2-CD1 3.73Å; F196-L218 HydrophobicContact CZ-CD1 3.66Å; F196-L224 HydrophobicContact CE2-CD2 4.25Å; F196-V225 PolarHBondContact N-O 3.41Å; F196-F226 HydrophobicContact CB-CD1 3.78Å; F196-F226 HydrophobicContact CB-CE1 4.36Å; F196-F226 AromaticContact CD2-CD1 3.75Å; F196-F226 HydrophobicContact CD2-CD1 3.75Å; F196-F226 AromaticContact CD2-CE1 3.49Å; F196-F226 HydrophobicContact CD2-CE1 3.49Å; F196-F226 VanDerWaalsContact CD2-CE1 3.49Å; F196-F226 HydrophobicContact CD2-CZ 4.44Å; F196-F226 HydrophobicContact CE2-CE1 4.01Å; F196-F226 HydrophobicContact CG-CD1 4.06Å; F196-F226 HydrophobicContact CG-CE1 4.14Å; F196-L227 PolarHBondContact O-N 3.22Å
197	D	94.8	Very high	90.4	Very high	8 Å²	8	44.9 Å²	44.9	4%	0.043	20%	0.2	C	C	.	.	T	Hydrogen-bonded Turn	trans	-79.7	138.7	177	-159.9	11.3	0	0	0	111.2	Y132 T133 I199 W211	Y132-D197 HydrophobicContact CE1-CB 3.69Å; Y132-D197 PolarHBondContact OH-OD2 2.85Å; T133-D197 VanDerWaalsContact O-CB 3.25Å; T133-D197 WeakPolarHBondContact O-CB 3.27Å; T133-D197 PolarHBondContact O-N 3.28Å; T133-D197 VanDerWaalsContact O-N 3.13Å; D197-I199 PolarHBondContact O-N 3.39Å; D197-W211 WeakPolarHBondContact O-CH2 3.3Å
198	E	91.7	Very high	90.5	Very high	14 Å²	14	43.5 Å²	43.5	7%	0.065	19%	0.191	C	C	.	.	T	Hydrogen-bonded Turn	trans	53.6	42.4	-179	-53.8	-76.6	110.9	0	0	114.4	K112 P135 H200 Y201 L227	K112-E198 IonicContact NZ-OE1 3.57Å; P135-E198 HydrophobicContact CG-CB 4.09Å; P135-E198 HydrophobicContact CG-CG 4.47Å; E198-H200 VanDerWaalsContact CD-CE1 3.48Å; E198-H200 PolarHBondContact O-N 3.48Å; E198-H200 IonicContact OE1-CE1 3.48Å; E198-H200 IonicContact OE2-CE1 2.89Å; E198-H200 PolarHBondContact OE2-CE1 3.3Å; E198-H200 IonicContact OE2-NE2 3.74Å; E198-H200 PolarHBondContact OE2-NE2 3.14Å; E198-Y201 HydrophobicContact CB-CD2 3.63Å; E198-Y201 HydrophobicContact CB-CE2 3.82Å; E198-Y201 HydrophobicContact CG-CE2 4.46Å; E198-Y201 VanDerWaalsContact O-CD2 3.26Å; E198-Y201 WeakPolarHBondContact O-CD2 3.5Å; E198-Y201 PolarHBondContact O-N 3.49Å; E198-L227 CarbonylContact C-O 3.55Å; E198-L227 VanDerWaalsContact CA-O 3.26Å; E198-L227 WeakPolarHBondContact CA-O 3.49Å; E198-L227 PolarHBondContact N-O 3.5Å
199	I	93.9	Very high	90.8	Very high	0 Å²	0	42.9 Å²	42.9	0%	0	19%	0.188	C	C	.	.	G	3₁₀ helix	trans	-52.8	-20.9	-176.5	-172.6	55.9	0	0	0	115	M103 F196 D197 Y201 M202 W211 I215 F226 L227 S228 F237	M103-I199 HydrophobicContact CE-CG2 4.37Å; F196-I199 HydrophobicContact CB-CD1 4.35Å; D197-I199 PolarHBondContact O-N 3.39Å; I199-Y201 PolarHBondContact O-N 2.83Å; I199-Y201 VanDerWaalsContact O-N 3.08Å; I199-M202 VanDerWaalsContact O-CB 3.29Å; I199-M202 WeakPolarHBondContact O-CB 3.08Å; I199-M202 PolarHBondContact O-N 3.29Å; I199-W211 HydrophobicContact CD1-CD2 4.21Å; I199-W211 HydrophobicContact CD1-CE3 3.33Å; I199-W211 HydrophobicContact CD1-CZ3 3.83Å; I199-I215 HydrophobicContact CD1-CD1 3.96Å; I199-F226 HydrophobicContact CD1-CD1 4.28Å; I199-F226 HydrophobicContact CG1-CD1 4.03Å; I199-F226 HydrophobicContact CG2-CB 4.19Å; I199-L227 PolarHBondContact N-O 3.46Å; I199-S228 VanDerWaalsContact CG2-CB 3.48Å; I199-F237 HydrophobicContact CD1-CZ 4.44Å; I199-F237 HydrophobicContact CG1-CE2 4.37Å; I199-F237 HydrophobicContact CG1-CZ 3.97Å
200	H	91.2	Very high	91.2	Very high	17 Å²	17	34.6 Å²	34.6	8%	0.079	16%	0.158	C	C	.	.	G	3₁₀ helix	trans	-61.5	-13.7	174.7	55.7	-83.2	0	0	0	113.8	E198 M202 R203 S228 A229 I231	E198-H200 VanDerWaalsContact CD-CE1 3.48Å; E198-H200 PolarHBondContact O-N 3.48Å; E198-H200 IonicContact OE1-CE1 3.48Å; E198-H200 IonicContact OE2-CE1 2.89Å; E198-H200 PolarHBondContact OE2-CE1 3.3Å; E198-H200 IonicContact OE2-NE2 3.74Å; E198-H200 PolarHBondContact OE2-NE2 3.14Å; H200-M202 PolarHBondContact O-N 2.99Å; H200-R203 VanDerWaalsContact O-CG 3.28Å; H200-R203 WeakPolarHBondContact O-CG 3.43Å; H200-R203 PolarHBondContact O-N 3.45Å; H200-R203 PolarHBondContact O-NE 3.02Å; H200-S228 WeakPolarHBondContact CB-OG 3.09Å; H200-A229 PolarHBondContact ND1-N 3.03Å; H200-A229 VanDerWaalsContact ND1-N 3.12Å; H200-I231 HydrophobicContact CB-CG2 4.27Å
201	Y	89.3	Confident	91.5	Very high	14 Å²	14	29.1 Å²	29.1	6%	0.055	13%	0.132	C	C	.	.	G	3₁₀ helix	trans	-61	-14.1	166.9	-85.5	-74.3	0	0	0	113.9	P135 E198 I199 R203 E204 M435	P135-Y201 HydrophobicContact CB-CD1 4.48Å; P135-Y201 HydrophobicContact CB-CD2 3.55Å; P135-Y201 HydrophobicContact CB-CE2 3.88Å; P135-Y201 HydrophobicContact CB-CG 3.91Å; P135-Y201 HydrophobicContact CG-CD2 3.66Å; P135-Y201 HydrophobicContact CG-CE2 3.66Å; P135-Y201 HydrophobicContact CG-CG 4.5Å; E198-Y201 HydrophobicContact CB-CD2 3.63Å; E198-Y201 HydrophobicContact CB-CE2 3.82Å; E198-Y201 HydrophobicContact CG-CE2 4.46Å; E198-Y201 VanDerWaalsContact O-CD2 3.26Å; E198-Y201 WeakPolarHBondContact O-CD2 3.5Å; E198-Y201 PolarHBondContact O-N 3.49Å; I199-Y201 PolarHBondContact O-N 2.83Å; I199-Y201 VanDerWaalsContact O-N 3.08Å; Y201-R203 PolarHBondContact O-N 3.24Å; Y201-R203 VanDerWaalsContact O-N 3.08Å; Y201-E204 WeakPolarHBondContact O-CB 3.44Å; Y201-E204 PolarHBondContact O-N 3.36Å; Y201-M435 HydrophobicContact CE1-CE 3.46Å; Y201-M435 VanDerWaalsContact CE1-CE 3.46Å; Y201-M435 WeakPolarHBondContact OH-CB 3.24Å; Y201-M435 WeakPolarHBondContact OH-CE 3.23Å
202	M	92.5	Very high	91.5	Very high	0 Å²	0	28.5 Å²	28.5	0%	0	13%	0.128	C	C	.	.	G	3₁₀ helix	trans	-59	-19.1	172.8	-171.1	-176.8	84.4	0	0	113.4	I199 H200 E204 G208 W211 E212 F237 W240 L507 S510 F537	I199-M202 VanDerWaalsContact O-CB 3.29Å; I199-M202 WeakPolarHBondContact O-CB 3.08Å; I199-M202 PolarHBondContact O-N 3.29Å; H200-M202 PolarHBondContact O-N 2.99Å; M202-E204 VanDerWaalsContact C-N 3.3Å; M202-G208 WeakPolarHBondContact O-CA 3.49Å; M202-W211 HydrophobicContact CB-CB 4.05Å; M202-W211 HydrophobicContact CB-CG 4.41Å; M202-W211 HydrophobicContact CG-CB 3.99Å; M202-E212 HydrophobicContact CE-CG 4.49Å; M202-E212 HydrophobicContact CG-CG 3.7Å; M202-E212 HydrophobicContact SD-CG 3.54Å; M202-E212 VanDerWaalsContact SD-CG 3.54Å; M202-F237 HydrophobicContact CE-CD2 4.07Å; M202-F237 HydrophobicContact CE-CE2 3.96Å; M202-F237 HydrophobicContact SD-CE2 3.92Å; M202-W240 HydrophobicContact SD-CZ3 4.32Å; M202-L507 HydrophobicContact CB-CD1 4.11Å; M202-L507 HydrophobicContact CE-CD1 3.95Å; M202-L507 HydrophobicContact CE-CD2 3.78Å; M202-L507 HydrophobicContact CE-CG 3.69Å; M202-S510 PolarHBondContact O-OG 3.17Å; M202-F537 HydrophobicContact CE-CD1 3.44Å; M202-F537 VanDerWaalsContact CE-CD1 3.44Å; M202-F537 HydrophobicContact CE-CE1 3.77Å; M202-F537 HydrophobicContact CE-CG 4.28Å
203	R	89.5	Confident	91.5	Very high	68 Å²	68	28 Å²	28	26%	0.257	12%	0.123	S	C	.	.	G	3₁₀ helix	trans	-77.6	-11.1	173.5	79.9	-171.3	68.4	-156	-8.2	114.3	H200 Y201 K205 I231 D505 R506 L507	H200-R203 VanDerWaalsContact O-CG 3.28Å; H200-R203 WeakPolarHBondContact O-CG 3.43Å; H200-R203 PolarHBondContact O-N 3.45Å; H200-R203 PolarHBondContact O-NE 3.02Å; Y201-R203 PolarHBondContact O-N 3.24Å; Y201-R203 VanDerWaalsContact O-N 3.08Å; R203-K205 PolarHBondContact O-N 3.18Å; R203-I231 VanDerWaalsContact NH2-CG2 3.28Å; R203-D505 VanDerWaalsContact NH1-C 3.3Å; R203-D505 PolarHBondContact NH1-O 2.93Å; R203-D505 PolarHBondContact NH2-O 2.89Å; R203-R506 PolarHBondContact NH1-O 2.88Å; R203-L507 HydrophobicContact CB-CD1 4.25Å
204	E	84.1	Confident	91.4	Very high	57 Å²	57	27.7 Å²	27.7	27%	0.266	12%	0.122	S	C	.	.			trans	-67.4	121	-176.4	-174.5	-175.2	171.9	0	0	110	Y201 M202 E206 R207 G208 S510	Y201-E204 WeakPolarHBondContact O-CB 3.44Å; Y201-E204 PolarHBondContact O-N 3.36Å; M202-E204 VanDerWaalsContact C-N 3.3Å; E204-E206 PolarHBondContact O-N 3.21Å; E204-R207 PolarHBondContact O-N 3.35Å; E204-G208 VanDerWaalsContact O-CA 3.26Å; E204-G208 WeakPolarHBondContact O-CA 3.46Å; E204-G208 PolarHBondContact O-N 2.95Å; E204-S510 PolarHBondContact O-OG 2.94Å
205	K	81.5	Confident	91.3	Very high	173 Å²	173	27.6 Å²	27.6	75%	0.752	12%	0.121	S	C	*	.	T	Hydrogen-bonded Turn	trans	-54.3	-33.9	-171.9	-65.8	-176.6	178.4	179.7	0	114.9	R203 Y512	R203-K205 PolarHBondContact O-N 3.18Å; K205-Y512 WeakPolarHBondContact O-CE1 3.29Å
206	E	78.2	Confident	91.2	Very high	148 Å²	148	28 Å²	28	69%	0.692	12%	0.123	S	C	*	.	T	Hydrogen-bonded Turn	trans	-93.5	-39.8	-175.7	-63.1	-175.5	177.4	0	0	112.9	E204 Y512	E204-E206 PolarHBondContact O-N 3.21Å; E206-Y512 PolarHBondContact O-OH 3.22Å
207	R	85.6	Confident	91	Very high	60 Å²	60	29.5 Å²	29.5	23%	0.226	13%	0.131	C	C	.	.	T	Hydrogen-bonded Turn	trans	-107.7	-11.5	-172.6	-61.4	177.1	67.5	-152.4	3.4	114	P135 E175 E204 V209 I210	P135-R207 VanDerWaalsContact O-CZ 3.24Å; P135-R207 PolarHBondContact O-NH1 3.34Å; P135-R207 PolarHBondContact O-NH2 3.06Å; E175-R207 IonicContact OE1-CZ 3.03Å; E175-R207 VanDerWaalsContact OE1-CZ 3.25Å; E175-R207 IonicContact OE1-NE 2.88Å; E175-R207 PolarHBondContact OE1-NE 2.78Å; E175-R207 IonicContact OE1-NH2 3.83Å; E175-R207 PolarHBondContact OE1-NH2 3.27Å; E175-R207 IonicContact OE2-NH2 3.59Å; E175-R207 PolarHBondContact OE2-NH2 2.82Å; E204-R207 PolarHBondContact O-N 3.35Å; R207-V209 VanDerWaalsContact C-N 3.26Å; R207-V209 PolarHBondContact O-N 3.12Å; R207-I210 HydrophobicContact CB-CD1 4.49Å; R207-I210 VanDerWaalsContact O-CB 3.29Å; R207-I210 WeakPolarHBondContact O-CB 3.32Å; R207-I210 WeakPolarHBondContact O-CG1 3.21Å; R207-I210 PolarHBondContact O-N 3.08Å; R207-I210 VanDerWaalsContact O-N 3.07Å
208	G	90.3	Very high	90.9	Very high	0 Å²	0	29.6 Å²	29.6	0%	0	13%	0.131	C	C	.	.	H	α-helix	trans	-59.7	-35.4	-176.5	0	0	0	0	0	113.4	M202 E204 I210 W211 E212	M202-G208 WeakPolarHBondContact O-CA 3.49Å; E204-G208 VanDerWaalsContact O-CA 3.26Å; E204-G208 WeakPolarHBondContact O-CA 3.46Å; E204-G208 PolarHBondContact O-N 2.95Å; G208-I210 PolarHBondContact O-N 3.32Å; G208-W211 WeakPolarHBondContact O-CB 3.39Å; G208-W211 PolarHBondContact O-N 3.31Å; G208-W211 VanDerWaalsContact O-N 3.12Å; G208-E212 PolarHBondContact O-N 3.15Å
209	V	92	Very high	90.9	Very high	4 Å²	4	31.4 Å²	31.4	2%	0.024	15%	0.145	C	C	.	.	H	α-helix	trans	-57.6	-33.5	176.1	69.4	0	0	0	0	113	R207 W211 E212 E213 F511 Y512 M517	R207-V209 VanDerWaalsContact C-N 3.26Å; R207-V209 PolarHBondContact O-N 3.12Å; V209-W211 VanDerWaalsContact C-N 3.3Å; V209-W211 PolarHBondContact O-N 2.97Å; V209-E212 PolarHBondContact O-N 2.96Å; V209-E213 WeakPolarHBondContact O-CB 3.38Å; V209-E213 PolarHBondContact O-N 3.4Å; V209-F511 HydrophobicContact CG2-CD2 4Å; V209-F511 HydrophobicContact CG2-CE2 4.2Å; V209-Y512 HydrophobicContact CB-CD1 4.18Å; V209-Y512 HydrophobicContact CB-CE1 3.93Å; V209-Y512 HydrophobicContact CG1-CD1 4.27Å; V209-Y512 HydrophobicContact CG1-CE1 3.56Å; V209-M517 HydrophobicContact CG2-CE 3.39Å
210	I	93.1	Very high	90.7	Very high	16 Å²	16	35.4 Å²	35.4	8%	0.082	17%	0.166	C	C	.	.	H	α-helix	trans	-65.5	-37.4	-178.6	-53.4	-175.9	0	0	0	110.2	T174 E175 R178 R207 G208 T214	T174-I210 HydrophobicContact CG2-CG2 4.2Å; E175-I210 HydrophobicContact CG-CD1 3.85Å; E175-I210 HydrophobicContact CG-CG2 4.24Å; R178-I210 HydrophobicContact CB-CG2 4.26Å; R207-I210 HydrophobicContact CB-CD1 4.49Å; R207-I210 VanDerWaalsContact O-CB 3.29Å; R207-I210 WeakPolarHBondContact O-CB 3.32Å; R207-I210 WeakPolarHBondContact O-CG1 3.21Å; R207-I210 PolarHBondContact O-N 3.08Å; R207-I210 VanDerWaalsContact O-N 3.07Å; G208-I210 PolarHBondContact O-N 3.32Å; I210-T214 VanDerWaalsContact O-CB 3.31Å; I210-T214 WeakPolarHBondContact O-CB 3.32Å; I210-T214 PolarHBondContact O-N 3.08Å; I210-T214 PolarHBondContact O-OG1 3.17Å
211	W	95.1	Very high	90.8	Very high	0 Å²	0	39 Å²	39	0%	0	19%	0.193	C	C	.	.	H	α-helix	trans	-67.2	-48.6	177.4	-68.8	81.9	0	0	0	111.4	P135 T174 F196 D197 I199 M202 G208 V209 T214 I215	P135-W211 HydrophobicContact CB-CZ2 3.96Å; T174-W211 HydrophobicContact CG2-CD2 3.94Å; T174-W211 HydrophobicContact CG2-CE3 4.19Å; T174-W211 HydrophobicContact CG2-CG 4.2Å; T174-W211 WeakPolarHBondContact OG1-CH2 3.27Å; T174-W211 VanDerWaalsContact OG1-CZ2 3.23Å; T174-W211 WeakPolarHBondContact OG1-CZ2 3.42Å; F196-W211 HydrophobicContact CB-CZ3 4.01Å; F196-W211 AromaticContact CD1-CE3 3.72Å; F196-W211 HydrophobicContact CD1-CE3 3.72Å; F196-W211 AromaticContact CD1-CZ3 3.52Å; F196-W211 HydrophobicContact CD1-CZ3 3.52Å; F196-W211 HydrophobicContact CE1-CE3 4.32Å; F196-W211 HydrophobicContact CE1-CZ3 4.46Å; F196-W211 HydrophobicContact CG-CZ3 4.22Å; D197-W211 WeakPolarHBondContact O-CH2 3.3Å; I199-W211 HydrophobicContact CD1-CD2 4.21Å; I199-W211 HydrophobicContact CD1-CE3 3.33Å; I199-W211 HydrophobicContact CD1-CZ3 3.83Å; M202-W211 HydrophobicContact CB-CB 4.05Å; M202-W211 HydrophobicContact CB-CG 4.41Å; M202-W211 HydrophobicContact CG-CB 3.99Å; G208-W211 WeakPolarHBondContact O-CB 3.39Å; G208-W211 PolarHBondContact O-N 3.31Å; G208-W211 VanDerWaalsContact O-N 3.12Å; V209-W211 VanDerWaalsContact C-N 3.3Å; V209-W211 PolarHBondContact O-N 2.97Å; W211-T214 PolarHBondContact O-N 2.8Å; W211-I215 WeakPolarHBondContact O-CG1 3.23Å; W211-I215 PolarHBondContact O-N 3.02Å
212	E	95	Very high	91	Very high	0 Å²	0	38.7 Å²	38.7	0%	0	19%	0.192	C	C	.	.	H	α-helix	trans	-60.7	-48.2	179.1	-71.7	-171.8	-143.6	0	0	111.9	M202 G208 V209 T214 I215 I216 W240 S509 F537	M202-E212 HydrophobicContact CE-CG 4.49Å; M202-E212 HydrophobicContact CG-CG 3.7Å; M202-E212 HydrophobicContact SD-CG 3.54Å; M202-E212 VanDerWaalsContact SD-CG 3.54Å; G208-E212 PolarHBondContact O-N 3.15Å; V209-E212 PolarHBondContact O-N 2.96Å; E212-T214 VanDerWaalsContact C-N 3.31Å; E212-T214 PolarHBondContact O-N 2.93Å; E212-I215 PolarHBondContact O-N 2.54Å; E212-I216 WeakPolarHBondContact O-CD1 3.42Å; E212-I216 VanDerWaalsContact O-CG1 3.24Å; E212-I216 WeakPolarHBondContact O-CG1 3.48Å; E212-I216 PolarHBondContact O-N 2.59Å; E212-W240 HydrophobicContact CB-CH2 4.32Å; E212-W240 HydrophobicContact CG-CH2 4.15Å; E212-S509 VanDerWaalsContact CD-OG 3.23Å; E212-S509 WeakPolarHBondContact OE1-CA 3.44Å; E212-S509 WeakPolarHBondContact OE1-CB 3.43Å; E212-S509 PolarHBondContact OE1-OG 3.31Å; E212-S509 PolarHBondContact OE2-OG 2.87Å; E212-F537 HydrophobicContact CG-CB 4.44Å; E212-F537 WeakPolarHBondContact OE2-CB 3.39Å; E212-F537 PolarHBondContact OE2-N 3.29Å; E212-F537 VanDerWaalsContact OE2-N 3.13Å
213	E	93.7	Very high	91.1	Very high	1 Å²	1	39.1 Å²	39.1	1%	0.005	20%	0.197	C	C	.	.	H	α-helix	trans	-57	-44.6	177.3	-178.8	177.6	-152.4	0	0	111.6	R178 Y182 V209 I216 L217 M532	R178-E213 WeakPolarHBondContact CD-OE2 3.47Å; R178-E213 HydrophobicContact CG-CG 4.27Å; R178-E213 IonicContact CZ-OE2 2.7Å; R178-E213 IonicContact NE-OE2 3.61Å; R178-E213 IonicContact NH1-OE2 2.78Å; R178-E213 PolarHBondContact NH1-OE2 3.4Å; Y182-E213 HydrophobicContact CE2-CG 4.42Å; Y182-E213 WeakPolarHBondContact CE2-OE1 3.06Å; Y182-E213 PolarHBondContact OH-OE1 2.82Å; V209-E213 WeakPolarHBondContact O-CB 3.38Å; V209-E213 PolarHBondContact O-N 3.4Å; E213-I216 PolarHBondContact O-N 2.89Å; E213-L217 HydrophobicContact CG-CD1 4.06Å; E213-L217 WeakPolarHBondContact O-CB 3.23Å; E213-L217 WeakPolarHBondContact O-CD1 3.49Å; E213-L217 WeakPolarHBondContact O-CG 3.22Å; E213-L217 PolarHBondContact O-N 3.2Å; E213-L217 VanDerWaalsContact O-N 3.09Å; E213-M532 HydrophobicContact CG-CE 4.24Å
214	T	94.9	Very high	91.5	Very high	0 Å²	0	36 Å²	36	0%	0	19%	0.185	C	C	.	.	H	α-helix	trans	-62.7	-45.8	177.4	-58	0	0	0	0	111.4	L177 R178 L181 F196 I210 W211 E212 L217 L218	L177-T214 HydrophobicContact CB-CG2 4.3Å; L177-T214 HydrophobicContact CD2-CG2 3.62Å; L177-T214 HydrophobicContact CG-CG2 3.75Å; R178-T214 WeakPolarHBondContact CB-OG1 3.43Å; L181-T214 HydrophobicContact CD1-CG2 3.82Å; F196-T214 HydrophobicContact CE1-CG2 4.11Å; F196-T214 HydrophobicContact CZ-CG2 4.09Å; I210-T214 VanDerWaalsContact O-CB 3.31Å; I210-T214 WeakPolarHBondContact O-CB 3.32Å; I210-T214 PolarHBondContact O-N 3.08Å; I210-T214 PolarHBondContact O-OG1 3.17Å; W211-T214 PolarHBondContact O-N 2.8Å; E212-T214 VanDerWaalsContact C-N 3.31Å; E212-T214 PolarHBondContact O-N 2.93Å; T214-L217 PolarHBondContact O-N 3.36Å; T214-L218 WeakPolarHBondContact O-CG 3.17Å; T214-L218 PolarHBondContact O-N 2.88Å
215	I	96	Very high	92.2	Very high	0 Å²	0	33.3 Å²	33.3	0%	0	17%	0.173	C	C	.	.	H	α-helix	trans	-64	-44	-179.8	-67.7	166.4	0	0	0	111	F196 I199 W211 E212 L217 L218 F226 F237 W240 I241 L244 H245	F196-I215 HydrophobicContact CE1-CG1 4.34Å; F196-I215 HydrophobicContact CE2-CG1 4.11Å; F196-I215 HydrophobicContact CZ-CG1 3.85Å; I199-I215 HydrophobicContact CD1-CD1 3.96Å; W211-I215 WeakPolarHBondContact O-CG1 3.23Å; W211-I215 PolarHBondContact O-N 3.02Å; E212-I215 PolarHBondContact O-N 2.54Å; I215-L217 VanDerWaalsContact C-N 3.29Å; I215-L217 PolarHBondContact O-N 3.18Å; I215-L218 PolarHBondContact O-N 2.79Å; I215-F226 HydrophobicContact CD1-CE1 3.93Å; I215-F226 HydrophobicContact CG1-CE1 4.32Å; I215-F237 HydrophobicContact CD1-CZ 4.2Å; I215-W240 HydrophobicContact CB-CH2 4.13Å; I215-W240 HydrophobicContact CD1-CH2 4.3Å; I215-W240 HydrophobicContact CD1-CZ3 4.07Å; I215-W240 HydrophobicContact CG2-CH2 3.94Å; I215-W240 HydrophobicContact CG2-CZ3 4.04Å; I215-I241 HydrophobicContact CG2-CD1 3.68Å; I215-L244 HydrophobicContact CG2-CD1 3.89Å; I215-H245 PolarHBondContact O-CE1 3.03Å; I215-H245 PolarHBondContact O-NE2 2.88Å
216	I	94.4	Very high	93	Very high	9 Å²	9	25 Å²	25	5%	0.046	14%	0.137	C	C	.	.	H	α-helix	trans	-64.5	-34.1	-179.9	-66.4	162.9	0	0	0	112	E212 E213 W240 L244 I527 M532 K535 N536	E212-I216 WeakPolarHBondContact O-CD1 3.42Å; E212-I216 VanDerWaalsContact O-CG1 3.24Å; E212-I216 WeakPolarHBondContact O-CG1 3.48Å; E212-I216 PolarHBondContact O-N 2.59Å; E213-I216 PolarHBondContact O-N 2.89Å; I216-W240 HydrophobicContact CD1-CZ2 4.12Å; I216-W240 HydrophobicContact CG1-CZ2 3.91Å; I216-L244 HydrophobicContact CG1-CD1 3.91Å; I216-L244 HydrophobicContact CG1-CD2 4.16Å; I216-I527 HydrophobicContact CG2-CD1 3.9Å; I216-M532 HydrophobicContact CB-SD 4.11Å; I216-M532 HydrophobicContact CD1-SD 3.5Å; I216-M532 VanDerWaalsContact CD1-SD 3.5Å; I216-M532 HydrophobicContact CG1-SD 4.42Å; I216-M532 HydrophobicContact CG2-CE 4.18Å; I216-M532 HydrophobicContact CG2-SD 3.79Å; I216-K535 HydrophobicContact CD1-CB 4.42Å; I216-K535 HydrophobicContact CG1-CB 4.47Å; I216-K535 HydrophobicContact CG2-CB 4.04Å; I216-K535 HydrophobicContact CG2-CD 3.91Å; I216-N536 HydrophobicContact CD1-CB 4.41Å
217	L	93.2	Very high	93.8	Very high	30 Å²	30	18 Å²	18	16%	0.157	10%	0.104	C	C	.	.	H	α-helix	trans	-82.6	-13	-179	-70.7	172.7	0	0	0	113.8	L181 Y182 E213 T214 I215 I527 M532	L181-L217 HydrophobicContact CB-CB 4.2Å; L181-L217 HydrophobicContact CB-CD1 4.34Å; L181-L217 HydrophobicContact CD1-CB 3.93Å; Y182-L217 HydrophobicContact CD1-CD1 4.25Å; Y182-L217 HydrophobicContact CE1-CD1 3.91Å; E213-L217 HydrophobicContact CG-CD1 4.06Å; E213-L217 WeakPolarHBondContact O-CB 3.23Å; E213-L217 WeakPolarHBondContact O-CD1 3.49Å; E213-L217 WeakPolarHBondContact O-CG 3.22Å; E213-L217 PolarHBondContact O-N 3.2Å; E213-L217 VanDerWaalsContact O-N 3.09Å; T214-L217 PolarHBondContact O-N 3.36Å; I215-L217 VanDerWaalsContact C-N 3.29Å; I215-L217 PolarHBondContact O-N 3.18Å; L217-I527 HydrophobicContact CD2-CD1 3.98Å; L217-I527 HydrophobicContact CD2-CG2 3.93Å; L217-M532 HydrophobicContact CD2-CE 4.35Å; L217-M532 HydrophobicContact CG-CE 4.27Å
218	L	93.6	Very high	94.2	Very high	10 Å²	10	15.1 Å²	15.1	5%	0.052	9%	0.093	C	C	.	.	S	Bend	trans	-67.2	140.6	-179.9	-82.7	171.5	0	0	0	111.5	L181 V194 F196 T214 I215 L224 H245	L181-L218 HydrophobicContact CD1-CD2 4.23Å; L181-L218 HydrophobicContact CD1-CG 4.3Å; L181-L218 HydrophobicContact CD2-CD2 4.21Å; V194-L218 HydrophobicContact CB-CD1 4.44Å; V194-L218 HydrophobicContact CG1-CD1 4.43Å; V194-L218 HydrophobicContact CG2-CD1 4.37Å; V194-L218 HydrophobicContact CG2-CD2 4.09Å; F196-L218 HydrophobicContact CE2-CD1 3.73Å; F196-L218 HydrophobicContact CZ-CD1 3.66Å; T214-L218 WeakPolarHBondContact O-CG 3.17Å; T214-L218 PolarHBondContact O-N 2.88Å; I215-L218 PolarHBondContact O-N 2.79Å; L218-L224 HydrophobicContact CD1-CD2 3.8Å; L218-H245 PolarHBondContact O-CE1 3.01Å; L218-H245 VanDerWaalsContact O-CE1 3.32Å
219	P	91.4	Very high	94	Very high	53 Å²	53	16.3 Å²	16.3	34%	0.344	10%	0.103	S	C	.	.			trans	-63.1	142.9	174.6	-21.1	32.2	0	0	0	112.4	S221 V222	P219-S221 PolarHBondContact O-N 2.89Å; P219-V222 HydrophobicContact CB-CG2 4.31Å; P219-V222 HydrophobicContact CG-CG2 4.43Å; P219-V222 PolarHBondContact O-N 2.9Å; P219-V222 VanDerWaalsContact O-N 3.17Å
220	D	90.9	Very high	93.9	Very high	83 Å²	83	16.5 Å²	16.5	44%	0.444	10%	0.104	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.6	-18.1	179.1	-64.9	-21.5	0	0	0	113.3	V222 H245 K247	D220-V222 VanDerWaalsContact C-N 3.32Å; D220-V222 PolarHBondContact O-N 3.39Å; D220-H245 WeakPolarHBondContact OD1-CA 3.46Å; D220-H245 IonicContact OD1-CE1 3.25Å; D220-H245 IonicContact OD1-CG 2.92Å; D220-H245 IonicContact OD1-ND1 2.68Å; D220-H245 PolarHBondContact OD1-ND1 3.41Å; D220-K247 WeakPolarHBondContact O-CD 3.49Å; D220-K247 WeakPolarHBondContact O-CE 3.48Å; D220-K247 PolarHBondContact O-NZ 3.26Å
221	S	91.4	Very high	93.8	Very high	94 Å²	94	15.8 Å²	15.8	66%	0.657	10%	0.1	S	C	*	.	T	Hydrogen-bonded Turn	trans	-68.7	-27.2	178.1	53.1	0	0	0	0	113.6	P219 K247	P219-S221 PolarHBondContact O-N 2.89Å; S221-K247 VanDerWaalsContact C-NZ 3.32Å; S221-K247 PolarHBondContact O-NZ 3.43Å
222	V	94.3	Very high	93.6	Very high	6 Å²	6	19.2 Å²	19.2	4%	0.036	12%	0.123	C	C	.	.	S	Bend	trans	-74.6	137.6	-171.3	-179.5	0	0	0	0	111.8	V191 V194 P219 D220 L224	V191-V222 HydrophobicContact CG1-CG1 4.32Å; V194-V222 HydrophobicContact CB-CG1 4.19Å; V194-V222 HydrophobicContact CG2-CG1 3.65Å; P219-V222 HydrophobicContact CB-CG2 4.31Å; P219-V222 HydrophobicContact CG-CG2 4.43Å; P219-V222 PolarHBondContact O-N 2.9Å; P219-V222 VanDerWaalsContact O-N 3.17Å; D220-V222 VanDerWaalsContact C-N 3.32Å; D220-V222 PolarHBondContact O-N 3.39Å; V222-L224 HydrophobicContact CG1-CD2 4.12Å
223	G	95.6	Very high	93.6	Very high	9 Å²	9	19.9 Å²	19.9	9%	0.093	13%	0.126	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.4	138	169.4	0	0	0	0	0	111.7	G192 W193 V194	G192-G223 PolarHBondContact O-N 2.88Å; W193-G223 VanDerWaalsContact CA-O 3.3Å; W193-G223 WeakPolarHBondContact CA-O 3.4Å; V194-G223 PolarHBondContact N-O 3.29Å
224	L	97.7	Very high	93.6	Very high	3 Å²	3	20.1 Å²	20.1	2%	0.016	13%	0.128	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	128.3	-173.2	-53.6	174	0	0	0	111.4	S101 V102 V194 F196 L218 V222 F226 I241	S101-L224 CarbonylContact C-O 3.49Å; S101-L224 WeakPolarHBondContact CA-O 3.25Å; S101-L224 WeakPolarHBondContact CB-O 3.35Å; S101-L224 PolarHBondContact OG-N 2.75Å; S101-L224 VanDerWaalsContact OG-N 3.13Å; V102-L224 PolarHBondContact N-O 3.14Å; V194-L224 HydrophobicContact CB-CD2 4.27Å; F196-L224 HydrophobicContact CE2-CD2 4.25Å; L218-L224 HydrophobicContact CD1-CD2 3.8Å; V222-L224 HydrophobicContact CG1-CD2 4.12Å; L224-F226 HydrophobicContact CB-CD2 4.39Å; L224-F226 HydrophobicContact CB-CE2 3.6Å; L224-F226 HydrophobicContact CB-CZ 3.7Å; L224-F226 HydrophobicContact CD1-CE2 4.18Å; L224-F226 HydrophobicContact CD1-CZ 3.76Å; L224-F226 HydrophobicContact CG-CZ 4.26Å; L224-I241 HydrophobicContact CD1-CG2 4.2Å
225	V	98	Very high	93.5	Very high	0 Å²	0	25.3 Å²	25.3	0%	0	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	114.4	171.9	179.4	0	0	0	0	108.8	I96 V102 V115 A119 W193 V194 I195 F196 L227	I96-V225 HydrophobicContact CD1-CG2 3.99Å; I96-V225 HydrophobicContact CG1-CG2 4.03Å; V102-V225 HydrophobicContact CG1-CG1 4.35Å; V102-V225 HydrophobicContact CG1-CG2 4.24Å; V102-V225 CarbonylContact O-C 3.51Å; V102-V225 WeakPolarHBondContact O-CA 3.33Å; V115-V225 HydrophobicContact CG1-CG1 4.2Å; A119-V225 HydrophobicContact CB-CG2 4.11Å; W193-V225 HydrophobicContact CE3-CG2 3.78Å; W193-V225 HydrophobicContact CZ3-CG2 3.87Å; V194-V225 PolarHBondContact O-N 2.84Å; I195-V225 CarbonylContact C-O 3.59Å; I195-V225 WeakPolarHBondContact CA-O 3.35Å; I195-V225 HydrophobicContact CG1-CB 4.15Å; I195-V225 HydrophobicContact CG2-CB 4.45Å; I195-V225 HydrophobicContact CG2-CG1 4.4Å; F196-V225 PolarHBondContact N-O 3.41Å; V225-L227 HydrophobicContact CG1-CD2 3.91Å; V225-L227 HydrophobicContact CG1-CG 4.47Å
226	F	98	Very high	93.4	Very high	0 Å²	0	26.6 Å²	26.6	0%	0	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	119.6	178.4	-54.5	-79.7	0	0	0	110.2	V102 M103 V104 F196 I199 I215 L224 F237 I241	V102-F226 PolarHBondContact O-N 2.64Å; M103-F226 HydrophobicContact CB-CB 4.26Å; M103-F226 HydrophobicContact CB-CD2 4.43Å; M103-F226 HydrophobicContact CG-CB 4.18Å; V104-F226 PolarHBondContact N-O 2.97Å; F196-F226 HydrophobicContact CB-CD1 3.78Å; F196-F226 HydrophobicContact CB-CE1 4.36Å; F196-F226 AromaticContact CD2-CD1 3.75Å; F196-F226 HydrophobicContact CD2-CD1 3.75Å; F196-F226 AromaticContact CD2-CE1 3.49Å; F196-F226 HydrophobicContact CD2-CE1 3.49Å; F196-F226 VanDerWaalsContact CD2-CE1 3.49Å; F196-F226 HydrophobicContact CD2-CZ 4.44Å; F196-F226 HydrophobicContact CE2-CE1 4.01Å; F196-F226 HydrophobicContact CG-CD1 4.06Å; F196-F226 HydrophobicContact CG-CE1 4.14Å; I199-F226 HydrophobicContact CD1-CD1 4.28Å; I199-F226 HydrophobicContact CG1-CD1 4.03Å; I199-F226 HydrophobicContact CG2-CB 4.19Å; I215-F226 HydrophobicContact CD1-CE1 3.93Å; I215-F226 HydrophobicContact CG1-CE1 4.32Å; L224-F226 HydrophobicContact CB-CD2 4.39Å; L224-F226 HydrophobicContact CB-CE2 3.6Å; L224-F226 HydrophobicContact CB-CZ 3.7Å; L224-F226 HydrophobicContact CD1-CE2 4.18Å; L224-F226 HydrophobicContact CD1-CZ 3.76Å; L224-F226 HydrophobicContact CG-CZ 4.26Å; F226-F237 HydrophobicContact CD1-CE1 4.05Å; F226-F237 HydrophobicContact CD1-CZ 4.08Å; F226-F237 AromaticContact CD2-CE1 3.95Å; F226-F237 HydrophobicContact CD2-CE1 3.95Å; F226-F237 HydrophobicContact CE1-CE1 4.14Å; F226-F237 HydrophobicContact CE1-CZ 4Å; F226-F237 HydrophobicContact CE2-CE1 4.03Å; F226-F237 AromaticContact CG-CE1 3.95Å; F226-F237 HydrophobicContact CG-CE1 3.95Å; F226-F237 HydrophobicContact CG-CZ 4.44Å; F226-F237 HydrophobicContact CZ-CE1 4.11Å; F226-F237 HydrophobicContact CZ-CZ 4.28Å; F226-I241 HydrophobicContact CE1-CD1 4.45Å; F226-I241 HydrophobicContact CE2-CD1 4.09Å; F226-I241 HydrophobicContact CE2-CG1 3.91Å; F226-I241 HydrophobicContact CE2-CG2 4.32Å; F226-I241 HydrophobicContact CZ-CD1 3.63Å; F226-I241 HydrophobicContact CZ-CG1 4Å
227	L	95.6	Very high	93.5	Very high	0 Å²	0	26.1 Å²	26.1	0%	0	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.9	121.2	174.6	-51.4	-177.9	0	0	0	109.1	V104 K112 V115 A116 I195 F196 E198 I199 V225	V104-L227 HydrophobicContact CB-CD2 4.14Å; V104-L227 HydrophobicContact CG2-CD2 4.34Å; K112-L227 HydrophobicContact CB-CD1 4.36Å; K112-L227 HydrophobicContact CB-CD2 4.38Å; K112-L227 HydrophobicContact CD-CB 4.31Å; V115-L227 HydrophobicContact CB-CD2 4.38Å; A116-L227 HydrophobicContact CB-CD1 4.09Å; I195-L227 HydrophobicContact CG2-CD1 4.26Å; I195-L227 HydrophobicContact CG2-CG 4.44Å; F196-L227 PolarHBondContact O-N 3.22Å; E198-L227 CarbonylContact C-O 3.55Å; E198-L227 VanDerWaalsContact CA-O 3.26Å; E198-L227 WeakPolarHBondContact CA-O 3.49Å; E198-L227 PolarHBondContact N-O 3.5Å; I199-L227 PolarHBondContact N-O 3.46Å; V225-L227 HydrophobicContact CG1-CD2 3.91Å; V225-L227 HydrophobicContact CG1-CG 4.47Å
228	S	93.1	Very high	93.6	Very high	0 Å²	0	24.7 Å²	24.7	0%	0	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.8	157.8	-176	-158	0	0	0	0	112.2	V104 A106 K112 I199 H200	V104-S228 PolarHBondContact O-N 3.29Å; A106-S228 PolarHBondContact N-O 3.48Å; K112-S228 VanDerWaalsContact CD-O 3.26Å; K112-S228 WeakPolarHBondContact CD-O 3.42Å; K112-S228 WeakPolarHBondContact CE-O 3.42Å; K112-S228 PolarHBondContact NZ-O 3.02Å; I199-S228 VanDerWaalsContact CG2-CB 3.48Å; H200-S228 WeakPolarHBondContact CB-OG 3.09Å
229	A	87.9	Confident	93.7	Very high	24 Å²	24	26.1 Å²	26.1	20%	0.198	15%	0.15	C	C	.	.	S	Bend	trans	-62.3	174.1	156	0	0	0	0	0	110.1	S105 A106 H200 I231	S105-A229 PolarHBondContact OG-O 3.01Å; A106-A229 WeakPolarHBondContact O-CA 3.14Å; H200-A229 PolarHBondContact ND1-N 3.03Å; H200-A229 VanDerWaalsContact ND1-N 3.12Å; A229-I231 PolarHBondContact O-N 3.18Å
230	T	89	Confident	93.9	Very high	8 Å²	8	23.6 Å²	23.6	5%	0.049	13%	0.134	C	C	.	.			trans	-62	117.7	174	49.8	0	0	0	0	109.7	S105 P504	S105-T230 VanDerWaalsContact OG-CA 3.28Å; S105-T230 WeakPolarHBondContact OG-CA 3.26Å; T230-P504 WeakPolarHBondContact O-CB 3.49Å; T230-P504 WeakPolarHBondContact OG1-CG 3.03Å
231	I	91.7	Very high	94.1	Very high	1 Å²	1	19.8 Å²	19.8	1%	0.005	11%	0.113	C	C	.	.			trans	-126.2	136.3	175.6	67.3	170.5	0	0	0	110.5	M103 S105 H200 R203 A229 A234 L507	M103-I231 HydrophobicContact CE-CD1 3.16Å; M103-I231 HydrophobicContact CE-CG1 3.95Å; M103-I231 HydrophobicContact SD-CD1 4.47Å; S105-I231 PolarHBondContact OG-N 3.33Å; H200-I231 HydrophobicContact CB-CG2 4.27Å; R203-I231 VanDerWaalsContact NH2-CG2 3.28Å; A229-I231 PolarHBondContact O-N 3.18Å; I231-A234 HydrophobicContact CD1-CB 4.21Å; I231-A234 HydrophobicContact CG1-CB 3.86Å; I231-L507 HydrophobicContact CD1-CB 3.83Å; I231-L507 HydrophobicContact CD1-CD2 3.68Å; I231-L507 HydrophobicContact CD1-CG 4.4Å
232	P	91.1	Very high	94.3	Very high	73 Å²	73	15.4 Å²	15.4	47%	0.474	8%	0.083	S	C	.	.	T	Hydrogen-bonded Turn	trans	-73.8	-30.4	-173.7	27.5	-36.1	0	0	0	114	R506	P232-R506 HydrophobicContact CG-CB 4.35Å; P232-R506 HydrophobicContact CG-CG 3.74Å
233	N	93.2	Very high	94.3	Very high	14 Å²	14	17.8 Å²	17.8	8%	0.075	9%	0.093	C	C	.	.	T	Hydrogen-bonded Turn	trans	-102	33.3	-177.5	65.7	-37.6	0	0	0	113.4	R235 E236 F237 L507	N233-R235 PolarHBondContact O-N 3.42Å; N233-E236 HydrophobicContact CB-CB 4.24Å; N233-E236 PolarHBondContact ND2-OE2 2.92Å; N233-E236 WeakPolarHBondContact O-CB 3.48Å; N233-E236 PolarHBondContact O-N 3.17Å; N233-E236 VanDerWaalsContact O-N 3.1Å; N233-F237 PolarHBondContact O-N 3.39Å; N233-L507 PolarHBondContact ND2-O 3.13Å; N233-L507 PolarHBondContact OD1-N 3.31Å
234	A	94.2	Very high	94.2	Very high	5 Å²	5	17.9 Å²	17.9	4%	0.041	9%	0.091	C	C	.	.	H	α-helix	trans	-56.2	-32.3	178.8	0	0	0	0	0	113.7	M103 I231 F237 A238 V251	M103-A234 HydrophobicContact CE-CB 4.27Å; M103-A234 HydrophobicContact SD-CB 3.9Å; I231-A234 HydrophobicContact CD1-CB 4.21Å; I231-A234 HydrophobicContact CG1-CB 3.86Å; A234-F237 PolarHBondContact O-N 3.43Å; A234-A238 PolarHBondContact O-N 3.26Å; A234-A238 VanDerWaalsContact O-N 3.08Å; A234-V251 HydrophobicContact CB-CG1 3.63Å
235	R	93.8	Very high	93.9	Very high	110 Å²	110	18.3 Å²	18.3	42%	0.415	9%	0.093	S	C	.	.	H	α-helix	trans	-64.5	-44.9	175.3	-173.1	-170.4	-63.7	164.6	0.7	112.6	T47 E59 V61 N233 F237 A238 E239	T47-R235 HydrophobicContact CG2-CG 4.47Å; E59-R235 IonicContact OE1-CZ 2.66Å; E59-R235 IonicContact OE1-NE 3.37Å; E59-R235 IonicContact OE1-NH2 2.96Å; E59-R235 PolarHBondContact OE1-NH2 3.25Å; E59-R235 IonicContact OE2-CZ 3.41Å; E59-R235 IonicContact OE2-NE 3.39Å; E59-R235 PolarHBondContact OE2-NE 3.48Å; E59-R235 IonicContact OE2-NH2 2.66Å; E59-R235 PolarHBondContact OE2-NH2 2.89Å; E59-R235 VanDerWaalsContact OE2-NH2 3.15Å; V61-R235 HydrophobicContact CG2-CG 4.38Å; N233-R235 PolarHBondContact O-N 3.42Å; R235-F237 VanDerWaalsContact C-N 3.26Å; R235-F237 PolarHBondContact O-N 2.99Å; R235-A238 PolarHBondContact O-N 3.42Å; R235-A238 VanDerWaalsContact O-N 3.09Å; R235-E239 WeakPolarHBondContact O-CG 3.48Å; R235-E239 PolarHBondContact O-N 3.2Å
236	E	94.1	Very high	93.5	Very high	26 Å²	26	28 Å²	28	12%	0.121	13%	0.129	C	C	.	.	H	α-helix	trans	-59.9	-39.5	178.3	180	179.2	-144.4	0	0	110.8	N233 E239 W240 R506 F537 F540 Q541	N233-E236 HydrophobicContact CB-CB 4.24Å; N233-E236 PolarHBondContact ND2-OE2 2.92Å; N233-E236 WeakPolarHBondContact O-CB 3.48Å; N233-E236 PolarHBondContact O-N 3.17Å; N233-E236 VanDerWaalsContact O-N 3.1Å; E236-E239 PolarHBondContact O-N 3.39Å; E236-W240 PolarHBondContact O-N 3.17Å; E236-W240 VanDerWaalsContact O-N 3.08Å; E236-R506 IonicContact OE2-NH2 3.41Å; E236-R506 PolarHBondContact OE2-NH2 3.19Å; E236-F537 HydrophobicContact CG-CE2 4.16Å; E236-F537 HydrophobicContact CG-CZ 4.16Å; E236-F540 HydrophobicContact CG-CE1 4.5Å; E236-Q541 WeakPolarHBondContact OE1-CG 3.39Å; E236-Q541 PolarHBondContact OE2-NE2 3.45Å
237	F	95.6	Very high	93.2	Very high	0 Å²	0	31.7 Å²	31.7	0%	0	15%	0.146	C	C	.	.	H	α-helix	trans	-63	-45.6	172.8	-176.9	-91.5	0	0	0	111.9	M103 I199 M202 I215 F226 N233 A234 R235 E239 W240 I241 L507	M103-F237 HydrophobicContact CE-CD1 4.06Å; M103-F237 HydrophobicContact CE-CG 4.39Å; M103-F237 HydrophobicContact SD-CB 4.26Å; M103-F237 HydrophobicContact SD-CD1 3.55Å; M103-F237 VanDerWaalsContact SD-CD1 3.55Å; M103-F237 HydrophobicContact SD-CE1 4.28Å; M103-F237 HydrophobicContact SD-CG 4.2Å; I199-F237 HydrophobicContact CD1-CZ 4.44Å; I199-F237 HydrophobicContact CG1-CE2 4.37Å; I199-F237 HydrophobicContact CG1-CZ 3.97Å; M202-F237 HydrophobicContact CE-CD2 4.07Å; M202-F237 HydrophobicContact CE-CE2 3.96Å; M202-F237 HydrophobicContact SD-CE2 3.92Å; I215-F237 HydrophobicContact CD1-CZ 4.2Å; F226-F237 HydrophobicContact CD1-CE1 4.05Å; F226-F237 HydrophobicContact CD1-CZ 4.08Å; F226-F237 AromaticContact CD2-CE1 3.95Å; F226-F237 HydrophobicContact CD2-CE1 3.95Å; F226-F237 HydrophobicContact CE1-CE1 4.14Å; F226-F237 HydrophobicContact CE1-CZ 4Å; F226-F237 HydrophobicContact CE2-CE1 4.03Å; F226-F237 AromaticContact CG-CE1 3.95Å; F226-F237 HydrophobicContact CG-CE1 3.95Å; F226-F237 HydrophobicContact CG-CZ 4.44Å; F226-F237 HydrophobicContact CZ-CE1 4.11Å; F226-F237 HydrophobicContact CZ-CZ 4.28Å; N233-F237 PolarHBondContact O-N 3.39Å; A234-F237 PolarHBondContact O-N 3.43Å; R235-F237 VanDerWaalsContact C-N 3.26Å; R235-F237 PolarHBondContact O-N 2.99Å; F237-E239 VanDerWaalsContact C-N 3.34Å; F237-E239 PolarHBondContact O-N 3.27Å; F237-W240 AromaticContact CD2-CE3 3.99Å; F237-W240 HydrophobicContact CD2-CE3 3.99Å; F237-W240 HydrophobicContact CD2-CZ3 4.27Å; F237-W240 AromaticContact CE2-CE3 3.79Å; F237-W240 HydrophobicContact CE2-CE3 3.79Å; F237-W240 AromaticContact CE2-CZ3 3.63Å; F237-W240 HydrophobicContact CE2-CZ3 3.63Å; F237-W240 HydrophobicContact CZ-CE3 4.36Å; F237-W240 HydrophobicContact CZ-CZ3 4.14Å; F237-W240 WeakPolarHBondContact O-CB 3.24Å; F237-W240 PolarHBondContact O-N 3.47Å; F237-W240 VanDerWaalsContact O-N 3.16Å; F237-I241 HydrophobicContact CD1-CG1 4.02Å; F237-I241 HydrophobicContact CE1-CD1 3.92Å; F237-I241 HydrophobicContact CE1-CG1 3.66Å; F237-I241 HydrophobicContact CZ-CD1 3.92Å; F237-I241 HydrophobicContact CZ-CG1 4.17Å; F237-I241 WeakPolarHBondContact O-CG1 3.47Å; F237-I241 PolarHBondContact O-N 3.33Å; F237-L507 HydrophobicContact CB-CD2 4.48Å; F237-L507 HydrophobicContact CD2-CD2 3.65Å; F237-L507 HydrophobicContact CE2-CD2 4.16Å; F237-L507 HydrophobicContact CG-CD2 4.22Å
238	A	96	Very high	93.1	Very high	0 Å²	0	32.9 Å²	32.9	0%	0	15%	0.153	C	C	.	.	H	α-helix	trans	-62.1	-39	176.7	0	0	0	0	0	112.7	V61 A234 R235 W240 I241 V242 C249 V251	V61-A238 HydrophobicContact CG2-CB 3.9Å; A234-A238 PolarHBondContact O-N 3.26Å; A234-A238 VanDerWaalsContact O-N 3.08Å; R235-A238 PolarHBondContact O-N 3.42Å; R235-A238 VanDerWaalsContact O-N 3.09Å; A238-W240 VanDerWaalsContact C-N 3.3Å; A238-W240 PolarHBondContact O-N 3.09Å; A238-I241 PolarHBondContact O-N 2.73Å; A238-V242 VanDerWaalsContact O-CG2 3.31Å; A238-V242 WeakPolarHBondContact O-CG2 3.47Å; A238-V242 PolarHBondContact O-N 3.16Å; A238-C249 HydrophobicContact CB-CB 4.15Å; A238-V251 HydrophobicContact CB-CG2 3.47Å; A238-V251 VanDerWaalsContact CB-CG2 3.47Å
239	E	95.2	Very high	93.2	Very high	39 Å²	39	32.9 Å²	32.9	18%	0.182	15%	0.153	C	C	.	.	H	α-helix	trans	-60.4	-39.3	173.1	-68.9	171	-179.9	0	0	112	F45 V61 R235 E236 F237 V242 F243 F540	F45-E239 HydrophobicContact CD2-CB 4.22Å; F45-E239 HydrophobicContact CD2-CG 4.23Å; F45-E239 HydrophobicContact CE2-CB 4.29Å; F45-E239 HydrophobicContact CG-CG 4.45Å; V61-E239 HydrophobicContact CG1-CB 4.42Å; V61-E239 HydrophobicContact CG1-CG 3.75Å; V61-E239 HydrophobicContact CG2-CG 4.04Å; R235-E239 WeakPolarHBondContact O-CG 3.48Å; R235-E239 PolarHBondContact O-N 3.2Å; E236-E239 PolarHBondContact O-N 3.39Å; F237-E239 VanDerWaalsContact C-N 3.34Å; F237-E239 PolarHBondContact O-N 3.27Å; E239-V242 PolarHBondContact O-N 3.43Å; E239-F243 WeakPolarHBondContact O-CB 3.33Å; E239-F243 PolarHBondContact O-N 3.48Å; E239-F540 HydrophobicContact CB-CE1 4.12Å; E239-F540 HydrophobicContact CB-CZ 3.77Å
240	W	95.4	Very high	93.6	Very high	0 Å²	0	31.8 Å²	31.8	0%	0	14%	0.144	C	C	.	.	H	α-helix	trans	-64.2	-43.2	173.1	176.7	62.2	0	0	0	112.4	M202 E212 I215 I216 E236 F237 A238 V242 F243 L244 K535 F537 F540	M202-W240 HydrophobicContact SD-CZ3 4.32Å; E212-W240 HydrophobicContact CB-CH2 4.32Å; E212-W240 HydrophobicContact CG-CH2 4.15Å; I215-W240 HydrophobicContact CB-CH2 4.13Å; I215-W240 HydrophobicContact CD1-CH2 4.3Å; I215-W240 HydrophobicContact CD1-CZ3 4.07Å; I215-W240 HydrophobicContact CG2-CH2 3.94Å; I215-W240 HydrophobicContact CG2-CZ3 4.04Å; I216-W240 HydrophobicContact CD1-CZ2 4.12Å; I216-W240 HydrophobicContact CG1-CZ2 3.91Å; E236-W240 PolarHBondContact O-N 3.17Å; E236-W240 VanDerWaalsContact O-N 3.08Å; F237-W240 AromaticContact CD2-CE3 3.99Å; F237-W240 HydrophobicContact CD2-CE3 3.99Å; F237-W240 HydrophobicContact CD2-CZ3 4.27Å; F237-W240 AromaticContact CE2-CE3 3.79Å; F237-W240 HydrophobicContact CE2-CE3 3.79Å; F237-W240 AromaticContact CE2-CZ3 3.63Å; F237-W240 HydrophobicContact CE2-CZ3 3.63Å; F237-W240 HydrophobicContact CZ-CE3 4.36Å; F237-W240 HydrophobicContact CZ-CZ3 4.14Å; F237-W240 WeakPolarHBondContact O-CB 3.24Å; F237-W240 PolarHBondContact O-N 3.47Å; F237-W240 VanDerWaalsContact O-N 3.16Å; A238-W240 VanDerWaalsContact C-N 3.3Å; A238-W240 PolarHBondContact O-N 3.09Å; W240-V242 VanDerWaalsContact C-N 3.34Å; W240-V242 PolarHBondContact O-N 3.44Å; W240-F243 WeakPolarHBondContact O-CB 3.42Å; W240-F243 PolarHBondContact O-N 3.48Å; W240-F243 VanDerWaalsContact O-N 3.15Å; W240-L244 HydrophobicContact CD2-CD1 3.99Å; W240-L244 VanDerWaalsContact CE2-CD1 3.48Å; W240-L244 HydrophobicContact CE3-CD1 4.46Å; W240-L244 HydrophobicContact CH2-CD1 4.04Å; W240-L244 HydrophobicContact CZ2-CD1 3.54Å; W240-L244 HydrophobicContact CZ3-CD1 4.47Å; W240-L244 WeakPolarHBondContact O-CG 3.4Å; W240-L244 PolarHBondContact O-N 2.9Å; W240-K535 PolarHBondContact NE1-O 3.27Å; W240-F537 HydrophobicContact CB-CD2 3.67Å; W240-F537 HydrophobicContact CB-CE2 3.82Å; W240-F537 AromaticContact CD1-CD2 3.97Å; W240-F537 HydrophobicContact CD2-CB 4.01Å; W240-F537 AromaticContact CD2-CD2 3.63Å; W240-F537 HydrophobicContact CD2-CD2 3.63Å; W240-F537 HydrophobicContact CD2-CE2 4.47Å; W240-F537 HydrophobicContact CD2-CG 4.09Å; W240-F537 HydrophobicContact CE3-CB 4.38Å; W240-F537 HydrophobicContact CE3-CD2 4.03Å; W240-F537 HydrophobicContact CE3-CG 4.29Å; W240-F537 HydrophobicContact CG-CB 4.48Å; W240-F537 AromaticContact CG-CD2 3.48Å; W240-F537 HydrophobicContact CG-CD2 3.48Å; W240-F537 VanDerWaalsContact CG-CD2 3.48Å; W240-F537 HydrophobicContact CG-CE2 4.15Å; W240-F537 HydrophobicContact CG-CG 4.36Å; W240-F537 HydrophobicContact CH2-CB 4.32Å; W240-F537 HydrophobicContact CZ2-CB 3.91Å; W240-F540 HydrophobicContact CB-CD1 3.9Å; W240-F540 HydrophobicContact CB-CE1 4.03Å; W240-F540 HydrophobicContact CB-CG 4.16Å; W240-F540 HydrophobicContact CB-CZ 4.41Å; W240-F540 AromaticContact CD1-CG 3.83Å; W240-F540 HydrophobicContact CG-CD1 4.48Å; W240-F540 HydrophobicContact CG-CG 4.36Å
241	I	96.2	Very high	94	Very high	3 Å²	3	31.6 Å²	31.6	2%	0.015	14%	0.143	C	C	.	.	H	α-helix	trans	-60.9	-42.7	175.2	-62.4	-53.8	0	0	0	111.6	I215 L224 F226 F237 A238 F243 L244 H245 C249	I215-I241 HydrophobicContact CG2-CD1 3.68Å; L224-I241 HydrophobicContact CD1-CG2 4.2Å; F226-I241 HydrophobicContact CE1-CD1 4.45Å; F226-I241 HydrophobicContact CE2-CD1 4.09Å; F226-I241 HydrophobicContact CE2-CG1 3.91Å; F226-I241 HydrophobicContact CE2-CG2 4.32Å; F226-I241 HydrophobicContact CZ-CD1 3.63Å; F226-I241 HydrophobicContact CZ-CG1 4Å; F237-I241 HydrophobicContact CD1-CG1 4.02Å; F237-I241 HydrophobicContact CE1-CD1 3.92Å; F237-I241 HydrophobicContact CE1-CG1 3.66Å; F237-I241 HydrophobicContact CZ-CD1 3.92Å; F237-I241 HydrophobicContact CZ-CG1 4.17Å; F237-I241 WeakPolarHBondContact O-CG1 3.47Å; F237-I241 PolarHBondContact O-N 3.33Å; A238-I241 PolarHBondContact O-N 2.73Å; I241-F243 VanDerWaalsContact C-N 3.32Å; I241-F243 PolarHBondContact O-N 2.95Å; I241-L244 PolarHBondContact O-N 3.37Å; I241-H245 PolarHBondContact O-N 3.47Å; I241-C249 HydrophobicContact CB-CB 4.32Å; I241-C249 HydrophobicContact CG2-CB 4.11Å
242	V	94.9	Very high	94.2	Very high	3 Å²	3	31.6 Å²	31.6	2%	0.018	14%	0.143	C	C	.	.	H	α-helix	trans	-63.9	-39.3	175.3	175.8	0	0	0	0	111.1	F45 V61 P63 A238 E239 W240 L244 R246 K247 C249	F45-V242 HydrophobicContact CD1-CB 4.46Å; F45-V242 HydrophobicContact CD1-CG1 3.96Å; F45-V242 HydrophobicContact CE1-CB 4.46Å; F45-V242 HydrophobicContact CE1-CG1 4.14Å; V61-V242 HydrophobicContact CB-CG2 3.82Å; V61-V242 HydrophobicContact CG1-CB 4.27Å; V61-V242 HydrophobicContact CG1-CG2 3.79Å; V61-V242 WeakPolarHBondContact O-CG2 3.38Å; P63-V242 HydrophobicContact CB-CG1 4.29Å; P63-V242 HydrophobicContact CG-CG1 3.77Å; A238-V242 VanDerWaalsContact O-CG2 3.31Å; A238-V242 WeakPolarHBondContact O-CG2 3.47Å; A238-V242 PolarHBondContact O-N 3.16Å; E239-V242 PolarHBondContact O-N 3.43Å; W240-V242 VanDerWaalsContact C-N 3.34Å; W240-V242 PolarHBondContact O-N 3.44Å; V242-L244 VanDerWaalsContact C-N 3.34Å; V242-L244 PolarHBondContact O-N 3.14Å; V242-R246 VanDerWaalsContact O-CA 3.23Å; V242-R246 WeakPolarHBondContact O-CA 3.44Å; V242-R246 PolarHBondContact O-N 2.82Å; V242-K247 WeakPolarHBondContact CG2-O 3.42Å; V242-C249 HydrophobicContact CG2-CB 3.93Å
243	F	93.2	Very high	94.3	Very high	56 Å²	56	30.7 Å²	30.7	25%	0.246	13%	0.13	C	C	.	.	H	α-helix	trans	-61.5	-39.6	174.5	166.7	-106	0	0	0	112.7	P43 F45 E239 W240 I241 F540	P43-F243 HydrophobicContact CB-CD2 4.31Å; P43-F243 HydrophobicContact CG-CD2 3.89Å; P43-F243 HydrophobicContact CG-CE2 4.3Å; F45-F243 HydrophobicContact CE1-CB 4.2Å; F45-F243 HydrophobicContact CZ-CB 3.96Å; E239-F243 WeakPolarHBondContact O-CB 3.33Å; E239-F243 PolarHBondContact O-N 3.48Å; W240-F243 WeakPolarHBondContact O-CB 3.42Å; W240-F243 PolarHBondContact O-N 3.48Å; W240-F243 VanDerWaalsContact O-N 3.15Å; I241-F243 VanDerWaalsContact C-N 3.32Å; I241-F243 PolarHBondContact O-N 2.95Å; F243-F540 HydrophobicContact CB-CD2 4.19Å; F243-F540 HydrophobicContact CB-CE2 3.75Å; F243-F540 AromaticContact CD1-CD2 3.84Å; F243-F540 HydrophobicContact CD1-CD2 3.84Å; F243-F540 HydrophobicContact CD1-CE2 4.27Å; F243-F540 HydrophobicContact CE1-CD2 4.36Å; F243-F540 AromaticContact CG-CD2 3.96Å; F243-F540 HydrophobicContact CG-CD2 3.96Å; F243-F540 AromaticContact CG-CE2 3.94Å; F243-F540 HydrophobicContact CG-CE2 3.94Å
244	L	93.3	Very high	94.2	Very high	11 Å²	11	30.3 Å²	30.3	6%	0.058	13%	0.129	C	C	.	.	H	α-helix	trans	-72.6	-57.2	179.8	-69.3	-178.4	0	0	0	112.7	I215 I216 W240 I241 V242 K535	I215-L244 HydrophobicContact CG2-CD1 3.89Å; I216-L244 HydrophobicContact CG1-CD1 3.91Å; I216-L244 HydrophobicContact CG1-CD2 4.16Å; W240-L244 HydrophobicContact CD2-CD1 3.99Å; W240-L244 VanDerWaalsContact CE2-CD1 3.48Å; W240-L244 HydrophobicContact CE3-CD1 4.46Å; W240-L244 HydrophobicContact CH2-CD1 4.04Å; W240-L244 HydrophobicContact CZ2-CD1 3.54Å; W240-L244 HydrophobicContact CZ3-CD1 4.47Å; W240-L244 WeakPolarHBondContact O-CG 3.4Å; W240-L244 PolarHBondContact O-N 2.9Å; I241-L244 PolarHBondContact O-N 3.37Å; V242-L244 VanDerWaalsContact C-N 3.34Å; V242-L244 PolarHBondContact O-N 3.14Å; L244-K535 HydrophobicContact CD2-CB 3.76Å; L244-K535 HydrophobicContact CD2-CD 4.05Å; L244-K535 HydrophobicContact CD2-CG 4.01Å
245	H	92	Very high	93.8	Very high	12 Å²	12	34 Å²	34	6%	0.056	15%	0.148	C	C	.	.	H	α-helix	trans	-103.2	-3.5	-166.8	-61	-63.9	0	0	0	114.5	I215 L218 D220 I241 K247	I215-H245 PolarHBondContact O-CE1 3.03Å; I215-H245 PolarHBondContact O-NE2 2.88Å; L218-H245 PolarHBondContact O-CE1 3.01Å; L218-H245 VanDerWaalsContact O-CE1 3.32Å; D220-H245 WeakPolarHBondContact OD1-CA 3.46Å; D220-H245 IonicContact OD1-CE1 3.25Å; D220-H245 IonicContact OD1-CG 2.92Å; D220-H245 IonicContact OD1-ND1 2.68Å; D220-H245 PolarHBondContact OD1-ND1 3.41Å; I241-H245 PolarHBondContact O-N 3.47Å; H245-K247 PolarHBondContact O-N 3.04Å; H245-K247 VanDerWaalsContact O-N 3.07Å
246	R	90.2	Very high	93.3	Very high	202 Å²	202	32.4 Å²	32.4	76%	0.762	15%	0.152	S	C	*	.			trans	54.9	27.7	178.8	-53.2	-179.7	-178.6	-175.7	1.9	114.2	P63 V242	P63-R246 WeakPolarHBondContact CG-O 3.4Å; V242-R246 VanDerWaalsContact O-CA 3.23Å; V242-R246 WeakPolarHBondContact O-CA 3.44Å; V242-R246 PolarHBondContact O-N 2.82Å
247	K	90.8	Very high	92.8	Very high	79 Å²	79	32.7 Å²	32.7	34%	0.343	15%	0.152	S	C	.	.	S	Bend	trans	-118.5	151.3	176.6	-76.3	179.3	169.8	-178.2	0	110.2	D220 S221 V242 H245	D220-K247 WeakPolarHBondContact O-CD 3.49Å; D220-K247 WeakPolarHBondContact O-CE 3.48Å; D220-K247 PolarHBondContact O-NZ 3.26Å; S221-K247 VanDerWaalsContact C-NZ 3.32Å; S221-K247 PolarHBondContact O-NZ 3.43Å; V242-K247 WeakPolarHBondContact CG2-O 3.42Å; H245-K247 PolarHBondContact O-N 3.04Å; H245-K247 VanDerWaalsContact O-N 3.07Å
248	P	93.6	Very high	92.2	Very high	25 Å²	25	35 Å²	35	16%	0.162	17%	0.168	C	C	.	.			trans	-62.9	141.8	177.9	25.8	-33	0	0	0	111.6	V60 V61 Y62 Q100	V60-P248 HydrophobicContact CG2-CB 4.33Å; V61-P248 VanDerWaalsContact O-CA 3.32Å; V61-P248 WeakPolarHBondContact O-CA 3.34Å; Y62-P248 HydrophobicContact CD1-CB 3.88Å; Y62-P248 HydrophobicContact CD1-CG 4.45Å; Y62-P248 HydrophobicContact CD2-CB 4.35Å; Y62-P248 HydrophobicContact CE1-CB 3.66Å; Y62-P248 HydrophobicContact CE1-CG 3.96Å; Y62-P248 HydrophobicContact CE2-CB 4.15Å; Y62-P248 HydrophobicContact CG-CB 4.23Å; Q100-P248 HydrophobicContact CB-CG 4.48Å; Q100-P248 HydrophobicContact CG-CG 4.05Å
249	C	96.2	Very high	91.9	Very high	0 Å²	0	35.3 Å²	35.3	0%	0	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	123.2	176	-170.9	0	0	0	0	109.6	V61 S101 A238 I241 V242	V61-C249 PolarHBondContact N-O 2.84Å; V61-C249 PolarHBondContact O-N 3.02Å; V61-C249 VanDerWaalsContact O-N 3.13Å; S101-C249 WeakPolarHBondContact O-CA 3.41Å; A238-C249 HydrophobicContact CB-CB 4.15Å; I241-C249 HydrophobicContact CB-CB 4.32Å; I241-C249 HydrophobicContact CG2-CB 4.11Å; V242-C249 HydrophobicContact CG2-CB 3.93Å
250	H	96.9	Very high	91.7	Very high	1 Å²	1	35.5 Å²	35.5	1%	0.005	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90	144.8	177.8	-64.1	-97.4	0	0	0	111	H58 E59 V60 C95 Q100 S101 V102 M103	H58-H250 AromaticContact CE1-ND1 3.96Å; H58-H250 AromaticContact NE2-CG 3.82Å; H58-H250 AromaticContact NE2-ND1 3.17Å; H58-H250 PolarHBondContact NE2-ND1 2.97Å; H58-H250 VanDerWaalsContact NE2-ND1 3.17Å; E59-H250 CarbonylContact O-C 3.45Å; E59-H250 WeakPolarHBondContact O-CA 3.45Å; V60-H250 WeakPolarHBondContact CB-ND1 3.32Å; V60-H250 WeakPolarHBondContact CG2-CE1 3.35Å; V60-H250 WeakPolarHBondContact CG2-ND1 3.38Å; C95-H250 HydrophobicContact CB-CB 4.42Å; Q100-H250 WeakPolarHBondContact CB-NE2 3.16Å; Q100-H250 PolarHBondContact OE1-CE1 3.08Å; Q100-H250 PolarHBondContact OE1-NE2 3.36Å; S101-H250 PolarHBondContact O-CD2 3.3Å; S101-H250 PolarHBondContact O-N 2.84Å; V102-H250 CarbonylContact C-O 3.51Å; V102-H250 WeakPolarHBondContact CA-O 3.43Å; V102-H250 HydrophobicContact CB-CB 4.3Å; V102-H250 HydrophobicContact CG2-CB 4.04Å; M103-H250 PolarHBondContact N-O 2.83Å
251	V	96.6	Very high	91.6	Very high	4 Å²	4	36.8 Å²	36.8	2%	0.024	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	119.1	169.5	179.7	0	0	0	0	108.2	H58 E59 A234 A238	H58-V251 CarbonylContact C-O 3.52Å; H58-V251 WeakPolarHBondContact CA-O 3.17Å; E59-V251 HydrophobicContact CB-CB 4.37Å; E59-V251 PolarHBondContact N-O 3.37Å; E59-V251 PolarHBondContact O-N 3.26Å; A234-V251 HydrophobicContact CB-CG1 3.63Å; A238-V251 HydrophobicContact CB-CG2 3.47Å; A238-V251 VanDerWaalsContact CB-CG2 3.47Å
252	V	95.7	Very high	91.5	Very high	0 Å²	0	37.3 Å²	37.3	0%	0	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	105	174	-178.1	0	0	0	0	107.6	F88 R91 A92 V102 M103 V104 S105	F88-V252 HydrophobicContact CB-CG1 3.8Å; F88-V252 WeakPolarHBondContact O-CG1 3.22Å; R91-V252 HydrophobicContact CB-CG1 4.36Å; R91-V252 HydrophobicContact CB-CG2 4.33Å; A92-V252 HydrophobicContact CB-CG2 4.38Å; V102-V252 HydrophobicContact CG2-CG2 3.91Å; M103-V252 PolarHBondContact O-N 2.96Å; V104-V252 WeakPolarHBondContact CA-O 3.41Å; S105-V252 PolarHBondContact N-O 2.87Å
253	Y	93.9	Very high	91.6	Very high	55 Å²	55	38 Å²	38	22%	0.216	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	136.1	-175.1	-180	-82.9	0	0	0	110.9	C56 I57 S105 D255	C56-Y253 CarbonylContact C-O 3.59Å; C56-Y253 WeakPolarHBondContact CA-O 3.3Å; I57-Y253 HydrophobicContact CD1-CD1 4.25Å; I57-Y253 PolarHBondContact N-O 3.2Å; I57-Y253 PolarHBondContact O-N 2.83Å; S105-Y253 WeakPolarHBondContact O-CA 3.44Å; Y253-D255 HydrophobicContact CE1-CB 4.24Å
254	T	90.8	Very high	91.7	Very high	6 Å²	6	37.2 Å²	37.2	4%	0.037	18%	0.182	C	C	.	.			trans	-144.7	133.7	169.4	-175.4	0	0	0	0	111.3	G55 F88 S105 A106 C256	G55-T254 WeakPolarHBondContact O-CB 3.48Å; G55-T254 PolarHBondContact O-OG1 3.23Å; F88-T254 HydrophobicContact CB-CG2 3.99Å; F88-T254 HydrophobicContact CD1-CG2 3.83Å; F88-T254 HydrophobicContact CD2-CG2 4.2Å; F88-T254 HydrophobicContact CE1-CG2 4.38Å; F88-T254 HydrophobicContact CG-CG2 3.73Å; S105-T254 PolarHBondContact O-N 2.94Å; A106-T254 HydrophobicContact CB-CG2 3.52Å; T254-C256 WeakPolarHBondContact OG1-CB 3.27Å; T254-C256 PolarHBondContact OG1-N 3.19Å
255	D	85.3	Confident	91.7	Very high	82 Å²	82	36.7 Å²	36.7	44%	0.439	18%	0.179	S	C	.	.			trans	-93.6	-2.4	172.3	63.7	-18.3	0	0	0	112.5	H107 Y253 R257	H107-D255 PolarHBondContact CD2-O 3.22Å; H107-D255 PolarHBondContact NE2-O 3.31Å; Y253-D255 HydrophobicContact CE1-CB 4.24Å; D255-R257 PolarHBondContact O-N 3.16Å
256	C	83.1	Confident	91.7	Very high	76 Å²	76	36.5 Å²	36.5	51%	0.514	18%	0.178	S	C	.	.			trans	-69.7	127.4	-178.7	-173.6	0	0	0	0	110.9	T254	T254-C256 WeakPolarHBondContact OG1-CB 3.27Å; T254-C256 PolarHBondContact OG1-N 3.19Å
257	R	83.8	Confident	91.7	Very high	32 Å²	32	26.9 Å²	26.9	12%	0.121	14%	0.141	C	C	.	.			trans	-107	123.8	174.1	-164.3	178.8	-170.4	-98.2	-1.9	109.7	D255 V259 G470 A472	D255-R257 PolarHBondContact O-N 3.16Å; R257-V259 WeakPolarHBondContact CD-O 3.34Å; R257-V259 VanDerWaalsContact CG-O 3.24Å; R257-V259 WeakPolarHBondContact CG-O 3.46Å; R257-V259 PolarHBondContact NH1-O 3.38Å; R257-V259 PolarHBondContact O-N 3.44Å; R257-V259 VanDerWaalsContact O-N 3.13Å; R257-G470 PolarHBondContact NH2-O 3.22Å; R257-A472 PolarHBondContact NH1-O 3.05Å; R257-A472 PolarHBondContact NH2-O 3.09Å
258	P	83.1	Confident	91.3	Very high	50 Å²	50	24.2 Å²	24.2	33%	0.325	13%	0.133	S	C	.	.	S	Bend	trans	-59.3	-27.7	-178.3	-29.8	37.6	0	0	0	115.3	S109 R475	S109-P258 WeakPolarHBondContact O-CG 3.3Å; P258-R475 HydrophobicContact CB-CG 4.22Å
259	V	88.9	Confident	90.6	Very high	6 Å²	6	24.5 Å²	24.5	4%	0.036	14%	0.14	C	C	.	.	S	Bend	trans	-120.8	118.9	173	-177.7	0	0	0	0	107.2	R257 R475	R257-V259 WeakPolarHBondContact CD-O 3.34Å; R257-V259 VanDerWaalsContact CG-O 3.24Å; R257-V259 WeakPolarHBondContact CG-O 3.46Å; R257-V259 PolarHBondContact NH1-O 3.38Å; R257-V259 PolarHBondContact O-N 3.44Å; R257-V259 VanDerWaalsContact O-N 3.13Å; V259-R475 HydrophobicContact CG2-CB 4.47Å
260	P	91.6	Very high	89.8	Confident	42 Å²	42	24.7 Å²	24.7	27%	0.273	14%	0.142	S	C	.	.			trans	-68.6	153.3	178.9	27.8	-34.4	0	0	0	111.3	Q279 T479 R480 G481	P260-Q279 HydrophobicContact CB-CB 3.87Å; P260-Q279 HydrophobicContact CB-CG 4.14Å; P260-Q279 HydrophobicContact CG-CB 4.21Å; P260-Q279 HydrophobicContact CG-CG 4.16Å; P260-T479 WeakPolarHBondContact CD-O 3.3Å; P260-R480 CarbonylContact O-C 3.54Å; P260-R480 WeakPolarHBondContact O-CA 3.5Å; P260-G481 PolarHBondContact O-N 2.89Å
261	L	93.2	Very high	88.9	Confident	27 Å²	27	32 Å²	32	14%	0.141	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100	147.2	176.5	-67.4	179.9	0	0	0	110.9	A472 G481 V483	L261-A472 HydrophobicContact CD2-CB 3.83Å; L261-A472 VanDerWaalsContact CD2-O 3.31Å; L261-A472 WeakPolarHBondContact CD2-O 3.38Å; L261-G481 WeakPolarHBondContact CA-O 3.43Å; L261-V483 HydrophobicContact CD1-CG2 4.41Å; L261-V483 HydrophobicContact CD2-CG2 4.09Å
262	Q	95	Very high	88.3	Confident	14 Å²	14	33 Å²	33	7%	0.065	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	127.5	164.3	-73.6	-174.5	-38.7	0	0	108.4	Y264 L275 V277 Q279 R480 G481 V483	Q262-Y264 HydrophobicContact CB-CD2 4.27Å; Q262-Y264 HydrophobicContact CB-CE2 3.69Å; Q262-Y264 PolarHBondContact OE1-OH 3.38Å; Q262-L275 HydrophobicContact CB-CD1 3.73Å; Q262-L275 HydrophobicContact CG-CD1 4.08Å; Q262-V277 WeakPolarHBondContact CA-O 3.37Å; Q262-Q279 HydrophobicContact CG-CG 3.61Å; Q262-R480 VanDerWaalsContact OE1-NE 3.14Å; Q262-G481 PolarHBondContact N-O 3.14Å; Q262-V483 PolarHBondContact O-N 3.46Å
263	H	96.2	Very high	88.1	Confident	19 Å²	19	35 Å²	35	9%	0.088	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103	124.2	179	-55.8	-107.4	0	0	0	109.4	V276 V277 Y465 V483 L500	H263-V276 HydrophobicContact CB-CG2 4.23Å; H263-V276 VanDerWaalsContact O-CG2 3.24Å; H263-V276 WeakPolarHBondContact O-CG2 3.36Å; H263-V276 PolarHBondContact O-N 3.28Å; H263-V277 HydrophobicContact CB-CB 3.81Å; H263-V277 HydrophobicContact CB-CG2 4.09Å; H263-V277 PolarHBondContact N-O 3.5Å; H263-V277 PolarHBondContact O-N 3.46Å; H263-V277 VanDerWaalsContact O-N 3.13Å; H263-Y465 AromaticContact CE1-CE1 3.73Å; H263-Y465 AromaticContact ND1-CE1 3.64Å; H263-Y465 AromaticContact ND1-CZ 3.64Å; H263-Y465 PolarHBondContact ND1-OH 2.82Å; H263-V483 CarbonylContact C-O 3.57Å; H263-V483 WeakPolarHBondContact CA-O 3.43Å; H263-L500 HydrophobicContact CB-CD2 3.9Å
264	Y	95.1	Very high	88.1	Confident	38 Å²	38	34.4 Å²	34.4	15%	0.149	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	145.5	177.9	-70.6	-99.1	0	0	0	109.8	Q262 I273 H274 L275 T482 V483 I484 M485	Q262-Y264 HydrophobicContact CB-CD2 4.27Å; Q262-Y264 HydrophobicContact CB-CE2 3.69Å; Q262-Y264 PolarHBondContact OE1-OH 3.38Å; Y264-I273 HydrophobicContact CD1-CB 4.12Å; Y264-I273 HydrophobicContact CD1-CD1 3.76Å; Y264-I273 HydrophobicContact CD1-CG1 3.82Å; Y264-I273 HydrophobicContact CE1-CD1 4.18Å; Y264-I273 HydrophobicContact CE1-CG1 4.35Å; Y264-I273 HydrophobicContact CG-CD1 4.12Å; Y264-H274 CarbonylContact C-O 3.58Å; Y264-H274 WeakPolarHBondContact CA-O 3.24Å; Y264-L275 HydrophobicContact CD1-CB 4.01Å; Y264-L275 HydrophobicContact CD1-CD1 4.46Å; Y264-L275 HydrophobicContact CD2-CD1 4.11Å; Y264-L275 HydrophobicContact CE1-CB 3.68Å; Y264-L275 HydrophobicContact CE1-CD1 4.09Å; Y264-L275 HydrophobicContact CE1-CG 4.46Å; Y264-L275 HydrophobicContact CE2-CD1 3.71Å; Y264-L275 HydrophobicContact CG-CD1 4.47Å; Y264-T482 HydrophobicContact CD2-CG2 3.67Å; Y264-T482 HydrophobicContact CE2-CG2 3.77Å; Y264-V483 PolarHBondContact N-O 2.79Å; Y264-I484 CarbonylContact O-C 3.57Å; Y264-I484 WeakPolarHBondContact O-CA 3.48Å; Y264-M485 PolarHBondContact O-N 3.29Å
265	V	93.8	Very high	88.3	Confident	0 Å²	0	35.7 Å²	35.7	0%	0	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	131.5	172.5	161.4	0	0	0	0	109	I273 H274 V276 A291 M485 L487 L500	V265-I273 WeakPolarHBondContact O-CA 3.49Å; V265-H274 PolarHBondContact N-O 2.72Å; V265-H274 PolarHBondContact O-N 2.88Å; V265-V276 HydrophobicContact CB-CG1 3.97Å; V265-V276 HydrophobicContact CG2-CB 4.39Å; V265-V276 HydrophobicContact CG2-CG1 3.82Å; V265-V276 HydrophobicContact CG2-CG2 3.7Å; V265-A291 HydrophobicContact CB-CB 4.28Å; V265-A291 HydrophobicContact CG1-CB 3.59Å; V265-M485 HydrophobicContact CG2-CE 3.9Å; V265-L487 HydrophobicContact CB-CD1 4.24Å; V265-L487 HydrophobicContact CG1-CB 4.23Å; V265-L487 HydrophobicContact CG1-CD1 3.25Å; V265-L487 HydrophobicContact CG1-CG 3.66Å; V265-L487 HydrophobicContact CG2-CD1 3.92Å; V265-L487 HydrophobicContact CG2-CG 4.32Å; V265-L500 HydrophobicContact CG2-CD1 4.46Å
266	Y	92.4	Very high	88.7	Confident	8 Å²	8	31.8 Å²	31.8	3%	0.031	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	104.8	168.5	-179.4	-101.7	0	0	0	109.1	C268 G270 G272 I273 Y321 L325 M485 M486 L487	Y266-C268 PolarHBondContact O-N 2.86Å; Y266-G270 WeakPolarHBondContact CE2-O 3.41Å; Y266-G270 PolarHBondContact OH-O 3.44Å; Y266-G272 WeakPolarHBondContact CD2-O 3.39Å; Y266-I273 HydrophobicContact CD2-CG2 3.94Å; Y266-I273 HydrophobicContact CG-CG2 4.47Å; Y266-Y321 HydrophobicContact CE1-CG 4.48Å; Y266-L325 HydrophobicContact CD1-CD2 3.9Å; Y266-L325 HydrophobicContact CD2-CD1 3.92Å; Y266-L325 HydrophobicContact CD2-CD2 4.3Å; Y266-L325 HydrophobicContact CE2-CD1 4.45Å; Y266-L325 HydrophobicContact CG-CD1 4.17Å; Y266-L325 HydrophobicContact CG-CD2 3.74Å; Y266-M485 PolarHBondContact N-O 3.33Å; Y266-M486 HydrophobicContact CD1-CE 4.49Å; Y266-M486 HydrophobicContact CD1-CG 4.07Å; Y266-M486 WeakPolarHBondContact O-CA 3.33Å; Y266-L487 PolarHBondContact O-N 2.97Å
267	P	89.4	Confident	89.2	Confident	0 Å²	0	28.4 Å²	28.4	0%	0	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.3	126.1	174.4	28.6	-31.6	0	0	0	109.9	G269 G270 A291 T294 L295	P267-G269 PolarHBondContact O-N 3.46Å; P267-G269 VanDerWaalsContact O-N 3.16Å; P267-G270 PolarHBondContact O-N 3.35Å; P267-A291 VanDerWaalsContact CB-O 3.27Å; P267-A291 WeakPolarHBondContact CB-O 3.18Å; P267-A291 HydrophobicContact CG-CB 4.35Å; P267-T294 HydrophobicContact CB-CG2 4.36Å; P267-T294 HydrophobicContact CG-CG2 3.81Å; P267-L295 HydrophobicContact CB-CB 3.85Å
268	C	83.2	Confident	89.6	Confident	24 Å²	24	28.2 Å²	28.2	16%	0.162	17%	0.166	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.4	121.5	177.3	-70.3	0	0	0	0	110.5	Y266 L295 A298 Y321 L487	Y266-C268 PolarHBondContact O-N 2.86Å; C268-L295 HydrophobicContact CB-CD1 4.11Å; C268-A298 WeakPolarHBondContact O-CB 3.42Å; C268-Y321 HydrophobicContact CB-CD2 4.26Å; C268-Y321 HydrophobicContact CB-CE2 4.08Å; C268-L487 WeakPolarHBondContact CB-O 3.31Å; C268-L487 PolarHBondContact N-O 3.15Å; C268-L487 PolarHBondContact SG-O 3.09Å
269	G	77.8	Confident	89.9	Confident	31 Å²	31	29.4 Å²	29.4	32%	0.32	17%	0.167	S	C	.	.	T	Hydrogen-bonded Turn	trans	93.6	-1.9	-174	0	0	0	0	0	115.3	P267	P267-G269 PolarHBondContact O-N 3.46Å; P267-G269 VanDerWaalsContact O-N 3.16Å
270	G	79.6	Confident	89.8	Confident	3 Å²	3	34.8 Å²	34.8	3%	0.031	20%	0.195	C	C	.	.			trans	-86.6	163.2	168.4	0	0	0	0	0	113.7	Y266 P267	Y266-G270 WeakPolarHBondContact CE2-O 3.41Å; Y266-G270 PolarHBondContact OH-O 3.44Å; P267-G270 PolarHBondContact O-N 3.35Å
271	D	78	Confident	89.5	Confident	155 Å²	155	39.8 Å²	39.8	83%	0.829	21%	0.209	S	C	*	.	S	Bend	trans	-96.7	0.6	-178.7	-69	-36.9	0	0	0	113.9
272	G	84.8	Confident	89.4	Confident	25 Å²	25	43.6 Å²	43.6	26%	0.258	23%	0.226	S	C	.	.	S	Bend	trans	-154.2	173.4	-174.9	0	0	0	0	0	114.6	Y266	Y266-G272 WeakPolarHBondContact CD2-O 3.39Å
273	I	91.2	Very high	89.2	Confident	41 Å²	41	45.1 Å²	45.1	21%	0.21	23%	0.232	C	C	.	.			trans	-105.2	141.4	175.4	59.6	176	0	0	0	110.2	Y264 V265 Y266 L325 L328 I484	Y264-I273 HydrophobicContact CD1-CB 4.12Å; Y264-I273 HydrophobicContact CD1-CD1 3.76Å; Y264-I273 HydrophobicContact CD1-CG1 3.82Å; Y264-I273 HydrophobicContact CE1-CD1 4.18Å; Y264-I273 HydrophobicContact CE1-CG1 4.35Å; Y264-I273 HydrophobicContact CG-CD1 4.12Å; V265-I273 WeakPolarHBondContact O-CA 3.49Å; Y266-I273 HydrophobicContact CD2-CG2 3.94Å; Y266-I273 HydrophobicContact CG-CG2 4.47Å; I273-L325 HydrophobicContact CG2-CD1 3.57Å; I273-L328 HydrophobicContact CD1-CD2 4.14Å; I273-L328 HydrophobicContact CG1-CD2 4.45Å; I273-I484 HydrophobicContact CD1-CD1 4.26Å; I273-I484 HydrophobicContact CG2-CG2 4.03Å
274	H	93	Very high	89.1	Confident	43 Å²	43	46.3 Å²	46.3	20%	0.199	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	125.3	-177.8	-60.4	-95	0	0	0	110.3	Y264 V265 V276 N287 A291	Y264-H274 CarbonylContact C-O 3.58Å; Y264-H274 WeakPolarHBondContact CA-O 3.24Å; V265-H274 PolarHBondContact N-O 2.72Å; V265-H274 PolarHBondContact O-N 2.88Å; H274-V276 PolarHBondContact O-N 3.16Å; H274-N287 HydrophobicContact CB-CB 4.45Å; H274-A291 HydrophobicContact CB-CB 4.02Å
275	L	95.3	Very high	88.9	Confident	33 Å²	33	47.2 Å²	47.2	17%	0.173	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.5	115.2	175.9	178.9	69.5	0	0	0	109.7	Q262 Y264 V277 N278 I284 N287	Q262-L275 HydrophobicContact CB-CD1 3.73Å; Q262-L275 HydrophobicContact CG-CD1 4.08Å; Y264-L275 HydrophobicContact CD1-CB 4.01Å; Y264-L275 HydrophobicContact CD1-CD1 4.46Å; Y264-L275 HydrophobicContact CD2-CD1 4.11Å; Y264-L275 HydrophobicContact CE1-CB 3.68Å; Y264-L275 HydrophobicContact CE1-CD1 4.09Å; Y264-L275 HydrophobicContact CE1-CG 4.46Å; Y264-L275 HydrophobicContact CE2-CD1 3.71Å; Y264-L275 HydrophobicContact CG-CD1 4.47Å; L275-V277 VanDerWaalsContact CD1-O 3.31Å; L275-V277 WeakPolarHBondContact CD1-O 3.44Å; L275-N278 HydrophobicContact CD2-CB 4.46Å; L275-I284 HydrophobicContact CD2-CD1 3.82Å; L275-I284 HydrophobicContact CG-CD1 3.95Å; L275-N287 WeakPolarHBondContact O-CB 3.46Å; L275-N287 PolarHBondContact O-ND2 3.11Å
276	V	94.1	Very high	88.7	Confident	0 Å²	0	49 Å²	49	0%	0	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	-23.2	-176.7	-62.5	0	0	0	0	113.3	H263 V265 H274 F283 I284 F288 L500	H263-V276 HydrophobicContact CB-CG2 4.23Å; H263-V276 VanDerWaalsContact O-CG2 3.24Å; H263-V276 WeakPolarHBondContact O-CG2 3.36Å; H263-V276 PolarHBondContact O-N 3.28Å; V265-V276 HydrophobicContact CB-CG1 3.97Å; V265-V276 HydrophobicContact CG2-CB 4.39Å; V265-V276 HydrophobicContact CG2-CG1 3.82Å; V265-V276 HydrophobicContact CG2-CG2 3.7Å; H274-V276 PolarHBondContact O-N 3.16Å; V276-F283 HydrophobicContact CB-CE2 4.41Å; V276-F283 CarbonylContact O-C 3.47Å; V276-F283 WeakPolarHBondContact O-CA 3.19Å; V276-F283 WeakPolarHBondContact O-CD2 3.48Å; V276-I284 PolarHBondContact O-N 3.42Å; V276-F288 HydrophobicContact CB-CB 4.4Å; V276-F288 HydrophobicContact CB-CD2 4.47Å; V276-F288 HydrophobicContact CG1-CB 3.88Å; V276-F288 HydrophobicContact CG1-CD2 3.99Å; V276-F288 HydrophobicContact CG1-CG 4.45Å; V276-L500 HydrophobicContact CG2-CD1 3.78Å; V276-L500 HydrophobicContact CG2-CD2 4.32Å
277	V	94	Very high	88.7	Confident	5 Å²	5	50.8 Å²	50.8	3%	0.03	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.2	124	170	-175.6	0	0	0	0	108.7	Q262 H263 L275 E282 F283 L500 L501	Q262-V277 WeakPolarHBondContact CA-O 3.37Å; H263-V277 HydrophobicContact CB-CB 3.81Å; H263-V277 HydrophobicContact CB-CG2 4.09Å; H263-V277 PolarHBondContact N-O 3.5Å; H263-V277 PolarHBondContact O-N 3.46Å; H263-V277 VanDerWaalsContact O-N 3.13Å; L275-V277 VanDerWaalsContact CD1-O 3.31Å; L275-V277 WeakPolarHBondContact CD1-O 3.44Å; V277-E282 WeakPolarHBondContact CA-O 3.47Å; V277-F283 HydrophobicContact CG2-CD2 3.84Å; V277-F283 HydrophobicContact CG2-CE2 4.42Å; V277-L500 HydrophobicContact CG2-CB 4.38Å; V277-L501 HydrophobicContact CG2-CD2 4.26Å
278	N	92.6	Very high	88.8	Confident	29 Å²	29	50.8 Å²	50.8	16%	0.155	27%	0.267	C	S	.	.			trans	-85.4	-177.6	179.9	74.9	13.4	0	0	0	112.5	L275 N280 R281 E282 I284	L275-N278 HydrophobicContact CD2-CB 4.46Å; N278-N280 PolarHBondContact O-N 2.88Å; N278-N280 WeakPolarHBondContact OD1-CA 3.27Å; N278-N280 WeakPolarHBondContact OD1-CB 3.4Å; N278-N280 PolarHBondContact OD1-N 3.35Å; N278-R281 PolarHBondContact O-N 3.23Å; N278-R281 VanDerWaalsContact O-N 3.09Å; N278-R281 PolarHBondContact OD1-N 3.24Å; N278-E282 PolarHBondContact N-O 3.06Å; N278-E282 PolarHBondContact ND2-OE2 2.97Å; N278-E282 WeakPolarHBondContact OD1-CB 3.37Å; N278-E282 PolarHBondContact OD1-N 2.63Å; N278-I284 HydrophobicContact CB-CD1 4.35Å
279	Q	88.8	Confident	89.1	Confident	75 Å²	75	51.2 Å²	51.2	35%	0.35	27%	0.267	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.9	-22.5	-177.1	-67	175.6	-11.4	0	0	114	P260 Q262 R281	P260-Q279 HydrophobicContact CB-CB 3.87Å; P260-Q279 HydrophobicContact CB-CG 4.14Å; P260-Q279 HydrophobicContact CG-CB 4.21Å; P260-Q279 HydrophobicContact CG-CG 4.16Å; Q262-Q279 HydrophobicContact CG-CG 3.61Å; Q279-R281 VanDerWaalsContact C-N 3.27Å
280	N	86.3	Confident	89.6	Confident	118 Å²	118	53.9 Å²	53.9	63%	0.631	27%	0.274	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.8	6.8	178.6	-60.7	-15.3	0	0	0	112.2	N278 E282	N278-N280 PolarHBondContact O-N 2.88Å; N278-N280 WeakPolarHBondContact OD1-CA 3.27Å; N278-N280 WeakPolarHBondContact OD1-CB 3.4Å; N278-N280 PolarHBondContact OD1-N 3.35Å; N280-E282 HydrophobicContact CB-CG 4.04Å; N280-E282 PolarHBondContact O-N 3.21Å
281	R	85.7	Confident	90	Very high	148 Å²	148	53.7 Å²	53.7	56%	0.558	27%	0.272	S	S	*	.			trans	63.1	23.8	-171	-58.3	-172.6	174.4	179.9	3	114.4	H107 N278 Q279	H107-R281 PolarHBondContact NE2-NH2 2.79Å; N278-R281 PolarHBondContact O-N 3.23Å; N278-R281 VanDerWaalsContact O-N 3.09Å; N278-R281 PolarHBondContact OD1-N 3.24Å; Q279-R281 VanDerWaalsContact C-N 3.27Å
282	E	91.2	Very high	90.5	Very high	107 Å²	107	47.5 Å²	47.5	50%	0.5	24%	0.239	S	C	.	.			trans	-82.7	130.9	173.8	-57.8	162.6	-179.1	0	0	110	V277 N278 N280	V277-E282 WeakPolarHBondContact CA-O 3.47Å; N278-E282 PolarHBondContact N-O 3.06Å; N278-E282 PolarHBondContact ND2-OE2 2.97Å; N278-E282 WeakPolarHBondContact OD1-CB 3.37Å; N278-E282 PolarHBondContact OD1-N 2.63Å; N280-E282 HydrophobicContact CB-CG 4.04Å; N280-E282 PolarHBondContact O-N 3.21Å
283	F	91.9	Very high	90.5	Very high	46 Å²	46	49.4 Å²	49.4	20%	0.202	24%	0.243	C	C	.	.	B	Isolated β-bridge	trans	-81.2	121.9	176.5	-166.9	-101.1	0	0	0	111	V276 V277 E285 F288 R497 L500 L501	V276-F283 HydrophobicContact CB-CE2 4.41Å; V276-F283 CarbonylContact O-C 3.47Å; V276-F283 WeakPolarHBondContact O-CA 3.19Å; V276-F283 WeakPolarHBondContact O-CD2 3.48Å; V277-F283 HydrophobicContact CG2-CD2 3.84Å; V277-F283 HydrophobicContact CG2-CE2 4.42Å; F283-E285 HydrophobicContact CD1-CB 4.35Å; F283-E285 WeakPolarHBondContact CD1-OE2 3.26Å; F283-E285 WeakPolarHBondContact CE1-OE2 3.45Å; F283-E285 PolarHBondContact O-N 3.36Å; F283-F288 HydrophobicContact CE1-CB 3.88Å; F283-F288 AromaticContact CE1-CD1 3.95Å; F283-F288 HydrophobicContact CE1-CD1 3.95Å; F283-F288 AromaticContact CE1-CG 3.97Å; F283-F288 HydrophobicContact CE1-CG 3.97Å; F283-F288 HydrophobicContact CE2-CG 4.49Å; F283-F288 HydrophobicContact CZ-CB 3.69Å; F283-F288 AromaticContact CZ-CD1 3.66Å; F283-F288 HydrophobicContact CZ-CD1 3.66Å; F283-F288 AromaticContact CZ-CD2 3.83Å; F283-F288 HydrophobicContact CZ-CD2 3.83Å; F283-F288 HydrophobicContact CZ-CE1 4.19Å; F283-F288 HydrophobicContact CZ-CE2 4.36Å; F283-F288 AromaticContact CZ-CG 3.45Å; F283-F288 HydrophobicContact CZ-CG 3.45Å; F283-F288 VanDerWaalsContact CZ-CG 3.45Å; F283-R497 HydrophobicContact CE1-CG 4.16Å; F283-R497 HydrophobicContact CE2-CG 4.35Å; F283-R497 HydrophobicContact CZ-CG 3.73Å; F283-L500 HydrophobicContact CE2-CD1 4.01Å; F283-L501 HydrophobicContact CB-CD1 3.98Å; F283-L501 HydrophobicContact CB-CD2 4.13Å; F283-L501 HydrophobicContact CD2-CD1 3.81Å; F283-L501 HydrophobicContact CD2-CD2 4Å; F283-L501 HydrophobicContact CD2-CG 3.95Å; F283-L501 HydrophobicContact CE2-CD1 4.48Å; F283-L501 HydrophobicContact CG-CD1 3.92Å; F283-L501 HydrophobicContact CG-CD2 4.47Å; F283-L501 HydrophobicContact CG-CG 4.5Å
284	I	92.8	Very high	90.2	Very high	43 Å²	43	49.4 Å²	49.4	22%	0.221	25%	0.245	C	C	.	.			trans	-93	86.9	178.8	-49	179	0	0	0	109	L275 V276 N278 S286 N287 F288	L275-I284 HydrophobicContact CD2-CD1 3.82Å; L275-I284 HydrophobicContact CG-CD1 3.95Å; V276-I284 PolarHBondContact O-N 3.42Å; N278-I284 HydrophobicContact CB-CD1 4.35Å; I284-S286 VanDerWaalsContact C-N 3.29Å; I284-S286 PolarHBondContact O-N 3.48Å; I284-N287 HydrophobicContact CB-CB 4.27Å; I284-N287 HydrophobicContact CG2-CB 3.88Å; I284-N287 PolarHBondContact O-N 2.66Å; I284-F288 PolarHBondContact O-N 3.15Å; I284-F288 VanDerWaalsContact O-N 3.11Å
285	E	90.5	Very high	89.7	Confident	57 Å²	57	48.2 Å²	48.2	27%	0.266	24%	0.24	S	C	.	.	H	α-helix	trans	-56.9	-39	-176.7	-166.9	67.2	-148	0	0	112.6	F283 N287 F288 N289 R497	F283-E285 HydrophobicContact CD1-CB 4.35Å; F283-E285 WeakPolarHBondContact CD1-OE2 3.26Å; F283-E285 WeakPolarHBondContact CE1-OE2 3.45Å; F283-E285 PolarHBondContact O-N 3.36Å; E285-N287 PolarHBondContact O-N 3.47Å; E285-F288 PolarHBondContact O-N 2.85Å; E285-N289 WeakPolarHBondContact O-CB 3.44Å; E285-N289 PolarHBondContact O-N 2.82Å; E285-N289 PolarHBondContact O-ND2 3.38Å; E285-N289 PolarHBondContact OE1-ND2 2.79Å; E285-R497 IonicContact OE1-CZ 3.19Å; E285-R497 IonicContact OE1-NH1 3.8Å; E285-R497 PolarHBondContact OE1-NH1 2.98Å; E285-R497 IonicContact OE2-NH1 2.66Å
286	S	91.2	Very high	88.9	Confident	38 Å²	38	53 Å²	53	27%	0.266	26%	0.262	S	S	.	.	H	α-helix	trans	-61.2	-47.2	179.2	56.7	0	0	0	0	112.3	I284 N289 L290	I284-S286 VanDerWaalsContact C-N 3.29Å; I284-S286 PolarHBondContact O-N 3.48Å; S286-N289 PolarHBondContact O-N 3.3Å; S286-L290 VanDerWaalsContact O-CG 3.31Å; S286-L290 WeakPolarHBondContact O-CG 3.46Å; S286-L290 PolarHBondContact O-N 3.09Å
287	N	91.7	Very high	88.1	Confident	46 Å²	46	57.7 Å²	57.7	25%	0.246	29%	0.287	C	S	.	.	H	α-helix	trans	-67.4	-37.9	178.6	-75.7	-8.3	0	0	0	112.2	H274 L275 I284 E285 L290 A291	H274-N287 HydrophobicContact CB-CB 4.45Å; L275-N287 WeakPolarHBondContact O-CB 3.46Å; L275-N287 PolarHBondContact O-ND2 3.11Å; I284-N287 HydrophobicContact CB-CB 4.27Å; I284-N287 HydrophobicContact CG2-CB 3.88Å; I284-N287 PolarHBondContact O-N 2.66Å; E285-N287 PolarHBondContact O-N 3.47Å; N287-L290 PolarHBondContact O-N 3.31Å; N287-A291 PolarHBondContact O-N 2.81Å
288	F	91.1	Very high	87.1	Confident	0 Å²	0	58.1 Å²	58.1	0%	0	29%	0.291	C	S	.	.	H	α-helix	trans	-62.5	-45.4	175.3	-177.7	-113.2	0	0	0	111.2	V276 F283 I284 E285 L290 A291 L292 L487 A493 A496 R497 L500	V276-F288 HydrophobicContact CB-CB 4.4Å; V276-F288 HydrophobicContact CB-CD2 4.47Å; V276-F288 HydrophobicContact CG1-CB 3.88Å; V276-F288 HydrophobicContact CG1-CD2 3.99Å; V276-F288 HydrophobicContact CG1-CG 4.45Å; F283-F288 HydrophobicContact CE1-CB 3.88Å; F283-F288 AromaticContact CE1-CD1 3.95Å; F283-F288 HydrophobicContact CE1-CD1 3.95Å; F283-F288 AromaticContact CE1-CG 3.97Å; F283-F288 HydrophobicContact CE1-CG 3.97Å; F283-F288 HydrophobicContact CE2-CG 4.49Å; F283-F288 HydrophobicContact CZ-CB 3.69Å; F283-F288 AromaticContact CZ-CD1 3.66Å; F283-F288 HydrophobicContact CZ-CD1 3.66Å; F283-F288 AromaticContact CZ-CD2 3.83Å; F283-F288 HydrophobicContact CZ-CD2 3.83Å; F283-F288 HydrophobicContact CZ-CE1 4.19Å; F283-F288 HydrophobicContact CZ-CE2 4.36Å; F283-F288 AromaticContact CZ-CG 3.45Å; F283-F288 HydrophobicContact CZ-CG 3.45Å; F283-F288 VanDerWaalsContact CZ-CG 3.45Å; I284-F288 PolarHBondContact O-N 3.15Å; I284-F288 VanDerWaalsContact O-N 3.11Å; E285-F288 PolarHBondContact O-N 2.85Å; F288-L290 PolarHBondContact O-N 3.37Å; F288-A291 WeakPolarHBondContact O-CB 3.42Å; F288-A291 PolarHBondContact O-N 3.02Å; F288-L292 HydrophobicContact CD1-CD1 3.93Å; F288-L292 HydrophobicContact CE1-CD1 3.5Å; F288-L292 VanDerWaalsContact CE1-CD1 3.5Å; F288-L292 HydrophobicContact CE1-CG 4.28Å; F288-L292 HydrophobicContact CZ-CD1 3.84Å; F288-L292 HydrophobicContact CZ-CD2 4.41Å; F288-L292 HydrophobicContact CZ-CG 4.26Å; F288-L292 WeakPolarHBondContact O-CG 3.42Å; F288-L292 PolarHBondContact O-N 2.84Å; F288-L487 HydrophobicContact CE2-CD1 4.34Å; F288-A493 HydrophobicContact CE1-CB 4.13Å; F288-A493 HydrophobicContact CZ-CB 4.45Å; F288-A496 HydrophobicContact CE2-CB 4.04Å; F288-A496 HydrophobicContact CZ-CB 3.83Å; F288-R497 HydrophobicContact CD1-CG 4.48Å; F288-R497 HydrophobicContact CE1-CG 3.85Å; F288-R497 HydrophobicContact CZ-CG 4.13Å; F288-L500 HydrophobicContact CE2-CD1 4.42Å
289	N	89.5	Confident	85.8	Confident	32 Å²	32	58.2 Å²	58.2	17%	0.171	30%	0.296	C	S	.	.	H	α-helix	trans	-65.7	-36.3	176	-73.8	-49.8	0	0	0	112.8	E285 S286 A291 L292 N293 N663	E285-N289 WeakPolarHBondContact O-CB 3.44Å; E285-N289 PolarHBondContact O-N 2.82Å; E285-N289 PolarHBondContact O-ND2 3.38Å; E285-N289 PolarHBondContact OE1-ND2 2.79Å; S286-N289 PolarHBondContact O-N 3.3Å; N289-A291 VanDerWaalsContact C-N 3.35Å; N289-L292 PolarHBondContact O-N 3.46Å; N289-N293 WeakPolarHBondContact O-CB 3.32Å; N289-N293 PolarHBondContact O-N 2.88Å; N289-N293 PolarHBondContact O-ND2 2.83Å; N289-N663 PolarHBondContact ND2-ND2 3.48Å; N289-N663 PolarHBondContact ND2-OD1 2.89Å
290	L	89.2	Confident	84.4	Confident	87 Å²	87	56.2 Å²	56.2	46%	0.455	30%	0.295	S	S	.	.	H	α-helix	trans	-61.3	-41.9	171.8	-73.4	171.9	0	0	0	112.1	S286 N287 F288 N293 T294	S286-L290 VanDerWaalsContact O-CG 3.31Å; S286-L290 WeakPolarHBondContact O-CG 3.46Å; S286-L290 PolarHBondContact O-N 3.09Å; N287-L290 PolarHBondContact O-N 3.31Å; F288-L290 PolarHBondContact O-N 3.37Å; L290-N293 PolarHBondContact O-N 2.83Å; L290-T294 PolarHBondContact O-N 3.36Å; L290-T294 PolarHBondContact O-OG1 3.15Å
291	A	88.2	Confident	82.8	Confident	0 Å²	0	55.7 Å²	55.7	0%	0	29%	0.293	C	S	.	.	H	α-helix	trans	-64.9	-45.8	176.6	0	0	0	0	0	111.8	V265 P267 H274 N287 F288 N289 N293 T294 L295	V265-A291 HydrophobicContact CB-CB 4.28Å; V265-A291 HydrophobicContact CG1-CB 3.59Å; P267-A291 VanDerWaalsContact CB-O 3.27Å; P267-A291 WeakPolarHBondContact CB-O 3.18Å; P267-A291 HydrophobicContact CG-CB 4.35Å; H274-A291 HydrophobicContact CB-CB 4.02Å; N287-A291 PolarHBondContact O-N 2.81Å; F288-A291 WeakPolarHBondContact O-CB 3.42Å; F288-A291 PolarHBondContact O-N 3.02Å; N289-A291 VanDerWaalsContact C-N 3.35Å; A291-N293 PolarHBondContact O-N 3.46Å; A291-T294 WeakPolarHBondContact O-CB 3.26Å; A291-T294 PolarHBondContact O-N 3.49Å; A291-T294 VanDerWaalsContact O-N 3.17Å; A291-L295 PolarHBondContact O-N 2.89Å
292	L	87	Confident	81.1	Confident	24 Å²	24	51.2 Å²	51.2	13%	0.126	28%	0.284	C	S	.	.	H	α-helix	trans	-61.9	-42	176.4	-69.8	179.3	0	0	0	112.3	F288 N289 T294 L295 Q296 L487 A493	F288-L292 HydrophobicContact CD1-CD1 3.93Å; F288-L292 HydrophobicContact CE1-CD1 3.5Å; F288-L292 VanDerWaalsContact CE1-CD1 3.5Å; F288-L292 HydrophobicContact CE1-CG 4.28Å; F288-L292 HydrophobicContact CZ-CD1 3.84Å; F288-L292 HydrophobicContact CZ-CD2 4.41Å; F288-L292 HydrophobicContact CZ-CG 4.26Å; F288-L292 WeakPolarHBondContact O-CG 3.42Å; F288-L292 PolarHBondContact O-N 2.84Å; N289-L292 PolarHBondContact O-N 3.46Å; L292-T294 VanDerWaalsContact C-N 3.28Å; L292-T294 PolarHBondContact O-N 2.99Å; L292-L295 WeakPolarHBondContact O-CB 3.37Å; L292-L295 PolarHBondContact O-N 2.83Å; L292-Q296 WeakPolarHBondContact O-CG 3.29Å; L292-Q296 PolarHBondContact O-N 3.12Å; L292-L487 HydrophobicContact CD2-CD1 4.35Å; L292-A493 HydrophobicContact CD1-CB 3.78Å
293	N	85.4	Confident	79	Confident	65 Å²	65	47 Å²	47	35%	0.348	27%	0.265	S	S	.	.	H	α-helix	trans	-60.3	-39.5	174.6	-75.2	-38.1	0	0	0	111.5	N289 L290 A291 Q296 N297	N289-N293 WeakPolarHBondContact O-CB 3.32Å; N289-N293 PolarHBondContact O-N 2.88Å; N289-N293 PolarHBondContact O-ND2 2.83Å; L290-N293 PolarHBondContact O-N 2.83Å; A291-N293 PolarHBondContact O-N 3.46Å; N293-Q296 PolarHBondContact O-N 3.3Å; N293-N297 WeakPolarHBondContact O-CB 3.47Å; N293-N297 PolarHBondContact O-N 3.1Å; N293-N297 PolarHBondContact O-ND2 3.1Å
294	T	84.8	Confident	76.7	Confident	42 Å²	42	48.2 Å²	48.2	26%	0.258	28%	0.278	S	S	.	.	H	α-helix	trans	-65.3	-42.9	177	-56.1	0	0	0	0	111.4	P267 L290 A291 L292 N297 A298	P267-T294 HydrophobicContact CB-CG2 4.36Å; P267-T294 HydrophobicContact CG-CG2 3.81Å; L290-T294 PolarHBondContact O-N 3.36Å; L290-T294 PolarHBondContact O-OG1 3.15Å; A291-T294 WeakPolarHBondContact O-CB 3.26Å; A291-T294 PolarHBondContact O-N 3.49Å; A291-T294 VanDerWaalsContact O-N 3.17Å; L292-T294 VanDerWaalsContact C-N 3.28Å; L292-T294 PolarHBondContact O-N 2.99Å; T294-N297 PolarHBondContact O-N 3.3Å; T294-A298 WeakPolarHBondContact O-CB 3.47Å; T294-A298 PolarHBondContact O-N 3.46Å
295	L	82.4	Confident	74.2	Confident	17 Å²	17	51.2 Å²	51.2	9%	0.089	30%	0.295	C	S	.	.	H	α-helix	trans	-61.3	-44.4	175.2	-177.5	66.5	0	0	0	111.7	P267 C268 A291 L292 A298 A299 L487 D488	P267-L295 HydrophobicContact CB-CB 3.85Å; C268-L295 HydrophobicContact CB-CD1 4.11Å; A291-L295 PolarHBondContact O-N 2.89Å; L292-L295 WeakPolarHBondContact O-CB 3.37Å; L292-L295 PolarHBondContact O-N 2.83Å; L295-A298 PolarHBondContact O-N 3.19Å; L295-A299 WeakPolarHBondContact O-CB 3.26Å; L295-A299 PolarHBondContact O-N 3.38Å; L295-L487 WeakPolarHBondContact CD1-O 3.25Å; L295-L487 HydrophobicContact CD2-CB 4.39Å; L295-D488 WeakPolarHBondContact CD2-O 3.09Å
296	Q	79.4	Confident	72	Confident	133 Å²	133	53.3 Å²	53.3	62%	0.621	31%	0.312	S	S	*	.	H	α-helix	trans	-63.2	-42.1	176.2	-72.2	177.5	-2.2	0	0	112.1	L292 N293 A299 G300	L292-Q296 WeakPolarHBondContact O-CG 3.29Å; L292-Q296 PolarHBondContact O-N 3.12Å; N293-Q296 PolarHBondContact O-N 3.3Å; Q296-A299 PolarHBondContact O-N 3.42Å; Q296-G300 PolarHBondContact O-N 3.39Å
297	N	77.2	Confident	69.4	Low	99 Å²	99	59.9 Å²	59.9	53%	0.529	34%	0.336	S	S	.	.	H	α-helix	trans	-65.2	-39.4	176.6	-69	-22.6	0	0	0	112	N293 T294 G300 N301	N293-N297 WeakPolarHBondContact O-CB 3.47Å; N293-N297 PolarHBondContact O-N 3.1Å; N293-N297 PolarHBondContact O-ND2 3.1Å; T294-N297 PolarHBondContact O-N 3.3Å; N297-G300 PolarHBondContact O-N 2.64Å; N297-N301 PolarHBondContact O-N 2.92Å
298	A	72.1	Confident	67	Low	15 Å²	15	61.9 Å²	61.9	12%	0.124	35%	0.353	C	S	.	.	H	α-helix	trans	-69.2	-41.1	177	0	0	0	0	0	112.6	C268 T294 L295 G300 N301 S302	C268-A298 WeakPolarHBondContact O-CB 3.42Å; T294-A298 WeakPolarHBondContact O-CB 3.47Å; T294-A298 PolarHBondContact O-N 3.46Å; L295-A298 PolarHBondContact O-N 3.19Å; A298-G300 PolarHBondContact O-N 2.93Å; A298-N301 PolarHBondContact O-N 3.44Å; A298-S302 PolarHBondContact O-N 3.07Å; A298-S302 VanDerWaalsContact O-N 3.09Å; A298-S302 PolarHBondContact O-OG 2.74Å
299	A	65.6	Low	64.4	Low	31 Å²	31	72.5 Å²	72.5	26%	0.256	39%	0.393	S	S	.	.	H	α-helix	trans	-59.3	-39.5	170.9	0	0	0	0	0	110.7	L295 Q296 I303	L295-A299 WeakPolarHBondContact O-CB 3.26Å; L295-A299 PolarHBondContact O-N 3.38Å; Q296-A299 PolarHBondContact O-N 3.42Å; A299-I303 WeakPolarHBondContact O-CD1 3.3Å; A299-I303 WeakPolarHBondContact O-CG1 3.48Å
300	G	58.7	Low	61.9	Low	32 Å²	32	74.2 Å²	74.2	33%	0.33	42%	0.418	S	S	.	.	H	α-helix	trans	-65	-40.2	173.9	0	0	0	0	0	114.7	Q296 N297 A298 I303	Q296-G300 PolarHBondContact O-N 3.39Å; N297-G300 PolarHBondContact O-N 2.64Å; A298-G300 PolarHBondContact O-N 2.93Å; G300-I303 VanDerWaalsContact O-CB 3.3Å; G300-I303 WeakPolarHBondContact O-CB 3.49Å; G300-I303 PolarHBondContact O-N 3.23Å
301	N	53.1	Low	59.3	Low	108 Å²	108	81.8 Å²	81.8	58%	0.578	44%	0.441	S	S	*	.	H	α-helix	trans	-75.5	-24.8	-179.5	-74.1	-19.5	0	0	0	113.7	N297 A298 I303 S304 D305	N297-N301 PolarHBondContact O-N 2.92Å; A298-N301 PolarHBondContact O-N 3.44Å; N301-I303 PolarHBondContact O-N 3.37Å; N301-I303 VanDerWaalsContact O-N 3.11Å; N301-S304 PolarHBondContact O-N 2.83Å; N301-S304 PolarHBondContact O-OG 3.1Å; N301-D305 PolarHBondContact O-N 3.03Å
302	S	50.1	Low	56.7	Low	53 Å²	53	89.7 Å²	89.7	37%	0.371	48%	0.483	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.8	-19.6	173.7	-54.1	0	0	0	0	112.7	A298 T306	A298-S302 PolarHBondContact O-N 3.07Å; A298-S302 VanDerWaalsContact O-N 3.09Å; A298-S302 PolarHBondContact O-OG 2.74Å; S302-T306 PolarHBondContact O-OG1 3.2Å
303	I	48.5	Very low	53.9	Low	20 Å²	20	93 Å²	93	10%	0.103	52%	0.523	C	S	.	.	T	Hydrogen-bonded Turn	trans	-86.7	-26.6	-175.9	-54	178.7	0	0	0	111.6	A299 G300 N301 T306 P635 I636	A299-I303 WeakPolarHBondContact O-CD1 3.3Å; A299-I303 WeakPolarHBondContact O-CG1 3.48Å; G300-I303 VanDerWaalsContact O-CB 3.3Å; G300-I303 WeakPolarHBondContact O-CB 3.49Å; G300-I303 PolarHBondContact O-N 3.23Å; N301-I303 PolarHBondContact O-N 3.37Å; N301-I303 VanDerWaalsContact O-N 3.11Å; I303-T306 WeakPolarHBondContact CA-OG1 3.49Å; I303-T306 PolarHBondContact O-OG1 2.94Å; I303-T306 VanDerWaalsContact O-OG1 3.09Å; I303-P635 HydrophobicContact CG2-CG 4.01Å; I303-I636 HydrophobicContact CD1-CD1 3.59Å; I303-I636 HydrophobicContact CD1-CG1 3.53Å; I303-I636 HydrophobicContact CG1-CD1 3.24Å; I303-I636 HydrophobicContact CG1-CG1 3.34Å
304	S	42.2	Very low	51.2	Low	70 Å²	70	93.2 Å²	93.2	49%	0.49	54%	0.541	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.8	-35.8	177.6	56.7	0	0	0	0	111.8	N301 T306 K307	N301-S304 PolarHBondContact O-N 2.83Å; N301-S304 PolarHBondContact O-OG 3.1Å; S304-T306 VanDerWaalsContact C-N 3.32Å; S304-T306 PolarHBondContact O-N 3.21Å; S304-K307 PolarHBondContact O-N 2.71Å
305	D	41	Very low	48.8	Very low	107 Å²	107	96.6 Å²	96.6	57%	0.572	57%	0.566	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.5	-16.9	178	-91.6	-9.4	0	0	0	114.5	N301 K307 S308	N301-D305 PolarHBondContact O-N 3.03Å; D305-K307 VanDerWaalsContact C-N 3.28Å; D305-K307 PolarHBondContact O-N 2.83Å; D305-S308 PolarHBondContact O-OG 3.4Å
306	T	44.2	Very low	46.5	Very low	101 Å²	101	102.4 Å²	102.4	62%	0.62	60%	0.603	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.2	-13.4	175.4	21.6	0	0	0	0	113.3	S302 I303 S304	S302-T306 PolarHBondContact O-OG1 3.2Å; I303-T306 WeakPolarHBondContact CA-OG1 3.49Å; I303-T306 PolarHBondContact O-OG1 2.94Å; I303-T306 VanDerWaalsContact O-OG1 3.09Å; S304-T306 VanDerWaalsContact C-N 3.32Å; S304-T306 PolarHBondContact O-N 3.21Å
307	K	37.2	Very low	44.6	Very low	176 Å²	176	106.5 Å²	106.5	77%	0.765	61%	0.612	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.3	-19.5	176.9	-73.5	-177.9	179.7	173.4	0	114.4	S304 D305	S304-K307 PolarHBondContact O-N 2.71Å; D305-K307 VanDerWaalsContact C-N 3.28Å; D305-K307 PolarHBondContact O-N 2.83Å
308	S	40.3	Very low	43.3	Very low	88 Å²	88	105.1 Å²	105.1	62%	0.615	61%	0.609	S	S	*	*	T	Hydrogen-bonded Turn	trans	-101.9	-13.6	-175.6	40.7	0	0	0	0	113.9	D305 G310	D305-S308 PolarHBondContact O-OG 3.4Å; S308-G310 PolarHBondContact O-N 3.27Å
309	R	37.5	Very low	42.5	Very low	222 Å²	222	109.4 Å²	109.4	84%	0.838	63%	0.626	S	S	*	*			trans	-98.2	64.9	175.3	-73	-179.6	118.5	146.7	0.7	112.2
310	G	35.1	Very low	42.4	Very low	68 Å²	68	110.8 Å²	110.8	70%	0.701	63%	0.633	S	S	*	*			trans	-73.2	136.1	165.5	0	0	0	0	0	111.9	S308	S308-G310 PolarHBondContact O-N 3.27Å
311	R	35.5	Very low	43.3	Very low	246 Å²	246	111.3 Å²	111.3	93%	0.928	63%	0.625	S	S	*	*	S	Bend	trans	103.4	3.4	146	-127.6	173.1	-179.7	156.3	-0.6	121.7
312	N	33.7	Very low	44.7	Very low	166 Å²	166	106.2 Å²	106.2	89%	0.888	60%	0.598	S	S	*	*			trans	-136	110.6	164.6	-91.1	-16	0	0	0	111.7	G314	N312-G314 PolarHBondContact O-N 3.14Å
313	G	28.8	Very low	46.3	Very low	94 Å²	94	104.6 Å²	104.6	97%	0.969	59%	0.586	S	S	*	*			trans	-66.3	122.5	-178.7	0	0	0	0	0	112.8
314	G	28.3	Very low	48	Very low	69 Å²	69	109.2 Å²	109.2	71%	0.711	61%	0.606	S	S	*	*			trans	-149.5	122.7	171.3	0	0	0	0	0	109.4	N312 T316	N312-G314 PolarHBondContact O-N 3.14Å; G314-T316 PolarHBondContact O-N 2.87Å
315	S	33.2	Very low	50.2	Low	114 Å²	114	106 Å²	106	80%	0.797	58%	0.583	S	S	*	*			trans	-42.8	133.7	172.2	-178.3	0	0	0	0	110.8	R317	S315-R317 VanDerWaalsContact C-N 3.29Å; S315-R317 PolarHBondContact O-N 3.01Å
316	T	35.5	Very low	52.6	Low	138 Å²	138	100.9 Å²	100.9	85%	0.847	56%	0.556	S	S	*	*			trans	-56.1	89.9	177	28	0	0	0	0	109.7	G314	G314-T316 PolarHBondContact O-N 2.87Å
317	R	39.5	Very low	54.8	Low	219 Å²	219	101.1 Å²	101.1	83%	0.826	55%	0.548	S	S	*	.	P	Polyproline II helix	trans	-53.5	134	169.4	-74.8	-178.2	175.1	179.3	-1.9	107.6	S315 Q319	S315-R317 VanDerWaalsContact C-N 3.29Å; S315-R317 PolarHBondContact O-N 3.01Å; R317-Q319 PolarHBondContact O-N 2.9Å
318	P	48.8	Very low	57.2	Low	70 Å²	70	95.1 Å²	95.1	46%	0.455	52%	0.524	S	S	.	.	P	Polyproline II helix	trans	-50.6	118.8	172.1	-20.2	28.8	0	0	0	107.5	F349	P318-F349 HydrophobicContact CB-CE1 4.11Å; P318-F349 HydrophobicContact CG-CE1 3.82Å; P318-F349 HydrophobicContact CG-CZ 4.08Å
319	Q	56.2	Low	59.7	Low	105 Å²	105	90.9 Å²	90.9	49%	0.491	50%	0.495	S	S	.	.	P	Polyproline II helix	trans	-54.3	145.9	178.5	-84.3	-148	23.8	0	0	109	R317 Y321	R317-Q319 PolarHBondContact O-N 2.9Å; Q319-Y321 HydrophobicContact CB-CD1 4.3Å; Q319-Y321 HydrophobicContact CB-CD2 3.68Å; Q319-Y321 HydrophobicContact CB-CE1 4Å; Q319-Y321 HydrophobicContact CB-CE2 3.4Å; Q319-Y321 HydrophobicContact CB-CG 4.13Å; Q319-Y321 HydrophobicContact CG-CE2 4.16Å; Q319-Y321 PolarHBondContact O-N 2.94Å; Q319-Y321 PolarHBondContact OE1-OH 3.49Å; Q319-Y321 VanDerWaalsContact OE1-OH 3.09Å
320	P	62.5	Low	62.2	Low	60 Å²	60	81.1 Å²	81.1	39%	0.39	46%	0.459	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.4	33.4	-172.2	32.6	-37.3	0	0	0	113	C322 S323 K324	P320-C322 VanDerWaalsContact C-N 3.3Å; P320-C322 PolarHBondContact O-N 2.91Å; P320-S323 WeakPolarHBondContact CB-OG 3.3Å; P320-S323 PolarHBondContact O-N 3.48Å; P320-S323 VanDerWaalsContact O-N 3.15Å; P320-S323 PolarHBondContact O-OG 3.38Å; P320-K324 PolarHBondContact O-N 2.96Å; P320-K324 VanDerWaalsContact O-N 3.14Å
321	Y	77.2	Confident	64.8	Low	43 Å²	43	82.9 Å²	82.9	17%	0.169	45%	0.452	C	S	.	.	H	α-helix	trans	-54.6	-45.5	-179.9	-63.6	-48.8	0	0	0	111.5	Y266 C268 Q319 S323 K324 L325	Y266-Y321 HydrophobicContact CE1-CG 4.48Å; C268-Y321 HydrophobicContact CB-CD2 4.26Å; C268-Y321 HydrophobicContact CB-CE2 4.08Å; Q319-Y321 HydrophobicContact CB-CD1 4.3Å; Q319-Y321 HydrophobicContact CB-CD2 3.68Å; Q319-Y321 HydrophobicContact CB-CE1 4Å; Q319-Y321 HydrophobicContact CB-CE2 3.4Å; Q319-Y321 HydrophobicContact CB-CG 4.13Å; Q319-Y321 HydrophobicContact CG-CE2 4.16Å; Q319-Y321 PolarHBondContact O-N 2.94Å; Q319-Y321 PolarHBondContact OE1-OH 3.49Å; Q319-Y321 VanDerWaalsContact OE1-OH 3.09Å; Y321-S323 VanDerWaalsContact C-N 3.35Å; Y321-S323 PolarHBondContact O-N 2.82Å; Y321-K324 PolarHBondContact O-N 3.32Å; Y321-L325 WeakPolarHBondContact O-CB 3.4Å; Y321-L325 PolarHBondContact O-N 3.4Å
322	C	82.7	Confident	67.4	Low	2 Å²	2	77.1 Å²	77.1	1%	0.014	44%	0.436	C	S	.	.	H	α-helix	trans	-58.4	-46.3	178.1	-174.5	0	0	0	0	111.3	P320 K324 L325 V326 Y350	P320-C322 VanDerWaalsContact C-N 3.3Å; P320-C322 PolarHBondContact O-N 2.91Å; C322-K324 PolarHBondContact O-N 3.15Å; C322-L325 PolarHBondContact O-N 3.36Å; C322-V326 WeakPolarHBondContact O-CG2 3.48Å; C322-V326 PolarHBondContact O-N 2.73Å; C322-Y350 HydrophobicContact CB-CD1 3.77Å; C322-Y350 HydrophobicContact CB-CE1 3.92Å; C322-Y350 HydrophobicContact CB-CG 4.43Å
323	S	83.7	Confident	70.2	Confident	18 Å²	18	74.1 Å²	74.1	13%	0.126	42%	0.42	C	S	.	.	H	α-helix	trans	-64.1	-37.6	179.7	72	0	0	0	0	113.6	P320 Y321 K327	P320-S323 WeakPolarHBondContact CB-OG 3.3Å; P320-S323 PolarHBondContact O-N 3.48Å; P320-S323 VanDerWaalsContact O-N 3.15Å; P320-S323 PolarHBondContact O-OG 3.38Å; Y321-S323 VanDerWaalsContact C-N 3.35Å; Y321-S323 PolarHBondContact O-N 2.82Å; S323-K327 WeakPolarHBondContact O-CB 3.31Å; S323-K327 PolarHBondContact O-N 3.13Å; S323-K327 VanDerWaalsContact O-N 3.07Å
324	K	84.7	Confident	73.2	Confident	117 Å²	117	70.5 Å²	70.5	51%	0.509	38%	0.378	S	S	.	.	H	α-helix	trans	-65.5	-43.1	174.5	-71	-176.7	177.3	-176.6	0	111.1	P320 Y321 C322 K327 L328	P320-K324 PolarHBondContact O-N 2.96Å; P320-K324 VanDerWaalsContact O-N 3.14Å; Y321-K324 PolarHBondContact O-N 3.32Å; C322-K324 PolarHBondContact O-N 3.15Å; K324-K327 PolarHBondContact O-N 3.36Å; K324-L328 PolarHBondContact O-N 3.17Å
325	L	89	Confident	76.2	Confident	2 Å²	2	69.9 Å²	69.9	1%	0.01	36%	0.356	C	S	.	.	H	α-helix	trans	-68.6	-42.9	-179	-176.2	55.9	0	0	0	111.7	Y266 I273 Y321 C322 K327 L328 V329 L445 I484 M486	Y266-L325 HydrophobicContact CD1-CD2 3.9Å; Y266-L325 HydrophobicContact CD2-CD1 3.92Å; Y266-L325 HydrophobicContact CD2-CD2 4.3Å; Y266-L325 HydrophobicContact CE2-CD1 4.45Å; Y266-L325 HydrophobicContact CG-CD1 4.17Å; Y266-L325 HydrophobicContact CG-CD2 3.74Å; I273-L325 HydrophobicContact CG2-CD1 3.57Å; Y321-L325 WeakPolarHBondContact O-CB 3.4Å; Y321-L325 PolarHBondContact O-N 3.4Å; C322-L325 PolarHBondContact O-N 3.36Å; L325-K327 VanDerWaalsContact C-N 3.31Å; L325-K327 PolarHBondContact O-N 2.91Å; L325-L328 PolarHBondContact O-N 3.22Å; L325-V329 HydrophobicContact CD1-CG2 4.47Å; L325-V329 VanDerWaalsContact O-CG2 3.27Å; L325-V329 WeakPolarHBondContact O-CG2 3.43Å; L325-V329 PolarHBondContact O-N 2.94Å; L325-L445 HydrophobicContact CD2-CD1 3.35Å; L325-L445 HydrophobicContact CD2-CD2 3.92Å; L325-L445 HydrophobicContact CD2-CG 4.3Å; L325-L445 HydrophobicContact CG-CD1 4.26Å; L325-L445 HydrophobicContact CG-CD2 4.22Å; L325-I484 HydrophobicContact CD1-CG2 4.3Å; L325-I484 HydrophobicContact CD2-CG2 3.97Å; L325-M486 HydrophobicContact CD2-CG 3.93Å; L325-M486 HydrophobicContact CD2-SD 4.28Å
326	V	91.6	Very high	79.2	Confident	0 Å²	0	65.1 Å²	65.1	0%	0	32%	0.323	C	S	.	.	H	α-helix	trans	-58.6	-45.8	173.1	172.6	0	0	0	0	110.2	C322 L328 V329 M330 L337 V339 L354 F359 V426 L445	C322-V326 WeakPolarHBondContact O-CG2 3.48Å; C322-V326 PolarHBondContact O-N 2.73Å; V326-L328 PolarHBondContact O-N 3.45Å; V326-V329 PolarHBondContact O-N 3.14Å; V326-M330 HydrophobicContact CG1-CG 4.17Å; V326-M330 WeakPolarHBondContact O-CG 3.49Å; V326-M330 PolarHBondContact O-N 2.96Å; V326-L337 HydrophobicContact CB-CD2 4.47Å; V326-L337 HydrophobicContact CG1-CD2 4.33Å; V326-L337 HydrophobicContact CG2-CD2 3.97Å; V326-V339 HydrophobicContact CG2-CG2 4.29Å; V326-L354 HydrophobicContact CB-CD1 4.37Å; V326-L354 HydrophobicContact CB-CD2 4.4Å; V326-L354 HydrophobicContact CG1-CD1 3.79Å; V326-L354 HydrophobicContact CG1-CD2 4.36Å; V326-F359 HydrophobicContact CG1-CZ 4.4Å; V326-V426 HydrophobicContact CG1-CG1 4.13Å; V326-V426 HydrophobicContact CG1-CG2 3.65Å; V326-L445 HydrophobicContact CG2-CD2 4.39Å
327	K	88.9	Confident	82.1	Confident	106 Å²	106	58.5 Å²	58.5	46%	0.461	28%	0.283	S	S	.	.	H	α-helix	trans	-57.6	-46.7	174.8	-173.7	178.9	176.3	-177.6	0	112.2	S323 K324 L325 V329 M330 D331 M357	S323-K327 WeakPolarHBondContact O-CB 3.31Å; S323-K327 PolarHBondContact O-N 3.13Å; S323-K327 VanDerWaalsContact O-N 3.07Å; K324-K327 PolarHBondContact O-N 3.36Å; L325-K327 VanDerWaalsContact C-N 3.31Å; L325-K327 PolarHBondContact O-N 2.91Å; K327-V329 VanDerWaalsContact C-N 3.31Å; K327-V329 PolarHBondContact O-N 3.01Å; K327-M330 PolarHBondContact O-N 2.83Å; K327-D331 WeakPolarHBondContact O-CB 3.3Å; K327-D331 PolarHBondContact O-N 3.41Å; K327-M357 HydrophobicContact CB-CE 3.88Å; K327-M357 HydrophobicContact CB-SD 4.02Å; K327-M357 HydrophobicContact CD-CE 4.08Å; K327-M357 HydrophobicContact CG-CE 4.31Å; K327-M357 HydrophobicContact CG-SD 4.35Å
328	L	88.9	Confident	84.8	Confident	50 Å²	50	48.1 Å²	48.1	26%	0.262	24%	0.243	S	C	.	.	H	α-helix	trans	-59	-42.2	177.1	-177.7	153.5	0	0	0	111.9	I273 K324 L325 V326 Q332	I273-L328 HydrophobicContact CD1-CD2 4.14Å; I273-L328 HydrophobicContact CG1-CD2 4.45Å; K324-L328 PolarHBondContact O-N 3.17Å; L325-L328 PolarHBondContact O-N 3.22Å; V326-L328 PolarHBondContact O-N 3.45Å; L328-Q332 HydrophobicContact CD2-CG 4.47Å; L328-Q332 VanDerWaalsContact O-CG 3.22Å; L328-Q332 WeakPolarHBondContact O-CG 3.5Å; L328-Q332 PolarHBondContact O-N 2.75Å
329	V	91.6	Very high	87.1	Confident	0 Å²	0	44.8 Å²	44.8	0%	0	22%	0.222	C	C	.	.	H	α-helix	trans	-65.1	-43	177.7	175.1	0	0	0	0	110.9	L325 V326 K327 Q332 L334 L337 I484	L325-V329 HydrophobicContact CD1-CG2 4.47Å; L325-V329 VanDerWaalsContact O-CG2 3.27Å; L325-V329 WeakPolarHBondContact O-CG2 3.43Å; L325-V329 PolarHBondContact O-N 2.94Å; V326-V329 PolarHBondContact O-N 3.14Å; K327-V329 VanDerWaalsContact C-N 3.31Å; K327-V329 PolarHBondContact O-N 3.01Å; V329-Q332 PolarHBondContact O-N 3.3Å; V329-L334 HydrophobicContact CG1-CB 3.55Å; V329-L334 HydrophobicContact CG1-CD1 4.38Å; V329-L334 WeakPolarHBondContact O-CB 3.48Å; V329-L334 PolarHBondContact O-N 3.11Å; V329-L334 VanDerWaalsContact O-N 3.14Å; V329-L337 HydrophobicContact CB-CD2 4.22Å; V329-L337 HydrophobicContact CG1-CB 4.31Å; V329-L337 HydrophobicContact CG1-CD1 4.17Å; V329-L337 HydrophobicContact CG1-CD2 3.97Å; V329-L337 HydrophobicContact CG1-CG 4.36Å; V329-I484 HydrophobicContact CG2-CD1 3.38Å
330	M	91.2	Very high	89	Confident	16 Å²	16	39.8 Å²	39.8	8%	0.079	20%	0.198	C	C	.	.	H	α-helix	trans	-65.9	-44.1	177.4	-62.8	-73.7	124.3	0	0	111.5	V326 K327 Q332 N333 E335 L337 F359 K425 V426	V326-M330 HydrophobicContact CG1-CG 4.17Å; V326-M330 WeakPolarHBondContact O-CG 3.49Å; V326-M330 PolarHBondContact O-N 2.96Å; K327-M330 PolarHBondContact O-N 2.83Å; M330-Q332 PolarHBondContact O-N 3.11Å; M330-Q332 VanDerWaalsContact O-N 3.15Å; M330-N333 PolarHBondContact O-N 3.45Å; M330-E335 HydrophobicContact CE-CB 3.88Å; M330-E335 HydrophobicContact SD-CB 4.07Å; M330-L337 HydrophobicContact CE-CB 3.69Å; M330-L337 HydrophobicContact CE-CD2 4.27Å; M330-F359 HydrophobicContact CB-CD1 4.24Å; M330-F359 HydrophobicContact CB-CE1 3.8Å; M330-F359 HydrophobicContact CG-CD1 3.95Å; M330-F359 HydrophobicContact CG-CE1 3.48Å; M330-F359 VanDerWaalsContact CG-CE1 3.48Å; M330-F359 HydrophobicContact CG-CZ 3.8Å; M330-F359 HydrophobicContact SD-CD1 3.99Å; M330-F359 HydrophobicContact SD-CE1 4.1Å; M330-F359 HydrophobicContact SD-CG 4.24Å; M330-F359 HydrophobicContact SD-CZ 4.44Å; M330-K425 HydrophobicContact SD-CB 4.16Å; M330-V426 HydrophobicContact CE-CG2 3.34Å; M330-V426 HydrophobicContact CG-CG2 4.38Å; M330-V426 HydrophobicContact SD-CG2 3.76Å
331	D	90.4	Very high	90.4	Very high	105 Å²	105	37 Å²	37	56%	0.561	18%	0.18	S	C	*	.	H	α-helix	trans	-62.4	-22.8	177.5	-69.1	-15.2	0	0	0	112.2	K327	K327-D331 WeakPolarHBondContact O-CB 3.3Å; K327-D331 PolarHBondContact O-N 3.41Å
332	Q	90	Very high	91	Very high	125 Å²	125	37.3 Å²	37.3	58%	0.584	18%	0.183	S	C	*	.	T	Hydrogen-bonded Turn	trans	-91.7	8.8	176.2	-67	-63.3	-46.3	0	0	113.9	L328 V329 M330 L334	L328-Q332 HydrophobicContact CD2-CG 4.47Å; L328-Q332 VanDerWaalsContact O-CG 3.22Å; L328-Q332 WeakPolarHBondContact O-CG 3.5Å; L328-Q332 PolarHBondContact O-N 2.75Å; V329-Q332 PolarHBondContact O-N 3.3Å; M330-Q332 PolarHBondContact O-N 3.11Å; M330-Q332 VanDerWaalsContact O-N 3.15Å; Q332-L334 VanDerWaalsContact C-N 3.28Å; Q332-L334 HydrophobicContact CB-CD1 3.96Å; Q332-L334 HydrophobicContact CB-CG 3.87Å; Q332-L334 PolarHBondContact O-N 2.93Å
333	N	90.9	Very high	91.3	Very high	104 Å²	104	38.6 Å²	38.6	56%	0.556	19%	0.192	S	C	*	.	T	Hydrogen-bonded Turn	trans	53	42.6	-175.8	-57.7	-54.6	0	0	0	112.6	M330 E335 R442	M330-N333 PolarHBondContact O-N 3.45Å; N333-E335 WeakPolarHBondContact CA-OE2 3.37Å; N333-R442 PolarHBondContact O-NH1 3.43Å; N333-R442 PolarHBondContact O-NH2 3.35Å
334	L	92.9	Very high	91.6	Very high	17 Å²	17	40.4 Å²	40.4	9%	0.089	20%	0.197	C	C	.	.			trans	-99.6	15.7	-177.4	-69	-179.6	0	0	0	113.2	V329 Q332 S443 T482	V329-L334 HydrophobicContact CG1-CB 3.55Å; V329-L334 HydrophobicContact CG1-CD1 4.38Å; V329-L334 WeakPolarHBondContact O-CB 3.48Å; V329-L334 PolarHBondContact O-N 3.11Å; V329-L334 VanDerWaalsContact O-N 3.14Å; Q332-L334 VanDerWaalsContact C-N 3.28Å; Q332-L334 HydrophobicContact CB-CD1 3.96Å; Q332-L334 HydrophobicContact CB-CG 3.87Å; Q332-L334 PolarHBondContact O-N 2.93Å; L334-S443 WeakPolarHBondContact CB-OG 3.18Å; L334-S443 WeakPolarHBondContact O-CB 3.24Å; L334-S443 PolarHBondContact O-OG 2.98Å; L334-T482 HydrophobicContact CD1-CG2 4.28Å
335	E	91.7	Very high	91.8	Very high	56 Å²	56	39.9 Å²	39.9	26%	0.262	20%	0.198	S	C	.	.			trans	-74.2	154	175.1	71.2	-73	165.1	0	0	113.3	M330 N333 K425 R442	M330-E335 HydrophobicContact CE-CB 3.88Å; M330-E335 HydrophobicContact SD-CB 4.07Å; N333-E335 WeakPolarHBondContact CA-OE2 3.37Å; E335-K425 HydrophobicContact CB-CB 4.29Å; E335-K425 HydrophobicContact CG-CD 4.46Å; E335-R442 WeakPolarHBondContact O-CB 3.43Å; E335-R442 WeakPolarHBondContact O-CD 3.46Å
336	P	95.5	Very high	91.9	Very high	14 Å²	14	42.8 Å²	42.8	9%	0.091	21%	0.213	C	C	.	.	S	Bend	cis	-71.7	148	-6.3	30.9	-34.2	0	0	0	111.9	F419 K425 A441 R442 S443 R474	P336-F419 HydrophobicContact CB-CE2 3.95Å; P336-F419 HydrophobicContact CB-CZ 4.23Å; P336-F419 HydrophobicContact CG-CZ 4.41Å; P336-K425 CarbonylContact C-O 3.52Å; P336-K425 VanDerWaalsContact CA-O 3.31Å; P336-K425 WeakPolarHBondContact CA-O 3.45Å; P336-A441 HydrophobicContact CG-CB 4.4Å; P336-A441 WeakPolarHBondContact O-CB 3.44Å; P336-R442 PolarHBondContact O-N 3.37Å; P336-S443 PolarHBondContact O-N 2.97Å; P336-S443 VanDerWaalsContact O-N 3.11Å; P336-R474 VanDerWaalsContact CD-CZ 3.47Å
337	L	96.7	Very high	91.9	Very high	0 Å²	0	42.8 Å²	42.8	0%	0	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112	125.3	179.5	173.2	64.5	0	0	0	110.1	V326 V329 M330 V339 K425 V426 L427 S443 L445	V326-L337 HydrophobicContact CB-CD2 4.47Å; V326-L337 HydrophobicContact CG1-CD2 4.33Å; V326-L337 HydrophobicContact CG2-CD2 3.97Å; V329-L337 HydrophobicContact CB-CD2 4.22Å; V329-L337 HydrophobicContact CG1-CB 4.31Å; V329-L337 HydrophobicContact CG1-CD1 4.17Å; V329-L337 HydrophobicContact CG1-CD2 3.97Å; V329-L337 HydrophobicContact CG1-CG 4.36Å; M330-L337 HydrophobicContact CE-CB 3.69Å; M330-L337 HydrophobicContact CE-CD2 4.27Å; L337-V339 HydrophobicContact CD2-CG2 3.79Å; L337-V339 HydrophobicContact CG-CG2 3.87Å; L337-K425 PolarHBondContact N-O 3.3Å; L337-V426 CarbonylContact O-C 3.55Å; L337-V426 WeakPolarHBondContact O-CA 3.24Å; L337-L427 PolarHBondContact O-N 2.7Å; L337-S443 WeakPolarHBondContact CA-O 3.48Å; L337-L445 HydrophobicContact CD1-CB 3.85Å
338	I	96.6	Very high	92	Very high	0 Å²	0	40.7 Å²	40.7	0%	0	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.1	126.3	165.5	-62.9	162.8	0	0	0	108.8	F340 F419 L427 A429 F433 A441 S443 V444 L445 R471	I338-F340 HydrophobicContact CG2-CD1 4.24Å; I338-F340 HydrophobicContact CG2-CD2 4.05Å; I338-F340 HydrophobicContact CG2-CE1 3.92Å; I338-F340 HydrophobicContact CG2-CE2 3.7Å; I338-F340 HydrophobicContact CG2-CG 4.3Å; I338-F340 HydrophobicContact CG2-CZ 3.61Å; I338-F419 HydrophobicContact CD1-CE1 4.4Å; I338-F419 HydrophobicContact CD1-CZ 3.97Å; I338-F419 HydrophobicContact CG1-CE2 4.16Å; I338-F419 HydrophobicContact CG1-CZ 3.73Å; I338-L427 CarbonylContact C-O 3.49Å; I338-L427 WeakPolarHBondContact CA-O 3.34Å; I338-L427 HydrophobicContact CG1-CD2 4.41Å; I338-A429 HydrophobicContact CG2-CB 4.25Å; I338-F433 HydrophobicContact CD1-CD1 4.2Å; I338-F433 HydrophobicContact CD1-CE1 3.64Å; I338-F433 HydrophobicContact CG1-CE1 4.25Å; I338-A441 HydrophobicContact CB-CB 4.43Å; I338-A441 HydrophobicContact CD1-CB 3.48Å; I338-A441 VanDerWaalsContact CD1-CB 3.48Å; I338-A441 HydrophobicContact CG1-CB 3.63Å; I338-S443 PolarHBondContact N-O 3.36Å; I338-V444 HydrophobicContact CB-CG2 4.42Å; I338-V444 CarbonylContact O-C 3.53Å; I338-V444 VanDerWaalsContact O-CA 3.31Å; I338-V444 WeakPolarHBondContact O-CA 3.32Å; I338-L445 PolarHBondContact O-N 3.01Å; I338-R471 HydrophobicContact CD1-CB 4.15Å
339	V	96.3	Very high	92.1	Very high	0 Å²	0	42.4 Å²	42.4	0%	0	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	105.4	175.1	-173.8	0	0	0	0	108.7	V326 L337 V426 L427 Y428 A429 L445 T447	V326-V339 HydrophobicContact CG2-CG2 4.29Å; L337-V339 HydrophobicContact CD2-CG2 3.79Å; L337-V339 HydrophobicContact CG-CG2 3.87Å; V339-V426 HydrophobicContact CG2-CG1 4.16Å; V339-L427 PolarHBondContact N-O 3.45Å; V339-Y428 HydrophobicContact CB-CD1 3.61Å; V339-Y428 HydrophobicContact CB-CE1 3.75Å; V339-Y428 HydrophobicContact CB-CG 4.35Å; V339-Y428 HydrophobicContact CG1-CD1 3.68Å; V339-Y428 HydrophobicContact CG1-CE1 3.6Å; V339-Y428 HydrophobicContact CG2-CD1 4.22Å; V339-Y428 HydrophobicContact CG2-CE1 3.96Å; V339-Y428 WeakPolarHBondContact O-CA 3.5Å; V339-A429 PolarHBondContact O-N 3.41Å; V339-L445 CarbonylContact C-O 3.54Å; V339-L445 WeakPolarHBondContact CA-O 3.34Å; V339-L445 HydrophobicContact CG1-CB 4.39Å; V339-L445 HydrophobicContact CG1-CD2 3.91Å; V339-L445 HydrophobicContact CG1-CG 4.12Å; V339-L445 HydrophobicContact CG2-CB 4.23Å; V339-L445 HydrophobicContact CG2-CD2 4.01Å; V339-T447 HydrophobicContact CG1-CG2 3.42Å; V339-T447 VanDerWaalsContact CG1-CG2 3.42Å
340	F	95.6	Very high	92	Very high	0 Å²	0	43.9 Å²	43.9	0%	0	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.5	124.6	177	-74.1	-64.4	0	0	0	111.7	I338 A429 F433 A434 V444 L445 F446 T447 M468 R471	I338-F340 HydrophobicContact CG2-CD1 4.24Å; I338-F340 HydrophobicContact CG2-CD2 4.05Å; I338-F340 HydrophobicContact CG2-CE1 3.92Å; I338-F340 HydrophobicContact CG2-CE2 3.7Å; I338-F340 HydrophobicContact CG2-CG 4.3Å; I338-F340 HydrophobicContact CG2-CZ 3.61Å; F340-A429 VanDerWaalsContact CA-O 3.29Å; F340-A429 WeakPolarHBondContact CA-O 3.41Å; F340-A429 HydrophobicContact CD1-CB 4.3Å; F340-A429 HydrophobicContact CE1-CB 4.24Å; F340-F433 HydrophobicContact CE1-CB 4.25Å; F340-F433 HydrophobicContact CE1-CD1 4.46Å; F340-F433 HydrophobicContact CZ-CD1 4.47Å; F340-A434 HydrophobicContact CE1-CB 3.99Å; F340-A434 HydrophobicContact CZ-CB 3.73Å; F340-V444 HydrophobicContact CD2-CG1 3.54Å; F340-V444 HydrophobicContact CE2-CG1 3.68Å; F340-V444 HydrophobicContact CE2-CG2 4.39Å; F340-L445 PolarHBondContact N-O 3.3Å; F340-F446 HydrophobicContact CB-CD1 4.45Å; F340-T447 PolarHBondContact O-N 2.87Å; F340-T447 PolarHBondContact O-OG1 3.26Å; F340-M468 HydrophobicContact CB-SD 4.33Å; F340-M468 HydrophobicContact CD1-SD 4.31Å; F340-M468 HydrophobicContact CD2-CB 3.98Å; F340-M468 HydrophobicContact CD2-CG 4.24Å; F340-M468 HydrophobicContact CD2-SD 4.28Å; F340-M468 HydrophobicContact CE2-CB 3.85Å; F340-M468 HydrophobicContact CE2-CG 4.17Å; F340-M468 HydrophobicContact CG-CG 4.46Å; F340-M468 HydrophobicContact CG-SD 4.06Å; F340-M468 HydrophobicContact CZ-CB 4.4Å; F340-M468 HydrophobicContact CZ-CG 4.32Å; F340-R471 HydrophobicContact CZ-CG 4.41Å
341	S	92.3	Very high	91.9	Very high	1 Å²	1	43.1 Å²	43.1	1%	0.007	21%	0.213	C	C	.	.			trans	-131.3	142.5	170	-162.1	0	0	0	0	110.8	S343 D346 A429 T430 T447	S341-S343 VanDerWaalsContact C-N 3.31Å; S341-S343 PolarHBondContact O-N 3.4Å; S341-D346 VanDerWaalsContact OG-CB 3.29Å; S341-D346 WeakPolarHBondContact OG-CB 3.47Å; S341-A429 PolarHBondContact N-O 2.6Å; S341-T430 WeakPolarHBondContact O-CA 3.39Å; S341-T430 WeakPolarHBondContact O-CG2 3.36Å; S341-T447 WeakPolarHBondContact CA-OG1 3.38Å; S341-T447 WeakPolarHBondContact CB-OG1 3.37Å; S341-T447 PolarHBondContact OG-OG1 3.18Å; S341-T447 VanDerWaalsContact OG-OG1 3.14Å
342	F	90	Very high	91.7	Very high	51 Å²	51	41.4 Å²	41.4	22%	0.224	20%	0.202	C	C	.	.	S	Bend	trans	-90.7	8.8	-174.3	-55	-70.2	0	0	0	113.7	E431 S448 R450 K451 L460 M468	F342-E431 HydrophobicContact CD1-CB 4.29Å; F342-E431 HydrophobicContact CE1-CB 4.17Å; F342-S448 WeakPolarHBondContact CE2-O 3.16Å; F342-R450 WeakPolarHBondContact CD2-O 3.23Å; F342-K451 HydrophobicContact CB-CB 3.89Å; F342-K451 HydrophobicContact CD1-CB 3.93Å; F342-K451 HydrophobicContact CD1-CD 4.24Å; F342-K451 HydrophobicContact CD2-CB 4Å; F342-K451 HydrophobicContact CG-CB 3.64Å; F342-L460 HydrophobicContact CE1-CD1 4.5Å; F342-L460 HydrophobicContact CE1-CD2 3.75Å; F342-L460 HydrophobicContact CE2-CD1 3.83Å; F342-L460 HydrophobicContact CE2-CD2 4.08Å; F342-L460 HydrophobicContact CE2-CG 4.3Å; F342-L460 HydrophobicContact CZ-CD1 3.49Å; F342-L460 VanDerWaalsContact CZ-CD1 3.49Å; F342-L460 HydrophobicContact CZ-CD2 3.51Å; F342-L460 HydrophobicContact CZ-CG 4.02Å; F342-M468 HydrophobicContact CE1-CE 3.91Å; F342-M468 HydrophobicContact CE1-SD 3.86Å; F342-M468 HydrophobicContact CZ-CE 3.94Å; F342-M468 HydrophobicContact CZ-SD 4.05Å
343	S	89.1	Confident	91.5	Very high	29 Å²	29	38.2 Å²	38.2	20%	0.203	19%	0.187	C	C	.	.			trans	-127.8	128.4	179.4	160.6	0	0	0	0	109.5	S341 M345 D346 C347	S341-S343 VanDerWaalsContact C-N 3.31Å; S341-S343 PolarHBondContact O-N 3.4Å; S343-M345 PolarHBondContact O-N 2.95Å; S343-M345 PolarHBondContact OG-N 3.06Å; S343-D346 WeakPolarHBondContact CB-OD1 3.49Å; S343-D346 PolarHBondContact O-N 3.34Å; S343-D346 VanDerWaalsContact O-N 3.13Å; S343-D346 VanDerWaalsContact OG-CG 3.29Å; S343-D346 PolarHBondContact OG-N 3.26Å; S343-D346 PolarHBondContact OG-OD1 2.84Å; S343-C347 PolarHBondContact O-N 3.45Å; S343-C347 VanDerWaalsContact O-N 3.14Å
344	K	90.2	Very high	91.2	Very high	56 Å²	56	33.3 Å²	33.3	24%	0.243	16%	0.161	C	C	.	.	H	α-helix	trans	-56.4	-42.9	174.9	-57.4	-179.7	-174.7	176.1	0	110.7	D346 C347 E348 H404 F998 S1001	K344-D346 VanDerWaalsContact C-N 3.32Å; K344-D346 PolarHBondContact O-N 3.45Å; K344-C347 PolarHBondContact O-N 3.04Å; K344-E348 PolarHBondContact O-N 3.36Å; K344-H404 HydrophobicContact CB-CB 4.43Å; K344-H404 HydrophobicContact CG-CB 4.09Å; K344-F998 HydrophobicContact CB-CE2 4.07Å; K344-F998 HydrophobicContact CB-CZ 3.95Å; K344-F998 HydrophobicContact CD-CD2 3.99Å; K344-F998 HydrophobicContact CD-CE2 4Å; K344-S1001 PolarHBondContact NZ-OG 3.22Å
345	M	89.1	Confident	90.5	Very high	105 Å²	105	35.6 Å²	35.6	52%	0.517	17%	0.173	S	C	.	.	H	α-helix	trans	-65	-35.7	178.7	-64.5	-177.3	-65.2	0	0	112.1	S343 F349 F998	S343-M345 PolarHBondContact O-N 2.95Å; S343-M345 PolarHBondContact OG-N 3.06Å; M345-F349 VanDerWaalsContact O-CB 3.27Å; M345-F349 WeakPolarHBondContact O-CB 3.48Å; M345-F349 PolarHBondContact O-N 3.37Å; M345-F998 HydrophobicContact CG-CZ 3.93Å
346	D	90.4	Very high	89.9	Confident	63 Å²	63	42.8 Å²	42.8	34%	0.337	20%	0.204	S	C	.	.	H	α-helix	trans	-71.1	-40	-178.6	-67.3	20.1	0	0	0	110.6	S341 S343 K344 E348 F349 Y350	S341-D346 VanDerWaalsContact OG-CB 3.29Å; S341-D346 WeakPolarHBondContact OG-CB 3.47Å; S343-D346 WeakPolarHBondContact CB-OD1 3.49Å; S343-D346 PolarHBondContact O-N 3.34Å; S343-D346 VanDerWaalsContact O-N 3.13Å; S343-D346 VanDerWaalsContact OG-CG 3.29Å; S343-D346 PolarHBondContact OG-N 3.26Å; S343-D346 PolarHBondContact OG-OD1 2.84Å; K344-D346 VanDerWaalsContact C-N 3.32Å; K344-D346 PolarHBondContact O-N 3.45Å; D346-E348 PolarHBondContact O-N 2.95Å; D346-F349 PolarHBondContact O-N 2.7Å; D346-Y350 HydrophobicContact CB-CD2 4.25Å; D346-Y350 HydrophobicContact CB-CE2 3.87Å; D346-Y350 WeakPolarHBondContact O-CD2 3.45Å; D346-Y350 PolarHBondContact O-N 2.96Å
347	C	91.9	Very high	89.6	Confident	0 Å²	0	44.3 Å²	44.3	0%	0	21%	0.21	C	C	.	.	H	α-helix	trans	-55.4	-50.2	173.9	-70.1	0	0	0	0	111.8	S343 K344 A351 I402	S343-C347 PolarHBondContact O-N 3.45Å; S343-C347 VanDerWaalsContact O-N 3.14Å; K344-C347 PolarHBondContact O-N 3.04Å; C347-A351 WeakPolarHBondContact O-CB 3.38Å; C347-A351 PolarHBondContact O-N 2.93Å; C347-I402 HydrophobicContact CB-CG2 4.31Å
348	E	90.9	Very high	89.4	Confident	63 Å²	63	48 Å²	48	29%	0.294	23%	0.23	S	C	.	.	H	α-helix	trans	-64.2	-43.6	177.3	-67.9	-179.5	-170.2	0	0	111.6	K344 D346 Y350 A351 M352 I402 H404	K344-E348 PolarHBondContact O-N 3.36Å; D346-E348 PolarHBondContact O-N 2.95Å; E348-Y350 PolarHBondContact O-N 2.78Å; E348-A351 PolarHBondContact O-N 3.34Å; E348-M352 VanDerWaalsContact O-CG 3.27Å; E348-M352 WeakPolarHBondContact O-CG 3.42Å; E348-M352 PolarHBondContact O-N 3.43Å; E348-I402 HydrophobicContact CG-CD1 4.48Å; E348-I402 HydrophobicContact CG-CG2 4.27Å; E348-H404 IonicContact OE1-CE1 2.84Å; E348-H404 PolarHBondContact OE1-CE1 3.34Å; E348-H404 VanDerWaalsContact OE1-CE1 3.29Å; E348-H404 IonicContact OE1-NE2 3.52Å; E348-H404 PolarHBondContact OE1-NE2 2.7Å
349	F	90	Very high	89.1	Confident	85 Å²	85	50.2 Å²	50.2	37%	0.373	24%	0.24	S	C	.	.	H	α-helix	trans	-60	-47.3	179.7	175.8	-103.8	0	0	0	112.6	P318 M345 D346 M352 Q353	P318-F349 HydrophobicContact CB-CE1 4.11Å; P318-F349 HydrophobicContact CG-CE1 3.82Å; P318-F349 HydrophobicContact CG-CZ 4.08Å; M345-F349 VanDerWaalsContact O-CB 3.27Å; M345-F349 WeakPolarHBondContact O-CB 3.48Å; M345-F349 PolarHBondContact O-N 3.37Å; D346-F349 PolarHBondContact O-N 2.7Å; F349-M352 PolarHBondContact O-N 2.81Å; F349-Q353 HydrophobicContact CE1-CG 4.45Å; F349-Q353 HydrophobicContact CZ-CG 4.49Å; F349-Q353 WeakPolarHBondContact O-CG 3.46Å; F349-Q353 PolarHBondContact O-N 3.25Å
350	Y	89.9	Confident	89	Confident	32 Å²	32	50.8 Å²	50.8	13%	0.125	24%	0.244	C	C	.	.	H	α-helix	trans	-67.4	-39.4	179.8	-67.1	-53.7	0	0	0	112.4	C322 D346 E348 M352 Q353 Y428 T447	C322-Y350 HydrophobicContact CB-CD1 3.77Å; C322-Y350 HydrophobicContact CB-CE1 3.92Å; C322-Y350 HydrophobicContact CB-CG 4.43Å; D346-Y350 HydrophobicContact CB-CD2 4.25Å; D346-Y350 HydrophobicContact CB-CE2 3.87Å; D346-Y350 WeakPolarHBondContact O-CD2 3.45Å; D346-Y350 PolarHBondContact O-N 2.96Å; E348-Y350 PolarHBondContact O-N 2.78Å; Y350-M352 VanDerWaalsContact C-N 3.3Å; Y350-M352 PolarHBondContact O-N 2.95Å; Y350-Q353 WeakPolarHBondContact O-CB 2.99Å; Y350-Q353 PolarHBondContact O-N 3.32Å; Y350-Q353 VanDerWaalsContact O-N 3.16Å; Y350-Y428 HydrophobicContact CD2-CE1 4.42Å; Y350-Y428 HydrophobicContact CG-CE1 4.11Å; Y350-T447 HydrophobicContact CD2-CG2 4.29Å; Y350-T447 HydrophobicContact CE2-CG2 3.97Å
351	A	89.7	Confident	88.9	Confident	0 Å²	0	54.2 Å²	54.2	0%	0	27%	0.265	C	S	.	.	H	α-helix	trans	-59.5	-41.9	174.8	0	0	0	0	0	111.6	C347 E348 Q353 L354 I400 I402 Y428	C347-A351 WeakPolarHBondContact O-CB 3.38Å; C347-A351 PolarHBondContact O-N 2.93Å; E348-A351 PolarHBondContact O-N 3.34Å; A351-Q353 VanDerWaalsContact C-N 3.31Å; A351-Q353 PolarHBondContact O-N 2.72Å; A351-L354 PolarHBondContact O-N 2.81Å; A351-I400 HydrophobicContact CB-CG2 4.21Å; A351-I402 HydrophobicContact CB-CD1 3.62Å; A351-I402 HydrophobicContact CB-CG1 3.57Å; A351-Y428 HydrophobicContact CB-CD2 3.75Å; A351-Y428 HydrophobicContact CB-CE2 4.1Å; A351-Y428 HydrophobicContact CB-CG 4.41Å
352	M	86.8	Confident	89	Confident	68 Å²	68	60.4 Å²	60.4	34%	0.335	29%	0.294	S	S	.	.	H	α-helix	trans	-67	-27.3	177.3	-68.4	-62.1	161	0	0	113.7	E348 F349 Y350 L354 N355 I391 V395	E348-M352 VanDerWaalsContact O-CG 3.27Å; E348-M352 WeakPolarHBondContact O-CG 3.42Å; E348-M352 PolarHBondContact O-N 3.43Å; F349-M352 PolarHBondContact O-N 2.81Å; Y350-M352 VanDerWaalsContact C-N 3.3Å; Y350-M352 PolarHBondContact O-N 2.95Å; M352-L354 PolarHBondContact O-N 2.69Å; M352-N355 VanDerWaalsContact O-CB 3.29Å; M352-N355 WeakPolarHBondContact O-CB 3.41Å; M352-N355 PolarHBondContact O-N 2.8Å; M352-N355 PolarHBondContact O-ND2 2.81Å; M352-I391 HydrophobicContact CE-CG2 3.19Å; M352-V395 HydrophobicContact CE-CG2 4.04Å
353	Q	85.8	Confident	89.3	Confident	58 Å²	58	62.2 Å²	62.2	27%	0.271	31%	0.313	S	S	.	.	H	α-helix	trans	-67	-27.1	175.3	-70.9	-170.1	-8	0	0	112.8	F349 Y350 A351 N355	F349-Q353 HydrophobicContact CE1-CG 4.45Å; F349-Q353 HydrophobicContact CZ-CG 4.49Å; F349-Q353 WeakPolarHBondContact O-CG 3.46Å; F349-Q353 PolarHBondContact O-N 3.25Å; Y350-Q353 WeakPolarHBondContact O-CB 2.99Å; Y350-Q353 PolarHBondContact O-N 3.32Å; Y350-Q353 VanDerWaalsContact O-N 3.16Å; A351-Q353 VanDerWaalsContact C-N 3.31Å; A351-Q353 PolarHBondContact O-N 2.72Å; Q353-N355 PolarHBondContact O-N 3.48Å
354	L	84.2	Confident	89.6	Confident	1 Å²	1	62.7 Å²	62.7	1%	0.005	31%	0.311	C	S	.	.	T	Hydrogen-bonded Turn	trans	-81.6	9.8	177.9	-66.4	-175.7	0	0	0	113.6	V326 A351 M352 K356 M357 F359 I400 V426 Y428	V326-L354 HydrophobicContact CB-CD1 4.37Å; V326-L354 HydrophobicContact CB-CD2 4.4Å; V326-L354 HydrophobicContact CG1-CD1 3.79Å; V326-L354 HydrophobicContact CG1-CD2 4.36Å; A351-L354 PolarHBondContact O-N 2.81Å; M352-L354 PolarHBondContact O-N 2.69Å; L354-K356 PolarHBondContact O-N 3.2Å; L354-M357 HydrophobicContact CD2-CE 4.09Å; L354-M357 HydrophobicContact CD2-SD 3.77Å; L354-M357 PolarHBondContact O-N 2.93Å; L354-F359 HydrophobicContact CD1-CE2 4.42Å; L354-I400 HydrophobicContact CB-CD1 3.61Å; L354-I400 HydrophobicContact CD1-CD1 4.15Å; L354-V426 HydrophobicContact CD1-CG1 4.28Å; L354-Y428 HydrophobicContact CD1-CE2 3.82Å; L354-Y428 VanDerWaalsContact CD1-OH 3.24Å; L354-Y428 WeakPolarHBondContact CD1-OH 3.32Å
355	N	76.9	Confident	89.9	Confident	66 Å²	66	61 Å²	61	35%	0.353	30%	0.304	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56	-13.1	-178.2	-85.6	-23.4	0	0	0	115.7	M352 Q353 R398	M352-N355 VanDerWaalsContact O-CB 3.29Å; M352-N355 WeakPolarHBondContact O-CB 3.41Å; M352-N355 PolarHBondContact O-N 2.8Å; M352-N355 PolarHBondContact O-ND2 2.81Å; Q353-N355 PolarHBondContact O-N 3.48Å; N355-R398 VanDerWaalsContact CA-NH1 3.31Å; N355-R398 VanDerWaalsContact O-CZ 3.28Å; N355-R398 PolarHBondContact O-NH1 2.84Å; N355-R398 PolarHBondContact OD1-NH1 3.17Å
356	K	80.9	Confident	90.2	Very high	206 Å²	206	58.8 Å²	58.8	90%	0.896	30%	0.303	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.7	-7.9	177.4	-62.6	-176.4	179.1	-177.6	0	114.1	L354	L354-K356 PolarHBondContact O-N 3.2Å
357	M	87.3	Confident	90.4	Very high	46 Å²	46	57.1 Å²	57.1	23%	0.227	30%	0.298	C	S	.	.			trans	-106.1	143.4	-178.7	-57.9	-173.5	-165.5	0	0	109.5	K327 L354 F359	K327-M357 HydrophobicContact CB-CE 3.88Å; K327-M357 HydrophobicContact CB-SD 4.02Å; K327-M357 HydrophobicContact CD-CE 4.08Å; K327-M357 HydrophobicContact CG-CE 4.31Å; K327-M357 HydrophobicContact CG-SD 4.35Å; L354-M357 HydrophobicContact CD2-CE 4.09Å; L354-M357 HydrophobicContact CD2-SD 3.77Å; L354-M357 PolarHBondContact O-N 2.93Å; M357-F359 HydrophobicContact CB-CE1 4.13Å; M357-F359 HydrophobicContact CB-CE2 3.96Å; M357-F359 HydrophobicContact CB-CZ 3.59Å; M357-F359 HydrophobicContact CG-CZ 4.31Å; M357-F359 HydrophobicContact SD-CE1 4.44Å; M357-F359 HydrophobicContact SD-CZ 3.83Å
358	D	92.5	Very high	90.6	Very high	79 Å²	79	57.1 Å²	57.1	42%	0.422	30%	0.298	S	S	.	.			trans	-134	116.7	179.1	-170.7	-3.7	0	0	0	107.9	S360 K365 R398	D358-S360 PolarHBondContact OD1-N 2.77Å; D358-K365 WeakPolarHBondContact OD1-CE 3.29Å; D358-K365 IonicContact OD1-NZ 3.84Å; D358-K365 WeakPolarHBondContact OD2-CE 3.36Å; D358-K365 IonicContact OD2-NZ 2.64Å; D358-K365 PolarHBondContact OD2-NZ 3.05Å; D358-R398 WeakPolarHBondContact OD1-CA 3.34Å
359	F	92.1	Very high	90.8	Very high	46 Å²	46	56.5 Å²	56.5	20%	0.202	30%	0.295	C	S	.	.			trans	-107.5	6.1	-175.9	-52.1	-66.5	0	0	0	112.4	V326 M330 L354 M357 R398 I400 K425 V426	V326-F359 HydrophobicContact CG1-CZ 4.4Å; M330-F359 HydrophobicContact CB-CD1 4.24Å; M330-F359 HydrophobicContact CB-CE1 3.8Å; M330-F359 HydrophobicContact CG-CD1 3.95Å; M330-F359 HydrophobicContact CG-CE1 3.48Å; M330-F359 VanDerWaalsContact CG-CE1 3.48Å; M330-F359 HydrophobicContact CG-CZ 3.8Å; M330-F359 HydrophobicContact SD-CD1 3.99Å; M330-F359 HydrophobicContact SD-CE1 4.1Å; M330-F359 HydrophobicContact SD-CG 4.24Å; M330-F359 HydrophobicContact SD-CZ 4.44Å; L354-F359 HydrophobicContact CD1-CE2 4.42Å; M357-F359 HydrophobicContact CB-CE1 4.13Å; M357-F359 HydrophobicContact CB-CE2 3.96Å; M357-F359 HydrophobicContact CB-CZ 3.59Å; M357-F359 HydrophobicContact CG-CZ 4.31Å; M357-F359 HydrophobicContact SD-CE1 4.44Å; M357-F359 HydrophobicContact SD-CZ 3.83Å; F359-R398 PolarHBondContact N-O 3.11Å; F359-I400 HydrophobicContact CD2-CD1 4.4Å; F359-I400 HydrophobicContact CD2-CG1 4Å; F359-I400 HydrophobicContact CE2-CD1 4.19Å; F359-I400 HydrophobicContact CE2-CG1 4.09Å; F359-K425 HydrophobicContact CB-CB 3.99Å; F359-K425 HydrophobicContact CB-CG 3.79Å; F359-V426 HydrophobicContact CD2-CG2 4.17Å; F359-V426 HydrophobicContact CE2-CG2 3.94Å
360	S	92.9	Very high	91	Very high	12 Å²	12	57.4 Å²	57.4	8%	0.084	30%	0.303	C	S	.	.			trans	-110.6	138.7	-176.9	-67.1	0	0	0	0	111.7	D358 E364 K365 R397 G399	D358-S360 PolarHBondContact OD1-N 2.77Å; S360-E364 WeakPolarHBondContact CA-OE2 3.35Å; S360-K365 WeakPolarHBondContact O-CE 3.38Å; S360-R397 WeakPolarHBondContact CB-O 3.47Å; S360-G399 VanDerWaalsContact OG-CA 3.23Å; S360-G399 WeakPolarHBondContact OG-CA 3.29Å; S360-G399 PolarHBondContact OG-N 3.36Å
361	T	94.2	Very high	91.1	Very high	72 Å²	72	58.2 Å²	58.2	44%	0.442	31%	0.311	S	S	.	.			trans	-71.2	159.7	166.5	60	0	0	0	0	110.8	S363 E364 K365	T361-S363 PolarHBondContact O-N 3.3Å; T361-S363 PolarHBondContact OG1-OG 3.36Å; T361-E364 PolarHBondContact N-OE2 2.95Å; T361-E364 PolarHBondContact O-N 3.14Å; T361-E364 WeakPolarHBondContact OG1-CB 3.24Å; T361-E364 VanDerWaalsContact OG1-CD 3.3Å; T361-E364 WeakPolarHBondContact OG1-CG 3.27Å; T361-E364 PolarHBondContact OG1-N 2.72Å; T361-E364 PolarHBondContact OG1-OE2 3.03Å; T361-K365 WeakPolarHBondContact O-CG 3.33Å; T361-K365 PolarHBondContact O-N 2.82Å
362	E	94.6	Very high	91.4	Very high	131 Å²	131	58.5 Å²	58.5	61%	0.612	31%	0.312	S	S	*	.	H	α-helix	trans	-59.9	-32	176.4	-65.3	-55.3	127.4	0	0	112.8	K365 A366	E362-K365 PolarHBondContact O-N 2.69Å; E362-K365 IonicContact OE1-NZ 2.72Å; E362-K365 PolarHBondContact OE1-NZ 3.05Å; E362-A366 PolarHBondContact O-N 3.18Å; E362-A366 VanDerWaalsContact O-N 3.1Å
363	S	95	Very high	91.7	Very high	89 Å²	89	59.3 Å²	59.3	62%	0.622	32%	0.318	S	S	*	.	H	α-helix	trans	-67.1	-41	172.7	46.5	0	0	0	0	112.8	T361 A366 A367	T361-S363 PolarHBondContact O-N 3.3Å; T361-S363 PolarHBondContact OG1-OG 3.36Å; S363-A366 PolarHBondContact O-N 3.16Å; S363-A367 PolarHBondContact O-N 2.63Å
364	E	95.5	Very high	92	Very high	38 Å²	38	61 Å²	61	18%	0.178	33%	0.329	C	S	.	.	H	α-helix	trans	-67.6	-39.1	176.3	-72.2	167.4	138.8	0	0	110.8	S360 T361 A366 A367 I368 F423 K425	S360-E364 WeakPolarHBondContact CA-OE2 3.35Å; T361-E364 PolarHBondContact N-OE2 2.95Å; T361-E364 PolarHBondContact O-N 3.14Å; T361-E364 WeakPolarHBondContact OG1-CB 3.24Å; T361-E364 VanDerWaalsContact OG1-CD 3.3Å; T361-E364 WeakPolarHBondContact OG1-CG 3.27Å; T361-E364 PolarHBondContact OG1-N 2.72Å; T361-E364 PolarHBondContact OG1-OE2 3.03Å; E364-A366 PolarHBondContact O-N 2.98Å; E364-A367 PolarHBondContact O-N 3.35Å; E364-I368 WeakPolarHBondContact O-CB 3.36Å; E364-I368 WeakPolarHBondContact O-CD1 3.48Å; E364-I368 WeakPolarHBondContact O-CG1 3.36Å; E364-I368 PolarHBondContact O-N 2.92Å; E364-F423 HydrophobicContact CB-CD1 4.1Å; E364-F423 HydrophobicContact CG-CD1 3.99Å; E364-F423 HydrophobicContact CG-CE1 4.25Å; E364-K425 WeakPolarHBondContact OE1-CE 3.42Å; E364-K425 IonicContact OE1-NZ 3.91Å; E364-K425 PolarHBondContact OE1-NZ 3.11Å
365	K	96.3	Very high	92.3	Very high	21 Å²	21	61.6 Å²	61.6	9%	0.091	33%	0.334	C	S	.	.	H	α-helix	trans	-57	-49.8	174.1	-73.1	173.2	-170.2	175	0	111.9	D358 S360 T361 E362 A367 I368 E369 R397	D358-K365 WeakPolarHBondContact OD1-CE 3.29Å; D358-K365 IonicContact OD1-NZ 3.84Å; D358-K365 WeakPolarHBondContact OD2-CE 3.36Å; D358-K365 IonicContact OD2-NZ 2.64Å; D358-K365 PolarHBondContact OD2-NZ 3.05Å; S360-K365 WeakPolarHBondContact O-CE 3.38Å; T361-K365 WeakPolarHBondContact O-CG 3.33Å; T361-K365 PolarHBondContact O-N 2.82Å; E362-K365 PolarHBondContact O-N 2.69Å; E362-K365 IonicContact OE1-NZ 2.72Å; E362-K365 PolarHBondContact OE1-NZ 3.05Å; K365-A367 VanDerWaalsContact C-N 3.31Å; K365-A367 PolarHBondContact O-N 3.26Å; K365-I368 PolarHBondContact O-N 3.21Å; K365-E369 WeakPolarHBondContact O-CG 3.01Å; K365-E369 PolarHBondContact O-N 3.14Å; K365-R397 WeakPolarHBondContact CG-O 3.48Å
366	A	95.8	Very high	93	Very high	59 Å²	59	58.9 Å²	58.9	49%	0.488	32%	0.319	S	S	.	.	H	α-helix	trans	-61.3	-39.8	177.9	0	0	0	0	0	112.2	E362 S363 E364 L370	E362-A366 PolarHBondContact O-N 3.18Å; E362-A366 VanDerWaalsContact O-N 3.1Å; S363-A366 PolarHBondContact O-N 3.16Å; E364-A366 PolarHBondContact O-N 2.98Å; A366-L370 WeakPolarHBondContact O-CB 3.33Å; A366-L370 PolarHBondContact O-N 3.42Å
367	A	95.1	Very high	93.4	Very high	28 Å²	28	55.1 Å²	55.1	23%	0.231	31%	0.305	C	S	.	.	H	α-helix	trans	-67	-43.4	176.3	0	0	0	0	0	112.5	S363 E364 K365 E369 L370 V371 F423	S363-A367 PolarHBondContact O-N 2.63Å; E364-A367 PolarHBondContact O-N 3.35Å; K365-A367 VanDerWaalsContact C-N 3.31Å; K365-A367 PolarHBondContact O-N 3.26Å; A367-E369 VanDerWaalsContact C-N 3.34Å; A367-E369 PolarHBondContact O-N 3.13Å; A367-L370 PolarHBondContact O-N 3.13Å; A367-V371 WeakPolarHBondContact O-CG2 3.24Å; A367-V371 PolarHBondContact O-N 3.34Å; A367-F423 HydrophobicContact CB-CD1 4.47Å; A367-F423 HydrophobicContact CB-CE1 3.67Å; A367-F423 HydrophobicContact CB-CE2 4.41Å; A367-F423 HydrophobicContact CB-CZ 3.63Å
368	I	95.5	Very high	93.3	Very high	0 Å²	0	56.5 Å²	56.5	0%	0	32%	0.319	C	S	.	.	H	α-helix	trans	-59.9	-46.2	175.8	-69.5	162.6	0	0	0	110.2	E364 K365 L370 V371 F372 L396 L418 F423	E364-I368 WeakPolarHBondContact O-CB 3.36Å; E364-I368 WeakPolarHBondContact O-CD1 3.48Å; E364-I368 WeakPolarHBondContact O-CG1 3.36Å; E364-I368 PolarHBondContact O-N 2.92Å; K365-I368 PolarHBondContact O-N 3.21Å; I368-L370 VanDerWaalsContact C-N 3.34Å; I368-L370 PolarHBondContact O-N 2.9Å; I368-V371 PolarHBondContact O-N 3.48Å; I368-F372 WeakPolarHBondContact O-CB 3.44Å; I368-F372 PolarHBondContact O-N 3.03Å; I368-L396 WeakPolarHBondContact CD1-O 3.36Å; I368-L396 HydrophobicContact CG2-CB 3.87Å; I368-L418 HydrophobicContact CG1-CD2 4.22Å; I368-L418 HydrophobicContact CG2-CD1 4.08Å; I368-F423 HydrophobicContact CD1-CB 3.95Å; I368-F423 HydrophobicContact CG1-CB 3.71Å; I368-F423 HydrophobicContact CG1-CD1 4.28Å; I368-F423 HydrophobicContact CG1-CG 3.97Å
369	E	95.3	Very high	93.1	Very high	49 Å²	49	53 Å²	53	23%	0.229	30%	0.3	C	S	.	.	H	α-helix	trans	-60.9	-42.4	176.1	-78.2	169.5	-111.5	0	0	112.2	K365 A367 N373 L393 R397	K365-E369 WeakPolarHBondContact O-CG 3.01Å; K365-E369 PolarHBondContact O-N 3.14Å; A367-E369 VanDerWaalsContact C-N 3.34Å; A367-E369 PolarHBondContact O-N 3.13Å; E369-N373 WeakPolarHBondContact O-CB 3.4Å; E369-N373 PolarHBondContact O-N 3.41Å; E369-N373 PolarHBondContact O-ND2 3.38Å; E369-N373 VanDerWaalsContact O-ND2 3.08Å; E369-L393 HydrophobicContact CG-CD1 4.29Å; E369-R397 HydrophobicContact CG-CG 4.1Å; E369-R397 IonicContact OE1-CZ 2.7Å; E369-R397 IonicContact OE1-NE 3.26Å; E369-R397 PolarHBondContact OE1-NE 2.87Å; E369-R397 IonicContact OE1-NH1 2.82Å; E369-R397 PolarHBondContact OE1-NH1 2.92Å; E369-R397 IonicContact OE1-NH2 2.85Å; E369-R397 PolarHBondContact OE1-NH2 2.91Å; E369-R397 IonicContact OE2-CZ 3.59Å; E369-R397 IonicContact OE2-NH1 2.82Å; E369-R397 PolarHBondContact OE2-NH1 3.42Å
370	L	94.5	Very high	92.9	Very high	105 Å²	105	53.3 Å²	53.3	55%	0.55	31%	0.308	S	S	.	.	H	α-helix	trans	-61.7	-51	177.8	-177.2	66.5	0	0	0	111.2	A366 A367 I368 F372 N373 N374	A366-L370 WeakPolarHBondContact O-CB 3.33Å; A366-L370 PolarHBondContact O-N 3.42Å; A367-L370 PolarHBondContact O-N 3.13Å; I368-L370 VanDerWaalsContact C-N 3.34Å; I368-L370 PolarHBondContact O-N 2.9Å; L370-F372 PolarHBondContact O-N 2.75Å; L370-N373 PolarHBondContact O-N 3.38Å; L370-N374 WeakPolarHBondContact O-CB 3.49Å; L370-N374 PolarHBondContact O-N 2.65Å; L370-N374 PolarHBondContact O-ND2 2.71Å; L370-N374 PolarHBondContact O-OD1 2.99Å
371	V	93	Very high	92.7	Very high	49 Å²	49	57.5 Å²	57.5	30%	0.297	33%	0.333	S	S	.	.	H	α-helix	trans	-62.5	-44.3	179.3	174.2	0	0	0	0	111	A367 I368 A375 V417 L418	A367-V371 WeakPolarHBondContact O-CG2 3.24Å; A367-V371 PolarHBondContact O-N 3.34Å; I368-V371 PolarHBondContact O-N 3.48Å; V371-A375 WeakPolarHBondContact O-CB 3.39Å; V371-A375 PolarHBondContact O-N 2.87Å; V371-A375 VanDerWaalsContact O-N 3.08Å; V371-V417 HydrophobicContact CG1-CG1 4.46Å; V371-L418 HydrophobicContact CB-CD2 4Å; V371-L418 HydrophobicContact CG1-CD2 3.88Å; V371-L418 HydrophobicContact CG1-CG 4.47Å; V371-L418 HydrophobicContact CG2-CD2 4.44Å
372	F	94.5	Very high	92.5	Very high	6 Å²	6	58.8 Å²	58.8	3%	0.026	34%	0.337	C	S	.	.	H	α-helix	trans	-63.7	-49.7	179.1	-174.4	-86.9	0	0	0	111.6	I368 L370 N374 A375 I376 V389 L393 L396 L411 I414	I368-F372 WeakPolarHBondContact O-CB 3.44Å; I368-F372 PolarHBondContact O-N 3.03Å; L370-F372 PolarHBondContact O-N 2.75Å; F372-N374 PolarHBondContact O-N 3.28Å; F372-A375 PolarHBondContact O-N 3.18Å; F372-I376 HydrophobicContact CD1-CG1 3.92Å; F372-I376 HydrophobicContact CE1-CB 4.45Å; F372-I376 HydrophobicContact CE1-CG1 3.65Å; F372-I376 HydrophobicContact CE2-CG1 4.31Å; F372-I376 HydrophobicContact CG-CG1 4.36Å; F372-I376 HydrophobicContact CZ-CD1 4.32Å; F372-I376 HydrophobicContact CZ-CG1 3.87Å; F372-I376 WeakPolarHBondContact O-CB 3.23Å; F372-I376 WeakPolarHBondContact O-CG1 3.4Å; F372-I376 PolarHBondContact O-N 3.48Å; F372-V389 HydrophobicContact CE1-CG1 4.21Å; F372-V389 HydrophobicContact CZ-CG1 3.85Å; F372-L393 HydrophobicContact CB-CD1 4.09Å; F372-L393 HydrophobicContact CD1-CB 4.2Å; F372-L393 HydrophobicContact CD1-CD1 3.76Å; F372-L393 HydrophobicContact CD1-CD2 4.07Å; F372-L393 HydrophobicContact CD1-CG 4.22Å; F372-L393 HydrophobicContact CD2-CD1 4.29Å; F372-L393 HydrophobicContact CE1-CB 3.77Å; F372-L393 HydrophobicContact CE1-CD1 4.23Å; F372-L393 HydrophobicContact CE1-CD2 4.05Å; F372-L393 HydrophobicContact CE1-CG 4.23Å; F372-L393 HydrophobicContact CE2-CB 4.22Å; F372-L393 HydrophobicContact CG-CD1 3.79Å; F372-L393 HydrophobicContact CZ-CB 3.79Å; F372-L396 HydrophobicContact CD2-CD1 3.62Å; F372-L396 HydrophobicContact CE2-CD1 3.84Å; F372-L411 HydrophobicContact CE2-CD2 4.17Å; F372-L411 HydrophobicContact CZ-CD2 4.43Å; F372-I414 HydrophobicContact CD2-CD1 4.27Å; F372-I414 HydrophobicContact CD2-CG2 4.04Å; F372-I414 HydrophobicContact CE2-CD1 4.48Å
373	N	93.5	Very high	92.2	Very high	85 Å²	85	53 Å²	53	46%	0.455	31%	0.31	S	S	.	.	H	α-helix	trans	-63.8	-41.7	-178.7	-71.2	-27.9	0	0	0	111.3	E369 L370 A375 I376 E377	E369-N373 WeakPolarHBondContact O-CB 3.4Å; E369-N373 PolarHBondContact O-N 3.41Å; E369-N373 PolarHBondContact O-ND2 3.38Å; E369-N373 VanDerWaalsContact O-ND2 3.08Å; L370-N373 PolarHBondContact O-N 3.38Å; N373-A375 PolarHBondContact O-N 2.95Å; N373-I376 PolarHBondContact O-N 2.9Å; N373-E377 WeakPolarHBondContact O-CB 3.39Å; N373-E377 PolarHBondContact O-N 2.69Å
374	N	91.8	Very high	92.1	Very high	94 Å²	94	52.7 Å²	52.7	50%	0.503	30%	0.295	S	S	.	.	H	α-helix	trans	-61.4	-43.5	176.4	-69.5	-8.3	0	0	0	111.9	L370 F372 E377	L370-N374 WeakPolarHBondContact O-CB 3.49Å; L370-N374 PolarHBondContact O-N 2.65Å; L370-N374 PolarHBondContact O-ND2 2.71Å; L370-N374 PolarHBondContact O-OD1 2.99Å; F372-N374 PolarHBondContact O-N 3.28Å; N374-E377 WeakPolarHBondContact O-CB 3.31Å; N374-E377 PolarHBondContact O-N 3.41Å
375	A	90.7	Very high	91.9	Very high	12 Å²	12	55.6 Å²	55.6	10%	0.099	31%	0.312	C	S	.	.	H	α-helix	trans	-67	-43.7	178.8	0	0	0	0	0	111.7	V371 F372 N373 E377 S378 I410 I414 L1049	V371-A375 WeakPolarHBondContact O-CB 3.39Å; V371-A375 PolarHBondContact O-N 2.87Å; V371-A375 VanDerWaalsContact O-N 3.08Å; F372-A375 PolarHBondContact O-N 3.18Å; N373-A375 PolarHBondContact O-N 2.95Å; A375-E377 VanDerWaalsContact C-N 3.26Å; A375-E377 PolarHBondContact O-N 3.15Å; A375-S378 PolarHBondContact O-N 3.03Å; A375-S378 PolarHBondContact O-OG 2.99Å; A375-I410 WeakPolarHBondContact O-CD1 3.47Å; A375-I414 HydrophobicContact CB-CD1 3.55Å; A375-I414 HydrophobicContact CB-CG1 3.64Å; A375-L1049 HydrophobicContact CB-CD1 3.96Å; A375-L1049 HydrophobicContact CB-CD2 4.05Å
376	I	91.4	Very high	91.6	Very high	10 Å²	10	54.7 Å²	54.7	5%	0.051	31%	0.308	C	S	.	.	H	α-helix	trans	-74.2	-16.9	-178.9	-65.1	-63.5	0	0	0	112.4	F372 N373 S378 L379 R384 V389 L411 I414	F372-I376 HydrophobicContact CD1-CG1 3.92Å; F372-I376 HydrophobicContact CE1-CB 4.45Å; F372-I376 HydrophobicContact CE1-CG1 3.65Å; F372-I376 HydrophobicContact CE2-CG1 4.31Å; F372-I376 HydrophobicContact CG-CG1 4.36Å; F372-I376 HydrophobicContact CZ-CD1 4.32Å; F372-I376 HydrophobicContact CZ-CG1 3.87Å; F372-I376 WeakPolarHBondContact O-CB 3.23Å; F372-I376 WeakPolarHBondContact O-CG1 3.4Å; F372-I376 PolarHBondContact O-N 3.48Å; N373-I376 PolarHBondContact O-N 2.9Å; I376-S378 PolarHBondContact O-N 2.97Å; I376-L379 HydrophobicContact CD1-CD1 3.68Å; I376-L379 HydrophobicContact CG2-CD1 4.4Å; I376-L379 WeakPolarHBondContact O-CB 3.42Å; I376-L379 PolarHBondContact O-N 3.27Å; I376-R384 HydrophobicContact CG2-CB 4.29Å; I376-R384 HydrophobicContact CG2-CG 3.63Å; I376-R384 PolarHBondContact O-NE 2.77Å; I376-V389 HydrophobicContact CD1-CG1 4.15Å; I376-V389 HydrophobicContact CG1-CG1 4.49Å; I376-V389 HydrophobicContact CG2-CG1 4.32Å; I376-L411 HydrophobicContact CD1-CD2 3.76Å; I376-I414 HydrophobicContact CD1-CD1 3.88Å; I376-I414 HydrophobicContact CG1-CD1 4.02Å
377	E	89.5	Confident	91.4	Very high	127 Å²	127	55.4 Å²	55.4	59%	0.593	31%	0.308	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.1	-23.6	174.1	-148	169.8	-160	0	0	112.6	N373 N374 A375 L379 R384	N373-E377 WeakPolarHBondContact O-CB 3.39Å; N373-E377 PolarHBondContact O-N 2.69Å; N374-E377 WeakPolarHBondContact O-CB 3.31Å; N374-E377 PolarHBondContact O-N 3.41Å; A375-E377 VanDerWaalsContact C-N 3.26Å; A375-E377 PolarHBondContact O-N 3.15Å; E377-L379 PolarHBondContact O-N 3.12Å; E377-R384 PolarHBondContact O-NH2 3.31Å
378	S	85.7	Confident	91.2	Very high	74 Å²	74	55 Å²	55	52%	0.517	30%	0.301	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.6	-19.2	172.3	67.3	0	0	0	0	114.2	A375 I376 I410	A375-S378 PolarHBondContact O-N 3.03Å; A375-S378 PolarHBondContact O-OG 2.99Å; I376-S378 PolarHBondContact O-N 2.97Å; S378-I410 WeakPolarHBondContact OG-CD1 3.4Å
379	L	88	Confident	91	Very high	7 Å²	7	55.1 Å²	55.1	4%	0.037	30%	0.302	C	S	.	.	S	Bend	trans	-88.2	153.5	-178.8	-58.3	-177.3	0	0	0	112.2	I376 E377 D383 R384 I410 I1043 C1046	I376-L379 HydrophobicContact CD1-CD1 3.68Å; I376-L379 HydrophobicContact CG2-CD1 4.4Å; I376-L379 WeakPolarHBondContact O-CB 3.42Å; I376-L379 PolarHBondContact O-N 3.27Å; E377-L379 PolarHBondContact O-N 3.12Å; L379-D383 HydrophobicContact CB-CB 4.06Å; L379-R384 HydrophobicContact CB-CG 4.17Å; L379-R384 PolarHBondContact O-NE 2.97Å; L379-R384 PolarHBondContact O-NH2 2.98Å; L379-R384 VanDerWaalsContact O-NH2 3.16Å; L379-I410 HydrophobicContact CD1-CD1 4.35Å; L379-I410 HydrophobicContact CD1-CG2 4.16Å; L379-I410 HydrophobicContact CD2-CD1 3.99Å; L379-I410 HydrophobicContact CD2-CG2 4.49Å; L379-I410 HydrophobicContact CG-CD1 4.06Å; L379-I1043 HydrophobicContact CD2-CG1 4.12Å; L379-C1046 HydrophobicContact CD2-CB 4.47Å
380	S	88.4	Confident	90.8	Very high	51 Å²	51	57.8 Å²	57.8	36%	0.357	31%	0.314	S	S	.	.			trans	-64.1	156.7	173.8	78.7	0	0	0	0	111.8	D382 D383 R384	S380-D382 PolarHBondContact O-N 2.84Å; S380-D383 PolarHBondContact O-N 3.14Å; S380-D383 VanDerWaalsContact O-N 3.08Å; S380-D383 WeakPolarHBondContact OG-CB 3.4Å; S380-D383 PolarHBondContact OG-N 3.34Å; S380-D383 PolarHBondContact OG-OD2 3.37Å; S380-R384 VanDerWaalsContact O-CG 3.28Å; S380-R384 WeakPolarHBondContact O-CG 3.4Å; S380-R384 PolarHBondContact O-N 3.45Å
381	V	88.8	Confident	90.7	Very high	101 Å²	101	57.1 Å²	57.1	61%	0.612	31%	0.31	S	S	*	.	H	α-helix	trans	-57	-38.1	179.8	179.4	0	0	0	0	111.8	R384 N385	V381-R384 PolarHBondContact O-N 2.84Å; V381-N385 PolarHBondContact O-N 3.11Å; V381-N385 PolarHBondContact O-ND2 3.47Å; V381-N385 VanDerWaalsContact O-ND2 3.08Å
382	D	88.9	Confident	90.7	Very high	98 Å²	98	55 Å²	55	52%	0.524	30%	0.297	S	S	.	.	H	α-helix	trans	-66.6	-42.3	177.1	-72	-5.7	0	0	0	111.6	S380 R384 N385	S380-D382 PolarHBondContact O-N 2.84Å; D382-R384 VanDerWaalsContact C-N 3.34Å; D382-R384 PolarHBondContact O-N 3.45Å; D382-N385 PolarHBondContact O-N 3.32Å; D382-N385 VanDerWaalsContact O-N 3.13Å
383	D	90.1	Very high	90.6	Very high	9 Å²	9	56.4 Å²	56.4	5%	0.048	31%	0.305	C	S	.	.	H	α-helix	trans	-68.3	-32.6	179.2	-68	-39.8	0	0	0	112.6	L379 S380 N385 L386 I1043	L379-D383 HydrophobicContact CB-CB 4.06Å; S380-D383 PolarHBondContact O-N 3.14Å; S380-D383 VanDerWaalsContact O-N 3.08Å; S380-D383 WeakPolarHBondContact OG-CB 3.4Å; S380-D383 PolarHBondContact OG-N 3.34Å; S380-D383 PolarHBondContact OG-OD2 3.37Å; D383-N385 PolarHBondContact O-N 3Å; D383-L386 HydrophobicContact CB-CD1 4.25Å; D383-L386 WeakPolarHBondContact O-CB 3.26Å; D383-L386 WeakPolarHBondContact O-CD1 3.23Å; D383-L386 WeakPolarHBondContact O-CG 3.34Å; D383-L386 PolarHBondContact O-N 2.98Å; D383-I1043 HydrophobicContact CB-CD1 4.05Å
384	R	91.4	Very high	90.6	Very high	84 Å²	84	55.2 Å²	55.2	32%	0.317	30%	0.302	S	S	.	.	H	α-helix	trans	-62.6	-27.4	173.3	-64.8	179	-163.8	-173.9	4.6	112.1	I376 E377 L379 S380 V381 D382 L386 Q390	I376-R384 HydrophobicContact CG2-CB 4.29Å; I376-R384 HydrophobicContact CG2-CG 3.63Å; I376-R384 PolarHBondContact O-NE 2.77Å; E377-R384 PolarHBondContact O-NH2 3.31Å; L379-R384 HydrophobicContact CB-CG 4.17Å; L379-R384 PolarHBondContact O-NE 2.97Å; L379-R384 PolarHBondContact O-NH2 2.98Å; L379-R384 VanDerWaalsContact O-NH2 3.16Å; S380-R384 VanDerWaalsContact O-CG 3.28Å; S380-R384 WeakPolarHBondContact O-CG 3.4Å; S380-R384 PolarHBondContact O-N 3.45Å; V381-R384 PolarHBondContact O-N 2.84Å; D382-R384 VanDerWaalsContact C-N 3.34Å; D382-R384 PolarHBondContact O-N 3.45Å; R384-L386 VanDerWaalsContact C-N 3.33Å; R384-Q390 PolarHBondContact O-NE2 3.4Å
385	N	91.2	Very high	90.7	Very high	98 Å²	98	50.9 Å²	50.9	52%	0.524	28%	0.279	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.4	1.8	179.7	-68	-38.5	0	0	0	113.5	V381 D382 D383	V381-N385 PolarHBondContact O-N 3.11Å; V381-N385 PolarHBondContact O-ND2 3.47Å; V381-N385 VanDerWaalsContact O-ND2 3.08Å; D382-N385 PolarHBondContact O-N 3.32Å; D382-N385 VanDerWaalsContact O-N 3.13Å; D383-N385 PolarHBondContact O-N 3Å
386	L	91.6	Very high	91	Very high	2 Å²	2	50.3 Å²	50.3	1%	0.01	27%	0.274	C	S	.	.			trans	-57.4	138	176.9	-71.5	168.7	0	0	0	111.1	D383 R384 Q388 V389 Q390 L408 F988 I1043	D383-L386 HydrophobicContact CB-CD1 4.25Å; D383-L386 WeakPolarHBondContact O-CB 3.26Å; D383-L386 WeakPolarHBondContact O-CD1 3.23Å; D383-L386 WeakPolarHBondContact O-CG 3.34Å; D383-L386 PolarHBondContact O-N 2.98Å; R384-L386 VanDerWaalsContact C-N 3.33Å; L386-Q388 PolarHBondContact O-N 3.15Å; L386-Q388 VanDerWaalsContact O-N 3.14Å; L386-V389 HydrophobicContact CB-CG2 4.04Å; L386-V389 PolarHBondContact O-N 3.05Å; L386-Q390 PolarHBondContact O-N 3.38Å; L386-Q390 VanDerWaalsContact O-N 3.12Å; L386-L408 HydrophobicContact CD1-CD1 4Å; L386-F988 HydrophobicContact CD1-CD1 3.76Å; L386-F988 HydrophobicContact CD1-CE1 4.2Å; L386-F988 HydrophobicContact CD2-CD1 4.04Å; L386-I1043 HydrophobicContact CD1-CD1 3.54Å
387	P	90.2	Very high	91.1	Very high	75 Å²	75	53.9 Å²	53.9	49%	0.487	29%	0.287	S	S	.	.	H	α-helix	trans	-52.6	-40.6	-178.3	-28.6	35	0	0	0	113.3	V389 Q390 I391	P387-V389 PolarHBondContact O-N 3.31Å; P387-Q390 PolarHBondContact O-N 3.09Å; P387-I391 VanDerWaalsContact O-CB 3.3Å; P387-I391 WeakPolarHBondContact O-CB 3.48Å; P387-I391 WeakPolarHBondContact O-CD1 3.17Å; P387-I391 WeakPolarHBondContact O-CG1 3.19Å; P387-I391 PolarHBondContact O-N 3.37Å
388	Q	91.1	Very high	91.3	Very high	19 Å²	19	51.2 Å²	51.2	9%	0.089	27%	0.272	C	S	.	.	H	α-helix	trans	-63.3	-38.2	179.3	-165.5	177.1	83.4	0	0	112.7	L386 L392 L407 L411 E999	L386-Q388 PolarHBondContact O-N 3.15Å; L386-Q388 VanDerWaalsContact O-N 3.14Å; Q388-L392 VanDerWaalsContact O-CB 3.25Å; Q388-L392 WeakPolarHBondContact O-CB 3.22Å; Q388-L392 PolarHBondContact O-N 3.08Å; Q388-L392 VanDerWaalsContact O-N 3.13Å; Q388-L407 HydrophobicContact CG-CD2 4.12Å; Q388-L411 HydrophobicContact CB-CD1 4.34Å; Q388-L411 HydrophobicContact CG-CD1 3.82Å; Q388-E999 PolarHBondContact NE2-OE2 3.21Å; Q388-E999 VanDerWaalsContact NE2-OE2 3.14Å
389	V	92.3	Very high	91.8	Very high	3 Å²	3	47.7 Å²	47.7	2%	0.018	25%	0.247	C	C	.	.	H	α-helix	trans	-68.4	-46.5	177.8	-179.3	0	0	0	0	110.2	F372 I376 L386 P387 I391 L392 L393 L408 L411	F372-V389 HydrophobicContact CE1-CG1 4.21Å; F372-V389 HydrophobicContact CZ-CG1 3.85Å; I376-V389 HydrophobicContact CD1-CG1 4.15Å; I376-V389 HydrophobicContact CG1-CG1 4.49Å; I376-V389 HydrophobicContact CG2-CG1 4.32Å; L386-V389 HydrophobicContact CB-CG2 4.04Å; L386-V389 PolarHBondContact O-N 3.05Å; P387-V389 PolarHBondContact O-N 3.31Å; V389-I391 PolarHBondContact O-N 2.66Å; V389-L392 PolarHBondContact O-N 2.58Å; V389-L393 PolarHBondContact O-N 2.93Å; V389-L408 HydrophobicContact CG2-CD1 4.03Å; V389-L411 HydrophobicContact CG2-CD1 4.09Å; V389-L411 HydrophobicContact CG2-CD2 4.28Å
390	Q	91.4	Very high	92.2	Very high	104 Å²	104	47.4 Å²	47.4	49%	0.486	25%	0.245	S	C	.	.	H	α-helix	trans	-65.3	-36.9	-178.6	-66.2	-63.3	-41.4	0	0	112.8	R384 L386 P387 P394	R384-Q390 PolarHBondContact O-NE2 3.4Å; L386-Q390 PolarHBondContact O-N 3.38Å; L386-Q390 VanDerWaalsContact O-N 3.12Å; P387-Q390 PolarHBondContact O-N 3.09Å; Q390-P394 WeakPolarHBondContact O-CD 3.14Å
391	I	91.2	Very high	92.5	Very high	91 Å²	91	45 Å²	45	47%	0.467	23%	0.229	S	C	.	.	H	α-helix	trans	-76.4	-34.6	179.6	-70.1	169	0	0	0	111.4	M352 P387 V389 P394 V395	M352-I391 HydrophobicContact CE-CG2 3.19Å; P387-I391 VanDerWaalsContact O-CB 3.3Å; P387-I391 WeakPolarHBondContact O-CB 3.48Å; P387-I391 WeakPolarHBondContact O-CD1 3.17Å; P387-I391 WeakPolarHBondContact O-CG1 3.19Å; P387-I391 PolarHBondContact O-N 3.37Å; V389-I391 PolarHBondContact O-N 2.66Å; I391-P394 WeakPolarHBondContact O-CD 3.42Å; I391-V395 WeakPolarHBondContact O-CG2 3.37Å
392	L	93	Very high	92.8	Very high	5 Å²	5	40.5 Å²	40.5	3%	0.026	20%	0.201	C	C	.	.	H	α-helix	trans	-71.7	-41.3	-173.4	-171.9	64.1	0	0	0	112.8	Q388 V389 V395 L396 I402 L411 V415	Q388-L392 VanDerWaalsContact O-CB 3.25Å; Q388-L392 WeakPolarHBondContact O-CB 3.22Å; Q388-L392 PolarHBondContact O-N 3.08Å; Q388-L392 VanDerWaalsContact O-N 3.13Å; V389-L392 PolarHBondContact O-N 2.58Å; L392-V395 WeakPolarHBondContact O-CA 3.37Å; L392-V395 WeakPolarHBondContact O-CB 3.44Å; L392-V395 PolarHBondContact O-N 2.68Å; L392-L396 HydrophobicContact CD1-CD2 4.35Å; L392-L396 HydrophobicContact CD1-CG 4.22Å; L392-L396 HydrophobicContact CD2-CD1 4.11Å; L392-L396 HydrophobicContact CG-CD1 3.79Å; L392-L396 HydrophobicContact CG-CD2 4.44Å; L392-L396 HydrophobicContact CG-CG 3.93Å; L392-L396 WeakPolarHBondContact O-CG 3.38Å; L392-L396 PolarHBondContact O-N 3.39Å; L392-I402 HydrophobicContact CD1-CB 4.49Å; L392-I402 HydrophobicContact CD1-CD1 4.42Å; L392-L411 HydrophobicContact CD2-CB 3.82Å; L392-L411 HydrophobicContact CD2-CD1 4.01Å; L392-L411 HydrophobicContact CD2-CD2 4.04Å; L392-L411 HydrophobicContact CD2-CG 4.17Å; L392-V415 HydrophobicContact CD2-CG2 4.27Å
393	L	93.4	Very high	93.1	Very high	36 Å²	36	36 Å²	36	19%	0.188	18%	0.177	C	C	.	.	H	α-helix	trans	-56.9	-48.7	-177	173.3	62.7	0	0	0	113.5	E369 F372 V389 V395 L396 R397	E369-L393 HydrophobicContact CG-CD1 4.29Å; F372-L393 HydrophobicContact CB-CD1 4.09Å; F372-L393 HydrophobicContact CD1-CB 4.2Å; F372-L393 HydrophobicContact CD1-CD1 3.76Å; F372-L393 HydrophobicContact CD1-CD2 4.07Å; F372-L393 HydrophobicContact CD1-CG 4.22Å; F372-L393 HydrophobicContact CD2-CD1 4.29Å; F372-L393 HydrophobicContact CE1-CB 3.77Å; F372-L393 HydrophobicContact CE1-CD1 4.23Å; F372-L393 HydrophobicContact CE1-CD2 4.05Å; F372-L393 HydrophobicContact CE1-CG 4.23Å; F372-L393 HydrophobicContact CE2-CB 4.22Å; F372-L393 HydrophobicContact CG-CD1 3.79Å; F372-L393 HydrophobicContact CZ-CB 3.79Å; V389-L393 PolarHBondContact O-N 2.93Å; L393-V395 PolarHBondContact O-N 3.08Å; L393-L396 PolarHBondContact O-N 2.79Å; L393-R397 HydrophobicContact CD1-CG 4.09Å; L393-R397 WeakPolarHBondContact O-CG 3.45Å; L393-R397 PolarHBondContact O-N 3.47Å
394	P	92.9	Very high	93.2	Very high	60 Å²	60	35.6 Å²	35.6	39%	0.39	17%	0.174	S	C	.	.	H	α-helix	trans	-58.9	-30.1	174.6	-26	34.4	0	0	0	114.4	Q390 I391	Q390-P394 WeakPolarHBondContact O-CD 3.14Å; I391-P394 WeakPolarHBondContact O-CD 3.42Å
395	V	94.1	Very high	93	Very high	3 Å²	3	32.5 Å²	32.5	2%	0.018	17%	0.169	C	C	.	.	H	α-helix	trans	-74.5	-45.7	177.4	-179.8	0	0	0	0	109.9	M352 I391 L392 L393 R397 R398 I400	M352-V395 HydrophobicContact CE-CG2 4.04Å; I391-V395 WeakPolarHBondContact O-CG2 3.37Å; L392-V395 WeakPolarHBondContact O-CA 3.37Å; L392-V395 WeakPolarHBondContact O-CB 3.44Å; L392-V395 PolarHBondContact O-N 2.68Å; L393-V395 PolarHBondContact O-N 3.08Å; V395-R397 PolarHBondContact O-N 3.42Å; V395-R398 PolarHBondContact O-N 3.21Å; V395-R398 VanDerWaalsContact O-N 3.12Å; V395-I400 CarbonylContact C-O 3.59Å; V395-I400 VanDerWaalsContact C-O 3.29Å; V395-I400 HydrophobicContact CG1-CB 3.81Å; V395-I400 HydrophobicContact CG1-CG2 3.74Å; V395-I400 WeakPolarHBondContact CG1-O 3.45Å; V395-I400 PolarHBondContact O-N 3.43Å; V395-I400 VanDerWaalsContact O-O 3.13Å
396	L	95.7	Very high	93	Very high	0 Å²	0	27.9 Å²	27.9	0%	0	14%	0.144	C	C	.	.	H	α-helix	trans	-60.7	-42.4	176.5	-63.8	173.3	0	0	0	112.1	I368 F372 L392 L393 R398 G399 I400 I414 V415 L418 I424	I368-L396 WeakPolarHBondContact CD1-O 3.36Å; I368-L396 HydrophobicContact CG2-CB 3.87Å; F372-L396 HydrophobicContact CD2-CD1 3.62Å; F372-L396 HydrophobicContact CE2-CD1 3.84Å; L392-L396 HydrophobicContact CD1-CD2 4.35Å; L392-L396 HydrophobicContact CD1-CG 4.22Å; L392-L396 HydrophobicContact CD2-CD1 4.11Å; L392-L396 HydrophobicContact CG-CD1 3.79Å; L392-L396 HydrophobicContact CG-CD2 4.44Å; L392-L396 HydrophobicContact CG-CG 3.93Å; L392-L396 WeakPolarHBondContact O-CG 3.38Å; L392-L396 PolarHBondContact O-N 3.39Å; L393-L396 PolarHBondContact O-N 2.79Å; L396-R398 PolarHBondContact O-N 3.43Å; L396-G399 WeakPolarHBondContact O-CA 3.43Å; L396-G399 PolarHBondContact O-N 2.87Å; L396-I400 WeakPolarHBondContact CA-O 3.31Å; L396-I400 PolarHBondContact N-O 3.27Å; L396-I414 HydrophobicContact CD1-CG2 4.4Å; L396-V415 HydrophobicContact CD2-CG2 3.96Å; L396-L418 HydrophobicContact CB-CD1 4.47Å; L396-L418 HydrophobicContact CD1-CD1 3.96Å; L396-L418 HydrophobicContact CD2-CD1 4.19Å; L396-L418 HydrophobicContact CG-CD1 4.44Å; L396-I424 HydrophobicContact CD2-CD1 3.65Å
397	R	95	Very high	93.1	Very high	85 Å²	85	28.1 Å²	28.1	32%	0.321	15%	0.146	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57	-20.4	176.5	-77.3	180	66.2	135.1	14.2	113.9	S360 K365 E369 L393 V395 G399	S360-R397 WeakPolarHBondContact CB-O 3.47Å; K365-R397 WeakPolarHBondContact CG-O 3.48Å; E369-R397 HydrophobicContact CG-CG 4.1Å; E369-R397 IonicContact OE1-CZ 2.7Å; E369-R397 IonicContact OE1-NE 3.26Å; E369-R397 PolarHBondContact OE1-NE 2.87Å; E369-R397 IonicContact OE1-NH1 2.82Å; E369-R397 PolarHBondContact OE1-NH1 2.92Å; E369-R397 IonicContact OE1-NH2 2.85Å; E369-R397 PolarHBondContact OE1-NH2 2.91Å; E369-R397 IonicContact OE2-CZ 3.59Å; E369-R397 IonicContact OE2-NH1 2.82Å; E369-R397 PolarHBondContact OE2-NH1 3.42Å; L393-R397 HydrophobicContact CD1-CG 4.09Å; L393-R397 WeakPolarHBondContact O-CG 3.45Å; L393-R397 PolarHBondContact O-N 3.47Å; V395-R397 PolarHBondContact O-N 3.42Å; R397-G399 VanDerWaalsContact C-N 3.34Å
398	R	94	Very high	93.2	Very high	71 Å²	71	24.6 Å²	24.6	27%	0.268	12%	0.123	S	C	.	.	T	Hydrogen-bonded Turn	trans	-92.3	4.3	176.5	-65.5	173	-176.7	154.2	-0.7	113.1	N355 D358 F359 V395 L396 I400	N355-R398 VanDerWaalsContact CA-NH1 3.31Å; N355-R398 VanDerWaalsContact O-CZ 3.28Å; N355-R398 PolarHBondContact O-NH1 2.84Å; N355-R398 PolarHBondContact OD1-NH1 3.17Å; D358-R398 WeakPolarHBondContact OD1-CA 3.34Å; F359-R398 PolarHBondContact N-O 3.11Å; V395-R398 PolarHBondContact O-N 3.21Å; V395-R398 VanDerWaalsContact O-N 3.12Å; L396-R398 PolarHBondContact O-N 3.43Å; R398-I400 HydrophobicContact CB-CD1 4.11Å; R398-I400 HydrophobicContact CB-CG1 4.4Å
399	G	94.9	Very high	93.1	Very high	0 Å²	0	25.3 Å²	25.3	0%	0	13%	0.129	C	C	.	.	T	Hydrogen-bonded Turn	trans	77.7	21.4	-175.4	0	0	0	0	0	113.2	S360 L396 R397 K425 V426	S360-G399 VanDerWaalsContact OG-CA 3.23Å; S360-G399 WeakPolarHBondContact OG-CA 3.29Å; S360-G399 PolarHBondContact OG-N 3.36Å; L396-G399 WeakPolarHBondContact O-CA 3.43Å; L396-G399 PolarHBondContact O-N 2.87Å; R397-G399 VanDerWaalsContact C-N 3.34Å; G399-K425 PolarHBondContact O-N 3.38Å; G399-V426 PolarHBondContact O-N 3.21Å; G399-V426 VanDerWaalsContact O-N 3.08Å
400	I	95.7	Very high	93	Very high	1 Å²	1	25.4 Å²	25.4	1%	0.005	13%	0.129	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	129.4	-178.8	-57	164.2	0	0	0	108.7	A351 L354 F359 V395 L396 R398 V426 Y428	A351-I400 HydrophobicContact CB-CG2 4.21Å; L354-I400 HydrophobicContact CB-CD1 3.61Å; L354-I400 HydrophobicContact CD1-CD1 4.15Å; F359-I400 HydrophobicContact CD2-CD1 4.4Å; F359-I400 HydrophobicContact CD2-CG1 4Å; F359-I400 HydrophobicContact CE2-CD1 4.19Å; F359-I400 HydrophobicContact CE2-CG1 4.09Å; V395-I400 CarbonylContact C-O 3.59Å; V395-I400 VanDerWaalsContact C-O 3.29Å; V395-I400 HydrophobicContact CG1-CB 3.81Å; V395-I400 HydrophobicContact CG1-CG2 3.74Å; V395-I400 WeakPolarHBondContact CG1-O 3.45Å; V395-I400 PolarHBondContact O-N 3.43Å; V395-I400 VanDerWaalsContact O-O 3.13Å; L396-I400 WeakPolarHBondContact CA-O 3.31Å; L396-I400 PolarHBondContact N-O 3.27Å; R398-I400 HydrophobicContact CB-CD1 4.11Å; R398-I400 HydrophobicContact CB-CG1 4.4Å; I400-V426 CarbonylContact C-O 3.29Å; I400-V426 WeakPolarHBondContact CA-O 3.23Å; I400-Y428 HydrophobicContact CG2-CD2 4.17Å; I400-Y428 HydrophobicContact CG2-CE2 4.14Å
401	G	95.4	Very high	93.1	Very high	0 Å²	0	20.5 Å²	20.5	0%	0	11%	0.106	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	156.2	177.9	0	0	0	0	0	112.5	V426 Y428	G401-V426 PolarHBondContact N-O 2.87Å; G401-Y428 PolarHBondContact O-N 3.35Å
402	I	95.9	Very high	93.1	Very high	7 Å²	7	18.5 Å²	18.5	4%	0.036	9%	0.094	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	135.7	174.9	-57.3	170.2	0	0	0	107.8	C347 E348 A351 L392 L407 V415 Y428	C347-I402 HydrophobicContact CB-CG2 4.31Å; E348-I402 HydrophobicContact CG-CD1 4.48Å; E348-I402 HydrophobicContact CG-CG2 4.27Å; A351-I402 HydrophobicContact CB-CD1 3.62Å; A351-I402 HydrophobicContact CB-CG1 3.57Å; L392-I402 HydrophobicContact CD1-CB 4.49Å; L392-I402 HydrophobicContact CD1-CD1 4.42Å; I402-L407 HydrophobicContact CB-CD1 4.41Å; I402-L407 HydrophobicContact CG2-CD1 4.24Å; I402-L407 WeakPolarHBondContact O-CD1 3.49Å; I402-V415 WeakPolarHBondContact O-CG2 3.46Å; I402-Y428 CarbonylContact C-O 3.57Å; I402-Y428 WeakPolarHBondContact CA-O 3.49Å
403	H	94.6	Very high	92.9	Very high	3 Å²	3	19.1 Å²	19.1	1%	0.014	10%	0.097	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.9	112	179.7	-171.6	-72	0	0	0	112	K412 E416 L427 Y428 A429 T430 F433	H403-K412 VanDerWaalsContact CD2-CG 3.49Å; H403-K412 WeakPolarHBondContact CD2-CG 3.41Å; H403-K412 WeakPolarHBondContact NE2-CD 3.38Å; H403-K412 VanDerWaalsContact NE2-CG 3.26Å; H403-K412 WeakPolarHBondContact NE2-CG 3.38Å; H403-E416 IonicContact CD2-OE1 3.34Å; H403-E416 IonicContact CE1-OE1 3.58Å; H403-E416 IonicContact NE2-OE1 2.91Å; H403-E416 PolarHBondContact NE2-OE1 3.18Å; H403-L427 HydrophobicContact CB-CD1 4.06Å; H403-Y428 PolarHBondContact N-O 2.98Å; H403-A429 HydrophobicContact CB-CB 4.15Å; H403-A429 CarbonylContact O-C 3.52Å; H403-A429 VanDerWaalsContact O-CA 3.23Å; H403-A429 WeakPolarHBondContact O-CA 3.33Å; H403-T430 PolarHBondContact O-N 2.82Å; H403-F433 HydrophobicContact CB-CD2 4.42Å; H403-F433 AromaticContact CD2-CD2 3.67Å; H403-F433 AromaticContact CE1-CD2 3.72Å; H403-F433 AromaticContact CG-CD2 3.73Å; H403-F433 AromaticContact ND1-CD2 3.8Å; H403-F433 AromaticContact NE2-CD2 3.64Å
404	H	92.7	Very high	92.9	Very high	0 Å²	0	17.5 Å²	17.5	0%	0	9%	0.088	C	C	.	.			trans	-158.5	163.1	170.2	53.6	85.5	0	0	0	110.5	K344 E348 G406 L407 T430	K344-H404 HydrophobicContact CB-CB 4.43Å; K344-H404 HydrophobicContact CG-CB 4.09Å; E348-H404 IonicContact OE1-CE1 2.84Å; E348-H404 PolarHBondContact OE1-CE1 3.34Å; E348-H404 VanDerWaalsContact OE1-CE1 3.29Å; E348-H404 IonicContact OE1-NE2 3.52Å; E348-H404 PolarHBondContact OE1-NE2 2.7Å; H404-G406 WeakPolarHBondContact ND1-CA 3.27Å; H404-G406 PolarHBondContact ND1-N 3.09Å; H404-G406 VanDerWaalsContact ND1-N 3.14Å; H404-G406 PolarHBondContact O-N 3.49Å; H404-L407 PolarHBondContact O-N 3.44Å; H404-L407 VanDerWaalsContact O-N 3.14Å; H404-T430 WeakPolarHBondContact CA-OG1 3.41Å; H404-T430 HydrophobicContact CB-CG2 3.64Å
405	G	87.8	Confident	93	Very high	20 Å²	20	14.6 Å²	14.6	21%	0.206	7%	0.07	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69.3	17.7	178.7	0	0	0	0	0	115.7	R1004	G405-R1004 PolarHBondContact O-NH2 2.8Å
406	G	90	Very high	92.8	Very high	0 Å²	0	14.5 Å²	14.5	0%	0	7%	0.069	C	C	.	.	T	Hydrogen-bonded Turn	trans	-105	-17.3	170.7	0	0	0	0	0	113.1	H404 G1000	H404-G406 WeakPolarHBondContact ND1-CA 3.27Å; H404-G406 PolarHBondContact ND1-N 3.09Å; H404-G406 VanDerWaalsContact ND1-N 3.14Å; H404-G406 PolarHBondContact O-N 3.49Å; G406-G1000 WeakPolarHBondContact O-CA 3.47Å; G406-G1000 PolarHBondContact O-N 2.67Å
407	L	92.9	Very high	92.6	Very high	8 Å²	8	16.3 Å²	16.3	4%	0.042	8%	0.08	C	C	.	.	S	Bend	trans	-70.6	152.7	173.8	-60.1	179.6	0	0	0	110.9	Q388 I402 H404 G1000	Q388-L407 HydrophobicContact CG-CD2 4.12Å; I402-L407 HydrophobicContact CB-CD1 4.41Å; I402-L407 HydrophobicContact CG2-CD1 4.24Å; I402-L407 WeakPolarHBondContact O-CD1 3.49Å; H404-L407 PolarHBondContact O-N 3.44Å; H404-L407 VanDerWaalsContact O-N 3.14Å; L407-G1000 WeakPolarHBondContact O-CA 3.31Å
408	L	92.4	Very high	92.6	Very high	1 Å²	1	12.2 Å²	12.2	1%	0.005	7%	0.065	C	C	.	.			trans	-53	137.2	165.8	-67.7	170	0	0	0	109.9	L386 V389 I410 L411 K412 F988 E999 I1003 I1043	L386-L408 HydrophobicContact CD1-CD1 4Å; V389-L408 HydrophobicContact CG2-CD1 4.03Å; L408-I410 VanDerWaalsContact C-N 3.28Å; L408-I410 HydrophobicContact CB-CG2 4.3Å; L408-I410 PolarHBondContact O-N 3.12Å; L408-L411 HydrophobicContact CB-CB 4.27Å; L408-L411 HydrophobicContact CB-CD1 4.11Å; L408-L411 HydrophobicContact CB-CG 3.95Å; L408-L411 HydrophobicContact CD1-CD1 3.89Å; L408-L411 HydrophobicContact CD1-CG 4.22Å; L408-L411 HydrophobicContact CG-CD1 4.35Å; L408-L411 PolarHBondContact O-N 3.03Å; L408-K412 PolarHBondContact O-N 3.28Å; L408-F988 HydrophobicContact CD2-CE1 3.88Å; L408-F988 HydrophobicContact CD2-CZ 4.2Å; L408-E999 HydrophobicContact CD2-CB 3.92Å; L408-E999 HydrophobicContact CG-CB 4.34Å; L408-I1003 HydrophobicContact CD2-CD1 3.32Å; L408-I1003 HydrophobicContact CD2-CG1 4.47Å; L408-I1043 HydrophobicContact CD1-CD1 3.84Å; L408-I1043 HydrophobicContact CD2-CD1 3.79Å; L408-I1043 HydrophobicContact CD2-CG1 4.43Å; L408-I1043 HydrophobicContact CG-CD1 4.43Å
409	P	88.9	Confident	92.6	Very high	33 Å²	33	9.3 Å²	9.3	21%	0.214	5%	0.054	C	C	.	.	H	α-helix	trans	-51.8	-44.1	-179.3	-29.6	35.9	0	0	0	113.7	L411 K412 E413 I1003	P409-L411 PolarHBondContact O-N 3.5Å; P409-K412 WeakPolarHBondContact O-CB 3.49Å; P409-K412 PolarHBondContact O-N 2.95Å; P409-E413 WeakPolarHBondContact O-CG 3.27Å; P409-E413 PolarHBondContact O-N 3.16Å; P409-I1003 HydrophobicContact CG-CG2 3.93Å
410	I	90.7	Very high	92.3	Very high	6 Å²	6	12.5 Å²	12.5	3%	0.031	8%	0.08	C	C	.	.	H	α-helix	trans	-61.7	-41.3	177.9	-167.2	172.4	0	0	0	112.4	A375 S378 L379 L408 K412 E413 I414 L1049	A375-I410 WeakPolarHBondContact O-CD1 3.47Å; S378-I410 WeakPolarHBondContact OG-CD1 3.4Å; L379-I410 HydrophobicContact CD1-CD1 4.35Å; L379-I410 HydrophobicContact CD1-CG2 4.16Å; L379-I410 HydrophobicContact CD2-CD1 3.99Å; L379-I410 HydrophobicContact CD2-CG2 4.49Å; L379-I410 HydrophobicContact CG-CD1 4.06Å; L408-I410 VanDerWaalsContact C-N 3.28Å; L408-I410 HydrophobicContact CB-CG2 4.3Å; L408-I410 PolarHBondContact O-N 3.12Å; I410-K412 VanDerWaalsContact C-N 3.34Å; I410-K412 PolarHBondContact O-N 3.48Å; I410-E413 PolarHBondContact O-N 3.12Å; I410-I414 HydrophobicContact CG1-CD1 4.35Å; I410-I414 VanDerWaalsContact O-CG1 3.28Å; I410-I414 WeakPolarHBondContact O-CG1 3.35Å; I410-I414 PolarHBondContact O-N 3.16Å; I410-L1049 HydrophobicContact CG1-CD1 4.1Å; I410-L1049 HydrophobicContact CG1-CD2 4.48Å; I410-L1049 HydrophobicContact CG1-CG 4.25Å
411	L	93.4	Very high	92.1	Very high	0 Å²	0	18.8 Å²	18.8	0%	0	11%	0.11	C	C	.	.	H	α-helix	trans	-67.2	-38.7	177.6	-64.3	-174.5	0	0	0	111.3	F372 I376 Q388 V389 L392 L408 P409 E413 I414 V415	F372-L411 HydrophobicContact CE2-CD2 4.17Å; F372-L411 HydrophobicContact CZ-CD2 4.43Å; I376-L411 HydrophobicContact CD1-CD2 3.76Å; Q388-L411 HydrophobicContact CB-CD1 4.34Å; Q388-L411 HydrophobicContact CG-CD1 3.82Å; V389-L411 HydrophobicContact CG2-CD1 4.09Å; V389-L411 HydrophobicContact CG2-CD2 4.28Å; L392-L411 HydrophobicContact CD2-CB 3.82Å; L392-L411 HydrophobicContact CD2-CD1 4.01Å; L392-L411 HydrophobicContact CD2-CD2 4.04Å; L392-L411 HydrophobicContact CD2-CG 4.17Å; L408-L411 HydrophobicContact CB-CB 4.27Å; L408-L411 HydrophobicContact CB-CD1 4.11Å; L408-L411 HydrophobicContact CB-CG 3.95Å; L408-L411 HydrophobicContact CD1-CD1 3.89Å; L408-L411 HydrophobicContact CD1-CG 4.22Å; L408-L411 HydrophobicContact CG-CD1 4.35Å; L408-L411 PolarHBondContact O-N 3.03Å; P409-L411 PolarHBondContact O-N 3.5Å; L411-E413 VanDerWaalsContact C-N 3.33Å; L411-I414 HydrophobicContact CD2-CD1 4.23Å; L411-I414 PolarHBondContact O-N 3.48Å; L411-V415 VanDerWaalsContact O-CG2 3.3Å; L411-V415 WeakPolarHBondContact O-CG2 3.34Å; L411-V415 PolarHBondContact O-N 2.92Å
412	K	90.9	Very high	91.9	Very high	49 Å²	49	20.2 Å²	20.2	21%	0.213	12%	0.124	C	C	.	.	H	α-helix	trans	-59.4	-47.3	174.7	-164	-162.7	70.1	146.4	0	110.4	H403 L408 P409 I410 V415 E416	H403-K412 VanDerWaalsContact CD2-CG 3.49Å; H403-K412 WeakPolarHBondContact CD2-CG 3.41Å; H403-K412 WeakPolarHBondContact NE2-CD 3.38Å; H403-K412 VanDerWaalsContact NE2-CG 3.26Å; H403-K412 WeakPolarHBondContact NE2-CG 3.38Å; L408-K412 PolarHBondContact O-N 3.28Å; P409-K412 WeakPolarHBondContact O-CB 3.49Å; P409-K412 PolarHBondContact O-N 2.95Å; I410-K412 VanDerWaalsContact C-N 3.34Å; I410-K412 PolarHBondContact O-N 3.48Å; K412-V415 PolarHBondContact O-N 3.11Å; K412-E416 WeakPolarHBondContact CE-OE1 3.36Å; K412-E416 IonicContact NZ-OE1 3.75Å; K412-E416 PolarHBondContact NZ-OE1 2.89Å; K412-E416 VanDerWaalsContact NZ-OE1 3.1Å; K412-E416 VanDerWaalsContact O-CG 3.22Å; K412-E416 WeakPolarHBondContact O-CG 3.29Å; K412-E416 PolarHBondContact O-N 3.17Å
413	E	89.8	Confident	91.9	Very high	19 Å²	19	21.9 Å²	21.9	9%	0.089	13%	0.131	C	C	.	.	H	α-helix	trans	-65.7	-39.7	179	-68.2	172.6	175.9	0	0	112.5	P409 I410 L411 V415 E416 V417 S1048 L1049 Y1050	P409-E413 WeakPolarHBondContact O-CG 3.27Å; P409-E413 PolarHBondContact O-N 3.16Å; I410-E413 PolarHBondContact O-N 3.12Å; L411-E413 VanDerWaalsContact C-N 3.33Å; E413-V415 VanDerWaalsContact C-N 3.3Å; E413-V415 PolarHBondContact O-N 3.35Å; E413-E416 WeakPolarHBondContact O-CB 3.45Å; E413-E416 PolarHBondContact O-N 3.33Å; E413-V417 WeakPolarHBondContact O-CG2 3.48Å; E413-V417 PolarHBondContact O-N 3.29Å; E413-S1048 WeakPolarHBondContact OE1-CB 3.43Å; E413-S1048 PolarHBondContact OE1-OG 3.44Å; E413-S1048 VanDerWaalsContact OE2-CA 3.3Å; E413-S1048 WeakPolarHBondContact OE2-CA 3.29Å; E413-S1048 PolarHBondContact OE2-OG 3.23Å; E413-L1049 HydrophobicContact CB-CB 4.23Å; E413-L1049 HydrophobicContact CB-CD1 3.93Å; E413-L1049 HydrophobicContact CB-CG 4.31Å; E413-L1049 PolarHBondContact OE2-N 3.29Å; E413-Y1050 HydrophobicContact CB-CE2 4.39Å; E413-Y1050 HydrophobicContact CG-CD2 4.12Å; E413-Y1050 HydrophobicContact CG-CE2 3.81Å
414	I	93.1	Very high	91.9	Very high	1 Å²	1	21.7 Å²	21.7	1%	0.005	13%	0.13	C	C	.	.	H	α-helix	trans	-57.7	-45.2	173	-67.9	166.2	0	0	0	110.5	F372 A375 I376 L396 I410 L411 E416 V417 L418 L1049	F372-I414 HydrophobicContact CD2-CD1 4.27Å; F372-I414 HydrophobicContact CD2-CG2 4.04Å; F372-I414 HydrophobicContact CE2-CD1 4.48Å; A375-I414 HydrophobicContact CB-CD1 3.55Å; A375-I414 HydrophobicContact CB-CG1 3.64Å; I376-I414 HydrophobicContact CD1-CD1 3.88Å; I376-I414 HydrophobicContact CG1-CD1 4.02Å; L396-I414 HydrophobicContact CD1-CG2 4.4Å; I410-I414 HydrophobicContact CG1-CD1 4.35Å; I410-I414 VanDerWaalsContact O-CG1 3.28Å; I410-I414 WeakPolarHBondContact O-CG1 3.35Å; I410-I414 PolarHBondContact O-N 3.16Å; L411-I414 HydrophobicContact CD2-CD1 4.23Å; L411-I414 PolarHBondContact O-N 3.48Å; I414-E416 VanDerWaalsContact C-N 3.32Å; I414-E416 PolarHBondContact O-N 2.95Å; I414-V417 PolarHBondContact O-N 3.11Å; I414-L418 HydrophobicContact CG2-CD1 3.71Å; I414-L418 HydrophobicContact CG2-CG 4.13Å; I414-L418 WeakPolarHBondContact O-CB 3.42Å; I414-L418 VanDerWaalsContact O-CG 3.26Å; I414-L418 WeakPolarHBondContact O-CG 3.45Å; I414-L418 PolarHBondContact O-N 2.96Å; I414-L1049 HydrophobicContact CG1-CD1 3.53Å
415	V	94.2	Very high	92.1	Very high	0 Å²	0	23.4 Å²	23.4	0%	0	14%	0.138	C	C	.	.	H	α-helix	trans	-62.5	-41.4	177.9	173.3	0	0	0	0	111.1	L392 L396 I402 L411 K412 E413 F419 L427	L392-V415 HydrophobicContact CD2-CG2 4.27Å; L396-V415 HydrophobicContact CD2-CG2 3.96Å; I402-V415 WeakPolarHBondContact O-CG2 3.46Å; L411-V415 VanDerWaalsContact O-CG2 3.3Å; L411-V415 WeakPolarHBondContact O-CG2 3.34Å; L411-V415 PolarHBondContact O-N 2.92Å; K412-V415 PolarHBondContact O-N 3.11Å; E413-V415 VanDerWaalsContact C-N 3.3Å; E413-V415 PolarHBondContact O-N 3.35Å; V415-F419 VanDerWaalsContact O-CB 3.23Å; V415-F419 WeakPolarHBondContact O-CB 3.21Å; V415-F419 PolarHBondContact O-N 3.4Å; V415-L427 HydrophobicContact CG1-CD1 3.43Å; V415-L427 VanDerWaalsContact CG1-CD1 3.43Å
416	E	91.6	Very high	92.5	Very high	1 Å²	1	22.4 Å²	22.4	1%	0.005	13%	0.128	C	C	.	.	H	α-helix	trans	-62.5	-45.9	176.9	-65.7	169.5	177.2	0	0	111.2	H403 K412 E413 I414 F419 A420 F433 L437 M439 Y1050	H403-E416 IonicContact CD2-OE1 3.34Å; H403-E416 IonicContact CE1-OE1 3.58Å; H403-E416 IonicContact NE2-OE1 2.91Å; H403-E416 PolarHBondContact NE2-OE1 3.18Å; K412-E416 WeakPolarHBondContact CE-OE1 3.36Å; K412-E416 IonicContact NZ-OE1 3.75Å; K412-E416 PolarHBondContact NZ-OE1 2.89Å; K412-E416 VanDerWaalsContact NZ-OE1 3.1Å; K412-E416 VanDerWaalsContact O-CG 3.22Å; K412-E416 WeakPolarHBondContact O-CG 3.29Å; K412-E416 PolarHBondContact O-N 3.17Å; E413-E416 WeakPolarHBondContact O-CB 3.45Å; E413-E416 PolarHBondContact O-N 3.33Å; I414-E416 VanDerWaalsContact C-N 3.32Å; I414-E416 PolarHBondContact O-N 2.95Å; E416-F419 PolarHBondContact O-N 2.89Å; E416-A420 WeakPolarHBondContact O-CB 3.33Å; E416-A420 PolarHBondContact O-N 2.96Å; E416-F433 HydrophobicContact CG-CE2 4.47Å; E416-L437 WeakPolarHBondContact OE1-CD1 3.46Å; E416-M439 HydrophobicContact CB-CE 3.79Å; E416-M439 HydrophobicContact CB-SD 3.9Å; E416-M439 HydrophobicContact CG-CE 3.74Å; E416-M439 HydrophobicContact CG-SD 4.33Å; E416-Y1050 WeakPolarHBondContact CB-OH 3.48Å; E416-Y1050 VanDerWaalsContact OE2-CE2 3.25Å; E416-Y1050 WeakPolarHBondContact OE2-CE2 3.37Å; E416-Y1050 VanDerWaalsContact OE2-CZ 3.3Å; E416-Y1050 PolarHBondContact OE2-OH 2.84Å
417	V	90.8	Very high	92.8	Very high	37 Å²	37	22.4 Å²	22.4	22%	0.224	13%	0.128	C	C	.	.	H	α-helix	trans	-62.3	-50.2	175.9	172.4	0	0	0	0	111.4	V371 E413 I414 F419 A420 E421	V371-V417 HydrophobicContact CG1-CG1 4.46Å; E413-V417 WeakPolarHBondContact O-CG2 3.48Å; E413-V417 PolarHBondContact O-N 3.29Å; I414-V417 PolarHBondContact O-N 3.11Å; V417-F419 PolarHBondContact O-N 3.14Å; V417-A420 PolarHBondContact O-N 3.33Å; V417-A420 VanDerWaalsContact O-N 3.15Å; V417-E421 HydrophobicContact CG1-CG 4.46Å; V417-E421 WeakPolarHBondContact O-CG 3.46Å; V417-E421 PolarHBondContact O-N 3.04Å
418	L	94.7	Very high	92.9	Very high	0 Å²	0	22 Å²	22	0%	0	13%	0.126	C	C	.	.	H	α-helix	trans	-63.4	-30.9	179.6	-68.5	175.9	0	0	0	112.5	I368 V371 L396 I414 G422 F423 I424	I368-L418 HydrophobicContact CG1-CD2 4.22Å; I368-L418 HydrophobicContact CG2-CD1 4.08Å; V371-L418 HydrophobicContact CB-CD2 4Å; V371-L418 HydrophobicContact CG1-CD2 3.88Å; V371-L418 HydrophobicContact CG1-CG 4.47Å; V371-L418 HydrophobicContact CG2-CD2 4.44Å; L396-L418 HydrophobicContact CB-CD1 4.47Å; L396-L418 HydrophobicContact CD1-CD1 3.96Å; L396-L418 HydrophobicContact CD2-CD1 4.19Å; L396-L418 HydrophobicContact CG-CD1 4.44Å; I414-L418 HydrophobicContact CG2-CD1 3.71Å; I414-L418 HydrophobicContact CG2-CG 4.13Å; I414-L418 WeakPolarHBondContact O-CB 3.42Å; I414-L418 VanDerWaalsContact O-CG 3.26Å; I414-L418 WeakPolarHBondContact O-CG 3.45Å; I414-L418 PolarHBondContact O-N 2.96Å; L418-G422 PolarHBondContact O-N 3.28Å; L418-F423 HydrophobicContact CB-CB 4.44Å; L418-F423 HydrophobicContact CD2-CB 4.34Å; L418-F423 HydrophobicContact CD2-CD2 3.83Å; L418-F423 HydrophobicContact CD2-CG 4.43Å; L418-F423 PolarHBondContact O-N 3.04Å; L418-I424 HydrophobicContact CB-CD1 4.15Å; L418-I424 HydrophobicContact CB-CG1 3.72Å; L418-I424 HydrophobicContact CD1-CD1 4.46Å; L418-I424 PolarHBondContact O-N 3.28Å
419	F	93.9	Very high	93	Very high	10 Å²	10	22 Å²	22	4%	0.044	13%	0.126	C	C	.	.	H	α-helix	trans	-71.6	-42.8	174	-173.4	-95.7	0	0	0	111.8	P336 I338 V415 E416 V417 G422 I424 L427 F433 M439 A441	P336-F419 HydrophobicContact CB-CE2 3.95Å; P336-F419 HydrophobicContact CB-CZ 4.23Å; P336-F419 HydrophobicContact CG-CZ 4.41Å; I338-F419 HydrophobicContact CD1-CE1 4.4Å; I338-F419 HydrophobicContact CD1-CZ 3.97Å; I338-F419 HydrophobicContact CG1-CE2 4.16Å; I338-F419 HydrophobicContact CG1-CZ 3.73Å; V415-F419 VanDerWaalsContact O-CB 3.23Å; V415-F419 WeakPolarHBondContact O-CB 3.21Å; V415-F419 PolarHBondContact O-N 3.4Å; E416-F419 PolarHBondContact O-N 2.89Å; V417-F419 PolarHBondContact O-N 3.14Å; F419-G422 PolarHBondContact O-N 3.06Å; F419-G422 VanDerWaalsContact O-N 3.12Å; F419-I424 HydrophobicContact CB-CB 4.32Å; F419-I424 HydrophobicContact CD2-CB 4.01Å; F419-I424 HydrophobicContact CD2-CG2 4.03Å; F419-L427 HydrophobicContact CD1-CD2 4.5Å; F419-L427 HydrophobicContact CD2-CB 3.87Å; F419-L427 HydrophobicContact CD2-CD2 3.81Å; F419-L427 HydrophobicContact CD2-CG 4.37Å; F419-L427 HydrophobicContact CE2-CB 3.82Å; F419-L427 HydrophobicContact CE2-CD2 4.03Å; F419-L427 HydrophobicContact CG-CD2 4.07Å; F419-L427 HydrophobicContact CZ-CD2 4.46Å; F419-F433 HydrophobicContact CD1-CZ 4.1Å; F419-F433 HydrophobicContact CE1-CZ 4.21Å; F419-M439 HydrophobicContact CD1-CB 3.9Å; F419-M439 HydrophobicContact CD1-CG 4.18Å; F419-M439 HydrophobicContact CD1-SD 4.04Å; F419-M439 HydrophobicContact CE1-CB 3.95Å; F419-A441 HydrophobicContact CZ-CB 4Å
420	A	88.9	Confident	93.2	Very high	66 Å²	66	21.2 Å²	21.2	55%	0.545	12%	0.12	S	C	.	.	H	α-helix	trans	-62.3	-41.4	176.8	0	0	0	0	0	112.5	E416 V417 G422	E416-A420 WeakPolarHBondContact O-CB 3.33Å; E416-A420 PolarHBondContact O-N 2.96Å; V417-A420 PolarHBondContact O-N 3.33Å; V417-A420 VanDerWaalsContact O-N 3.15Å; A420-G422 PolarHBondContact O-N 2.81Å
421	E	90.6	Very high	93.1	Very high	134 Å²	134	22.4 Å²	22.4	63%	0.626	13%	0.126	S	C	*	.	T	Hydrogen-bonded Turn	trans	-72.3	-10.2	175.6	-66.2	-58.9	139.3	0	0	113.3	V417 F423	V417-E421 HydrophobicContact CG1-CG 4.46Å; V417-E421 WeakPolarHBondContact O-CG 3.46Å; V417-E421 PolarHBondContact O-N 3.04Å; E421-F423 HydrophobicContact CB-CD2 3.58Å; E421-F423 HydrophobicContact CB-CE2 3.6Å; E421-F423 HydrophobicContact CG-CE2 4.31Å
422	G	92.2	Very high	92.7	Very high	30 Å²	30	25.8 Å²	25.8	31%	0.309	15%	0.147	S	C	.	.	T	Hydrogen-bonded Turn	trans	82.9	13.9	176.4	0	0	0	0	0	115.2	L418 F419 A420 K425	L418-G422 PolarHBondContact O-N 3.28Å; F419-G422 PolarHBondContact O-N 3.06Å; F419-G422 VanDerWaalsContact O-N 3.12Å; A420-G422 PolarHBondContact O-N 2.81Å; G422-K425 PolarHBondContact O-NZ 3.08Å
423	F	95.2	Very high	92.6	Very high	41 Å²	41	23.5 Å²	23.5	18%	0.18	14%	0.137	C	C	.	.			trans	-74.5	-32.4	174.7	-66.4	-59.2	0	0	0	112.6	E364 A367 I368 L418 E421	E364-F423 HydrophobicContact CB-CD1 4.1Å; E364-F423 HydrophobicContact CG-CD1 3.99Å; E364-F423 HydrophobicContact CG-CE1 4.25Å; A367-F423 HydrophobicContact CB-CD1 4.47Å; A367-F423 HydrophobicContact CB-CE1 3.67Å; A367-F423 HydrophobicContact CB-CE2 4.41Å; A367-F423 HydrophobicContact CB-CZ 3.63Å; I368-F423 HydrophobicContact CD1-CB 3.95Å; I368-F423 HydrophobicContact CG1-CB 3.71Å; I368-F423 HydrophobicContact CG1-CD1 4.28Å; I368-F423 HydrophobicContact CG1-CG 3.97Å; L418-F423 HydrophobicContact CB-CB 4.44Å; L418-F423 HydrophobicContact CD2-CB 4.34Å; L418-F423 HydrophobicContact CD2-CD2 3.83Å; L418-F423 HydrophobicContact CD2-CG 4.43Å; L418-F423 PolarHBondContact O-N 3.04Å; E421-F423 HydrophobicContact CB-CD2 3.58Å; E421-F423 HydrophobicContact CB-CE2 3.6Å; E421-F423 HydrophobicContact CG-CE2 4.31Å
424	I	95.8	Very high	92.3	Very high	0 Å²	0	22.6 Å²	22.6	0%	0	13%	0.132	C	C	.	.			trans	-85.4	116.9	175.7	-56	-58.7	0	0	0	110.2	L396 L418 F419 V426 L427	L396-I424 HydrophobicContact CD2-CD1 3.65Å; L418-I424 HydrophobicContact CB-CD1 4.15Å; L418-I424 HydrophobicContact CB-CG1 3.72Å; L418-I424 HydrophobicContact CD1-CD1 4.46Å; L418-I424 PolarHBondContact O-N 3.28Å; F419-I424 HydrophobicContact CB-CB 4.32Å; F419-I424 HydrophobicContact CD2-CB 4.01Å; F419-I424 HydrophobicContact CD2-CG2 4.03Å; I424-V426 VanDerWaalsContact CG2-O 3.23Å; I424-V426 WeakPolarHBondContact CG2-O 3.45Å; I424-L427 HydrophobicContact CG2-CB 4.17Å
425	K	95.5	Very high	91.5	Very high	35 Å²	35	25.1 Å²	25.1	15%	0.152	15%	0.145	C	C	.	.	S	Bend	trans	-89.2	-33.8	177.9	-46.8	-53.1	178.5	-175	0	111.6	M330 E335 P336 L337 F359 E364 G399 G422	M330-K425 HydrophobicContact SD-CB 4.16Å; E335-K425 HydrophobicContact CB-CB 4.29Å; E335-K425 HydrophobicContact CG-CD 4.46Å; P336-K425 CarbonylContact C-O 3.52Å; P336-K425 VanDerWaalsContact CA-O 3.31Å; P336-K425 WeakPolarHBondContact CA-O 3.45Å; L337-K425 PolarHBondContact N-O 3.3Å; F359-K425 HydrophobicContact CB-CB 3.99Å; F359-K425 HydrophobicContact CB-CG 3.79Å; E364-K425 WeakPolarHBondContact OE1-CE 3.42Å; E364-K425 IonicContact OE1-NZ 3.91Å; E364-K425 PolarHBondContact OE1-NZ 3.11Å; G399-K425 PolarHBondContact O-N 3.38Å; G422-K425 PolarHBondContact O-NZ 3.08Å
426	V	96.2	Very high	90.2	Very high	0 Å²	0	25.3 Å²	25.3	0%	0	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126	120.6	177.2	-177.1	0	0	0	0	109.6	V326 M330 L337 V339 L354 F359 G399 I400 G401 I424 Y428	V326-V426 HydrophobicContact CG1-CG1 4.13Å; V326-V426 HydrophobicContact CG1-CG2 3.65Å; M330-V426 HydrophobicContact CE-CG2 3.34Å; M330-V426 HydrophobicContact CG-CG2 4.38Å; M330-V426 HydrophobicContact SD-CG2 3.76Å; L337-V426 CarbonylContact O-C 3.55Å; L337-V426 WeakPolarHBondContact O-CA 3.24Å; V339-V426 HydrophobicContact CG2-CG1 4.16Å; L354-V426 HydrophobicContact CD1-CG1 4.28Å; F359-V426 HydrophobicContact CD2-CG2 4.17Å; F359-V426 HydrophobicContact CE2-CG2 3.94Å; G399-V426 PolarHBondContact O-N 3.21Å; G399-V426 VanDerWaalsContact O-N 3.08Å; I400-V426 CarbonylContact C-O 3.29Å; I400-V426 WeakPolarHBondContact CA-O 3.23Å; G401-V426 PolarHBondContact N-O 2.87Å; I424-V426 VanDerWaalsContact CG2-O 3.23Å; I424-V426 WeakPolarHBondContact CG2-O 3.45Å; V426-Y428 HydrophobicContact CG1-CD2 4.17Å; V426-Y428 HydrophobicContact CG1-CE2 3.68Å
427	L	96.3	Very high	89.2	Confident	0 Å²	0	25.6 Å²	25.6	0%	0	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	116	176.6	179.5	64	0	0	0	110.7	L337 I338 V339 H403 V415 F419 I424 A429 F433	L337-L427 PolarHBondContact O-N 2.7Å; I338-L427 CarbonylContact C-O 3.49Å; I338-L427 WeakPolarHBondContact CA-O 3.34Å; I338-L427 HydrophobicContact CG1-CD2 4.41Å; V339-L427 PolarHBondContact N-O 3.45Å; H403-L427 HydrophobicContact CB-CD1 4.06Å; V415-L427 HydrophobicContact CG1-CD1 3.43Å; V415-L427 VanDerWaalsContact CG1-CD1 3.43Å; F419-L427 HydrophobicContact CD1-CD2 4.5Å; F419-L427 HydrophobicContact CD2-CB 3.87Å; F419-L427 HydrophobicContact CD2-CD2 3.81Å; F419-L427 HydrophobicContact CD2-CG 4.37Å; F419-L427 HydrophobicContact CE2-CB 3.82Å; F419-L427 HydrophobicContact CE2-CD2 4.03Å; F419-L427 HydrophobicContact CG-CD2 4.07Å; F419-L427 HydrophobicContact CZ-CD2 4.46Å; I424-L427 HydrophobicContact CG2-CB 4.17Å; L427-A429 HydrophobicContact CG-CB 4.36Å; L427-F433 HydrophobicContact CD2-CD1 4.26Å; L427-F433 HydrophobicContact CD2-CD2 4.15Å; L427-F433 HydrophobicContact CD2-CE1 3.76Å; L427-F433 HydrophobicContact CD2-CE2 3.62Å; L427-F433 HydrophobicContact CD2-CG 4.45Å; L427-F433 HydrophobicContact CD2-CZ 3.39Å
428	Y	95.8	Very high	88.5	Confident	0 Å²	0	28.3 Å²	28.3	0%	0	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.5	115.9	169.9	-71.5	-83.3	0	0	0	110.2	V339 Y350 A351 L354 I400 G401 I402 H403 V426	V339-Y428 HydrophobicContact CB-CD1 3.61Å; V339-Y428 HydrophobicContact CB-CE1 3.75Å; V339-Y428 HydrophobicContact CB-CG 4.35Å; V339-Y428 HydrophobicContact CG1-CD1 3.68Å; V339-Y428 HydrophobicContact CG1-CE1 3.6Å; V339-Y428 HydrophobicContact CG2-CD1 4.22Å; V339-Y428 HydrophobicContact CG2-CE1 3.96Å; V339-Y428 WeakPolarHBondContact O-CA 3.5Å; Y350-Y428 HydrophobicContact CD2-CE1 4.42Å; Y350-Y428 HydrophobicContact CG-CE1 4.11Å; A351-Y428 HydrophobicContact CB-CD2 3.75Å; A351-Y428 HydrophobicContact CB-CE2 4.1Å; A351-Y428 HydrophobicContact CB-CG 4.41Å; L354-Y428 HydrophobicContact CD1-CE2 3.82Å; L354-Y428 VanDerWaalsContact CD1-OH 3.24Å; L354-Y428 WeakPolarHBondContact CD1-OH 3.32Å; I400-Y428 HydrophobicContact CG2-CD2 4.17Å; I400-Y428 HydrophobicContact CG2-CE2 4.14Å; G401-Y428 PolarHBondContact O-N 3.35Å; I402-Y428 CarbonylContact C-O 3.57Å; I402-Y428 WeakPolarHBondContact CA-O 3.49Å; H403-Y428 PolarHBondContact N-O 2.98Å; V426-Y428 HydrophobicContact CG1-CD2 4.17Å; V426-Y428 HydrophobicContact CG1-CE2 3.68Å
429	A	95.1	Very high	88	Confident	0 Å²	0	29 Å²	29	0%	0	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.6	147.9	-171.7	0	0	0	0	0	113.9	I338 V339 F340 S341 H403 L427 F433	I338-A429 HydrophobicContact CG2-CB 4.25Å; V339-A429 PolarHBondContact O-N 3.41Å; F340-A429 VanDerWaalsContact CA-O 3.29Å; F340-A429 WeakPolarHBondContact CA-O 3.41Å; F340-A429 HydrophobicContact CD1-CB 4.3Å; F340-A429 HydrophobicContact CE1-CB 4.24Å; S341-A429 PolarHBondContact N-O 2.6Å; H403-A429 HydrophobicContact CB-CB 4.15Å; H403-A429 CarbonylContact O-C 3.52Å; H403-A429 VanDerWaalsContact O-CA 3.23Å; H403-A429 WeakPolarHBondContact O-CA 3.33Å; L427-A429 HydrophobicContact CG-CB 4.36Å; A429-F433 HydrophobicContact CB-CB 3.69Å; A429-F433 HydrophobicContact CB-CD1 4.34Å; A429-F433 HydrophobicContact CB-CG 3.99Å
430	T	92.6	Very high	87.8	Confident	17 Å²	17	30.8 Å²	30.8	10%	0.104	18%	0.178	C	C	.	.			trans	-79.4	164	163.3	51.8	0	0	0	0	111.7	S341 H403 H404 T432 F433	S341-T430 WeakPolarHBondContact O-CA 3.39Å; S341-T430 WeakPolarHBondContact O-CG2 3.36Å; H403-T430 PolarHBondContact O-N 2.82Å; H404-T430 WeakPolarHBondContact CA-OG1 3.41Å; H404-T430 HydrophobicContact CB-CG2 3.64Å; T430-T432 PolarHBondContact O-N 3.13Å; T430-T432 PolarHBondContact OG1-OG1 2.89Å; T430-F433 WeakPolarHBondContact O-CB 3.4Å; T430-F433 PolarHBondContact O-N 3.05Å
431	E	88.4	Confident	88	Confident	30 Å²	30	27.7 Å²	27.7	14%	0.14	15%	0.152	C	C	.	.	G	3₁₀ helix	trans	-49.6	-31.5	179.2	-178	176.2	-176	0	0	113.4	F342 F433 A434 M435 K451 M468	F342-E431 HydrophobicContact CD1-CB 4.29Å; F342-E431 HydrophobicContact CE1-CB 4.17Å; E431-F433 PolarHBondContact O-N 2.87Å; E431-A434 WeakPolarHBondContact O-CA 3.16Å; E431-A434 WeakPolarHBondContact O-CB 3.1Å; E431-A434 PolarHBondContact O-N 3.1Å; E431-M435 PolarHBondContact O-N 3Å; E431-K451 IonicContact OE1-NZ 3.68Å; E431-K451 PolarHBondContact OE1-NZ 2.87Å; E431-K451 WeakPolarHBondContact OE2-CD 3.37Å; E431-K451 IonicContact OE2-NZ 3.92Å; E431-K451 PolarHBondContact OE2-NZ 2.83Å; E431-M468 HydrophobicContact CB-SD 4.28Å; E431-M468 HydrophobicContact CG-CE 4.39Å; E431-M468 HydrophobicContact CG-CG 4.45Å; E431-M468 HydrophobicContact CG-SD 4.04Å
432	T	84.8	Confident	88.2	Confident	72 Å²	72	25 Å²	25	44%	0.442	14%	0.136	S	C	.	.	G	3₁₀ helix	trans	-54.5	-23.9	175.5	55.6	0	0	0	0	114.4	T430 M435	T430-T432 PolarHBondContact O-N 3.13Å; T430-T432 PolarHBondContact OG1-OG1 2.89Å; T432-M435 PolarHBondContact O-N 3.01Å
433	F	88.3	Confident	88.5	Confident	1 Å²	1	23.5 Å²	23.5	0%	0.004	12%	0.121	C	C	.	.	G	3₁₀ helix	trans	-73.4	-31	174.6	-174.1	-94.1	0	0	0	112.4	I338 F340 H403 E416 F419 L427 A429 T430 E431 M435 L437 M439	I338-F433 HydrophobicContact CD1-CD1 4.2Å; I338-F433 HydrophobicContact CD1-CE1 3.64Å; I338-F433 HydrophobicContact CG1-CE1 4.25Å; F340-F433 HydrophobicContact CE1-CB 4.25Å; F340-F433 HydrophobicContact CE1-CD1 4.46Å; F340-F433 HydrophobicContact CZ-CD1 4.47Å; H403-F433 HydrophobicContact CB-CD2 4.42Å; H403-F433 AromaticContact CD2-CD2 3.67Å; H403-F433 AromaticContact CE1-CD2 3.72Å; H403-F433 AromaticContact CG-CD2 3.73Å; H403-F433 AromaticContact ND1-CD2 3.8Å; H403-F433 AromaticContact NE2-CD2 3.64Å; E416-F433 HydrophobicContact CG-CE2 4.47Å; F419-F433 HydrophobicContact CD1-CZ 4.1Å; F419-F433 HydrophobicContact CE1-CZ 4.21Å; L427-F433 HydrophobicContact CD2-CD1 4.26Å; L427-F433 HydrophobicContact CD2-CD2 4.15Å; L427-F433 HydrophobicContact CD2-CE1 3.76Å; L427-F433 HydrophobicContact CD2-CE2 3.62Å; L427-F433 HydrophobicContact CD2-CG 4.45Å; L427-F433 HydrophobicContact CD2-CZ 3.39Å; A429-F433 HydrophobicContact CB-CB 3.69Å; A429-F433 HydrophobicContact CB-CD1 4.34Å; A429-F433 HydrophobicContact CB-CG 3.99Å; T430-F433 WeakPolarHBondContact O-CB 3.4Å; T430-F433 PolarHBondContact O-N 3.05Å; E431-F433 PolarHBondContact O-N 2.87Å; F433-M435 PolarHBondContact O-N 3.16Å; F433-L437 HydrophobicContact CD2-CD1 4.43Å; F433-M439 HydrophobicContact CE1-CB 4.13Å; F433-M439 HydrophobicContact CE2-CB 4.5Å; F433-M439 HydrophobicContact CE2-CE 3.61Å; F433-M439 HydrophobicContact CE2-SD 3.93Å; F433-M439 HydrophobicContact CZ-CB 3.62Å; F433-M439 HydrophobicContact CZ-CE 3.92Å; F433-M439 HydrophobicContact CZ-CG 4.36Å; F433-M439 HydrophobicContact CZ-SD 3.84Å
434	A	84.6	Confident	88.5	Confident	0 Å²	0	21.6 Å²	21.6	0%	0	11%	0.113	C	C	.	.	T	Hydrogen-bonded Turn	trans	-73.3	-13.2	172.8	0	0	0	0	0	112.5	F340 E431 M468 R471	F340-A434 HydrophobicContact CE1-CB 3.99Å; F340-A434 HydrophobicContact CZ-CB 3.73Å; E431-A434 WeakPolarHBondContact O-CA 3.16Å; E431-A434 WeakPolarHBondContact O-CB 3.1Å; E431-A434 PolarHBondContact O-N 3.1Å; A434-M468 HydrophobicContact CB-CB 4.27Å; A434-M468 HydrophobicContact CB-CG 3.6Å; A434-R471 HydrophobicContact CB-CG 4.35Å; A434-R471 PolarHBondContact O-NE 3.1Å; A434-R471 PolarHBondContact O-NH2 3.44Å
435	M	77.1	Confident	88.5	Confident	53 Å²	53	21.6 Å²	21.6	26%	0.261	11%	0.113	S	C	.	.	S	Bend	trans	-91.1	111.9	180	-61.3	179.3	82.5	0	0	109.9	I136 Y201 E431 T432 F433 L437	I136-M435 WeakPolarHBondContact CD1-O 3.49Å; Y201-M435 HydrophobicContact CE1-CE 3.46Å; Y201-M435 VanDerWaalsContact CE1-CE 3.46Å; Y201-M435 WeakPolarHBondContact OH-CB 3.24Å; Y201-M435 WeakPolarHBondContact OH-CE 3.23Å; E431-M435 PolarHBondContact O-N 3Å; T432-M435 PolarHBondContact O-N 3.01Å; F433-M435 PolarHBondContact O-N 3.16Å; M435-L437 VanDerWaalsContact C-N 3.34Å; M435-L437 PolarHBondContact O-N 2.71Å; M435-L437 VanDerWaalsContact O-N 3.14Å
436	G	65.3	Low	88.5	Confident	5 Å²	5	20 Å²	20	5%	0.052	11%	0.106	C	C	.	.	S	Bend	trans	72.7	1	162.7	0	0	0	0	0	118.6	L139	L139-G436 VanDerWaalsContact CB-O 3.29Å; L139-G436 WeakPolarHBondContact CB-O 3.39Å; L139-G436 VanDerWaalsContact CD1-O 3.23Å; L139-G436 WeakPolarHBondContact CD1-O 3.35Å; L139-G436 WeakPolarHBondContact CD2-O 3.49Å; L139-G436 WeakPolarHBondContact CG-O 3.34Å
437	L	70.6	Confident	88.3	Confident	6 Å²	6	20.8 Å²	20.8	3%	0.031	11%	0.111	C	C	.	.			trans	-104.8	140.5	173.6	-68.6	167.8	0	0	0	111.6	A138 E416 F433 M435 M439 R471	A138-L437 HydrophobicContact CB-CD2 4.09Å; E416-L437 WeakPolarHBondContact OE1-CD1 3.46Å; F433-L437 HydrophobicContact CD2-CD1 4.43Å; M435-L437 VanDerWaalsContact C-N 3.34Å; M435-L437 PolarHBondContact O-N 2.71Å; M435-L437 VanDerWaalsContact O-N 3.14Å; L437-M439 VanDerWaalsContact C-N 3.35Å; L437-M439 HydrophobicContact CB-CE 3.58Å; L437-M439 HydrophobicContact CD1-CE 3.57Å; L437-M439 HydrophobicContact CD2-CE 4.15Å; L437-M439 HydrophobicContact CG-CE 3.95Å; L437-M439 PolarHBondContact O-N 3.08Å; L437-R471 PolarHBondContact O-NH1 3.29Å
438	N	76.2	Confident	88	Confident	94 Å²	94	22.3 Å²	22.3	50%	0.503	12%	0.121	S	C	.	.			trans	-91	62.5	178.7	-172.1	26.4	0	0	0	112.4	P440	N438-P440 WeakPolarHBondContact O-CD 3.46Å
439	M	84.7	Confident	87.7	Confident	14 Å²	14	22.3 Å²	22.3	7%	0.069	12%	0.122	C	C	.	.			trans	-119.9	85	179.5	-79.2	-179.8	-83.4	0	0	111.5	E416 F419 F433 L437	E416-M439 HydrophobicContact CB-CE 3.79Å; E416-M439 HydrophobicContact CB-SD 3.9Å; E416-M439 HydrophobicContact CG-CE 3.74Å; E416-M439 HydrophobicContact CG-SD 4.33Å; F419-M439 HydrophobicContact CD1-CB 3.9Å; F419-M439 HydrophobicContact CD1-CG 4.18Å; F419-M439 HydrophobicContact CD1-SD 4.04Å; F419-M439 HydrophobicContact CE1-CB 3.95Å; F433-M439 HydrophobicContact CE1-CB 4.13Å; F433-M439 HydrophobicContact CE2-CB 4.5Å; F433-M439 HydrophobicContact CE2-CE 3.61Å; F433-M439 HydrophobicContact CE2-SD 3.93Å; F433-M439 HydrophobicContact CZ-CB 3.62Å; F433-M439 HydrophobicContact CZ-CE 3.92Å; F433-M439 HydrophobicContact CZ-CG 4.36Å; F433-M439 HydrophobicContact CZ-SD 3.84Å; L437-M439 VanDerWaalsContact C-N 3.35Å; L437-M439 HydrophobicContact CB-CE 3.58Å; L437-M439 HydrophobicContact CD1-CE 3.57Å; L437-M439 HydrophobicContact CD2-CE 4.15Å; L437-M439 HydrophobicContact CG-CE 3.95Å; L437-M439 PolarHBondContact O-N 3.08Å
440	P	89.7	Confident	87.5	Confident	49 Å²	49	26.2 Å²	26.2	32%	0.318	14%	0.136	S	C	.	.			trans	-78.1	148.6	177.7	31.8	-34	0	0	0	112	N438 R471 R474	N438-P440 WeakPolarHBondContact O-CD 3.46Å; P440-R471 CarbonylContact C-O 3.57Å; P440-R471 WeakPolarHBondContact CA-O 3.43Å; P440-R474 HydrophobicContact CB-CG 3.88Å; P440-R474 HydrophobicContact CG-CB 4.5Å; P440-R474 HydrophobicContact CG-CG 3.97Å
441	A	93.5	Very high	87.3	Confident	0 Å²	0	26.4 Å²	26.4	0%	0	14%	0.136	C	C	.	.	B	Isolated β-bridge	trans	-114.7	165.8	174.8	0	0	0	0	0	110.9	P336 I338 F419 S443 R471 A472 G473	P336-A441 HydrophobicContact CG-CB 4.4Å; P336-A441 WeakPolarHBondContact O-CB 3.44Å; I338-A441 HydrophobicContact CB-CB 4.43Å; I338-A441 HydrophobicContact CD1-CB 3.48Å; I338-A441 VanDerWaalsContact CD1-CB 3.48Å; I338-A441 HydrophobicContact CG1-CB 3.63Å; F419-A441 HydrophobicContact CZ-CB 4Å; A441-S443 WeakPolarHBondContact CB-O 3.38Å; A441-R471 PolarHBondContact N-O 3.37Å; A441-A472 CarbonylContact O-C 3.54Å; A441-A472 WeakPolarHBondContact O-CA 3.47Å; A441-G473 PolarHBondContact O-N 2.82Å
442	R	95.2	Very high	87.1	Confident	77 Å²	77	29.9 Å²	29.9	29%	0.291	15%	0.15	S	C	.	.	S	Bend	trans	-72.7	-38.3	169.6	-179	167.7	178.6	179.6	-9.2	110.7	N333 E335 P336 G473 D478 T482	N333-R442 PolarHBondContact O-NH1 3.43Å; N333-R442 PolarHBondContact O-NH2 3.35Å; E335-R442 WeakPolarHBondContact O-CB 3.43Å; E335-R442 WeakPolarHBondContact O-CD 3.46Å; P336-R442 PolarHBondContact O-N 3.37Å; R442-G473 PolarHBondContact O-N 2.9Å; R442-D478 WeakPolarHBondContact CA-OD2 3.47Å; R442-D478 WeakPolarHBondContact CD-OD1 3.12Å; R442-D478 WeakPolarHBondContact CG-OD1 3.34Å; R442-D478 IonicContact NE-OD1 3.96Å; R442-T482 PolarHBondContact O-N 2.92Å; R442-T482 VanDerWaalsContact O-N 3.1Å
443	S	97	Very high	86.7	Confident	0 Å²	0	30.4 Å²	30.4	0%	0	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	148.7	-176.7	-53.3	0	0	0	0	113.1	L334 P336 L337 I338 A441 T482	L334-S443 WeakPolarHBondContact CB-OG 3.18Å; L334-S443 WeakPolarHBondContact O-CB 3.24Å; L334-S443 PolarHBondContact O-OG 2.98Å; P336-S443 PolarHBondContact O-N 2.97Å; P336-S443 VanDerWaalsContact O-N 3.11Å; L337-S443 WeakPolarHBondContact CA-O 3.48Å; I338-S443 PolarHBondContact N-O 3.36Å; A441-S443 WeakPolarHBondContact CB-O 3.38Å; S443-T482 CarbonylContact C-O 3.53Å; S443-T482 WeakPolarHBondContact CA-O 3.31Å
444	V	96.4	Very high	86	Confident	0 Å²	0	33 Å²	33	0%	0	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	134.4	173.3	170.9	0	0	0	0	108.9	I338 F340 F446 R471 A472 T482 V483 I484	I338-V444 HydrophobicContact CB-CG2 4.42Å; I338-V444 CarbonylContact O-C 3.53Å; I338-V444 VanDerWaalsContact O-CA 3.31Å; I338-V444 WeakPolarHBondContact O-CA 3.32Å; F340-V444 HydrophobicContact CD2-CG1 3.54Å; F340-V444 HydrophobicContact CE2-CG1 3.68Å; F340-V444 HydrophobicContact CE2-CG2 4.39Å; V444-F446 HydrophobicContact CG1-CD2 4.17Å; V444-F446 HydrophobicContact CG1-CE2 3.73Å; V444-F446 HydrophobicContact CG1-CZ 4.22Å; V444-R471 HydrophobicContact CG2-CB 3.99Å; V444-A472 HydrophobicContact CB-CB 4.17Å; V444-A472 HydrophobicContact CG2-CB 3.78Å; V444-T482 PolarHBondContact N-O 3.26Å; V444-V483 CarbonylContact O-C 3.43Å; V444-V483 WeakPolarHBondContact O-CA 3.48Å; V444-I484 PolarHBondContact O-N 2.93Å
445	L	96.2	Very high	85.3	Confident	0 Å²	0	42.4 Å²	42.4	0%	0	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	126.6	176.7	171.2	63.5	0	0	0	110	L325 V326 L337 I338 V339 F340 I484 M486	L325-L445 HydrophobicContact CD2-CD1 3.35Å; L325-L445 HydrophobicContact CD2-CD2 3.92Å; L325-L445 HydrophobicContact CD2-CG 4.3Å; L325-L445 HydrophobicContact CG-CD1 4.26Å; L325-L445 HydrophobicContact CG-CD2 4.22Å; V326-L445 HydrophobicContact CG2-CD2 4.39Å; L337-L445 HydrophobicContact CD1-CB 3.85Å; I338-L445 PolarHBondContact O-N 3.01Å; V339-L445 CarbonylContact C-O 3.54Å; V339-L445 WeakPolarHBondContact CA-O 3.34Å; V339-L445 HydrophobicContact CG1-CB 4.39Å; V339-L445 HydrophobicContact CG1-CD2 3.91Å; V339-L445 HydrophobicContact CG1-CG 4.12Å; V339-L445 HydrophobicContact CG2-CB 4.23Å; V339-L445 HydrophobicContact CG2-CD2 4.01Å; F340-L445 PolarHBondContact N-O 3.3Å; L445-I484 CarbonylContact C-O 3.59Å; L445-I484 VanDerWaalsContact CA-O 3.27Å; L445-I484 WeakPolarHBondContact CA-O 3.25Å; L445-I484 HydrophobicContact CD1-CB 3.78Å; L445-I484 HydrophobicContact CD1-CG2 3.7Å; L445-M486 HydrophobicContact CD1-CG 3.95Å; L445-M486 HydrophobicContact CD1-SD 4.44Å
446	F	94.9	Very high	85.4	Confident	2 Å²	2	45.5 Å²	45.5	1%	0.009	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.3	122.4	171.5	-66.4	-97	0	0	0	109.9	F340 V444 L460 Y465 M468 V483 I484 M485 M486	F340-F446 HydrophobicContact CB-CD1 4.45Å; V444-F446 HydrophobicContact CG1-CD2 4.17Å; V444-F446 HydrophobicContact CG1-CE2 3.73Å; V444-F446 HydrophobicContact CG1-CZ 4.22Å; F446-L460 HydrophobicContact CD1-CD1 4.4Å; F446-Y465 AromaticContact CD2-CE2 3.95Å; F446-Y465 HydrophobicContact CD2-CE2 3.95Å; F446-Y465 AromaticContact CE1-CD2 3.97Å; F446-Y465 HydrophobicContact CE1-CD2 3.97Å; F446-Y465 HydrophobicContact CE1-CE2 4.3Å; F446-Y465 AromaticContact CE2-CD2 3.97Å; F446-Y465 HydrophobicContact CE2-CD2 3.97Å; F446-Y465 AromaticContact CE2-CE2 3.52Å; F446-Y465 HydrophobicContact CE2-CE2 3.52Å; F446-Y465 AromaticContact CZ-CD2 3.64Å; F446-Y465 HydrophobicContact CZ-CD2 3.64Å; F446-Y465 AromaticContact CZ-CE2 3.71Å; F446-Y465 HydrophobicContact CZ-CE2 3.71Å; F446-M468 HydrophobicContact CD1-SD 4.42Å; F446-M468 HydrophobicContact CE1-CB 3.57Å; F446-M468 HydrophobicContact CE1-CE 3.79Å; F446-M468 HydrophobicContact CE1-CG 4.26Å; F446-M468 HydrophobicContact CE1-SD 3.72Å; F446-M468 HydrophobicContact CZ-CB 3.51Å; F446-V483 HydrophobicContact CD2-CG1 4.09Å; F446-V483 HydrophobicContact CE2-CG1 3.64Å; F446-I484 PolarHBondContact N-O 3.27Å; F446-M485 HydrophobicContact CB-CG 4.48Å; F446-M486 WeakPolarHBondContact O-CB 3.31Å; F446-M486 WeakPolarHBondContact O-CG 3.48Å; F446-M486 PolarHBondContact O-N 3.28Å
447	T	92.3	Very high	86.2	Confident	16 Å²	16	52.2 Å²	52.2	10%	0.098	26%	0.258	C	S	.	.	S	Bend	trans	-79.5	-20.6	178.5	65.9	0	0	0	0	113.5	V339 F340 S341 Y350	V339-T447 HydrophobicContact CG1-CG2 3.42Å; V339-T447 VanDerWaalsContact CG1-CG2 3.42Å; F340-T447 PolarHBondContact O-N 2.87Å; F340-T447 PolarHBondContact O-OG1 3.26Å; S341-T447 WeakPolarHBondContact CA-OG1 3.38Å; S341-T447 WeakPolarHBondContact CB-OG1 3.37Å; S341-T447 PolarHBondContact OG-OG1 3.18Å; S341-T447 VanDerWaalsContact OG-OG1 3.14Å; Y350-T447 HydrophobicContact CD2-CG2 4.29Å; Y350-T447 HydrophobicContact CE2-CG2 3.97Å
448	S	90	Very high	87.1	Confident	32 Å²	32	56 Å²	56	22%	0.224	27%	0.272	C	S	.	.			trans	-150.9	158.3	178.7	-171.7	0	0	0	0	110.3	F342 R450	F342-S448 WeakPolarHBondContact CE2-O 3.16Å; S448-R450 PolarHBondContact OG-N 3.18Å; S448-R450 PolarHBondContact OG-O 3.34Å
449	T	90	Very high	87.8	Confident	1 Å²	1	53.6 Å²	53.6	1%	0.006	26%	0.259	C	S	.	.	S	Bend	trans	-97.7	-6.2	174.3	56.1	0	0	0	0	113	L459 L460 M485 L487 I491 L499	T449-L459 WeakPolarHBondContact O-CD1 3.43Å; T449-L460 WeakPolarHBondContact O-CG 2.9Å; T449-L460 PolarHBondContact O-N 2.84Å; T449-L460 VanDerWaalsContact O-N 3.09Å; T449-M485 HydrophobicContact CG2-CG 3.99Å; T449-M485 HydrophobicContact CG2-SD 3.74Å; T449-L487 HydrophobicContact CG2-CD2 4Å; T449-I491 HydrophobicContact CG2-CD1 3.91Å; T449-L499 HydrophobicContact CG2-CD2 4.35Å
450	R	89.8	Confident	88.1	Confident	81 Å²	81	53.1 Å²	53.1	31%	0.306	26%	0.257	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121	147.8	-176.1	-62.7	178.6	173.5	-149.3	-4.7	110.8	F342 S448 R458 L459 R490	F342-R450 WeakPolarHBondContact CD2-O 3.23Å; S448-R450 PolarHBondContact OG-N 3.18Å; S448-R450 PolarHBondContact OG-O 3.34Å; R450-R458 CarbonylContact C-O 3.45Å; R450-R458 VanDerWaalsContact CA-O 3.25Å; R450-R458 WeakPolarHBondContact CA-O 3.23Å; R450-L459 HydrophobicContact CG-CD1 4.45Å; R450-R490 PolarHBondContact NH2-O 2.94Å
451	K	88.9	Confident	88	Confident	22 Å²	22	52.1 Å²	52.1	10%	0.096	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.9	155.9	173.9	70.9	171.9	176.6	177.9	0	111.8	F342 E431 F457 R458 L460 E464	F342-K451 HydrophobicContact CB-CB 3.89Å; F342-K451 HydrophobicContact CD1-CB 3.93Å; F342-K451 HydrophobicContact CD1-CD 4.24Å; F342-K451 HydrophobicContact CD2-CB 4Å; F342-K451 HydrophobicContact CG-CB 3.64Å; E431-K451 IonicContact OE1-NZ 3.68Å; E431-K451 PolarHBondContact OE1-NZ 2.87Å; E431-K451 WeakPolarHBondContact OE2-CD 3.37Å; E431-K451 IonicContact OE2-NZ 3.92Å; E431-K451 PolarHBondContact OE2-NZ 2.83Å; K451-F457 CarbonylContact O-C 3.54Å; K451-F457 WeakPolarHBondContact O-CA 3.19Å; K451-R458 PolarHBondContact N-O 3.05Å; K451-R458 PolarHBondContact O-N 2.76Å; K451-L460 HydrophobicContact CB-CD2 4.26Å; K451-L460 HydrophobicContact CD-CD2 3.72Å; K451-L460 HydrophobicContact CG-CD2 3.89Å; K451-E464 VanDerWaalsContact CE-CD 3.48Å; K451-E464 WeakPolarHBondContact CE-OE1 3.37Å; K451-E464 WeakPolarHBondContact CE-OE2 3.37Å; K451-E464 IonicContact NZ-OE1 3.34Å; K451-E464 PolarHBondContact NZ-OE1 3.42Å; K451-E464 IonicContact NZ-OE2 3.79Å
452	F	83.8	Confident	87.8	Confident	102 Å²	102	53.1 Å²	53.1	45%	0.447	26%	0.257	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.5	124.7	172.9	-173.1	-113	0	0	0	109.4	G454 R455 F457	F452-G454 WeakPolarHBondContact CZ-O 3.39Å; F452-R455 WeakPolarHBondContact CE2-O 3.37Å; F452-F457 HydrophobicContact CB-CD1 4.07Å; F452-F457 HydrophobicContact CB-CE1 3.78Å; F452-F457 HydrophobicContact CB-CE2 4.23Å; F452-F457 HydrophobicContact CB-CG 4.44Å; F452-F457 HydrophobicContact CB-CZ 3.87Å; F452-F457 AromaticContact CD2-CD2 3.77Å; F452-F457 HydrophobicContact CD2-CD2 3.77Å; F452-F457 AromaticContact CD2-CE2 3.71Å; F452-F457 HydrophobicContact CD2-CE2 3.71Å; F452-F457 HydrophobicContact CD2-CG 4.3Å; F452-F457 HydrophobicContact CD2-CZ 4.21Å; F452-F457 HydrophobicContact CE2-CE2 4.47Å; F452-F457 HydrophobicContact CG-CE2 4.26Å; F452-F457 HydrophobicContact CG-CZ 4.3Å
453	D	76.9	Confident	87.3	Confident	84 Å²	84	50.3 Å²	50.3	45%	0.449	25%	0.252	S	S	.	.			trans	-97.5	9.6	-179.4	69.2	1.2	0	0	0	113.9	R455 D456 R458	D453-R455 PolarHBondContact OD1-N 3.03Å; D453-D456 PolarHBondContact N-O 3.1Å; D453-D456 VanDerWaalsContact N-O 3.14Å; D453-D456 PolarHBondContact OD1-N 2.96Å; D453-D456 VanDerWaalsContact OD1-O 3.11Å; D453-R458 HydrophobicContact CB-CG 4.43Å; D453-R458 IonicContact OD2-NE 3.64Å
454	G	72.5	Confident	86.9	Confident	54 Å²	54	51.7 Å²	51.7	56%	0.557	26%	0.259	S	S	*	.	S	Bend	trans	101.9	-20.9	-174.6	0	0	0	0	0	113.4	F452	F452-G454 WeakPolarHBondContact CZ-O 3.39Å
455	R	70.9	Confident	86.7	Confident	199 Å²	199	51.9 Å²	51.9	75%	0.751	26%	0.259	S	S	*	.	S	Bend	trans	-118.8	-53.6	177.7	-62.9	-178	-176.8	-179.8	1.3	111.4	F452 D453	F452-R455 WeakPolarHBondContact CE2-O 3.37Å; D453-R455 PolarHBondContact OD1-N 3.03Å
456	D	79.3	Confident	86.3	Confident	118 Å²	118	54.1 Å²	54.1	63%	0.631	27%	0.271	S	S	*	.	S	Bend	trans	-134.2	159.5	-174.2	-70.2	-52.3	0	0	0	112	D453 R458	D453-D456 PolarHBondContact N-O 3.1Å; D453-D456 VanDerWaalsContact N-O 3.14Å; D453-D456 PolarHBondContact OD1-N 2.96Å; D453-D456 VanDerWaalsContact OD1-O 3.11Å; D456-R458 PolarHBondContact O-N 2.94Å
457	F	82.6	Confident	85.9	Confident	145 Å²	145	56 Å²	56	64%	0.636	28%	0.28	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-83.3	101.2	168.1	-81.8	-89.7	0	0	0	109.6	K451 F452	K451-F457 CarbonylContact O-C 3.54Å; K451-F457 WeakPolarHBondContact O-CA 3.19Å; F452-F457 HydrophobicContact CB-CD1 4.07Å; F452-F457 HydrophobicContact CB-CE1 3.78Å; F452-F457 HydrophobicContact CB-CE2 4.23Å; F452-F457 HydrophobicContact CB-CG 4.44Å; F452-F457 HydrophobicContact CB-CZ 3.87Å; F452-F457 AromaticContact CD2-CD2 3.77Å; F452-F457 HydrophobicContact CD2-CD2 3.77Å; F452-F457 AromaticContact CD2-CE2 3.71Å; F452-F457 HydrophobicContact CD2-CE2 3.71Å; F452-F457 HydrophobicContact CD2-CG 4.3Å; F452-F457 HydrophobicContact CD2-CZ 4.21Å; F452-F457 HydrophobicContact CE2-CE2 4.47Å; F452-F457 HydrophobicContact CG-CE2 4.26Å; F452-F457 HydrophobicContact CG-CZ 4.3Å
458	R	89.2	Confident	85.9	Confident	85 Å²	85	55.2 Å²	55.2	32%	0.321	28%	0.275	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101	159.1	177.8	67.4	169.4	-179.3	83.4	-6.8	112.5	R450 K451 D453 D456 E464	R450-R458 CarbonylContact C-O 3.45Å; R450-R458 VanDerWaalsContact CA-O 3.25Å; R450-R458 WeakPolarHBondContact CA-O 3.23Å; K451-R458 PolarHBondContact N-O 3.05Å; K451-R458 PolarHBondContact O-N 2.76Å; D453-R458 HydrophobicContact CB-CG 4.43Å; D453-R458 IonicContact OD2-NE 3.64Å; D456-R458 PolarHBondContact O-N 2.94Å; R458-E464 IonicContact CZ-OE1 2.72Å; R458-E464 IonicContact CZ-OE2 2.86Å; R458-E464 IonicContact NH1-OE1 3.35Å; R458-E464 IonicContact NH1-OE2 3.49Å; R458-E464 PolarHBondContact NH1-OE2 2.95Å; R458-E464 IonicContact NH2-OE1 3.46Å; R458-E464 PolarHBondContact NH2-OE1 3.36Å; R458-E464 IonicContact NH2-OE2 3.99Å
459	L	90.5	Very high	86	Confident	45 Å²	45	53.9 Å²	53.9	24%	0.236	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.5	147.2	167.3	-166.1	73.2	0	0	0	109.9	T449 R450 I491 E495	T449-L459 WeakPolarHBondContact O-CD1 3.43Å; R450-L459 HydrophobicContact CG-CD1 4.45Å; L459-I491 HydrophobicContact CD1-CD1 3.61Å; L459-I491 HydrophobicContact CD1-CG1 4.14Å; L459-E495 HydrophobicContact CD2-CB 3.86Å; L459-E495 HydrophobicContact CD2-CG 4.16Å
460	L	90.6	Very high	85.9	Confident	4 Å²	4	54.4 Å²	54.4	2%	0.021	27%	0.271	C	S	.	.	P	Polyproline II helix	trans	-59	141.3	167.2	-65.1	169.4	0	0	0	110.3	F342 F446 T449 K451 E464 M468 L499	F342-L460 HydrophobicContact CE1-CD1 4.5Å; F342-L460 HydrophobicContact CE1-CD2 3.75Å; F342-L460 HydrophobicContact CE2-CD1 3.83Å; F342-L460 HydrophobicContact CE2-CD2 4.08Å; F342-L460 HydrophobicContact CE2-CG 4.3Å; F342-L460 HydrophobicContact CZ-CD1 3.49Å; F342-L460 VanDerWaalsContact CZ-CD1 3.49Å; F342-L460 HydrophobicContact CZ-CD2 3.51Å; F342-L460 HydrophobicContact CZ-CG 4.02Å; F446-L460 HydrophobicContact CD1-CD1 4.4Å; T449-L460 WeakPolarHBondContact O-CG 2.9Å; T449-L460 PolarHBondContact O-N 2.84Å; T449-L460 VanDerWaalsContact O-N 3.09Å; K451-L460 HydrophobicContact CB-CD2 4.26Å; K451-L460 HydrophobicContact CD-CD2 3.72Å; K451-L460 HydrophobicContact CG-CD2 3.89Å; L460-E464 WeakPolarHBondContact CA-OE2 3.29Å; L460-M468 HydrophobicContact CD1-CE 4.1Å; L460-M468 HydrophobicContact CD2-CE 4Å; L460-L499 HydrophobicContact CB-CD1 3.94Å; L460-L499 WeakPolarHBondContact O-CD1 3.46Å
461	S	87.8	Confident	86	Confident	27 Å²	27	51.1 Å²	51.1	19%	0.189	26%	0.259	C	S	.	.	P	Polyproline II helix	trans	-73	155.4	170.4	86.2	0	0	0	0	110.3	G463 E464 Y465 D505	S461-G463 PolarHBondContact O-N 3.36Å; S461-G463 PolarHBondContact OG-N 2.84Å; S461-E464 PolarHBondContact N-OE2 3.03Å; S461-E464 PolarHBondContact O-N 2.85Å; S461-E464 WeakPolarHBondContact OG-CG 3.48Å; S461-E464 PolarHBondContact OG-N 2.96Å; S461-E464 VanDerWaalsContact OG-N 3.13Å; S461-Y465 PolarHBondContact O-N 3.49Å; S461-D505 PolarHBondContact OG-OD2 3.34Å
462	P	88.7	Confident	86.2	Confident	21 Å²	21	50.1 Å²	50.1	14%	0.136	25%	0.254	C	S	.	.	H	α-helix	trans	-54.2	-38.7	170.2	-27.5	36.8	0	0	0	112.9	Y465 I466	P462-Y465 PolarHBondContact O-N 3.1Å; P462-I466 WeakPolarHBondContact O-CB 3.4Å; P462-I466 VanDerWaalsContact O-CG1 3.23Å; P462-I466 WeakPolarHBondContact O-CG1 3.36Å; P462-I466 PolarHBondContact O-N 2.96Å
463	G	85.5	Confident	86.5	Confident	18 Å²	18	45.3 Å²	45.3	19%	0.186	23%	0.234	C	C	.	.	H	α-helix	trans	-60.4	-46.6	175.3	0	0	0	0	0	113.5	S461 Y465 I466 Q467 D505	S461-G463 PolarHBondContact O-N 3.36Å; S461-G463 PolarHBondContact OG-N 2.84Å; G463-Y465 VanDerWaalsContact C-N 3.33Å; G463-Y465 PolarHBondContact O-N 3.02Å; G463-I466 PolarHBondContact O-N 3.26Å; G463-Q467 PolarHBondContact O-N 3.29Å; G463-D505 WeakPolarHBondContact CA-OD2 3.31Å; G463-D505 PolarHBondContact N-OD2 2.95Å
464	E	87.5	Confident	87.2	Confident	30 Å²	30	43.7 Å²	43.7	14%	0.14	22%	0.222	C	C	.	.	H	α-helix	trans	-60.9	-42.5	176.4	-68	169.4	156.2	0	0	111.1	K451 R458 L460 S461 Q467 M468	K451-E464 VanDerWaalsContact CE-CD 3.48Å; K451-E464 WeakPolarHBondContact CE-OE1 3.37Å; K451-E464 WeakPolarHBondContact CE-OE2 3.37Å; K451-E464 IonicContact NZ-OE1 3.34Å; K451-E464 PolarHBondContact NZ-OE1 3.42Å; K451-E464 IonicContact NZ-OE2 3.79Å; R458-E464 IonicContact CZ-OE1 2.72Å; R458-E464 IonicContact CZ-OE2 2.86Å; R458-E464 IonicContact NH1-OE1 3.35Å; R458-E464 IonicContact NH1-OE2 3.49Å; R458-E464 PolarHBondContact NH1-OE2 2.95Å; R458-E464 IonicContact NH2-OE1 3.46Å; R458-E464 PolarHBondContact NH2-OE1 3.36Å; R458-E464 IonicContact NH2-OE2 3.99Å; L460-E464 WeakPolarHBondContact CA-OE2 3.29Å; S461-E464 PolarHBondContact N-OE2 3.03Å; S461-E464 PolarHBondContact O-N 2.85Å; S461-E464 WeakPolarHBondContact OG-CG 3.48Å; S461-E464 PolarHBondContact OG-N 2.96Å; S461-E464 VanDerWaalsContact OG-N 3.13Å; E464-Q467 PolarHBondContact O-N 3.42Å; E464-M468 HydrophobicContact CB-CE 4.17Å; E464-M468 VanDerWaalsContact O-CE 3.3Å; E464-M468 WeakPolarHBondContact O-CE 3.3Å; E464-M468 PolarHBondContact O-N 2.9Å; E464-M468 VanDerWaalsContact O-N 3.1Å
465	Y	92.1	Very high	87.8	Confident	3 Å²	3	46.9 Å²	46.9	1%	0.012	22%	0.217	C	C	.	.	H	α-helix	trans	-63.6	-45.6	176	-177.8	-102.3	0	0	0	112.6	H263 F446 S461 P462 G463 Q467 M468 S469 V483 M485 L499 L500	H263-Y465 AromaticContact CE1-CE1 3.73Å; H263-Y465 AromaticContact ND1-CE1 3.64Å; H263-Y465 AromaticContact ND1-CZ 3.64Å; H263-Y465 PolarHBondContact ND1-OH 2.82Å; F446-Y465 AromaticContact CD2-CE2 3.95Å; F446-Y465 HydrophobicContact CD2-CE2 3.95Å; F446-Y465 AromaticContact CE1-CD2 3.97Å; F446-Y465 HydrophobicContact CE1-CD2 3.97Å; F446-Y465 HydrophobicContact CE1-CE2 4.3Å; F446-Y465 AromaticContact CE2-CD2 3.97Å; F446-Y465 HydrophobicContact CE2-CD2 3.97Å; F446-Y465 AromaticContact CE2-CE2 3.52Å; F446-Y465 HydrophobicContact CE2-CE2 3.52Å; F446-Y465 AromaticContact CZ-CD2 3.64Å; F446-Y465 HydrophobicContact CZ-CD2 3.64Å; F446-Y465 AromaticContact CZ-CE2 3.71Å; F446-Y465 HydrophobicContact CZ-CE2 3.71Å; S461-Y465 PolarHBondContact O-N 3.49Å; P462-Y465 PolarHBondContact O-N 3.1Å; G463-Y465 VanDerWaalsContact C-N 3.33Å; G463-Y465 PolarHBondContact O-N 3.02Å; Y465-Q467 VanDerWaalsContact C-N 3.31Å; Y465-Q467 PolarHBondContact O-N 3.28Å; Y465-M468 PolarHBondContact O-N 3.45Å; Y465-S469 WeakPolarHBondContact O-CB 3.43Å; Y465-S469 PolarHBondContact O-N 2.97Å; Y465-S469 PolarHBondContact O-OG 2.89Å; Y465-V483 WeakPolarHBondContact OH-CG1 3.42Å; Y465-M485 HydrophobicContact CE2-SD 4.44Å; Y465-L499 VanDerWaalsContact CD1-O 3.26Å; Y465-L499 WeakPolarHBondContact CD1-O 3.44Å; Y465-L499 HydrophobicContact CD2-CD1 4.34Å; Y465-L499 HydrophobicContact CD2-CD2 4.31Å; Y465-L499 HydrophobicContact CD2-CG 4.06Å; Y465-L499 HydrophobicContact CG-CD1 4.05Å; Y465-L499 HydrophobicContact CG-CG 4.02Å; Y465-L500 HydrophobicContact CE1-CD2 4.27Å; Y465-L500 WeakPolarHBondContact OH-CD2 3.38Å
466	I	89	Confident	88.5	Confident	47 Å²	47	41.4 Å²	41.4	24%	0.241	22%	0.222	C	C	.	.	H	α-helix	trans	-61.5	-39.8	177.6	-70.6	165.6	0	0	0	110.8	P462 G463 S469 G470 P504	P462-I466 WeakPolarHBondContact O-CB 3.4Å; P462-I466 VanDerWaalsContact O-CG1 3.23Å; P462-I466 WeakPolarHBondContact O-CG1 3.36Å; P462-I466 PolarHBondContact O-N 2.96Å; G463-I466 PolarHBondContact O-N 3.26Å; I466-S469 WeakPolarHBondContact CA-OG 3.12Å; I466-S469 PolarHBondContact O-OG 2.71Å; I466-G470 WeakPolarHBondContact O-CA 3.4Å; I466-G470 PolarHBondContact O-N 2.67Å; I466-P504 HydrophobicContact CD1-CG 4.18Å
467	Q	86.7	Confident	88.9	Confident	42 Å²	42	43.6 Å²	43.6	20%	0.196	23%	0.226	C	C	.	.	H	α-helix	trans	-65.8	-46.7	178.9	-168.6	179	24	0	0	112.2	G463 E464 Y465	G463-Q467 PolarHBondContact O-N 3.29Å; E464-Q467 PolarHBondContact O-N 3.42Å; Y465-Q467 VanDerWaalsContact C-N 3.31Å; Y465-Q467 PolarHBondContact O-N 3.28Å
468	M	91	Very high	89.3	Confident	0 Å²	0	37.5 Å²	37.5	0%	0	20%	0.2	C	C	.	.	H	α-helix	trans	-70.2	-47.4	178.8	-75.1	-176.3	-82.7	0	0	112.5	F340 F342 E431 A434 F446 L460 E464 Y465 G470 R471	F340-M468 HydrophobicContact CB-SD 4.33Å; F340-M468 HydrophobicContact CD1-SD 4.31Å; F340-M468 HydrophobicContact CD2-CB 3.98Å; F340-M468 HydrophobicContact CD2-CG 4.24Å; F340-M468 HydrophobicContact CD2-SD 4.28Å; F340-M468 HydrophobicContact CE2-CB 3.85Å; F340-M468 HydrophobicContact CE2-CG 4.17Å; F340-M468 HydrophobicContact CG-CG 4.46Å; F340-M468 HydrophobicContact CG-SD 4.06Å; F340-M468 HydrophobicContact CZ-CB 4.4Å; F340-M468 HydrophobicContact CZ-CG 4.32Å; F342-M468 HydrophobicContact CE1-CE 3.91Å; F342-M468 HydrophobicContact CE1-SD 3.86Å; F342-M468 HydrophobicContact CZ-CE 3.94Å; F342-M468 HydrophobicContact CZ-SD 4.05Å; E431-M468 HydrophobicContact CB-SD 4.28Å; E431-M468 HydrophobicContact CG-CE 4.39Å; E431-M468 HydrophobicContact CG-CG 4.45Å; E431-M468 HydrophobicContact CG-SD 4.04Å; A434-M468 HydrophobicContact CB-CB 4.27Å; A434-M468 HydrophobicContact CB-CG 3.6Å; F446-M468 HydrophobicContact CD1-SD 4.42Å; F446-M468 HydrophobicContact CE1-CB 3.57Å; F446-M468 HydrophobicContact CE1-CE 3.79Å; F446-M468 HydrophobicContact CE1-CG 4.26Å; F446-M468 HydrophobicContact CE1-SD 3.72Å; F446-M468 HydrophobicContact CZ-CB 3.51Å; L460-M468 HydrophobicContact CD1-CE 4.1Å; L460-M468 HydrophobicContact CD2-CE 4Å; E464-M468 HydrophobicContact CB-CE 4.17Å; E464-M468 VanDerWaalsContact O-CE 3.3Å; E464-M468 WeakPolarHBondContact O-CE 3.3Å; E464-M468 PolarHBondContact O-N 2.9Å; E464-M468 VanDerWaalsContact O-N 3.1Å; Y465-M468 PolarHBondContact O-N 3.45Å; M468-G470 PolarHBondContact O-N 2.98Å; M468-R471 WeakPolarHBondContact O-CB 3.32Å; M468-R471 WeakPolarHBondContact O-CG 3.42Å; M468-R471 PolarHBondContact O-N 3.43Å; M468-R471 VanDerWaalsContact O-N 3.16Å
469	S	92.2	Very high	89.4	Confident	4 Å²	4	39.4 Å²	39.4	3%	0.028	22%	0.221	C	C	.	.	H	α-helix	trans	-65.9	-28.2	177.8	63.5	0	0	0	0	112.2	Y465 I466 R471 A472	Y465-S469 WeakPolarHBondContact O-CB 3.43Å; Y465-S469 PolarHBondContact O-N 2.97Å; Y465-S469 PolarHBondContact O-OG 2.89Å; I466-S469 WeakPolarHBondContact CA-OG 3.12Å; I466-S469 PolarHBondContact O-OG 2.71Å; S469-R471 PolarHBondContact O-N 3.16Å; S469-A472 WeakPolarHBondContact O-CB 3.48Å; S469-A472 PolarHBondContact O-N 3.43Å
470	G	88.3	Confident	89.5	Confident	11 Å²	11	42 Å²	42	11%	0.113	23%	0.228	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.6	-10	172.9	0	0	0	0	0	114.7	R257 I466 M468	R257-G470 PolarHBondContact NH2-O 3.22Å; I466-G470 WeakPolarHBondContact O-CA 3.4Å; I466-G470 PolarHBondContact O-N 2.67Å; M468-G470 PolarHBondContact O-N 2.98Å
471	R	90.9	Very high	89.7	Confident	13 Å²	13	41.8 Å²	41.8	5%	0.049	23%	0.227	C	C	.	.	T	Hydrogen-bonded Turn	trans	-80.2	-14.9	172.5	-56.2	-66.2	162.2	-174.9	3.2	113.7	I338 F340 A434 L437 P440 A441 V444 M468 S469	I338-R471 HydrophobicContact CD1-CB 4.15Å; F340-R471 HydrophobicContact CZ-CG 4.41Å; A434-R471 HydrophobicContact CB-CG 4.35Å; A434-R471 PolarHBondContact O-NE 3.1Å; A434-R471 PolarHBondContact O-NH2 3.44Å; L437-R471 PolarHBondContact O-NH1 3.29Å; P440-R471 CarbonylContact C-O 3.57Å; P440-R471 WeakPolarHBondContact CA-O 3.43Å; A441-R471 PolarHBondContact N-O 3.37Å; V444-R471 HydrophobicContact CG2-CB 3.99Å; M468-R471 WeakPolarHBondContact O-CB 3.32Å; M468-R471 WeakPolarHBondContact O-CG 3.42Å; M468-R471 PolarHBondContact O-N 3.43Å; M468-R471 VanDerWaalsContact O-N 3.16Å; S469-R471 PolarHBondContact O-N 3.16Å
472	A	93.2	Very high	90.1	Very high	0 Å²	0	40.6 Å²	40.6	0%	0	22%	0.219	C	C	.	.	B	Isolated β-bridge	trans	-81.5	139	178.3	0	0	0	0	0	112.7	R257 L261 A441 V444 S469 V483	R257-A472 PolarHBondContact NH1-O 3.05Å; R257-A472 PolarHBondContact NH2-O 3.09Å; L261-A472 HydrophobicContact CD2-CB 3.83Å; L261-A472 VanDerWaalsContact CD2-O 3.31Å; L261-A472 WeakPolarHBondContact CD2-O 3.38Å; A441-A472 CarbonylContact O-C 3.54Å; A441-A472 WeakPolarHBondContact O-CA 3.47Å; V444-A472 HydrophobicContact CB-CB 4.17Å; V444-A472 HydrophobicContact CG2-CB 3.78Å; S469-A472 WeakPolarHBondContact O-CB 3.48Å; S469-A472 PolarHBondContact O-N 3.43Å; A472-V483 HydrophobicContact CB-CG2 3.86Å
473	G	91.8	Very high	90.5	Very high	2 Å²	2	39.6 Å²	39.6	2%	0.021	21%	0.212	C	C	.	.	S	Bend	trans	84.4	109.5	-179.1	0	0	0	0	0	113.1	A441 R442	A441-G473 PolarHBondContact O-N 2.82Å; R442-G473 PolarHBondContact O-N 2.9Å
474	R	90	Very high	91	Very high	50 Å²	50	38.8 Å²	38.8	19%	0.189	20%	0.203	C	C	.	.			trans	-93.7	121.2	-179.6	-59	168.4	-66	176.4	0.8	110.2	P336 P440 G476 K477 D478	P336-R474 VanDerWaalsContact CD-CZ 3.47Å; P440-R474 HydrophobicContact CB-CG 3.88Å; P440-R474 HydrophobicContact CG-CB 4.5Å; P440-R474 HydrophobicContact CG-CG 3.97Å; R474-G476 PolarHBondContact O-N 3.25Å; R474-K477 HydrophobicContact CB-CB 4.01Å; R474-K477 HydrophobicContact CB-CD 4.49Å; R474-K477 PolarHBondContact O-N 2.96Å; R474-D478 VanDerWaalsContact CB-OD2 3.23Å; R474-D478 WeakPolarHBondContact CB-OD2 3.3Å; R474-D478 VanDerWaalsContact CG-OD2 3.31Å; R474-D478 WeakPolarHBondContact CG-OD2 3.48Å; R474-D478 IonicContact CZ-OD1 3.5Å; R474-D478 IonicContact CZ-OD2 2.78Å; R474-D478 PolarHBondContact N-OD2 3.45Å; R474-D478 IonicContact NE-OD1 2.63Å; R474-D478 PolarHBondContact NE-OD1 3.16Å; R474-D478 IonicContact NE-OD2 2.98Å; R474-D478 PolarHBondContact NE-OD2 3.35Å; R474-D478 IonicContact NH2-OD1 3.88Å; R474-D478 PolarHBondContact NH2-OD1 3.13Å; R474-D478 IonicContact NH2-OD2 3.1Å; R474-D478 PolarHBondContact O-N 2.93Å
475	R	86.7	Confident	91.3	Very high	121 Å²	121	37.4 Å²	37.4	46%	0.457	20%	0.197	S	C	.	.	T	Hydrogen-bonded Turn	trans	-55.2	127.3	178	-170.4	176.2	-177.5	160.1	3.6	109.6	D86 A110 P258 V259 K477	D86-R475 IonicContact OD1-NH2 2.8Å; D86-R475 IonicContact OD2-CZ 2.72Å; D86-R475 IonicContact OD2-NH1 3.66Å; D86-R475 IonicContact OD2-NH2 3.97Å; D86-R475 PolarHBondContact OD2-NH2 3.33Å; A110-R475 PolarHBondContact O-NH1 3.21Å; P258-R475 HydrophobicContact CB-CG 4.22Å; V259-R475 HydrophobicContact CG2-CB 4.47Å; R475-K477 VanDerWaalsContact C-N 3.28Å; R475-K477 PolarHBondContact O-N 3.35Å
476	G	84.9	Confident	91.3	Very high	84 Å²	84	37.9 Å²	37.9	87%	0.866	20%	0.199	S	C	*	.	T	Hydrogen-bonded Turn	trans	80	-9.8	-179.5	0	0	0	0	0	116.2	R474	R474-G476 PolarHBondContact O-N 3.25Å
477	K	87.5	Confident	91.2	Very high	163 Å²	163	35.7 Å²	35.7	71%	0.709	19%	0.188	S	C	*	.	T	Hydrogen-bonded Turn	trans	-112.9	-37.6	177.3	-61.8	-176.6	179.2	-178.6	0	113	R474 R475	R474-K477 HydrophobicContact CB-CB 4.01Å; R474-K477 HydrophobicContact CB-CD 4.49Å; R474-K477 PolarHBondContact O-N 2.96Å; R475-K477 VanDerWaalsContact C-N 3.28Å; R475-K477 PolarHBondContact O-N 3.35Å
478	D	91.9	Very high	90.9	Very high	17 Å²	17	35.1 Å²	35.1	9%	0.091	19%	0.187	C	C	.	.			trans	-114.7	139.3	-177.3	-52.5	-47.6	0	0	0	110.9	R442 R474 R480	R442-D478 WeakPolarHBondContact CA-OD2 3.47Å; R442-D478 WeakPolarHBondContact CD-OD1 3.12Å; R442-D478 WeakPolarHBondContact CG-OD1 3.34Å; R442-D478 IonicContact NE-OD1 3.96Å; R474-D478 VanDerWaalsContact CB-OD2 3.23Å; R474-D478 WeakPolarHBondContact CB-OD2 3.3Å; R474-D478 VanDerWaalsContact CG-OD2 3.31Å; R474-D478 WeakPolarHBondContact CG-OD2 3.48Å; R474-D478 IonicContact CZ-OD1 3.5Å; R474-D478 IonicContact CZ-OD2 2.78Å; R474-D478 PolarHBondContact N-OD2 3.45Å; R474-D478 IonicContact NE-OD1 2.63Å; R474-D478 PolarHBondContact NE-OD1 3.16Å; R474-D478 IonicContact NE-OD2 2.98Å; R474-D478 PolarHBondContact NE-OD2 3.35Å; R474-D478 IonicContact NH2-OD1 3.88Å; R474-D478 PolarHBondContact NH2-OD1 3.13Å; R474-D478 IonicContact NH2-OD2 3.1Å; R474-D478 PolarHBondContact O-N 2.93Å; D478-R480 VanDerWaalsContact C-N 3.32Å
479	T	91	Very high	90.1	Very high	126 Å²	126	40.5 Å²	40.5	77%	0.773	22%	0.215	S	C	*	.	S	Bend	trans	-77.3	-22.5	172.3	55.1	0	0	0	0	112.5	P260	P260-T479 WeakPolarHBondContact CD-O 3.3Å
480	R	92.9	Very high	89.4	Confident	98 Å²	98	48 Å²	48	37%	0.37	24%	0.243	S	C	.	.	S	Bend	trans	-155.1	146.6	-179.7	66.8	-164.9	-171.4	-168.3	-0.7	110.6	P260 Q262 D478	P260-R480 CarbonylContact O-C 3.54Å; P260-R480 WeakPolarHBondContact O-CA 3.5Å; Q262-R480 VanDerWaalsContact OE1-NE 3.14Å; D478-R480 VanDerWaalsContact C-N 3.32Å
481	G	94.5	Very high	89	Confident	0 Å²	0	48.2 Å²	48.2	0%	0	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.5	135.2	168.6	0	0	0	0	0	110.8	P260 L261 Q262	P260-G481 PolarHBondContact O-N 2.89Å; L261-G481 WeakPolarHBondContact CA-O 3.43Å; Q262-G481 PolarHBondContact N-O 3.14Å
482	T	96.4	Very high	88.7	Confident	3 Å²	3	50 Å²	50	2%	0.018	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.9	121.7	178.6	-54.4	0	0	0	0	109.9	Y264 L334 R442 S443 V444 I484	Y264-T482 HydrophobicContact CD2-CG2 3.67Å; Y264-T482 HydrophobicContact CE2-CG2 3.77Å; L334-T482 HydrophobicContact CD1-CG2 4.28Å; R442-T482 PolarHBondContact O-N 2.92Å; R442-T482 VanDerWaalsContact O-N 3.1Å; S443-T482 CarbonylContact C-O 3.53Å; S443-T482 WeakPolarHBondContact CA-O 3.31Å; V444-T482 PolarHBondContact N-O 3.26Å; T482-I484 HydrophobicContact CG2-CD1 4.39Å; T482-I484 HydrophobicContact CG2-CG1 4.06Å
483	V	96.5	Very high	88.3	Confident	0 Å²	0	51.5 Å²	51.5	0%	0	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113	125.4	177.1	-177.4	0	0	0	0	107.7	L261 Q262 H263 Y264 V444 F446 Y465 A472	L261-V483 HydrophobicContact CD1-CG2 4.41Å; L261-V483 HydrophobicContact CD2-CG2 4.09Å; Q262-V483 PolarHBondContact O-N 3.46Å; H263-V483 CarbonylContact C-O 3.57Å; H263-V483 WeakPolarHBondContact CA-O 3.43Å; Y264-V483 PolarHBondContact N-O 2.79Å; V444-V483 CarbonylContact O-C 3.43Å; V444-V483 WeakPolarHBondContact O-CA 3.48Å; F446-V483 HydrophobicContact CD2-CG1 4.09Å; F446-V483 HydrophobicContact CE2-CG1 3.64Å; Y465-V483 WeakPolarHBondContact OH-CG1 3.42Å; A472-V483 HydrophobicContact CB-CG2 3.86Å
484	I	95.6	Very high	88.1	Confident	0 Å²	0	56.4 Å²	56.4	0%	0	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	127.9	-179.8	-53.3	172.3	0	0	0	108.1	Y264 I273 L325 V329 V444 L445 F446 T482	Y264-I484 CarbonylContact O-C 3.57Å; Y264-I484 WeakPolarHBondContact O-CA 3.48Å; I273-I484 HydrophobicContact CD1-CD1 4.26Å; I273-I484 HydrophobicContact CG2-CG2 4.03Å; L325-I484 HydrophobicContact CD1-CG2 4.3Å; L325-I484 HydrophobicContact CD2-CG2 3.97Å; V329-I484 HydrophobicContact CG2-CD1 3.38Å; V444-I484 PolarHBondContact O-N 2.93Å; L445-I484 CarbonylContact C-O 3.59Å; L445-I484 VanDerWaalsContact CA-O 3.27Å; L445-I484 WeakPolarHBondContact CA-O 3.25Å; L445-I484 HydrophobicContact CD1-CB 3.78Å; L445-I484 HydrophobicContact CD1-CG2 3.7Å; F446-I484 PolarHBondContact N-O 3.27Å; T482-I484 HydrophobicContact CG2-CD1 4.39Å; T482-I484 HydrophobicContact CG2-CG1 4.06Å
485	M	94	Very high	88.1	Confident	1 Å²	1	57.3 Å²	57.3	1%	0.005	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115	119.4	177.6	-178.3	174.4	60.9	0	0	109.8	Y264 V265 Y266 F446 T449 Y465 L487 L499 L500	Y264-M485 PolarHBondContact O-N 3.29Å; V265-M485 HydrophobicContact CG2-CE 3.9Å; Y266-M485 PolarHBondContact N-O 3.33Å; F446-M485 HydrophobicContact CB-CG 4.48Å; T449-M485 HydrophobicContact CG2-CG 3.99Å; T449-M485 HydrophobicContact CG2-SD 3.74Å; Y465-M485 HydrophobicContact CE2-SD 4.44Å; M485-L487 HydrophobicContact CE-CD1 4.48Å; M485-L487 HydrophobicContact CE-CD2 3.55Å; M485-L487 HydrophobicContact CE-CG 4.1Å; M485-L487 HydrophobicContact CG-CD2 4.26Å; M485-L487 PolarHBondContact O-N 2.81Å; M485-L487 HydrophobicContact SD-CD2 4.14Å; M485-L499 HydrophobicContact SD-CD2 3.8Å; M485-L500 HydrophobicContact CE-CD1 3.91Å; M485-L500 HydrophobicContact CE-CD2 4.01Å; M485-L500 HydrophobicContact CE-CG 3.95Å
486	M	91.8	Very high	88.1	Confident	13 Å²	13	51.6 Å²	51.6	6%	0.064	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.8	118.8	169.4	-64	-179.5	59	0	0	108.8	Y266 L325 L445 F446	Y266-M486 HydrophobicContact CD1-CE 4.49Å; Y266-M486 HydrophobicContact CD1-CG 4.07Å; Y266-M486 WeakPolarHBondContact O-CA 3.33Å; L325-M486 HydrophobicContact CD2-CG 3.93Å; L325-M486 HydrophobicContact CD2-SD 4.28Å; L445-M486 HydrophobicContact CD1-CG 3.95Å; L445-M486 HydrophobicContact CD1-SD 4.44Å; F446-M486 WeakPolarHBondContact O-CB 3.31Å; F446-M486 WeakPolarHBondContact O-CG 3.48Å; F446-M486 PolarHBondContact O-N 3.28Å
487	L	87.1	Confident	88.3	Confident	1 Å²	1	50 Å²	50	1%	0.005	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.2	123.5	173.2	-73.1	-173	0	0	0	109.4	V265 Y266 C268 F288 L292 L295 T449 M485 I491 A496	V265-L487 HydrophobicContact CB-CD1 4.24Å; V265-L487 HydrophobicContact CG1-CB 4.23Å; V265-L487 HydrophobicContact CG1-CD1 3.25Å; V265-L487 HydrophobicContact CG1-CG 3.66Å; V265-L487 HydrophobicContact CG2-CD1 3.92Å; V265-L487 HydrophobicContact CG2-CG 4.32Å; Y266-L487 PolarHBondContact O-N 2.97Å; C268-L487 WeakPolarHBondContact CB-O 3.31Å; C268-L487 PolarHBondContact N-O 3.15Å; C268-L487 PolarHBondContact SG-O 3.09Å; F288-L487 HydrophobicContact CE2-CD1 4.34Å; L292-L487 HydrophobicContact CD2-CD1 4.35Å; L295-L487 WeakPolarHBondContact CD1-O 3.25Å; L295-L487 HydrophobicContact CD2-CB 4.39Å; T449-L487 HydrophobicContact CG2-CD2 4Å; M485-L487 HydrophobicContact CE-CD1 4.48Å; M485-L487 HydrophobicContact CE-CD2 3.55Å; M485-L487 HydrophobicContact CE-CG 4.1Å; M485-L487 HydrophobicContact CG-CD2 4.26Å; M485-L487 PolarHBondContact O-N 2.81Å; M485-L487 HydrophobicContact SD-CD2 4.14Å; L487-I491 HydrophobicContact CD2-CG2 3.68Å; L487-A496 HydrophobicContact CD2-CB 4.42Å
488	D	80.6	Confident	88.4	Confident	30 Å²	30	51.4 Å²	51.4	16%	0.16	25%	0.248	C	C	.	.	P	Polyproline II helix	trans	-99.8	173.6	166.6	67.6	12.5	0	0	0	110.6	L295 R490	L295-D488 WeakPolarHBondContact CD2-O 3.09Å; D488-R490 PolarHBondContact O-N 3.47Å; D488-R490 VanDerWaalsContact O-N 3.11Å; D488-R490 VanDerWaalsContact OD1-CB 3.31Å; D488-R490 WeakPolarHBondContact OD1-CB 3.35Å; D488-R490 PolarHBondContact OD1-N 3.41Å; D488-R490 VanDerWaalsContact OD1-N 3.13Å; D488-R490 WeakPolarHBondContact OD2-CD 3.17Å; D488-R490 IonicContact OD2-NE 3.71Å
489	D	74.9	Confident	88.3	Confident	113 Å²	113	50.8 Å²	50.8	60%	0.604	24%	0.244	S	C	*	.	T	Hydrogen-bonded Turn	trans	-72	4.8	-178.7	62.3	-15.1	0	0	0	114.1
490	R	76.6	Confident	88.3	Confident	161 Å²	161	45.4 Å²	45.4	61%	0.608	21%	0.211	S	C	*	.	T	Hydrogen-bonded Turn	trans	-94.8	-10.4	-174.3	-53	178.1	-178.8	176.4	-0.6	113.4	R450 D488	R450-R490 PolarHBondContact NH2-O 2.94Å; D488-R490 PolarHBondContact O-N 3.47Å; D488-R490 VanDerWaalsContact O-N 3.11Å; D488-R490 VanDerWaalsContact OD1-CB 3.31Å; D488-R490 WeakPolarHBondContact OD1-CB 3.35Å; D488-R490 PolarHBondContact OD1-N 3.41Å; D488-R490 VanDerWaalsContact OD1-N 3.13Å; D488-R490 WeakPolarHBondContact OD2-CD 3.17Å; D488-R490 IonicContact OD2-NE 3.71Å
491	I	80.6	Confident	88	Confident	16 Å²	16	45 Å²	45	8%	0.082	22%	0.215	C	C	.	.	S	Bend	trans	-109.2	133.3	-178.8	-171.9	173.6	0	0	0	110.7	T449 L459 L487 E495 A496	T449-I491 HydrophobicContact CG2-CD1 3.91Å; L459-I491 HydrophobicContact CD1-CD1 3.61Å; L459-I491 HydrophobicContact CD1-CG1 4.14Å; L487-I491 HydrophobicContact CD2-CG2 3.68Å; I491-E495 HydrophobicContact CD1-CB 4.12Å; I491-E495 HydrophobicContact CG1-CB 3.59Å; I491-A496 HydrophobicContact CD1-CB 3.81Å; I491-A496 HydrophobicContact CG1-CB 4.18Å
492	S	84	Confident	87.4	Confident	52 Å²	52	45.9 Å²	45.9	36%	0.364	23%	0.225	S	C	.	.			trans	-73.8	158	173.7	65.5	0	0	0	0	111.3	D494 E495 A496	S492-D494 PolarHBondContact O-N 3.4Å; S492-E495 WeakPolarHBondContact CB-OE2 3.4Å; S492-E495 PolarHBondContact N-OE2 2.98Å; S492-E495 PolarHBondContact O-N 2.89Å; S492-E495 WeakPolarHBondContact OG-CB 3.32Å; S492-E495 WeakPolarHBondContact OG-CG 3.49Å; S492-E495 PolarHBondContact OG-N 3.34Å; S492-E495 PolarHBondContact OG-OE2 2.96Å; S492-A496 PolarHBondContact O-N 2.88Å
493	A	85.6	Confident	86.7	Confident	31 Å²	31	53.2 Å²	53.2	26%	0.256	26%	0.259	S	S	.	.	H	α-helix	trans	-57.2	-37.4	176.7	0	0	0	0	0	112.2	F288 L292 R497	F288-A493 HydrophobicContact CE1-CB 4.13Å; F288-A493 HydrophobicContact CZ-CB 4.45Å; L292-A493 HydrophobicContact CD1-CB 3.78Å; A493-R497 WeakPolarHBondContact O-CB 3.48Å; A493-R497 VanDerWaalsContact O-CG 3.31Å; A493-R497 WeakPolarHBondContact O-CG 3.44Å; A493-R497 PolarHBondContact O-N 3.24Å
494	D	87.3	Confident	86.1	Confident	104 Å²	104	55 Å²	55	56%	0.556	27%	0.271	S	S	*	.	H	α-helix	trans	-73.2	-39.4	-179	-62.9	-28.2	0	0	0	112.5	S492 R497 R498	S492-D494 PolarHBondContact O-N 3.4Å; D494-R497 PolarHBondContact O-N 3.11Å; D494-R497 IonicContact OD1-CZ 3.29Å; D494-R497 IonicContact OD1-NE 3.08Å; D494-R497 PolarHBondContact OD1-NE 3Å; D494-R497 IonicContact OD1-NH2 3.12Å; D494-R497 PolarHBondContact OD1-NH2 3.48Å; D494-R498 WeakPolarHBondContact O-CB 3.45Å; D494-R498 PolarHBondContact O-N 3.44Å
495	E	88.7	Confident	85.7	Confident	70 Å²	70	57.9 Å²	57.9	33%	0.327	29%	0.286	S	S	.	.	H	α-helix	trans	-62.3	-43.8	172.5	-74.1	166.3	144.2	0	0	111.5	L459 I491 S492 R498 L499	L459-E495 HydrophobicContact CD2-CB 3.86Å; L459-E495 HydrophobicContact CD2-CG 4.16Å; I491-E495 HydrophobicContact CD1-CB 4.12Å; I491-E495 HydrophobicContact CG1-CB 3.59Å; S492-E495 WeakPolarHBondContact CB-OE2 3.4Å; S492-E495 PolarHBondContact N-OE2 2.98Å; S492-E495 PolarHBondContact O-N 2.89Å; S492-E495 WeakPolarHBondContact OG-CB 3.32Å; S492-E495 WeakPolarHBondContact OG-CG 3.49Å; S492-E495 PolarHBondContact OG-N 3.34Å; S492-E495 PolarHBondContact OG-OE2 2.96Å; E495-R498 PolarHBondContact O-N 3.12Å; E495-L499 WeakPolarHBondContact O-CB 3.49Å; E495-L499 PolarHBondContact O-N 3.14Å
496	A	88	Confident	85.6	Confident	0 Å²	0	64.3 Å²	64.3	0%	0	31%	0.31	C	S	.	.	H	α-helix	trans	-65.3	-40.3	176.8	0	0	0	0	0	112	F288 L487 I491 S492 L499 L500	F288-A496 HydrophobicContact CE2-CB 4.04Å; F288-A496 HydrophobicContact CZ-CB 3.83Å; L487-A496 HydrophobicContact CD2-CB 4.42Å; I491-A496 HydrophobicContact CD1-CB 3.81Å; I491-A496 HydrophobicContact CG1-CB 4.18Å; S492-A496 PolarHBondContact O-N 2.88Å; A496-L499 PolarHBondContact O-N 3.28Å; A496-L500 WeakPolarHBondContact O-CB 3.3Å; A496-L500 WeakPolarHBondContact O-CG 3.42Å; A496-L500 PolarHBondContact O-N 3.4Å
497	R	89.1	Confident	85.6	Confident	52 Å²	52	63.7 Å²	63.7	20%	0.196	31%	0.307	C	S	.	.	H	α-helix	trans	-61.7	-46.8	173.3	-79.9	-171.9	-81.2	-152.2	4.4	111.6	F283 E285 F288 A493 D494 L499 L500 L501	F283-R497 HydrophobicContact CE1-CG 4.16Å; F283-R497 HydrophobicContact CE2-CG 4.35Å; F283-R497 HydrophobicContact CZ-CG 3.73Å; E285-R497 IonicContact OE1-CZ 3.19Å; E285-R497 IonicContact OE1-NH1 3.8Å; E285-R497 PolarHBondContact OE1-NH1 2.98Å; E285-R497 IonicContact OE2-NH1 2.66Å; F288-R497 HydrophobicContact CD1-CG 4.48Å; F288-R497 HydrophobicContact CE1-CG 3.85Å; F288-R497 HydrophobicContact CZ-CG 4.13Å; A493-R497 WeakPolarHBondContact O-CB 3.48Å; A493-R497 VanDerWaalsContact O-CG 3.31Å; A493-R497 WeakPolarHBondContact O-CG 3.44Å; A493-R497 PolarHBondContact O-N 3.24Å; D494-R497 PolarHBondContact O-N 3.11Å; D494-R497 IonicContact OD1-CZ 3.29Å; D494-R497 IonicContact OD1-NE 3.08Å; D494-R497 PolarHBondContact OD1-NE 3Å; D494-R497 IonicContact OD1-NH2 3.12Å; D494-R497 PolarHBondContact OD1-NH2 3.48Å; R497-L499 VanDerWaalsContact C-N 3.29Å; R497-L499 PolarHBondContact O-N 3.39Å; R497-L500 PolarHBondContact O-N 2.9Å; R497-L501 WeakPolarHBondContact O-CB 3.33Å; R497-L501 PolarHBondContact O-N 3.3Å
498	R	89.5	Confident	85.9	Confident	191 Å²	191	67.1 Å²	67.1	72%	0.721	33%	0.325	S	S	*	.	H	α-helix	trans	-62.5	-35.2	177.5	-170	177.4	-169.4	161	3.9	112.5	D494 E495 G502	D494-R498 WeakPolarHBondContact O-CB 3.45Å; D494-R498 PolarHBondContact O-N 3.44Å; E495-R498 PolarHBondContact O-N 3.12Å; R498-G502 WeakPolarHBondContact O-CA 3.41Å; R498-G502 PolarHBondContact O-N 3.47Å
499	L	90.6	Very high	86.5	Confident	4 Å²	4	66.6 Å²	66.6	2%	0.021	32%	0.324	C	S	.	.	H	α-helix	trans	-69.2	-41.4	176.4	-171.3	64.4	0	0	0	112.1	T449 L460 Y465 M485 E495 A496 R497	T449-L499 HydrophobicContact CG2-CD2 4.35Å; L460-L499 HydrophobicContact CB-CD1 3.94Å; L460-L499 WeakPolarHBondContact O-CD1 3.46Å; Y465-L499 VanDerWaalsContact CD1-O 3.26Å; Y465-L499 WeakPolarHBondContact CD1-O 3.44Å; Y465-L499 HydrophobicContact CD2-CD1 4.34Å; Y465-L499 HydrophobicContact CD2-CD2 4.31Å; Y465-L499 HydrophobicContact CD2-CG 4.06Å; Y465-L499 HydrophobicContact CG-CD1 4.05Å; Y465-L499 HydrophobicContact CG-CG 4.02Å; M485-L499 HydrophobicContact SD-CD2 3.8Å; E495-L499 WeakPolarHBondContact O-CB 3.49Å; E495-L499 PolarHBondContact O-N 3.14Å; A496-L499 PolarHBondContact O-N 3.28Å; R497-L499 VanDerWaalsContact C-N 3.29Å; R497-L499 PolarHBondContact O-N 3.39Å
500	L	89.3	Confident	87.1	Confident	14 Å²	14	62.3 Å²	62.3	7%	0.073	30%	0.303	C	S	.	.	H	α-helix	trans	-76.2	-35	-177.9	-73.2	166.8	0	0	0	113.8	H263 V265 V276 V277 F283 F288 Y465 M485 A496 R497	H263-L500 HydrophobicContact CB-CD2 3.9Å; V265-L500 HydrophobicContact CG2-CD1 4.46Å; V276-L500 HydrophobicContact CG2-CD1 3.78Å; V276-L500 HydrophobicContact CG2-CD2 4.32Å; V277-L500 HydrophobicContact CG2-CB 4.38Å; F283-L500 HydrophobicContact CE2-CD1 4.01Å; F288-L500 HydrophobicContact CE2-CD1 4.42Å; Y465-L500 HydrophobicContact CE1-CD2 4.27Å; Y465-L500 WeakPolarHBondContact OH-CD2 3.38Å; M485-L500 HydrophobicContact CE-CD1 3.91Å; M485-L500 HydrophobicContact CE-CD2 4.01Å; M485-L500 HydrophobicContact CE-CG 3.95Å; A496-L500 WeakPolarHBondContact O-CB 3.3Å; A496-L500 WeakPolarHBondContact O-CG 3.42Å; A496-L500 PolarHBondContact O-N 3.4Å; R497-L500 PolarHBondContact O-N 2.9Å
501	L	87.6	Confident	87.7	Confident	88 Å²	88	55 Å²	55	46%	0.461	28%	0.276	S	S	.	.	H	α-helix	trans	-110.5	-0.8	-174.9	-61.5	175.8	0	0	0	113.9	V277 F283 R497	V277-L501 HydrophobicContact CG2-CD2 4.26Å; F283-L501 HydrophobicContact CB-CD1 3.98Å; F283-L501 HydrophobicContact CB-CD2 4.13Å; F283-L501 HydrophobicContact CD2-CD1 3.81Å; F283-L501 HydrophobicContact CD2-CD2 4Å; F283-L501 HydrophobicContact CD2-CG 3.95Å; F283-L501 HydrophobicContact CE2-CD1 4.48Å; F283-L501 HydrophobicContact CG-CD1 3.92Å; F283-L501 HydrophobicContact CG-CD2 4.47Å; F283-L501 HydrophobicContact CG-CG 4.5Å; R497-L501 WeakPolarHBondContact O-CB 3.33Å; R497-L501 PolarHBondContact O-N 3.3Å
502	G	80.7	Confident	88.2	Confident	20 Å²	20	57.1 Å²	57.1	21%	0.206	28%	0.283	C	S	.	.	P	Polyproline II helix	trans	-64.1	149.1	-171.8	0	0	0	0	0	113.3	R498	R498-G502 WeakPolarHBondContact O-CA 3.41Å; R498-G502 PolarHBondContact O-N 3.47Å
503	E	82.6	Confident	88.5	Confident	157 Å²	157	54.7 Å²	54.7	73%	0.734	27%	0.266	S	S	*	.	P	Polyproline II helix	trans	-73.6	154	176.3	-64.7	-176	167.8	0	0	111.2	D505	E503-D505 PolarHBondContact O-N 2.78Å
504	P	84.6	Confident	88.7	Confident	37 Å²	37	54.9 Å²	54.9	24%	0.24	26%	0.264	C	S	.	.	P	Polyproline II helix	trans	-58.1	138.9	170.2	-19.5	30.8	0	0	0	111.4	T230 I466	T230-P504 WeakPolarHBondContact O-CB 3.49Å; T230-P504 WeakPolarHBondContact OG1-CG 3.03Å; I466-P504 HydrophobicContact CD1-CG 4.18Å
505	D	87	Confident	89	Confident	60 Å²	60	50.8 Å²	50.8	32%	0.321	24%	0.242	S	C	.	.	P	Polyproline II helix	trans	-61.7	141.2	-179.9	-64.7	-32.9	0	0	0	110.9	R203 S461 G463 E503	R203-D505 VanDerWaalsContact NH1-C 3.3Å; R203-D505 PolarHBondContact NH1-O 2.93Å; R203-D505 PolarHBondContact NH2-O 2.89Å; S461-D505 PolarHBondContact OG-OD2 3.34Å; G463-D505 WeakPolarHBondContact CA-OD2 3.31Å; G463-D505 PolarHBondContact N-OD2 2.95Å; E503-D505 PolarHBondContact O-N 2.78Å
506	R	91.1	Very high	89.1	Confident	137 Å²	137	48.1 Å²	48.1	52%	0.517	23%	0.23	S	C	.	.	P	Polyproline II helix	trans	-57.3	152.7	172.2	-71	179.1	68.2	129.8	2.9	111.1	R203 P232 E236 D508	R203-R506 PolarHBondContact NH1-O 2.88Å; P232-R506 HydrophobicContact CG-CB 4.35Å; P232-R506 HydrophobicContact CG-CG 3.74Å; E236-R506 IonicContact OE2-NH2 3.41Å; E236-R506 PolarHBondContact OE2-NH2 3.19Å; R506-D508 IonicContact NE-OD1 3.63Å; R506-D508 PolarHBondContact O-N 2.89Å
507	L	92.8	Very high	89.3	Confident	0 Å²	0	48.2 Å²	48.2	0%	0	23%	0.23	C	C	.	.			trans	-89.3	93.8	167.5	-177.4	64.3	0	0	0	107.9	M202 R203 I231 N233 F237 F537	M202-L507 HydrophobicContact CB-CD1 4.11Å; M202-L507 HydrophobicContact CE-CD1 3.95Å; M202-L507 HydrophobicContact CE-CD2 3.78Å; M202-L507 HydrophobicContact CE-CG 3.69Å; R203-L507 HydrophobicContact CB-CD1 4.25Å; I231-L507 HydrophobicContact CD1-CB 3.83Å; I231-L507 HydrophobicContact CD1-CD2 3.68Å; I231-L507 HydrophobicContact CD1-CG 4.4Å; N233-L507 PolarHBondContact ND2-O 3.13Å; N233-L507 PolarHBondContact OD1-N 3.31Å; F237-L507 HydrophobicContact CB-CD2 4.48Å; F237-L507 HydrophobicContact CD2-CD2 3.65Å; F237-L507 HydrophobicContact CE2-CD2 4.16Å; F237-L507 HydrophobicContact CG-CD2 4.22Å; L507-F537 WeakPolarHBondContact O-CE1 3.47Å
508	D	92.4	Very high	89.5	Confident	72 Å²	72	45.7 Å²	45.7	39%	0.385	22%	0.221	S	C	.	.			trans	-106.4	145.9	174.8	-62.9	-40.1	0	0	0	109.8	R506 Q541	R506-D508 IonicContact NE-OD1 3.63Å; R506-D508 PolarHBondContact O-N 2.89Å; D508-Q541 PolarHBondContact OD1-NE2 3.5Å
509	S	92.7	Very high	89.8	Confident	19 Å²	19	36.6 Å²	36.6	13%	0.133	19%	0.187	C	C	.	.			trans	-63.8	136.7	179.8	178.3	0	0	0	0	111.6	E212 F511 Q538	E212-S509 VanDerWaalsContact CD-OG 3.23Å; E212-S509 WeakPolarHBondContact OE1-CA 3.44Å; E212-S509 WeakPolarHBondContact OE1-CB 3.43Å; E212-S509 PolarHBondContact OE1-OG 3.31Å; E212-S509 PolarHBondContact OE2-OG 2.87Å; S509-F511 WeakPolarHBondContact OG-CB 3.45Å; S509-F511 PolarHBondContact OG-N 3.25Å; S509-Q538 PolarHBondContact OG-N 2.95Å
510	S	88.8	Confident	89.9	Confident	23 Å²	23	36.8 Å²	36.8	16%	0.161	19%	0.188	C	C	.	.			trans	-111	36.2	168.7	71.2	0	0	0	0	111.2	M202 E204 Y512	M202-S510 PolarHBondContact O-OG 3.17Å; E204-S510 PolarHBondContact O-OG 2.94Å; S510-Y512 WeakPolarHBondContact O-CD1 3.36Å
511	F	89.4	Confident	90.1	Very high	8 Å²	8	36.1 Å²	36.1	4%	0.035	18%	0.184	C	C	.	.			trans	-62.9	136.1	-178	-169.4	-87.5	0	0	0	111.5	V209 S509 L513 M517 M532 L533 N536 Q538	V209-F511 HydrophobicContact CG2-CD2 4Å; V209-F511 HydrophobicContact CG2-CE2 4.2Å; S509-F511 WeakPolarHBondContact OG-CB 3.45Å; S509-F511 PolarHBondContact OG-N 3.25Å; F511-L513 HydrophobicContact CE1-CD2 3.89Å; F511-L513 HydrophobicContact CE1-CG 4.36Å; F511-L513 HydrophobicContact CZ-CD2 4.24Å; F511-M517 HydrophobicContact CE2-CE 4.21Å; F511-M517 HydrophobicContact CE2-SD 4.47Å; F511-M517 HydrophobicContact CZ-CE 4.18Å; F511-M517 HydrophobicContact CZ-SD 3.93Å; F511-M532 HydrophobicContact CE2-CG 4.19Å; F511-M532 HydrophobicContact CE2-SD 4.47Å; F511-M532 HydrophobicContact CZ-CG 3.93Å; F511-L533 HydrophobicContact CE1-CD2 3.74Å; F511-L533 HydrophobicContact CZ-CD2 4.39Å; F511-N536 HydrophobicContact CD1-CB 4.38Å; F511-N536 WeakPolarHBondContact CD1-ND2 3.4Å; F511-N536 HydrophobicContact CD2-CB 3.7Å; F511-N536 HydrophobicContact CE2-CB 3.84Å; F511-N536 HydrophobicContact CG-CB 4Å; F511-N536 HydrophobicContact CZ-CB 4.26Å; F511-Q538 HydrophobicContact CB-CB 4.47Å
512	Y	89.9	Confident	90.3	Very high	60 Å²	60	33.6 Å²	33.6	24%	0.235	17%	0.171	C	C	.	.			trans	-149.4	155.6	171.6	65.6	-85	0	0	0	109.7	K205 E206 V209 S510 T514 H939	K205-Y512 WeakPolarHBondContact O-CE1 3.29Å; E206-Y512 PolarHBondContact O-OH 3.22Å; V209-Y512 HydrophobicContact CB-CD1 4.18Å; V209-Y512 HydrophobicContact CB-CE1 3.93Å; V209-Y512 HydrophobicContact CG1-CD1 4.27Å; V209-Y512 HydrophobicContact CG1-CE1 3.56Å; S510-Y512 WeakPolarHBondContact O-CD1 3.36Å; Y512-T514 HydrophobicContact CD2-CG2 3.82Å; Y512-T514 HydrophobicContact CE2-CG2 3.3Å; Y512-H939 AromaticContact CD2-NE2 3.89Å
513	L	90.3	Very high	90.7	Very high	2 Å²	2	36.9 Å²	36.9	1%	0.01	18%	0.177	C	C	.	.			trans	-88.5	134.1	179.4	-67.9	174.5	0	0	0	111.1	F511 M517 L533 H830 E833 L834 R837	F511-L513 HydrophobicContact CE1-CD2 3.89Å; F511-L513 HydrophobicContact CE1-CG 4.36Å; F511-L513 HydrophobicContact CZ-CD2 4.24Å; L513-M517 HydrophobicContact CD2-SD 3.99Å; L513-L533 HydrophobicContact CD1-CD2 4.33Å; L513-L533 HydrophobicContact CD2-CD2 3.96Å; L513-L533 HydrophobicContact CG-CD2 4.36Å; L513-H830 HydrophobicContact CD1-CB 3.78Å; L513-H830 HydrophobicContact CG-CB 4.24Å; L513-E833 HydrophobicContact CD1-CB 4.44Å; L513-E833 HydrophobicContact CD1-CG 4.45Å; L513-L834 HydrophobicContact CD1-CB 3.77Å; L513-L834 HydrophobicContact CD1-CD1 4.47Å; L513-R837 PolarHBondContact O-NH2 3.12Å
514	T	90.3	Very high	90.7	Very high	35 Å²	35	31 Å²	31	22%	0.215	15%	0.152	C	C	.	.			trans	-115.2	157.5	167.7	62.7	0	0	0	0	110	Y512 N516 M517 I518	Y512-T514 HydrophobicContact CD2-CG2 3.82Å; Y512-T514 HydrophobicContact CE2-CG2 3.3Å; T514-N516 VanDerWaalsContact C-N 3.35Å; T514-M517 PolarHBondContact O-N 3.32Å; T514-M517 WeakPolarHBondContact OG1-CB 3.46Å; T514-M517 PolarHBondContact OG1-N 3.43Å; T514-M517 VanDerWaalsContact OG1-N 3.1Å; T514-I518 WeakPolarHBondContact O-CG1 3.41Å; T514-I518 PolarHBondContact O-N 3.08Å; T514-I518 VanDerWaalsContact O-N 3.16Å
515	N	92.7	Very high	90.3	Very high	18 Å²	18	38.5 Å²	38.5	10%	0.096	18%	0.184	C	C	.	.	H	α-helix	trans	-72	-36.3	178.6	-46.7	-56.7	0	0	0	110.4	M517 I518 L519 R837 L841 E868 L869	N515-M517 VanDerWaalsContact C-N 3.35Å; N515-M517 PolarHBondContact O-N 3.09Å; N515-I518 PolarHBondContact O-N 3.48Å; N515-L519 WeakPolarHBondContact O-CB 3.44Å; N515-L519 VanDerWaalsContact O-CG 3.3Å; N515-L519 WeakPolarHBondContact O-CG 3.38Å; N515-L519 PolarHBondContact O-N 3.4Å; N515-R837 PolarHBondContact OD1-NH1 3.23Å; N515-L841 HydrophobicContact CB-CD2 4.13Å; N515-E868 WeakPolarHBondContact CA-OE1 3.46Å; N515-E868 HydrophobicContact CB-CG 4.44Å; N515-E868 WeakPolarHBondContact CB-OE1 3.4Å; N515-E868 PolarHBondContact N-OE1 2.86Å; N515-L869 HydrophobicContact CB-CD1 4.48Å; N515-L869 HydrophobicContact CB-CD2 4.22Å; N515-L869 HydrophobicContact CB-CG 4.38Å; N515-L869 VanDerWaalsContact ND2-CD1 3.32Å; N515-L869 WeakPolarHBondContact ND2-CD1 3.37Å
516	N	91.8	Very high	89.8	Confident	14 Å²	14	43.1 Å²	43.1	8%	0.075	21%	0.208	C	C	.	.	H	α-helix	trans	-55.5	-45.4	171.5	-177.5	-84.7	0	0	0	112.4	T514 L519 N520 A860 I863 E868	T514-N516 VanDerWaalsContact C-N 3.35Å; N516-L519 PolarHBondContact O-N 2.92Å; N516-N520 WeakPolarHBondContact O-CB 3.3Å; N516-N520 PolarHBondContact O-N 2.97Å; N516-N520 PolarHBondContact O-ND2 3.24Å; N516-N520 VanDerWaalsContact O-ND2 3.1Å; N516-N520 PolarHBondContact OD1-ND2 2.86Å; N516-A860 PolarHBondContact ND2-O 3.41Å; N516-I863 PolarHBondContact ND2-O 3.41Å; N516-E868 HydrophobicContact CB-CG 4.16Å; N516-E868 PolarHBondContact N-OE1 3.43Å
517	M	92.1	Very high	89.5	Confident	1 Å²	1	37.3 Å²	37.3	1%	0.005	19%	0.187	C	C	.	.	H	α-helix	trans	-59.2	-50.6	174.5	177.1	-165.8	-70.1	0	0	110.9	V209 F511 L513 T514 N515 L519 N520 L521	V209-M517 HydrophobicContact CG2-CE 3.39Å; F511-M517 HydrophobicContact CE2-CE 4.21Å; F511-M517 HydrophobicContact CE2-SD 4.47Å; F511-M517 HydrophobicContact CZ-CE 4.18Å; F511-M517 HydrophobicContact CZ-SD 3.93Å; L513-M517 HydrophobicContact CD2-SD 3.99Å; T514-M517 PolarHBondContact O-N 3.32Å; T514-M517 WeakPolarHBondContact OG1-CB 3.46Å; T514-M517 PolarHBondContact OG1-N 3.43Å; T514-M517 VanDerWaalsContact OG1-N 3.1Å; N515-M517 VanDerWaalsContact C-N 3.35Å; N515-M517 PolarHBondContact O-N 3.09Å; M517-L519 VanDerWaalsContact C-N 3.32Å; M517-L519 PolarHBondContact O-N 3.03Å; M517-N520 PolarHBondContact O-N 2.98Å; M517-L521 HydrophobicContact CG-CD1 3.61Å; M517-L521 HydrophobicContact CG-CG 4.19Å; M517-L521 WeakPolarHBondContact O-CB 3.38Å; M517-L521 VanDerWaalsContact O-CG 3.23Å; M517-L521 WeakPolarHBondContact O-CG 3.42Å; M517-L521 PolarHBondContact O-N 3.16Å; M517-L521 HydrophobicContact SD-CD1 4.22Å
518	I	94.4	Very high	89.2	Confident	0 Å²	0	40.2 Å²	40.2	0%	0	20%	0.203	C	C	.	.	H	α-helix	trans	-58.8	-45.8	-178.6	-66.1	166.4	0	0	0	110.6	T514 N515 L521 L522 P529 L834 R837 L841	T514-I518 WeakPolarHBondContact O-CG1 3.41Å; T514-I518 PolarHBondContact O-N 3.08Å; T514-I518 VanDerWaalsContact O-N 3.16Å; N515-I518 PolarHBondContact O-N 3.48Å; I518-L521 PolarHBondContact O-N 3.13Å; I518-L522 HydrophobicContact CG2-CD1 4.06Å; I518-L522 HydrophobicContact CG2-CG 4.41Å; I518-L522 WeakPolarHBondContact O-CB 3.48Å; I518-L522 VanDerWaalsContact O-CG 3.27Å; I518-L522 WeakPolarHBondContact O-CG 3.48Å; I518-L522 PolarHBondContact O-N 2.86Å; I518-P529 HydrophobicContact CG2-CG 4.14Å; I518-L834 HydrophobicContact CD1-CD1 3.81Å; I518-L834 HydrophobicContact CG1-CD1 3.91Å; I518-L834 HydrophobicContact CG2-CD1 4.36Å; I518-R837 HydrophobicContact CD1-CB 3.58Å; I518-R837 HydrophobicContact CD1-CG 4.22Å; I518-L841 HydrophobicContact CB-CD1 4.25Å; I518-L841 HydrophobicContact CG2-CD1 3.75Å
519	L	94.4	Very high	89.2	Confident	0 Å²	0	36.9 Å²	36.9	0%	0	19%	0.185	C	C	.	.	H	α-helix	trans	-65.5	-40.8	-179.7	-69.2	171.1	0	0	0	112.5	N515 N516 M517 L522 R523 L841 F846 A860	N515-L519 WeakPolarHBondContact O-CB 3.44Å; N515-L519 VanDerWaalsContact O-CG 3.3Å; N515-L519 WeakPolarHBondContact O-CG 3.38Å; N515-L519 PolarHBondContact O-N 3.4Å; N516-L519 PolarHBondContact O-N 2.92Å; M517-L519 VanDerWaalsContact C-N 3.32Å; M517-L519 PolarHBondContact O-N 3.03Å; L519-L522 PolarHBondContact O-N 3.15Å; L519-R523 PolarHBondContact O-N 2.88Å; L519-L841 HydrophobicContact CD1-CD2 4.27Å; L519-L841 HydrophobicContact CD2-CD1 4.15Å; L519-L841 HydrophobicContact CD2-CD2 4.26Å; L519-L841 HydrophobicContact CG-CD1 4.29Å; L519-L841 HydrophobicContact CG-CD2 4.34Å; L519-F846 HydrophobicContact CD1-CD1 4Å; L519-F846 HydrophobicContact CD2-CB 4.13Å; L519-A860 HydrophobicContact CD1-CB 3.7Å
520	N	92.9	Very high	89.1	Confident	7 Å²	7	38.7 Å²	38.7	4%	0.037	19%	0.192	C	C	.	.	H	α-helix	trans	-66.8	-41.3	175.5	-81.8	-52.2	0	0	0	112	Y182 N516 M517 L522 R523 V524 C861	Y182-N520 HydrophobicContact CD1-CB 3.75Å; Y182-N520 HydrophobicContact CD2-CB 4.29Å; Y182-N520 HydrophobicContact CE1-CB 3.6Å; Y182-N520 HydrophobicContact CE2-CB 4.13Å; Y182-N520 HydrophobicContact CG-CB 4.1Å; N516-N520 WeakPolarHBondContact O-CB 3.3Å; N516-N520 PolarHBondContact O-N 2.97Å; N516-N520 PolarHBondContact O-ND2 3.24Å; N516-N520 VanDerWaalsContact O-ND2 3.1Å; N516-N520 PolarHBondContact OD1-ND2 2.86Å; M517-N520 PolarHBondContact O-N 2.98Å; N520-L522 VanDerWaalsContact C-N 3.33Å; N520-L522 PolarHBondContact O-N 3.13Å; N520-R523 WeakPolarHBondContact O-CB 3.48Å; N520-R523 PolarHBondContact O-N 3.04Å; N520-V524 WeakPolarHBondContact O-CG2 3.36Å; N520-V524 PolarHBondContact O-N 2.94Å; N520-C861 PolarHBondContact OD1-SG 3.38Å
521	L	92.9	Very high	89.2	Confident	1 Å²	1	40.6 Å²	40.6	1%	0.005	20%	0.199	C	C	.	.	H	α-helix	trans	-67.9	-30.5	176.1	-65.7	172.8	0	0	0	112.7	Y182 M517 I518 R523 I527 P529 M532	Y182-L521 HydrophobicContact CE1-CD2 3.94Å; Y182-L521 HydrophobicContact CE1-CG 4.37Å; M517-L521 HydrophobicContact CG-CD1 3.61Å; M517-L521 HydrophobicContact CG-CG 4.19Å; M517-L521 WeakPolarHBondContact O-CB 3.38Å; M517-L521 VanDerWaalsContact O-CG 3.23Å; M517-L521 WeakPolarHBondContact O-CG 3.42Å; M517-L521 PolarHBondContact O-N 3.16Å; M517-L521 HydrophobicContact SD-CD1 4.22Å; I518-L521 PolarHBondContact O-N 3.13Å; L521-R523 PolarHBondContact O-N 3.25Å; L521-I527 HydrophobicContact CD2-CG2 3.43Å; L521-I527 VanDerWaalsContact CD2-CG2 3.43Å; L521-P529 HydrophobicContact CB-CG 3.87Å; L521-P529 HydrophobicContact CD1-CB 4.43Å; L521-P529 HydrophobicContact CD1-CG 4.47Å; L521-M532 HydrophobicContact CD1-CB 3.77Å; L521-M532 HydrophobicContact CD1-CE 4.13Å; L521-M532 HydrophobicContact CD1-CG 3.89Å; L521-M532 HydrophobicContact CD2-CE 3.56Å; L521-M532 HydrophobicContact CG-CE 4.48Å
522	L	92.4	Very high	89.3	Confident	34 Å²	34	40.2 Å²	40.2	18%	0.178	20%	0.198	C	C	.	.	T	Hydrogen-bonded Turn	trans	-71.8	-14.1	171.4	-70.5	176.8	0	0	0	113.1	I518 L519 N520 P529 C847 D851 V853	I518-L522 HydrophobicContact CG2-CD1 4.06Å; I518-L522 HydrophobicContact CG2-CG 4.41Å; I518-L522 WeakPolarHBondContact O-CB 3.48Å; I518-L522 VanDerWaalsContact O-CG 3.27Å; I518-L522 WeakPolarHBondContact O-CG 3.48Å; I518-L522 PolarHBondContact O-N 2.86Å; L519-L522 PolarHBondContact O-N 3.15Å; N520-L522 VanDerWaalsContact C-N 3.33Å; N520-L522 PolarHBondContact O-N 3.13Å; L522-P529 HydrophobicContact CD2-CG 4Å; L522-P529 HydrophobicContact CG-CG 4.09Å; L522-C847 HydrophobicContact CD1-CB 4.5Å; L522-D851 HydrophobicContact CD1-CB 4.38Å; L522-D851 HydrophobicContact CD2-CB 3.94Å; L522-V853 HydrophobicContact CB-CG2 3.58Å
523	R	88.7	Confident	89.4	Confident	90 Å²	90	37.4 Å²	37.4	34%	0.34	19%	0.186	S	C	.	.	T	Hydrogen-bonded Turn	trans	-91.1	-27.9	178.4	-170.6	-179.1	73	170.3	0.8	112.9	Y182 L519 N520 L521 V853 E862	Y182-R523 PolarHBondContact O-NH2 3.29Å; L519-R523 PolarHBondContact O-N 2.88Å; N520-R523 WeakPolarHBondContact O-CB 3.48Å; N520-R523 PolarHBondContact O-N 3.04Å; L521-R523 PolarHBondContact O-N 3.25Å; R523-V853 HydrophobicContact CB-CG2 4.46Å; R523-E862 IonicContact NH1-OE1 3.85Å
524	V	83.7	Confident	89.4	Confident	33 Å²	33	39.4 Å²	39.4	20%	0.2	20%	0.199	C	C	.	.			trans	-81.3	138.8	-177.8	177.5	0	0	0	0	110.1	Y182 N520 I527	Y182-V524 HydrophobicContact CD1-CG2 4.1Å; N520-V524 WeakPolarHBondContact O-CG2 3.36Å; N520-V524 PolarHBondContact O-N 2.94Å; V524-I527 HydrophobicContact CB-CG2 4.32Å; V524-I527 HydrophobicContact CG1-CG2 4.16Å
525	E	75.9	Confident	89.4	Confident	195 Å²	195	40.8 Å²	40.8	91%	0.911	20%	0.202	S	C	*	.	S	Bend	trans	-75	-40.9	-174.9	-64.2	-175.5	170.4	0	0	113.3
526	D	76.3	Confident	89.4	Confident	157 Å²	157	40 Å²	40	84%	0.84	20%	0.197	S	C	*	.	S	Bend	trans	-86.4	-12.1	-170.5	-66.8	-43.3	0	0	0	114.7
527	I	83.8	Confident	89.6	Confident	14 Å²	14	39.3 Å²	39.3	7%	0.072	19%	0.194	C	C	.	.			trans	-138.9	144.1	-175.8	-136.2	169.6	0	0	0	109.9	I216 L217 L521 V524 I531 M532	I216-I527 HydrophobicContact CG2-CD1 3.9Å; L217-I527 HydrophobicContact CD2-CD1 3.98Å; L217-I527 HydrophobicContact CD2-CG2 3.93Å; L521-I527 HydrophobicContact CD2-CG2 3.43Å; L521-I527 VanDerWaalsContact CD2-CG2 3.43Å; V524-I527 HydrophobicContact CB-CG2 4.32Å; V524-I527 HydrophobicContact CG1-CG2 4.16Å; I527-I531 HydrophobicContact CD1-CG2 4.43Å; I527-I531 HydrophobicContact CG1-CB 4.21Å; I527-I531 HydrophobicContact CG1-CG2 3.79Å; I527-M532 HydrophobicContact CD1-CE 4.48Å
528	N	88.1	Confident	89.5	Confident	62 Å²	62	41.8 Å²	41.8	33%	0.332	21%	0.205	S	C	.	.			trans	-127.8	167.3	172.4	66.3	23.2	0	0	0	110.1	E530 I531 M532	N528-E530 PolarHBondContact O-N 2.86Å; N528-E530 PolarHBondContact OD1-N 3.34Å; N528-I531 PolarHBondContact O-N 2.66Å; N528-I531 VanDerWaalsContact O-N 3.16Å; N528-I531 WeakPolarHBondContact OD1-CB 3.3Å; N528-I531 WeakPolarHBondContact OD1-CG1 3.38Å; N528-I531 PolarHBondContact OD1-N 3.03Å; N528-M532 PolarHBondContact O-N 2.82Å
529	P	91.6	Very high	89.3	Confident	1 Å²	1	41.8 Å²	41.8	1%	0.006	21%	0.206	C	C	.	.	H	α-helix	trans	-54.6	-35.8	179.9	-26.5	34.3	0	0	0	114	I518 L521 L522 M532 L533 L834	I518-P529 HydrophobicContact CG2-CG 4.14Å; L521-P529 HydrophobicContact CB-CG 3.87Å; L521-P529 HydrophobicContact CD1-CB 4.43Å; L521-P529 HydrophobicContact CD1-CG 4.47Å; L522-P529 HydrophobicContact CD2-CG 4Å; L522-P529 HydrophobicContact CG-CG 4.09Å; P529-M532 WeakPolarHBondContact O-CB 3.17Å; P529-M532 PolarHBondContact O-N 2.74Å; P529-L533 WeakPolarHBondContact O-CG 3.19Å; P529-L533 PolarHBondContact O-N 2.66Å; P529-L834 HydrophobicContact CB-CD1 3.67Å; P529-L834 HydrophobicContact CB-CD2 3.92Å; P529-L834 HydrophobicContact CB-CG 4.46Å; P529-L834 HydrophobicContact CG-CD1 4.49Å
530	E	90.9	Very high	89.2	Confident	58 Å²	58	42.1 Å²	42.1	27%	0.271	21%	0.207	S	C	.	.	H	α-helix	trans	-66.8	-41.3	179.1	-67.6	81.7	175.5	0	0	112.5	N528 M532 L533 V534 F831 L834 K838	N528-E530 PolarHBondContact O-N 2.86Å; N528-E530 PolarHBondContact OD1-N 3.34Å; E530-M532 VanDerWaalsContact C-N 3.35Å; E530-L533 PolarHBondContact O-N 3.25Å; E530-V534 WeakPolarHBondContact O-CG2 3.39Å; E530-V534 PolarHBondContact O-N 3.42Å; E530-V534 VanDerWaalsContact O-N 3.12Å; E530-F831 HydrophobicContact CG-CE2 4.35Å; E530-L834 HydrophobicContact CG-CD2 4.14Å; E530-K838 IonicContact OE1-NZ 2.65Å; E530-K838 PolarHBondContact OE1-NZ 3.22Å; E530-K838 IonicContact OE2-NZ 3.38Å
531	I	90.7	Very high	89.1	Confident	62 Å²	62	43 Å²	43	32%	0.318	21%	0.211	S	C	.	.	H	α-helix	trans	-66.2	-40.8	175.2	-68.8	164.8	0	0	0	110	I527 N528 L533 V534 K535	I527-I531 HydrophobicContact CD1-CG2 4.43Å; I527-I531 HydrophobicContact CG1-CB 4.21Å; I527-I531 HydrophobicContact CG1-CG2 3.79Å; N528-I531 PolarHBondContact O-N 2.66Å; N528-I531 VanDerWaalsContact O-N 3.16Å; N528-I531 WeakPolarHBondContact OD1-CB 3.3Å; N528-I531 WeakPolarHBondContact OD1-CG1 3.38Å; N528-I531 PolarHBondContact OD1-N 3.03Å; I531-L533 VanDerWaalsContact C-N 3.34Å; I531-L533 PolarHBondContact O-N 3.29Å; I531-V534 PolarHBondContact O-N 2.87Å; I531-V534 VanDerWaalsContact O-N 3.17Å; I531-K535 HydrophobicContact CG2-CD 3.93Å; I531-K535 HydrophobicContact CG2-CG 4.28Å; I531-K535 WeakPolarHBondContact O-CB 3.43Å; I531-K535 WeakPolarHBondContact O-CG 3.26Å; I531-K535 PolarHBondContact O-N 2.8Å
532	M	91.5	Very high	88.9	Confident	1 Å²	1	45.2 Å²	45.2	1%	0.005	23%	0.226	C	C	.	.	H	α-helix	trans	-57.5	-46.1	175	-176.9	65.3	77.6	0	0	111.2	E213 I216 L217 F511 L521 I527 N528 P529 E530 V534 K535 N536	E213-M532 HydrophobicContact CG-CE 4.24Å; I216-M532 HydrophobicContact CB-SD 4.11Å; I216-M532 HydrophobicContact CD1-SD 3.5Å; I216-M532 VanDerWaalsContact CD1-SD 3.5Å; I216-M532 HydrophobicContact CG1-SD 4.42Å; I216-M532 HydrophobicContact CG2-CE 4.18Å; I216-M532 HydrophobicContact CG2-SD 3.79Å; L217-M532 HydrophobicContact CD2-CE 4.35Å; L217-M532 HydrophobicContact CG-CE 4.27Å; F511-M532 HydrophobicContact CE2-CG 4.19Å; F511-M532 HydrophobicContact CE2-SD 4.47Å; F511-M532 HydrophobicContact CZ-CG 3.93Å; L521-M532 HydrophobicContact CD1-CB 3.77Å; L521-M532 HydrophobicContact CD1-CE 4.13Å; L521-M532 HydrophobicContact CD1-CG 3.89Å; L521-M532 HydrophobicContact CD2-CE 3.56Å; L521-M532 HydrophobicContact CG-CE 4.48Å; I527-M532 HydrophobicContact CD1-CE 4.48Å; N528-M532 PolarHBondContact O-N 2.82Å; P529-M532 WeakPolarHBondContact O-CB 3.17Å; P529-M532 PolarHBondContact O-N 2.74Å; E530-M532 VanDerWaalsContact C-N 3.35Å; M532-V534 VanDerWaalsContact C-N 3.32Å; M532-V534 PolarHBondContact O-N 2.84Å; M532-K535 PolarHBondContact O-N 3.36Å; M532-K535 VanDerWaalsContact O-N 3.16Å; M532-N536 PolarHBondContact O-N 2.86Å
533	L	91.4	Very high	88.6	Confident	0 Å²	0	46 Å²	46	0%	0	23%	0.227	C	C	.	.	H	α-helix	trans	-62.1	-36.3	176.1	-72.4	-174.8	0	0	0	113.5	F511 L513 P529 E530 I531 K535 N536 Q539 H830 L834	F511-L533 HydrophobicContact CE1-CD2 3.74Å; F511-L533 HydrophobicContact CZ-CD2 4.39Å; L513-L533 HydrophobicContact CD1-CD2 4.33Å; L513-L533 HydrophobicContact CD2-CD2 3.96Å; L513-L533 HydrophobicContact CG-CD2 4.36Å; P529-L533 WeakPolarHBondContact O-CG 3.19Å; P529-L533 PolarHBondContact O-N 2.66Å; E530-L533 PolarHBondContact O-N 3.25Å; I531-L533 VanDerWaalsContact C-N 3.34Å; I531-L533 PolarHBondContact O-N 3.29Å; L533-K535 VanDerWaalsContact C-N 3.31Å; L533-N536 PolarHBondContact O-ND2 2.89Å; L533-Q539 WeakPolarHBondContact O-CB 3.24Å; L533-H830 HydrophobicContact CD2-CB 3.91Å; L533-L834 HydrophobicContact CD1-CB 4.05Å; L533-L834 HydrophobicContact CD1-CD2 3.62Å; L533-L834 HydrophobicContact CD1-CG 4.44Å; L533-L834 HydrophobicContact CG-CD2 4.46Å
534	V	89.8	Confident	88.5	Confident	44 Å²	44	43.7 Å²	43.7	27%	0.267	22%	0.224	S	C	.	.	H	α-helix	trans	-70.3	-31.9	177.2	172.7	0	0	0	0	111.7	E530 I531 M532 L828	E530-V534 WeakPolarHBondContact O-CG2 3.39Å; E530-V534 PolarHBondContact O-N 3.42Å; E530-V534 VanDerWaalsContact O-N 3.12Å; I531-V534 PolarHBondContact O-N 2.87Å; I531-V534 VanDerWaalsContact O-N 3.17Å; M532-V534 VanDerWaalsContact C-N 3.32Å; M532-V534 PolarHBondContact O-N 2.84Å; V534-L828 HydrophobicContact CG2-CD1 4.17Å; V534-L828 HydrophobicContact CG2-CD2 3.82Å
535	K	91.8	Very high	88.5	Confident	65 Å²	65	46.2 Å²	46.2	28%	0.283	23%	0.234	S	C	.	.	H	α-helix	trans	-91.8	-19.3	-174.2	-75.8	-171.6	176.2	-171.1	0	114.4	I216 W240 L244 I531 M532 L533	I216-K535 HydrophobicContact CD1-CB 4.42Å; I216-K535 HydrophobicContact CG1-CB 4.47Å; I216-K535 HydrophobicContact CG2-CB 4.04Å; I216-K535 HydrophobicContact CG2-CD 3.91Å; W240-K535 PolarHBondContact NE1-O 3.27Å; L244-K535 HydrophobicContact CD2-CB 3.76Å; L244-K535 HydrophobicContact CD2-CD 4.05Å; L244-K535 HydrophobicContact CD2-CG 4.01Å; I531-K535 HydrophobicContact CG2-CD 3.93Å; I531-K535 HydrophobicContact CG2-CG 4.28Å; I531-K535 WeakPolarHBondContact O-CB 3.43Å; I531-K535 WeakPolarHBondContact O-CG 3.26Å; I531-K535 PolarHBondContact O-N 2.8Å; M532-K535 PolarHBondContact O-N 3.36Å; M532-K535 VanDerWaalsContact O-N 3.16Å; L533-K535 VanDerWaalsContact C-N 3.31Å
536	N	92.7	Very high	89	Confident	0 Å²	0	37.6 Å²	37.6	0%	0	19%	0.194	C	C	.	.	S	Bend	trans	-60.3	157.4	-176	73	35.7	0	0	0	113.3	I216 F511 M532 L533 Q538 Q539 F540	I216-N536 HydrophobicContact CD1-CB 4.41Å; F511-N536 HydrophobicContact CD1-CB 4.38Å; F511-N536 WeakPolarHBondContact CD1-ND2 3.4Å; F511-N536 HydrophobicContact CD2-CB 3.7Å; F511-N536 HydrophobicContact CE2-CB 3.84Å; F511-N536 HydrophobicContact CG-CB 4Å; F511-N536 HydrophobicContact CZ-CB 4.26Å; M532-N536 PolarHBondContact O-N 2.86Å; L533-N536 PolarHBondContact O-ND2 2.89Å; N536-Q538 PolarHBondContact OD1-N 2.85Å; N536-Q539 WeakPolarHBondContact OD1-CB 3.36Å; N536-Q539 PolarHBondContact OD1-N 3.34Å; N536-F540 PolarHBondContact O-N 2.83Å
537	F	94.6	Very high	89.5	Confident	0 Å²	0	33.5 Å²	33.5	0%	0	18%	0.176	C	C	.	.	H	α-helix	trans	-70.6	-36.2	-173.3	-174.6	-133.6	0	0	0	111.4	M202 E212 E236 W240 L507 Q539 F540 Q541	M202-F537 HydrophobicContact CE-CD1 3.44Å; M202-F537 VanDerWaalsContact CE-CD1 3.44Å; M202-F537 HydrophobicContact CE-CE1 3.77Å; M202-F537 HydrophobicContact CE-CG 4.28Å; E212-F537 HydrophobicContact CG-CB 4.44Å; E212-F537 WeakPolarHBondContact OE2-CB 3.39Å; E212-F537 PolarHBondContact OE2-N 3.29Å; E212-F537 VanDerWaalsContact OE2-N 3.13Å; E236-F537 HydrophobicContact CG-CE2 4.16Å; E236-F537 HydrophobicContact CG-CZ 4.16Å; W240-F537 HydrophobicContact CB-CD2 3.67Å; W240-F537 HydrophobicContact CB-CE2 3.82Å; W240-F537 AromaticContact CD1-CD2 3.97Å; W240-F537 HydrophobicContact CD2-CB 4.01Å; W240-F537 AromaticContact CD2-CD2 3.63Å; W240-F537 HydrophobicContact CD2-CD2 3.63Å; W240-F537 HydrophobicContact CD2-CE2 4.47Å; W240-F537 HydrophobicContact CD2-CG 4.09Å; W240-F537 HydrophobicContact CE3-CB 4.38Å; W240-F537 HydrophobicContact CE3-CD2 4.03Å; W240-F537 HydrophobicContact CE3-CG 4.29Å; W240-F537 HydrophobicContact CG-CB 4.48Å; W240-F537 AromaticContact CG-CD2 3.48Å; W240-F537 HydrophobicContact CG-CD2 3.48Å; W240-F537 VanDerWaalsContact CG-CD2 3.48Å; W240-F537 HydrophobicContact CG-CE2 4.15Å; W240-F537 HydrophobicContact CG-CG 4.36Å; W240-F537 HydrophobicContact CH2-CB 4.32Å; W240-F537 HydrophobicContact CZ2-CB 3.91Å; L507-F537 WeakPolarHBondContact O-CE1 3.47Å; F537-Q539 PolarHBondContact O-N 3.12Å; F537-F540 HydrophobicContact CD2-CB 4.48Å; F537-F540 HydrophobicContact CD2-CD1 4.29Å; F537-F540 HydrophobicContact CE2-CD1 4.23Å; F537-F540 WeakPolarHBondContact O-CA 3.31Å; F537-F540 VanDerWaalsContact O-CB 3.32Å; F537-F540 WeakPolarHBondContact O-CB 3.26Å; F537-F540 PolarHBondContact O-N 2.96Å; F537-F540 VanDerWaalsContact O-N 3.12Å; F537-Q541 HydrophobicContact CD1-CG 4.36Å; F537-Q541 HydrophobicContact CD2-CG 4.16Å; F537-Q541 HydrophobicContact CE1-CG 4.1Å; F537-Q541 HydrophobicContact CE2-CG 3.9Å; F537-Q541 HydrophobicContact CG-CG 4.39Å; F537-Q541 HydrophobicContact CZ-CG 3.86Å; F537-Q541 WeakPolarHBondContact O-CG 3.48Å; F537-Q541 PolarHBondContact O-N 2.92Å
538	Q	91.7	Very high	89.7	Confident	53 Å²	53	39.3 Å²	39.3	25%	0.248	20%	0.198	C	C	.	.	H	α-helix	trans	-57.3	-47.2	176.5	-167.9	177.5	11.4	0	0	113.1	S509 F511 N536 F540 Q541 C542 H830	S509-Q538 PolarHBondContact OG-N 2.95Å; F511-Q538 HydrophobicContact CB-CB 4.47Å; N536-Q538 PolarHBondContact OD1-N 2.85Å; Q538-F540 VanDerWaalsContact C-N 3.27Å; Q538-F540 PolarHBondContact O-N 3.02Å; Q538-Q541 PolarHBondContact O-N 2.71Å; Q538-C542 PolarHBondContact O-N 2.8Å; Q538-C542 PolarHBondContact O-SG 2.97Å; Q538-C542 VanDerWaalsContact O-SG 3.37Å; Q538-H830 PolarHBondContact OE1-NE2 3.08Å
539	Q	90.4	Very high	89.8	Confident	1 Å²	1	36.4 Å²	36.4	1%	0.005	18%	0.182	C	C	.	.	H	α-helix	trans	-65.8	-34.1	178.1	-174.7	62.8	57.1	0	0	111.3	L533 N536 F537 R543 L828 S829	L533-Q539 WeakPolarHBondContact O-CB 3.24Å; N536-Q539 WeakPolarHBondContact OD1-CB 3.36Å; N536-Q539 PolarHBondContact OD1-N 3.34Å; F537-Q539 PolarHBondContact O-N 3.12Å; Q539-R543 WeakPolarHBondContact O-CB 3.44Å; Q539-R543 WeakPolarHBondContact O-CG 3.4Å; Q539-R543 PolarHBondContact O-N 3.23Å; Q539-R543 VanDerWaalsContact O-N 3.09Å; Q539-L828 HydrophobicContact CG-CD2 4.22Å; Q539-S829 PolarHBondContact OE1-OG 3.11Å
540	F	92	Very high	89.7	Confident	6 Å²	6	41.2 Å²	41.2	3%	0.026	21%	0.205	C	C	.	.	H	α-helix	trans	-63.8	-48.1	172.5	-176	-90	0	0	0	111.3	F42 F45 E236 E239 W240 F243 N536 F537 Q538 C542 R543 S544	F42-F540 HydrophobicContact CZ-CE2 4.34Å; F42-F540 HydrophobicContact CZ-CZ 4.19Å; F45-F540 HydrophobicContact CE2-CE2 4.04Å; F45-F540 AromaticContact CE2-CZ 3.87Å; F45-F540 HydrophobicContact CE2-CZ 3.87Å; F45-F540 AromaticContact CZ-CE2 3.91Å; F45-F540 HydrophobicContact CZ-CE2 3.91Å; F45-F540 HydrophobicContact CZ-CZ 4.1Å; E236-F540 HydrophobicContact CG-CE1 4.5Å; E239-F540 HydrophobicContact CB-CE1 4.12Å; E239-F540 HydrophobicContact CB-CZ 3.77Å; W240-F540 HydrophobicContact CB-CD1 3.9Å; W240-F540 HydrophobicContact CB-CE1 4.03Å; W240-F540 HydrophobicContact CB-CG 4.16Å; W240-F540 HydrophobicContact CB-CZ 4.41Å; W240-F540 AromaticContact CD1-CG 3.83Å; W240-F540 HydrophobicContact CG-CD1 4.48Å; W240-F540 HydrophobicContact CG-CG 4.36Å; F243-F540 HydrophobicContact CB-CD2 4.19Å; F243-F540 HydrophobicContact CB-CE2 3.75Å; F243-F540 AromaticContact CD1-CD2 3.84Å; F243-F540 HydrophobicContact CD1-CD2 3.84Å; F243-F540 HydrophobicContact CD1-CE2 4.27Å; F243-F540 HydrophobicContact CE1-CD2 4.36Å; F243-F540 AromaticContact CG-CD2 3.96Å; F243-F540 HydrophobicContact CG-CD2 3.96Å; F243-F540 AromaticContact CG-CE2 3.94Å; F243-F540 HydrophobicContact CG-CE2 3.94Å; N536-F540 PolarHBondContact O-N 2.83Å; F537-F540 HydrophobicContact CD2-CB 4.48Å; F537-F540 HydrophobicContact CD2-CD1 4.29Å; F537-F540 HydrophobicContact CE2-CD1 4.23Å; F537-F540 WeakPolarHBondContact O-CA 3.31Å; F537-F540 VanDerWaalsContact O-CB 3.32Å; F537-F540 WeakPolarHBondContact O-CB 3.26Å; F537-F540 PolarHBondContact O-N 2.96Å; F537-F540 VanDerWaalsContact O-N 3.12Å; Q538-F540 VanDerWaalsContact C-N 3.27Å; Q538-F540 PolarHBondContact O-N 3.02Å; F540-C542 PolarHBondContact O-N 2.84Å; F540-R543 PolarHBondContact O-N 3.2Å; F540-S544 PolarHBondContact O-N 3.37Å
541	Q	91.2	Very high	89.7	Confident	25 Å²	25	45.1 Å²	45.1	12%	0.117	22%	0.221	C	C	.	.	H	α-helix	trans	-61	-42.9	176.4	-65.7	-171.1	-68.8	0	0	111.9	E236 D508 F537 Q538 R543 S544	E236-Q541 WeakPolarHBondContact OE1-CG 3.39Å; E236-Q541 PolarHBondContact OE2-NE2 3.45Å; D508-Q541 PolarHBondContact OD1-NE2 3.5Å; F537-Q541 HydrophobicContact CD1-CG 4.36Å; F537-Q541 HydrophobicContact CD2-CG 4.16Å; F537-Q541 HydrophobicContact CE1-CG 4.1Å; F537-Q541 HydrophobicContact CE2-CG 3.9Å; F537-Q541 HydrophobicContact CG-CG 4.39Å; F537-Q541 HydrophobicContact CZ-CG 3.86Å; F537-Q541 WeakPolarHBondContact O-CG 3.48Å; F537-Q541 PolarHBondContact O-N 2.92Å; Q538-Q541 PolarHBondContact O-N 2.71Å; Q541-R543 PolarHBondContact O-N 3.13Å; Q541-S544 PolarHBondContact O-N 2.68Å; Q541-S544 PolarHBondContact O-OG 3.32Å
542	C	87.1	Confident	89.7	Confident	49 Å²	49	46.9 Å²	46.9	33%	0.331	22%	0.223	S	C	.	.	H	α-helix	trans	-61.5	-44.9	175.4	-67.5	0	0	0	0	111.7	Q538 F540 S544 E545 T825	Q538-C542 PolarHBondContact O-N 2.8Å; Q538-C542 PolarHBondContact O-SG 2.97Å; Q538-C542 VanDerWaalsContact O-SG 3.37Å; F540-C542 PolarHBondContact O-N 2.84Å; C542-S544 VanDerWaalsContact C-N 3.28Å; C542-S544 PolarHBondContact O-N 2.89Å; C542-E545 PolarHBondContact O-N 3.43Å; C542-T825 HydrophobicContact CB-CG2 4.43Å; C542-T825 WeakPolarHBondContact O-CG2 3.26Å
543	R	86.4	Confident	89.7	Confident	50 Å²	50	48.3 Å²	48.3	19%	0.189	23%	0.231	C	C	.	.	H	α-helix	trans	-68.7	-25.2	-178.8	-76	-178.9	177	159.6	5.6	113.3	F42 Q539 F540 Q541 E545 L546	F42-R543 HydrophobicContact CD2-CB 3.79Å; F42-R543 WeakPolarHBondContact CD2-O 3.44Å; F42-R543 VanDerWaalsContact CE2-C 3.45Å; F42-R543 HydrophobicContact CE2-CB 3.85Å; Q539-R543 WeakPolarHBondContact O-CB 3.44Å; Q539-R543 WeakPolarHBondContact O-CG 3.4Å; Q539-R543 PolarHBondContact O-N 3.23Å; Q539-R543 VanDerWaalsContact O-N 3.09Å; F540-R543 PolarHBondContact O-N 3.2Å; Q541-R543 PolarHBondContact O-N 3.13Å; R543-E545 PolarHBondContact O-N 2.99Å; R543-L546 HydrophobicContact CB-CD1 4.34Å; R543-L546 HydrophobicContact CG-CD1 4.31Å; R543-L546 WeakPolarHBondContact O-CB 3.31Å; R543-L546 PolarHBondContact O-N 3.36Å
544	S	86.2	Confident	89.7	Confident	41 Å²	41	53.3 Å²	53.3	29%	0.287	26%	0.258	S	S	.	.	H	α-helix	trans	-65.8	-20.7	177.6	78.3	0	0	0	0	112.4	F540 Q541 C542 P547	F540-S544 PolarHBondContact O-N 3.37Å; Q541-S544 PolarHBondContact O-N 2.68Å; Q541-S544 PolarHBondContact O-OG 3.32Å; C542-S544 VanDerWaalsContact C-N 3.28Å; C542-S544 PolarHBondContact O-N 2.89Å; S544-P547 WeakPolarHBondContact O-CD 3.37Å
545	E	85.1	Confident	89.8	Confident	87 Å²	87	55.9 Å²	55.9	41%	0.407	27%	0.27	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.3	-20	174.4	-63.2	-167.1	179	0	0	114.2	C542 R543 Y548 L549 R821	C542-E545 PolarHBondContact O-N 3.43Å; R543-E545 PolarHBondContact O-N 2.99Å; E545-Y548 PolarHBondContact O-N 2.97Å; E545-Y548 VanDerWaalsContact O-N 3.1Å; E545-L549 HydrophobicContact CB-CD1 4.39Å; E545-L549 PolarHBondContact O-N 3.41Å; E545-L549 VanDerWaalsContact O-N 3.16Å; E545-R821 IonicContact OE2-NH2 3.86Å; E545-R821 PolarHBondContact OE2-NH2 3.12Å
546	L	86.2	Confident	89.6	Confident	14 Å²	14	53.9 Å²	53.9	7%	0.073	26%	0.263	C	S	.	.	H	α-helix	trans	-52.9	-48.8	-172.6	-76	171.6	0	0	0	113.9	R543 Y548 L549 E550 T825	R543-L546 HydrophobicContact CB-CD1 4.34Å; R543-L546 HydrophobicContact CG-CD1 4.31Å; R543-L546 WeakPolarHBondContact O-CB 3.31Å; R543-L546 PolarHBondContact O-N 3.36Å; L546-Y548 PolarHBondContact O-N 3.08Å; L546-L549 PolarHBondContact O-N 3.45Å; L546-E550 PolarHBondContact O-N 3.23Å; L546-T825 HydrophobicContact CD1-CG2 4.14Å; L546-T825 HydrophobicContact CD2-CG2 3.45Å; L546-T825 VanDerWaalsContact CD2-CG2 3.45Å; L546-T825 HydrophobicContact CG-CG2 3.49Å; L546-T825 VanDerWaalsContact CG-CG2 3.49Å
547	P	86.3	Confident	89.5	Confident	71 Å²	71	56.7 Å²	56.7	46%	0.461	28%	0.277	S	S	.	.	H	α-helix	trans	-60.4	-31.9	-178.2	-23.2	35.3	0	0	0	113.3	S544	S544-P547 WeakPolarHBondContact O-CD 3.37Å
548	Y	88.5	Confident	89.4	Confident	136 Å²	136	60.2 Å²	60.2	53%	0.533	30%	0.301	S	S	.	.	H	α-helix	trans	-74.7	-41.2	177.9	171.1	-100.9	0	0	0	112	E545 L546 K551 R552	E545-Y548 PolarHBondContact O-N 2.97Å; E545-Y548 VanDerWaalsContact O-N 3.1Å; L546-Y548 PolarHBondContact O-N 3.08Å; Y548-K551 PolarHBondContact O-N 3.03Å; Y548-R552 VanDerWaalsContact CE1-CD 3.41Å; Y548-R552 HydrophobicContact CE1-CG 4.42Å; Y548-R552 HydrophobicContact CE2-CG 4.49Å; Y548-R552 PolarHBondContact O-N 3.32Å; Y548-R552 WeakPolarHBondContact OH-CD 3.16Å; Y548-R552 PolarHBondContact OH-NH1 2.93Å
549	L	89.1	Confident	89.3	Confident	1 Å²	1	61 Å²	61	1%	0.005	31%	0.307	C	S	.	.	H	α-helix	trans	-67.6	-42	179.4	-66.8	176.2	0	0	0	112.4	E545 L546 K551 R552 L553 R821 I822	E545-L549 HydrophobicContact CB-CD1 4.39Å; E545-L549 PolarHBondContact O-N 3.41Å; E545-L549 VanDerWaalsContact O-N 3.16Å; L546-L549 PolarHBondContact O-N 3.45Å; L549-K551 VanDerWaalsContact C-N 3.26Å; L549-K551 PolarHBondContact O-N 3.4Å; L549-R552 PolarHBondContact O-N 2.98Å; L549-L553 PolarHBondContact O-N 2.65Å; L549-R821 HydrophobicContact CD1-CB 4.21Å; L549-I822 HydrophobicContact CB-CD1 4.11Å; L549-I822 HydrophobicContact CB-CG1 3.66Å; L549-I822 HydrophobicContact CD1-CG1 4.2Å
550	E	89.7	Confident	89.2	Confident	102 Å²	102	62.2 Å²	62.2	48%	0.477	31%	0.313	S	S	.	.	H	α-helix	trans	-58.6	-38.7	176.9	-73.2	-175.6	157	0	0	112	L546 N554	L546-E550 PolarHBondContact O-N 3.23Å; E550-N554 PolarHBondContact O-ND2 3.32Å
551	K	91.2	Very high	89	Confident	140 Å²	140	70 Å²	70	61%	0.609	35%	0.347	S	S	*	.	H	α-helix	trans	-63	-48.4	175.3	-173.9	-180	177.5	-177.1	0	111.8	Y548 L549 L553 N554 D555	Y548-K551 PolarHBondContact O-N 3.03Å; L549-K551 VanDerWaalsContact C-N 3.26Å; L549-K551 PolarHBondContact O-N 3.4Å; K551-L553 VanDerWaalsContact C-N 3.33Å; K551-L553 PolarHBondContact O-N 3.12Å; K551-N554 PolarHBondContact O-N 2.82Å; K551-D555 PolarHBondContact O-N 2.86Å
552	R	90.1	Very high	88.9	Confident	98 Å²	98	74.9 Å²	74.9	37%	0.37	37%	0.374	S	S	.	.	H	α-helix	trans	-64.4	-34	-178.6	-75	-175.9	60.2	164.6	-3.2	114.1	Y548 L549 D555 T556 I818	Y548-R552 VanDerWaalsContact CE1-CD 3.41Å; Y548-R552 HydrophobicContact CE1-CG 4.42Å; Y548-R552 HydrophobicContact CE2-CG 4.49Å; Y548-R552 PolarHBondContact O-N 3.32Å; Y548-R552 WeakPolarHBondContact OH-CD 3.16Å; Y548-R552 PolarHBondContact OH-NH1 2.93Å; L549-R552 PolarHBondContact O-N 2.98Å; R552-D555 PolarHBondContact O-N 3.37Å; R552-T556 PolarHBondContact O-N 3.4Å; R552-T556 VanDerWaalsContact O-N 3.16Å; R552-T556 PolarHBondContact O-OG1 3.42Å; R552-I818 HydrophobicContact CB-CD1 4.3Å
553	L	91.1	Very high	88.8	Confident	32 Å²	32	73.1 Å²	73.1	17%	0.168	36%	0.361	C	S	.	.	H	α-helix	trans	-59.8	-50	177.2	-179.4	69.6	0	0	0	110.6	L549 K551 D555 T556 E557 I818 R819 I822	L549-L553 PolarHBondContact O-N 2.65Å; K551-L553 VanDerWaalsContact C-N 3.33Å; K551-L553 PolarHBondContact O-N 3.12Å; L553-D555 VanDerWaalsContact C-N 3.32Å; L553-D555 PolarHBondContact O-N 3.04Å; L553-T556 PolarHBondContact O-N 3.31Å; L553-E557 PolarHBondContact O-N 3.25Å; L553-I818 HydrophobicContact CB-CG2 3.94Å; L553-I818 HydrophobicContact CD1-CG2 4.04Å; L553-R819 HydrophobicContact CD1-CG 3.42Å; L553-R819 VanDerWaalsContact CD1-CG 3.42Å; L553-I822 HydrophobicContact CB-CD1 4.17Å; L553-I822 HydrophobicContact CD2-CD1 4.02Å
554	N	92.4	Very high	88.6	Confident	104 Å²	104	75.4 Å²	75.4	56%	0.556	38%	0.383	S	S	*	.	H	α-helix	trans	-61.3	-40.3	-179.6	-66.8	-28.3	0	0	0	111.9	E550 K551	E550-N554 PolarHBondContact O-ND2 3.32Å; K551-N554 PolarHBondContact O-N 2.82Å
555	D	92.4	Very high	88.7	Confident	98 Å²	98	76 Å²	76	52%	0.524	38%	0.38	S	S	.	.	H	α-helix	trans	-66.2	-41.3	180	-65.1	-21.5	0	0	0	112.5	K551 R552 L553 S558 L559	K551-D555 PolarHBondContact O-N 2.86Å; R552-D555 PolarHBondContact O-N 3.37Å; L553-D555 VanDerWaalsContact C-N 3.32Å; L553-D555 PolarHBondContact O-N 3.04Å; D555-S558 WeakPolarHBondContact O-CB 3.49Å; D555-S558 PolarHBondContact O-N 3.33Å; D555-L559 PolarHBondContact O-N 3.08Å
556	T	87.2	Confident	88.6	Confident	24 Å²	24	73.7 Å²	73.7	15%	0.147	37%	0.373	C	S	.	.	H	α-helix	trans	-73.5	-37.3	-176.2	-50.5	0	0	0	0	112.3	R552 L553 S558 L559 I560 L815	R552-T556 PolarHBondContact O-N 3.4Å; R552-T556 VanDerWaalsContact O-N 3.16Å; R552-T556 PolarHBondContact O-OG1 3.42Å; L553-T556 PolarHBondContact O-N 3.31Å; T556-S558 PolarHBondContact O-N 3.22Å; T556-L559 PolarHBondContact O-N 3.27Å; T556-L559 VanDerWaalsContact O-N 3.15Å; T556-I560 HydrophobicContact CG2-CD1 4.21Å; T556-I560 PolarHBondContact O-N 3.13Å; T556-L815 HydrophobicContact CG2-CB 4Å; T556-L815 HydrophobicContact CG2-CD1 4.5Å
557	E	91.5	Very high	88.2	Confident	59 Å²	59	82.9 Å²	82.9	28%	0.276	42%	0.416	S	S	.	.	H	α-helix	trans	-59.7	-34.1	175	-83.3	-176.4	-174.2	0	0	112.8	L553 L815 R819	L553-E557 PolarHBondContact O-N 3.25Å; E557-L815 HydrophobicContact CB-CD1 4.39Å; E557-L815 HydrophobicContact CG-CD1 3.55Å; E557-R819 IonicContact OE1-CZ 3.6Å; E557-R819 IonicContact OE1-NE 3.49Å; E557-R819 IonicContact OE1-NH2 3.14Å; E557-R819 PolarHBondContact OE1-NH2 2.94Å
558	S	91.3	Very high	87.9	Confident	73 Å²	73	84.5 Å²	84.5	51%	0.51	42%	0.421	S	S	.	.	H	α-helix	trans	-67.4	-41.4	175.2	-169.2	0	0	0	0	111.7	D555 T556 N562	D555-S558 WeakPolarHBondContact O-CB 3.49Å; D555-S558 PolarHBondContact O-N 3.33Å; T556-S558 PolarHBondContact O-N 3.22Å; S558-N562 PolarHBondContact O-ND2 3Å
559	L	89.7	Confident	87.6	Confident	70 Å²	70	79 Å²	79	37%	0.366	40%	0.401	S	S	.	.	H	α-helix	trans	-69.2	-40.8	-173.8	-170.2	143.4	0	0	0	113.8	D555 T556 K561 N562 W807 N811	D555-L559 PolarHBondContact O-N 3.08Å; T556-L559 PolarHBondContact O-N 3.27Å; T556-L559 VanDerWaalsContact O-N 3.15Å; L559-K561 VanDerWaalsContact C-N 3.34Å; L559-K561 PolarHBondContact O-N 3.21Å; L559-N562 PolarHBondContact O-N 2.76Å; L559-W807 HydrophobicContact CD2-CZ2 4.19Å; L559-N811 HydrophobicContact CD2-CB 4.22Å
560	I	88.3	Confident	87.5	Confident	26 Å²	26	83.4 Å²	83.4	13%	0.133	42%	0.424	C	S	.	.	H	α-helix	trans	-66.4	-34.8	-177.2	-70.9	159.4	0	0	0	112.4	T556 N562 I563 N811 L812 L815	T556-I560 HydrophobicContact CG2-CD1 4.21Å; T556-I560 PolarHBondContact O-N 3.13Å; I560-N562 PolarHBondContact O-N 3.07Å; I560-N562 VanDerWaalsContact O-N 3.08Å; I560-I563 PolarHBondContact O-N 3.04Å; I560-N811 HydrophobicContact CD1-CB 4.41Å; I560-N811 HydrophobicContact CG1-CB 3.86Å; I560-L812 HydrophobicContact CD1-CD2 4.19Å; I560-L812 HydrophobicContact CG2-CD2 3.85Å; I560-L812 HydrophobicContact CG2-CG 4.31Å; I560-L815 HydrophobicContact CD1-CB 3.79Å; I560-L815 HydrophobicContact CD1-CD1 3.52Å; I560-L815 HydrophobicContact CD1-CG 4.3Å
561	K	87.7	Confident	87.2	Confident	171 Å²	171	82 Å²	82	74%	0.743	42%	0.418	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.2	-15.4	178.9	-73.4	176.6	-179.3	171	0	113	L559	L559-K561 VanDerWaalsContact C-N 3.34Å; L559-K561 PolarHBondContact O-N 3.21Å
562	N	89	Confident	87	Confident	127 Å²	127	77.9 Å²	77.9	68%	0.679	42%	0.415	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.9	3.6	-174.5	-61.6	-25.9	0	0	0	115.2	S558 L559 I560	S558-N562 PolarHBondContact O-ND2 3Å; L559-N562 PolarHBondContact O-N 2.76Å; I560-N562 PolarHBondContact O-N 3.07Å; I560-N562 VanDerWaalsContact O-N 3.08Å
563	I	85.9	Confident	86.8	Confident	12 Å²	12	77 Å²	77	6%	0.062	42%	0.415	C	S	.	.			trans	-101.8	117.6	-174.3	-49.6	176.9	0	0	0	114	I560 W807 K808	I560-I563 PolarHBondContact O-N 3.04Å; I563-W807 HydrophobicContact CD1-CD2 4.15Å; I563-W807 HydrophobicContact CD1-CE3 3.77Å; I563-W807 HydrophobicContact CD1-CH2 4.24Å; I563-W807 HydrophobicContact CD1-CZ3 3.82Å; I563-W807 HydrophobicContact CG1-CE3 4.04Å; I563-W807 HydrophobicContact CG1-CH2 4.16Å; I563-W807 HydrophobicContact CG1-CZ3 3.66Å; I563-W807 HydrophobicContact CG2-CE3 4.17Å; I563-W807 HydrophobicContact CG2-CZ3 4.29Å; I563-K808 HydrophobicContact CB-CD 4.4Å; I563-K808 HydrophobicContact CB-CG 4.4Å; I563-K808 HydrophobicContact CD1-CB 4.25Å; I563-K808 HydrophobicContact CD1-CG 4.26Å; I563-K808 HydrophobicContact CG2-CB 3.98Å; I563-K808 HydrophobicContact CG2-CD 4.12Å; I563-K808 HydrophobicContact CG2-CG 4.18Å; I563-K808 PolarHBondContact O-NZ 2.98Å
564	C	82.5	Confident	86.7	Confident	98 Å²	98	75.4 Å²	75.4	66%	0.662	41%	0.407	S	S	*	.			trans	-124.5	152.3	-174.8	-58.9	0	0	0	0	115.1
565	F	86.8	Confident	86.5	Confident	52 Å²	52	71.3 Å²	71.3	23%	0.228	39%	0.389	C	S	.	.			trans	-115.9	155	176	-66.4	-89.5	0	0	0	111.8	M571 R804 F805 K808	F565-M571 HydrophobicContact CD1-CE 4.15Å; F565-M571 HydrophobicContact CD1-SD 4.11Å; F565-M571 HydrophobicContact CD2-CE 4.15Å; F565-M571 HydrophobicContact CE1-CE 4.03Å; F565-M571 HydrophobicContact CE2-CE 4.02Å; F565-M571 HydrophobicContact CG-CE 4.22Å; F565-M571 HydrophobicContact CG-SD 4.17Å; F565-M571 HydrophobicContact CZ-CE 3.98Å; F565-R804 HydrophobicContact CE1-CB 4.21Å; F565-F805 HydrophobicContact CE1-CB 4.14Å; F565-F805 HydrophobicContact CE1-CD2 4.29Å; F565-F805 HydrophobicContact CZ-CB 4.42Å; F565-F805 HydrophobicContact CZ-CD2 4.27Å; F565-K808 HydrophobicContact CE2-CD 3.68Å; F565-K808 HydrophobicContact CZ-CB 4.5Å; F565-K808 HydrophobicContact CZ-CD 4.29Å
566	P	84.2	Confident	86.3	Confident	40 Å²	40	68.6 Å²	68.6	26%	0.26	38%	0.381	S	S	.	.			trans	-60.4	146.9	171.7	-22.4	35.3	0	0	0	112.7	D568 I569 L801	P566-D568 VanDerWaalsContact C-N 3.32Å; P566-D568 WeakPolarHBondContact CB-OD1 3.24Å; P566-D568 PolarHBondContact O-N 2.41Å; P566-I569 WeakPolarHBondContact O-CG2 3.44Å; P566-L801 HydrophobicContact CG-CD2 4.04Å
567	E	78.4	Confident	86.5	Confident	206 Å²	206	68.6 Å²	68.6	96%	0.963	38%	0.378	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.4	-20.6	-176.4	-64.9	-174.4	168.8	0	0	113.8	I569	E567-I569 VanDerWaalsContact C-N 3.35Å
568	D	79.1	Confident	86.4	Confident	106 Å²	106	67.3 Å²	67.3	57%	0.567	37%	0.374	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.3	-4.5	-175.2	65.7	-56.7	0	0	0	114.1	P566 R795	P566-D568 VanDerWaalsContact C-N 3.32Å; P566-D568 WeakPolarHBondContact CB-OD1 3.24Å; P566-D568 PolarHBondContact O-N 2.41Å; D568-R795 IonicContact OD2-CZ 3.54Å; D568-R795 IonicContact OD2-NH1 2.84Å; D568-R795 PolarHBondContact OD2-NH1 2.87Å; D568-R795 IonicContact OD2-NH2 3.9Å; D568-R795 PolarHBondContact OD2-NH2 3.32Å; D568-R795 VanDerWaalsContact OD2-NH2 3.15Å
569	I	83.3	Confident	86.3	Confident	21 Å²	21	69.9 Å²	69.9	11%	0.108	38%	0.376	C	S	.	.			trans	-90.3	129.4	-170.8	-156.2	167.5	0	0	0	112.9	P566 E567 M571 L574 L801	P566-I569 WeakPolarHBondContact O-CG2 3.44Å; E567-I569 VanDerWaalsContact C-N 3.35Å; I569-M571 HydrophobicContact CG2-CG 4.21Å; I569-M571 HydrophobicContact CG2-SD 3.65Å; I569-M571 PolarHBondContact O-N 3.39Å; I569-L574 HydrophobicContact CD1-CB 4.31Å; I569-L574 HydrophobicContact CD1-CD2 3.83Å; I569-L574 HydrophobicContact CD1-CG 4.46Å; I569-L801 HydrophobicContact CD1-CB 4.26Å; I569-L801 HydrophobicContact CD1-CD1 3.42Å; I569-L801 VanDerWaalsContact CD1-CD1 3.42Å; I569-L801 HydrophobicContact CD1-CD2 3.57Å; I569-L801 HydrophobicContact CD1-CG 3.92Å
570	D	85	Confident	86.3	Confident	92 Å²	92	69 Å²	69	49%	0.492	37%	0.371	S	S	.	.			trans	-78.3	102.1	164.4	-174.3	-25.1	0	0	0	108.9	G572 Q573 L574	D570-G572 PolarHBondContact O-N 3.37Å; D570-G572 VanDerWaalsContact OD1-CA 3.3Å; D570-G572 WeakPolarHBondContact OD1-CA 3.19Å; D570-G572 PolarHBondContact OD1-N 3.39Å; D570-Q573 HydrophobicContact CB-CB 4.09Å; D570-Q573 HydrophobicContact CB-CG 3.97Å; D570-Q573 PolarHBondContact O-N 3.04Å; D570-Q573 VanDerWaalsContact O-N 3.13Å; D570-Q573 PolarHBondContact OD1-N 3.46Å; D570-Q573 WeakPolarHBondContact OD2-CG 3.46Å; D570-L574 PolarHBondContact O-N 2.93Å
571	M	84.5	Confident	86.3	Confident	74 Å²	74	72.5 Å²	72.5	37%	0.365	39%	0.387	S	S	.	.	H	α-helix	trans	-59	-25.7	178.2	-66.7	-63.6	-73.1	0	0	112.8	F565 I569 G575 F805	F565-M571 HydrophobicContact CD1-CE 4.15Å; F565-M571 HydrophobicContact CD1-SD 4.11Å; F565-M571 HydrophobicContact CD2-CE 4.15Å; F565-M571 HydrophobicContact CE1-CE 4.03Å; F565-M571 HydrophobicContact CE2-CE 4.02Å; F565-M571 HydrophobicContact CG-CE 4.22Å; F565-M571 HydrophobicContact CG-SD 4.17Å; F565-M571 HydrophobicContact CZ-CE 3.98Å; I569-M571 HydrophobicContact CG2-CG 4.21Å; I569-M571 HydrophobicContact CG2-SD 3.65Å; I569-M571 PolarHBondContact O-N 3.39Å; M571-G575 PolarHBondContact O-N 3.48Å; M571-G575 VanDerWaalsContact O-N 3.15Å; M571-F805 HydrophobicContact CE-CD2 3.62Å; M571-F805 HydrophobicContact CE-CE2 3.65Å
572	G	86.2	Confident	86.2	Confident	52 Å²	52	70.9 Å²	70.9	54%	0.536	38%	0.382	S	S	.	.	H	α-helix	trans	-71.4	-42.6	174.9	0	0	0	0	0	112.6	D570 G575 A576	D570-G572 PolarHBondContact O-N 3.37Å; D570-G572 VanDerWaalsContact OD1-CA 3.3Å; D570-G572 WeakPolarHBondContact OD1-CA 3.19Å; D570-G572 PolarHBondContact OD1-N 3.39Å; G572-G575 PolarHBondContact O-N 2.98Å; G572-A576 PolarHBondContact O-N 3.09Å; G572-A576 VanDerWaalsContact O-N 3.14Å
573	Q	87.3	Confident	86.3	Confident	79 Å²	79	66.7 Å²	66.7	37%	0.369	37%	0.365	S	S	.	.	H	α-helix	trans	-68.4	-40.5	175.7	-67.1	-68.1	-25.6	0	0	112	D570 G575 A576 Y577 I792	D570-Q573 HydrophobicContact CB-CB 4.09Å; D570-Q573 HydrophobicContact CB-CG 3.97Å; D570-Q573 PolarHBondContact O-N 3.04Å; D570-Q573 VanDerWaalsContact O-N 3.13Å; D570-Q573 PolarHBondContact OD1-N 3.46Å; D570-Q573 WeakPolarHBondContact OD2-CG 3.46Å; Q573-G575 VanDerWaalsContact C-N 3.3Å; Q573-G575 PolarHBondContact O-N 3.17Å; Q573-A576 PolarHBondContact O-N 2.87Å; Q573-A576 VanDerWaalsContact O-N 3.13Å; Q573-Y577 PolarHBondContact O-N 2.84Å; Q573-I792 HydrophobicContact CB-CD1 3.46Å; Q573-I792 VanDerWaalsContact CB-CD1 3.46Å; Q573-I792 HydrophobicContact CB-CG1 4.11Å
574	L	88.4	Confident	86.5	Confident	0 Å²	0	66.9 Å²	66.9	0%	0	37%	0.367	C	S	.	.	H	α-helix	trans	-60.3	-44.8	176.3	178.4	63.6	0	0	0	110.2	I569 D570 A576 Y577 V578 I792 L798 L801 I802 F805	I569-L574 HydrophobicContact CD1-CB 4.31Å; I569-L574 HydrophobicContact CD1-CD2 3.83Å; I569-L574 HydrophobicContact CD1-CG 4.46Å; D570-L574 PolarHBondContact O-N 2.93Å; L574-A576 VanDerWaalsContact C-N 3.28Å; L574-A576 PolarHBondContact O-N 2.85Å; L574-Y577 PolarHBondContact O-N 2.69Å; L574-V578 HydrophobicContact CD1-CG2 4.49Å; L574-V578 WeakPolarHBondContact O-CG2 3.29Å; L574-V578 PolarHBondContact O-N 3.16Å; L574-I792 HydrophobicContact CB-CD1 4.11Å; L574-L798 HydrophobicContact CD1-CD1 4.26Å; L574-L801 HydrophobicContact CD1-CB 3.97Å; L574-L801 HydrophobicContact CD2-CB 4.17Å; L574-I802 HydrophobicContact CD1-CG1 4.2Å; L574-F805 HydrophobicContact CD2-CB 4.15Å; L574-F805 HydrophobicContact CD2-CD2 4.09Å; L574-F805 HydrophobicContact CD2-CG 4.39Å
575	G	87.6	Confident	86.6	Confident	18 Å²	18	64.9 Å²	64.9	19%	0.186	36%	0.357	C	S	.	.	H	α-helix	trans	-58.7	-36.3	174.7	0	0	0	0	0	113.6	M571 G572 Q573 K579	M571-G575 PolarHBondContact O-N 3.48Å; M571-G575 VanDerWaalsContact O-N 3.15Å; G572-G575 PolarHBondContact O-N 2.98Å; Q573-G575 VanDerWaalsContact C-N 3.3Å; Q573-G575 PolarHBondContact O-N 3.17Å; G575-K579 WeakPolarHBondContact O-CG 3.44Å
576	A	89.2	Confident	86.5	Confident	41 Å²	41	65.9 Å²	65.9	34%	0.339	37%	0.367	S	S	.	.	H	α-helix	trans	-72.8	-37.8	177.5	0	0	0	0	0	113.2	G572 Q573 L574 K579 L580	G572-A576 PolarHBondContact O-N 3.09Å; G572-A576 VanDerWaalsContact O-N 3.14Å; Q573-A576 PolarHBondContact O-N 2.87Å; Q573-A576 VanDerWaalsContact O-N 3.13Å; L574-A576 VanDerWaalsContact C-N 3.28Å; L574-A576 PolarHBondContact O-N 2.85Å; A576-K579 PolarHBondContact O-N 2.85Å; A576-L580 PolarHBondContact O-N 3.14Å
577	Y	91.1	Very high	86.7	Confident	23 Å²	23	65.1 Å²	65.1	9%	0.09	36%	0.362	C	S	.	.	H	α-helix	trans	-64.5	-46.9	178.2	-173.5	-85.4	0	0	0	112	Q573 L574 K579 L580 H581 N790 I792 L798 I802	Q573-Y577 PolarHBondContact O-N 2.84Å; L574-Y577 PolarHBondContact O-N 2.69Å; Y577-K579 PolarHBondContact O-N 3.26Å; Y577-K579 VanDerWaalsContact O-N 3.15Å; Y577-L580 PolarHBondContact O-N 2.63Å; Y577-H581 HydrophobicContact CE1-CB 4.47Å; Y577-H581 PolarHBondContact O-N 3.2Å; Y577-H581 VanDerWaalsContact O-N 3.15Å; Y577-N790 HydrophobicContact CD2-CB 4Å; Y577-I792 HydrophobicContact CD2-CB 4.44Å; Y577-I792 HydrophobicContact CD2-CG2 4.38Å; Y577-I792 HydrophobicContact CG-CG2 4.3Å; Y577-L798 HydrophobicContact CD1-CD1 3.82Å; Y577-L798 HydrophobicContact CD1-CD2 3.93Å; Y577-L798 HydrophobicContact CD1-CG 4.17Å; Y577-L798 HydrophobicContact CD2-CD2 4.2Å; Y577-L798 HydrophobicContact CE1-CD1 4.02Å; Y577-L798 HydrophobicContact CE1-CD2 3.36Å; Y577-L798 HydrophobicContact CE1-CG 3.83Å; Y577-L798 HydrophobicContact CE2-CD2 3.68Å; Y577-L798 HydrophobicContact CG-CD1 4.28Å; Y577-L798 HydrophobicContact CG-CD2 4.32Å; Y577-L798 WeakPolarHBondContact OH-CD2 3.28Å; Y577-I802 HydrophobicContact CD1-CD1 3.77Å; Y577-I802 HydrophobicContact CE1-CD1 3.77Å
578	V	88.8	Confident	87.1	Confident	32 Å²	32	58.4 Å²	58.4	19%	0.194	33%	0.331	C	S	.	.	H	α-helix	trans	-55	-35.8	178.9	174.5	0	0	0	0	111.4	L574 I802	L574-V578 HydrophobicContact CD1-CG2 4.49Å; L574-V578 WeakPolarHBondContact O-CG2 3.29Å; L574-V578 PolarHBondContact O-N 3.16Å; V578-I802 HydrophobicContact CG2-CB 4.23Å; V578-I802 HydrophobicContact CG2-CD1 4.39Å; V578-I802 HydrophobicContact CG2-CG1 3.73Å; V578-I802 HydrophobicContact CG2-CG2 3.95Å
579	K	89.5	Confident	87.2	Confident	128 Å²	128	56.3 Å²	56.3	56%	0.557	33%	0.329	S	S	*	.	H	α-helix	trans	-68.8	-40.8	177.6	-68.6	175.4	-178.1	-177.8	0	113.5	G575 A576 Y577	G575-K579 WeakPolarHBondContact O-CG 3.44Å; A576-K579 PolarHBondContact O-N 2.85Å; Y577-K579 PolarHBondContact O-N 3.26Å; Y577-K579 VanDerWaalsContact O-N 3.15Å
580	L	90.2	Very high	87.3	Confident	50 Å²	50	59.9 Å²	59.9	26%	0.262	35%	0.345	S	S	.	.	H	α-helix	trans	-68.4	-40.6	179.2	-74.2	171.3	0	0	0	112.2	A576 Y577 H582 A583 M787	A576-L580 PolarHBondContact O-N 3.14Å; Y577-L580 PolarHBondContact O-N 2.63Å; L580-H582 VanDerWaalsContact C-N 3.27Å; L580-H582 PolarHBondContact O-N 3.34Å; L580-A583 PolarHBondContact O-N 2.94Å; L580-A583 VanDerWaalsContact O-N 3.1Å; L580-M787 HydrophobicContact CB-CG 3.99Å
581	H	88.3	Confident	87.5	Confident	101 Å²	101	58.3 Å²	58.3	47%	0.468	33%	0.332	S	S	.	.	H	α-helix	trans	-56.2	-43.5	178.8	-179.5	-88.5	0	0	0	111.7	Y577 A583 M787	Y577-H581 HydrophobicContact CE1-CB 4.47Å; Y577-H581 PolarHBondContact O-N 3.2Å; Y577-H581 VanDerWaalsContact O-N 3.15Å; H581-A583 VanDerWaalsContact C-N 3.3Å; H581-A583 PolarHBondContact O-N 3.42Å; H581-M787 HydrophobicContact CB-CE 4.11Å
582	H	85.9	Confident	87.4	Confident	137 Å²	137	56.2 Å²	56.2	63%	0.634	32%	0.32	S	S	*	.	H	α-helix	trans	-62.7	-33.6	178.3	-170.2	62.2	0	0	0	113.3	L580	L580-H582 VanDerWaalsContact C-N 3.27Å; L580-H582 PolarHBondContact O-N 3.34Å
583	A	89.7	Confident	87.3	Confident	39 Å²	39	56 Å²	56	32%	0.322	31%	0.314	S	S	.	.	H	α-helix	trans	-70.5	-32.2	-177.1	0	0	0	0	0	114.3	L580 H581	L580-A583 PolarHBondContact O-N 2.94Å; L580-A583 VanDerWaalsContact O-N 3.1Å; H581-A583 VanDerWaalsContact C-N 3.3Å; H581-A583 PolarHBondContact O-N 3.42Å
584	V	89.7	Confident	87.2	Confident	16 Å²	16	53.5 Å²	53.5	10%	0.097	30%	0.303	C	S	.	.	H	α-helix	trans	-67.8	-41.5	179.6	168	0	0	0	0	112.1	V586 C587 E588 L783 K784 M787	V584-V586 PolarHBondContact O-N 2.93Å; V584-C587 PolarHBondContact O-N 2.92Å; V584-E588 PolarHBondContact O-N 3.26Å; V584-L783 HydrophobicContact CG2-CB 3.57Å; V584-L783 HydrophobicContact CG2-CD1 4.32Å; V584-K784 HydrophobicContact CG1-CG 4.32Å; V584-K784 HydrophobicContact CG2-CG 4.47Å; V584-M787 HydrophobicContact CB-SD 4.23Å; V584-M787 HydrophobicContact CG2-SD 3.47Å; V584-M787 WeakPolarHBondContact CG2-SD 3.35Å
585	A	85.5	Confident	87	Confident	55 Å²	55	53.6 Å²	53.6	46%	0.455	30%	0.303	S	S	.	.	H	α-helix	trans	-57.7	-38.5	-179.2	0	0	0	0	0	111.7
586	V	85.2	Confident	86.7	Confident	74 Å²	74	53.3 Å²	53.3	45%	0.448	30%	0.298	S	S	.	.	H	α-helix	trans	-63.1	-44.9	179.6	178.6	0	0	0	0	112.2	V584 E588	V584-V586 PolarHBondContact O-N 2.93Å; V586-E588 PolarHBondContact O-N 3.4Å
587	C	87.8	Confident	86.2	Confident	23 Å²	23	57 Å²	57	16%	0.155	31%	0.308	C	S	.	.	H	α-helix	trans	-68.8	-32.8	-177.6	-67.6	0	0	0	0	114.2	V584 A589 E590 R591 I780 L783	V584-C587 PolarHBondContact O-N 2.92Å; C587-A589 VanDerWaalsContact C-N 3.34Å; C587-A589 PolarHBondContact O-N 3.36Å; C587-E590 PolarHBondContact O-N 2.79Å; C587-R591 PolarHBondContact O-N 3.04Å; C587-I780 HydrophobicContact CB-CG1 3.76Å; C587-L783 HydrophobicContact CB-CD1 4.42Å; C587-L783 VanDerWaalsContact SG-CD1 3.59Å
588	E	86	Confident	85.7	Confident	65 Å²	65	59.6 Å²	59.6	30%	0.304	32%	0.318	S	S	.	.	H	α-helix	trans	-66.1	-36.4	-180	-72	-167.9	162.8	0	0	112.5	V584 V586 I780 K784	V584-E588 PolarHBondContact O-N 3.26Å; V586-E588 PolarHBondContact O-N 3.4Å; E588-I780 HydrophobicContact CG-CD1 4.03Å; E588-I780 HydrophobicContact CG-CG1 4.3Å; E588-I780 HydrophobicContact CG-CG2 4.29Å; E588-K784 WeakPolarHBondContact OE1-CE 3.49Å; E588-K784 IonicContact OE1-NZ 2.67Å; E588-K784 PolarHBondContact OE1-NZ 3.11Å
589	A	82.2	Confident	84.9	Confident	63 Å²	63	65.9 Å²	65.9	52%	0.521	34%	0.343	S	S	.	.	H	α-helix	trans	-63.6	-42.5	175.5	0	0	0	0	0	112	C587 R591 W592 A593	C587-A589 VanDerWaalsContact C-N 3.34Å; C587-A589 PolarHBondContact O-N 3.36Å; A589-R591 PolarHBondContact O-N 2.89Å; A589-W592 PolarHBondContact O-N 2.83Å; A589-A593 PolarHBondContact O-N 2.91Å
590	E	85.2	Confident	84.3	Confident	96 Å²	96	62.1 Å²	62.1	45%	0.449	33%	0.333	S	S	.	.	H	α-helix	trans	-63.2	-40	179.4	-66.8	-176.5	166.8	0	0	113	C587 W592 A593 Q776	C587-E590 PolarHBondContact O-N 2.79Å; E590-W592 VanDerWaalsContact C-N 3.32Å; E590-W592 PolarHBondContact O-N 3.36Å; E590-A593 PolarHBondContact O-N 3.28Å; E590-Q776 PolarHBondContact OE2-NE2 3.49Å
591	R	88.1	Confident	84	Confident	59 Å²	59	60 Å²	60	22%	0.223	32%	0.322	C	S	.	.	H	α-helix	trans	-59.2	-42.8	179.5	-174.4	-174.2	61.8	86.5	5.7	112	C587 A589 L594 Q776 I780	C587-R591 PolarHBondContact O-N 3.04Å; A589-R591 PolarHBondContact O-N 2.89Å; R591-L594 PolarHBondContact O-N 3.21Å; R591-Q776 HydrophobicContact CB-CB 3.92Å; R591-Q776 HydrophobicContact CG-CB 4.06Å; R591-I780 HydrophobicContact CB-CD1 4.15Å
592	W	84.4	Confident	83.6	Confident	29 Å²	29	56.7 Å²	56.7	11%	0.11	31%	0.307	C	S	.	.	H	α-helix	trans	-71.4	-38.5	-176.6	-178.2	-102.2	0	0	0	112.6	A589 E590 L594 V595 S596 L703 S704 G705 I706	A589-W592 PolarHBondContact O-N 2.83Å; E590-W592 VanDerWaalsContact C-N 3.32Å; E590-W592 PolarHBondContact O-N 3.36Å; W592-L594 PolarHBondContact O-N 2.87Å; W592-L594 VanDerWaalsContact O-N 3.07Å; W592-V595 HydrophobicContact CE3-CB 4.31Å; W592-V595 HydrophobicContact CE3-CG1 4.36Å; W592-V595 HydrophobicContact CZ3-CG1 4.07Å; W592-V595 PolarHBondContact O-N 3.14Å; W592-S596 PolarHBondContact O-N 2.66Å; W592-S596 VanDerWaalsContact O-N 3.14Å; W592-L703 VanDerWaalsContact CE2-O 3.3Å; W592-L703 HydrophobicContact CZ2-CB 3.67Å; W592-L703 VanDerWaalsContact NE1-C 3.26Å; W592-L703 PolarHBondContact NE1-O 3.07Å; W592-S704 VanDerWaalsContact CE2-CA 3.45Å; W592-S704 VanDerWaalsContact CE3-O 3.32Å; W592-G705 VanDerWaalsContact CH2-CA 3.49Å; W592-I706 HydrophobicContact CH2-CG1 4.18Å
593	A	83.2	Confident	83.5	Confident	49 Å²	49	54.6 Å²	54.6	41%	0.405	31%	0.306	S	S	.	.	H	α-helix	trans	-56.3	-26.2	176	0	0	0	0	0	113.3	A589 E590 S596 Q597	A589-A593 PolarHBondContact O-N 2.91Å; E590-A593 PolarHBondContact O-N 3.28Å; A593-S596 PolarHBondContact O-OG 3.35Å; A593-Q597 WeakPolarHBondContact O-CG 3.19Å; A593-Q597 PolarHBondContact O-NE2 3.48Å
594	L	85.1	Confident	83.4	Confident	26 Å²	26	55.3 Å²	55.3	14%	0.136	30%	0.302	C	S	.	.	H	α-helix	trans	-80.1	-36.5	174.9	-66.3	170.8	0	0	0	113.4	R591 W592 R772 V773 Q776	R591-L594 PolarHBondContact O-N 3.21Å; W592-L594 PolarHBondContact O-N 2.87Å; W592-L594 VanDerWaalsContact O-N 3.07Å; L594-R772 HydrophobicContact CD1-CB 3.83Å; L594-R772 HydrophobicContact CD2-CB 4.44Å; L594-V773 HydrophobicContact CB-CG2 3.75Å; L594-V773 HydrophobicContact CD1-CG2 4.39Å; L594-Q776 HydrophobicContact CD1-CG 4.03Å
595	V	84.8	Confident	83.2	Confident	1 Å²	1	55.1 Å²	55.1	1%	0.006	30%	0.299	C	S	.	.	H	α-helix	trans	-72.3	-42.8	-176.6	172.8	0	0	0	0	111.2	W592 Q597 R598 V601 P762 L766 I768 V773	W592-V595 HydrophobicContact CE3-CB 4.31Å; W592-V595 HydrophobicContact CE3-CG1 4.36Å; W592-V595 HydrophobicContact CZ3-CG1 4.07Å; W592-V595 PolarHBondContact O-N 3.14Å; V595-Q597 PolarHBondContact O-N 3.36Å; V595-R598 PolarHBondContact O-N 2.95Å; V595-V601 HydrophobicContact CG1-CG2 4.47Å; V595-P762 HydrophobicContact CG2-CB 3.83Å; V595-P762 HydrophobicContact CG2-CG 3.88Å; V595-L766 HydrophobicContact CG1-CD1 4.24Å; V595-I768 HydrophobicContact CG1-CD1 3.86Å; V595-V773 HydrophobicContact CG2-CG1 3.99Å; V595-V773 HydrophobicContact CG2-CG2 4.26Å
596	S	80.6	Confident	83.2	Confident	13 Å²	13	57 Å²	57	9%	0.091	30%	0.299	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61.6	-24.7	-177.8	61.1	0	0	0	0	113.8	W592 A593 R598 L700	W592-S596 PolarHBondContact O-N 2.66Å; W592-S596 VanDerWaalsContact O-N 3.14Å; A593-S596 PolarHBondContact O-OG 3.35Å; S596-R598 VanDerWaalsContact C-N 3.25Å; S596-R598 PolarHBondContact O-N 2.84Å; S596-L700 WeakPolarHBondContact O-CD2 3.41Å
597	Q	79.8	Confident	83.4	Confident	117 Å²	117	55 Å²	55	55%	0.547	29%	0.29	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.2	-10.7	-179.5	-66.6	174.8	6.5	0	0	114.4	A593 V595	A593-Q597 WeakPolarHBondContact O-CG 3.19Å; A593-Q597 PolarHBondContact O-NE2 3.48Å; V595-Q597 PolarHBondContact O-N 3.36Å
598	R	79.1	Confident	83.4	Confident	78 Å²	78	53.9 Å²	53.9	29%	0.294	28%	0.282	S	S	.	.			trans	-92.9	126.6	-169.9	-66	-65.3	-174.3	-95.1	17.8	112.9	V595 S596 S600 V601 I768 D770	V595-R598 PolarHBondContact O-N 2.95Å; S596-R598 VanDerWaalsContact C-N 3.25Å; S596-R598 PolarHBondContact O-N 2.84Å; R598-S600 PolarHBondContact O-N 3.42Å; R598-S600 VanDerWaalsContact O-N 3.13Å; R598-V601 HydrophobicContact CB-CG2 4.18Å; R598-V601 WeakPolarHBondContact O-CB 3.35Å; R598-V601 WeakPolarHBondContact O-CG2 3.18Å; R598-V601 PolarHBondContact O-N 3.18Å; R598-V601 VanDerWaalsContact O-N 3.12Å; R598-I768 HydrophobicContact CB-CD1 4.39Å; R598-I768 HydrophobicContact CG-CD1 4.37Å; R598-I768 HydrophobicContact CG-CG2 4.13Å; R598-D770 IonicContact CZ-OD2 3.37Å; R598-D770 VanDerWaalsContact CZ-OD2 3.32Å; R598-D770 IonicContact NH1-OD2 3.03Å; R598-D770 VanDerWaalsContact NH2-CG 3.34Å; R598-D770 IonicContact NH2-OD2 3.13Å; R598-D770 PolarHBondContact NH2-OD2 2.93Å
599	K	72.3	Confident	83.7	Confident	165 Å²	165	51.9 Å²	51.9	72%	0.717	27%	0.272	S	S	*	.	G	3₁₀ helix	trans	-60.1	-23.4	176.1	-68.2	-172.9	-179.3	-177.5	0	113.9	V601 I602	K599-V601 PolarHBondContact O-N 2.97Å; K599-I602 HydrophobicContact CB-CD1 4.24Å; K599-I602 HydrophobicContact CG-CD1 4.36Å; K599-I602 WeakPolarHBondContact O-CB 3.26Å; K599-I602 PolarHBondContact O-N 2.94Å
600	S	77.8	Confident	84.2	Confident	49 Å²	49	48.9 Å²	48.9	34%	0.343	25%	0.247	S	C	.	.	G	3₁₀ helix	trans	-63.8	-18.2	177	55.4	0	0	0	0	113.5	R598 P603 F604	R598-S600 PolarHBondContact O-N 3.42Å; R598-S600 VanDerWaalsContact O-N 3.13Å; S600-P603 WeakPolarHBondContact O-CD 3.42Å; S600-F604 WeakPolarHBondContact O-CD2 3.23Å; S600-F604 WeakPolarHBondContact O-CE2 3.46Å
601	V	82.5	Confident	84.6	Confident	6 Å²	6	44.3 Å²	44.3	4%	0.036	23%	0.226	C	C	.	.	G	3₁₀ helix	trans	-78.2	-28.1	179	-173.5	0	0	0	0	111.4	V595 R598 K599 F604 F605 I706 L766 I768	V595-V601 HydrophobicContact CG1-CG2 4.47Å; R598-V601 HydrophobicContact CB-CG2 4.18Å; R598-V601 WeakPolarHBondContact O-CB 3.35Å; R598-V601 WeakPolarHBondContact O-CG2 3.18Å; R598-V601 PolarHBondContact O-N 3.18Å; R598-V601 VanDerWaalsContact O-N 3.12Å; K599-V601 PolarHBondContact O-N 2.97Å; V601-F604 WeakPolarHBondContact O-CB 3.16Å; V601-F604 PolarHBondContact O-N 3.18Å; V601-F605 HydrophobicContact CB-CE2 4.48Å; V601-F605 HydrophobicContact CG1-CE1 4.42Å; V601-F605 HydrophobicContact CG1-CE2 3.76Å; V601-F605 HydrophobicContact CG1-CZ 3.57Å; V601-I706 HydrophobicContact CG1-CD1 3.29Å; V601-L766 HydrophobicContact CG2-CD1 4.35Å; V601-I768 HydrophobicContact CG2-CD1 4.2Å
602	I	81.4	Confident	84.7	Confident	30 Å²	30	45.4 Å²	45.4	15%	0.154	23%	0.23	C	C	.	.	G	3₁₀ helix	trans	-56.7	-44	-173	-60	165.4	0	0	0	113.6	K599 F604 F605 M647	K599-I602 HydrophobicContact CB-CD1 4.24Å; K599-I602 HydrophobicContact CG-CD1 4.36Å; K599-I602 WeakPolarHBondContact O-CB 3.26Å; K599-I602 PolarHBondContact O-N 2.94Å; I602-F604 PolarHBondContact O-N 3.36Å; I602-F604 VanDerWaalsContact O-N 3.14Å; I602-F605 PolarHBondContact O-N 3.32Å; I602-F605 VanDerWaalsContact O-N 3.15Å; I602-M647 HydrophobicContact CD1-CE 3.96Å; I602-M647 HydrophobicContact CD1-SD 3.89Å; I602-M647 HydrophobicContact CG1-SD 4.06Å; I602-M647 HydrophobicContact CG2-CE 4.27Å
603	P	83.5	Confident	84.9	Confident	94 Å²	94	44 Å²	44	61%	0.61	23%	0.225	S	C	*	.	G	3₁₀ helix	trans	-60.1	-21	176.9	-24.5	35.4	0	0	0	114.7	S600 F605	S600-P603 WeakPolarHBondContact O-CD 3.42Å; P603-F605 VanDerWaalsContact C-N 3.31Å
604	F	87.1	Confident	85	Confident	53 Å²	53	45 Å²	45	23%	0.232	22%	0.218	C	C	.	.	G	3₁₀ helix	trans	-79.2	-15.5	-179.6	-66.6	-94.3	0	0	0	112.7	S600 V601 I602 Q606 R609 L760 D765 L766	S600-F604 WeakPolarHBondContact O-CD2 3.23Å; S600-F604 WeakPolarHBondContact O-CE2 3.46Å; V601-F604 WeakPolarHBondContact O-CB 3.16Å; V601-F604 PolarHBondContact O-N 3.18Å; I602-F604 PolarHBondContact O-N 3.36Å; I602-F604 VanDerWaalsContact O-N 3.14Å; F604-Q606 PolarHBondContact O-N 3.04Å; F604-R609 WeakPolarHBondContact O-CB 3.26Å; F604-R609 WeakPolarHBondContact O-CG 3.21Å; F604-R609 PolarHBondContact O-NE 3.19Å; F604-L760 HydrophobicContact CD1-CD1 3.75Å; F604-L760 HydrophobicContact CE1-CD1 4.26Å; F604-L760 HydrophobicContact CG-CD1 4.45Å; F604-D765 WeakPolarHBondContact CZ-O 3.43Å; F604-L766 HydrophobicContact CB-CD2 4.42Å; F604-L766 HydrophobicContact CD1-CD2 3.81Å; F604-L766 HydrophobicContact CD2-CD2 3.61Å; F604-L766 HydrophobicContact CE1-CD2 3.88Å; F604-L766 HydrophobicContact CE2-CD2 3.69Å; F604-L766 HydrophobicContact CG-CD2 3.67Å; F604-L766 HydrophobicContact CZ-CD2 3.82Å
605	F	86.5	Confident	84.8	Confident	12 Å²	12	45.1 Å²	45.1	5%	0.053	22%	0.219	C	C	.	.			trans	-82.7	43.9	174.8	-56.5	-53.1	0	0	0	112.9	V601 I602 P603 V611 V626 V629 L700 L703 I706	V601-F605 HydrophobicContact CB-CE2 4.48Å; V601-F605 HydrophobicContact CG1-CE1 4.42Å; V601-F605 HydrophobicContact CG1-CE2 3.76Å; V601-F605 HydrophobicContact CG1-CZ 3.57Å; I602-F605 PolarHBondContact O-N 3.32Å; I602-F605 VanDerWaalsContact O-N 3.15Å; P603-F605 VanDerWaalsContact C-N 3.31Å; F605-V611 HydrophobicContact CD1-CG1 4.18Å; F605-V611 HydrophobicContact CE1-CG1 4.06Å; F605-V626 HydrophobicContact CB-CG1 4.26Å; F605-V626 HydrophobicContact CD1-CG2 4.32Å; F605-V626 WeakPolarHBondContact O-CG1 3.41Å; F605-V629 HydrophobicContact CB-CG2 3.63Å; F605-V629 WeakPolarHBondContact O-CG2 3.41Å; F605-L700 HydrophobicContact CE2-CD1 3.56Å; F605-L700 HydrophobicContact CZ-CD1 3.68Å; F605-L703 HydrophobicContact CE1-CD1 3.62Å; F605-L703 HydrophobicContact CZ-CD1 3.7Å; F605-I706 HydrophobicContact CE1-CD1 3.72Å; F605-I706 HydrophobicContact CE1-CG1 4.1Å; F605-I706 HydrophobicContact CZ-CD1 3.93Å
606	Q	85.5	Confident	84.1	Confident	96 Å²	96	52.9 Å²	52.9	45%	0.449	26%	0.259	S	S	.	.			trans	-70	151.2	171.8	64.9	-174.7	7	0	0	111.3	F604 G608 R609 C710	F604-Q606 PolarHBondContact O-N 3.04Å; Q606-G608 PolarHBondContact O-N 3.2Å; Q606-R609 HydrophobicContact CG-CB 4.45Å; Q606-R609 VanDerWaalsContact NE2-NH2 3.15Å; Q606-R609 VanDerWaalsContact O-CB 3.23Å; Q606-R609 WeakPolarHBondContact O-CB 3.42Å; Q606-R609 PolarHBondContact O-N 3.22Å; Q606-C710 PolarHBondContact NE2-SG 3.2Å
607	A	88	Confident	83.4	Confident	30 Å²	30	58 Å²	58	25%	0.248	29%	0.286	C	S	.	.	T	Hydrogen-bonded Turn	trans	-55.2	124.1	177.1	0	0	0	0	0	110.6	L713 T724 L727	A607-L713 HydrophobicContact CB-CD1 4.44Å; A607-T724 HydrophobicContact CB-CG2 4.26Å; A607-L727 HydrophobicContact CB-CD2 3.98Å
608	G	88	Confident	82.7	Confident	0 Å²	0	57.5 Å²	57.5	0%	0	29%	0.287	C	S	.	.	T	Hydrogen-bonded Turn	trans	100.1	-10.1	-174.5	0	0	0	0	0	115.6	Q606 V626 C710 L711	Q606-G608 PolarHBondContact O-N 3.2Å; G608-V626 PolarHBondContact N-O 3.23Å; G608-C710 VanDerWaalsContact C-SG 3.56Å; G608-C710 CarbonylContact O-C 3.55Å; G608-C710 WeakPolarHBondContact O-CA 3.27Å; G608-L711 WeakPolarHBondContact CA-O 3.36Å; G608-L711 PolarHBondContact O-N 3.37Å
609	R	92.7	Very high	82.5	Confident	23 Å²	23	59.3 Å²	59.3	9%	0.087	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-61.9	141.5	178.3	176.1	64.6	60.8	-161.2	-2.6	111.5	F604 Q606 V611 I625 V626 I706 S707 S708 V709	F604-R609 WeakPolarHBondContact O-CB 3.26Å; F604-R609 WeakPolarHBondContact O-CG 3.21Å; F604-R609 PolarHBondContact O-NE 3.19Å; Q606-R609 HydrophobicContact CG-CB 4.45Å; Q606-R609 VanDerWaalsContact NE2-NH2 3.15Å; Q606-R609 VanDerWaalsContact O-CB 3.23Å; Q606-R609 WeakPolarHBondContact O-CB 3.42Å; Q606-R609 PolarHBondContact O-N 3.22Å; R609-V611 HydrophobicContact CG-CG1 4.19Å; R609-I625 CarbonylContact O-C 3.5Å; R609-I625 WeakPolarHBondContact O-CA 3.47Å; R609-V626 HydrophobicContact CB-CB 4.06Å; R609-V626 HydrophobicContact CB-CG2 3.98Å; R609-V626 HydrophobicContact CG-CG2 4.31Å; R609-V626 WeakPolarHBondContact O-CG2 3.23Å; R609-V626 PolarHBondContact O-N 3.42Å; R609-I706 HydrophobicContact CG-CG2 4.03Å; R609-S707 WeakPolarHBondContact CD-O 3.4Å; R609-S707 PolarHBondContact NH1-O 3.45Å; R609-S708 PolarHBondContact NH1-O 2.97Å; R609-V709 PolarHBondContact NH1-O 3.13Å
610	V	93.4	Very high	83	Confident	0 Å²	0	54.1 Å²	54.1	0%	0	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.6	133.8	174.4	-178.2	0	0	0	0	111.5	W623 G624 S707 V709 V746 L757	V610-W623 HydrophobicContact CG1-CB 4.09Å; V610-W623 HydrophobicContact CG1-CD2 4.23Å; V610-W623 HydrophobicContact CG1-CE3 3.71Å; V610-W623 HydrophobicContact CG1-CG 4.43Å; V610-W623 HydrophobicContact CG1-CZ3 4.46Å; V610-G624 CarbonylContact C-O 3.55Å; V610-G624 VanDerWaalsContact CA-O 3.27Å; V610-G624 WeakPolarHBondContact CA-O 3.5Å; V610-S707 WeakPolarHBondContact O-CB 3.41Å; V610-S707 PolarHBondContact O-N 3.32Å; V610-V709 HydrophobicContact CG2-CB 4.25Å; V610-V709 HydrophobicContact CG2-CG1 4.04Å; V610-V709 PolarHBondContact N-O 3.44Å; V610-V709 VanDerWaalsContact N-O 3.17Å; V610-V746 HydrophobicContact CG1-CG1 4.43Å; V610-V746 HydrophobicContact CG2-CG2 4.12Å; V610-L757 HydrophobicContact CG1-CD1 4.12Å
611	V	92.2	Very high	83.4	Confident	0 Å²	0	52.8 Å²	52.8	0%	0	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135	151.1	-176.3	-64.9	0	0	0	0	111.9	F605 R609 I613 W623 G624 V626 L703 G705 I706	F605-V611 HydrophobicContact CD1-CG1 4.18Å; F605-V611 HydrophobicContact CE1-CG1 4.06Å; R609-V611 HydrophobicContact CG-CG1 4.19Å; V611-I613 HydrophobicContact CG2-CD1 4.28Å; V611-I613 HydrophobicContact CG2-CG1 4.35Å; V611-W623 VanDerWaalsContact C-CE3 3.45Å; V611-W623 CarbonylContact O-C 3.55Å; V611-W623 VanDerWaalsContact O-CA 3.28Å; V611-W623 WeakPolarHBondContact O-CA 3.38Å; V611-G624 PolarHBondContact N-O 3.27Å; V611-G624 PolarHBondContact O-N 2.55Å; V611-V626 HydrophobicContact CG1-CG2 3.83Å; V611-V626 HydrophobicContact CG2-CG2 4.1Å; V611-L703 HydrophobicContact CB-CD2 4.29Å; V611-L703 HydrophobicContact CG2-CD2 3.97Å; V611-G705 CarbonylContact C-O 3.57Å; V611-G705 WeakPolarHBondContact CA-O 3.48Å; V611-I706 HydrophobicContact CG1-CG1 4.33Å; V611-I706 HydrophobicContact CG1-CG2 4.35Å
612	R	90.4	Very high	83.6	Confident	83 Å²	83	53.7 Å²	53.7	31%	0.313	27%	0.272	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.4	143.4	176.4	-166.3	-177.8	-177.9	164.6	0.3	110.5	D620 G622 W623 L703 S704 G705	R612-D620 IonicContact CZ-OD2 3.57Å; R612-D620 IonicContact NE-OD1 3.54Å; R612-D620 IonicContact NE-OD2 2.71Å; R612-D620 PolarHBondContact NE-OD2 3.22Å; R612-D620 IonicContact NH2-OD2 3.64Å; R612-D620 PolarHBondContact NH2-OD2 3.28Å; R612-G622 CarbonylContact C-O 3.57Å; R612-G622 VanDerWaalsContact CA-O 3.31Å; R612-G622 WeakPolarHBondContact CA-O 3.37Å; R612-G622 WeakPolarHBondContact CG-O 3.27Å; R612-W623 HydrophobicContact CB-CD2 4.35Å; R612-W623 HydrophobicContact CB-CE3 3.9Å; R612-W623 HydrophobicContact CB-CH2 4.28Å; R612-W623 HydrophobicContact CB-CZ3 3.86Å; R612-L703 CarbonylContact O-C 3.53Å; R612-L703 WeakPolarHBondContact O-CA 3.47Å; R612-S704 WeakPolarHBondContact CG-OG 3.33Å; R612-S704 PolarHBondContact O-N 3.47Å; R612-G705 PolarHBondContact N-O 3.44Å
613	I	89.6	Confident	84.1	Confident	0 Å²	0	54.3 Å²	54.3	0%	0	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.3	130	-167.1	-56.9	170.8	0	0	0	110.9	V611 F621 G622 C651 M653 F673 V698 C702 L703	V611-I613 HydrophobicContact CG2-CD1 4.28Å; V611-I613 HydrophobicContact CG2-CG1 4.35Å; I613-F621 HydrophobicContact CB-CB 4.18Å; I613-F621 HydrophobicContact CG2-CB 4.2Å; I613-F621 PolarHBondContact O-N 3.14Å; I613-G622 PolarHBondContact N-O 3.46Å; I613-C651 HydrophobicContact CD1-CB 4.31Å; I613-M653 HydrophobicContact CB-CE 4.06Å; I613-M653 HydrophobicContact CD1-CE 3.39Å; I613-M653 HydrophobicContact CD1-CG 3.96Å; I613-M653 HydrophobicContact CD1-SD 3.31Å; I613-M653 WeakPolarHBondContact CD1-SD 3.46Å; I613-M653 HydrophobicContact CG1-CE 4.28Å; I613-M653 HydrophobicContact CG2-CE 3.96Å; I613-F673 HydrophobicContact CG2-CD2 4.39Å; I613-F673 HydrophobicContact CG2-CE2 3.47Å; I613-F673 VanDerWaalsContact CG2-CE2 3.47Å; I613-F673 HydrophobicContact CG2-CZ 3.55Å; I613-V698 HydrophobicContact CD1-CG1 4.49Å; I613-V698 HydrophobicContact CD1-CG2 4.19Å; I613-V698 HydrophobicContact CG2-CG1 3.89Å; I613-C702 CarbonylContact C-O 3.57Å; I613-C702 WeakPolarHBondContact CA-O 3.28Å; I613-L703 HydrophobicContact CD1-CD2 4.48Å; I613-L703 HydrophobicContact CG1-CD2 3.85Å
614	R	84.4	Confident	84.4	Confident	69 Å²	69	49.9 Å²	49.9	26%	0.26	24%	0.244	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.3	146.2	173.8	-75.3	-171.9	-167.2	170.1	5.6	111.2	D618 W619 D620 C702	R614-D618 IonicContact NH1-OD1 3.88Å; R614-W619 VanDerWaalsContact CA-O 3.22Å; R614-W619 WeakPolarHBondContact CA-O 3.45Å; R614-D620 HydrophobicContact CG-CB 4.24Å; R614-D620 IonicContact NE-OD2 2.92Å; R614-D620 IonicContact NH2-OD2 2.77Å; R614-C702 PolarHBondContact N-O 3.36Å; R614-C702 CarbonylContact O-C 3.56Å; R614-C702 WeakPolarHBondContact O-CA 3.43Å; R614-C702 VanDerWaalsContact O-CB 3.28Å; R614-C702 WeakPolarHBondContact O-CB 3.16Å
615	N	80.5	Confident	84.7	Confident	29 Å²	29	47.4 Å²	47.4	16%	0.155	23%	0.233	C	C	.	.			trans	-85.7	179.4	171.7	82.7	-8.5	0	0	0	112.1	D617 D618 W619 F621 F673	N615-D617 VanDerWaalsContact C-N 3.28Å; N615-D617 PolarHBondContact ND2-OD2 3.48Å; N615-D617 PolarHBondContact O-N 3.27Å; N615-D617 VanDerWaalsContact OD1-CA 3.31Å; N615-D617 WeakPolarHBondContact OD1-CA 3.43Å; N615-D617 PolarHBondContact OD1-N 3.44Å; N615-D618 PolarHBondContact O-N 3.4Å; N615-D618 PolarHBondContact OD1-N 3.41Å; N615-W619 PolarHBondContact N-O 2.73Å; N615-W619 WeakPolarHBondContact OD1-CB 3.17Å; N615-W619 PolarHBondContact OD1-N 3.46Å; N615-F621 HydrophobicContact CB-CE2 4.11Å; N615-F673 HydrophobicContact CB-CE1 3.86Å; N615-F673 HydrophobicContact CB-CZ 4.21Å
616	L	70.4	Confident	84.9	Confident	163 Å²	163	46.8 Å²	46.8	85%	0.853	23%	0.231	S	C	*	.	T	Hydrogen-bonded Turn	trans	-72.1	-18.8	177.1	-67.4	167.6	0	0	0	113.6	D618	L616-D618 VanDerWaalsContact C-N 3.26Å
617	D	66.1	Low	85	Confident	122 Å²	122	42.3 Å²	42.3	65%	0.652	21%	0.21	S	C	*	.	T	Hydrogen-bonded Turn	trans	-90.9	16.2	173.8	-51.1	-53.1	0	0	0	112.3	N615 W619	N615-D617 VanDerWaalsContact C-N 3.28Å; N615-D617 PolarHBondContact ND2-OD2 3.48Å; N615-D617 PolarHBondContact O-N 3.27Å; N615-D617 VanDerWaalsContact OD1-CA 3.31Å; N615-D617 WeakPolarHBondContact OD1-CA 3.43Å; N615-D617 PolarHBondContact OD1-N 3.44Å; D617-W619 PolarHBondContact O-N 2.95Å
618	D	65.7	Low	84.9	Confident	106 Å²	106	42.6 Å²	42.6	57%	0.567	21%	0.206	S	C	*	.			trans	61.2	20.3	179.1	-133.1	3.6	0	0	0	115.3	R614 N615 L616 D620	R614-D618 IonicContact NH1-OD1 3.88Å; N615-D618 PolarHBondContact O-N 3.4Å; N615-D618 PolarHBondContact OD1-N 3.41Å; L616-D618 VanDerWaalsContact C-N 3.26Å; D618-D620 PolarHBondContact O-N 2.66Å
619	W	75.5	Confident	84.8	Confident	115 Å²	115	43.9 Å²	43.9	44%	0.436	21%	0.213	S	C	.	.			trans	-69	125	168.5	-67.7	2.1	0	0	0	110.4	R614 N615 D617 F621 K677 P678	R614-W619 VanDerWaalsContact CA-O 3.22Å; R614-W619 WeakPolarHBondContact CA-O 3.45Å; N615-W619 PolarHBondContact N-O 2.73Å; N615-W619 WeakPolarHBondContact OD1-CB 3.17Å; N615-W619 PolarHBondContact OD1-N 3.46Å; D617-W619 PolarHBondContact O-N 2.95Å; W619-F621 HydrophobicContact CB-CE2 4.16Å; W619-K677 HydrophobicContact CH2-CD 4.22Å; W619-K677 HydrophobicContact CZ3-CD 4.03Å; W619-K677 HydrophobicContact CZ3-CG 3.92Å; W619-P678 HydrophobicContact CB-CG 4.1Å; W619-P678 HydrophobicContact CE3-CG 4.47Å
620	D	81.4	Confident	84.2	Confident	57 Å²	57	46.3 Å²	46.3	31%	0.305	23%	0.228	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.4	115	177.6	-159.8	-17.2	0	0	0	111	R612 R614 D618 G622	R612-D620 IonicContact CZ-OD2 3.57Å; R612-D620 IonicContact NE-OD1 3.54Å; R612-D620 IonicContact NE-OD2 2.71Å; R612-D620 PolarHBondContact NE-OD2 3.22Å; R612-D620 IonicContact NH2-OD2 3.64Å; R612-D620 PolarHBondContact NH2-OD2 3.28Å; R614-D620 HydrophobicContact CG-CB 4.24Å; R614-D620 IonicContact NE-OD2 2.92Å; R614-D620 IonicContact NH2-OD2 2.77Å; D618-D620 PolarHBondContact O-N 2.66Å; D620-G622 VanDerWaalsContact C-N 3.32Å; D620-G622 PolarHBondContact OD1-N 2.82Å
621	F	85.8	Confident	83.2	Confident	20 Å²	20	54.1 Å²	54.1	9%	0.088	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.7	-2.2	176.7	-74.5	-103.8	0	0	0	112.2	I613 N615 W619 M653 F673 V676 P678	I613-F621 HydrophobicContact CB-CB 4.18Å; I613-F621 HydrophobicContact CG2-CB 4.2Å; I613-F621 PolarHBondContact O-N 3.14Å; N615-F621 HydrophobicContact CB-CE2 4.11Å; W619-F621 HydrophobicContact CB-CE2 4.16Å; F621-M653 HydrophobicContact CB-CE 3.69Å; F621-M653 HydrophobicContact CD1-CE 4.05Å; F621-M653 HydrophobicContact CG-CE 4.15Å; F621-F673 HydrophobicContact CD1-CE2 4.02Å; F621-F673 AromaticContact CD2-CE2 3.85Å; F621-F673 HydrophobicContact CD2-CE2 3.85Å; F621-F673 AromaticContact CD2-CZ 3.59Å; F621-F673 HydrophobicContact CD2-CZ 3.59Å; F621-F673 AromaticContact CE1-CE2 4Å; F621-F673 HydrophobicContact CE1-CE2 4Å; F621-F673 HydrophobicContact CE1-CZ 4.44Å; F621-F673 HydrophobicContact CE2-CE1 4.4Å; F621-F673 AromaticContact CE2-CE2 3.86Å; F621-F673 HydrophobicContact CE2-CE2 3.86Å; F621-F673 AromaticContact CE2-CZ 3.47Å; F621-F673 HydrophobicContact CE2-CZ 3.47Å; F621-F673 VanDerWaalsContact CE2-CZ 3.47Å; F621-F673 AromaticContact CG-CE2 3.94Å; F621-F673 HydrophobicContact CG-CE2 3.94Å; F621-F673 HydrophobicContact CG-CZ 4.15Å; F621-F673 AromaticContact CZ-CE2 3.91Å; F621-F673 HydrophobicContact CZ-CE2 3.91Å; F621-F673 AromaticContact CZ-CZ 3.92Å; F621-F673 HydrophobicContact CZ-CZ 3.92Å; F621-V676 HydrophobicContact CE1-CB 4.32Å; F621-V676 HydrophobicContact CE1-CG2 3.79Å; F621-V676 WeakPolarHBondContact CE1-O 3.25Å; F621-V676 HydrophobicContact CZ-CG2 4.45Å; F621-V676 WeakPolarHBondContact CZ-O 3.36Å; F621-P678 HydrophobicContact CD1-CB 4.43Å; F621-P678 HydrophobicContact CD1-CG 4.13Å; F621-P678 HydrophobicContact CD2-CG 4.06Å; F621-P678 HydrophobicContact CE1-CG 4.09Å; F621-P678 HydrophobicContact CE2-CG 3.99Å; F621-P678 HydrophobicContact CG-CG 4.13Å; F621-P678 HydrophobicContact CZ-CG 4.03Å
622	G	87.6	Confident	81.5	Confident	25 Å²	25	57.4 Å²	57.4	26%	0.258	28%	0.28	S	S	.	.	E	Extended strand (participates in β ladder)	trans	76.1	-140.8	-177.3	0	0	0	0	0	112.8	R612 I613 D620	R612-G622 CarbonylContact C-O 3.57Å; R612-G622 VanDerWaalsContact CA-O 3.31Å; R612-G622 WeakPolarHBondContact CA-O 3.37Å; R612-G622 WeakPolarHBondContact CG-O 3.27Å; I613-G622 PolarHBondContact N-O 3.46Å; D620-G622 VanDerWaalsContact C-N 3.32Å; D620-G622 PolarHBondContact OD1-N 2.82Å
623	W	90.9	Very high	79.3	Confident	44 Å²	44	61 Å²	61	17%	0.167	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.8	155	-174.2	-66.2	99.3	0	0	0	111.8	V610 V611 R612 W743 V746 L757 V759	V610-W623 HydrophobicContact CG1-CB 4.09Å; V610-W623 HydrophobicContact CG1-CD2 4.23Å; V610-W623 HydrophobicContact CG1-CE3 3.71Å; V610-W623 HydrophobicContact CG1-CG 4.43Å; V610-W623 HydrophobicContact CG1-CZ3 4.46Å; V611-W623 VanDerWaalsContact C-CE3 3.45Å; V611-W623 CarbonylContact O-C 3.55Å; V611-W623 VanDerWaalsContact O-CA 3.28Å; V611-W623 WeakPolarHBondContact O-CA 3.38Å; R612-W623 HydrophobicContact CB-CD2 4.35Å; R612-W623 HydrophobicContact CB-CE3 3.9Å; R612-W623 HydrophobicContact CB-CH2 4.28Å; R612-W623 HydrophobicContact CB-CZ3 3.86Å; W623-W743 WeakPolarHBondContact O-CH2 3.48Å; W623-V746 HydrophobicContact CB-CG1 4.47Å; W623-L757 HydrophobicContact CB-CD1 4.4Å; W623-L757 HydrophobicContact CD2-CD1 3.67Å; W623-L757 HydrophobicContact CE3-CD1 4.3Å; W623-L757 HydrophobicContact CG-CD1 3.7Å; W623-L757 HydrophobicContact CH2-CB 4.1Å; W623-L757 HydrophobicContact CZ2-CB 3.7Å; W623-L757 HydrophobicContact CZ2-CD1 4.36Å; W623-V759 HydrophobicContact CH2-CG2 3.95Å
624	G	90.7	Very high	76.7	Confident	0 Å²	0	64.4 Å²	64.4	0%	0	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.7	156.3	177.1	0	0	0	0	0	111.8	V610 V611 L652	V610-G624 CarbonylContact C-O 3.55Å; V610-G624 VanDerWaalsContact CA-O 3.27Å; V610-G624 WeakPolarHBondContact CA-O 3.5Å; V611-G624 PolarHBondContact N-O 3.27Å; V611-G624 PolarHBondContact O-N 2.55Å; G624-L652 WeakPolarHBondContact CA-O 3.47Å
625	I	93.1	Very high	74.1	Confident	1 Å²	1	65.3 Å²	65.3	1%	0.005	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	118.4	-179.8	-52.4	158.2	0	0	0	110.1	R609 V627 C651 L652 L711 L713 I742 W743 V746	R609-I625 CarbonylContact O-C 3.5Å; R609-I625 WeakPolarHBondContact O-CA 3.47Å; I625-V627 PolarHBondContact O-N 3.47Å; I625-C651 CarbonylContact O-C 3.38Å; I625-C651 VanDerWaalsContact O-CA 3.24Å; I625-C651 WeakPolarHBondContact O-CA 3.42Å; I625-L652 HydrophobicContact CB-CB 4.21Å; I625-L652 HydrophobicContact CD1-CD2 4.17Å; I625-L652 PolarHBondContact N-O 3.25Å; I625-L652 PolarHBondContact O-N 2.98Å; I625-L711 HydrophobicContact CD1-CD1 3.64Å; I625-L711 HydrophobicContact CG1-CD1 3.97Å; I625-L711 HydrophobicContact CG2-CD1 4.26Å; I625-L713 HydrophobicContact CG2-CD1 4.5Å; I625-I742 HydrophobicContact CD1-CG2 4.05Å; I625-W743 HydrophobicContact CD1-CE3 4.15Å; I625-V746 HydrophobicContact CD1-CG2 3.65Å; I625-V746 HydrophobicContact CG1-CG2 3.45Å; I625-V746 VanDerWaalsContact CG1-CG2 3.45Å
626	V	91.9	Very high	71.9	Confident	0 Å²	0	68 Å²	68	0%	0	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.5	129	174.9	179.8	0	0	0	0	110.3	F605 G608 R609 V611 V629 V649	F605-V626 HydrophobicContact CB-CG1 4.26Å; F605-V626 HydrophobicContact CD1-CG2 4.32Å; F605-V626 WeakPolarHBondContact O-CG1 3.41Å; G608-V626 PolarHBondContact N-O 3.23Å; R609-V626 HydrophobicContact CB-CB 4.06Å; R609-V626 HydrophobicContact CB-CG2 3.98Å; R609-V626 HydrophobicContact CG-CG2 4.31Å; R609-V626 WeakPolarHBondContact O-CG2 3.23Å; R609-V626 PolarHBondContact O-N 3.42Å; V611-V626 HydrophobicContact CG1-CG2 3.83Å; V611-V626 HydrophobicContact CG2-CG2 4.1Å; V626-V629 HydrophobicContact CG1-CG2 4.45Å; V626-V649 HydrophobicContact CB-CG1 4.23Å; V626-V649 HydrophobicContact CG1-CG1 3.68Å; V626-V649 HydrophobicContact CG2-CG1 3.78Å
627	V	87.6	Confident	70	Confident	1 Å²	1	65.4 Å²	65.4	1%	0.006	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	-43.1	176.3	179.8	0	0	0	0	110.8	I625 I650 L652 L695 L713 L727 C728	I625-V627 PolarHBondContact O-N 3.47Å; V627-I650 PolarHBondContact N-O 2.98Å; V627-L652 HydrophobicContact CG2-CB 4.23Å; V627-L695 HydrophobicContact CB-CD2 4.02Å; V627-L695 HydrophobicContact CG1-CD2 4.26Å; V627-L695 HydrophobicContact CG2-CD2 3.68Å; V627-L713 HydrophobicContact CG2-CD1 4.44Å; V627-L727 HydrophobicContact CG1-CD2 4.28Å; V627-L727 HydrophobicContact CG1-CG 4.37Å; V627-C728 HydrophobicContact CG1-CB 4.27Å
628	H	85.9	Confident	68.4	Low	37 Å²	37	68.5 Å²	68.5	17%	0.171	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.7	160	-179.7	-179.5	80.3	0	0	0	110.8	I650 T724 C728	H628-I650 HydrophobicContact CB-CB 4.31Å; H628-I650 HydrophobicContact CB-CD1 4.13Å; H628-I650 PolarHBondContact N-O 3.47Å; H628-I650 PolarHBondContact O-N 2.92Å; H628-T724 PolarHBondContact ND1-OG1 2.93Å; H628-C728 HydrophobicContact CB-CB 4.23Å
629	V	85.3	Confident	67	Low	26 Å²	26	69 Å²	69	16%	0.158	37%	0.371	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	112.1	176.9	179.3	0	0	0	0	108.1	F605 V626 M647 V649	F605-V629 HydrophobicContact CB-CG2 3.63Å; F605-V629 WeakPolarHBondContact O-CG2 3.41Å; V626-V629 HydrophobicContact CG1-CG2 4.45Å; V629-M647 HydrophobicContact CG1-CG 4.26Å; V629-M647 HydrophobicContact CG1-SD 4.41Å; V629-V649 HydrophobicContact CG2-CG1 4.46Å
630	D	80.1	Confident	64.7	Low	75 Å²	75	67 Å²	67	40%	0.401	39%	0.386	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.3	131.2	-178.4	-168.2	6	0	0	0	110.6	S648	D630-S648 PolarHBondContact N-O 2.86Å; D630-S648 PolarHBondContact O-N 3.42Å
631	R	73.1	Confident	62.3	Low	164 Å²	164	73 Å²	73	62%	0.619	41%	0.412	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-119.5	84	-177.2	-60.9	-171.3	-177.8	178	-2.6	109	D633 M647	R631-D633 PolarHBondContact O-N 3.46Å; R631-M647 HydrophobicContact CG-CE 3.52Å; R631-M647 HydrophobicContact CG-CG 4.34Å
632	S	56	Low	59.8	Low	68 Å²	68	81 Å²	81	48%	0.476	45%	0.45	S	S	.	.			trans	-74.5	113.8	174.7	66.1	0	0	0	0	110.8	R646	S632-R646 PolarHBondContact OG-O 2.75Å
633	D	43.1	Very low	57	Low	158 Å²	158	90.6 Å²	90.6	85%	0.845	48%	0.484	S	S	*	.			trans	-104.1	42.2	-170.9	-125	9.4	0	0	0	113.1	R631 P635	R631-D633 PolarHBondContact O-N 3.46Å; D633-P635 WeakPolarHBondContact O-CD 3.42Å
634	S	35	Very low	54.6	Low	73 Å²	73	91.1 Å²	91.1	51%	0.51	49%	0.494	S	S	.	.			trans	-116.3	107.8	-168	71.3	0	0	0	0	114.8
635	P	30.3	Very low	52.6	Low	87 Å²	87	96.3 Å²	96.3	57%	0.565	52%	0.522	S	S	*	.			trans	-92.8	118.2	178	32.5	-35.6	0	0	0	115.5	I303 D633	I303-P635 HydrophobicContact CG2-CG 4.01Å; D633-P635 WeakPolarHBondContact O-CD 3.42Å
636	I	34	Very low	51	Low	86 Å²	86	106.9 Å²	106.9	44%	0.441	56%	0.562	S	S	.	*			trans	-144.9	97.3	157.3	-60.2	-178.8	0	0	0	106.6	I303	I303-I636 HydrophobicContact CD1-CD1 3.59Å; I303-I636 HydrophobicContact CD1-CG1 3.53Å; I303-I636 HydrophobicContact CG1-CD1 3.24Å; I303-I636 HydrophobicContact CG1-CG1 3.34Å
637	T	31.3	Very low	50.1	Low	108 Å²	108	108 Å²	108	66%	0.663	57%	0.568	S	S	*	*				61.9	105.6	89.1	62.6	0	0	0	0	116.9
638	H	31.7	Very low	50.1	Low	187 Å²	187	109.1 Å²	109.1	87%	0.866	58%	0.575	S	S	*	*			trans	96.3	65.5	156.4	-55.3	-65.1	0	0	0	121.1
639	S	36.5	Very low	50.1	Low	117 Å²	117	107.4 Å²	107.4	82%	0.818	57%	0.567	S	S	*	*				-156.4	118.2	129.3	59	0	0	0	0	108.1	H641	S639-H641 PolarHBondContact O-N 3.45Å
640	G	27.9	Very low	50.4	Low	72 Å²	72	106.7 Å²	106.7	74%	0.742	56%	0.563	S	S	*	*			trans	-62.7	124.1	-177.3	0	0	0	0	0	110.4
641	H	30.4	Very low	51	Low	184 Å²	184	103.1 Å²	103.1	85%	0.852	54%	0.543	S	S	*	.	S	Bend		174.9	127.5	119.9	-88.6	51.6	0	0	0	107.4	S639	S639-H641 PolarHBondContact O-N 3.45Å
642	Q	33.8	Very low	51.9	Low	188 Å²	188	95.3 Å²	95.3	88%	0.879	51%	0.514	S	S	*	.			trans	73.4	93.7	173.1	-58.5	-173.1	2.7	0	0	119	S644	Q642-S644 PolarHBondContact O-N 2.91Å
643	K	29.3	Very low	53.5	Low	226 Å²	226	92 Å²	92	98%	0.983	49%	0.491	S	S	*	.			trans	-67.3	83.5	158.1	-70.8	174.6	176	175.1	0	109.7
644	S	40.2	Very low	55.7	Low	55 Å²	55	87.3 Å²	87.3	39%	0.385	46%	0.464	S	S	.	.			trans	-106.9	131.9	162.3	-161.1	0	0	0	0	108.9	Q642 R646	Q642-S644 PolarHBondContact O-N 2.91Å; S644-R646 PolarHBondContact O-N 2.69Å
645	N	48	Very low	58.1	Low	109 Å²	109	83.8 Å²	83.8	58%	0.583	44%	0.44	S	S	*	.			trans	-45.3	106.9	178	-102.2	-9.7	0	0	0	109.4	M647	N645-M647 PolarHBondContact O-N 3.12Å
646	R	59.3	Low	60.7	Low	224 Å²	224	79.9 Å²	79.9	85%	0.845	41%	0.414	S	S	*	.			trans	-72.3	64.6	175.2	-80.9	-175.5	167.2	158.8	-3.7	110.5	S632 S644	S632-R646 PolarHBondContact OG-O 2.75Å; S644-R646 PolarHBondContact O-N 2.69Å
647	M	74.3	Confident	62.7	Low	24 Å²	24	78.9 Å²	78.9	12%	0.118	41%	0.408	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.2	131.8	167.3	-121.6	170.7	-159.1	0	0	107.5	I602 V629 R631 N645 L700	I602-M647 HydrophobicContact CD1-CE 3.96Å; I602-M647 HydrophobicContact CD1-SD 3.89Å; I602-M647 HydrophobicContact CG1-SD 4.06Å; I602-M647 HydrophobicContact CG2-CE 4.27Å; V629-M647 HydrophobicContact CG1-CG 4.26Å; V629-M647 HydrophobicContact CG1-SD 4.41Å; R631-M647 HydrophobicContact CG-CE 3.52Å; R631-M647 HydrophobicContact CG-CG 4.34Å; N645-M647 PolarHBondContact O-N 3.12Å; M647-L700 PolarHBondContact O-N 3.04Å
648	S	85.6	Confident	64.3	Low	23 Å²	23	79.1 Å²	79.1	16%	0.161	41%	0.405	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	143.4	169.1	67	0	0	0	0	109.6	D630 S697 V698	D630-S648 PolarHBondContact N-O 2.86Å; D630-S648 PolarHBondContact O-N 3.42Å; S648-S697 VanDerWaalsContact CB-OG 3.29Å; S648-S697 WeakPolarHBondContact CB-OG 3.39Å; S648-S697 PolarHBondContact OG-OG 2.9Å; S648-S697 VanDerWaalsContact OG-OG 3.14Å; S648-V698 WeakPolarHBondContact CA-O 3.44Å
649	V	87.6	Confident	65.6	Low	1 Å²	1	74.3 Å²	74.3	1%	0.006	38%	0.383	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	122.8	176.1	-172	0	0	0	0	107.2	V626 V629 C651 V698 L700 L703	V626-V649 HydrophobicContact CB-CG1 4.23Å; V626-V649 HydrophobicContact CG1-CG1 3.68Å; V626-V649 HydrophobicContact CG2-CG1 3.78Å; V629-V649 HydrophobicContact CG2-CG1 4.46Å; V649-C651 PolarHBondContact O-N 3.35Å; V649-V698 PolarHBondContact N-O 3.46Å; V649-V698 PolarHBondContact O-N 3.43Å; V649-L700 HydrophobicContact CG2-CD1 4.2Å; V649-L703 HydrophobicContact CG2-CD1 4.36Å
650	I	90.6	Very high	66.8	Low	11 Å²	11	70.1 Å²	70.1	6%	0.056	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.7	111.5	175	-59.8	174.3	0	0	0	107.1	V627 H628 P670 L695 V696	V627-I650 PolarHBondContact N-O 2.98Å; H628-I650 HydrophobicContact CB-CB 4.31Å; H628-I650 HydrophobicContact CB-CD1 4.13Å; H628-I650 PolarHBondContact N-O 3.47Å; H628-I650 PolarHBondContact O-N 2.92Å; I650-P670 HydrophobicContact CD1-CG 3.68Å; I650-P670 HydrophobicContact CG1-CG 4.07Å; I650-P670 HydrophobicContact CG2-CB 4.06Å; I650-P670 HydrophobicContact CG2-CG 3.87Å; I650-L695 HydrophobicContact CG2-CB 4.34Å; I650-L695 HydrophobicContact CG2-CD2 3.82Å; I650-V696 WeakPolarHBondContact CA-O 3.41Å
651	C	92	Very high	68	Low	0 Å²	0	71.9 Å²	71.9	0%	0	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113	138.2	-177	-67.1	0	0	0	0	110.9	I613 I625 V649 M653 L695 V696 V698	I613-C651 HydrophobicContact CD1-CB 4.31Å; I625-C651 CarbonylContact O-C 3.38Å; I625-C651 VanDerWaalsContact O-CA 3.24Å; I625-C651 WeakPolarHBondContact O-CA 3.42Å; V649-C651 PolarHBondContact O-N 3.35Å; C651-M653 HydrophobicContact CB-CG 3.86Å; C651-M653 HydrophobicContact CB-SD 4.14Å; C651-L695 CarbonylContact O-C 3.58Å; C651-L695 WeakPolarHBondContact O-CA 3.42Å; C651-V696 PolarHBondContact N-O 3.5Å; C651-V696 PolarHBondContact O-N 3.36Å; C651-V698 HydrophobicContact CB-CG2 4.18Å
652	L	92	Very high	69	Low	0 Å²	0	72.6 Å²	72.6	0%	0	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.5	121.7	161.8	-166	71.5	0	0	0	107.9	G624 I625 V627 I693 Q694 L695 L731 K739 I742 W743	G624-L652 WeakPolarHBondContact CA-O 3.47Å; I625-L652 HydrophobicContact CB-CB 4.21Å; I625-L652 HydrophobicContact CD1-CD2 4.17Å; I625-L652 PolarHBondContact N-O 3.25Å; I625-L652 PolarHBondContact O-N 2.98Å; V627-L652 HydrophobicContact CG2-CB 4.23Å; L652-I693 HydrophobicContact CD1-CG2 3.67Å; L652-I693 HydrophobicContact CD2-CG2 3.95Å; L652-I693 HydrophobicContact CG-CG2 3.56Å; L652-Q694 WeakPolarHBondContact CA-O 3.47Å; L652-L695 HydrophobicContact CB-CD2 4.47Å; L652-L695 HydrophobicContact CD1-CD2 4.19Å; L652-L695 HydrophobicContact CD1-CG 4.15Å; L652-L731 HydrophobicContact CD1-CD2 3.82Å; L652-L731 HydrophobicContact CD2-CD2 4.44Å; L652-K739 HydrophobicContact CD1-CB 4.48Å; L652-I742 HydrophobicContact CD2-CB 4.08Å; L652-I742 HydrophobicContact CD2-CG2 3.74Å; L652-W743 WeakPolarHBondContact O-CZ3 3.35Å
653	M	90.6	Very high	69.4	Low	0 Å²	0	66 Å²	66	0%	0	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.4	150.4	-174.3	-61	177.8	64.1	0	0	111.3	I613 F621 C651 V655 F673 I693 Q694 V696 V698	I613-M653 HydrophobicContact CB-CE 4.06Å; I613-M653 HydrophobicContact CD1-CE 3.39Å; I613-M653 HydrophobicContact CD1-CG 3.96Å; I613-M653 HydrophobicContact CD1-SD 3.31Å; I613-M653 WeakPolarHBondContact CD1-SD 3.46Å; I613-M653 HydrophobicContact CG1-CE 4.28Å; I613-M653 HydrophobicContact CG2-CE 3.96Å; F621-M653 HydrophobicContact CB-CE 3.69Å; F621-M653 HydrophobicContact CD1-CE 4.05Å; F621-M653 HydrophobicContact CG-CE 4.15Å; C651-M653 HydrophobicContact CB-CG 3.86Å; C651-M653 HydrophobicContact CB-SD 4.14Å; M653-V655 HydrophobicContact CB-CG1 4.2Å; M653-F673 HydrophobicContact CE-CE2 4.27Å; M653-I693 VanDerWaalsContact O-CA 3.32Å; M653-I693 WeakPolarHBondContact O-CA 3.4Å; M653-Q694 PolarHBondContact N-O 2.99Å; M653-Q694 PolarHBondContact O-N 3.21Å; M653-V696 HydrophobicContact CB-CG2 4.36Å; M653-V696 HydrophobicContact SD-CB 3.94Å; M653-V696 HydrophobicContact SD-CG1 4.32Å; M653-V696 HydrophobicContact SD-CG2 4.26Å; M653-V698 HydrophobicContact SD-CG2 3.68Å
654	E	89.1	Confident	70	Confident	58 Å²	58	60.1 Å²	60.1	27%	0.271	30%	0.296	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.5	125.8	166	-175.9	169.3	-158.1	0	0	109.9	A679 S691 V692 I693 W743	E654-A679 HydrophobicContact CG-CB 4.11Å; E654-S691 VanDerWaalsContact OE1-CB 3.23Å; E654-S691 WeakPolarHBondContact OE1-CB 3.27Å; E654-S691 PolarHBondContact OE1-OG 3.5Å; E654-V692 WeakPolarHBondContact CA-O 3.48Å; E654-I693 HydrophobicContact CB-CG1 4.35Å; E654-W743 HydrophobicContact CB-CD2 4.4Å; E654-W743 HydrophobicContact CB-CH2 3.86Å; E654-W743 HydrophobicContact CB-CZ2 3.3Å; E654-W743 HydrophobicContact CG-CZ2 4.45Å; E654-W743 PolarHBondContact OE2-NE1 3.15Å
655	V	86.5	Confident	70.2	Confident	0 Å²	0	63.9 Å²	63.9	0%	0	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.7	158.2	-174.2	-62.8	0	0	0	0	109.8	M653 E657 I660 V676 S691 V692 V696	M653-V655 HydrophobicContact CB-CG1 4.2Å; V655-E657 PolarHBondContact O-N 2.99Å; V655-I660 HydrophobicContact CG2-CD1 3.93Å; V655-I660 HydrophobicContact CG2-CG1 4.38Å; V655-V676 HydrophobicContact CB-CB 4.01Å; V655-V676 HydrophobicContact CB-CG1 4.12Å; V655-V676 HydrophobicContact CG1-CB 3.74Å; V655-V676 HydrophobicContact CG1-CG1 3.96Å; V655-V676 HydrophobicContact CG1-CG2 4.11Å; V655-V676 HydrophobicContact CG2-CB 4.47Å; V655-V676 HydrophobicContact CG2-CG1 4.03Å; V655-S691 WeakPolarHBondContact O-CA 3.47Å; V655-V692 HydrophobicContact CG2-CG2 4.27Å; V655-V692 PolarHBondContact N-O 2.79Å; V655-V692 PolarHBondContact O-N 3.37Å; V655-V696 HydrophobicContact CG1-CG2 4.48Å
656	A	83.2	Confident	70	Confident	4 Å²	4	61.5 Å²	61.5	3%	0.033	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.8	131.9	176.3	0	0	0	0	0	111.5	K677	A656-K677 HydrophobicContact CB-CB 4.36Å; A656-K677 PolarHBondContact N-O 3Å; A656-K677 VanDerWaalsContact N-O 3.13Å
657	E	76.9	Confident	69.6	Low	66 Å²	66	56 Å²	56	31%	0.308	30%	0.296	S	S	.	.	G	3₁₀ helix	trans	-65.8	-39.5	-175.4	-168.9	168	-176.8	0	0	112.7	V655 H659 I660 R662 T690 V692	V655-E657 PolarHBondContact O-N 2.99Å; E657-H659 PolarHBondContact O-N 2.92Å; E657-H659 VanDerWaalsContact O-N 3.07Å; E657-I660 PolarHBondContact O-N 2.85Å; E657-R662 IonicContact OE1-NH2 3.96Å; E657-R662 PolarHBondContact OE1-NH2 3.17Å; E657-R662 VanDerWaalsContact OE1-NH2 3.13Å; E657-T690 WeakPolarHBondContact CB-O 3.3Å; E657-T690 WeakPolarHBondContact CB-OG1 3.37Å; E657-T690 PolarHBondContact N-O 2.8Å; E657-T690 PolarHBondContact OE2-OG1 2.79Å; E657-V692 HydrophobicContact CB-CG1 3.87Å; E657-V692 HydrophobicContact CB-CG2 4Å; E657-V692 VanDerWaalsContact CD-CG1 3.47Å; E657-V692 HydrophobicContact CG-CG1 3.65Å; E657-V692 HydrophobicContact CG-CG2 4.13Å; E657-V692 WeakPolarHBondContact OE2-CG1 3.43Å
658	D	64.9	Low	68.9	Low	113 Å²	113	64.3 Å²	64.3	60%	0.604	33%	0.325	S	S	*	.	G	3₁₀ helix	trans	-65	-17.1	-171.5	-67.2	-35.1	0	0	0	114.6
659	H	59.7	Low	68.2	Low	85 Å²	85	70.6 Å²	70.6	39%	0.394	35%	0.35	S	S	.	.	G	3₁₀ helix	trans	-103.8	-1.1	-178	-82.1	-63	0	0	0	114.8	E657 L661 F675 K677	E657-H659 PolarHBondContact O-N 2.92Å; E657-H659 VanDerWaalsContact O-N 3.07Å; H659-L661 PolarHBondContact O-N 3.13Å; H659-F675 VanDerWaalsContact O-O 3.06Å; H659-K677 HydrophobicContact CB-CG 4.39Å; H659-K677 VanDerWaalsContact CD2-CD 3.41Å; H659-K677 WeakPolarHBondContact CD2-CD 3.43Å; H659-K677 WeakPolarHBondContact NE2-CE 3.32Å; H659-K677 PolarHBondContact NE2-NZ 3.06Å
660	I	60.4	Low	67.8	Low	29 Å²	29	72.2 Å²	72.2	15%	0.149	36%	0.36	C	S	.	.			trans	-76.4	100.7	172.6	-64.3	159.2	0	0	0	108.2	V655 E657 R662 I671 V692 Q694	V655-I660 HydrophobicContact CG2-CD1 3.93Å; V655-I660 HydrophobicContact CG2-CG1 4.38Å; E657-I660 PolarHBondContact O-N 2.85Å; I660-R662 VanDerWaalsContact C-N 3.29Å; I660-R662 PolarHBondContact O-N 3.49Å; I660-I671 HydrophobicContact CG1-CD1 4.26Å; I660-I671 HydrophobicContact CG2-CD1 3.79Å; I660-V692 HydrophobicContact CD1-CG2 3.17Å; I660-Q694 HydrophobicContact CD1-CG 3.8Å
661	L	53.3	Low	67.6	Low	109 Å²	109	73.1 Å²	73.1	57%	0.571	37%	0.365	S	S	*	.			trans	-57.9	92.6	168.4	-79.9	156.2	0	0	0	108.8	H659 N663 F675	H659-L661 PolarHBondContact O-N 3.13Å; L661-N663 VanDerWaalsContact C-N 3.28Å; L661-N663 PolarHBondContact O-N 2.99Å; L661-F675 HydrophobicContact CB-CD1 4.26Å; L661-F675 HydrophobicContact CD1-CD1 3.55Å; L661-F675 HydrophobicContact CD1-CE1 3.69Å; L661-F675 HydrophobicContact CG-CD1 4.48Å
662	R	50.8	Low	67.2	Low	199 Å²	199	76.2 Å²	76.2	75%	0.751	39%	0.385	S	S	*	.			trans	-66.8	86.4	176.7	-73.6	-173.5	-178.4	-176.8	3.6	108.8	E657 I660 S664	E657-R662 IonicContact OE1-NH2 3.96Å; E657-R662 PolarHBondContact OE1-NH2 3.17Å; E657-R662 VanDerWaalsContact OE1-NH2 3.13Å; I660-R662 VanDerWaalsContact C-N 3.29Å; I660-R662 PolarHBondContact O-N 3.49Å; R662-S664 PolarHBondContact O-N 3.04Å; R662-S664 VanDerWaalsContact O-N 3.12Å
663	N	43.4	Very low	66.9	Low	51 Å²	51	77 Å²	77	27%	0.273	39%	0.388	S	S	.	.			trans	-65.6	108.4	160.7	-97.4	-16.1	0	0	0	107.6	N289 L661 D665 S666	N289-N663 PolarHBondContact ND2-ND2 3.48Å; N289-N663 PolarHBondContact ND2-OD1 2.89Å; L661-N663 VanDerWaalsContact C-N 3.28Å; L661-N663 PolarHBondContact O-N 2.99Å; N663-D665 PolarHBondContact O-N 3.44Å; N663-S666 WeakPolarHBondContact CB-OG 3.25Å; N663-S666 PolarHBondContact O-N 3.43Å; N663-S666 VanDerWaalsContact O-N 3.12Å; N663-S666 PolarHBondContact O-OG 3.36Å
664	S	42.2	Very low	66.4	Low	101 Å²	101	81.9 Å²	81.9	71%	0.706	42%	0.423	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.2	-9.5	-174.3	40.3	0	0	0	0	115	R662	R662-S664 PolarHBondContact O-N 3.04Å; R662-S664 VanDerWaalsContact O-N 3.12Å
665	D	43.1	Very low	66	Low	134 Å²	134	82.9 Å²	82.9	72%	0.717	43%	0.426	S	S	*	.	T	Hydrogen-bonded Turn	trans	-119	2.7	178.9	-77	-37.2	0	0	0	115.1	N663	N663-D665 PolarHBondContact O-N 3.44Å
666	S	45.3	Very low	65.7	Low	60 Å²	60	83.3 Å²	83.3	42%	0.42	43%	0.429	S	S	.	.			trans	-110	28.1	-172.2	73.4	0	0	0	0	115.5	N663 R668 K669	N663-S666 WeakPolarHBondContact CB-OG 3.25Å; N663-S666 PolarHBondContact O-N 3.43Å; N663-S666 VanDerWaalsContact O-N 3.12Å; N663-S666 PolarHBondContact O-OG 3.36Å; S666-R668 PolarHBondContact O-N 3.07Å; S666-K669 PolarHBondContact O-N 2.83Å
667	T	51	Low	65.6	Low	109 Å²	109	86.3 Å²	86.3	67%	0.669	44%	0.441	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.3	10.7	-179.8	53.3	0	0	0	0	115.2
668	R	58.3	Low	65.8	Low	197 Å²	197	83.8 Å²	83.8	74%	0.743	43%	0.43	S	S	*	.	T	Hydrogen-bonded Turn	trans	-118.4	0.1	-175.9	-61.8	-175.7	-177.8	-179.1	1.4	115	S666	S666-R668 PolarHBondContact O-N 3.07Å
669	K	71.4	Confident	66.3	Low	155 Å²	155	79.6 Å²	79.6	67%	0.674	41%	0.411	S	S	*	.	S	Bend	trans	-125.9	150	179.9	-70	-172.3	178.1	-176.2	0	112.3	S666	S666-K669 PolarHBondContact O-N 2.83Å
670	P	80	Confident	66.8	Low	35 Å²	35	82.8 Å²	82.8	23%	0.227	43%	0.432	C	S	.	.	P	Polyproline II helix	trans	-60.6	144.1	172.1	-16.6	27.3	0	0	0	112.5	I650 L695	I650-P670 HydrophobicContact CD1-CG 3.68Å; I650-P670 HydrophobicContact CG1-CG 4.07Å; I650-P670 HydrophobicContact CG2-CB 4.06Å; I650-P670 HydrophobicContact CG2-CG 3.87Å; P670-L695 CarbonylContact C-O 3.51Å; P670-L695 WeakPolarHBondContact CA-O 3.46Å; P670-L695 HydrophobicContact CB-CB 4.3Å
671	I	84.5	Confident	66.5	Low	31 Å²	31	83 Å²	83	16%	0.159	44%	0.44	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.3	134.7	178.4	-56.9	173.7	0	0	0	109.3	I660 F675 V676 Q694 L695 V696 S697	I660-I671 HydrophobicContact CG1-CD1 4.26Å; I660-I671 HydrophobicContact CG2-CD1 3.79Å; I671-F675 HydrophobicContact CG2-CB 3.78Å; I671-V676 HydrophobicContact CG2-CG1 4.13Å; I671-Q694 HydrophobicContact CD1-CB 3.77Å; I671-Q694 HydrophobicContact CD1-CG 3.83Å; I671-L695 PolarHBondContact N-O 2.95Å; I671-V696 CarbonylContact O-C 3.59Å; I671-V696 WeakPolarHBondContact O-CA 3.45Å; I671-V696 WeakPolarHBondContact O-CG1 3.27Å; I671-S697 PolarHBondContact O-N 2.89Å
672	P	84.3	Confident	66.1	Low	64 Å²	64	83.3 Å²	83.3	42%	0.416	45%	0.447	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66	141.9	174	-16	28.8	0	0	0	112.1	S674 F675	P672-S674 PolarHBondContact O-N 3.32Å; P672-S674 VanDerWaalsContact O-N 3.09Å; P672-F675 HydrophobicContact CB-CD2 3.74Å; P672-F675 HydrophobicContact CB-CE2 4.05Å; P672-F675 HydrophobicContact CG-CD2 3.95Å; P672-F675 HydrophobicContact CG-CE2 4.03Å; P672-F675 WeakPolarHBondContact O-CB 3.48Å; P672-F675 PolarHBondContact O-N 2.78Å
673	F	85.1	Confident	65.7	Low	17 Å²	17	79.5 Å²	79.5	8%	0.075	44%	0.441	C	S	.	.	G	3₁₀ helix	trans	-57	-27	-176.8	-176.3	-117.3	0	0	0	115.1	I613 N615 F621 M653 F675 V676 V696 S697 V698 C702	I613-F673 HydrophobicContact CG2-CD2 4.39Å; I613-F673 HydrophobicContact CG2-CE2 3.47Å; I613-F673 VanDerWaalsContact CG2-CE2 3.47Å; I613-F673 HydrophobicContact CG2-CZ 3.55Å; N615-F673 HydrophobicContact CB-CE1 3.86Å; N615-F673 HydrophobicContact CB-CZ 4.21Å; F621-F673 HydrophobicContact CD1-CE2 4.02Å; F621-F673 AromaticContact CD2-CE2 3.85Å; F621-F673 HydrophobicContact CD2-CE2 3.85Å; F621-F673 AromaticContact CD2-CZ 3.59Å; F621-F673 HydrophobicContact CD2-CZ 3.59Å; F621-F673 AromaticContact CE1-CE2 4Å; F621-F673 HydrophobicContact CE1-CE2 4Å; F621-F673 HydrophobicContact CE1-CZ 4.44Å; F621-F673 HydrophobicContact CE2-CE1 4.4Å; F621-F673 AromaticContact CE2-CE2 3.86Å; F621-F673 HydrophobicContact CE2-CE2 3.86Å; F621-F673 AromaticContact CE2-CZ 3.47Å; F621-F673 HydrophobicContact CE2-CZ 3.47Å; F621-F673 VanDerWaalsContact CE2-CZ 3.47Å; F621-F673 AromaticContact CG-CE2 3.94Å; F621-F673 HydrophobicContact CG-CE2 3.94Å; F621-F673 HydrophobicContact CG-CZ 4.15Å; F621-F673 AromaticContact CZ-CE2 3.91Å; F621-F673 HydrophobicContact CZ-CE2 3.91Å; F621-F673 AromaticContact CZ-CZ 3.92Å; F621-F673 HydrophobicContact CZ-CZ 3.92Å; M653-F673 HydrophobicContact CE-CE2 4.27Å; F673-F675 PolarHBondContact O-N 3.39Å; F673-F675 VanDerWaalsContact O-N 3.16Å; F673-V676 HydrophobicContact CD2-CG2 3.97Å; F673-V676 HydrophobicContact CE2-CG2 4.41Å; F673-V676 VanDerWaalsContact O-CG2 3.22Å; F673-V676 WeakPolarHBondContact O-CG2 3.18Å; F673-V676 PolarHBondContact O-N 3.09Å; F673-V696 HydrophobicContact CB-CG1 4.02Å; F673-V696 HydrophobicContact CD2-CG1 4.03Å; F673-S697 VanDerWaalsContact CB-O 3.3Å; F673-S697 WeakPolarHBondContact CB-O 3.21Å; F673-S697 PolarHBondContact N-O 3.31Å; F673-V698 HydrophobicContact CD2-CG1 4.37Å; F673-V698 HydrophobicContact CD2-CG2 4.01Å; F673-V698 HydrophobicContact CG-CG1 4.43Å; F673-V698 HydrophobicContact CG-CG2 4.46Å; F673-C702 HydrophobicContact CD1-CB 4.06Å; F673-C702 HydrophobicContact CE1-CB 3.68Å; F673-C702 HydrophobicContact CZ-CB 4.3Å
674	S	81.1	Confident	65.6	Low	103 Å²	103	86 Å²	86	72%	0.72	47%	0.467	S	S	*	.	G	3₁₀ helix	trans	-68.7	-8	176.1	59.7	0	0	0	0	114.4	P672	P672-S674 PolarHBondContact O-N 3.32Å; P672-S674 VanDerWaalsContact O-N 3.09Å
675	F	80.4	Confident	65.5	Low	79 Å²	79	88.9 Å²	88.9	35%	0.346	47%	0.47	S	S	.	.	G	3₁₀ helix	trans	-103.1	10	-176.2	-69.9	-114.8	0	0	0	112.7	H659 L661 I671 P672 F673	H659-F675 VanDerWaalsContact O-O 3.06Å; L661-F675 HydrophobicContact CB-CD1 4.26Å; L661-F675 HydrophobicContact CD1-CD1 3.55Å; L661-F675 HydrophobicContact CD1-CE1 3.69Å; L661-F675 HydrophobicContact CG-CD1 4.48Å; I671-F675 HydrophobicContact CG2-CB 3.78Å; P672-F675 HydrophobicContact CB-CD2 3.74Å; P672-F675 HydrophobicContact CB-CE2 4.05Å; P672-F675 HydrophobicContact CG-CD2 3.95Å; P672-F675 HydrophobicContact CG-CE2 4.03Å; P672-F675 WeakPolarHBondContact O-CB 3.48Å; P672-F675 PolarHBondContact O-N 2.78Å; F673-F675 PolarHBondContact O-N 3.39Å; F673-F675 VanDerWaalsContact O-N 3.16Å
676	V	81.1	Confident	65	Low	9 Å²	9	88.7 Å²	88.7	6%	0.055	47%	0.473	C	S	.	.			trans	-128.5	149.4	-176.9	-66.5	0	0	0	0	111.7	F621 V655 I671 F673 V696	F621-V676 HydrophobicContact CE1-CB 4.32Å; F621-V676 HydrophobicContact CE1-CG2 3.79Å; F621-V676 WeakPolarHBondContact CE1-O 3.25Å; F621-V676 HydrophobicContact CZ-CG2 4.45Å; F621-V676 WeakPolarHBondContact CZ-O 3.36Å; V655-V676 HydrophobicContact CB-CB 4.01Å; V655-V676 HydrophobicContact CB-CG1 4.12Å; V655-V676 HydrophobicContact CG1-CB 3.74Å; V655-V676 HydrophobicContact CG1-CG1 3.96Å; V655-V676 HydrophobicContact CG1-CG2 4.11Å; V655-V676 HydrophobicContact CG2-CB 4.47Å; V655-V676 HydrophobicContact CG2-CG1 4.03Å; I671-V676 HydrophobicContact CG2-CG1 4.13Å; F673-V676 HydrophobicContact CD2-CG2 3.97Å; F673-V676 HydrophobicContact CE2-CG2 4.41Å; F673-V676 VanDerWaalsContact O-CG2 3.22Å; F673-V676 WeakPolarHBondContact O-CG2 3.18Å; F673-V676 PolarHBondContact O-N 3.09Å; V676-V696 HydrophobicContact CG1-CG2 4.17Å; V676-V696 HydrophobicContact CG2-CG1 4.07Å
677	K	81.2	Confident	64.8	Low	66 Å²	66	92 Å²	92	29%	0.287	49%	0.487	S	S	.	.			trans	-115.6	154.7	170.3	-68.6	-159.2	-176.8	165.5	0	111	W619 A656 H659	W619-K677 HydrophobicContact CH2-CD 4.22Å; W619-K677 HydrophobicContact CZ3-CD 4.03Å; W619-K677 HydrophobicContact CZ3-CG 3.92Å; A656-K677 HydrophobicContact CB-CB 4.36Å; A656-K677 PolarHBondContact N-O 3Å; A656-K677 VanDerWaalsContact N-O 3.13Å; H659-K677 HydrophobicContact CB-CG 4.39Å; H659-K677 VanDerWaalsContact CD2-CD 3.41Å; H659-K677 WeakPolarHBondContact CD2-CD 3.43Å; H659-K677 WeakPolarHBondContact NE2-CE 3.32Å; H659-K677 PolarHBondContact NE2-NZ 3.06Å
678	P	80.7	Confident	64.6	Low	13 Å²	13	93.5 Å²	93.5	8%	0.084	50%	0.496	C	S	.	.	B	Isolated β-bridge	trans	-58.6	142.7	173.7	-19.4	31	0	0	0	111.1	W619 F621 D680 G681	W619-P678 HydrophobicContact CB-CG 4.1Å; W619-P678 HydrophobicContact CE3-CG 4.47Å; F621-P678 HydrophobicContact CD1-CB 4.43Å; F621-P678 HydrophobicContact CD1-CG 4.13Å; F621-P678 HydrophobicContact CD2-CG 4.06Å; F621-P678 HydrophobicContact CE1-CG 4.09Å; F621-P678 HydrophobicContact CE2-CG 3.99Å; F621-P678 HydrophobicContact CG-CG 4.13Å; F621-P678 HydrophobicContact CZ-CG 4.03Å; P678-D680 PolarHBondContact O-N 2.92Å; P678-G681 PolarHBondContact O-N 3.1Å
679	A	76	Confident	64.4	Low	25 Å²	25	88.2 Å²	88.2	21%	0.207	48%	0.478	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64.4	-30.9	173.9	0	0	0	0	0	112.3	E654 G681	E654-A679 HydrophobicContact CG-CB 4.11Å; A679-G681 VanDerWaalsContact C-N 3.33Å; A679-G681 PolarHBondContact O-N 3.21Å
680	D	68.5	Low	64.4	Low	153 Å²	153	84.3 Å²	84.3	82%	0.818	47%	0.467	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.2	24.3	-179.4	-60.2	-26.5	0	0	0	112.9	P678 V682	P678-D680 PolarHBondContact O-N 2.92Å; D680-V682 PolarHBondContact O-N 3.3Å
681	G	54.1	Low	64.4	Low	32 Å²	32	84.2 Å²	84.2	33%	0.33	47%	0.468	S	S	.	.			trans	-53.2	120.9	-173	0	0	0	0	0	113.5	P678 A679 D683	P678-G681 PolarHBondContact O-N 3.1Å; A679-G681 VanDerWaalsContact C-N 3.33Å; A679-G681 PolarHBondContact O-N 3.21Å; G681-D683 PolarHBondContact O-N 2.73Å
682	V	46.4	Very low	64.4	Low	117 Å²	117	83.4 Å²	83.4	71%	0.709	46%	0.464	S	S	*	.			trans	-75.7	60.8	-175.5	-165.3	0	0	0	0	111	D680 F684	D680-V682 PolarHBondContact O-N 3.3Å; V682-F684 HydrophobicContact CG1-CD2 3.81Å; V682-F684 HydrophobicContact CG1-CE2 3.44Å; V682-F684 VanDerWaalsContact CG1-CE2 3.44Å; V682-F684 HydrophobicContact CG1-CZ 4.34Å
683	D	42.2	Very low	64.6	Low	118 Å²	118	80.8 Å²	80.8	63%	0.631	45%	0.447	S	S	*	.			trans	-94.2	104.9	159.5	-88.6	-33.2	0	0	0	107.7	G681 Q685	G681-D683 PolarHBondContact O-N 2.73Å; D683-Q685 PolarHBondContact O-N 3.37Å
684	F	40.4	Very low	64.7	Low	187 Å²	187	81.9 Å²	81.9	82%	0.82	45%	0.452	S	S	*	.	S	Bend	trans	-67	67.6	170.6	-78.6	-90.1	0	0	0	110	V682	V682-F684 HydrophobicContact CG1-CD2 3.81Å; V682-F684 HydrophobicContact CG1-CE2 3.44Å; V682-F684 VanDerWaalsContact CG1-CE2 3.44Å; V682-F684 HydrophobicContact CG1-CZ 4.34Å
685	Q	41.1	Very low	65.1	Low	163 Å²	163	77.3 Å²	77.3	76%	0.762	42%	0.42	S	S	*	.	S	Bend	trans	-172.5	99.4	165.1	-105.3	151.5	70.9	0	0	108	D683 D687	D683-Q685 PolarHBondContact O-N 3.37Å; Q685-D687 PolarHBondContact O-N 3.09Å
686	T	32.2	Very low	65.6	Low	129 Å²	129	73.6 Å²	73.6	79%	0.791	40%	0.403	S	S	*	.			trans	28.3	88	146.3	53.2	0	0	0	0	116
687	D	40.8	Very low	66	Low	131 Å²	131	74.7 Å²	74.7	70%	0.701	41%	0.411	S	S	*	.			trans	-163	131.5	137.6	-89	-29.9	0	0	0	109	Q685 F689	Q685-D687 PolarHBondContact O-N 3.09Å; D687-F689 WeakPolarHBondContact O-CD2 3.45Å; D687-F689 PolarHBondContact O-N 2.96Å
688	T	46.8	Very low	66.4	Low	140 Å²	140	71.5 Å²	71.5	86%	0.859	40%	0.397	S	S	*	.			trans	-69.2	92.4	174	40.5	0	0	0	0	108.6	T690	T688-T690 PolarHBondContact O-N 3.46Å
689	F	55.2	Low	66.7	Low	85 Å²	85	73.6 Å²	73.6	37%	0.373	41%	0.411	S	S	.	.	P	Polyproline II helix	trans	-63.1	129.2	176.2	-62	-71.6	0	0	0	110.2	D687	D687-F689 WeakPolarHBondContact O-CD2 3.45Å; D687-F689 PolarHBondContact O-N 2.96Å
690	T	69.7	Low	67	Low	73 Å²	73	73.5 Å²	73.5	45%	0.448	41%	0.407	S	S	.	.	P	Polyproline II helix	trans	-79.6	134.8	169.3	45.5	0	0	0	0	108.7	E657 T688	E657-T690 WeakPolarHBondContact CB-O 3.3Å; E657-T690 WeakPolarHBondContact CB-OG1 3.37Å; E657-T690 PolarHBondContact N-O 2.8Å; E657-T690 PolarHBondContact OE2-OG1 2.79Å; T688-T690 PolarHBondContact O-N 3.46Å
691	S	80.7	Confident	67.5	Low	33 Å²	33	70.6 Å²	70.6	23%	0.231	39%	0.391	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.5	139.8	178.8	70.2	0	0	0	0	111.3	E654 V655 R740	E654-S691 VanDerWaalsContact OE1-CB 3.23Å; E654-S691 WeakPolarHBondContact OE1-CB 3.27Å; E654-S691 PolarHBondContact OE1-OG 3.5Å; V655-S691 WeakPolarHBondContact O-CA 3.47Å; S691-R740 PolarHBondContact O-NH2 3.3Å
692	V	84.4	Confident	69	Low	14 Å²	14	69.7 Å²	69.7	9%	0.085	38%	0.38	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130	155.2	175.9	-68.7	0	0	0	0	110.8	E654 V655 E657 I660 Q694	E654-V692 WeakPolarHBondContact CA-O 3.48Å; V655-V692 HydrophobicContact CG2-CG2 4.27Å; V655-V692 PolarHBondContact N-O 2.79Å; V655-V692 PolarHBondContact O-N 3.37Å; E657-V692 HydrophobicContact CB-CG1 3.87Å; E657-V692 HydrophobicContact CB-CG2 4Å; E657-V692 VanDerWaalsContact CD-CG1 3.47Å; E657-V692 HydrophobicContact CG-CG1 3.65Å; E657-V692 HydrophobicContact CG-CG2 4.13Å; E657-V692 WeakPolarHBondContact OE2-CG1 3.43Å; I660-V692 HydrophobicContact CD1-CG2 3.17Å; V692-Q694 HydrophobicContact CG2-CG 4.36Å
693	I	88.7	Confident	70.9	Confident	9 Å²	9	64.3 Å²	64.3	5%	0.046	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	116.7	-175.2	-64.1	159.2	0	0	0	108.8	L652 M653 E654 K739 R740 W743	L652-I693 HydrophobicContact CD1-CG2 3.67Å; L652-I693 HydrophobicContact CD2-CG2 3.95Å; L652-I693 HydrophobicContact CG-CG2 3.56Å; M653-I693 VanDerWaalsContact O-CA 3.32Å; M653-I693 WeakPolarHBondContact O-CA 3.4Å; E654-I693 HydrophobicContact CB-CG1 4.35Å; I693-K739 HydrophobicContact CB-CB 4.42Å; I693-K739 HydrophobicContact CG2-CB 4.04Å; I693-K739 WeakPolarHBondContact O-CD 3.13Å; I693-R740 VanDerWaalsContact CD1-CA 3.46Å; I693-R740 HydrophobicContact CD1-CB 3.79Å; I693-R740 HydrophobicContact CD1-CG 3.87Å; I693-W743 HydrophobicContact CD1-CB 3.44Å; I693-W743 VanDerWaalsContact CD1-CB 3.44Å; I693-W743 HydrophobicContact CD1-CD2 4.46Å; I693-W743 HydrophobicContact CD1-CG 3.55Å; I693-W743 HydrophobicContact CG1-CB 4.19Å; I693-W743 HydrophobicContact CG1-CD2 4.48Å; I693-W743 HydrophobicContact CG1-CG 4.03Å; I693-W743 HydrophobicContact CG2-CB 4.18Å
694	Q	87.5	Confident	73	Confident	41 Å²	41	59.8 Å²	59.8	19%	0.192	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.3	158.3	-175.1	-67	-62.6	-6.2	0	0	112.6	L652 M653 I660 I671 V692	L652-Q694 WeakPolarHBondContact CA-O 3.47Å; M653-Q694 PolarHBondContact N-O 2.99Å; M653-Q694 PolarHBondContact O-N 3.21Å; I660-Q694 HydrophobicContact CD1-CG 3.8Å; I671-Q694 HydrophobicContact CD1-CB 3.77Å; I671-Q694 HydrophobicContact CD1-CG 3.83Å; V692-Q694 HydrophobicContact CG2-CG 4.36Å
695	L	89.9	Confident	75.2	Confident	7 Å²	7	51 Å²	51	4%	0.037	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.5	118.2	168.9	-75.8	164.7	0	0	0	108.6	V627 I650 C651 L652 P670 I671 L731 S732	V627-L695 HydrophobicContact CB-CD2 4.02Å; V627-L695 HydrophobicContact CG1-CD2 4.26Å; V627-L695 HydrophobicContact CG2-CD2 3.68Å; I650-L695 HydrophobicContact CG2-CB 4.34Å; I650-L695 HydrophobicContact CG2-CD2 3.82Å; C651-L695 CarbonylContact O-C 3.58Å; C651-L695 WeakPolarHBondContact O-CA 3.42Å; L652-L695 HydrophobicContact CB-CD2 4.47Å; L652-L695 HydrophobicContact CD1-CD2 4.19Å; L652-L695 HydrophobicContact CD1-CG 4.15Å; P670-L695 CarbonylContact C-O 3.51Å; P670-L695 WeakPolarHBondContact CA-O 3.46Å; P670-L695 HydrophobicContact CB-CB 4.3Å; I671-L695 PolarHBondContact N-O 2.95Å; L695-L731 HydrophobicContact CD1-CB 4.41Å; L695-L731 HydrophobicContact CD1-CD2 4.06Å; L695-L731 HydrophobicContact CD2-CD2 4.15Å; L695-L731 HydrophobicContact CG-CD2 4.19Å; L695-S732 WeakPolarHBondContact CD1-OG 3.36Å
696	V	89.5	Confident	77.5	Confident	0 Å²	0	43.3 Å²	43.3	0%	0	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.3	131.4	-178.3	-174.5	0	0	0	0	109.5	I650 C651 M653 V655 I671 F673 V676 V698	I650-V696 WeakPolarHBondContact CA-O 3.41Å; C651-V696 PolarHBondContact N-O 3.5Å; C651-V696 PolarHBondContact O-N 3.36Å; M653-V696 HydrophobicContact CB-CG2 4.36Å; M653-V696 HydrophobicContact SD-CB 3.94Å; M653-V696 HydrophobicContact SD-CG1 4.32Å; M653-V696 HydrophobicContact SD-CG2 4.26Å; V655-V696 HydrophobicContact CG1-CG2 4.48Å; I671-V696 CarbonylContact O-C 3.59Å; I671-V696 WeakPolarHBondContact O-CA 3.45Å; I671-V696 WeakPolarHBondContact O-CG1 3.27Å; F673-V696 HydrophobicContact CB-CG1 4.02Å; F673-V696 HydrophobicContact CD2-CG1 4.03Å; V676-V696 HydrophobicContact CG1-CG2 4.17Å; V676-V696 HydrophobicContact CG2-CG1 4.07Å; V696-V698 HydrophobicContact CB-CG2 4.29Å; V696-V698 HydrophobicContact CG1-CG2 3.99Å; V696-V698 PolarHBondContact O-N 3.26Å
697	S	90.1	Very high	80.3	Confident	32 Å²	32	37.2 Å²	37.2	22%	0.224	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.9	107.5	170.5	177.8	0	0	0	0	109.2	S648 I671 F673	S648-S697 VanDerWaalsContact CB-OG 3.29Å; S648-S697 WeakPolarHBondContact CB-OG 3.39Å; S648-S697 PolarHBondContact OG-OG 2.9Å; S648-S697 VanDerWaalsContact OG-OG 3.14Å; I671-S697 PolarHBondContact O-N 2.89Å; F673-S697 VanDerWaalsContact CB-O 3.3Å; F673-S697 WeakPolarHBondContact CB-O 3.21Å; F673-S697 PolarHBondContact N-O 3.31Å
698	V	89.1	Confident	82.7	Confident	0 Å²	0	33.7 Å²	33.7	0%	0	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	122.4	-173.9	-175.6	0	0	0	0	109.5	I613 S648 V649 C651 M653 F673 V696 C702 L703	I613-V698 HydrophobicContact CD1-CG1 4.49Å; I613-V698 HydrophobicContact CD1-CG2 4.19Å; I613-V698 HydrophobicContact CG2-CG1 3.89Å; S648-V698 WeakPolarHBondContact CA-O 3.44Å; V649-V698 PolarHBondContact N-O 3.46Å; V649-V698 PolarHBondContact O-N 3.43Å; C651-V698 HydrophobicContact CB-CG2 4.18Å; M653-V698 HydrophobicContact SD-CG2 3.68Å; F673-V698 HydrophobicContact CD2-CG1 4.37Å; F673-V698 HydrophobicContact CD2-CG2 4.01Å; F673-V698 HydrophobicContact CG-CG1 4.43Å; F673-V698 HydrophobicContact CG-CG2 4.46Å; V696-V698 HydrophobicContact CB-CG2 4.29Å; V696-V698 HydrophobicContact CG1-CG2 3.99Å; V696-V698 PolarHBondContact O-N 3.26Å; V698-C702 HydrophobicContact CG1-CB 3.87Å; V698-L703 HydrophobicContact CG1-CD2 4.01Å
699	P	86.5	Confident	84.7	Confident	57 Å²	57	28 Å²	28	37%	0.37	16%	0.164	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-58	142.9	171.2	-22.6	33.1	0	0	0	111	D701 C702	P699-D701 PolarHBondContact O-N 2.93Å; P699-D701 VanDerWaalsContact O-N 3.11Å; P699-C702 WeakPolarHBondContact O-CB 3.42Å; P699-C702 PolarHBondContact O-N 3.36Å
700	L	83.4	Confident	86.3	Confident	23 Å²	23	26.3 Å²	26.3	12%	0.12	16%	0.163	C	C	.	.	G	3₁₀ helix	trans	-56.7	-31.2	-180	-166.5	71.9	0	0	0	112.9	S596 F605 M647 V649 C702 L703	S596-L700 WeakPolarHBondContact O-CD2 3.41Å; F605-L700 HydrophobicContact CE2-CD1 3.56Å; F605-L700 HydrophobicContact CZ-CD1 3.68Å; M647-L700 PolarHBondContact O-N 3.04Å; V649-L700 HydrophobicContact CG2-CD1 4.2Å; L700-C702 PolarHBondContact O-N 3.11Å; L700-L703 HydrophobicContact CD1-CD1 3.88Å; L700-L703 PolarHBondContact O-N 3.26Å
701	D	78.9	Confident	87.2	Confident	92 Å²	92	24.4 Å²	24.4	49%	0.492	15%	0.149	S	C	.	.	G	3₁₀ helix	trans	-69.5	-19.6	179.1	-59.7	-28	0	0	0	113.3	P699	P699-D701 PolarHBondContact O-N 2.93Å; P699-D701 VanDerWaalsContact O-N 3.11Å
702	C	86.5	Confident	87.4	Confident	13 Å²	13	31.6 Å²	31.6	9%	0.088	18%	0.176	C	C	.	.	G	3₁₀ helix	trans	-90.2	-3.3	177.4	-62.2	0	0	0	0	113.2	I613 R614 F673 V698 P699 L700	I613-C702 CarbonylContact C-O 3.57Å; I613-C702 WeakPolarHBondContact CA-O 3.28Å; R614-C702 PolarHBondContact N-O 3.36Å; R614-C702 CarbonylContact O-C 3.56Å; R614-C702 WeakPolarHBondContact O-CA 3.43Å; R614-C702 VanDerWaalsContact O-CB 3.28Å; R614-C702 WeakPolarHBondContact O-CB 3.16Å; F673-C702 HydrophobicContact CD1-CB 4.06Å; F673-C702 HydrophobicContact CE1-CB 3.68Å; F673-C702 HydrophobicContact CZ-CB 4.3Å; V698-C702 HydrophobicContact CG1-CB 3.87Å; P699-C702 WeakPolarHBondContact O-CB 3.42Å; P699-C702 PolarHBondContact O-N 3.36Å; L700-C702 PolarHBondContact O-N 3.11Å
703	L	86.3	Confident	87.2	Confident	3 Å²	3	31.1 Å²	31.1	2%	0.016	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.4	157.9	166.9	-57.7	-174.5	0	0	0	108.5	W592 F605 V611 R612 I613 V649 V698 L700	W592-L703 VanDerWaalsContact CE2-O 3.3Å; W592-L703 HydrophobicContact CZ2-CB 3.67Å; W592-L703 VanDerWaalsContact NE1-C 3.26Å; W592-L703 PolarHBondContact NE1-O 3.07Å; F605-L703 HydrophobicContact CE1-CD1 3.62Å; F605-L703 HydrophobicContact CZ-CD1 3.7Å; V611-L703 HydrophobicContact CB-CD2 4.29Å; V611-L703 HydrophobicContact CG2-CD2 3.97Å; R612-L703 CarbonylContact O-C 3.53Å; R612-L703 WeakPolarHBondContact O-CA 3.47Å; I613-L703 HydrophobicContact CD1-CD2 4.48Å; I613-L703 HydrophobicContact CG1-CD2 3.85Å; V649-L703 HydrophobicContact CG2-CD1 4.36Å; V698-L703 HydrophobicContact CG1-CD2 4.01Å; L700-L703 HydrophobicContact CD1-CD1 3.88Å; L700-L703 PolarHBondContact O-N 3.26Å
704	S	85.2	Confident	86	Confident	23 Å²	23	33 Å²	33	16%	0.161	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.7	-4.7	174.1	62.4	0	0	0	0	113.3	W592 R612	W592-S704 VanDerWaalsContact CE2-CA 3.45Å; W592-S704 VanDerWaalsContact CE3-O 3.32Å; R612-S704 WeakPolarHBondContact CG-OG 3.33Å; R612-S704 PolarHBondContact O-N 3.47Å
705	G	86.6	Confident	84.9	Confident	3 Å²	3	35.6 Å²	35.6	3%	0.031	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-174.2	159.6	177.5	0	0	0	0	0	113	W592 V611 R612	W592-G705 VanDerWaalsContact CH2-CA 3.49Å; V611-G705 CarbonylContact C-O 3.57Å; V611-G705 WeakPolarHBondContact CA-O 3.48Å; R612-G705 PolarHBondContact N-O 3.44Å
706	I	89.7	Confident	83.7	Confident	2 Å²	2	39.4 Å²	39.4	1%	0.01	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	128.2	174.8	-55.3	173.8	0	0	0	108.1	W592 V601 F605 R609 V611 V759 L760 L766	W592-I706 HydrophobicContact CH2-CG1 4.18Å; V601-I706 HydrophobicContact CG1-CD1 3.29Å; F605-I706 HydrophobicContact CE1-CD1 3.72Å; F605-I706 HydrophobicContact CE1-CG1 4.1Å; F605-I706 HydrophobicContact CZ-CD1 3.93Å; R609-I706 HydrophobicContact CG-CG2 4.03Å; V611-I706 HydrophobicContact CG1-CG1 4.33Å; V611-I706 HydrophobicContact CG1-CG2 4.35Å; I706-V759 CarbonylContact O-C 3.54Å; I706-V759 WeakPolarHBondContact O-CA 3.39Å; I706-L760 HydrophobicContact CB-CD1 4.14Å; I706-L760 HydrophobicContact CG2-CD1 3.61Å; I706-L760 HydrophobicContact CG2-CG 4.4Å; I706-L760 PolarHBondContact O-N 2.9Å; I706-L766 HydrophobicContact CD1-CD1 4.46Å
707	S	91.7	Very high	82.6	Confident	0 Å²	0	40 Å²	40	0%	0	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.4	149.6	176.4	-177.6	0	0	0	0	112.3	R609 V610 V709 P758	R609-S707 WeakPolarHBondContact CD-O 3.4Å; R609-S707 PolarHBondContact NH1-O 3.45Å; V610-S707 WeakPolarHBondContact O-CB 3.41Å; V610-S707 PolarHBondContact O-N 3.32Å; S707-V709 PolarHBondContact O-N 3.32Å; S707-V709 PolarHBondContact OG-N 3.37Å; S707-P758 WeakPolarHBondContact CA-O 3.47Å; S707-P758 WeakPolarHBondContact CB-O 3.45Å; S707-P758 PolarHBondContact OG-O 2.52Å
708	S	89.7	Confident	81.3	Confident	58 Å²	58	47.3 Å²	47.3	41%	0.406	26%	0.26	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.2	-13.6	172	63.4	0	0	0	0	113.8	R609 P758	R609-S708 PolarHBondContact NH1-O 2.97Å; S708-P758 PolarHBondContact N-O 2.98Å; S708-P758 WeakPolarHBondContact OG-CG 3.03Å
709	V	89.6	Confident	79.8	Confident	20 Å²	20	48 Å²	48	12%	0.121	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.5	137.1	178.1	178.6	0	0	0	0	112.4	R609 V610 S707 A749 L753 L757	R609-V709 PolarHBondContact NH1-O 3.13Å; V610-V709 HydrophobicContact CG2-CB 4.25Å; V610-V709 HydrophobicContact CG2-CG1 4.04Å; V610-V709 PolarHBondContact N-O 3.44Å; V610-V709 VanDerWaalsContact N-O 3.17Å; S707-V709 PolarHBondContact O-N 3.32Å; S707-V709 PolarHBondContact OG-N 3.37Å; V709-A749 HydrophobicContact CG1-CB 3.77Å; V709-A749 HydrophobicContact CG2-CB 4.39Å; V709-L753 HydrophobicContact CG2-CD1 3.54Å; V709-L757 HydrophobicContact CG2-CD2 3.93Å
710	C	89.4	Confident	78.5	Confident	50 Å²	50	52 Å²	52	34%	0.338	28%	0.283	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.5	121.9	173.6	-168.9	0	0	0	0	111.3	Q606 G608	Q606-C710 PolarHBondContact NE2-SG 3.2Å; G608-C710 VanDerWaalsContact C-SG 3.56Å; G608-C710 CarbonylContact O-C 3.55Å; G608-C710 WeakPolarHBondContact O-CA 3.27Å
711	L	87.1	Confident	77.4	Confident	33 Å²	33	57 Å²	57	17%	0.173	31%	0.31	C	S	.	.			trans	-85	144.6	-179.2	-57.8	177.1	0	0	0	111.7	G608 I625 L713 V746	G608-L711 WeakPolarHBondContact CA-O 3.36Å; G608-L711 PolarHBondContact O-N 3.37Å; I625-L711 HydrophobicContact CD1-CD1 3.64Å; I625-L711 HydrophobicContact CG1-CD1 3.97Å; I625-L711 HydrophobicContact CG2-CD1 4.26Å; L711-L713 PolarHBondContact O-N 3.37Å; L711-V746 HydrophobicContact CD1-CG2 4.11Å
712	K	84.9	Confident	76.5	Confident	183 Å²	183	61.7 Å²	61.7	80%	0.796	33%	0.329	S	S	*	.			trans	-85.6	94.1	175	-72.2	-174.5	178.5	-178.6	0	110.7	S715	K712-S715 PolarHBondContact O-OG 3.07Å
713	L	80.8	Confident	75.7	Confident	5 Å²	5	64.2 Å²	64.2	3%	0.026	34%	0.342	C	S	.	.			trans	-78.4	-37.7	-176.7	-64.9	175.4	0	0	0	113.9	A607 I625 V627 L711 S715 L716 L727 I742	A607-L713 HydrophobicContact CB-CD1 4.44Å; I625-L713 HydrophobicContact CG2-CD1 4.5Å; V627-L713 HydrophobicContact CG2-CD1 4.44Å; L711-L713 PolarHBondContact O-N 3.37Å; L713-S715 VanDerWaalsContact C-N 3.31Å; L713-S715 PolarHBondContact O-N 3.03Å; L713-L716 PolarHBondContact O-N 3.16Å; L713-L716 VanDerWaalsContact O-N 3.08Å; L713-L727 HydrophobicContact CB-CD1 4.32Å; L713-L727 HydrophobicContact CB-CD2 3.95Å; L713-L727 HydrophobicContact CD1-CD2 3.97Å; L713-I742 HydrophobicContact CD2-CG2 3.51Å
714	N	64.5	Low	75.2	Confident	47 Å²	47	67.1 Å²	67.1	25%	0.251	36%	0.359	S	S	.	.	G	3₁₀ helix	trans	-61.5	-34.3	-170.8	-65	-6.3	0	0	0	114.2	L716 N721	N714-L716 PolarHBondContact O-N 3.2Å; N714-N721 WeakPolarHBondContact CB-OD1 3.23Å; N714-N721 PolarHBondContact ND2-OD1 3.47Å
715	S	64.4	Low	74.8	Confident	96 Å²	96	71.6 Å²	71.6	67%	0.671	38%	0.378	S	S	*	.	G	3₁₀ helix	trans	-69.2	-15.9	179	40.3	0	0	0	0	114.1	K712 L713	K712-S715 PolarHBondContact O-OG 3.07Å; L713-S715 VanDerWaalsContact C-N 3.31Å; L713-S715 PolarHBondContact O-N 3.03Å
716	L	64.8	Low	74.2	Confident	87 Å²	87	75.7 Å²	75.7	46%	0.455	40%	0.396	S	S	.	.	G	3₁₀ helix	trans	-91.4	-13.7	-176.8	-74.3	154.6	0	0	0	113.3	L713 N714 I742	L713-L716 PolarHBondContact O-N 3.16Å; L713-L716 VanDerWaalsContact O-N 3.08Å; N714-L716 PolarHBondContact O-N 3.2Å; L716-I742 HydrophobicContact CD1-CG1 4.28Å
717	L	64.5	Low	73.6	Confident	13 Å²	13	75.6 Å²	75.6	7%	0.068	40%	0.396	C	S	.	.	T	Hydrogen-bonded Turn	trans	-130.5	12.4	-169.6	-66.8	173.5	0	0	0	114.4	C719 L727 K730 L731 Q734 V738	L717-C719 VanDerWaalsContact C-N 3.25Å; L717-C719 PolarHBondContact O-N 3.02Å; L717-C719 PolarHBondContact O-SG 3.21Å; L717-C719 VanDerWaalsContact O-SG 3.41Å; L717-L727 HydrophobicContact CD1-CD1 3.79Å; L717-K730 PolarHBondContact O-NZ 2.82Å; L717-L731 HydrophobicContact CD1-CB 4.09Å; L717-L731 HydrophobicContact CD1-CD1 3.7Å; L717-L731 HydrophobicContact CD1-CG 4.03Å; L717-Q734 HydrophobicContact CD2-CG 3.57Å; L717-V738 HydrophobicContact CD2-CG1 4.34Å
718	E	63	Low	73.1	Confident	185 Å²	185	76 Å²	76	86%	0.864	40%	0.398	S	S	*	.	T	Hydrogen-bonded Turn	trans	47.4	48.5	-179.1	-62.7	179.7	175.8	0	0	111.8	K730	E718-K730 PolarHBondContact O-NZ 3.4Å
719	C	59.2	Low	72.6	Confident	15 Å²	15	77.1 Å²	77.1	10%	0.101	40%	0.4	C	S	.	.			trans	-99.5	137.2	179.6	-60.9	0	0	0	0	111	L717 N721 K730	L717-C719 VanDerWaalsContact C-N 3.25Å; L717-C719 PolarHBondContact O-N 3.02Å; L717-C719 PolarHBondContact O-SG 3.21Å; L717-C719 VanDerWaalsContact O-SG 3.41Å; C719-N721 PolarHBondContact O-N 3.48Å; C719-K730 WeakPolarHBondContact SG-CD 3.5Å; C719-K730 PolarHBondContact SG-NZ 3.36Å
720	D	59.3	Low	72.1	Confident	141 Å²	141	79.8 Å²	79.8	75%	0.754	41%	0.41	S	S	*	.			trans	-58.8	133	162.9	-90.1	-29.6	0	0	0	110	Q722	D720-Q722 PolarHBondContact O-N 3.04Å
721	N	58.5	Low	71.8	Confident	129 Å²	129	77.5 Å²	77.5	69%	0.69	39%	0.394	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.3	-4.2	-165.1	-86	-37.2	0	0	0	116.1	N714 C719	N714-N721 WeakPolarHBondContact CB-OD1 3.23Å; N714-N721 PolarHBondContact ND2-OD1 3.47Å; C719-N721 PolarHBondContact O-N 3.48Å
722	Q	61.2	Low	71.4	Confident	189 Å²	189	76.8 Å²	76.8	88%	0.883	39%	0.392	S	S	*	.	T	Hydrogen-bonded Turn	trans	-107.4	-6.6	-165	-66.1	-165.9	-5.8	0	0	115.9	D720	D720-Q722 PolarHBondContact O-N 3.04Å
723	N	69.7	Low	71.1	Confident	67 Å²	67	73.2 Å²	73.2	36%	0.358	39%	0.385	S	S	.	.			trans	-125.6	91.9	-173.3	-153.6	-16.5	0	0	0	112.8	E725 Q726 L727	N723-E725 PolarHBondContact O-N 2.9Å; N723-Q726 HydrophobicContact CB-CB 4Å; N723-Q726 HydrophobicContact CB-CG 3.81Å; N723-Q726 PolarHBondContact ND2-NE2 3.38Å; N723-Q726 WeakPolarHBondContact O-CB 3.44Å; N723-Q726 PolarHBondContact O-N 3.43Å; N723-Q726 VanDerWaalsContact O-N 3.08Å; N723-L727 PolarHBondContact O-N 2.97Å; N723-L727 VanDerWaalsContact O-N 3.11Å
724	T	75.6	Confident	71.1	Confident	63 Å²	63	76 Å²	76	39%	0.387	40%	0.398	S	S	.	.	H	α-helix	trans	-65.9	-24.1	179.5	55.3	0	0	0	0	112.8	A607 H628 L727 C728	A607-T724 HydrophobicContact CB-CG2 4.26Å; H628-T724 PolarHBondContact ND1-OG1 2.93Å; T724-L727 WeakPolarHBondContact O-CB 3.47Å; T724-L727 PolarHBondContact O-N 3.38Å; T724-C728 PolarHBondContact O-N 3.01Å
725	E	77.3	Confident	71.8	Confident	117 Å²	117	76.8 Å²	76.8	55%	0.547	41%	0.406	S	S	.	.	H	α-helix	trans	-67.8	-40.1	171.8	-164.6	-179.8	173.1	0	0	110.7	N723 L727 C728 N729	N723-E725 PolarHBondContact O-N 2.9Å; E725-L727 VanDerWaalsContact C-N 3.31Å; E725-L727 PolarHBondContact O-N 2.94Å; E725-C728 PolarHBondContact O-N 3.38Å; E725-N729 WeakPolarHBondContact O-CB 3.31Å; E725-N729 PolarHBondContact O-N 3.44Å; E725-N729 PolarHBondContact O-ND2 2.82Å
726	Q	73.6	Confident	72.6	Confident	89 Å²	89	76.7 Å²	76.7	42%	0.416	40%	0.398	S	S	.	.	H	α-helix	trans	-64.3	-35.7	170.7	-70.8	177	-8.4	0	0	112.2	N723 N729 K730	N723-Q726 HydrophobicContact CB-CB 4Å; N723-Q726 HydrophobicContact CB-CG 3.81Å; N723-Q726 PolarHBondContact ND2-NE2 3.38Å; N723-Q726 WeakPolarHBondContact O-CB 3.44Å; N723-Q726 PolarHBondContact O-N 3.43Å; N723-Q726 VanDerWaalsContact O-N 3.08Å; Q726-N729 PolarHBondContact O-N 3.01Å; Q726-K730 WeakPolarHBondContact O-CB 3.24Å; Q726-K730 PolarHBondContact O-N 2.74Å
727	L	77.7	Confident	73.5	Confident	1 Å²	1	79 Å²	79	1%	0.005	41%	0.406	C	S	.	.	H	α-helix	trans	-62.2	-48.5	173.7	-175.1	72.2	0	0	0	110.7	A607 V627 L713 L717 N723 T724 E725 N729 K730 L731	A607-L727 HydrophobicContact CB-CD2 3.98Å; V627-L727 HydrophobicContact CG1-CD2 4.28Å; V627-L727 HydrophobicContact CG1-CG 4.37Å; L713-L727 HydrophobicContact CB-CD1 4.32Å; L713-L727 HydrophobicContact CB-CD2 3.95Å; L713-L727 HydrophobicContact CD1-CD2 3.97Å; L717-L727 HydrophobicContact CD1-CD1 3.79Å; N723-L727 PolarHBondContact O-N 2.97Å; N723-L727 VanDerWaalsContact O-N 3.11Å; T724-L727 WeakPolarHBondContact O-CB 3.47Å; T724-L727 PolarHBondContact O-N 3.38Å; E725-L727 VanDerWaalsContact C-N 3.31Å; E725-L727 PolarHBondContact O-N 2.94Å; L727-N729 VanDerWaalsContact C-N 3.34Å; L727-N729 PolarHBondContact O-N 3.27Å; L727-K730 PolarHBondContact O-N 3.25Å; L727-L731 WeakPolarHBondContact O-CB 3.42Å; L727-L731 PolarHBondContact O-N 2.8Å
728	C	81.2	Confident	74.4	Confident	7 Å²	7	79.8 Å²	79.8	5%	0.047	41%	0.411	C	S	.	.	H	α-helix	trans	-59	-45.6	176.1	-171.6	0	0	0	0	111.5	V627 H628 T724 E725 L731 S732	V627-C728 HydrophobicContact CG1-CB 4.27Å; H628-C728 HydrophobicContact CB-CB 4.23Å; T724-C728 PolarHBondContact O-N 3.01Å; E725-C728 PolarHBondContact O-N 3.38Å; C728-L731 PolarHBondContact O-N 2.63Å; C728-S732 WeakPolarHBondContact O-CB 3.18Å; C728-S732 PolarHBondContact O-N 2.78Å; C728-S732 PolarHBondContact O-OG 2.98Å
729	N	78.1	Confident	75.5	Confident	83 Å²	83	71.6 Å²	71.6	44%	0.444	37%	0.373	S	S	.	.	H	α-helix	trans	-63.6	-46.3	178.9	-71.7	-23.3	0	0	0	111.9	E725 Q726 L727 S732 V733	E725-N729 WeakPolarHBondContact O-CB 3.31Å; E725-N729 PolarHBondContact O-N 3.44Å; E725-N729 PolarHBondContact O-ND2 2.82Å; Q726-N729 PolarHBondContact O-N 3.01Å; L727-N729 VanDerWaalsContact C-N 3.34Å; L727-N729 PolarHBondContact O-N 3.27Å; N729-S732 WeakPolarHBondContact O-CB 3.35Å; N729-S732 PolarHBondContact O-N 3.31Å; N729-V733 WeakPolarHBondContact O-CG2 3.47Å
730	K	79.1	Confident	76.7	Confident	76 Å²	76	76.9 Å²	76.9	33%	0.33	39%	0.391	S	S	.	.	H	α-helix	trans	-63	-46.9	176.7	-86	176.3	165.3	-165.8	0	111.7	L717 E718 C719 Q726 L727 S732 V733 Q734	L717-K730 PolarHBondContact O-NZ 2.82Å; E718-K730 PolarHBondContact O-NZ 3.4Å; C719-K730 WeakPolarHBondContact SG-CD 3.5Å; C719-K730 PolarHBondContact SG-NZ 3.36Å; Q726-K730 WeakPolarHBondContact O-CB 3.24Å; Q726-K730 PolarHBondContact O-N 2.74Å; L727-K730 PolarHBondContact O-N 3.25Å; K730-S732 PolarHBondContact O-N 2.92Å; K730-V733 PolarHBondContact O-N 3.4Å; K730-V733 VanDerWaalsContact O-N 3.08Å; K730-Q734 WeakPolarHBondContact O-CG 3.35Å; K730-Q734 PolarHBondContact O-N 2.83Å
731	L	82.5	Confident	78	Confident	1 Å²	1	78.1 Å²	78.1	1%	0.005	39%	0.385	C	S	.	.	H	α-helix	trans	-67.5	-25.8	-177.1	-149.2	145.4	0	0	0	111.9	L652 L695 L717 L727 C728 V733 K739 I742	L652-L731 HydrophobicContact CD1-CD2 3.82Å; L652-L731 HydrophobicContact CD2-CD2 4.44Å; L695-L731 HydrophobicContact CD1-CB 4.41Å; L695-L731 HydrophobicContact CD1-CD2 4.06Å; L695-L731 HydrophobicContact CD2-CD2 4.15Å; L695-L731 HydrophobicContact CG-CD2 4.19Å; L717-L731 HydrophobicContact CD1-CB 4.09Å; L717-L731 HydrophobicContact CD1-CD1 3.7Å; L717-L731 HydrophobicContact CD1-CG 4.03Å; L727-L731 WeakPolarHBondContact O-CB 3.42Å; L727-L731 PolarHBondContact O-N 2.8Å; C728-L731 PolarHBondContact O-N 2.63Å; L731-V733 VanDerWaalsContact C-N 3.35Å; L731-K739 HydrophobicContact CD2-CG 4.42Å; L731-K739 WeakPolarHBondContact O-CE 3.35Å; L731-I742 HydrophobicContact CD1-CD1 3.79Å; L731-I742 HydrophobicContact CG-CD1 4.24Å
732	S	79.7	Confident	79.3	Confident	18 Å²	18	72.2 Å²	72.2	13%	0.126	35%	0.353	C	S	.	.	H	α-helix	trans	-65.6	-33.5	171.3	-59.2	0	0	0	0	113	L695 C728 N729 K730	L695-S732 WeakPolarHBondContact CD1-OG 3.36Å; C728-S732 WeakPolarHBondContact O-CB 3.18Å; C728-S732 PolarHBondContact O-N 2.78Å; C728-S732 PolarHBondContact O-OG 2.98Å; N729-S732 WeakPolarHBondContact O-CB 3.35Å; N729-S732 PolarHBondContact O-N 3.31Å; K730-S732 PolarHBondContact O-N 2.92Å
733	V	78.9	Confident	80.5	Confident	109 Å²	109	64.3 Å²	64.3	66%	0.661	32%	0.315	S	S	*	.	H	α-helix	trans	-92.7	-6.7	-179.1	-131.9	0	0	0	0	113.9	N729 K730 L731	N729-V733 WeakPolarHBondContact O-CG2 3.47Å; K730-V733 PolarHBondContact O-N 3.4Å; K730-V733 VanDerWaalsContact O-N 3.08Å; L731-V733 VanDerWaalsContact C-N 3.35Å
734	Q	80.5	Confident	81.4	Confident	63 Å²	63	64.8 Å²	64.8	29%	0.294	32%	0.315	S	S	.	.	S	Bend	trans	-72.5	143.4	-179.1	-73	-63.2	-30.5	0	0	111.8	L717 K730 V738 K739	L717-Q734 HydrophobicContact CD2-CG 3.57Å; K730-Q734 WeakPolarHBondContact O-CG 3.35Å; K730-Q734 PolarHBondContact O-N 2.83Å; Q734-V738 HydrophobicContact CB-CB 4.08Å; Q734-V738 HydrophobicContact CB-CG1 4.15Å; Q734-V738 HydrophobicContact CG-CG1 4.18Å; Q734-K739 WeakPolarHBondContact O-CE 3.48Å
735	P	79.9	Confident	81.9	Confident	64 Å²	64	62.2 Å²	62.2	42%	0.416	30%	0.301	S	S	.	.			trans	-58.1	152.6	172.5	-22.8	33.1	0	0	0	112.9	H737 V738 K739	P735-H737 WeakPolarHBondContact CB-CE1 3.45Å; P735-H737 WeakPolarHBondContact CB-ND1 3.36Å; P735-H737 PolarHBondContact O-N 3.22Å; P735-H737 VanDerWaalsContact O-N 3.14Å; P735-V738 WeakPolarHBondContact O-CB 3.42Å; P735-V738 PolarHBondContact O-N 2.7Å; P735-K739 PolarHBondContact O-N 2.89Å
736	D	79.9	Confident	82.3	Confident	93 Å²	93	56.9 Å²	56.9	50%	0.497	28%	0.277	S	S	.	.	H	α-helix	trans	-59.2	-30.8	-175.7	-66.2	-27.4	0	0	0	114	V738 K739 R740	D736-V738 PolarHBondContact O-N 3.03Å; D736-K739 PolarHBondContact O-N 3.48Å; D736-K739 IonicContact OD1-NZ 3.67Å; D736-R740 WeakPolarHBondContact O-CB 3.43Å; D736-R740 PolarHBondContact O-N 3.22Å
737	H	83.5	Confident	82.9	Confident	137 Å²	137	56.5 Å²	56.5	63%	0.634	28%	0.278	S	S	*	.	H	α-helix	trans	-63.6	-29.6	175.4	68.3	-95.9	0	0	0	112.8	P735 R741	P735-H737 WeakPolarHBondContact CB-CE1 3.45Å; P735-H737 WeakPolarHBondContact CB-ND1 3.36Å; P735-H737 PolarHBondContact O-N 3.22Å; P735-H737 VanDerWaalsContact O-N 3.14Å; H737-R741 WeakPolarHBondContact O-CB 3.47Å; H737-R741 PolarHBondContact O-N 2.89Å; H737-R741 VanDerWaalsContact O-N 3.07Å
738	V	83.5	Confident	83.4	Confident	29 Å²	29	62.2 Å²	62.2	18%	0.176	30%	0.299	C	S	.	.	H	α-helix	trans	-73.9	-45.3	175.3	-178.3	0	0	0	0	110.1	L717 Q734 P735 D736 R740 R741 I742	L717-V738 HydrophobicContact CD2-CG1 4.34Å; Q734-V738 HydrophobicContact CB-CB 4.08Å; Q734-V738 HydrophobicContact CB-CG1 4.15Å; Q734-V738 HydrophobicContact CG-CG1 4.18Å; P735-V738 WeakPolarHBondContact O-CB 3.42Å; P735-V738 PolarHBondContact O-N 2.7Å; D736-V738 PolarHBondContact O-N 3.03Å; V738-R740 VanDerWaalsContact C-N 3.31Å; V738-R740 PolarHBondContact O-N 3.48Å; V738-R741 PolarHBondContact O-N 2.98Å; V738-I742 WeakPolarHBondContact O-CG1 3.37Å; V738-I742 PolarHBondContact O-N 3.2Å; V738-I742 VanDerWaalsContact O-N 3.14Å
739	K	85.7	Confident	83.7	Confident	13 Å²	13	62.6 Å²	62.6	6%	0.057	30%	0.303	C	S	.	.	H	α-helix	trans	-59.2	-43.3	174.5	-63.6	178.3	-171.9	164.3	0	111.1	L652 I693 L731 Q734 P735 D736 I742 W743	L652-K739 HydrophobicContact CD1-CB 4.48Å; I693-K739 HydrophobicContact CB-CB 4.42Å; I693-K739 HydrophobicContact CG2-CB 4.04Å; I693-K739 WeakPolarHBondContact O-CD 3.13Å; L731-K739 HydrophobicContact CD2-CG 4.42Å; L731-K739 WeakPolarHBondContact O-CE 3.35Å; Q734-K739 WeakPolarHBondContact O-CE 3.48Å; P735-K739 PolarHBondContact O-N 2.89Å; D736-K739 PolarHBondContact O-N 3.48Å; D736-K739 IonicContact OD1-NZ 3.67Å; K739-I742 WeakPolarHBondContact O-CB 3.38Å; K739-I742 PolarHBondContact O-N 3.43Å; K739-W743 PolarHBondContact O-N 3.33Å
740	R	86.1	Confident	84.1	Confident	126 Å²	126	62.8 Å²	62.8	48%	0.475	30%	0.3	S	S	.	.	H	α-helix	trans	-60.2	-44.9	175.3	-170.4	168.3	-82.4	161.6	-4.5	112.6	S691 I693 D736 V738 I742 W743 E744	S691-R740 PolarHBondContact O-NH2 3.3Å; I693-R740 VanDerWaalsContact CD1-CA 3.46Å; I693-R740 HydrophobicContact CD1-CB 3.79Å; I693-R740 HydrophobicContact CD1-CG 3.87Å; D736-R740 WeakPolarHBondContact O-CB 3.43Å; D736-R740 PolarHBondContact O-N 3.22Å; V738-R740 VanDerWaalsContact C-N 3.31Å; V738-R740 PolarHBondContact O-N 3.48Å; R740-I742 VanDerWaalsContact C-N 3.26Å; R740-I742 PolarHBondContact O-N 3.08Å; R740-W743 WeakPolarHBondContact O-CB 3.48Å; R740-W743 PolarHBondContact O-N 3.28Å; R740-W743 VanDerWaalsContact O-N 3.17Å; R740-E744 VanDerWaalsContact O-CG 3.29Å; R740-E744 WeakPolarHBondContact O-CG 3.41Å; R740-E744 PolarHBondContact O-N 2.95Å
741	R	86	Confident	84.5	Confident	166 Å²	166	63 Å²	63	63%	0.626	32%	0.315	S	S	*	.	H	α-helix	trans	-60.4	-33.9	175.2	-169.4	176.9	-178.8	176.8	1	113.5	H737 V738 R748	H737-R741 WeakPolarHBondContact O-CB 3.47Å; H737-R741 PolarHBondContact O-N 2.89Å; H737-R741 VanDerWaalsContact O-N 3.07Å; V738-R741 PolarHBondContact O-N 2.98Å; R741-R748 PolarHBondContact O-NH2 3.07Å
742	I	85.1	Confident	84.7	Confident	6 Å²	6	71.8 Å²	71.8	3%	0.031	35%	0.353	C	S	.	.	H	α-helix	trans	-70.7	-47	174.7	-64.9	171.7	0	0	0	110.4	I625 L652 L713 L716 L731 V738 K739 R740 E744 G745	I625-I742 HydrophobicContact CD1-CG2 4.05Å; L652-I742 HydrophobicContact CD2-CB 4.08Å; L652-I742 HydrophobicContact CD2-CG2 3.74Å; L713-I742 HydrophobicContact CD2-CG2 3.51Å; L716-I742 HydrophobicContact CD1-CG1 4.28Å; L731-I742 HydrophobicContact CD1-CD1 3.79Å; L731-I742 HydrophobicContact CG-CD1 4.24Å; V738-I742 WeakPolarHBondContact O-CG1 3.37Å; V738-I742 PolarHBondContact O-N 3.2Å; V738-I742 VanDerWaalsContact O-N 3.14Å; K739-I742 WeakPolarHBondContact O-CB 3.38Å; K739-I742 PolarHBondContact O-N 3.43Å; R740-I742 VanDerWaalsContact C-N 3.26Å; R740-I742 PolarHBondContact O-N 3.08Å; I742-E744 PolarHBondContact O-N 2.92Å; I742-G745 WeakPolarHBondContact O-CA 3.41Å; I742-G745 PolarHBondContact O-N 2.82Å
743	W	87.4	Confident	85.1	Confident	22 Å²	22	74.9 Å²	74.9	8%	0.083	37%	0.368	C	S	.	.	H	α-helix	trans	-58.4	-44.7	177.2	179.5	-108.7	0	0	0	113.2	W623 I625 L652 E654 I693 K739 R740 G745 V746	W623-W743 WeakPolarHBondContact O-CH2 3.48Å; I625-W743 HydrophobicContact CD1-CE3 4.15Å; L652-W743 WeakPolarHBondContact O-CZ3 3.35Å; E654-W743 HydrophobicContact CB-CD2 4.4Å; E654-W743 HydrophobicContact CB-CH2 3.86Å; E654-W743 HydrophobicContact CB-CZ2 3.3Å; E654-W743 HydrophobicContact CG-CZ2 4.45Å; E654-W743 PolarHBondContact OE2-NE1 3.15Å; I693-W743 HydrophobicContact CD1-CB 3.44Å; I693-W743 VanDerWaalsContact CD1-CB 3.44Å; I693-W743 HydrophobicContact CD1-CD2 4.46Å; I693-W743 HydrophobicContact CD1-CG 3.55Å; I693-W743 HydrophobicContact CG1-CB 4.19Å; I693-W743 HydrophobicContact CG1-CD2 4.48Å; I693-W743 HydrophobicContact CG1-CG 4.03Å; I693-W743 HydrophobicContact CG2-CB 4.18Å; K739-W743 PolarHBondContact O-N 3.33Å; R740-W743 WeakPolarHBondContact O-CB 3.48Å; R740-W743 PolarHBondContact O-N 3.28Å; R740-W743 VanDerWaalsContact O-N 3.17Å; W743-G745 PolarHBondContact O-N 3.47Å; W743-V746 WeakPolarHBondContact O-CB 3.44Å; W743-V746 PolarHBondContact O-N 3.14Å
744	E	87.3	Confident	85.2	Confident	77 Å²	77	73.1 Å²	73.1	36%	0.36	37%	0.372	S	S	.	.	H	α-helix	trans	-56.9	-15.6	172.9	-70.2	168.1	-174.7	0	0	112.7	R740 I742 V746 D747 R748	R740-E744 VanDerWaalsContact O-CG 3.29Å; R740-E744 WeakPolarHBondContact O-CG 3.41Å; R740-E744 PolarHBondContact O-N 2.95Å; I742-E744 PolarHBondContact O-N 2.92Å; E744-V746 VanDerWaalsContact C-N 3.25Å; E744-V746 PolarHBondContact O-N 3.15Å; E744-D747 PolarHBondContact O-N 3.29Å; E744-R748 VanDerWaalsContact CB-NH1 3.27Å; E744-R748 WeakPolarHBondContact O-CB 3.33Å; E744-R748 VanDerWaalsContact O-CG 3.28Å; E744-R748 WeakPolarHBondContact O-CG 3.37Å; E744-R748 PolarHBondContact O-N 3.39Å; E744-R748 PolarHBondContact O-NE 3.09Å; E744-R748 IonicContact OE2-NH1 3.38Å; E744-R748 PolarHBondContact OE2-NH1 3.11Å; E744-R748 VanDerWaalsContact OE2-NH1 3.14Å
745	G	86.1	Confident	85.1	Confident	9 Å²	9	72.1 Å²	72.1	9%	0.093	38%	0.378	C	S	.	.	H	α-helix	trans	-59.8	-34.2	168.9	0	0	0	0	0	113.1	I742 W743 R748 A749	I742-G745 WeakPolarHBondContact O-CA 3.41Å; I742-G745 PolarHBondContact O-N 2.82Å; W743-G745 PolarHBondContact O-N 3.47Å; G745-R748 VanDerWaalsContact N-NH2 3.19Å; G745-A749 WeakPolarHBondContact O-CB 3.31Å; G745-A749 PolarHBondContact O-N 3.27Å
746	V	86.9	Confident	85.3	Confident	5 Å²	5	75.1 Å²	75.1	3%	0.03	39%	0.39	C	S	.	.	H	α-helix	trans	-70.2	-46.1	175	-180	0	0	0	0	110.3	V610 W623 I625 L711 W743 E744 R748 A749 K750 L757	V610-V746 HydrophobicContact CG1-CG1 4.43Å; V610-V746 HydrophobicContact CG2-CG2 4.12Å; W623-V746 HydrophobicContact CB-CG1 4.47Å; I625-V746 HydrophobicContact CD1-CG2 3.65Å; I625-V746 HydrophobicContact CG1-CG2 3.45Å; I625-V746 VanDerWaalsContact CG1-CG2 3.45Å; L711-V746 HydrophobicContact CD1-CG2 4.11Å; W743-V746 WeakPolarHBondContact O-CB 3.44Å; W743-V746 PolarHBondContact O-N 3.14Å; E744-V746 VanDerWaalsContact C-N 3.25Å; E744-V746 PolarHBondContact O-N 3.15Å; V746-R748 PolarHBondContact O-N 3.24Å; V746-A749 CarbonylContact O-C 3.56Å; V746-A749 WeakPolarHBondContact O-CA 3.42Å; V746-A749 WeakPolarHBondContact O-CB 3.43Å; V746-A749 PolarHBondContact O-N 2.71Å; V746-K750 WeakPolarHBondContact O-CB 3.03Å; V746-K750 PolarHBondContact O-N 3.42Å; V746-L757 HydrophobicContact CG1-CD1 3.92Å
747	D	86.1	Confident	85.5	Confident	82 Å²	82	70.9 Å²	70.9	44%	0.439	37%	0.367	S	S	.	.	H	α-helix	trans	-62.8	-43.2	177.6	-64.5	-36.5	0	0	0	111.8	E744 A749 K750 A751	E744-D747 PolarHBondContact O-N 3.29Å; D747-A749 VanDerWaalsContact C-N 3.25Å; D747-A749 PolarHBondContact O-N 3.24Å; D747-K750 PolarHBondContact O-N 2.88Å; D747-A751 WeakPolarHBondContact O-CB 3.37Å; D747-A751 PolarHBondContact O-N 2.66Å
748	R	87.2	Confident	85.8	Confident	121 Å²	121	67 Å²	67	46%	0.457	35%	0.354	S	S	.	.	H	α-helix	trans	-60.5	-35.3	173.1	-73.3	-175	-64.8	-96.7	-0.5	112	R741 E744 G745 V746 K752	R741-R748 PolarHBondContact O-NH2 3.07Å; E744-R748 VanDerWaalsContact CB-NH1 3.27Å; E744-R748 WeakPolarHBondContact O-CB 3.33Å; E744-R748 VanDerWaalsContact O-CG 3.28Å; E744-R748 WeakPolarHBondContact O-CG 3.37Å; E744-R748 PolarHBondContact O-N 3.39Å; E744-R748 PolarHBondContact O-NE 3.09Å; E744-R748 IonicContact OE2-NH1 3.38Å; E744-R748 PolarHBondContact OE2-NH1 3.11Å; E744-R748 VanDerWaalsContact OE2-NH1 3.14Å; G745-R748 VanDerWaalsContact N-NH2 3.19Å; V746-R748 PolarHBondContact O-N 3.24Å; R748-K752 WeakPolarHBondContact O-CB 3.13Å; R748-K752 VanDerWaalsContact O-CG 3.31Å; R748-K752 WeakPolarHBondContact O-CG 3.39Å; R748-K752 PolarHBondContact O-N 3.16Å
749	A	87.4	Confident	86	Confident	15 Å²	15	69.4 Å²	69.4	12%	0.124	37%	0.369	C	S	.	.	H	α-helix	trans	-72	-44.4	175.3	0	0	0	0	0	112	V709 G745 V746 D747 A751 K752 L753 L757	V709-A749 HydrophobicContact CG1-CB 3.77Å; V709-A749 HydrophobicContact CG2-CB 4.39Å; G745-A749 WeakPolarHBondContact O-CB 3.31Å; G745-A749 PolarHBondContact O-N 3.27Å; V746-A749 CarbonylContact O-C 3.56Å; V746-A749 WeakPolarHBondContact O-CA 3.42Å; V746-A749 WeakPolarHBondContact O-CB 3.43Å; V746-A749 PolarHBondContact O-N 2.71Å; D747-A749 VanDerWaalsContact C-N 3.25Å; D747-A749 PolarHBondContact O-N 3.24Å; A749-A751 PolarHBondContact O-N 2.97Å; A749-K752 PolarHBondContact O-N 2.85Å; A749-L753 WeakPolarHBondContact O-CB 3.32Å; A749-L753 VanDerWaalsContact O-CG 3.32Å; A749-L753 WeakPolarHBondContact O-CG 3.38Å; A749-L753 PolarHBondContact O-N 2.8Å; A749-L753 VanDerWaalsContact O-N 3.1Å; A749-L757 HydrophobicContact CB-CD2 4.35Å
750	K	87.5	Confident	86.1	Confident	87 Å²	87	69.7 Å²	69.7	38%	0.378	37%	0.371	S	S	.	.	H	α-helix	trans	-61.1	-43.2	177.3	-171.5	178.3	179.2	-174.6	0	111.5	V746 D747 L753 G755 L757	V746-K750 WeakPolarHBondContact O-CB 3.03Å; V746-K750 PolarHBondContact O-N 3.42Å; D747-K750 PolarHBondContact O-N 2.88Å; K750-L753 PolarHBondContact O-N 3.23Å; K750-G755 WeakPolarHBondContact CE-O 3.38Å; K750-G755 WeakPolarHBondContact CG-O 3.45Å; K750-G755 WeakPolarHBondContact O-CA 3.36Å; K750-G755 PolarHBondContact O-N 3.49Å; K750-L757 HydrophobicContact CB-CD2 4.13Å; K750-L757 HydrophobicContact CB-CG 4.17Å; K750-L757 HydrophobicContact CG-CG 4.3Å
751	A	87.7	Confident	86	Confident	80 Å²	80	66.2 Å²	66.2	66%	0.661	36%	0.361	S	S	*	.	H	α-helix	trans	-63.9	-40.9	175.2	0	0	0	0	0	112.4	D747 A749 L753	D747-A751 WeakPolarHBondContact O-CB 3.37Å; D747-A751 PolarHBondContact O-N 2.66Å; A749-A751 PolarHBondContact O-N 2.97Å; A751-L753 PolarHBondContact O-N 2.74Å
752	K	86.9	Confident	86	Confident	185 Å²	185	58.8 Å²	58.8	80%	0.804	34%	0.335	S	S	*	.	H	α-helix	trans	-68.4	-19.4	176	-78.8	-178.4	178.1	-174	0	114.1	R748 A749	R748-K752 WeakPolarHBondContact O-CB 3.13Å; R748-K752 VanDerWaalsContact O-CG 3.31Å; R748-K752 WeakPolarHBondContact O-CG 3.39Å; R748-K752 PolarHBondContact O-N 3.16Å; A749-K752 PolarHBondContact O-N 2.85Å
753	L	86.7	Confident	86	Confident	84 Å²	84	62 Å²	62	44%	0.44	35%	0.351	S	S	.	.	T	Hydrogen-bonded Turn	trans	-108.9	22.6	-174.8	-65.8	170.6	0	0	0	113.6	V709 A749 K750 A751 L757 P758	V709-L753 HydrophobicContact CG2-CD1 3.54Å; A749-L753 WeakPolarHBondContact O-CB 3.32Å; A749-L753 VanDerWaalsContact O-CG 3.32Å; A749-L753 WeakPolarHBondContact O-CG 3.38Å; A749-L753 PolarHBondContact O-N 2.8Å; A749-L753 VanDerWaalsContact O-N 3.1Å; K750-L753 PolarHBondContact O-N 3.23Å; A751-L753 PolarHBondContact O-N 2.74Å; L753-L757 HydrophobicContact CD1-CD2 4.28Å; L753-P758 HydrophobicContact CD1-CG 4.22Å
754	G	81.1	Confident	86	Confident	71 Å²	71	69 Å²	69	73%	0.732	38%	0.382	S	S	*	.	T	Hydrogen-bonded Turn	trans	75.3	26.1	174.1	0	0	0	0	0	114.6	I756	G754-I756 VanDerWaalsContact C-N 3.3Å; G754-I756 PolarHBondContact O-N 3.27Å
755	G	80	Confident	85.8	Confident	42 Å²	42	69.1 Å²	69.1	43%	0.433	39%	0.385	S	S	.	.	T	Hydrogen-bonded Turn	trans	87	-8.6	175.7	0	0	0	0	0	114.7	K750	K750-G755 WeakPolarHBondContact CE-O 3.38Å; K750-G755 WeakPolarHBondContact CG-O 3.45Å; K750-G755 WeakPolarHBondContact O-CA 3.36Å; K750-G755 PolarHBondContact O-N 3.49Å
756	I	82.3	Confident	85.8	Confident	127 Å²	127	68.9 Å²	68.9	65%	0.651	38%	0.382	S	S	*	.			trans	-120.2	127.8	-178.9	-54.9	174.2	0	0	0	108.8	G754 P758	G754-I756 VanDerWaalsContact C-N 3.3Å; G754-I756 PolarHBondContact O-N 3.27Å; I756-P758 WeakPolarHBondContact O-CD 3.48Å
757	L	86	Confident	85.6	Confident	5 Å²	5	74 Å²	74	3%	0.026	41%	0.409	C	S	.	.	P	Polyproline II helix	trans	-82.7	116.8	170.3	-71	173.3	0	0	0	108.7	V610 W623 V709 V746 A749 K750 L753 V759	V610-L757 HydrophobicContact CG1-CD1 4.12Å; W623-L757 HydrophobicContact CB-CD1 4.4Å; W623-L757 HydrophobicContact CD2-CD1 3.67Å; W623-L757 HydrophobicContact CE3-CD1 4.3Å; W623-L757 HydrophobicContact CG-CD1 3.7Å; W623-L757 HydrophobicContact CH2-CB 4.1Å; W623-L757 HydrophobicContact CZ2-CB 3.7Å; W623-L757 HydrophobicContact CZ2-CD1 4.36Å; V709-L757 HydrophobicContact CG2-CD2 3.93Å; V746-L757 HydrophobicContact CG1-CD1 3.92Å; A749-L757 HydrophobicContact CB-CD2 4.35Å; K750-L757 HydrophobicContact CB-CD2 4.13Å; K750-L757 HydrophobicContact CB-CG 4.17Å; K750-L757 HydrophobicContact CG-CG 4.3Å; L753-L757 HydrophobicContact CD1-CD2 4.28Å; L757-V759 PolarHBondContact O-N 2.88Å
758	P	89.2	Confident	85.5	Confident	55 Å²	55	70.4 Å²	70.4	36%	0.357	39%	0.39	S	S	.	.	P	Polyproline II helix	trans	-64.1	130.3	-179.2	13.3	-15.2	0	0	0	110.1	S707 S708 L753 I756	S707-P758 WeakPolarHBondContact CA-O 3.47Å; S707-P758 WeakPolarHBondContact CB-O 3.45Å; S707-P758 PolarHBondContact OG-O 2.52Å; S708-P758 PolarHBondContact N-O 2.98Å; S708-P758 WeakPolarHBondContact OG-CG 3.03Å; L753-P758 HydrophobicContact CD1-CG 4.22Å; I756-P758 WeakPolarHBondContact O-CD 3.48Å
759	V	87.8	Confident	85.1	Confident	80 Å²	80	73.4 Å²	73.4	49%	0.485	41%	0.406	S	S	.	.	B	Isolated β-bridge	trans	-89.5	137	176.2	-175.9	0	0	0	0	108.8	W623 I706 L757 D761	W623-V759 HydrophobicContact CH2-CG2 3.95Å; I706-V759 CarbonylContact O-C 3.54Å; I706-V759 WeakPolarHBondContact O-CA 3.39Å; L757-V759 PolarHBondContact O-N 2.88Å; V759-D761 PolarHBondContact O-N 3.07Å
760	L	87.1	Confident	85	Confident	19 Å²	19	73.7 Å²	73.7	10%	0.099	41%	0.406	C	S	.	.	P	Polyproline II helix	trans	-64.2	125.2	173.2	-64.6	175.4	0	0	0	110.1	F604 I706 D765 L766	F604-L760 HydrophobicContact CD1-CD1 3.75Å; F604-L760 HydrophobicContact CE1-CD1 4.26Å; F604-L760 HydrophobicContact CG-CD1 4.45Å; I706-L760 HydrophobicContact CB-CD1 4.14Å; I706-L760 HydrophobicContact CG2-CD1 3.61Å; I706-L760 HydrophobicContact CG2-CG 4.4Å; I706-L760 PolarHBondContact O-N 2.9Å; L760-D765 VanDerWaalsContact CA-OD2 3.32Å; L760-D765 WeakPolarHBondContact CA-OD2 2.94Å; L760-D765 HydrophobicContact CB-CB 3.88Å; L760-D765 HydrophobicContact CD2-CB 3.75Å; L760-D765 HydrophobicContact CG-CB 4.37Å; L760-L766 HydrophobicContact CB-CD2 4.16Å; L760-L766 HydrophobicContact CB-CG 4.19Å; L760-L766 HydrophobicContact CD1-CD2 3.77Å
761	D	85.2	Confident	84.9	Confident	52 Å²	52	74.9 Å²	74.9	28%	0.278	42%	0.416	S	S	.	.	P	Polyproline II helix	trans	-65.5	124.5	173.7	-176.9	-46.7	0	0	0	109.4	V759 I763 K764 D765 L766	V759-D761 PolarHBondContact O-N 3.07Å; D761-I763 PolarHBondContact O-N 3.43Å; D761-I763 WeakPolarHBondContact OD1-CA 3.38Å; D761-I763 WeakPolarHBondContact OD1-CB 3.48Å; D761-I763 PolarHBondContact OD1-N 3.4Å; D761-K764 HydrophobicContact CB-CB 3.92Å; D761-K764 HydrophobicContact CB-CG 4.41Å; D761-K764 PolarHBondContact OD1-N 2.99Å; D761-K764 WeakPolarHBondContact OD2-CD 3.49Å; D761-D765 PolarHBondContact N-OD2 2.74Å; D761-D765 WeakPolarHBondContact O-CB 3.44Å; D761-D765 PolarHBondContact O-N 2.98Å; D761-L766 PolarHBondContact O-N 3.46Å; D761-L766 VanDerWaalsContact O-N 3.1Å
762	P	85.6	Confident	84.9	Confident	11 Å²	11	76.4 Å²	76.4	7%	0.071	41%	0.405	C	S	.	.	T	Hydrogen-bonded Turn	trans	-54.9	-35	179.4	-27	34.8	0	0	0	113.8	V595 I768 V773	V595-P762 HydrophobicContact CG2-CB 3.83Å; V595-P762 HydrophobicContact CG2-CG 3.88Å; P762-I768 HydrophobicContact CB-CD1 4.27Å; P762-I768 WeakPolarHBondContact O-CB 3.43Å; P762-I768 VanDerWaalsContact O-CG1 3.3Å; P762-I768 WeakPolarHBondContact O-CG1 3.4Å; P762-I768 PolarHBondContact O-N 3.16Å; P762-V773 HydrophobicContact CB-CG1 3.94Å
763	I	85.2	Confident	84.9	Confident	72 Å²	72	67.6 Å²	67.6	37%	0.369	37%	0.367	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.8	-52.5	-177.3	-58.8	174.9	0	0	0	109.9	D761 N767 K774	D761-I763 PolarHBondContact O-N 3.43Å; D761-I763 WeakPolarHBondContact OD1-CA 3.38Å; D761-I763 WeakPolarHBondContact OD1-CB 3.48Å; D761-I763 PolarHBondContact OD1-N 3.4Å; I763-N767 WeakPolarHBondContact O-CA 3.41Å; I763-N767 PolarHBondContact O-N 3.09Å; I763-K774 HydrophobicContact CD1-CB 4.24Å; I763-K774 HydrophobicContact CD1-CG 4.42Å
764	K	86.1	Confident	84.9	Confident	169 Å²	169	68.6 Å²	68.6	74%	0.735	37%	0.368	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.4	-42.6	-171.6	-60.2	176.8	-176.2	169.2	0	113.5	D761	D761-K764 HydrophobicContact CB-CB 3.92Å; D761-K764 HydrophobicContact CB-CG 4.41Å; D761-K764 PolarHBondContact OD1-N 2.99Å; D761-K764 WeakPolarHBondContact OD2-CD 3.49Å
765	D	84.6	Confident	85.2	Confident	80 Å²	80	71.2 Å²	71.2	43%	0.428	36%	0.36	S	S	.	.	T	Hydrogen-bonded Turn	trans	-97.8	-39	-170.7	-60.2	-35.7	0	0	0	112.3	F604 L760 D761	F604-D765 WeakPolarHBondContact CZ-O 3.43Å; L760-D765 VanDerWaalsContact CA-OD2 3.32Å; L760-D765 WeakPolarHBondContact CA-OD2 2.94Å; L760-D765 HydrophobicContact CB-CB 3.88Å; L760-D765 HydrophobicContact CD2-CB 3.75Å; L760-D765 HydrophobicContact CG-CB 4.37Å; D761-D765 PolarHBondContact N-OD2 2.74Å; D761-D765 WeakPolarHBondContact O-CB 3.44Å; D761-D765 PolarHBondContact O-N 2.98Å
766	L	85.2	Confident	85.6	Confident	5 Å²	5	71 Å²	71	3%	0.026	35%	0.348	C	S	.	.	S	Bend	trans	-89.3	-4.4	178.5	-57.8	179.8	0	0	0	113.4	V595 V601 F604 I706 L760 D761 I768	V595-L766 HydrophobicContact CG1-CD1 4.24Å; V601-L766 HydrophobicContact CG2-CD1 4.35Å; F604-L766 HydrophobicContact CB-CD2 4.42Å; F604-L766 HydrophobicContact CD1-CD2 3.81Å; F604-L766 HydrophobicContact CD2-CD2 3.61Å; F604-L766 HydrophobicContact CE1-CD2 3.88Å; F604-L766 HydrophobicContact CE2-CD2 3.69Å; F604-L766 HydrophobicContact CG-CD2 3.67Å; F604-L766 HydrophobicContact CZ-CD2 3.82Å; I706-L766 HydrophobicContact CD1-CD1 4.46Å; L760-L766 HydrophobicContact CB-CD2 4.16Å; L760-L766 HydrophobicContact CB-CG 4.19Å; L760-L766 HydrophobicContact CD1-CD2 3.77Å; D761-L766 PolarHBondContact O-N 3.46Å; D761-L766 VanDerWaalsContact O-N 3.1Å; L766-I768 VanDerWaalsContact C-N 3.27Å; L766-I768 HydrophobicContact CB-CD1 4.06Å; L766-I768 HydrophobicContact CB-CG1 3.99Å; L766-I768 HydrophobicContact CD1-CD1 4.26Å; L766-I768 PolarHBondContact O-N 3.08Å
767	N	82.5	Confident	85.9	Confident	113 Å²	113	66.7 Å²	66.7	60%	0.604	33%	0.329	S	S	*	.			trans	54.5	37.8	179.2	-158.3	11.8	0	0	0	113.2	I763	I763-N767 WeakPolarHBondContact O-CA 3.41Å; I763-N767 PolarHBondContact O-N 3.09Å
768	I	84.5	Confident	86	Confident	6 Å²	6	71.8 Å²	71.8	3%	0.031	35%	0.353	C	S	.	.			trans	-84.4	119.2	177.9	-57.2	172.6	0	0	0	109.7	V595 R598 V601 P762 L766 D770	V595-I768 HydrophobicContact CG1-CD1 3.86Å; R598-I768 HydrophobicContact CB-CD1 4.39Å; R598-I768 HydrophobicContact CG-CD1 4.37Å; R598-I768 HydrophobicContact CG-CG2 4.13Å; V601-I768 HydrophobicContact CG2-CD1 4.2Å; P762-I768 HydrophobicContact CB-CD1 4.27Å; P762-I768 WeakPolarHBondContact O-CB 3.43Å; P762-I768 VanDerWaalsContact O-CG1 3.3Å; P762-I768 WeakPolarHBondContact O-CG1 3.4Å; P762-I768 PolarHBondContact O-N 3.16Å; L766-I768 VanDerWaalsContact C-N 3.27Å; L766-I768 HydrophobicContact CB-CD1 4.06Å; L766-I768 HydrophobicContact CB-CG1 3.99Å; L766-I768 HydrophobicContact CD1-CD1 4.26Å; L766-I768 PolarHBondContact O-N 3.08Å; I768-D770 HydrophobicContact CG2-CB 4.05Å
769	K	78.8	Confident	86	Confident	183 Å²	183	70.9 Å²	70.9	80%	0.796	35%	0.35	S	S	*	.			trans	-99.8	30.3	-178.3	-56.8	-176.5	179.6	-177.9	0	113.9
770	D	84.9	Confident	86.1	Confident	21 Å²	21	67.6 Å²	67.6	11%	0.112	33%	0.33	C	S	.	.			trans	-89.1	121.2	179	-175.3	-10.8	0	0	0	111.4	R598 I768 R772 V773 K774	R598-D770 IonicContact CZ-OD2 3.37Å; R598-D770 VanDerWaalsContact CZ-OD2 3.32Å; R598-D770 IonicContact NH1-OD2 3.03Å; R598-D770 VanDerWaalsContact NH2-CG 3.34Å; R598-D770 IonicContact NH2-OD2 3.13Å; R598-D770 PolarHBondContact NH2-OD2 2.93Å; I768-D770 HydrophobicContact CG2-CB 4.05Å; D770-R772 VanDerWaalsContact C-N 3.26Å; D770-R772 PolarHBondContact O-N 3.43Å; D770-R772 WeakPolarHBondContact OD1-CB 3.34Å; D770-R772 PolarHBondContact OD1-N 3Å; D770-R772 IonicContact OD1-NE 3.41Å; D770-R772 PolarHBondContact OD1-NE 3.15Å; D770-R772 IonicContact OD2-CZ 3.65Å; D770-R772 IonicContact OD2-NE 3.74Å; D770-R772 PolarHBondContact OD2-NE 3.31Å; D770-R772 IonicContact OD2-NH2 3.83Å; D770-R772 PolarHBondContact OD2-NH2 2.86Å; D770-V773 HydrophobicContact CB-CG2 4.06Å; D770-V773 PolarHBondContact O-N 2.85Å; D770-K774 PolarHBondContact O-N 2.94Å
771	D	85.7	Confident	86.2	Confident	113 Å²	113	72 Å²	72	60%	0.604	35%	0.354	S	S	*	.	H	α-helix	trans	-61.2	-29.9	178.9	-71	-32.4	0	0	0	113.6	V773 K774 Q775	D771-V773 VanDerWaalsContact C-N 3.32Å; D771-V773 PolarHBondContact O-N 3.29Å; D771-K774 WeakPolarHBondContact O-CB 3.38Å; D771-K774 PolarHBondContact O-N 2.92Å; D771-Q775 WeakPolarHBondContact O-CG 3.41Å; D771-Q775 PolarHBondContact O-N 2.9Å
772	R	87.7	Confident	86.5	Confident	112 Å²	112	74.5 Å²	74.5	42%	0.423	37%	0.366	S	S	.	.	H	α-helix	trans	-66.7	-37	178.7	-62.1	176.6	-62.1	161.5	12.7	111.8	L594 D770 K774 Q775 Q776	L594-R772 HydrophobicContact CD1-CB 3.83Å; L594-R772 HydrophobicContact CD2-CB 4.44Å; D770-R772 VanDerWaalsContact C-N 3.26Å; D770-R772 PolarHBondContact O-N 3.43Å; D770-R772 WeakPolarHBondContact OD1-CB 3.34Å; D770-R772 PolarHBondContact OD1-N 3Å; D770-R772 IonicContact OD1-NE 3.41Å; D770-R772 PolarHBondContact OD1-NE 3.15Å; D770-R772 IonicContact OD2-CZ 3.65Å; D770-R772 IonicContact OD2-NE 3.74Å; D770-R772 PolarHBondContact OD2-NE 3.31Å; D770-R772 IonicContact OD2-NH2 3.83Å; D770-R772 PolarHBondContact OD2-NH2 2.86Å; R772-K774 VanDerWaalsContact C-N 3.28Å; R772-K774 PolarHBondContact O-N 3.39Å; R772-Q775 PolarHBondContact O-N 2.84Å; R772-Q776 PolarHBondContact O-N 2.86Å; R772-Q776 VanDerWaalsContact O-N 3.11Å
773	V	86.9	Confident	86.8	Confident	0 Å²	0	75.7 Å²	75.7	0%	0	37%	0.372	C	S	.	.	H	α-helix	trans	-65.1	-38.7	175.6	178.2	0	0	0	0	109.7	L594 V595 P762 D770 D771 C777	L594-V773 HydrophobicContact CB-CG2 3.75Å; L594-V773 HydrophobicContact CD1-CG2 4.39Å; V595-V773 HydrophobicContact CG2-CG1 3.99Å; V595-V773 HydrophobicContact CG2-CG2 4.26Å; P762-V773 HydrophobicContact CB-CG1 3.94Å; D770-V773 HydrophobicContact CB-CG2 4.06Å; D770-V773 PolarHBondContact O-N 2.85Å; D771-V773 VanDerWaalsContact C-N 3.32Å; D771-V773 PolarHBondContact O-N 3.29Å; V773-C777 PolarHBondContact O-N 2.94Å; V773-C777 VanDerWaalsContact O-N 3.15Å; V773-C777 PolarHBondContact O-SG 2.86Å
774	K	86.5	Confident	87.1	Confident	105 Å²	105	76.9 Å²	76.9	46%	0.457	37%	0.374	S	S	.	.	H	α-helix	trans	-62.9	-46.4	175.3	-173	-175.9	174	-171.3	0	112.2	I763 D770 D771 R772 Q776 C777 E778	I763-K774 HydrophobicContact CD1-CB 4.24Å; I763-K774 HydrophobicContact CD1-CG 4.42Å; D770-K774 PolarHBondContact O-N 2.94Å; D771-K774 WeakPolarHBondContact O-CB 3.38Å; D771-K774 PolarHBondContact O-N 2.92Å; R772-K774 VanDerWaalsContact C-N 3.28Å; R772-K774 PolarHBondContact O-N 3.39Å; K774-Q776 PolarHBondContact O-N 3.03Å; K774-C777 WeakPolarHBondContact O-CB 3.44Å; K774-C777 PolarHBondContact O-N 3.12Å; K774-E778 WeakPolarHBondContact CE-OE1 3.45Å; K774-E778 WeakPolarHBondContact O-CG 3.42Å; K774-E778 PolarHBondContact O-N 2.77Å; K774-E778 VanDerWaalsContact O-N 3.11Å
775	Q	87.5	Confident	87.2	Confident	125 Å²	125	71 Å²	71	58%	0.584	36%	0.357	S	S	*	.	H	α-helix	trans	-60	-43.7	177.8	-72.5	174.8	-4.8	0	0	112.7	D771 R772 C777 E778 A779	D771-Q775 WeakPolarHBondContact O-CG 3.41Å; D771-Q775 PolarHBondContact O-N 2.9Å; R772-Q775 PolarHBondContact O-N 2.84Å; Q775-C777 VanDerWaalsContact C-N 3.34Å; Q775-C777 PolarHBondContact O-N 3.4Å; Q775-E778 WeakPolarHBondContact O-CB 3.45Å; Q775-E778 PolarHBondContact O-N 3.26Å; Q775-E778 VanDerWaalsContact O-N 3.13Å; Q775-A779 PolarHBondContact O-N 3.45Å
776	Q	89.2	Confident	87.5	Confident	38 Å²	38	73.9 Å²	73.9	18%	0.178	36%	0.362	C	S	.	.	H	α-helix	trans	-64.4	-39.2	178	-74	-66.8	-6.9	0	0	112.2	E590 R591 L594 R772 K774 E778 A779 I780	E590-Q776 PolarHBondContact OE2-NE2 3.49Å; R591-Q776 HydrophobicContact CB-CB 3.92Å; R591-Q776 HydrophobicContact CG-CB 4.06Å; L594-Q776 HydrophobicContact CD1-CG 4.03Å; R772-Q776 PolarHBondContact O-N 2.86Å; R772-Q776 VanDerWaalsContact O-N 3.11Å; K774-Q776 PolarHBondContact O-N 3.03Å; Q776-E778 VanDerWaalsContact C-N 3.28Å; Q776-E778 PolarHBondContact O-N 3.29Å; Q776-A779 PolarHBondContact O-N 3.2Å; Q776-I780 WeakPolarHBondContact O-CD1 3.22Å; Q776-I780 WeakPolarHBondContact O-CG1 3.06Å; Q776-I780 PolarHBondContact O-N 3.4Å
777	C	87.4	Confident	87.7	Confident	37 Å²	37	75.1 Å²	75.1	25%	0.25	37%	0.368	C	S	.	.	H	α-helix	trans	-59.4	-38.3	171.9	-70.4	0	0	0	0	112.3	V773 K774 Q775 N781	V773-C777 PolarHBondContact O-N 2.94Å; V773-C777 VanDerWaalsContact O-N 3.15Å; V773-C777 PolarHBondContact O-SG 2.86Å; K774-C777 WeakPolarHBondContact O-CB 3.44Å; K774-C777 PolarHBondContact O-N 3.12Å; Q775-C777 VanDerWaalsContact C-N 3.34Å; Q775-C777 PolarHBondContact O-N 3.4Å; C777-N781 VanDerWaalsContact O-CG 3.29Å; C777-N781 PolarHBondContact O-ND2 3.45Å; C777-N781 VanDerWaalsContact O-ND2 3.09Å
778	E	88.4	Confident	88	Confident	111 Å²	111	73 Å²	73	52%	0.519	37%	0.366	S	S	.	.	H	α-helix	trans	-69.8	-42.3	177.8	-69.5	170	-174.2	0	0	112.5	K774 Q775 Q776 N781 L782	K774-E778 WeakPolarHBondContact CE-OE1 3.45Å; K774-E778 WeakPolarHBondContact O-CG 3.42Å; K774-E778 PolarHBondContact O-N 2.77Å; K774-E778 VanDerWaalsContact O-N 3.11Å; Q775-E778 WeakPolarHBondContact O-CB 3.45Å; Q775-E778 PolarHBondContact O-N 3.26Å; Q775-E778 VanDerWaalsContact O-N 3.13Å; Q776-E778 VanDerWaalsContact C-N 3.28Å; Q776-E778 PolarHBondContact O-N 3.29Å; E778-N781 PolarHBondContact O-N 3.17Å; E778-L782 PolarHBondContact O-N 2.92Å
779	A	89.1	Confident	88.2	Confident	37 Å²	37	79.5 Å²	79.5	31%	0.306	40%	0.398	S	S	.	.	H	α-helix	trans	-63.4	-44.2	-179.7	0	0	0	0	0	113.2	Q775 Q776 N781 L782 L783	Q775-A779 PolarHBondContact O-N 3.45Å; Q776-A779 PolarHBondContact O-N 3.2Å; A779-N781 VanDerWaalsContact C-N 3.25Å; A779-N781 PolarHBondContact O-N 3.12Å; A779-L782 PolarHBondContact O-N 3.4Å; A779-L782 VanDerWaalsContact O-N 3.12Å; A779-L783 PolarHBondContact O-N 3.16Å; A779-L783 VanDerWaalsContact O-N 3.09Å
780	I	90.4	Very high	88.6	Confident	11 Å²	11	71.5 Å²	71.5	6%	0.056	36%	0.364	C	S	.	.	H	α-helix	trans	-59.4	-40.1	177.6	-68.2	162.1	0	0	0	110.6	C587 E588 R591 Q776 L782 K784	C587-I780 HydrophobicContact CB-CG1 3.76Å; E588-I780 HydrophobicContact CG-CD1 4.03Å; E588-I780 HydrophobicContact CG-CG1 4.3Å; E588-I780 HydrophobicContact CG-CG2 4.29Å; R591-I780 HydrophobicContact CB-CD1 4.15Å; Q776-I780 WeakPolarHBondContact O-CD1 3.22Å; Q776-I780 WeakPolarHBondContact O-CG1 3.06Å; Q776-I780 PolarHBondContact O-N 3.4Å; I780-L782 VanDerWaalsContact C-N 3.35Å; I780-L782 PolarHBondContact O-N 2.98Å; I780-K784 HydrophobicContact CG2-CD 4.11Å; I780-K784 WeakPolarHBondContact O-CB 3.21Å; I780-K784 WeakPolarHBondContact O-CG 3.44Å; I780-K784 PolarHBondContact O-N 3.39Å
781	N	89	Confident	88.6	Confident	112 Å²	112	75 Å²	75	60%	0.599	39%	0.388	S	S	*	.	H	α-helix	trans	-64.6	-38.2	177.4	-69.6	-24.6	0	0	0	112.1	C777 E778 A779 A785	C777-N781 VanDerWaalsContact O-CG 3.29Å; C777-N781 PolarHBondContact O-ND2 3.45Å; C777-N781 VanDerWaalsContact O-ND2 3.09Å; E778-N781 PolarHBondContact O-N 3.17Å; A779-N781 VanDerWaalsContact C-N 3.25Å; A779-N781 PolarHBondContact O-N 3.12Å; N781-A785 PolarHBondContact O-N 2.86Å; N781-A785 VanDerWaalsContact O-N 3.16Å
782	L	91.2	Very high	88.7	Confident	104 Å²	104	70.2 Å²	70.2	55%	0.545	36%	0.362	S	S	.	.	H	α-helix	trans	-68.4	-45.5	178.8	-177	68.4	0	0	0	113	E778 A779 I780 A785 R786	E778-L782 PolarHBondContact O-N 2.92Å; A779-L782 PolarHBondContact O-N 3.4Å; A779-L782 VanDerWaalsContact O-N 3.12Å; I780-L782 VanDerWaalsContact C-N 3.35Å; I780-L782 PolarHBondContact O-N 2.98Å; L782-A785 WeakPolarHBondContact O-CB 3.44Å; L782-A785 PolarHBondContact O-N 2.72Å; L782-R786 PolarHBondContact O-N 2.83Å; L782-R786 VanDerWaalsContact O-N 3.09Å
783	L	91.8	Very high	88.6	Confident	35 Å²	35	66.6 Å²	66.6	18%	0.183	35%	0.354	C	S	.	.	H	α-helix	trans	-64.4	-41.7	179.8	-71.5	172.5	0	0	0	111.7	V584 C587 A779 A785 R786 M787	V584-L783 HydrophobicContact CG2-CB 3.57Å; V584-L783 HydrophobicContact CG2-CD1 4.32Å; C587-L783 HydrophobicContact CB-CD1 4.42Å; C587-L783 VanDerWaalsContact SG-CD1 3.59Å; A779-L783 PolarHBondContact O-N 3.16Å; A779-L783 VanDerWaalsContact O-N 3.09Å; L783-A785 VanDerWaalsContact C-N 3.26Å; L783-A785 PolarHBondContact O-N 3.29Å; L783-R786 PolarHBondContact O-N 2.91Å; L783-R786 VanDerWaalsContact O-N 3.09Å; L783-M787 PolarHBondContact O-N 3.02Å
784	K	90.9	Very high	88.4	Confident	98 Å²	98	75.3 Å²	75.3	43%	0.426	39%	0.392	S	S	.	.	H	α-helix	trans	-61	-36.3	174.3	-72.9	-178.9	179	177.5	0	111.7	V584 E588 I780 A788	V584-K784 HydrophobicContact CG1-CG 4.32Å; V584-K784 HydrophobicContact CG2-CG 4.47Å; E588-K784 WeakPolarHBondContact OE1-CE 3.49Å; E588-K784 IonicContact OE1-NZ 2.67Å; E588-K784 PolarHBondContact OE1-NZ 3.11Å; I780-K784 HydrophobicContact CG2-CD 4.11Å; I780-K784 WeakPolarHBondContact O-CB 3.21Å; I780-K784 WeakPolarHBondContact O-CG 3.44Å; I780-K784 PolarHBondContact O-N 3.39Å; K784-A788 PolarHBondContact O-N 3.34Å
785	A	89.9	Confident	88.4	Confident	45 Å²	45	74 Å²	74	37%	0.372	38%	0.384	S	S	.	.	H	α-helix	trans	-65.1	-38.9	173	0	0	0	0	0	112.8	N781 L782 L783 A788 M789	N781-A785 PolarHBondContact O-N 2.86Å; N781-A785 VanDerWaalsContact O-N 3.16Å; L782-A785 WeakPolarHBondContact O-CB 3.44Å; L782-A785 PolarHBondContact O-N 2.72Å; L783-A785 VanDerWaalsContact C-N 3.26Å; L783-A785 PolarHBondContact O-N 3.29Å; A785-A788 PolarHBondContact O-N 3.02Å; A785-M789 WeakPolarHBondContact O-CG 3.09Å; A785-M789 PolarHBondContact O-N 3.46Å
786	R	89.4	Confident	88.3	Confident	141 Å²	141	73.3 Å²	73.3	53%	0.532	40%	0.4	S	S	.	.	H	α-helix	trans	-66.6	-42	175.7	-75.6	-172	178	178.7	-0.1	113.4	L782 L783 A788 M789	L782-R786 PolarHBondContact O-N 2.83Å; L782-R786 VanDerWaalsContact O-N 3.09Å; L783-R786 PolarHBondContact O-N 2.91Å; L783-R786 VanDerWaalsContact O-N 3.09Å; R786-A788 PolarHBondContact O-N 2.97Å; R786-M789 HydrophobicContact CG-CE 4.27Å; R786-M789 WeakPolarHBondContact O-CB 3.06Å; R786-M789 PolarHBondContact O-N 3.05Å
787	M	90.2	Very high	88.1	Confident	31 Å²	31	74.1 Å²	74.1	15%	0.153	41%	0.405	C	S	.	.	H	α-helix	trans	-58.9	-40.4	175	-74	-179.6	66.7	0	0	111.5	L580 H581 V584 L783 M789 N790 S793	L580-M787 HydrophobicContact CB-CG 3.99Å; H581-M787 HydrophobicContact CB-CE 4.11Å; V584-M787 HydrophobicContact CB-SD 4.23Å; V584-M787 HydrophobicContact CG2-SD 3.47Å; V584-M787 WeakPolarHBondContact CG2-SD 3.35Å; L783-M787 PolarHBondContact O-N 3.02Å; M787-M789 PolarHBondContact O-N 2.87Å; M787-N790 PolarHBondContact O-N 3.28Å; M787-S793 VanDerWaalsContact O-CB 3.25Å; M787-S793 WeakPolarHBondContact O-CB 3.48Å
788	A	88.9	Confident	88.1	Confident	68 Å²	68	72.8 Å²	72.8	56%	0.562	40%	0.395	S	S	*	.	H	α-helix	trans	-65.8	-17.3	176.2	0	0	0	0	0	114.1	K784 A785 R786	K784-A788 PolarHBondContact O-N 3.34Å; A785-A788 PolarHBondContact O-N 3.02Å; R786-A788 PolarHBondContact O-N 2.97Å
789	M	88.4	Confident	87.9	Confident	142 Å²	142	73 Å²	73	70%	0.7	40%	0.4	S	S	*	.	H	α-helix	trans	-85.4	-19.9	175.8	-68	-173.7	-118.2	0	0	113.8	A785 R786 M787	A785-M789 WeakPolarHBondContact O-CG 3.09Å; A785-M789 PolarHBondContact O-N 3.46Å; R786-M789 HydrophobicContact CG-CE 4.27Å; R786-M789 WeakPolarHBondContact O-CB 3.06Å; R786-M789 PolarHBondContact O-N 3.05Å; M787-M789 PolarHBondContact O-N 2.87Å
790	N	86.7	Confident	87.7	Confident	15 Å²	15	73.5 Å²	73.5	8%	0.08	40%	0.401	C	S	.	.	S	Bend	trans	-69.2	131	-178.3	-175.5	-48.6	0	0	0	110.6	Y577 M787 I792 S793	Y577-N790 HydrophobicContact CD2-CB 4Å; M787-N790 PolarHBondContact O-N 3.28Å; N790-I792 PolarHBondContact O-N 3.16Å; N790-I792 WeakPolarHBondContact OD1-CB 3.48Å; N790-I792 PolarHBondContact OD1-N 2.97Å; N790-S793 WeakPolarHBondContact O-CB 3.33Å; N790-S793 PolarHBondContact O-N 3.28Å; N790-S793 PolarHBondContact O-OG 3.43Å
791	P	86	Confident	87.6	Confident	94 Å²	94	73 Å²	73	61%	0.61	40%	0.399	S	S	*	.	G	3₁₀ helix	trans	-56.2	-34.3	-178.5	-26.1	34.4	0	0	0	114.5	S793	P791-S793 PolarHBondContact O-N 2.83Å
792	I	86.8	Confident	87.5	Confident	14 Å²	14	68.6 Å²	68.6	7%	0.072	38%	0.375	C	S	.	.	G	3₁₀ helix	trans	-69.6	-22.6	179.4	-70.1	-174.9	0	0	0	111.9	Q573 L574 Y577 N790 K794 R795 L798	Q573-I792 HydrophobicContact CB-CD1 3.46Å; Q573-I792 VanDerWaalsContact CB-CD1 3.46Å; Q573-I792 HydrophobicContact CB-CG1 4.11Å; L574-I792 HydrophobicContact CB-CD1 4.11Å; Y577-I792 HydrophobicContact CD2-CB 4.44Å; Y577-I792 HydrophobicContact CD2-CG2 4.38Å; Y577-I792 HydrophobicContact CG-CG2 4.3Å; N790-I792 PolarHBondContact O-N 3.16Å; N790-I792 WeakPolarHBondContact OD1-CB 3.48Å; N790-I792 PolarHBondContact OD1-N 2.97Å; I792-K794 PolarHBondContact O-N 3.14Å; I792-R795 WeakPolarHBondContact O-CB 3.4Å; I792-R795 PolarHBondContact O-N 3.34Å; I792-L798 HydrophobicContact CG2-CD1 3.15Å; I792-L798 HydrophobicContact CG2-CD2 3.94Å; I792-L798 HydrophobicContact CG2-CG 4.09Å; I792-L798 WeakPolarHBondContact O-CD2 3.37Å
793	S	86.3	Confident	87.2	Confident	35 Å²	35	68.7 Å²	68.7	25%	0.245	38%	0.376	C	S	.	.	G	3₁₀ helix	trans	-57.5	-17.4	-179.1	69.3	0	0	0	0	114.8	M787 N790 P791	M787-S793 VanDerWaalsContact O-CB 3.25Å; M787-S793 WeakPolarHBondContact O-CB 3.48Å; N790-S793 WeakPolarHBondContact O-CB 3.33Å; N790-S793 PolarHBondContact O-N 3.28Å; N790-S793 PolarHBondContact O-OG 3.43Å; P791-S793 PolarHBondContact O-N 2.83Å
794	K	83.4	Confident	87	Confident	184 Å²	184	71.5 Å²	71.5	80%	0.8	39%	0.385	S	S	*	.	G	3₁₀ helix	trans	-95.3	-4.5	179.1	-60.8	-178.8	-177.7	177.1	0	113.6	I792	I792-K794 PolarHBondContact O-N 3.14Å
795	R	86.1	Confident	86.9	Confident	76 Å²	76	70.1 Å²	70.1	29%	0.287	38%	0.378	S	S	.	.			trans	-73.8	138.1	178.8	-76.3	-170.6	74.2	118.2	-3.8	110.5	D568 I792 D797 L798	D568-R795 IonicContact OD2-CZ 3.54Å; D568-R795 IonicContact OD2-NH1 2.84Å; D568-R795 PolarHBondContact OD2-NH1 2.87Å; D568-R795 IonicContact OD2-NH2 3.9Å; D568-R795 PolarHBondContact OD2-NH2 3.32Å; D568-R795 VanDerWaalsContact OD2-NH2 3.15Å; I792-R795 WeakPolarHBondContact O-CB 3.4Å; I792-R795 PolarHBondContact O-N 3.34Å; R795-D797 WeakPolarHBondContact CB-OD1 3.41Å; R795-D797 IonicContact CZ-OD1 2.78Å; R795-D797 IonicContact CZ-OD2 3.68Å; R795-D797 IonicContact NE-OD1 2.83Å; R795-D797 PolarHBondContact NE-OD1 2.92Å; R795-D797 IonicContact NE-OD2 3.15Å; R795-D797 IonicContact NH2-OD1 3.67Å; R795-D797 PolarHBondContact NH2-OD1 3.42Å; R795-D797 IonicContact NH2-OD2 3.49Å; R795-D797 PolarHBondContact NH2-OD2 2.74Å; R795-L798 HydrophobicContact CB-CB 4.37Å
796	A	85.1	Confident	86.7	Confident	111 Å²	111	71.8 Å²	71.8	92%	0.917	38%	0.381	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.8	-23.7	176.9	0	0	0	0	0	113
797	D	85.1	Confident	86.6	Confident	55 Å²	55	71.4 Å²	71.4	29%	0.294	38%	0.38	S	S	.	.	T	Hydrogen-bonded Turn	trans	-98.3	11.3	-176.9	64.6	-26.7	0	0	0	113.6	R795 D799 S800 L801	R795-D797 WeakPolarHBondContact CB-OD1 3.41Å; R795-D797 IonicContact CZ-OD1 2.78Å; R795-D797 IonicContact CZ-OD2 3.68Å; R795-D797 IonicContact NE-OD1 2.83Å; R795-D797 PolarHBondContact NE-OD1 2.92Å; R795-D797 IonicContact NE-OD2 3.15Å; R795-D797 IonicContact NH2-OD1 3.67Å; R795-D797 PolarHBondContact NH2-OD1 3.42Å; R795-D797 IonicContact NH2-OD2 3.49Å; R795-D797 PolarHBondContact NH2-OD2 2.74Å; D797-D799 PolarHBondContact O-N 2.89Å; D797-S800 PolarHBondContact O-N 3.46Å; D797-L801 WeakPolarHBondContact O-CG 3.31Å; D797-L801 PolarHBondContact O-N 3.08Å; D797-L801 VanDerWaalsContact O-N 3.16Å; D797-L801 WeakPolarHBondContact OD2-CD1 3.34Å
798	L	86.1	Confident	86.5	Confident	9 Å²	9	73.1 Å²	73.1	5%	0.047	39%	0.387	C	S	.	.	H	α-helix	trans	-56.3	-49.8	-172	-179.3	45.1	0	0	0	112.9	L574 Y577 I792 R795 S800 L801 I802	L574-L798 HydrophobicContact CD1-CD1 4.26Å; Y577-L798 HydrophobicContact CD1-CD1 3.82Å; Y577-L798 HydrophobicContact CD1-CD2 3.93Å; Y577-L798 HydrophobicContact CD1-CG 4.17Å; Y577-L798 HydrophobicContact CD2-CD2 4.2Å; Y577-L798 HydrophobicContact CE1-CD1 4.02Å; Y577-L798 HydrophobicContact CE1-CD2 3.36Å; Y577-L798 HydrophobicContact CE1-CG 3.83Å; Y577-L798 HydrophobicContact CE2-CD2 3.68Å; Y577-L798 HydrophobicContact CG-CD1 4.28Å; Y577-L798 HydrophobicContact CG-CD2 4.32Å; Y577-L798 WeakPolarHBondContact OH-CD2 3.28Å; I792-L798 HydrophobicContact CG2-CD1 3.15Å; I792-L798 HydrophobicContact CG2-CD2 3.94Å; I792-L798 HydrophobicContact CG2-CG 4.09Å; I792-L798 WeakPolarHBondContact O-CD2 3.37Å; R795-L798 HydrophobicContact CB-CB 4.37Å; L798-S800 VanDerWaalsContact C-N 3.31Å; L798-S800 PolarHBondContact O-N 3.24Å; L798-L801 WeakPolarHBondContact O-CB 3.34Å; L798-L801 PolarHBondContact O-N 2.82Å; L798-L801 VanDerWaalsContact O-N 3.11Å; L798-I802 HydrophobicContact CD1-CD1 3.83Å; L798-I802 HydrophobicContact CD1-CG1 3.96Å; L798-I802 HydrophobicContact CG-CD1 3.97Å; L798-I802 VanDerWaalsContact O-CG1 3.31Å; L798-I802 WeakPolarHBondContact O-CG1 3.49Å; L798-I802 PolarHBondContact O-N 3.41Å
799	D	84.7	Confident	86.4	Confident	115 Å²	115	71.6 Å²	71.6	62%	0.615	37%	0.374	S	S	*	.	H	α-helix	trans	-58.8	-43.2	-178.4	-60.9	-29.2	0	0	0	111.5	D797 L801 I802 D803	D797-D799 PolarHBondContact O-N 2.89Å; D799-L801 VanDerWaalsContact C-N 3.32Å; D799-L801 PolarHBondContact O-N 3.22Å; D799-I802 WeakPolarHBondContact O-CB 3.23Å; D799-I802 PolarHBondContact O-N 2.87Å; D799-D803 VanDerWaalsContact O-CG 3.28Å; D799-D803 PolarHBondContact O-N 3.33Å
800	S	86.1	Confident	86.3	Confident	48 Å²	48	67.2 Å²	67.2	34%	0.336	36%	0.357	S	S	.	.	H	α-helix	trans	-64.2	-34.6	178	-173.1	0	0	0	0	113.3	D797 L798 R804	D797-S800 PolarHBondContact O-N 3.46Å; L798-S800 VanDerWaalsContact C-N 3.31Å; L798-S800 PolarHBondContact O-N 3.24Å; S800-R804 WeakPolarHBondContact O-CG 3.31Å; S800-R804 PolarHBondContact O-N 2.87Å; S800-R804 PolarHBondContact OG-NE 2.78Å; S800-R804 PolarHBondContact OG-NH2 3.32Å
801	L	87.7	Confident	86.3	Confident	0 Å²	0	67 Å²	67	0%	0	36%	0.356	C	S	.	.	H	α-helix	trans	-71.6	-40.3	178	-70.9	166.1	0	0	0	111.5	P566 I569 L574 D797 L798 D799 D803 F805	P566-L801 HydrophobicContact CG-CD2 4.04Å; I569-L801 HydrophobicContact CD1-CB 4.26Å; I569-L801 HydrophobicContact CD1-CD1 3.42Å; I569-L801 VanDerWaalsContact CD1-CD1 3.42Å; I569-L801 HydrophobicContact CD1-CD2 3.57Å; I569-L801 HydrophobicContact CD1-CG 3.92Å; L574-L801 HydrophobicContact CD1-CB 3.97Å; L574-L801 HydrophobicContact CD2-CB 4.17Å; D797-L801 WeakPolarHBondContact O-CG 3.31Å; D797-L801 PolarHBondContact O-N 3.08Å; D797-L801 VanDerWaalsContact O-N 3.16Å; D797-L801 WeakPolarHBondContact OD2-CD1 3.34Å; L798-L801 WeakPolarHBondContact O-CB 3.34Å; L798-L801 PolarHBondContact O-N 2.82Å; L798-L801 VanDerWaalsContact O-N 3.11Å; D799-L801 VanDerWaalsContact C-N 3.32Å; D799-L801 PolarHBondContact O-N 3.22Å; L801-D803 VanDerWaalsContact C-N 3.31Å; L801-F805 WeakPolarHBondContact O-CB 3.39Å; L801-F805 PolarHBondContact O-N 3.43Å
802	I	87	Confident	86.4	Confident	20 Å²	20	66.2 Å²	66.2	10%	0.103	35%	0.346	C	S	.	.	H	α-helix	trans	-59.1	-46.5	173.3	-64.2	174.1	0	0	0	109.5	L574 Y577 V578 L798 D799 F805 N806	L574-I802 HydrophobicContact CD1-CG1 4.2Å; Y577-I802 HydrophobicContact CD1-CD1 3.77Å; Y577-I802 HydrophobicContact CE1-CD1 3.77Å; V578-I802 HydrophobicContact CG2-CB 4.23Å; V578-I802 HydrophobicContact CG2-CD1 4.39Å; V578-I802 HydrophobicContact CG2-CG1 3.73Å; V578-I802 HydrophobicContact CG2-CG2 3.95Å; L798-I802 HydrophobicContact CD1-CD1 3.83Å; L798-I802 HydrophobicContact CD1-CG1 3.96Å; L798-I802 HydrophobicContact CG-CD1 3.97Å; L798-I802 VanDerWaalsContact O-CG1 3.31Å; L798-I802 WeakPolarHBondContact O-CG1 3.49Å; L798-I802 PolarHBondContact O-N 3.41Å; D799-I802 WeakPolarHBondContact O-CB 3.23Å; D799-I802 PolarHBondContact O-N 2.87Å; I802-F805 PolarHBondContact O-N 3.15Å; I802-N806 WeakPolarHBondContact O-CB 3.35Å; I802-N806 VanDerWaalsContact O-CG 3.23Å; I802-N806 PolarHBondContact O-N 2.91Å; I802-N806 VanDerWaalsContact O-N 3.07Å; I802-N806 PolarHBondContact O-ND2 3.17Å; I802-N806 VanDerWaalsContact O-ND2 3.12Å
803	D	85.2	Confident	86.5	Confident	106 Å²	106	73.7 Å²	73.7	57%	0.567	37%	0.373	S	S	*	.	H	α-helix	trans	-63	-47.7	-179.9	-68.5	-22	0	0	0	113	D799 L801 F805 N806 W807	D799-D803 VanDerWaalsContact O-CG 3.28Å; D799-D803 PolarHBondContact O-N 3.33Å; L801-D803 VanDerWaalsContact C-N 3.31Å; D803-F805 VanDerWaalsContact C-N 3.34Å; D803-F805 PolarHBondContact O-N 3.12Å; D803-N806 PolarHBondContact O-N 2.79Å; D803-W807 WeakPolarHBondContact O-CB 3.48Å; D803-W807 PolarHBondContact O-N 2.87Å
804	R	87.6	Confident	86.5	Confident	95 Å²	95	76.9 Å²	76.9	36%	0.358	38%	0.383	S	S	.	.	H	α-helix	trans	-63.2	-40.4	178.7	-76.9	-177.5	-125.9	176.4	1.7	112.6	F565 S800 N806 W807 K808	F565-R804 HydrophobicContact CE1-CB 4.21Å; S800-R804 WeakPolarHBondContact O-CG 3.31Å; S800-R804 PolarHBondContact O-N 2.87Å; S800-R804 PolarHBondContact OG-NE 2.78Å; S800-R804 PolarHBondContact OG-NH2 3.32Å; R804-N806 VanDerWaalsContact C-N 3.34Å; R804-W807 PolarHBondContact O-N 2.91Å; R804-K808 PolarHBondContact O-N 3.15Å
805	F	88.1	Confident	86.9	Confident	68 Å²	68	69 Å²	69	30%	0.298	35%	0.35	S	S	.	.	H	α-helix	trans	-60.1	-48	177.2	-172.1	-84.6	0	0	0	110.8	F565 M571 L574 L801 I802 D803 W807 A809	F565-F805 HydrophobicContact CE1-CB 4.14Å; F565-F805 HydrophobicContact CE1-CD2 4.29Å; F565-F805 HydrophobicContact CZ-CB 4.42Å; F565-F805 HydrophobicContact CZ-CD2 4.27Å; M571-F805 HydrophobicContact CE-CD2 3.62Å; M571-F805 HydrophobicContact CE-CE2 3.65Å; L574-F805 HydrophobicContact CD2-CB 4.15Å; L574-F805 HydrophobicContact CD2-CD2 4.09Å; L574-F805 HydrophobicContact CD2-CG 4.39Å; L801-F805 WeakPolarHBondContact O-CB 3.39Å; L801-F805 PolarHBondContact O-N 3.43Å; I802-F805 PolarHBondContact O-N 3.15Å; D803-F805 VanDerWaalsContact C-N 3.34Å; D803-F805 PolarHBondContact O-N 3.12Å; F805-W807 VanDerWaalsContact C-N 3.32Å; F805-W807 PolarHBondContact O-N 3.13Å; F805-A809 PolarHBondContact O-N 3.45Å
806	N	86.5	Confident	87.1	Confident	80 Å²	80	71.7 Å²	71.7	43%	0.428	37%	0.365	S	S	.	.	H	α-helix	trans	-62.6	-38.2	176.9	-68.8	-27.3	0	0	0	112	I802 D803 R804 S810	I802-N806 WeakPolarHBondContact O-CB 3.35Å; I802-N806 VanDerWaalsContact O-CG 3.23Å; I802-N806 PolarHBondContact O-N 2.91Å; I802-N806 VanDerWaalsContact O-N 3.07Å; I802-N806 PolarHBondContact O-ND2 3.17Å; I802-N806 VanDerWaalsContact O-ND2 3.12Å; D803-N806 PolarHBondContact O-N 2.79Å; R804-N806 VanDerWaalsContact C-N 3.34Å; N806-S810 PolarHBondContact O-N 3.22Å; N806-S810 VanDerWaalsContact O-N 3.08Å
807	W	85.7	Confident	87.2	Confident	134 Å²	134	70.8 Å²	70.8	51%	0.508	35%	0.345	S	S	.	.	H	α-helix	trans	-67.9	-43.9	-179.3	-173.4	53.6	0	0	0	113.9	L559 I563 D803 R804 F805 S810 N811	L559-W807 HydrophobicContact CD2-CZ2 4.19Å; I563-W807 HydrophobicContact CD1-CD2 4.15Å; I563-W807 HydrophobicContact CD1-CE3 3.77Å; I563-W807 HydrophobicContact CD1-CH2 4.24Å; I563-W807 HydrophobicContact CD1-CZ3 3.82Å; I563-W807 HydrophobicContact CG1-CE3 4.04Å; I563-W807 HydrophobicContact CG1-CH2 4.16Å; I563-W807 HydrophobicContact CG1-CZ3 3.66Å; I563-W807 HydrophobicContact CG2-CE3 4.17Å; I563-W807 HydrophobicContact CG2-CZ3 4.29Å; D803-W807 WeakPolarHBondContact O-CB 3.48Å; D803-W807 PolarHBondContact O-N 2.87Å; R804-W807 PolarHBondContact O-N 2.91Å; F805-W807 VanDerWaalsContact C-N 3.32Å; F805-W807 PolarHBondContact O-N 3.13Å; W807-S810 PolarHBondContact O-N 2.95Å; W807-N811 PolarHBondContact NE1-ND2 3.1Å; W807-N811 PolarHBondContact O-N 2.72Å; W807-N811 PolarHBondContact O-ND2 3.5Å
808	K	89	Confident	87.4	Confident	67 Å²	67	68.5 Å²	68.5	29%	0.291	33%	0.333	S	S	.	.	H	α-helix	trans	-62.8	-44.6	176.7	-169.1	172.9	-175.7	161	0	111.5	I563 F565 R804 S810 N811 L812	I563-K808 HydrophobicContact CB-CD 4.4Å; I563-K808 HydrophobicContact CB-CG 4.4Å; I563-K808 HydrophobicContact CD1-CB 4.25Å; I563-K808 HydrophobicContact CD1-CG 4.26Å; I563-K808 HydrophobicContact CG2-CB 3.98Å; I563-K808 HydrophobicContact CG2-CD 4.12Å; I563-K808 HydrophobicContact CG2-CG 4.18Å; I563-K808 PolarHBondContact O-NZ 2.98Å; F565-K808 HydrophobicContact CE2-CD 3.68Å; F565-K808 HydrophobicContact CZ-CB 4.5Å; F565-K808 HydrophobicContact CZ-CD 4.29Å; R804-K808 PolarHBondContact O-N 3.15Å; K808-S810 VanDerWaalsContact C-N 3.27Å; K808-S810 PolarHBondContact O-N 3.4Å; K808-N811 PolarHBondContact O-N 3.43Å; K808-L812 HydrophobicContact CG-CD1 4.4Å; K808-L812 PolarHBondContact O-N 3.18Å
809	A	86.2	Confident	87.6	Confident	35 Å²	35	74.3 Å²	74.3	29%	0.289	35%	0.354	S	S	.	.	H	α-helix	trans	-60.9	-37	177.9	0	0	0	0	0	112.1	F805 R813	F805-A809 PolarHBondContact O-N 3.45Å; A809-R813 WeakPolarHBondContact O-CG 3.32Å
810	S	86.7	Confident	87.7	Confident	51 Å²	51	72.5 Å²	72.5	36%	0.357	34%	0.342	S	S	.	.	H	α-helix	trans	-64.1	-43.8	176.9	-175	0	0	0	0	113.2	N806 W807 K808 K814	N806-S810 PolarHBondContact O-N 3.22Å; N806-S810 VanDerWaalsContact O-N 3.08Å; W807-S810 PolarHBondContact O-N 2.95Å; K808-S810 VanDerWaalsContact C-N 3.27Å; K808-S810 PolarHBondContact O-N 3.4Å; S810-K814 WeakPolarHBondContact O-CG 3.49Å; S810-K814 PolarHBondContact O-N 3.41Å
811	N	87.4	Confident	87.7	Confident	10 Å²	10	75.7 Å²	75.7	5%	0.053	35%	0.347	C	S	.	.	H	α-helix	trans	-74.8	-35.4	-174.9	-73.8	-72.4	0	0	0	114	L559 I560 W807 K808 R813 K814 L815	L559-N811 HydrophobicContact CD2-CB 4.22Å; I560-N811 HydrophobicContact CD1-CB 4.41Å; I560-N811 HydrophobicContact CG1-CB 3.86Å; W807-N811 PolarHBondContact NE1-ND2 3.1Å; W807-N811 PolarHBondContact O-N 2.72Å; W807-N811 PolarHBondContact O-ND2 3.5Å; K808-N811 PolarHBondContact O-N 3.43Å; N811-R813 VanDerWaalsContact C-N 3.3Å; N811-R813 PolarHBondContact O-N 2.94Å; N811-K814 PolarHBondContact O-N 2.91Å; N811-L815 PolarHBondContact O-N 2.89Å
812	L	88.7	Confident	87.7	Confident	77 Å²	77	77 Å²	77	40%	0.403	35%	0.354	S	S	.	.	H	α-helix	trans	-60.3	-41.7	175	-79.6	165.4	0	0	0	111.7	I560 K808 K814 L815 E816	I560-L812 HydrophobicContact CD1-CD2 4.19Å; I560-L812 HydrophobicContact CG2-CD2 3.85Å; I560-L812 HydrophobicContact CG2-CG 4.31Å; K808-L812 HydrophobicContact CG-CD1 4.4Å; K808-L812 PolarHBondContact O-N 3.18Å; L812-K814 PolarHBondContact O-N 3.37Å; L812-L815 PolarHBondContact O-N 3.31Å; L812-E816 PolarHBondContact O-N 2.92Å
813	R	88.4	Confident	87.5	Confident	171 Å²	171	80 Å²	80	65%	0.645	38%	0.376	S	S	*	.	H	α-helix	trans	-58.7	-47	174.6	-68.3	175.1	-175.3	170.2	1.9	111.8	A809 N811 L815 E816 D817	A809-R813 WeakPolarHBondContact O-CG 3.32Å; N811-R813 VanDerWaalsContact C-N 3.3Å; N811-R813 PolarHBondContact O-N 2.94Å; R813-L815 VanDerWaalsContact C-N 3.28Å; R813-L815 PolarHBondContact O-N 3.23Å; R813-E816 PolarHBondContact O-N 3.32Å; R813-D817 VanDerWaalsContact O-CG 3.23Å; R813-D817 PolarHBondContact O-N 3.08Å; R813-D817 VanDerWaalsContact O-N 3.1Å
814	K	86.7	Confident	87.3	Confident	103 Å²	103	80.9 Å²	80.9	45%	0.448	37%	0.371	S	S	.	.	H	α-helix	trans	-58	-37.2	178.4	-67.7	175.4	-173.9	176.1	0	113.5	S810 N811 L812 I818	S810-K814 WeakPolarHBondContact O-CG 3.49Å; S810-K814 PolarHBondContact O-N 3.41Å; N811-K814 PolarHBondContact O-N 2.91Å; L812-K814 PolarHBondContact O-N 3.37Å; K814-I818 WeakPolarHBondContact O-CG1 3.31Å; K814-I818 PolarHBondContact O-N 3.12Å
815	L	91.2	Very high	86.8	Confident	19 Å²	19	77 Å²	77	10%	0.099	36%	0.358	C	S	.	.	H	α-helix	trans	-69.3	-41.1	-178.8	-179.3	150.8	0	0	0	111.7	T556 E557 I560 N811 L812 R813 D817 I818 R819	T556-L815 HydrophobicContact CG2-CB 4Å; T556-L815 HydrophobicContact CG2-CD1 4.5Å; E557-L815 HydrophobicContact CB-CD1 4.39Å; E557-L815 HydrophobicContact CG-CD1 3.55Å; I560-L815 HydrophobicContact CD1-CB 3.79Å; I560-L815 HydrophobicContact CD1-CD1 3.52Å; I560-L815 HydrophobicContact CD1-CG 4.3Å; N811-L815 PolarHBondContact O-N 2.89Å; L812-L815 PolarHBondContact O-N 3.31Å; R813-L815 VanDerWaalsContact C-N 3.28Å; R813-L815 PolarHBondContact O-N 3.23Å; L815-D817 VanDerWaalsContact C-N 3.34Å; L815-I818 PolarHBondContact O-N 3.49Å; L815-R819 PolarHBondContact O-N 3.01Å
816	E	89.4	Confident	86	Confident	132 Å²	132	77.2 Å²	77.2	62%	0.617	36%	0.363	S	S	*	.	H	α-helix	trans	-61.7	-44.6	174.9	-69.3	175.1	168.4	0	0	110.5	L812 R813 I818 R819 E820	L812-E816 PolarHBondContact O-N 2.92Å; R813-E816 PolarHBondContact O-N 3.32Å; E816-I818 VanDerWaalsContact C-N 3.34Å; E816-I818 PolarHBondContact O-N 2.91Å; E816-R819 PolarHBondContact O-N 3.42Å; E816-E820 PolarHBondContact O-N 3.09Å
817	D	87.8	Confident	85.7	Confident	91 Å²	91	76.6 Å²	76.6	49%	0.487	37%	0.365	S	S	.	.	H	α-helix	trans	-57.3	-42.6	177	-61.7	-25.3	0	0	0	112.7	R813 L815 R821	R813-D817 VanDerWaalsContact O-CG 3.23Å; R813-D817 PolarHBondContact O-N 3.08Å; R813-D817 VanDerWaalsContact O-N 3.1Å; L815-D817 VanDerWaalsContact C-N 3.34Å; D817-R821 PolarHBondContact O-N 3.37Å; D817-R821 VanDerWaalsContact O-N 3.08Å
818	I	88.8	Confident	85.4	Confident	8 Å²	8	72.4 Å²	72.4	4%	0.041	35%	0.352	C	S	.	.	H	α-helix	trans	-67.5	-45.5	-179.4	-66.6	164.4	0	0	0	111.1	R552 L553 K814 L815 E816 E820 R821 I822	R552-I818 HydrophobicContact CB-CD1 4.3Å; L553-I818 HydrophobicContact CB-CG2 3.94Å; L553-I818 HydrophobicContact CD1-CG2 4.04Å; K814-I818 WeakPolarHBondContact O-CG1 3.31Å; K814-I818 PolarHBondContact O-N 3.12Å; L815-I818 PolarHBondContact O-N 3.49Å; E816-I818 VanDerWaalsContact C-N 3.34Å; E816-I818 PolarHBondContact O-N 2.91Å; I818-E820 VanDerWaalsContact C-N 3.27Å; I818-E820 PolarHBondContact O-N 3.25Å; I818-R821 PolarHBondContact O-N 3.42Å; I818-I822 HydrophobicContact CG2-CD1 4.27Å; I818-I822 PolarHBondContact O-N 3.24Å; I818-I822 VanDerWaalsContact O-N 3.11Å
819	R	90.3	Very high	84.8	Confident	130 Å²	130	70.4 Å²	70.4	49%	0.491	35%	0.346	S	S	.	.	H	α-helix	trans	-61.9	-39.6	179.1	-74.8	-178.4	173.7	171.1	-2.3	111.3	L553 E557 L815 E816 I822 S823	L553-R819 HydrophobicContact CD1-CG 3.42Å; L553-R819 VanDerWaalsContact CD1-CG 3.42Å; E557-R819 IonicContact OE1-CZ 3.6Å; E557-R819 IonicContact OE1-NE 3.49Å; E557-R819 IonicContact OE1-NH2 3.14Å; E557-R819 PolarHBondContact OE1-NH2 2.94Å; L815-R819 PolarHBondContact O-N 3.01Å; E816-R819 PolarHBondContact O-N 3.42Å; R819-I822 PolarHBondContact O-N 2.83Å; R819-S823 PolarHBondContact O-N 2.86Å; R819-S823 VanDerWaalsContact O-N 3.14Å
820	E	87.7	Confident	84.8	Confident	78 Å²	78	70.8 Å²	70.8	36%	0.364	34%	0.342	S	S	.	.	H	α-helix	trans	-63.3	-44.1	176.1	-161.1	-175.1	174.8	0	0	111.6	E816 I818 I822 S823 R824 L946	E816-E820 PolarHBondContact O-N 3.09Å; I818-E820 VanDerWaalsContact C-N 3.27Å; I818-E820 PolarHBondContact O-N 3.25Å; E820-I822 PolarHBondContact O-N 3.19Å; E820-S823 PolarHBondContact O-N 3.4Å; E820-R824 WeakPolarHBondContact O-CG 3.46Å; E820-R824 PolarHBondContact O-N 3.42Å; E820-R824 IonicContact OE1-CZ 3.03Å; E820-R824 IonicContact OE1-NE 2.67Å; E820-R824 PolarHBondContact OE1-NE 2.88Å; E820-R824 IonicContact OE1-NH2 3.58Å; E820-R824 PolarHBondContact OE1-NH2 3.45Å; E820-R824 IonicContact OE2-NH2 2.71Å; E820-R824 PolarHBondContact OE2-NH2 2.98Å; E820-L946 VanDerWaalsContact OE1-CD2 3.29Å; E820-L946 WeakPolarHBondContact OE1-CD2 3.38Å
821	R	85.4	Confident	84.8	Confident	115 Å²	115	72.4 Å²	72.4	43%	0.434	34%	0.343	S	S	.	.	H	α-helix	trans	-59.6	-43.3	176.2	-78.4	-177.8	77.1	164.3	1.8	113.3	E545 L549 D817 I818 R824 T825	E545-R821 IonicContact OE2-NH2 3.86Å; E545-R821 PolarHBondContact OE2-NH2 3.12Å; L549-R821 HydrophobicContact CD1-CB 4.21Å; D817-R821 PolarHBondContact O-N 3.37Å; D817-R821 VanDerWaalsContact O-N 3.08Å; I818-R821 PolarHBondContact O-N 3.42Å; R821-R824 PolarHBondContact O-N 3.45Å; R821-T825 PolarHBondContact O-N 2.71Å; R821-T825 VanDerWaalsContact O-N 3.08Å; R821-T825 PolarHBondContact O-OG1 2.82Å
822	I	87.4	Confident	84.9	Confident	28 Å²	28	78.2 Å²	78.2	14%	0.144	37%	0.374	C	S	.	.	H	α-helix	trans	-62	-46.3	177.5	-67.6	171.6	0	0	0	110.2	L549 L553 I818 R819 E820 R824 T825 D826	L549-I822 HydrophobicContact CB-CD1 4.11Å; L549-I822 HydrophobicContact CB-CG1 3.66Å; L549-I822 HydrophobicContact CD1-CG1 4.2Å; L553-I822 HydrophobicContact CB-CD1 4.17Å; L553-I822 HydrophobicContact CD2-CD1 4.02Å; I818-I822 HydrophobicContact CG2-CD1 4.27Å; I818-I822 PolarHBondContact O-N 3.24Å; I818-I822 VanDerWaalsContact O-N 3.11Å; R819-I822 PolarHBondContact O-N 2.83Å; E820-I822 PolarHBondContact O-N 3.19Å; I822-R824 VanDerWaalsContact C-N 3.27Å; I822-R824 PolarHBondContact O-N 3.44Å; I822-T825 WeakPolarHBondContact O-CB 3.44Å; I822-T825 PolarHBondContact O-N 2.81Å; I822-D826 PolarHBondContact O-N 3.04Å
823	S	84.2	Confident	85	Confident	82 Å²	82	77.1 Å²	77.1	57%	0.573	37%	0.367	S	S	*	.	H	α-helix	trans	-59.9	-37.6	178	-171.5	0	0	0	0	112.7	R819 E820 T825 S827	R819-S823 PolarHBondContact O-N 2.86Å; R819-S823 VanDerWaalsContact O-N 3.14Å; E820-S823 PolarHBondContact O-N 3.4Å; S823-T825 VanDerWaalsContact C-N 3.3Å; S823-S827 PolarHBondContact O-N 2.77Å
824	R	80.4	Confident	85.2	Confident	125 Å²	125	69.1 Å²	69.1	47%	0.472	34%	0.336	S	S	.	.	H	α-helix	trans	-68.8	-27.6	175.5	-69.8	177.4	-170.5	176.9	4.8	112.9	E820 R821 I822 S827	E820-R824 WeakPolarHBondContact O-CG 3.46Å; E820-R824 PolarHBondContact O-N 3.42Å; E820-R824 IonicContact OE1-CZ 3.03Å; E820-R824 IonicContact OE1-NE 2.67Å; E820-R824 PolarHBondContact OE1-NE 2.88Å; E820-R824 IonicContact OE1-NH2 3.58Å; E820-R824 PolarHBondContact OE1-NH2 3.45Å; E820-R824 IonicContact OE2-NH2 2.71Å; E820-R824 PolarHBondContact OE2-NH2 2.98Å; R821-R824 PolarHBondContact O-N 3.45Å; I822-R824 VanDerWaalsContact C-N 3.27Å; I822-R824 PolarHBondContact O-N 3.44Å; R824-S827 WeakPolarHBondContact CA-OG 3.23Å; R824-S827 PolarHBondContact O-OG 3.47Å
825	T	78.2	Confident	85.4	Confident	13 Å²	13	71.7 Å²	71.7	8%	0.08	34%	0.343	C	S	.	.	H	α-helix	trans	-77.4	-33.6	-179.4	-51.1	0	0	0	0	112.1	C542 L546 R821 I822 S823	C542-T825 HydrophobicContact CB-CG2 4.43Å; C542-T825 WeakPolarHBondContact O-CG2 3.26Å; L546-T825 HydrophobicContact CD1-CG2 4.14Å; L546-T825 HydrophobicContact CD2-CG2 3.45Å; L546-T825 VanDerWaalsContact CD2-CG2 3.45Å; L546-T825 HydrophobicContact CG-CG2 3.49Å; L546-T825 VanDerWaalsContact CG-CG2 3.49Å; R821-T825 PolarHBondContact O-N 2.71Å; R821-T825 VanDerWaalsContact O-N 3.08Å; R821-T825 PolarHBondContact O-OG1 2.82Å; I822-T825 WeakPolarHBondContact O-CB 3.44Å; I822-T825 PolarHBondContact O-N 2.81Å; S823-T825 VanDerWaalsContact C-N 3.3Å
826	D	71.2	Confident	85.5	Confident	73 Å²	73	71.2 Å²	71.2	39%	0.39	34%	0.342	S	S	.	.	H	α-helix	trans	-73	-29.2	174.9	-88.9	-11.7	0	0	0	112.7	L39 I822	L39-D826 WeakPolarHBondContact CD2-OD2 3.38Å; I822-D826 PolarHBondContact O-N 3.04Å
827	S	78.7	Confident	85.8	Confident	67 Å²	67	65.8 Å²	65.8	47%	0.469	32%	0.316	S	S	.	.	S	Bend	trans	-67.2	133.4	173.1	55.8	0	0	0	0	110.8	S823 R824 S829	S823-S827 PolarHBondContact O-N 2.77Å; R824-S827 WeakPolarHBondContact CA-OG 3.23Å; R824-S827 PolarHBondContact O-OG 3.47Å; S827-S829 PolarHBondContact O-N 3.09Å
828	L	79.3	Confident	86.1	Confident	46 Å²	46	62.1 Å²	62.1	24%	0.241	30%	0.296	C	S	.	.	P	Polyproline II helix	trans	-65.5	117.6	172.8	-73.6	173.9	0	0	0	109.1	V534 Q539 F831	V534-L828 HydrophobicContact CG2-CD1 4.17Å; V534-L828 HydrophobicContact CG2-CD2 3.82Å; Q539-L828 HydrophobicContact CG-CD2 4.22Å; L828-F831 HydrophobicContact CB-CB 3.78Å; L828-F831 HydrophobicContact CB-CD2 4.36Å; L828-F831 HydrophobicContact CB-CG 4.31Å; L828-F831 HydrophobicContact CD1-CD2 4.01Å; L828-F831 HydrophobicContact CD1-CE2 4.48Å; L828-F831 VanDerWaalsContact O-CB 3.23Å; L828-F831 WeakPolarHBondContact O-CB 3.45Å; L828-F831 PolarHBondContact O-N 3.32Å; L828-F831 VanDerWaalsContact O-N 3.16Å
829	S	77.9	Confident	86.4	Confident	25 Å²	25	67.7 Å²	67.7	18%	0.175	32%	0.316	C	S	.	.	T	Hydrogen-bonded Turn	trans	-51.9	140.8	169.6	58.8	0	0	0	0	109.6	Q539 S827 F831	Q539-S829 PolarHBondContact OE1-OG 3.11Å; S827-S829 PolarHBondContact O-N 3.09Å; S829-F831 PolarHBondContact O-N 2.98Å
830	H	84.5	Confident	86.6	Confident	42 Å²	42	61.6 Å²	61.6	19%	0.194	29%	0.293	C	S	.	.	T	Hydrogen-bonded Turn	trans	61.6	7.5	-178	-52.9	-82.5	0	0	0	116.5	L513 L533 Q538 E833 L834	L513-H830 HydrophobicContact CD1-CB 3.78Å; L513-H830 HydrophobicContact CG-CB 4.24Å; L533-H830 HydrophobicContact CD2-CB 3.91Å; Q538-H830 PolarHBondContact OE1-NE2 3.08Å; H830-E833 HydrophobicContact CB-CB 4.47Å; H830-E833 IonicContact CE1-OE2 3.89Å; H830-E833 IonicContact CG-OE2 2.62Å; H830-E833 IonicContact ND1-OE2 2.81Å; H830-E833 PolarHBondContact ND1-OE2 3.29Å; H830-E833 WeakPolarHBondContact O-CB 3.32Å; H830-E833 PolarHBondContact O-N 2.87Å; H830-L834 WeakPolarHBondContact O-CB 3.43Å; H830-L834 PolarHBondContact O-N 2.83Å
831	F	88.1	Confident	87	Confident	86 Å²	86	57.9 Å²	57.9	38%	0.377	28%	0.276	S	S	.	.	H	α-helix	trans	-67.6	-40.5	-178.6	-170.3	-100.6	0	0	0	113.2	E530 L828 S829 E833 L834 R835	E530-F831 HydrophobicContact CG-CE2 4.35Å; L828-F831 HydrophobicContact CB-CB 3.78Å; L828-F831 HydrophobicContact CB-CD2 4.36Å; L828-F831 HydrophobicContact CB-CG 4.31Å; L828-F831 HydrophobicContact CD1-CD2 4.01Å; L828-F831 HydrophobicContact CD1-CE2 4.48Å; L828-F831 VanDerWaalsContact O-CB 3.23Å; L828-F831 WeakPolarHBondContact O-CB 3.45Å; L828-F831 PolarHBondContact O-N 3.32Å; L828-F831 VanDerWaalsContact O-N 3.16Å; S829-F831 PolarHBondContact O-N 2.98Å; F831-E833 VanDerWaalsContact C-N 3.32Å; F831-L834 PolarHBondContact O-N 3.38Å; F831-R835 PolarHBondContact O-N 3.46Å
832	D	88.2	Confident	87.5	Confident	132 Å²	132	55.6 Å²	55.6	71%	0.706	27%	0.267	S	S	*	.	H	α-helix	trans	-64.9	-38.7	173.9	-71.7	-34.3	0	0	0	111.4	R835 A836	D832-R835 PolarHBondContact O-N 3.41Å; D832-A836 WeakPolarHBondContact O-CB 3.48Å; D832-A836 PolarHBondContact O-N 2.97Å
833	E	90.6	Very high	87.8	Confident	54 Å²	54	60.2 Å²	60.2	25%	0.252	28%	0.283	S	S	.	.	H	α-helix	trans	-63.7	-45.3	174	-171.6	-172.1	168.4	0	0	111.4	L513 H830 F831 R835 A836 R837	L513-E833 HydrophobicContact CD1-CB 4.44Å; L513-E833 HydrophobicContact CD1-CG 4.45Å; H830-E833 HydrophobicContact CB-CB 4.47Å; H830-E833 IonicContact CE1-OE2 3.89Å; H830-E833 IonicContact CG-OE2 2.62Å; H830-E833 IonicContact ND1-OE2 2.81Å; H830-E833 PolarHBondContact ND1-OE2 3.29Å; H830-E833 WeakPolarHBondContact O-CB 3.32Å; H830-E833 PolarHBondContact O-N 2.87Å; F831-E833 VanDerWaalsContact C-N 3.32Å; E833-R835 VanDerWaalsContact C-N 3.31Å; E833-R835 PolarHBondContact O-N 3.3Å; E833-A836 WeakPolarHBondContact O-CB 3.33Å; E833-A836 PolarHBondContact O-N 2.93Å; E833-R837 HydrophobicContact CG-CG 4.49Å; E833-R837 WeakPolarHBondContact O-CB 3.4Å; E833-R837 WeakPolarHBondContact O-CG 3.41Å; E833-R837 PolarHBondContact O-N 3.45Å; E833-R837 IonicContact OE1-CZ 3.68Å; E833-R837 VanDerWaalsContact OE1-CZ 3.26Å; E833-R837 IonicContact OE1-NE 3.62Å; E833-R837 PolarHBondContact OE1-NE 3.23Å; E833-R837 IonicContact OE1-NH2 2.84Å; E833-R837 PolarHBondContact OE1-NH2 3.13Å
834	L	92.5	Very high	88.3	Confident	2 Å²	2	56.7 Å²	56.7	1%	0.01	26%	0.257	C	S	.	.	H	α-helix	trans	-57.9	-44.3	174.7	175.7	61.3	0	0	0	110.9	L513 I518 P529 E530 L533 H830 F831 R837 K838	L513-L834 HydrophobicContact CD1-CB 3.77Å; L513-L834 HydrophobicContact CD1-CD1 4.47Å; I518-L834 HydrophobicContact CD1-CD1 3.81Å; I518-L834 HydrophobicContact CG1-CD1 3.91Å; I518-L834 HydrophobicContact CG2-CD1 4.36Å; P529-L834 HydrophobicContact CB-CD1 3.67Å; P529-L834 HydrophobicContact CB-CD2 3.92Å; P529-L834 HydrophobicContact CB-CG 4.46Å; P529-L834 HydrophobicContact CG-CD1 4.49Å; E530-L834 HydrophobicContact CG-CD2 4.14Å; L533-L834 HydrophobicContact CD1-CB 4.05Å; L533-L834 HydrophobicContact CD1-CD2 3.62Å; L533-L834 HydrophobicContact CD1-CG 4.44Å; L533-L834 HydrophobicContact CG-CD2 4.46Å; H830-L834 WeakPolarHBondContact O-CB 3.43Å; H830-L834 PolarHBondContact O-N 2.83Å; F831-L834 PolarHBondContact O-N 3.38Å; L834-R837 PolarHBondContact O-N 2.89Å; L834-K838 HydrophobicContact CD1-CD 4.41Å; L834-K838 HydrophobicContact CD1-CG 4.23Å; L834-K838 HydrophobicContact CG-CD 4.45Å; L834-K838 WeakPolarHBondContact O-CB 3.19Å; L834-K838 WeakPolarHBondContact O-CG 3.04Å; L834-K838 PolarHBondContact O-N 3.27Å
835	R	92.6	Very high	89.1	Confident	157 Å²	157	54.4 Å²	54.4	59%	0.592	26%	0.26	S	S	*	.	H	α-helix	trans	-65.6	-40	177.9	-169.5	178.2	-174.2	175.3	3.8	112	F831 D832 E833 R839	F831-R835 PolarHBondContact O-N 3.46Å; D832-R835 PolarHBondContact O-N 3.41Å; E833-R835 VanDerWaalsContact C-N 3.31Å; E833-R835 PolarHBondContact O-N 3.3Å; R835-R839 WeakPolarHBondContact O-CB 3.37Å; R835-R839 PolarHBondContact O-N 2.62Å
836	A	93.2	Very high	90	Very high	9 Å²	9	53.8 Å²	53.8	7%	0.074	26%	0.256	C	S	.	.	H	α-helix	trans	-63.2	-47	175	0	0	0	0	0	111.1	D832 E833 R839 L840 C933 I935	D832-A836 WeakPolarHBondContact O-CB 3.48Å; D832-A836 PolarHBondContact O-N 2.97Å; E833-A836 WeakPolarHBondContact O-CB 3.33Å; E833-A836 PolarHBondContact O-N 2.93Å; A836-R839 WeakPolarHBondContact O-CB 3.23Å; A836-R839 PolarHBondContact O-N 2.88Å; A836-L840 PolarHBondContact O-N 2.9Å; A836-C933 VanDerWaalsContact CB-O 3.31Å; A836-C933 WeakPolarHBondContact CB-O 3.41Å; A836-I935 HydrophobicContact CB-CG1 3.68Å
837	R	94.1	Very high	91.1	Very high	19 Å²	19	50.5 Å²	50.5	7%	0.072	24%	0.239	C	C	.	.	H	α-helix	trans	-63.6	-45.1	176.2	-71.7	176.6	-179.2	-92.5	8.8	112.9	L513 N515 I518 E833 L834 R839 L840 L841 I935	L513-R837 PolarHBondContact O-NH2 3.12Å; N515-R837 PolarHBondContact OD1-NH1 3.23Å; I518-R837 HydrophobicContact CD1-CB 3.58Å; I518-R837 HydrophobicContact CD1-CG 4.22Å; E833-R837 HydrophobicContact CG-CG 4.49Å; E833-R837 WeakPolarHBondContact O-CB 3.4Å; E833-R837 WeakPolarHBondContact O-CG 3.41Å; E833-R837 PolarHBondContact O-N 3.45Å; E833-R837 IonicContact OE1-CZ 3.68Å; E833-R837 VanDerWaalsContact OE1-CZ 3.26Å; E833-R837 IonicContact OE1-NE 3.62Å; E833-R837 PolarHBondContact OE1-NE 3.23Å; E833-R837 IonicContact OE1-NH2 2.84Å; E833-R837 PolarHBondContact OE1-NH2 3.13Å; L834-R837 PolarHBondContact O-N 2.89Å; R837-R839 VanDerWaalsContact C-N 3.28Å; R837-R839 PolarHBondContact O-N 2.97Å; R837-L840 WeakPolarHBondContact O-CB 3.36Å; R837-L840 PolarHBondContact O-N 3.11Å; R837-L840 VanDerWaalsContact O-N 3.14Å; R837-L841 VanDerWaalsContact O-CG 3.3Å; R837-L841 WeakPolarHBondContact O-CG 3.33Å; R837-L841 PolarHBondContact O-N 3.14Å; R837-I935 HydrophobicContact CB-CD1 4.43Å; R837-I935 HydrophobicContact CG-CD1 3.95Å; R837-I935 HydrophobicContact CG-CG1 4.32Å
838	K	94.3	Very high	91.8	Very high	13 Å²	13	49.2 Å²	49.2	6%	0.057	23%	0.23	C	C	.	.	H	α-helix	trans	-57.3	-42.4	172.4	-78.4	-173.8	168.6	-164.4	0	111.4	E530 L834 L840 L841 R842 D851	E530-K838 IonicContact OE1-NZ 2.65Å; E530-K838 PolarHBondContact OE1-NZ 3.22Å; E530-K838 IonicContact OE2-NZ 3.38Å; L834-K838 HydrophobicContact CD1-CD 4.41Å; L834-K838 HydrophobicContact CD1-CG 4.23Å; L834-K838 HydrophobicContact CG-CD 4.45Å; L834-K838 WeakPolarHBondContact O-CB 3.19Å; L834-K838 WeakPolarHBondContact O-CG 3.04Å; L834-K838 PolarHBondContact O-N 3.27Å; K838-L840 PolarHBondContact O-N 3.25Å; K838-L841 PolarHBondContact O-N 3.18Å; K838-R842 VanDerWaalsContact O-CG 3.25Å; K838-R842 WeakPolarHBondContact O-CG 3.42Å; K838-R842 PolarHBondContact O-N 3.38Å; K838-D851 WeakPolarHBondContact CD-OD2 3.45Å; K838-D851 WeakPolarHBondContact CE-OD2 3.18Å; K838-D851 IonicContact NZ-OD2 3.62Å; K838-D851 PolarHBondContact NZ-OD2 2.81Å
839	R	94.9	Very high	92.4	Very high	126 Å²	126	53.6 Å²	53.6	48%	0.475	25%	0.249	S	C	.	.	H	α-helix	trans	-60.4	-44.4	175	-170.3	-170.2	-52.3	-141.1	2.3	112.1	R835 A836 R837 R843	R835-R839 WeakPolarHBondContact O-CB 3.37Å; R835-R839 PolarHBondContact O-N 2.62Å; A836-R839 WeakPolarHBondContact O-CB 3.23Å; A836-R839 PolarHBondContact O-N 2.88Å; R837-R839 VanDerWaalsContact C-N 3.28Å; R837-R839 PolarHBondContact O-N 2.97Å; R839-R843 VanDerWaalsContact O-CB 3.27Å; R839-R843 WeakPolarHBondContact O-CB 3.4Å; R839-R843 PolarHBondContact O-N 3.25Å
840	L	94.8	Very high	93.1	Very high	1 Å²	1	59.1 Å²	59.1	1%	0.005	28%	0.277	C	S	.	.	H	α-helix	trans	-60.7	-48.1	174.9	176.7	67.7	0	0	0	111.2	A836 R837 K838 R842 R843 L844 L869 M929 C933 I935	A836-L840 PolarHBondContact O-N 2.9Å; R837-L840 WeakPolarHBondContact O-CB 3.36Å; R837-L840 PolarHBondContact O-N 3.11Å; R837-L840 VanDerWaalsContact O-N 3.14Å; K838-L840 PolarHBondContact O-N 3.25Å; L840-R842 VanDerWaalsContact C-N 3.34Å; L840-R842 PolarHBondContact O-N 3.21Å; L840-R843 PolarHBondContact O-N 3.35Å; L840-L844 HydrophobicContact CD1-CD1 3.72Å; L840-L844 HydrophobicContact CD1-CG 4.02Å; L840-L844 HydrophobicContact CG-CD1 3.91Å; L840-L844 HydrophobicContact CG-CG 4.45Å; L840-L844 WeakPolarHBondContact O-CB 3.47Å; L840-L844 WeakPolarHBondContact O-CG 3.29Å; L840-L844 PolarHBondContact O-N 2.92Å; L840-L869 HydrophobicContact CD2-CD1 3.93Å; L840-M929 HydrophobicContact CD1-CB 4Å; L840-C933 HydrophobicContact CB-CB 4.17Å; L840-I935 HydrophobicContact CB-CD1 3.48Å; L840-I935 VanDerWaalsContact CB-CD1 3.48Å; L840-I935 HydrophobicContact CD2-CD1 3.5Å; L840-I935 VanDerWaalsContact CD2-CD1 3.5Å; L840-I935 HydrophobicContact CG-CD1 4.05Å
841	L	96.3	Very high	93.4	Very high	0 Å²	0	58.6 Å²	58.6	0%	0	28%	0.276	C	S	.	.	H	α-helix	trans	-62.3	-39.9	-178.9	-66.9	170.2	0	0	0	112.1	N515 I518 L519 R837 K838 C845 F846 L869	N515-L841 HydrophobicContact CB-CD2 4.13Å; I518-L841 HydrophobicContact CB-CD1 4.25Å; I518-L841 HydrophobicContact CG2-CD1 3.75Å; L519-L841 HydrophobicContact CD1-CD2 4.27Å; L519-L841 HydrophobicContact CD2-CD1 4.15Å; L519-L841 HydrophobicContact CD2-CD2 4.26Å; L519-L841 HydrophobicContact CG-CD1 4.29Å; L519-L841 HydrophobicContact CG-CD2 4.34Å; R837-L841 VanDerWaalsContact O-CG 3.3Å; R837-L841 WeakPolarHBondContact O-CG 3.33Å; R837-L841 PolarHBondContact O-N 3.14Å; K838-L841 PolarHBondContact O-N 3.18Å; L841-C845 PolarHBondContact O-N 3.24Å; L841-C845 VanDerWaalsContact O-N 3.12Å; L841-F846 HydrophobicContact CB-CB 4.21Å; L841-F846 HydrophobicContact CD2-CB 3.88Å; L841-F846 HydrophobicContact CD2-CD1 4.47Å; L841-F846 HydrophobicContact CD2-CG 4.17Å; L841-F846 PolarHBondContact O-N 2.66Å; L841-L869 HydrophobicContact CD2-CD2 3.82Å
842	R	95.9	Very high	93.6	Very high	67 Å²	67	58.7 Å²	58.7	25%	0.253	28%	0.283	S	S	.	.	H	α-helix	trans	-65.2	-45.6	172.9	-67.8	173.2	-165.2	-179.2	4.5	111.7	K838 L840 L844 C845 C847 S848 E849 D851	K838-R842 VanDerWaalsContact O-CG 3.25Å; K838-R842 WeakPolarHBondContact O-CG 3.42Å; K838-R842 PolarHBondContact O-N 3.38Å; L840-R842 VanDerWaalsContact C-N 3.34Å; L840-R842 PolarHBondContact O-N 3.21Å; R842-L844 VanDerWaalsContact C-N 3.29Å; R842-L844 PolarHBondContact O-N 3.34Å; R842-C845 WeakPolarHBondContact O-CA 3.3Å; R842-C845 PolarHBondContact O-N 3.43Å; R842-C847 VanDerWaalsContact CG-SG 3.6Å; R842-S848 WeakPolarHBondContact CG-O 3.49Å; R842-E849 PolarHBondContact NH1-O 3.15Å; R842-E849 IonicContact NH1-OE2 2.79Å; R842-D851 IonicContact CZ-OD1 3.48Å; R842-D851 IonicContact NE-OD1 3.35Å; R842-D851 PolarHBondContact NE-OD1 2.82Å; R842-D851 IonicContact NH2-OD1 3.25Å; R842-D851 PolarHBondContact NH2-OD1 3.37Å; R842-D851 IonicContact NH2-OD2 3.32Å; R842-D851 PolarHBondContact NH2-OD2 3.33Å
843	R	94.4	Very high	93.9	Very high	126 Å²	126	53.3 Å²	53.3	48%	0.475	26%	0.255	S	S	.	.	H	α-helix	trans	-63	-34.1	179.7	-173.5	172.3	-179.6	174.6	-4.2	113.1	R839 L840 C845 E932	R839-R843 VanDerWaalsContact O-CB 3.27Å; R839-R843 WeakPolarHBondContact O-CB 3.4Å; R839-R843 PolarHBondContact O-N 3.25Å; L840-R843 PolarHBondContact O-N 3.35Å; R843-C845 VanDerWaalsContact C-N 3.31Å; R843-E932 IonicContact CZ-OE2 2.72Å; R843-E932 IonicContact NH1-OE2 3.23Å; R843-E932 PolarHBondContact NH1-OE2 2.99Å; R843-E932 IonicContact NH2-OE2 3.15Å; R843-E932 PolarHBondContact NH2-OE2 2.97Å
844	L	95.4	Very high	94.1	Very high	7 Å²	7	52.4 Å²	52.4	4%	0.037	26%	0.257	C	S	.	.	T	Hydrogen-bonded Turn	trans	-86.3	-1	174.7	-65	177.3	0	0	0	113.2	L840 R842 F846 K856 L869 L926 M929	L840-L844 HydrophobicContact CD1-CD1 3.72Å; L840-L844 HydrophobicContact CD1-CG 4.02Å; L840-L844 HydrophobicContact CG-CD1 3.91Å; L840-L844 HydrophobicContact CG-CG 4.45Å; L840-L844 WeakPolarHBondContact O-CB 3.47Å; L840-L844 WeakPolarHBondContact O-CG 3.29Å; L840-L844 PolarHBondContact O-N 2.92Å; R842-L844 VanDerWaalsContact C-N 3.29Å; R842-L844 PolarHBondContact O-N 3.34Å; L844-F846 HydrophobicContact CB-CD2 3.53Å; L844-F846 HydrophobicContact CB-CE2 3.71Å; L844-F846 HydrophobicContact CD1-CE2 4.33Å; L844-K856 WeakPolarHBondContact O-CD 3.4Å; L844-K856 PolarHBondContact O-NZ 3.19Å; L844-K856 VanDerWaalsContact O-NZ 3.08Å; L844-L869 HydrophobicContact CD1-CD1 4.3Å; L844-L926 HydrophobicContact CD1-CD2 4.04Å; L844-L926 HydrophobicContact CD2-CD2 4.2Å; L844-M929 HydrophobicContact CD2-CG 4.44Å
845	C	95.8	Very high	94.2	Very high	78 Å²	78	57 Å²	57	53%	0.527	28%	0.281	S	S	.	.	T	Hydrogen-bonded Turn	trans	63.7	32.6	-178	-52	0	0	0	0	114.8	L841 R842 R843 A854	L841-C845 PolarHBondContact O-N 3.24Å; L841-C845 VanDerWaalsContact O-N 3.12Å; R842-C845 WeakPolarHBondContact O-CA 3.3Å; R842-C845 PolarHBondContact O-N 3.43Å; R843-C845 VanDerWaalsContact C-N 3.31Å; C845-A854 WeakPolarHBondContact O-CB 3.5Å
846	F	97	Very high	94.4	Very high	0 Å²	0	52 Å²	52	0%	0	26%	0.264	C	S	.	.	S	Bend	trans	-79.3	-29.6	171.2	-76.4	-114.7	0	0	0	112.1	L519 L841 L844 A854 K856 G857 A860 L869 T872 E873	L519-F846 HydrophobicContact CD1-CD1 4Å; L519-F846 HydrophobicContact CD2-CB 4.13Å; L841-F846 HydrophobicContact CB-CB 4.21Å; L841-F846 HydrophobicContact CD2-CB 3.88Å; L841-F846 HydrophobicContact CD2-CD1 4.47Å; L841-F846 HydrophobicContact CD2-CG 4.17Å; L841-F846 PolarHBondContact O-N 2.66Å; L844-F846 HydrophobicContact CB-CD2 3.53Å; L844-F846 HydrophobicContact CB-CE2 3.71Å; L844-F846 HydrophobicContact CD1-CE2 4.33Å; F846-A854 WeakPolarHBondContact O-CB 3.44Å; F846-A854 PolarHBondContact O-N 3.19Å; F846-K856 HydrophobicContact CB-CB 4.49Å; F846-K856 HydrophobicContact CD1-CB 4.11Å; F846-K856 HydrophobicContact CD2-CB 4.08Å; F846-K856 HydrophobicContact CD2-CD 4.06Å; F846-K856 HydrophobicContact CE1-CB 4.37Å; F846-K856 HydrophobicContact CE2-CB 4.32Å; F846-K856 HydrophobicContact CE2-CD 3.93Å; F846-K856 HydrophobicContact CG-CB 3.96Å; F846-K856 HydrophobicContact CZ-CB 4.47Å; F846-G857 VanDerWaalsContact O-CA 3.3Å; F846-G857 WeakPolarHBondContact O-CA 3.38Å; F846-G857 PolarHBondContact O-N 3.27Å; F846-A860 HydrophobicContact CD1-CB 3.83Å; F846-A860 HydrophobicContact CE1-CB 3.66Å; F846-L869 HydrophobicContact CD1-CD2 3.82Å; F846-L869 HydrophobicContact CD2-CD2 4.48Å; F846-L869 HydrophobicContact CE1-CD2 3.47Å; F846-L869 VanDerWaalsContact CE1-CD2 3.47Å; F846-L869 HydrophobicContact CE2-CD2 4.22Å; F846-L869 HydrophobicContact CG-CD2 4.31Å; F846-L869 HydrophobicContact CZ-CB 4.41Å; F846-L869 HydrophobicContact CZ-CD2 3.71Å; F846-T872 HydrophobicContact CE1-CG2 3.7Å; F846-T872 HydrophobicContact CZ-CG2 3.73Å; F846-E873 HydrophobicContact CE2-CG 4.4Å; F846-E873 HydrophobicContact CZ-CG 4.34Å
847	C	95.2	Very high	94.5	Very high	4 Å²	4	51.6 Å²	51.6	3%	0.027	26%	0.26	C	S	.	.	B	Isolated β-bridge	trans	-134.5	161.2	166.8	58.1	0	0	0	0	110.5	L522 R842 T852	L522-C847 HydrophobicContact CD1-CB 4.5Å; R842-C847 VanDerWaalsContact CG-SG 3.6Å; C847-T852 CarbonylContact C-O 3.48Å; C847-T852 VanDerWaalsContact CA-O 3.23Å; C847-T852 WeakPolarHBondContact CA-O 3.48Å; C847-T852 WeakPolarHBondContact CB-O 3.49Å
848	S	93.6	Very high	94.5	Very high	40 Å²	40	57.8 Å²	57.8	28%	0.28	28%	0.283	S	S	.	.			trans	-75.5	172.2	172.7	72.9	0	0	0	0	111.6	R842 D850 D851 T852	R842-S848 WeakPolarHBondContact CG-O 3.49Å; S848-D850 PolarHBondContact O-N 2.89Å; S848-D850 PolarHBondContact OG-N 3.29Å; S848-D851 PolarHBondContact O-N 3.29Å; S848-T852 WeakPolarHBondContact CB-OG1 3.38Å; S848-T852 PolarHBondContact N-O 2.77Å; S848-T852 PolarHBondContact OG-N 3.44Å; S848-T852 VanDerWaalsContact OG-N 3.14Å; S848-T852 PolarHBondContact OG-OG1 3.04Å
849	E	92.1	Very high	94.6	Very high	137 Å²	137	57.1 Å²	57.1	64%	0.64	28%	0.28	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59	-27.3	174.8	-69.6	-62.7	160.7	0	0	113.5	R842 D851	R842-E849 PolarHBondContact NH1-O 3.15Å; R842-E849 IonicContact NH1-OE2 2.79Å; E849-D851 VanDerWaalsContact C-N 3.26Å; E849-D851 PolarHBondContact O-N 3.29Å
850	D	90.9	Very high	94.6	Very high	141 Å²	141	51.1 Å²	51.1	75%	0.754	26%	0.258	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.6	15.1	177.2	-60	-41.2	0	0	0	112.8	S848 T852	S848-D850 PolarHBondContact O-N 2.89Å; S848-D850 PolarHBondContact OG-N 3.29Å; D850-T852 HydrophobicContact CB-CG2 4.49Å; D850-T852 PolarHBondContact O-N 3.19Å
851	D	90.9	Very high	94.6	Very high	32 Å²	32	51.6 Å²	51.6	17%	0.171	26%	0.261	C	S	.	.			trans	61.3	21.7	-177.2	-68.9	-28.9	0	0	0	115.1	L522 K838 R842 S848 E849	L522-D851 HydrophobicContact CD1-CB 4.38Å; L522-D851 HydrophobicContact CD2-CB 3.94Å; K838-D851 WeakPolarHBondContact CD-OD2 3.45Å; K838-D851 WeakPolarHBondContact CE-OD2 3.18Å; K838-D851 IonicContact NZ-OD2 3.62Å; K838-D851 PolarHBondContact NZ-OD2 2.81Å; R842-D851 IonicContact CZ-OD1 3.48Å; R842-D851 IonicContact NE-OD1 3.35Å; R842-D851 PolarHBondContact NE-OD1 2.82Å; R842-D851 IonicContact NH2-OD1 3.25Å; R842-D851 PolarHBondContact NH2-OD1 3.37Å; R842-D851 IonicContact NH2-OD2 3.32Å; R842-D851 PolarHBondContact NH2-OD2 3.33Å; S848-D851 PolarHBondContact O-N 3.29Å; E849-D851 VanDerWaalsContact C-N 3.26Å; E849-D851 PolarHBondContact O-N 3.29Å
852	T	93.1	Very high	94.4	Very high	87 Å²	87	53.2 Å²	53.2	53%	0.534	27%	0.268	S	S	.	.			trans	-81.6	130.9	172.2	66.7	0	0	0	0	110.8	C847 S848 D850 A854	C847-T852 CarbonylContact C-O 3.48Å; C847-T852 VanDerWaalsContact CA-O 3.23Å; C847-T852 WeakPolarHBondContact CA-O 3.48Å; C847-T852 WeakPolarHBondContact CB-O 3.49Å; S848-T852 WeakPolarHBondContact CB-OG1 3.38Å; S848-T852 PolarHBondContact N-O 2.77Å; S848-T852 PolarHBondContact OG-N 3.44Å; S848-T852 VanDerWaalsContact OG-N 3.14Å; S848-T852 PolarHBondContact OG-OG1 3.04Å; D850-T852 HydrophobicContact CB-CG2 4.49Å; D850-T852 PolarHBondContact O-N 3.19Å; T852-A854 PolarHBondContact O-N 2.8Å
853	V	93.5	Very high	94.3	Very high	20 Å²	20	50 Å²	50	12%	0.121	26%	0.256	C	S	.	.	B	Isolated β-bridge	trans	-66.8	118.9	-175.5	-174.2	0	0	0	0	111	L522 R523 R858	L522-V853 HydrophobicContact CB-CG2 3.58Å; R523-V853 HydrophobicContact CB-CG2 4.46Å; V853-R858 HydrophobicContact CG1-CG 3.97Å
854	A	95	Very high	93.9	Very high	35 Å²	35	47 Å²	47	29%	0.289	26%	0.255	S	S	.	.			trans	-83.2	177.3	178.1	0	0	0	0	0	111.6	C845 F846 T852 K856 G857 R858	C845-A854 WeakPolarHBondContact O-CB 3.5Å; F846-A854 WeakPolarHBondContact O-CB 3.44Å; F846-A854 PolarHBondContact O-N 3.19Å; T852-A854 PolarHBondContact O-N 2.8Å; A854-K856 VanDerWaalsContact C-N 3.32Å; A854-K856 PolarHBondContact O-N 3.36Å; A854-G857 WeakPolarHBondContact O-CA 3.38Å; A854-G857 PolarHBondContact O-N 3.08Å; A854-R858 PolarHBondContact O-N 3.08Å
855	L	95	Very high	93.4	Very high	97 Å²	97	47.4 Å²	47.4	51%	0.508	26%	0.257	S	S	.	.	H	α-helix	trans	-55	-45.9	179.2	179.2	61.7	0	0	0	112.2	G857 R858 I859	L855-G857 VanDerWaalsContact C-N 3.3Å; L855-G857 PolarHBondContact O-N 3.33Å; L855-R858 PolarHBondContact O-N 2.73Å; L855-R858 VanDerWaalsContact O-N 3.15Å; L855-I859 HydrophobicContact CD1-CD1 4.34Å; L855-I859 HydrophobicContact CD1-CG1 4.44Å; L855-I859 HydrophobicContact CG-CD1 4.04Å; L855-I859 WeakPolarHBondContact O-CG1 3.41Å; L855-I859 PolarHBondContact O-N 3Å
856	K	96.3	Very high	92.8	Very high	54 Å²	54	45.3 Å²	45.3	24%	0.235	25%	0.249	C	C	.	.	H	α-helix	trans	-55.7	-45	175	-68.6	-161.9	173.9	-177.7	0	112.1	L844 F846 A854 R858 I859 A860 T872 E873 L876	L844-K856 WeakPolarHBondContact O-CD 3.4Å; L844-K856 PolarHBondContact O-NZ 3.19Å; L844-K856 VanDerWaalsContact O-NZ 3.08Å; F846-K856 HydrophobicContact CB-CB 4.49Å; F846-K856 HydrophobicContact CD1-CB 4.11Å; F846-K856 HydrophobicContact CD2-CB 4.08Å; F846-K856 HydrophobicContact CD2-CD 4.06Å; F846-K856 HydrophobicContact CE1-CB 4.37Å; F846-K856 HydrophobicContact CE2-CB 4.32Å; F846-K856 HydrophobicContact CE2-CD 3.93Å; F846-K856 HydrophobicContact CG-CB 3.96Å; F846-K856 HydrophobicContact CZ-CB 4.47Å; A854-K856 VanDerWaalsContact C-N 3.32Å; A854-K856 PolarHBondContact O-N 3.36Å; K856-R858 PolarHBondContact O-N 3.29Å; K856-I859 PolarHBondContact O-N 2.8Å; K856-A860 WeakPolarHBondContact O-CB 3.46Å; K856-A860 PolarHBondContact O-N 3.35Å; K856-T872 HydrophobicContact CB-CG2 4.22Å; K856-E873 IonicContact NZ-OE1 2.7Å; K856-E873 PolarHBondContact NZ-OE1 2.59Å; K856-L876 HydrophobicContact CB-CD1 4.46Å; K856-L876 HydrophobicContact CD-CD1 3.97Å; K856-L876 HydrophobicContact CG-CD1 3.5Å
857	G	95.6	Very high	92.6	Very high	0 Å²	0	46.5 Å²	46.5	0%	0	26%	0.255	C	S	.	.	H	α-helix	trans	-61.9	-40.8	177	0	0	0	0	0	112.8	F846 A854 L855 A860 C861	F846-G857 VanDerWaalsContact O-CA 3.3Å; F846-G857 WeakPolarHBondContact O-CA 3.38Å; F846-G857 PolarHBondContact O-N 3.27Å; A854-G857 WeakPolarHBondContact O-CA 3.38Å; A854-G857 PolarHBondContact O-N 3.08Å; L855-G857 VanDerWaalsContact C-N 3.3Å; L855-G857 PolarHBondContact O-N 3.33Å; G857-A860 PolarHBondContact O-N 2.91Å; G857-C861 PolarHBondContact O-N 3.23Å; G857-C861 PolarHBondContact O-SG 3.47Å
858	R	94.5	Very high	92.5	Very high	148 Å²	148	47.3 Å²	47.3	56%	0.558	26%	0.259	S	S	*	.	H	α-helix	trans	-64.9	-40.2	176.3	-64.7	179.9	-171.3	-170.7	-1.1	112.6	V853 A854 L855 K856 C861 V1022	V853-R858 HydrophobicContact CG1-CG 3.97Å; A854-R858 PolarHBondContact O-N 3.08Å; L855-R858 PolarHBondContact O-N 2.73Å; L855-R858 VanDerWaalsContact O-N 3.15Å; K856-R858 PolarHBondContact O-N 3.29Å; R858-C861 PolarHBondContact O-N 2.91Å; R858-V1022 HydrophobicContact CB-CG1 3.97Å
859	I	96.2	Very high	92.6	Very high	0 Å²	0	45.7 Å²	45.7	0%	0	25%	0.247	C	C	.	.	H	α-helix	trans	-61.7	-47.3	174.5	-66.1	166.7	0	0	0	109.6	L855 K856 C861 E862 T872 L875 L876 A1019 V1022 A1023	L855-I859 HydrophobicContact CD1-CD1 4.34Å; L855-I859 HydrophobicContact CD1-CG1 4.44Å; L855-I859 HydrophobicContact CG-CD1 4.04Å; L855-I859 WeakPolarHBondContact O-CG1 3.41Å; L855-I859 PolarHBondContact O-N 3Å; K856-I859 PolarHBondContact O-N 2.8Å; I859-C861 VanDerWaalsContact C-N 3.31Å; I859-C861 PolarHBondContact O-N 2.79Å; I859-E862 PolarHBondContact O-N 3.16Å; I859-E862 VanDerWaalsContact O-N 3.12Å; I859-T872 HydrophobicContact CB-CG2 4.19Å; I859-T872 HydrophobicContact CG2-CG2 3.97Å; I859-L875 HydrophobicContact CG2-CD2 3.81Å; I859-L876 HydrophobicContact CD1-CD1 4.31Å; I859-L876 HydrophobicContact CD1-CD2 4.02Å; I859-L876 HydrophobicContact CD1-CG 4.47Å; I859-A1019 HydrophobicContact CG2-CB 3.85Å; I859-V1022 HydrophobicContact CG1-CB 4.37Å; I859-V1022 HydrophobicContact CG1-CG1 3.97Å; I859-A1023 HydrophobicContact CD1-CB 3.57Å; I859-A1023 HydrophobicContact CG1-CB 4.1Å
860	A	95.8	Very high	92.7	Very high	0 Å²	0	39.1 Å²	39.1	0%	0	22%	0.216	C	C	.	.	H	α-helix	trans	-65.1	-30.5	-179.5	0	0	0	0	0	113.8	N516 L519 F846 K856 G857 E862 I863 E868 T872	N516-A860 PolarHBondContact ND2-O 3.41Å; L519-A860 HydrophobicContact CD1-CB 3.7Å; F846-A860 HydrophobicContact CD1-CB 3.83Å; F846-A860 HydrophobicContact CE1-CB 3.66Å; K856-A860 WeakPolarHBondContact O-CB 3.46Å; K856-A860 PolarHBondContact O-N 3.35Å; G857-A860 PolarHBondContact O-N 2.91Å; A860-E862 PolarHBondContact O-N 3.39Å; A860-I863 PolarHBondContact O-N 2.66Å; A860-I863 VanDerWaalsContact O-N 3.11Å; A860-E868 HydrophobicContact CB-CB 4.34Å; A860-T872 WeakPolarHBondContact CA-OG1 3.35Å; A860-T872 WeakPolarHBondContact CB-OG1 3.22Å
861	C	93.8	Very high	93	Very high	11 Å²	11	32.4 Å²	32.4	7%	0.074	18%	0.181	C	C	.	.	H	α-helix	trans	-59.8	-27.6	173.2	-73.6	0	0	0	0	113.1	N520 G857 R858 I859 I863	N520-C861 PolarHBondContact OD1-SG 3.38Å; G857-C861 PolarHBondContact O-N 3.23Å; G857-C861 PolarHBondContact O-SG 3.47Å; R858-C861 PolarHBondContact O-N 2.91Å; I859-C861 VanDerWaalsContact C-N 3.31Å; I859-C861 PolarHBondContact O-N 2.79Å; C861-I863 VanDerWaalsContact C-N 3.31Å
862	E	92.6	Very high	93.3	Very high	33 Å²	33	30.9 Å²	30.9	15%	0.154	17%	0.172	C	C	.	.	T	Hydrogen-bonded Turn	trans	-82.4	-8.5	178.6	-60.6	-52.7	139.7	0	0	113.3	R183 R523 I859 A860 Q1015 N1018 A1019 V1022	R183-E862 IonicContact NH2-OE2 3.29Å; R183-E862 PolarHBondContact NH2-OE2 3.23Å; R523-E862 IonicContact NH1-OE1 3.85Å; I859-E862 PolarHBondContact O-N 3.16Å; I859-E862 VanDerWaalsContact O-N 3.12Å; A860-E862 PolarHBondContact O-N 3.39Å; E862-Q1015 WeakPolarHBondContact O-CB 3.37Å; E862-N1018 HydrophobicContact CB-CB 4.41Å; E862-A1019 HydrophobicContact CB-CB 4.48Å; E862-V1022 HydrophobicContact CG-CG2 4.01Å
863	I	92.9	Very high	93.4	Very high	0 Å²	0	27.2 Å²	27.2	0%	0	15%	0.149	C	C	.	.			trans	-104.7	114	-178.6	-55.5	173.1	0	0	0	108.7	N516 A860 C861 E868 L871 M1016 A1019	N516-I863 PolarHBondContact ND2-O 3.41Å; A860-I863 PolarHBondContact O-N 2.66Å; A860-I863 VanDerWaalsContact O-N 3.11Å; C861-I863 VanDerWaalsContact C-N 3.31Å; I863-E868 HydrophobicContact CB-CB 4.21Å; I863-E868 HydrophobicContact CG2-CB 4.27Å; I863-L871 HydrophobicContact CD1-CB 3.78Å; I863-L871 HydrophobicContact CG2-CB 4.45Å; I863-L871 HydrophobicContact CG2-CD1 3.56Å; I863-M1016 HydrophobicContact CD1-SD 3.71Å; I863-M1016 HydrophobicContact CG1-SD 4.14Å; I863-A1019 HydrophobicContact CD1-CB 4.22Å; I863-A1019 HydrophobicContact CG1-CB 4.08Å
864	S	87.5	Confident	93.6	Very high	64 Å²	64	26.4 Å²	26.4	45%	0.448	14%	0.144	S	C	.	.			trans	-121.6	-20.5	177.9	69.5	0	0	0	0	113.2	Q1015	S864-Q1015 PolarHBondContact OG-NE2 3.09Å
865	T	84.6	Confident	93.6	Very high	14 Å²	14	25 Å²	25	9%	0.086	13%	0.132	C	C	.	.	S	Bend	trans	-94.8	124.9	171.8	-56.1	0	0	0	0	108.3	V896 L1012 Q1015	T865-V896 HydrophobicContact CG2-CG1 3.85Å; T865-L1012 HydrophobicContact CG2-CB 3.97Å; T865-L1012 VanDerWaalsContact O-CD1 3.32Å; T865-L1012 WeakPolarHBondContact O-CD1 3.42Å; T865-Q1015 PolarHBondContact OG1-NE2 3.4Å; T865-Q1015 PolarHBondContact OG1-OE1 2.85Å
866	G	83.6	Confident	93.6	Very high	34 Å²	34	24 Å²	24	35%	0.351	13%	0.127	S	C	.	.	S	Bend	trans	86.3	-164.9	-178.1	0	0	0	0	0	113.5
867	D	91.2	Very high	93.6	Very high	25 Å²	25	26 Å²	26	13%	0.134	14%	0.14	C	C	.	.			trans	-94.1	110	-178.8	-173.7	-54.8	0	0	0	110.7	L869 M870 L871 Y967 F971	D867-L869 VanDerWaalsContact C-N 3.32Å; D867-L869 PolarHBondContact O-N 2.81Å; D867-L869 PolarHBondContact OD1-N 2.75Å; D867-L869 VanDerWaalsContact OD1-N 3.08Å; D867-M870 HydrophobicContact CB-CB 3.91Å; D867-M870 PolarHBondContact O-N 3.44Å; D867-M870 WeakPolarHBondContact OD1-CB 3.47Å; D867-M870 PolarHBondContact OD1-N 3.41Å; D867-L871 WeakPolarHBondContact O-CB 3.19Å; D867-L871 WeakPolarHBondContact O-CG 3.43Å; D867-L871 PolarHBondContact O-N 2.8Å; D867-Y967 PolarHBondContact OD1-OH 3.25Å; D867-Y967 VanDerWaalsContact OD2-CE2 3.24Å; D867-Y967 WeakPolarHBondContact OD2-CE2 3.06Å; D867-Y967 VanDerWaalsContact OD2-CZ 3.26Å; D867-Y967 PolarHBondContact OD2-OH 3.2Å; D867-F971 HydrophobicContact CB-CE1 4.22Å; D867-F971 HydrophobicContact CB-CZ 4.16Å
868	E	93.7	Very high	93.5	Very high	22 Å²	22	27.5 Å²	27.5	10%	0.103	16%	0.155	C	C	.	.	H	α-helix	trans	-64.4	-32	-173.5	67	-82.3	-163.6	0	0	113.4	N515 N516 A860 I863 T872	N515-E868 WeakPolarHBondContact CA-OE1 3.46Å; N515-E868 HydrophobicContact CB-CG 4.44Å; N515-E868 WeakPolarHBondContact CB-OE1 3.4Å; N515-E868 PolarHBondContact N-OE1 2.86Å; N516-E868 HydrophobicContact CB-CG 4.16Å; N516-E868 PolarHBondContact N-OE1 3.43Å; A860-E868 HydrophobicContact CB-CB 4.34Å; I863-E868 HydrophobicContact CB-CB 4.21Å; I863-E868 HydrophobicContact CG2-CB 4.27Å; E868-T872 WeakPolarHBondContact O-CB 3.39Å; E868-T872 PolarHBondContact O-N 3.31Å; E868-T872 PolarHBondContact O-OG1 3.15Å
869	L	95.1	Very high	93.6	Very high	5 Å²	5	21.1 Å²	21.1	3%	0.026	13%	0.132	C	C	.	.	H	α-helix	trans	-75.2	-48.2	178.9	-60	-172.5	0	0	0	109.9	N515 L840 L841 L844 F846 D867 T872 E873	N515-L869 HydrophobicContact CB-CD1 4.48Å; N515-L869 HydrophobicContact CB-CD2 4.22Å; N515-L869 HydrophobicContact CB-CG 4.38Å; N515-L869 VanDerWaalsContact ND2-CD1 3.32Å; N515-L869 WeakPolarHBondContact ND2-CD1 3.37Å; L840-L869 HydrophobicContact CD2-CD1 3.93Å; L841-L869 HydrophobicContact CD2-CD2 3.82Å; L844-L869 HydrophobicContact CD1-CD1 4.3Å; F846-L869 HydrophobicContact CD1-CD2 3.82Å; F846-L869 HydrophobicContact CD2-CD2 4.48Å; F846-L869 HydrophobicContact CE1-CD2 3.47Å; F846-L869 VanDerWaalsContact CE1-CD2 3.47Å; F846-L869 HydrophobicContact CE2-CD2 4.22Å; F846-L869 HydrophobicContact CG-CD2 4.31Å; F846-L869 HydrophobicContact CZ-CB 4.41Å; F846-L869 HydrophobicContact CZ-CD2 3.71Å; D867-L869 VanDerWaalsContact C-N 3.32Å; D867-L869 PolarHBondContact O-N 2.81Å; D867-L869 PolarHBondContact OD1-N 2.75Å; D867-L869 VanDerWaalsContact OD1-N 3.08Å; L869-T872 PolarHBondContact O-N 3.48Å; L869-E873 WeakPolarHBondContact O-CB 3.42Å; L869-E873 VanDerWaalsContact O-CG 3.23Å; L869-E873 WeakPolarHBondContact O-CG 3.35Å; L869-E873 PolarHBondContact O-N 2.9Å
870	M	95.1	Very high	93.6	Very high	0 Å²	0	21.1 Å²	21.1	0%	0	13%	0.132	C	C	.	.	H	α-helix	trans	-60.7	-48.2	179.7	-176.7	60.8	166.2	0	0	111.9	D867 E873 L874 F895 I919 K922 A923 L926 F971	D867-M870 HydrophobicContact CB-CB 3.91Å; D867-M870 PolarHBondContact O-N 3.44Å; D867-M870 WeakPolarHBondContact OD1-CB 3.47Å; D867-M870 PolarHBondContact OD1-N 3.41Å; M870-E873 PolarHBondContact O-N 3.29Å; M870-L874 HydrophobicContact CE-CD1 3.85Å; M870-L874 HydrophobicContact CE-CG 4.35Å; M870-L874 HydrophobicContact CG-CD1 4.12Å; M870-L874 WeakPolarHBondContact O-CB 3.46Å; M870-L874 VanDerWaalsContact O-CG 3.27Å; M870-L874 WeakPolarHBondContact O-CG 3.48Å; M870-L874 PolarHBondContact O-N 3.14Å; M870-L874 HydrophobicContact SD-CD1 4.18Å; M870-L874 HydrophobicContact SD-CG 4.26Å; M870-F895 HydrophobicContact CG-CE1 3.83Å; M870-I919 HydrophobicContact CE-CB 4.1Å; M870-I919 HydrophobicContact CE-CG2 3.58Å; M870-I919 WeakPolarHBondContact CE-O 3.44Å; M870-K922 HydrophobicContact CE-CB 3.98Å; M870-K922 HydrophobicContact CE-CG 4.25Å; M870-K922 HydrophobicContact SD-CB 4.1Å; M870-K922 HydrophobicContact SD-CG 3.72Å; M870-A923 HydrophobicContact CE-CB 4.15Å; M870-L926 HydrophobicContact CB-CD1 3.99Å; M870-L926 HydrophobicContact CG-CD1 4.5Å; M870-L926 HydrophobicContact SD-CD1 3.77Å; M870-F971 HydrophobicContact CB-CZ 4.31Å; M870-F971 HydrophobicContact CG-CE1 4.25Å; M870-F971 HydrophobicContact CG-CZ 3.99Å
871	L	96.8	Very high	93.5	Very high	0 Å²	0	23.2 Å²	23.2	0%	0	15%	0.146	C	C	.	.	H	α-helix	trans	-66	-40.8	-179.7	-72.9	167.2	0	0	0	112.2	I863 D867 L875 F880 M892 F895 L1012 M1016	I863-L871 HydrophobicContact CD1-CB 3.78Å; I863-L871 HydrophobicContact CG2-CB 4.45Å; I863-L871 HydrophobicContact CG2-CD1 3.56Å; D867-L871 WeakPolarHBondContact O-CB 3.19Å; D867-L871 WeakPolarHBondContact O-CG 3.43Å; D867-L871 PolarHBondContact O-N 2.8Å; L871-L875 VanDerWaalsContact O-CB 3.24Å; L871-L875 WeakPolarHBondContact O-CB 3.22Å; L871-L875 PolarHBondContact O-N 3.37Å; L871-F880 HydrophobicContact CD2-CZ 4.13Å; L871-M892 HydrophobicContact CD2-CE 3.9Å; L871-M892 HydrophobicContact CD2-SD 4.28Å; L871-F895 HydrophobicContact CD2-CD1 3.95Å; L871-F895 HydrophobicContact CD2-CD2 3.83Å; L871-F895 HydrophobicContact CD2-CE1 4Å; L871-F895 HydrophobicContact CD2-CE2 3.86Å; L871-F895 HydrophobicContact CD2-CG 3.9Å; L871-F895 HydrophobicContact CD2-CZ 3.95Å; L871-F895 HydrophobicContact CG-CD1 4.23Å; L871-F895 HydrophobicContact CG-CE1 4.38Å; L871-L1012 HydrophobicContact CD1-CD1 3.65Å; L871-M1016 HydrophobicContact CB-CE 4.38Å; L871-M1016 HydrophobicContact CB-SD 3.99Å; L871-M1016 HydrophobicContact CD1-SD 4.32Å; L871-M1016 HydrophobicContact CD2-CE 4.46Å; L871-M1016 HydrophobicContact CD2-SD 4.18Å; L871-M1016 HydrophobicContact CG-SD 4.4Å
872	T	97	Very high	93.5	Very high	0 Å²	0	28 Å²	28	0%	0	17%	0.167	C	C	.	.	H	α-helix	trans	-64.4	-43.5	176.2	-61	0	0	0	0	111.5	F846 K856 I859 A860 E868 L869 L875 L876	F846-T872 HydrophobicContact CE1-CG2 3.7Å; F846-T872 HydrophobicContact CZ-CG2 3.73Å; K856-T872 HydrophobicContact CB-CG2 4.22Å; I859-T872 HydrophobicContact CB-CG2 4.19Å; I859-T872 HydrophobicContact CG2-CG2 3.97Å; A860-T872 WeakPolarHBondContact CA-OG1 3.35Å; A860-T872 WeakPolarHBondContact CB-OG1 3.22Å; E868-T872 WeakPolarHBondContact O-CB 3.39Å; E868-T872 PolarHBondContact O-N 3.31Å; E868-T872 PolarHBondContact O-OG1 3.15Å; L869-T872 PolarHBondContact O-N 3.48Å; T872-L875 PolarHBondContact O-N 2.98Å; T872-L876 HydrophobicContact CG2-CD1 4.04Å; T872-L876 WeakPolarHBondContact O-CG 3.22Å; T872-L876 PolarHBondContact O-N 3.06Å; T872-L876 VanDerWaalsContact O-N 3.11Å
873	E	96.3	Very high	93.7	Very high	10 Å²	10	27 Å²	27	5%	0.047	16%	0.163	C	C	.	.	H	α-helix	trans	-65.5	-46.5	178.3	-76	-75.5	134.7	0	0	112	F846 K856 L869 M870 L875 L876 D877 K922 L926	F846-E873 HydrophobicContact CE2-CG 4.4Å; F846-E873 HydrophobicContact CZ-CG 4.34Å; K856-E873 IonicContact NZ-OE1 2.7Å; K856-E873 PolarHBondContact NZ-OE1 2.59Å; L869-E873 WeakPolarHBondContact O-CB 3.42Å; L869-E873 VanDerWaalsContact O-CG 3.23Å; L869-E873 WeakPolarHBondContact O-CG 3.35Å; L869-E873 PolarHBondContact O-N 2.9Å; M870-E873 PolarHBondContact O-N 3.29Å; E873-L875 VanDerWaalsContact C-N 3.29Å; E873-L875 PolarHBondContact O-N 2.98Å; E873-L876 PolarHBondContact O-N 3.07Å; E873-D877 WeakPolarHBondContact O-CB 3.29Å; E873-D877 PolarHBondContact O-N 3.45Å; E873-K922 VanDerWaalsContact CB-CE 3.46Å; E873-K922 WeakPolarHBondContact OE2-CE 3.24Å; E873-K922 IonicContact OE2-NZ 3.18Å; E873-K922 PolarHBondContact OE2-NZ 2.99Å; E873-L926 HydrophobicContact CG-CD2 4.29Å
874	L	96.5	Very high	93.8	Very high	2 Å²	2	29.3 Å²	29.3	1%	0.01	18%	0.179	C	C	.	.	H	α-helix	trans	-62.7	-36.5	176.2	-71.1	175.8	0	0	0	112.3	M870 G878 F879 F880 F895 I919 K922	M870-L874 HydrophobicContact CE-CD1 3.85Å; M870-L874 HydrophobicContact CE-CG 4.35Å; M870-L874 HydrophobicContact CG-CD1 4.12Å; M870-L874 WeakPolarHBondContact O-CB 3.46Å; M870-L874 VanDerWaalsContact O-CG 3.27Å; M870-L874 WeakPolarHBondContact O-CG 3.48Å; M870-L874 PolarHBondContact O-N 3.14Å; M870-L874 HydrophobicContact SD-CD1 4.18Å; M870-L874 HydrophobicContact SD-CG 4.26Å; L874-G878 PolarHBondContact O-N 3.38Å; L874-F879 HydrophobicContact CB-CB 4.14Å; L874-F879 HydrophobicContact CB-CD1 4.09Å; L874-F879 HydrophobicContact CB-CG 4.45Å; L874-F879 HydrophobicContact CD1-CD1 4.08Å; L874-F879 HydrophobicContact CD1-CE1 4.3Å; L874-F879 HydrophobicContact CD2-CB 3.97Å; L874-F879 HydrophobicContact CD2-CD1 3.89Å; L874-F879 HydrophobicContact CD2-CD2 4.43Å; L874-F879 HydrophobicContact CD2-CE1 4.49Å; L874-F879 HydrophobicContact CD2-CG 3.84Å; L874-F879 HydrophobicContact CG-CD1 4.26Å; L874-F879 WeakPolarHBondContact O-CB 3.46Å; L874-F879 PolarHBondContact O-N 3.39Å; L874-F879 VanDerWaalsContact O-N 3.09Å; L874-F880 HydrophobicContact CB-CD2 4.49Å; L874-F880 HydrophobicContact CB-CE2 3.65Å; L874-F880 HydrophobicContact CB-CZ 3.8Å; L874-F880 HydrophobicContact CD1-CZ 4.13Å; L874-F895 HydrophobicContact CD1-CE1 4.3Å; L874-F895 HydrophobicContact CD1-CZ 3.62Å; L874-I919 HydrophobicContact CD1-CG1 4.21Å; L874-K922 HydrophobicContact CD2-CB 4.27Å; L874-K922 HydrophobicContact CD2-CG 4.08Å
875	L	96.2	Very high	94.3	Very high	7 Å²	7	27.2 Å²	27.2	4%	0.037	16%	0.163	C	C	.	.	H	α-helix	trans	-60.7	-45.8	175.9	-175.9	69.3	0	0	0	111.3	I859 L871 T872 E873 G878 F880 M1016 A1019 A1023 L1028 F1032	I859-L875 HydrophobicContact CG2-CD2 3.81Å; L871-L875 VanDerWaalsContact O-CB 3.24Å; L871-L875 WeakPolarHBondContact O-CB 3.22Å; L871-L875 PolarHBondContact O-N 3.37Å; T872-L875 PolarHBondContact O-N 2.98Å; E873-L875 VanDerWaalsContact C-N 3.29Å; E873-L875 PolarHBondContact O-N 2.98Å; L875-G878 PolarHBondContact O-N 3.43Å; L875-F880 HydrophobicContact CB-CD2 4.32Å; L875-F880 HydrophobicContact CB-CE2 4.28Å; L875-F880 HydrophobicContact CD1-CD2 4.13Å; L875-M1016 HydrophobicContact CB-CE 4.22Å; L875-M1016 HydrophobicContact CD1-CE 4.06Å; L875-M1016 HydrophobicContact CD2-CE 4.39Å; L875-M1016 HydrophobicContact CG-CE 4.47Å; L875-A1019 HydrophobicContact CD2-CB 4.29Å; L875-A1023 HydrophobicContact CD2-CB 4.39Å; L875-L1028 HydrophobicContact CD1-CD1 3.55Å; L875-F1032 HydrophobicContact CD1-CE2 3.84Å; L875-F1032 HydrophobicContact CD1-CZ 4.19Å
876	L	95.3	Very high	94.8	Very high	76 Å²	76	27.8 Å²	27.8	40%	0.398	17%	0.167	S	C	.	.	H	α-helix	trans	-80.6	-25.1	-177.2	-65.1	173.2	0	0	0	113.6	K856 I859 T872 E873 G878	K856-L876 HydrophobicContact CB-CD1 4.46Å; K856-L876 HydrophobicContact CD-CD1 3.97Å; K856-L876 HydrophobicContact CG-CD1 3.5Å; I859-L876 HydrophobicContact CD1-CD1 4.31Å; I859-L876 HydrophobicContact CD1-CD2 4.02Å; I859-L876 HydrophobicContact CD1-CG 4.47Å; T872-L876 HydrophobicContact CG2-CD1 4.04Å; T872-L876 WeakPolarHBondContact O-CG 3.22Å; T872-L876 PolarHBondContact O-N 3.06Å; T872-L876 VanDerWaalsContact O-N 3.11Å; E873-L876 PolarHBondContact O-N 3.07Å; L876-G878 PolarHBondContact O-N 3.41Å
877	D	94.5	Very high	95.5	Very high	95 Å²	95	29 Å²	29	51%	0.508	16%	0.164	S	C	.	.	T	Hydrogen-bonded Turn	trans	-70.5	-7.7	170.6	-73.2	-11.7	0	0	0	112.5	E873 F879 K922	E873-D877 WeakPolarHBondContact O-CB 3.29Å; E873-D877 PolarHBondContact O-N 3.45Å; D877-F879 VanDerWaalsContact C-N 3.27Å; D877-F879 PolarHBondContact O-N 3.39Å; D877-K922 IonicContact OD1-NZ 2.9Å; D877-K922 WeakPolarHBondContact OD2-CE 3.44Å; D877-K922 IonicContact OD2-NZ 3.43Å; D877-K922 PolarHBondContact OD2-NZ 3.02Å
878	G	94.4	Very high	95.7	Very high	32 Å²	32	27.8 Å²	27.8	33%	0.33	16%	0.157	S	C	.	.	T	Hydrogen-bonded Turn	trans	73.9	15.5	-176.6	0	0	0	0	0	113.8	L874 L875 L876 F880 S881	L874-G878 PolarHBondContact O-N 3.38Å; L875-G878 PolarHBondContact O-N 3.43Å; L876-G878 PolarHBondContact O-N 3.41Å; G878-F880 VanDerWaalsContact C-N 3.29Å; G878-F880 PolarHBondContact O-N 3.29Å; G878-S881 WeakPolarHBondContact O-CB 3.28Å; G878-S881 PolarHBondContact O-N 2.8Å
879	F	96	Very high	95.9	Very high	14 Å²	14	26.8 Å²	26.8	6%	0.061	15%	0.152	C	C	.	.	G	3₁₀ helix	trans	-58.6	-39.1	-176.1	171.9	-108.5	0	0	0	112.6	L874 D877 S881 Q882 F883 V891 A915 T918 I919	L874-F879 HydrophobicContact CB-CB 4.14Å; L874-F879 HydrophobicContact CB-CD1 4.09Å; L874-F879 HydrophobicContact CB-CG 4.45Å; L874-F879 HydrophobicContact CD1-CD1 4.08Å; L874-F879 HydrophobicContact CD1-CE1 4.3Å; L874-F879 HydrophobicContact CD2-CB 3.97Å; L874-F879 HydrophobicContact CD2-CD1 3.89Å; L874-F879 HydrophobicContact CD2-CD2 4.43Å; L874-F879 HydrophobicContact CD2-CE1 4.49Å; L874-F879 HydrophobicContact CD2-CG 3.84Å; L874-F879 HydrophobicContact CG-CD1 4.26Å; L874-F879 WeakPolarHBondContact O-CB 3.46Å; L874-F879 PolarHBondContact O-N 3.39Å; L874-F879 VanDerWaalsContact O-N 3.09Å; D877-F879 VanDerWaalsContact C-N 3.27Å; D877-F879 PolarHBondContact O-N 3.39Å; F879-S881 VanDerWaalsContact C-N 3.35Å; F879-Q882 WeakPolarHBondContact O-CG 3.33Å; F879-Q882 PolarHBondContact O-NE2 3.45Å; F879-F883 HydrophobicContact CD1-CE2 4.19Å; F879-F883 HydrophobicContact CD2-CE2 4.31Å; F879-F883 AromaticContact CE1-CE2 3.82Å; F879-F883 HydrophobicContact CE1-CE2 3.82Å; F879-F883 HydrophobicContact CE1-CZ 4.41Å; F879-F883 AromaticContact CE2-CE2 3.93Å; F879-F883 HydrophobicContact CE2-CE2 3.93Å; F879-F883 AromaticContact CE2-CZ 3.93Å; F879-F883 HydrophobicContact CE2-CZ 3.93Å; F879-F883 HydrophobicContact CG-CE2 4.43Å; F879-F883 AromaticContact CZ-CE2 3.68Å; F879-F883 HydrophobicContact CZ-CE2 3.68Å; F879-F883 AromaticContact CZ-CZ 3.82Å; F879-F883 HydrophobicContact CZ-CZ 3.82Å; F879-F883 WeakPolarHBondContact O-CE2 3.21Å; F879-V891 HydrophobicContact CE1-CG1 3.74Å; F879-V891 HydrophobicContact CZ-CG1 4.04Å; F879-A915 HydrophobicContact CZ-CB 4.14Å; F879-T918 HydrophobicContact CD2-CG2 3.77Å; F879-T918 HydrophobicContact CE2-CG2 3.66Å; F879-I919 HydrophobicContact CE1-CD1 3.99Å; F879-I919 HydrophobicContact CE1-CG1 3.94Å; F879-I919 HydrophobicContact CZ-CD1 3.9Å; F879-I919 HydrophobicContact CZ-CG1 3.78Å
880	F	96.1	Very high	95.9	Very high	0 Å²	0	26.5 Å²	26.5	0%	0	15%	0.151	C	C	.	.	G	3₁₀ helix	trans	-75.7	-21.6	-177.9	-61.1	-61	0	0	0	113.6	L871 L874 L875 G878 Q882 F883 L888 M892 M1016 L1028 F1032	L871-F880 HydrophobicContact CD2-CZ 4.13Å; L874-F880 HydrophobicContact CB-CD2 4.49Å; L874-F880 HydrophobicContact CB-CE2 3.65Å; L874-F880 HydrophobicContact CB-CZ 3.8Å; L874-F880 HydrophobicContact CD1-CZ 4.13Å; L875-F880 HydrophobicContact CB-CD2 4.32Å; L875-F880 HydrophobicContact CB-CE2 4.28Å; L875-F880 HydrophobicContact CD1-CD2 4.13Å; G878-F880 VanDerWaalsContact C-N 3.29Å; G878-F880 PolarHBondContact O-N 3.29Å; F880-Q882 PolarHBondContact O-N 3.32Å; F880-F883 PolarHBondContact O-N 3.45Å; F880-L888 HydrophobicContact CB-CD1 3.81Å; F880-L888 HydrophobicContact CD1-CD1 3.53Å; F880-L888 HydrophobicContact CE1-CD1 4.48Å; F880-L888 HydrophobicContact CG-CD1 4Å; F880-M892 HydrophobicContact CD1-SD 4.05Å; F880-M892 HydrophobicContact CE1-CG 4.46Å; F880-M892 HydrophobicContact CE1-SD 3.34Å; F880-M892 WeakPolarHBondContact CE1-SD 3.46Å; F880-M892 HydrophobicContact CZ-SD 3.7Å; F880-M1016 HydrophobicContact CD2-CE 4.33Å; F880-M1016 HydrophobicContact CE2-CE 3.81Å; F880-M1016 HydrophobicContact CZ-CE 4.43Å; F880-L1028 HydrophobicContact CB-CD2 4.14Å; F880-F1032 HydrophobicContact CB-CZ 4.23Å; F880-F1032 HydrophobicContact CD2-CZ 4.02Å; F880-F1032 HydrophobicContact CG-CZ 4.08Å
881	S	94.3	Very high	95.9	Very high	43 Å²	43	26.5 Å²	26.5	30%	0.301	15%	0.151	S	C	.	.	G	3₁₀ helix	trans	-64.4	-28.9	-174	-57.6	0	0	0	0	113.4	G878 F879 F883 K1031	G878-S881 WeakPolarHBondContact O-CB 3.28Å; G878-S881 PolarHBondContact O-N 2.8Å; F879-S881 VanDerWaalsContact C-N 3.35Å; S881-F883 VanDerWaalsContact C-N 3.32Å; S881-F883 PolarHBondContact O-N 3.01Å; S881-K1031 PolarHBondContact O-NZ 3.45Å
882	Q	93.8	Very high	95.9	Very high	112 Å²	112	26.5 Å²	26.5	52%	0.523	15%	0.151	S	C	.	.	G	3₁₀ helix	trans	-75.8	-13.6	-176.3	74.2	-168	-38.1	0	0	114.9	F879 F880	F879-Q882 WeakPolarHBondContact O-CG 3.33Å; F879-Q882 PolarHBondContact O-NE2 3.45Å; F880-Q882 PolarHBondContact O-N 3.32Å
883	F	96	Very high	95.8	Very high	12 Å²	12	26.5 Å²	26.5	5%	0.053	15%	0.151	C	C	.	.	S	Bend	trans	-94.9	146.4	-174.6	-60	-65.4	0	0	0	111.2	F879 F880 S881 Q887 L888 V891 V911 A915 K1031	F879-F883 HydrophobicContact CD1-CE2 4.19Å; F879-F883 HydrophobicContact CD2-CE2 4.31Å; F879-F883 AromaticContact CE1-CE2 3.82Å; F879-F883 HydrophobicContact CE1-CE2 3.82Å; F879-F883 HydrophobicContact CE1-CZ 4.41Å; F879-F883 AromaticContact CE2-CE2 3.93Å; F879-F883 HydrophobicContact CE2-CE2 3.93Å; F879-F883 AromaticContact CE2-CZ 3.93Å; F879-F883 HydrophobicContact CE2-CZ 3.93Å; F879-F883 HydrophobicContact CG-CE2 4.43Å; F879-F883 AromaticContact CZ-CE2 3.68Å; F879-F883 HydrophobicContact CZ-CE2 3.68Å; F879-F883 AromaticContact CZ-CZ 3.82Å; F879-F883 HydrophobicContact CZ-CZ 3.82Å; F879-F883 WeakPolarHBondContact O-CE2 3.21Å; F880-F883 PolarHBondContact O-N 3.45Å; S881-F883 VanDerWaalsContact C-N 3.32Å; S881-F883 PolarHBondContact O-N 3.01Å; F883-Q887 HydrophobicContact CB-CB 3.89Å; F883-Q887 HydrophobicContact CD1-CB 4.12Å; F883-Q887 HydrophobicContact CG-CB 4.39Å; F883-L888 HydrophobicContact CB-CB 4.2Å; F883-V891 HydrophobicContact CD1-CG2 4.2Å; F883-V891 HydrophobicContact CD2-CG2 4.37Å; F883-V891 HydrophobicContact CE1-CG2 3.96Å; F883-V891 HydrophobicContact CE2-CG1 4.31Å; F883-V891 HydrophobicContact CE2-CG2 4.15Å; F883-V891 HydrophobicContact CG-CG2 4.41Å; F883-V891 HydrophobicContact CZ-CG2 3.94Å; F883-V911 HydrophobicContact CD1-CG1 4.24Å; F883-V911 HydrophobicContact CE1-CG1 4.04Å; F883-A915 HydrophobicContact CE1-CB 4.02Å; F883-A915 HydrophobicContact CZ-CB 3.68Å; F883-K1031 WeakPolarHBondContact O-CD 3.42Å
884	S	96.1	Very high	95.6	Very high	48 Å²	48	26 Å²	26	34%	0.336	15%	0.149	S	C	.	.			trans	-67.3	161	163.2	71.4	0	0	0	0	110.4	V886 Q887 L888	S884-V886 PolarHBondContact O-N 3.19Å; S884-Q887 CarbonylContact O-C 3.55Å; S884-Q887 PolarHBondContact O-N 3.46Å; S884-Q887 WeakPolarHBondContact OG-CG 3.18Å; S884-Q887 PolarHBondContact OG-N 3.3Å; S884-L888 VanDerWaalsContact O-CB 3.27Å; S884-L888 WeakPolarHBondContact O-CB 3.23Å; S884-L888 PolarHBondContact O-N 3.11Å
885	P	96.7	Very high	95.5	Very high	20 Å²	20	26.8 Å²	26.8	13%	0.13	15%	0.152	C	C	.	.	H	α-helix	trans	-52.5	-39.2	176.3	-27.3	33.7	0	0	0	114.1	L888 A889 K1031 E1034 L1038	P885-L888 PolarHBondContact O-N 3.38Å; P885-A889 PolarHBondContact O-N 3.44Å; P885-K1031 HydrophobicContact CG-CG 4.19Å; P885-E1034 HydrophobicContact CB-CB 4.16Å; P885-E1034 HydrophobicContact CB-CG 3.93Å; P885-E1034 HydrophobicContact CG-CB 4.19Å; P885-E1034 HydrophobicContact CG-CG 3.9Å; P885-E1034 VanDerWaalsContact CG-OE2 3.28Å; P885-E1034 WeakPolarHBondContact CG-OE2 3.48Å; P885-L1038 HydrophobicContact CB-CD1 3.7Å
886	V	96.7	Very high	95.3	Very high	26 Å²	26	26.8 Å²	26.8	16%	0.158	15%	0.152	C	C	.	.	H	α-helix	trans	-62	-51.9	173.8	171.1	0	0	0	0	111.3	S884 L888 A889 G890 C980 A983 E984 L1038	S884-V886 PolarHBondContact O-N 3.19Å; V886-L888 VanDerWaalsContact C-N 3.26Å; V886-L888 PolarHBondContact O-N 2.88Å; V886-A889 PolarHBondContact O-N 3.48Å; V886-G890 PolarHBondContact O-N 3.23Å; V886-G890 VanDerWaalsContact O-N 3.13Å; V886-C980 HydrophobicContact CG1-CB 4.17Å; V886-A983 HydrophobicContact CB-CB 4.27Å; V886-A983 HydrophobicContact CG1-CB 4.06Å; V886-A983 HydrophobicContact CG2-CB 4.14Å; V886-E984 HydrophobicContact CG1-CG 3.63Å; V886-E984 HydrophobicContact CG2-CG 4.41Å; V886-L1038 HydrophobicContact CG2-CD1 3.82Å
887	Q	96.7	Very high	94.9	Very high	60 Å²	60	23.7 Å²	23.7	28%	0.28	14%	0.137	S	C	.	.	H	α-helix	trans	-65	-35.5	-179.8	-71.1	171	-12.4	0	0	111.2	F883 S884 G890 V891 M912	F883-Q887 HydrophobicContact CB-CB 3.89Å; F883-Q887 HydrophobicContact CD1-CB 4.12Å; F883-Q887 HydrophobicContact CG-CB 4.39Å; S884-Q887 CarbonylContact O-C 3.55Å; S884-Q887 PolarHBondContact O-N 3.46Å; S884-Q887 WeakPolarHBondContact OG-CG 3.18Å; S884-Q887 PolarHBondContact OG-N 3.3Å; Q887-G890 PolarHBondContact O-N 3.2Å; Q887-V891 WeakPolarHBondContact O-CG2 3.38Å; Q887-V891 PolarHBondContact O-N 3.03Å; Q887-M912 HydrophobicContact CB-CE 3.85Å; Q887-M912 HydrophobicContact CG-CE 3.9Å
888	L	96.8	Very high	94.1	Very high	0 Å²	0	24 Å²	24	0%	0	14%	0.136	C	C	.	.	H	α-helix	trans	-62.3	-46.8	176.7	-178	63.3	0	0	0	110.5	F880 F883 S884 P885 V886 G890 V891 M892 K1031 F1032	F880-L888 HydrophobicContact CB-CD1 3.81Å; F880-L888 HydrophobicContact CD1-CD1 3.53Å; F880-L888 HydrophobicContact CE1-CD1 4.48Å; F880-L888 HydrophobicContact CG-CD1 4Å; F883-L888 HydrophobicContact CB-CB 4.2Å; S884-L888 VanDerWaalsContact O-CB 3.27Å; S884-L888 WeakPolarHBondContact O-CB 3.23Å; S884-L888 PolarHBondContact O-N 3.11Å; P885-L888 PolarHBondContact O-N 3.38Å; V886-L888 VanDerWaalsContact C-N 3.26Å; V886-L888 PolarHBondContact O-N 2.88Å; L888-G890 VanDerWaalsContact C-N 3.31Å; L888-G890 PolarHBondContact O-N 3.1Å; L888-V891 PolarHBondContact O-N 3.5Å; L888-M892 HydrophobicContact CD1-CG 4.09Å; L888-M892 HydrophobicContact CG-CG 4.32Å; L888-M892 VanDerWaalsContact O-CB 3.27Å; L888-M892 WeakPolarHBondContact O-CB 3.46Å; L888-M892 WeakPolarHBondContact O-CG 3.33Å; L888-M892 PolarHBondContact O-N 3.17Å; L888-K1031 HydrophobicContact CD2-CB 4.36Å; L888-K1031 HydrophobicContact CD2-CD 4.14Å; L888-K1031 HydrophobicContact CD2-CG 3.79Å; L888-F1032 HydrophobicContact CD1-CE1 3.91Å; L888-F1032 HydrophobicContact CD2-CD1 3.65Å; L888-F1032 HydrophobicContact CD2-CE1 3.77Å; L888-F1032 HydrophobicContact CD2-CG 4.37Å; L888-F1032 HydrophobicContact CG-CD1 4.27Å; L888-F1032 HydrophobicContact CG-CE1 4.09Å
889	A	96.5	Very high	93	Very high	0 Å²	0	28.4 Å²	28.4	0%	0	15%	0.146	C	C	.	.	H	α-helix	trans	-57.5	-45.4	174.1	0	0	0	0	0	111.5	P885 V886 M892 S893 V979 A983 A1035 I1039	P885-A889 PolarHBondContact O-N 3.44Å; V886-A889 PolarHBondContact O-N 3.48Å; A889-M892 PolarHBondContact O-N 3.44Å; A889-S893 PolarHBondContact O-N 3.17Å; A889-S893 VanDerWaalsContact O-N 3.14Å; A889-V979 HydrophobicContact CB-CG1 3.92Å; A889-V979 WeakPolarHBondContact O-CG1 3.46Å; A889-A983 HydrophobicContact CB-CB 4.45Å; A889-A1035 HydrophobicContact CB-CB 4.36Å; A889-I1039 HydrophobicContact CB-CG2 3.96Å
890	G	95.6	Very high	91.6	Very high	0 Å²	0	29.7 Å²	29.7	0%	0	15%	0.152	C	C	.	.	H	α-helix	trans	-59.9	-47.8	175.4	0	0	0	0	0	113.5	V886 Q887 L888 M892 S893 M976	V886-G890 PolarHBondContact O-N 3.23Å; V886-G890 VanDerWaalsContact O-N 3.13Å; Q887-G890 PolarHBondContact O-N 3.2Å; L888-G890 VanDerWaalsContact C-N 3.31Å; L888-G890 PolarHBondContact O-N 3.1Å; G890-M892 PolarHBondContact O-N 3.16Å; G890-S893 WeakPolarHBondContact O-CB 3.3Å; G890-S893 PolarHBondContact O-N 3.13Å; G890-S893 PolarHBondContact O-OG 3.04Å; G890-M976 WeakPolarHBondContact CA-O 3.38Å; G890-M976 WeakPolarHBondContact O-CA 3.46Å; G890-M976 WeakPolarHBondContact O-CB 3.34Å; G890-M976 VanDerWaalsContact O-CG 3.29Å; G890-M976 WeakPolarHBondContact O-CG 3.23Å
891	V	96	Very high	89.9	Confident	0 Å²	0	36 Å²	36	0%	0	19%	0.191	C	C	.	.	H	α-helix	trans	-63.3	-43.5	177.5	172.3	0	0	0	0	111.1	F879 F883 Q887 L888 S893 C894 M912 A915 I919 M976	F879-V891 HydrophobicContact CE1-CG1 3.74Å; F879-V891 HydrophobicContact CZ-CG1 4.04Å; F883-V891 HydrophobicContact CD1-CG2 4.2Å; F883-V891 HydrophobicContact CD2-CG2 4.37Å; F883-V891 HydrophobicContact CE1-CG2 3.96Å; F883-V891 HydrophobicContact CE2-CG1 4.31Å; F883-V891 HydrophobicContact CE2-CG2 4.15Å; F883-V891 HydrophobicContact CG-CG2 4.41Å; F883-V891 HydrophobicContact CZ-CG2 3.94Å; Q887-V891 WeakPolarHBondContact O-CG2 3.38Å; Q887-V891 PolarHBondContact O-N 3.03Å; L888-V891 PolarHBondContact O-N 3.5Å; V891-S893 PolarHBondContact O-N 3.21Å; V891-C894 PolarHBondContact O-N 3.02Å; V891-C894 PolarHBondContact O-SG 3.32Å; V891-M912 HydrophobicContact CG2-CE 4.38Å; V891-M912 HydrophobicContact CG2-SD 3.73Å; V891-A915 HydrophobicContact CG1-CB 4.38Å; V891-A915 HydrophobicContact CG2-CB 3.67Å; V891-I919 HydrophobicContact CG1-CD1 3.86Å; V891-M976 HydrophobicContact CB-CE 4.27Å; V891-M976 HydrophobicContact CG2-CE 3.88Å
892	M	95.7	Very high	88.1	Confident	0 Å²	0	39.6 Å²	39.6	0%	0	20%	0.201	C	C	.	.	H	α-helix	trans	-65.2	-22.1	-179	-72	-63.2	-61.4	0	0	113.1	L871 F880 L888 A889 G890 C894 F895 L1009 L1012 L1013 M1016 F1032	L871-M892 HydrophobicContact CD2-CE 3.9Å; L871-M892 HydrophobicContact CD2-SD 4.28Å; F880-M892 HydrophobicContact CD1-SD 4.05Å; F880-M892 HydrophobicContact CE1-CG 4.46Å; F880-M892 HydrophobicContact CE1-SD 3.34Å; F880-M892 WeakPolarHBondContact CE1-SD 3.46Å; F880-M892 HydrophobicContact CZ-SD 3.7Å; L888-M892 HydrophobicContact CD1-CG 4.09Å; L888-M892 HydrophobicContact CG-CG 4.32Å; L888-M892 VanDerWaalsContact O-CB 3.27Å; L888-M892 WeakPolarHBondContact O-CB 3.46Å; L888-M892 WeakPolarHBondContact O-CG 3.33Å; L888-M892 PolarHBondContact O-N 3.17Å; A889-M892 PolarHBondContact O-N 3.44Å; G890-M892 PolarHBondContact O-N 3.16Å; M892-C894 PolarHBondContact O-N 3.13Å; M892-C894 VanDerWaalsContact O-N 3.16Å; M892-F895 HydrophobicContact CE-CD2 4.43Å; M892-F895 PolarHBondContact O-N 2.92Å; M892-F895 HydrophobicContact SD-CD2 4.21Å; M892-F895 HydrophobicContact SD-CE2 4.22Å; M892-L1009 HydrophobicContact CB-CD1 3.51Å; M892-L1012 HydrophobicContact CE-CD1 3.97Å; M892-L1012 HydrophobicContact CE-CD2 3.54Å; M892-L1012 HydrophobicContact CE-CG 3.51Å; M892-L1013 HydrophobicContact CB-CD2 4.11Å; M892-L1013 HydrophobicContact CG-CD2 3.89Å; M892-M1016 HydrophobicContact CE-CG 3.57Å; M892-M1016 HydrophobicContact CE-SD 4.48Å; M892-F1032 HydrophobicContact CG-CE1 4.49Å; M892-F1032 HydrophobicContact SD-CE1 4.34Å
893	S	94.5	Very high	86.1	Confident	0 Å²	0	42.9 Å²	42.9	0%	0	22%	0.216	C	C	.	.	G	3₁₀ helix	trans	-61.6	-24.2	176.7	83.2	0	0	0	0	112.9	A889 G890 V891 F895 V896 A897 M976	A889-S893 PolarHBondContact O-N 3.17Å; A889-S893 VanDerWaalsContact O-N 3.14Å; G890-S893 WeakPolarHBondContact O-CB 3.3Å; G890-S893 PolarHBondContact O-N 3.13Å; G890-S893 PolarHBondContact O-OG 3.04Å; V891-S893 PolarHBondContact O-N 3.21Å; S893-F895 PolarHBondContact O-N 3.4Å; S893-V896 WeakPolarHBondContact O-CG2 3.15Å; S893-V896 PolarHBondContact O-N 3.07Å; S893-A897 VanDerWaalsContact O-CB 3.3Å; S893-A897 WeakPolarHBondContact O-CB 3.34Å; S893-A897 PolarHBondContact O-N 3.14Å; S893-M976 WeakPolarHBondContact OG-CA 3.4Å
894	C	93.4	Very high	84.2	Confident	0 Å²	0	47.6 Å²	47.6	0%	0	24%	0.238	C	C	.	.	G	3₁₀ helix	trans	-68	-15.3	-179	76.7	0	0	0	0	114.1	V891 M892 I916 F971 V972	V891-C894 PolarHBondContact O-N 3.02Å; V891-C894 PolarHBondContact O-SG 3.32Å; M892-C894 PolarHBondContact O-N 3.13Å; M892-C894 VanDerWaalsContact O-N 3.16Å; C894-I916 HydrophobicContact CB-CD1 4.01Å; C894-F971 WeakPolarHBondContact O-CA 3.45Å; C894-V972 VanDerWaalsContact CA-O 3.24Å; C894-V972 WeakPolarHBondContact CA-O 3.43Å; C894-V972 WeakPolarHBondContact CB-O 3.49Å; C894-V972 PolarHBondContact O-N 2.81Å
895	F	93.8	Very high	82.2	Confident	18 Å²	18	53.9 Å²	53.9	8%	0.079	26%	0.264	C	S	.	.	G	3₁₀ helix	trans	-90.9	-8.8	178.2	-60.7	-79	0	0	0	113.1	M870 L871 L874 M892 S893 I919 F971 L1012	M870-F895 HydrophobicContact CG-CE1 3.83Å; L871-F895 HydrophobicContact CD2-CD1 3.95Å; L871-F895 HydrophobicContact CD2-CD2 3.83Å; L871-F895 HydrophobicContact CD2-CE1 4Å; L871-F895 HydrophobicContact CD2-CE2 3.86Å; L871-F895 HydrophobicContact CD2-CG 3.9Å; L871-F895 HydrophobicContact CD2-CZ 3.95Å; L871-F895 HydrophobicContact CG-CD1 4.23Å; L871-F895 HydrophobicContact CG-CE1 4.38Å; L874-F895 HydrophobicContact CD1-CE1 4.3Å; L874-F895 HydrophobicContact CD1-CZ 3.62Å; M892-F895 HydrophobicContact CE-CD2 4.43Å; M892-F895 PolarHBondContact O-N 2.92Å; M892-F895 HydrophobicContact SD-CD2 4.21Å; M892-F895 HydrophobicContact SD-CE2 4.22Å; S893-F895 PolarHBondContact O-N 3.4Å; F895-I919 HydrophobicContact CE2-CD1 4.36Å; F895-I919 HydrophobicContact CZ-CD1 4.19Å; F895-I919 HydrophobicContact CZ-CG1 4.34Å; F895-I919 HydrophobicContact CZ-CG2 4.39Å; F895-F971 AromaticContact CD1-CD1 3.57Å; F895-F971 HydrophobicContact CD1-CD1 3.57Å; F895-F971 AromaticContact CD1-CE1 3.56Å; F895-F971 HydrophobicContact CD1-CE1 3.56Å; F895-F971 AromaticContact CE1-CD1 3.69Å; F895-F971 HydrophobicContact CE1-CD1 3.69Å; F895-F971 AromaticContact CE1-CE1 3.69Å; F895-F971 HydrophobicContact CE1-CE1 3.69Å; F895-L1012 HydrophobicContact CB-CD2 3.69Å
896	V	91.4	Very high	80.7	Confident	6 Å²	6	55.4 Å²	55.4	4%	0.036	27%	0.271	C	S	.	.	T	Hydrogen-bonded Turn	trans	-127.1	-16.4	-177.2	-62.9	0	0	0	0	114.2	T865 S893 R1008 L1009 L1012	T865-V896 HydrophobicContact CG2-CG1 3.85Å; S893-V896 WeakPolarHBondContact O-CG2 3.15Å; S893-V896 PolarHBondContact O-N 3.07Å; V896-R1008 HydrophobicContact CB-CB 4.08Å; V896-R1008 HydrophobicContact CG1-CB 4.23Å; V896-L1009 HydrophobicContact CG2-CB 3.99Å; V896-L1009 HydrophobicContact CG2-CD1 4.49Å; V896-L1012 HydrophobicContact CG1-CB 4.16Å; V896-L1012 HydrophobicContact CG1-CD2 3.69Å
897	A	86.7	Confident	79.7	Confident	11 Å²	11	60.5 Å²	60.5	9%	0.091	30%	0.297	C	S	.	.	P	Polyproline II helix	trans	-68.6	136.7	-179.9	0	0	0	0	0	112.1	S893 L975	S893-A897 VanDerWaalsContact O-CB 3.3Å; S893-A897 WeakPolarHBondContact O-CB 3.34Å; S893-A897 PolarHBondContact O-N 3.14Å; A897-L975 HydrophobicContact CB-CD1 4.19Å
898	E	78.4	Confident	79.2	Confident	103 Å²	103	58.8 Å²	58.8	48%	0.481	29%	0.29	S	S	.	.	P	Polyproline II helix	trans	-85.4	137.4	173.1	-66.9	169.7	-162.2	0	0	110	Q900 R1004 R1008	E898-Q900 PolarHBondContact O-N 3.23Å; E898-R1004 IonicContact OE1-NH1 3.5Å; E898-R1008 IonicContact OE1-NH1 3.26Å
899	K	72	Confident	78.8	Confident	123 Å²	123	60.6 Å²	60.6	54%	0.535	30%	0.302	S	S	.	.	P	Polyproline II helix	trans	-61.3	123.2	177.9	-169.3	171.7	-176.1	172.4	0	110.2	D969 V972	K899-D969 IonicContact NZ-OD2 2.7Å; K899-D969 PolarHBondContact NZ-OD2 2.96Å; K899-V972 HydrophobicContact CB-CG2 4.1Å; K899-V972 HydrophobicContact CG-CG2 4.31Å
900	Q	66.5	Low	78.6	Confident	41 Å²	41	65.9 Å²	65.9	19%	0.192	34%	0.337	C	S	.	.	P	Polyproline II helix	trans	-77.3	139.2	175.2	-61.3	-166.8	27.5	0	0	110.5	E898 K902 T995 S996	E898-Q900 PolarHBondContact O-N 3.23Å; Q900-K902 PolarHBondContact O-N 3.08Å; Q900-T995 PolarHBondContact NE2-OG1 3.34Å; Q900-S996 PolarHBondContact OE1-OG 3.39Å; Q900-S996 VanDerWaalsContact OE1-OG 3.14Å
901	T	59.2	Low	78.5	Confident	133 Å²	133	68.6 Å²	68.6	82%	0.816	35%	0.353	S	S	*	.	S	Bend	trans	-71	-19.9	178.7	48.6	0	0	0	0	113.4
902	K	57.7	Low	78.4	Confident	119 Å²	119	68.8 Å²	68.8	52%	0.517	35%	0.354	S	S	.	.	S	Bend	trans	-94.3	116.2	176.5	-67.9	-176.4	-178.8	175.3	0	109.3	Q900 H904	Q900-K902 PolarHBondContact O-N 3.08Å; K902-H904 PolarHBondContact O-N 3.42Å
903	H	51.6	Low	78.3	Confident	181 Å²	181	73.6 Å²	73.6	84%	0.838	38%	0.375	S	S	*	.			trans	-68	76	167.2	-74.5	-76.1	0	0	0	110.2
904	H	55.5	Low	78.3	Confident	110 Å²	110	80.3 Å²	80.3	51%	0.509	40%	0.404	S	S	.	.			trans	-85.4	116.8	157.5	-74.7	-66.5	0	0	0	106.9	K902 I906 S996	K902-H904 PolarHBondContact O-N 3.42Å; H904-I906 PolarHBondContact O-N 3.11Å; H904-S996 PolarHBondContact CD2-OG 3.3Å
905	M	53.5	Low	78.4	Confident	181 Å²	181	80.4 Å²	80.4	89%	0.892	41%	0.405	S	S	*	.			trans	-66.3	98.9	172.1	-71.4	-175.6	75	0	0	108.2	N907	M905-N907 PolarHBondContact O-N 3.27Å
906	I	66.5	Low	78.4	Confident	51 Å²	51	80.4 Å²	80.4	26%	0.262	41%	0.406	S	S	.	.			trans	-78.5	121.8	172.7	-61.3	175.8	0	0	0	107.4	H904 L908 D974	H904-I906 PolarHBondContact O-N 3.11Å; I906-L908 VanDerWaalsContact C-N 3.34Å; I906-L908 HydrophobicContact CG2-CD2 4.46Å; I906-L908 PolarHBondContact O-N 3.14Å; I906-D974 HydrophobicContact CD1-CB 3.93Å; I906-D974 WeakPolarHBondContact CD1-O 3.36Å
907	N	75.3	Confident	78.5	Confident	134 Å²	134	86.4 Å²	86.4	72%	0.717	43%	0.431	S	S	*	.			trans	-78.2	86.4	179.1	-92.1	-28.7	0	0	0	110.1	M905	M905-N907 PolarHBondContact O-N 3.27Å
908	L	85.8	Confident	78.9	Confident	24 Å²	24	88.4 Å²	88.4	13%	0.126	44%	0.443	C	S	.	.			trans	-58.6	144	178.6	-70.8	176.6	0	0	0	112.6	I906 M912 K913 I916 G973 M976 D977	I906-L908 VanDerWaalsContact C-N 3.34Å; I906-L908 HydrophobicContact CG2-CD2 4.46Å; I906-L908 PolarHBondContact O-N 3.14Å; L908-M912 HydrophobicContact CB-CB 4.3Å; L908-M912 HydrophobicContact CD2-CB 4.33Å; L908-K913 HydrophobicContact CB-CD 4.34Å; L908-K913 HydrophobicContact CB-CG 3.53Å; L908-K913 VanDerWaalsContact O-CD 3.29Å; L908-K913 WeakPolarHBondContact O-CD 3.46Å; L908-K913 WeakPolarHBondContact O-CE 3.22Å; L908-K913 PolarHBondContact O-NZ 2.76Å; L908-I916 HydrophobicContact CD1-CG2 4.35Å; L908-G973 WeakPolarHBondContact CD2-O 3.38Å; L908-M976 HydrophobicContact CD1-SD 4.28Å; L908-M976 HydrophobicContact CD2-CB 4.16Å; L908-D977 WeakPolarHBondContact CA-OD2 3.41Å
909	S	90	Very high	79.7	Confident	37 Å²	37	83.5 Å²	83.5	26%	0.259	42%	0.42	S	S	.	.			trans	-59.3	153.3	170.8	65.6	0	0	0	0	111.6	V911 M912 K913 D977	S909-V911 PolarHBondContact O-N 3.44Å; S909-M912 PolarHBondContact O-N 2.96Å; S909-M912 VanDerWaalsContact O-N 3.11Å; S909-M912 WeakPolarHBondContact OG-CG 3.37Å; S909-K913 WeakPolarHBondContact O-CG 3.42Å; S909-K913 PolarHBondContact O-N 3.23Å; S909-D977 WeakPolarHBondContact CB-OD1 3.44Å; S909-D977 PolarHBondContact N-OD2 2.66Å; S909-D977 PolarHBondContact OG-OD1 2.99Å
910	P	92.3	Very high	80.8	Confident	111 Å²	111	80 Å²	80	72%	0.721	41%	0.405	S	S	*	.	H	α-helix	trans	-56.7	-34.8	-176.6	-26.6	35	0	0	0	114	K914	P910-K914 PolarHBondContact O-N 3.46Å; P910-K914 VanDerWaalsContact O-N 3.09Å
911	V	92.8	Very high	82.2	Confident	58 Å²	58	81.3 Å²	81.3	35%	0.352	41%	0.413	S	S	.	.	H	α-helix	trans	-66.4	-48	177	-179.7	0	0	0	0	110.5	F883 S909 K914 A915	F883-V911 HydrophobicContact CD1-CG1 4.24Å; F883-V911 HydrophobicContact CE1-CG1 4.04Å; S909-V911 PolarHBondContact O-N 3.44Å; V911-K914 PolarHBondContact O-N 2.94Å; V911-A915 PolarHBondContact O-N 2.9Å
912	M	93.6	Very high	83.9	Confident	3 Å²	3	76.4 Å²	76.4	2%	0.015	38%	0.381	C	S	.	.	H	α-helix	trans	-66.7	-39.7	179.1	-61.8	-56.2	148.3	0	0	112	Q887 V891 L908 S909 K914 A915 I916 M976 D977 C980	Q887-M912 HydrophobicContact CB-CE 3.85Å; Q887-M912 HydrophobicContact CG-CE 3.9Å; V891-M912 HydrophobicContact CG2-CE 4.38Å; V891-M912 HydrophobicContact CG2-SD 3.73Å; L908-M912 HydrophobicContact CB-CB 4.3Å; L908-M912 HydrophobicContact CD2-CB 4.33Å; S909-M912 PolarHBondContact O-N 2.96Å; S909-M912 VanDerWaalsContact O-N 3.11Å; S909-M912 WeakPolarHBondContact OG-CG 3.37Å; M912-K914 VanDerWaalsContact C-N 3.29Å; M912-K914 PolarHBondContact O-N 3.03Å; M912-A915 PolarHBondContact O-N 3.29Å; M912-I916 WeakPolarHBondContact O-CG2 3.3Å; M912-I916 PolarHBondContact O-N 3.08Å; M912-M976 HydrophobicContact CB-CB 4.35Å; M912-M976 HydrophobicContact CB-CE 3.86Å; M912-M976 HydrophobicContact CB-SD 4.16Å; M912-M976 HydrophobicContact CG-CB 4.15Å; M912-M976 HydrophobicContact CG-CE 4.2Å; M912-M976 HydrophobicContact SD-CB 4.13Å; M912-M976 HydrophobicContact SD-CE 3.51Å; M912-M976 VanDerWaalsContact SD-CE 3.51Å; M912-D977 WeakPolarHBondContact CG-OD1 3.33Å; M912-C980 WeakPolarHBondContact CE-SG 3.46Å
913	K	93.3	Very high	85.6	Confident	102 Å²	102	70.7 Å²	70.7	44%	0.443	36%	0.356	S	S	.	.	H	α-helix	trans	-57.8	-39.8	172.4	-75.8	179.6	170.3	146	0	112.5	L908 S909 I916 K917	L908-K913 HydrophobicContact CB-CD 4.34Å; L908-K913 HydrophobicContact CB-CG 3.53Å; L908-K913 VanDerWaalsContact O-CD 3.29Å; L908-K913 WeakPolarHBondContact O-CD 3.46Å; L908-K913 WeakPolarHBondContact O-CE 3.22Å; L908-K913 PolarHBondContact O-NZ 2.76Å; S909-K913 WeakPolarHBondContact O-CG 3.42Å; S909-K913 PolarHBondContact O-N 3.23Å; K913-I916 WeakPolarHBondContact O-CG2 3.38Å; K913-K917 WeakPolarHBondContact O-CB 3.41Å; K913-K917 PolarHBondContact O-N 3.41Å
914	K	94.4	Very high	87.7	Confident	140 Å²	140	66.6 Å²	66.6	61%	0.609	33%	0.333	S	S	*	.	H	α-helix	trans	-70.2	-44.8	175.9	-171.9	-176	176.8	-168.7	0	111.1	P910 V911 M912 K917 T918	P910-K914 PolarHBondContact O-N 3.46Å; P910-K914 VanDerWaalsContact O-N 3.09Å; V911-K914 PolarHBondContact O-N 2.94Å; M912-K914 VanDerWaalsContact C-N 3.29Å; M912-K914 PolarHBondContact O-N 3.03Å; K914-K917 PolarHBondContact O-N 2.9Å; K914-T918 PolarHBondContact O-N 2.79Å; K914-T918 VanDerWaalsContact O-N 3.08Å; K914-T918 PolarHBondContact O-OG1 2.98Å
915	A	95.2	Very high	89.5	Confident	2 Å²	2	66.4 Å²	66.4	2%	0.017	33%	0.329	C	S	.	.	H	α-helix	trans	-60.7	-49.5	-179.5	0	0	0	0	0	112.3	F879 F883 V891 V911 M912 K917 T918 I919 M976	F879-A915 HydrophobicContact CZ-CB 4.14Å; F883-A915 HydrophobicContact CE1-CB 4.02Å; F883-A915 HydrophobicContact CZ-CB 3.68Å; V891-A915 HydrophobicContact CG1-CB 4.38Å; V891-A915 HydrophobicContact CG2-CB 3.67Å; V911-A915 PolarHBondContact O-N 2.9Å; M912-A915 PolarHBondContact O-N 3.29Å; A915-K917 VanDerWaalsContact C-N 3.28Å; A915-K917 PolarHBondContact O-N 3.22Å; A915-T918 PolarHBondContact O-N 3.33Å; A915-T918 VanDerWaalsContact O-N 3.15Å; A915-I919 WeakPolarHBondContact O-CG1 3.43Å; A915-I919 PolarHBondContact O-N 2.86Å; A915-M976 HydrophobicContact CB-CE 4.2Å
916	I	93.7	Very high	91.4	Very high	19 Å²	19	58 Å²	58	10%	0.097	29%	0.287	C	S	.	.	H	α-helix	trans	-63.3	-35.6	179.7	-163.1	65.4	0	0	0	111.7	C894 L908 M912 K913 I919 H920 M976	C894-I916 HydrophobicContact CB-CD1 4.01Å; L908-I916 HydrophobicContact CD1-CG2 4.35Å; M912-I916 WeakPolarHBondContact O-CG2 3.3Å; M912-I916 PolarHBondContact O-N 3.08Å; K913-I916 WeakPolarHBondContact O-CG2 3.38Å; I916-I919 PolarHBondContact O-N 2.73Å; I916-H920 WeakPolarHBondContact O-CB 3.49Å; I916-H920 VanDerWaalsContact O-CG 3.24Å; I916-H920 PolarHBondContact O-N 3.31Å; I916-M976 HydrophobicContact CB-SD 4.18Å; I916-M976 HydrophobicContact CD1-SD 4.3Å
917	K	94.5	Very high	92.5	Very high	132 Å²	132	55.7 Å²	55.7	57%	0.574	28%	0.276	S	S	*	.	H	α-helix	trans	-62.2	-46.1	173.8	-176.6	-179.3	176.5	-178.1	0	111.6	K913 K914 A915 I919 H920 D921	K913-K917 WeakPolarHBondContact O-CB 3.41Å; K913-K917 PolarHBondContact O-N 3.41Å; K914-K917 PolarHBondContact O-N 2.9Å; A915-K917 VanDerWaalsContact C-N 3.28Å; A915-K917 PolarHBondContact O-N 3.22Å; K917-I919 VanDerWaalsContact C-N 3.32Å; K917-I919 PolarHBondContact O-N 2.94Å; K917-H920 PolarHBondContact O-N 3.17Å; K917-D921 PolarHBondContact O-N 2.75Å
918	T	95.4	Very high	93.3	Very high	53 Å²	53	55 Å²	55	33%	0.325	27%	0.266	S	S	.	.	H	α-helix	trans	-61.9	-40.4	176.4	-59.7	0	0	0	0	111.9	F879 K914 A915 D921 K922	F879-T918 HydrophobicContact CD2-CG2 3.77Å; F879-T918 HydrophobicContact CE2-CG2 3.66Å; K914-T918 PolarHBondContact O-N 2.79Å; K914-T918 VanDerWaalsContact O-N 3.08Å; K914-T918 PolarHBondContact O-OG1 2.98Å; A915-T918 PolarHBondContact O-N 3.33Å; A915-T918 VanDerWaalsContact O-N 3.15Å; T918-D921 PolarHBondContact O-N 2.81Å; T918-K922 PolarHBondContact O-N 3.21Å
919	I	95.7	Very high	93.5	Very high	0 Å²	0	54.4 Å²	54.4	0%	0	26%	0.263	C	S	.	.	H	α-helix	trans	-61.4	-47	174.8	-71.7	162.5	0	0	0	110.2	M870 L874 F879 V891 F895 A915 I916 K917 D921 K922 A923 F971	M870-I919 HydrophobicContact CE-CB 4.1Å; M870-I919 HydrophobicContact CE-CG2 3.58Å; M870-I919 WeakPolarHBondContact CE-O 3.44Å; L874-I919 HydrophobicContact CD1-CG1 4.21Å; F879-I919 HydrophobicContact CE1-CD1 3.99Å; F879-I919 HydrophobicContact CE1-CG1 3.94Å; F879-I919 HydrophobicContact CZ-CD1 3.9Å; F879-I919 HydrophobicContact CZ-CG1 3.78Å; V891-I919 HydrophobicContact CG1-CD1 3.86Å; F895-I919 HydrophobicContact CE2-CD1 4.36Å; F895-I919 HydrophobicContact CZ-CD1 4.19Å; F895-I919 HydrophobicContact CZ-CG1 4.34Å; F895-I919 HydrophobicContact CZ-CG2 4.39Å; A915-I919 WeakPolarHBondContact O-CG1 3.43Å; A915-I919 PolarHBondContact O-N 2.86Å; I916-I919 PolarHBondContact O-N 2.73Å; K917-I919 VanDerWaalsContact C-N 3.32Å; K917-I919 PolarHBondContact O-N 2.94Å; I919-D921 PolarHBondContact O-N 3.04Å; I919-K922 PolarHBondContact O-N 3.44Å; I919-A923 VanDerWaalsContact O-CB 3.29Å; I919-A923 WeakPolarHBondContact O-CB 3.38Å; I919-A923 PolarHBondContact O-N 3.22Å; I919-F971 HydrophobicContact CG2-CB 3.84Å; I919-F971 HydrophobicContact CG2-CD2 4.39Å; I919-F971 HydrophobicContact CG2-CG 4Å
920	H	95	Very high	93.6	Very high	49 Å²	49	53.1 Å²	53.1	23%	0.227	25%	0.254	C	S	.	.	H	α-helix	trans	-62.5	-40.7	176.3	-68.2	176	0	0	0	112.4	I916 K917 A923 R924 V968 F971	I916-H920 WeakPolarHBondContact O-CB 3.49Å; I916-H920 VanDerWaalsContact O-CG 3.24Å; I916-H920 PolarHBondContact O-N 3.31Å; K917-H920 PolarHBondContact O-N 3.17Å; H920-A923 PolarHBondContact O-N 3.26Å; H920-R924 WeakPolarHBondContact O-CG 3.25Å; H920-R924 PolarHBondContact O-N 2.81Å; H920-V968 HydrophobicContact CB-CG1 3.85Å; H920-F971 PolarHBondContact NE2-O 2.91Å
921	D	95.2	Very high	93.4	Very high	68 Å²	68	49.2 Å²	49.2	36%	0.364	23%	0.231	S	C	.	.	H	α-helix	trans	-64.6	-41.8	177.7	-67.4	-21.9	0	0	0	111.8	K917 T918 I919 R924 Y925	K917-D921 PolarHBondContact O-N 2.75Å; T918-D921 PolarHBondContact O-N 2.81Å; I919-D921 PolarHBondContact O-N 3.04Å; D921-R924 PolarHBondContact O-N 3.45Å; D921-R924 IonicContact OD1-CZ 3.69Å; D921-R924 IonicContact OD1-NH1 2.79Å; D921-R924 PolarHBondContact OD1-NH1 2.83Å; D921-R924 IonicContact OD1-NH2 2.71Å; D921-Y925 PolarHBondContact O-N 3.27Å; D921-Y925 VanDerWaalsContact O-N 3.16Å
922	K	95.1	Very high	93.2	Very high	30 Å²	30	50.5 Å²	50.5	13%	0.13	23%	0.233	C	C	.	.	H	α-helix	trans	-70.2	-36.2	175.3	-174.4	75.4	178.7	-161.2	0	111.9	M870 E873 L874 D877 T918 I919 R924 Y925 L926	M870-K922 HydrophobicContact CE-CB 3.98Å; M870-K922 HydrophobicContact CE-CG 4.25Å; M870-K922 HydrophobicContact SD-CB 4.1Å; M870-K922 HydrophobicContact SD-CG 3.72Å; E873-K922 VanDerWaalsContact CB-CE 3.46Å; E873-K922 WeakPolarHBondContact OE2-CE 3.24Å; E873-K922 IonicContact OE2-NZ 3.18Å; E873-K922 PolarHBondContact OE2-NZ 2.99Å; L874-K922 HydrophobicContact CD2-CB 4.27Å; L874-K922 HydrophobicContact CD2-CG 4.08Å; D877-K922 IonicContact OD1-NZ 2.9Å; D877-K922 WeakPolarHBondContact OD2-CE 3.44Å; D877-K922 IonicContact OD2-NZ 3.43Å; D877-K922 PolarHBondContact OD2-NZ 3.02Å; T918-K922 PolarHBondContact O-N 3.21Å; I919-K922 PolarHBondContact O-N 3.44Å; K922-R924 PolarHBondContact O-N 2.78Å; K922-Y925 HydrophobicContact CD-CD1 4.38Å; K922-Y925 WeakPolarHBondContact O-CB 3.41Å; K922-Y925 PolarHBondContact O-N 2.89Å; K922-L926 PolarHBondContact O-N 3.1Å
923	A	94.1	Very high	93	Very high	0 Å²	0	50.4 Å²	50.4	0%	0	23%	0.233	C	C	.	.	H	α-helix	trans	-60.8	-43.4	173.2	0	0	0	0	0	111.5	M870 I919 H920 Y925 L926 A927 Y967 V968 F971	M870-A923 HydrophobicContact CE-CB 4.15Å; I919-A923 VanDerWaalsContact O-CB 3.29Å; I919-A923 WeakPolarHBondContact O-CB 3.38Å; I919-A923 PolarHBondContact O-N 3.22Å; H920-A923 PolarHBondContact O-N 3.26Å; A923-Y925 VanDerWaalsContact C-N 3.33Å; A923-Y925 PolarHBondContact O-N 2.79Å; A923-L926 PolarHBondContact O-N 3.48Å; A923-A927 WeakPolarHBondContact O-CB 3.32Å; A923-A927 PolarHBondContact O-N 3.47Å; A923-Y967 HydrophobicContact CB-CD1 3.95Å; A923-Y967 HydrophobicContact CB-CE1 3.95Å; A923-Y967 WeakPolarHBondContact O-CD1 3.35Å; A923-V968 HydrophobicContact CB-CG2 4.06Å; A923-F971 HydrophobicContact CB-CD2 3.99Å; A923-F971 HydrophobicContact CB-CE2 3.76Å
924	R	94.1	Very high	92.6	Very high	94 Å²	94	51.6 Å²	51.6	36%	0.355	24%	0.244	S	C	.	.	H	α-helix	trans	-59.7	-41.3	173	-71.2	-169.4	-146.8	111.9	10.5	112.3	H920 D921 K922 A927 K928 E964 V968	H920-R924 WeakPolarHBondContact O-CG 3.25Å; H920-R924 PolarHBondContact O-N 2.81Å; D921-R924 PolarHBondContact O-N 3.45Å; D921-R924 IonicContact OD1-CZ 3.69Å; D921-R924 IonicContact OD1-NH1 2.79Å; D921-R924 PolarHBondContact OD1-NH1 2.83Å; D921-R924 IonicContact OD1-NH2 2.71Å; K922-R924 PolarHBondContact O-N 2.78Å; R924-A927 PolarHBondContact O-N 2.93Å; R924-K928 WeakPolarHBondContact O-CB 3.36Å; R924-K928 PolarHBondContact O-N 2.95Å; R924-E964 HydrophobicContact CB-CG 4.41Å; R924-E964 VanDerWaalsContact CB-OE1 3.24Å; R924-E964 WeakPolarHBondContact CB-OE1 3.18Å; R924-E964 WeakPolarHBondContact CD-OE1 3.46Å; R924-E964 HydrophobicContact CG-CG 4.11Å; R924-E964 WeakPolarHBondContact CG-OE1 3.42Å; R924-V968 HydrophobicContact CG-CG2 3.65Å
925	Y	93.8	Very high	91.9	Very high	107 Å²	107	45.5 Å²	45.5	42%	0.42	22%	0.218	S	C	.	.	H	α-helix	trans	-60.5	-47.7	175	171.5	-99.9	0	0	0	112.3	D921 K922 A923 K928 M929	D921-Y925 PolarHBondContact O-N 3.27Å; D921-Y925 VanDerWaalsContact O-N 3.16Å; K922-Y925 HydrophobicContact CD-CD1 4.38Å; K922-Y925 WeakPolarHBondContact O-CB 3.41Å; K922-Y925 PolarHBondContact O-N 2.89Å; A923-Y925 VanDerWaalsContact C-N 3.33Å; A923-Y925 PolarHBondContact O-N 2.79Å; Y925-K928 PolarHBondContact O-N 3.29Å; Y925-M929 HydrophobicContact CD1-CG 4.44Å; Y925-M929 HydrophobicContact CD2-CG 4.43Å; Y925-M929 HydrophobicContact CE1-CG 3.97Å; Y925-M929 HydrophobicContact CE2-CE 4.21Å; Y925-M929 HydrophobicContact CE2-CG 3.95Å; Y925-M929 HydrophobicContact CE2-SD 4.16Å; Y925-M929 WeakPolarHBondContact O-CG 3.47Å; Y925-M929 PolarHBondContact O-N 2.77Å
926	L	93.1	Very high	90.3	Very high	3 Å²	3	50 Å²	50	2%	0.016	24%	0.242	C	C	.	.	H	α-helix	trans	-66.9	-38.6	178.9	-69.2	179.3	0	0	0	112.6	L844 M870 E873 K922 A923 K928 M929 S930 Y967	L844-L926 HydrophobicContact CD1-CD2 4.04Å; L844-L926 HydrophobicContact CD2-CD2 4.2Å; M870-L926 HydrophobicContact CB-CD1 3.99Å; M870-L926 HydrophobicContact CG-CD1 4.5Å; M870-L926 HydrophobicContact SD-CD1 3.77Å; E873-L926 HydrophobicContact CG-CD2 4.29Å; K922-L926 PolarHBondContact O-N 3.1Å; A923-L926 PolarHBondContact O-N 3.48Å; L926-K928 VanDerWaalsContact C-N 3.34Å; L926-M929 PolarHBondContact O-N 3.29Å; L926-S930 WeakPolarHBondContact O-CB 3.41Å; L926-S930 PolarHBondContact O-N 3.17Å; L926-S930 PolarHBondContact O-OG 3.2Å; L926-Y967 HydrophobicContact CB-CE1 4.13Å
927	A	90.8	Very high	88.4	Confident	3 Å²	3	50 Å²	50	3%	0.025	24%	0.243	C	C	.	.	H	α-helix	trans	-60.4	-44.8	173.4	0	0	0	0	0	111	A923 R924 S930 A931 E964 Y967	A923-A927 WeakPolarHBondContact O-CB 3.32Å; A923-A927 PolarHBondContact O-N 3.47Å; R924-A927 PolarHBondContact O-N 2.93Å; A927-S930 WeakPolarHBondContact O-CB 3.45Å; A927-S930 PolarHBondContact O-N 2.77Å; A927-A931 WeakPolarHBondContact O-CB 3.31Å; A927-A931 PolarHBondContact O-N 3.39Å; A927-E964 HydrophobicContact CB-CB 4.34Å; A927-E964 HydrophobicContact CB-CG 4.03Å; A927-Y967 HydrophobicContact CB-CD1 4Å; A927-Y967 HydrophobicContact CB-CG 4.37Å
928	K	90.9	Very high	85.8	Confident	119 Å²	119	44.7 Å²	44.7	52%	0.517	23%	0.226	S	C	.	.	H	α-helix	trans	-61.8	-45.6	175.2	-173.5	-179	178.3	-176.4	0	112.4	R924 Y925 L926 S930 A931 E932	R924-K928 WeakPolarHBondContact O-CB 3.36Å; R924-K928 PolarHBondContact O-N 2.95Å; Y925-K928 PolarHBondContact O-N 3.29Å; L926-K928 VanDerWaalsContact C-N 3.34Å; K928-S930 VanDerWaalsContact C-N 3.3Å; K928-S930 PolarHBondContact O-N 3.13Å; K928-A931 PolarHBondContact O-N 3.39Å; K928-E932 VanDerWaalsContact CE-OE1 3.25Å; K928-E932 WeakPolarHBondContact CE-OE1 3.42Å; K928-E932 WeakPolarHBondContact O-CG 3.36Å; K928-E932 PolarHBondContact O-N 3.45Å
929	M	91.1	Very high	83.2	Confident	12 Å²	12	47.4 Å²	47.4	6%	0.059	23%	0.234	C	C	.	.	H	α-helix	trans	-62.6	-38.6	176.9	-69.1	-59.6	96.5	0	0	112.2	L840 L844 Y925 L926 E932 C933	L840-M929 HydrophobicContact CD1-CB 4Å; L844-M929 HydrophobicContact CD2-CG 4.44Å; Y925-M929 HydrophobicContact CD1-CG 4.44Å; Y925-M929 HydrophobicContact CD2-CG 4.43Å; Y925-M929 HydrophobicContact CE1-CG 3.97Å; Y925-M929 HydrophobicContact CE2-CE 4.21Å; Y925-M929 HydrophobicContact CE2-CG 3.95Å; Y925-M929 HydrophobicContact CE2-SD 4.16Å; Y925-M929 WeakPolarHBondContact O-CG 3.47Å; Y925-M929 PolarHBondContact O-N 2.77Å; L926-M929 PolarHBondContact O-N 3.29Å; M929-E932 WeakPolarHBondContact CE-OE1 3.4Å; M929-E932 PolarHBondContact O-N 3.15Å; M929-C933 PolarHBondContact O-N 3.45Å; M929-C933 PolarHBondContact O-SG 3.39Å
930	S	90.9	Very high	80.1	Confident	11 Å²	11	51.5 Å²	51.5	8%	0.077	26%	0.263	C	S	.	.	H	α-helix	trans	-63.3	-47.1	175.5	-58.9	0	0	0	0	111.2	L926 A927 K928 E932 C933 N934 I935 T937	L926-S930 WeakPolarHBondContact O-CB 3.41Å; L926-S930 PolarHBondContact O-N 3.17Å; L926-S930 PolarHBondContact O-OG 3.2Å; A927-S930 WeakPolarHBondContact O-CB 3.45Å; A927-S930 PolarHBondContact O-N 2.77Å; K928-S930 VanDerWaalsContact C-N 3.3Å; K928-S930 PolarHBondContact O-N 3.13Å; S930-E932 PolarHBondContact O-N 3.11Å; S930-C933 CarbonylContact O-C 3.47Å; S930-C933 WeakPolarHBondContact O-CA 3.31Å; S930-C933 PolarHBondContact O-N 3.34Å; S930-N934 PolarHBondContact O-N 3.47Å; S930-I935 CarbonylContact C-O 3.36Å; S930-I935 WeakPolarHBondContact O-CB 3.33Å; S930-I935 PolarHBondContact O-N 3.26Å; S930-T937 VanDerWaalsContact CB-CG2 3.47Å
931	A	88	Confident	77.1	Confident	28 Å²	28	55.7 Å²	55.7	23%	0.231	29%	0.287	C	S	.	.	H	α-helix	trans	-62.1	-41.5	177.2	0	0	0	0	0	112.3	A927 K928 C933 N934 L960	A927-A931 WeakPolarHBondContact O-CB 3.31Å; A927-A931 PolarHBondContact O-N 3.39Å; K928-A931 PolarHBondContact O-N 3.39Å; A931-C933 PolarHBondContact O-N 3.28Å; A931-N934 PolarHBondContact O-N 3.34Å; A931-L960 HydrophobicContact CB-CD2 3.66Å
932	E	89.5	Confident	73.9	Confident	85 Å²	85	58.6 Å²	58.6	40%	0.397	31%	0.313	S	S	.	.	H	α-helix	trans	-64	-20.5	174.8	-72.7	178.9	-158.5	0	0	113.3	R843 K928 M929 S930	R843-E932 IonicContact CZ-OE2 2.72Å; R843-E932 IonicContact NH1-OE2 3.23Å; R843-E932 PolarHBondContact NH1-OE2 2.99Å; R843-E932 IonicContact NH2-OE2 3.15Å; R843-E932 PolarHBondContact NH2-OE2 2.97Å; K928-E932 VanDerWaalsContact CE-OE1 3.25Å; K928-E932 WeakPolarHBondContact CE-OE1 3.42Å; K928-E932 WeakPolarHBondContact O-CG 3.36Å; K928-E932 PolarHBondContact O-N 3.45Å; M929-E932 WeakPolarHBondContact CE-OE1 3.4Å; M929-E932 PolarHBondContact O-N 3.15Å; S930-E932 PolarHBondContact O-N 3.11Å
933	C	88.2	Confident	70.8	Confident	1 Å²	1	65.6 Å²	65.6	1%	0.007	35%	0.346	C	S	.	.	T	Hydrogen-bonded Turn	trans	-94	8.4	174.4	-70.3	0	0	0	0	113.2	A836 L840 M929 S930 A931 I935	A836-C933 VanDerWaalsContact CB-O 3.31Å; A836-C933 WeakPolarHBondContact CB-O 3.41Å; L840-C933 HydrophobicContact CB-CB 4.17Å; M929-C933 PolarHBondContact O-N 3.45Å; M929-C933 PolarHBondContact O-SG 3.39Å; S930-C933 CarbonylContact O-C 3.47Å; S930-C933 WeakPolarHBondContact O-CA 3.31Å; S930-C933 PolarHBondContact O-N 3.34Å; A931-C933 PolarHBondContact O-N 3.28Å; C933-I935 VanDerWaalsContact C-N 3.26Å; C933-I935 HydrophobicContact CB-CD1 4.3Å; C933-I935 HydrophobicContact CB-CG1 4.41Å; C933-I935 PolarHBondContact O-N 3.19Å
934	N	85.2	Confident	67.8	Low	127 Å²	127	74.8 Å²	74.8	68%	0.679	39%	0.386	S	S	*	.	T	Hydrogen-bonded Turn	trans	60.3	31.6	-174.5	-58.5	-28.5	0	0	0	113.5	S930 A931	S930-N934 PolarHBondContact O-N 3.47Å; A931-N934 PolarHBondContact O-N 3.34Å
935	I	79.3	Confident	64.8	Low	13 Å²	13	78 Å²	78	7%	0.067	41%	0.405	C	S	.	.			trans	-94	105.4	168.3	-56.9	166.7	0	0	0	106	A836 R837 L840 S930 C933 T937	A836-I935 HydrophobicContact CB-CG1 3.68Å; R837-I935 HydrophobicContact CB-CD1 4.43Å; R837-I935 HydrophobicContact CG-CD1 3.95Å; R837-I935 HydrophobicContact CG-CG1 4.32Å; L840-I935 HydrophobicContact CB-CD1 3.48Å; L840-I935 VanDerWaalsContact CB-CD1 3.48Å; L840-I935 HydrophobicContact CD2-CD1 3.5Å; L840-I935 VanDerWaalsContact CD2-CD1 3.5Å; L840-I935 HydrophobicContact CG-CD1 4.05Å; S930-I935 CarbonylContact C-O 3.36Å; S930-I935 WeakPolarHBondContact O-CB 3.33Å; S930-I935 PolarHBondContact O-N 3.26Å; C933-I935 VanDerWaalsContact C-N 3.26Å; C933-I935 HydrophobicContact CB-CD1 4.3Å; C933-I935 HydrophobicContact CB-CG1 4.41Å; C933-I935 PolarHBondContact O-N 3.19Å; I935-T937 PolarHBondContact O-N 3.22Å
936	N	63.1	Low	61.8	Low	96 Å²	96	78.4 Å²	78.4	51%	0.513	41%	0.413	S	S	.	.			trans	-66.4	117.6	167.9	-67.9	-7.3	0	0	0	107	G938	N936-G938 PolarHBondContact O-N 3.06Å
937	T	52.3	Low	58.7	Low	20 Å²	20	84.2 Å²	84.2	12%	0.123	45%	0.449	C	S	.	.	S	Bend	trans	-78.3	-6.9	-176.1	51.1	0	0	0	0	111.6	S930 I935 D963 R970	S930-T937 VanDerWaalsContact CB-CG2 3.47Å; I935-T937 PolarHBondContact O-N 3.22Å; T937-D963 PolarHBondContact N-OD2 3.27Å; T937-D963 PolarHBondContact OG1-O 3.14Å; T937-R970 PolarHBondContact O-NH2 3.33Å
938	G	41.6	Very low	55.8	Low	20 Å²	20	87.5 Å²	87.5	21%	0.206	47%	0.469	C	S	.	.	S	Bend	trans	-83	115.5	163.6	0	0	0	0	0	113.1	N936 S940 D963	N936-G938 PolarHBondContact O-N 3.06Å; G938-S940 PolarHBondContact O-N 3.31Å; G938-D963 PolarHBondContact N-OD2 3.18Å
939	H	40.8	Very low	52.9	Low	109 Å²	109	89.7 Å²	89.7	51%	0.505	49%	0.486	S	S	.	.			trans	-67.7	75.4	153.9	-71.3	11	0	0	0	108.4	Y512	Y512-H939 AromaticContact CD2-NE2 3.89Å
940	S	30.4	Very low	50.1	Low	87 Å²	87	95.9 Å²	95.9	61%	0.608	52%	0.524	S	S	*	.			trans	-124.9	92.5	172.4	47.8	0	0	0	0	108.5	G938	G938-S940 PolarHBondContact O-N 3.31Å
941	N	31	Very low	47.3	Very low	137 Å²	137	102.6 Å²	102.6	73%	0.733	55%	0.554	S	S	*	*			trans	13.5	115.8	160	-66.2	-5.5	0	0	0	118	E943	N941-E943 PolarHBondContact O-N 3.07Å
942	S	28.4	Very low	44.8	Very low	128 Å²	128	103.9 Å²	103.9	90%	0.895	56%	0.557	S	S	*	*	T	Hydrogen-bonded Turn	trans	-56.2	24.4	174.1	-30.5	0	0	0	0	117.2
943	E	30.6	Very low	42.1	Very low	178 Å²	178	108.2 Å²	108.2	83%	0.832	58%	0.582	S	S	*	*	T	Hydrogen-bonded Turn	trans	-108.6	-2.7	-170.6	-87.2	-173.5	152.2	0	0	116.6	N941	N941-E943 PolarHBondContact O-N 3.07Å
944	K	30.6	Very low	39.6	Very low	193 Å²	193	116.5 Å²	116.5	84%	0.839	62%	0.621	S	S	*	*	S	Bend	trans	-124.1	5.2	-175.4	-77.4	-173	177.8	179.2	0	118.1	L946	K944-L946 PolarHBondContact O-N 2.83Å
945	Q	31.4	Very low	37.4	Very low	161 Å²	161	114.4 Å²	114.4	75%	0.752	61%	0.609	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84	-0.2	-174.6	-77.7	-174.7	3.2	0	0	116.2
946	L	29.6	Very low	35.4	Very low	115 Å²	115	118 Å²	118	60%	0.602	63%	0.629	S	S	*	*	T	Hydrogen-bonded Turn	trans	-92.4	6.1	-172.2	-127.9	109.7	0	0	0	116.6	E820 K944	E820-L946 VanDerWaalsContact OE1-CD2 3.29Å; E820-L946 WeakPolarHBondContact OE1-CD2 3.38Å; K944-L946 PolarHBondContact O-N 2.83Å
947	T	28.2	Very low	33.9	Very low	125 Å²	125	123.5 Å²	123.5	77%	0.767	64%	0.642	S	S	*	*	S	Bend	trans	-125.2	13.6	-171.4	-18.2	0	0	0	0	116.2
948	T	30.4	Very low	33.2	Very low	72 Å²	72	127.5 Å²	127.5	44%	0.442	66%	0.663	S	S	.	*			trans	-146.6	66.3	179.4	-27.2	0	0	0	0	113	Q951	T948-Q951 HydrophobicContact CG2-CB 4.38Å
949	L	30	Very low	33.3	Very low	165 Å²	165	131.7 Å²	131.7	86%	0.864	68%	0.681	S	S	*	*	S	Bend	trans	-93.1	14.1	179.4	-110.1	155.1	0	0	0	114.6
950	V	31.7	Very low	33.2	Very low	142 Å²	142	131 Å²	131	86%	0.861	68%	0.68	S	S	*	*	S	Bend	trans	-129	-11.3	-177.8	-177.2	0	0	0	0	115.2
951	Q	32.6	Very low	33.9	Very low	152 Å²	152	131.9 Å²	131.9	71%	0.71	68%	0.678	S	S	*	*	S	Bend	trans	-113.6	0.7	-171.8	-80.4	171.8	-23.1	0	0	116.7	T948	T948-Q951 HydrophobicContact CG2-CB 4.38Å
952	N	35.3	Very low	35.4	Very low	55 Å²	55	130.9 Å²	130.9	29%	0.294	67%	0.672	S	S	.	*	T	Hydrogen-bonded Turn	trans	-115.6	52.7	-160.2	-67.3	-24.5	0	0	0	115.8	N955 N956	N952-N955 HydrophobicContact CB-CB 4.44Å; N952-N955 WeakPolarHBondContact OD1-CB 3.27Å; N952-N955 PolarHBondContact OD1-ND2 3.34Å; N952-N956 PolarHBondContact O-ND2 3.27Å
953	L	34	Very low	37.3	Very low	176 Å²	176	126.6 Å²	126.6	92%	0.921	64%	0.639	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.1	-19.1	157.3	-75.8	164.9	0	0	0	112.1
954	E	35.3	Very low	39.7	Very low	175 Å²	175	120.9 Å²	120.9	82%	0.818	61%	0.613	S	S	*	*	S	Bend	trans	-102	-33.7	178.8	-67.3	-175.3	159.6	0	0	114.1	N956	E954-N956 PolarHBondContact O-N 2.91Å
955	N	39.3	Very low	42.3	Very low	83 Å²	83	116.1 Å²	116.1	44%	0.444	59%	0.593	S	S	.	*	T	Hydrogen-bonded Turn	trans	-74.8	-18.2	-179.5	-73.6	-31.6	0	0	0	115.2	N952 R957 N958	N952-N955 HydrophobicContact CB-CB 4.44Å; N952-N955 WeakPolarHBondContact OD1-CB 3.27Å; N952-N955 PolarHBondContact OD1-ND2 3.34Å; N955-R957 PolarHBondContact O-N 2.84Å; N955-N958 PolarHBondContact O-N 3.5Å
956	N	37.2	Very low	44.7	Very low	90 Å²	90	111 Å²	111	48%	0.481	58%	0.578	S	S	.	*	H	α-helix	trans	-62.5	-26.1	179.1	-89.6	-21.4	0	0	0	112.3	N952 E954 L960	N952-N956 PolarHBondContact O-ND2 3.27Å; E954-N956 PolarHBondContact O-N 2.91Å; N956-L960 WeakPolarHBondContact O-CD1 3.28Å; N956-L960 PolarHBondContact O-N 3.3Å
957	R	31.6	Very low	47.4	Very low	210 Å²	210	106.2 Å²	106.2	79%	0.792	55%	0.552	S	S	*	*	H	α-helix	trans	-68.6	-34.4	178.8	-105.8	178.9	162.3	166.4	-4.8	114	N955 L961	N955-R957 PolarHBondContact O-N 2.84Å; R957-L961 WeakPolarHBondContact O-CG 3.22Å
958	N	38	Very low	50.3	Low	104 Å²	104	100.3 Å²	100.3	56%	0.556	52%	0.516	S	S	*	.	H	α-helix	trans	-79.5	-39.5	-175.8	-71.5	-14.2	0	0	0	112.2	N955 L960 L961 D962	N955-N958 PolarHBondContact O-N 3.5Å; N958-L960 VanDerWaalsContact C-N 3.31Å; N958-L960 PolarHBondContact O-N 3.21Å; N958-L961 PolarHBondContact O-N 3.34Å; N958-D962 PolarHBondContact O-N 3.41Å
959	N	42	Very low	53	Low	109 Å²	109	100.1 Å²	100.1	58%	0.583	51%	0.513	S	S	*	.	H	α-helix	trans	-66.9	-31.7	177.2	-71.1	-10.1	0	0	0	112.9	L961 D963	N959-L961 VanDerWaalsContact C-N 3.3Å; N959-L961 PolarHBondContact O-N 3.13Å; N959-D963 PolarHBondContact O-N 3.18Å
960	L	39.3	Very low	55.7	Low	94 Å²	94	98.4 Å²	98.4	49%	0.492	50%	0.495	S	S	.	.	H	α-helix	trans	-64.2	-33.7	174.8	-100.2	121.5	0	0	0	112.6	A931 N956 N958 E964	A931-L960 HydrophobicContact CB-CD2 3.66Å; N956-L960 WeakPolarHBondContact O-CD1 3.28Å; N956-L960 PolarHBondContact O-N 3.3Å; N958-L960 VanDerWaalsContact C-N 3.31Å; N958-L960 PolarHBondContact O-N 3.21Å; L960-E964 PolarHBondContact O-N 3.26Å
961	L	45.9	Very low	58.5	Low	105 Å²	105	92.1 Å²	92.1	55%	0.55	46%	0.456	S	S	.	.	H	α-helix	trans	-71.5	-37.5	-179.6	-70.7	166.6	0	0	0	112	R957 N958 N959 E964 Q965	R957-L961 WeakPolarHBondContact O-CG 3.22Å; N958-L961 PolarHBondContact O-N 3.34Å; N959-L961 VanDerWaalsContact C-N 3.3Å; N959-L961 PolarHBondContact O-N 3.13Å; L961-E964 PolarHBondContact O-N 3.44Å; L961-Q965 PolarHBondContact O-N 2.9Å; L961-Q965 VanDerWaalsContact O-N 3.13Å
962	D	61.6	Low	61.1	Low	116 Å²	116	85.7 Å²	85.7	62%	0.62	43%	0.427	S	S	*	.	H	α-helix	trans	-67.3	-40.7	178.9	-77.4	-13.3	0	0	0	111.9	N958 A966	N958-D962 PolarHBondContact O-N 3.41Å; D962-A966 VanDerWaalsContact O-CB 3.31Å; D962-A966 WeakPolarHBondContact O-CB 3.33Å; D962-A966 PolarHBondContact O-N 2.93Å
963	D	69.6	Low	63.6	Low	38 Å²	38	83.4 Å²	83.4	20%	0.203	42%	0.416	C	S	.	.	H	α-helix	trans	-65.4	-41.5	176.9	-97	17.1	0	0	0	111.9	T937 G938 N959 A966 Y967	T937-D963 PolarHBondContact N-OD2 3.27Å; T937-D963 PolarHBondContact OG1-O 3.14Å; G938-D963 PolarHBondContact N-OD2 3.18Å; N959-D963 PolarHBondContact O-N 3.18Å; D963-A966 PolarHBondContact O-N 2.93Å; D963-Y967 PolarHBondContact O-N 3.38Å; D963-Y967 VanDerWaalsContact O-N 3.14Å
964	E	80.9	Confident	66.1	Low	58 Å²	58	77.2 Å²	77.2	27%	0.271	38%	0.384	S	S	.	.	H	α-helix	trans	-62.3	-48.1	176.8	-176.9	178.7	161.3	0	0	111.4	R924 A927 L960 L961 A966 Y967 V968	R924-E964 HydrophobicContact CB-CG 4.41Å; R924-E964 VanDerWaalsContact CB-OE1 3.24Å; R924-E964 WeakPolarHBondContact CB-OE1 3.18Å; R924-E964 WeakPolarHBondContact CD-OE1 3.46Å; R924-E964 HydrophobicContact CG-CG 4.11Å; R924-E964 WeakPolarHBondContact CG-OE1 3.42Å; A927-E964 HydrophobicContact CB-CB 4.34Å; A927-E964 HydrophobicContact CB-CG 4.03Å; L960-E964 PolarHBondContact O-N 3.26Å; L961-E964 PolarHBondContact O-N 3.44Å; E964-A966 PolarHBondContact O-N 3.41Å; E964-Y967 PolarHBondContact O-N 3.47Å; E964-V968 WeakPolarHBondContact O-CG2 3.46Å; E964-V968 PolarHBondContact O-N 3.28Å
965	Q	84.1	Confident	68.8	Low	93 Å²	93	69.4 Å²	69.4	44%	0.435	35%	0.348	S	S	.	.	H	α-helix	trans	-65.8	-38.8	179.3	-170.4	58.8	44	0	0	111.8	L961 Y967 V968 D969	L961-Q965 PolarHBondContact O-N 2.9Å; L961-Q965 VanDerWaalsContact O-N 3.13Å; Q965-Y967 VanDerWaalsContact C-N 3.27Å; Q965-Y967 PolarHBondContact O-N 3.17Å; Q965-V968 PolarHBondContact O-N 3.26Å; Q965-D969 PolarHBondContact NE2-OD1 3.1Å; Q965-D969 WeakPolarHBondContact O-CB 3.32Å; Q965-D969 PolarHBondContact O-N 3.48Å
966	A	82.4	Confident	71.3	Confident	53 Å²	53	65.5 Å²	65.5	44%	0.438	33%	0.327	S	S	.	.	H	α-helix	trans	-61.9	-33.7	176.9	0	0	0	0	0	112.9	D962 D963 E964	D962-A966 VanDerWaalsContact O-CB 3.31Å; D962-A966 WeakPolarHBondContact O-CB 3.33Å; D962-A966 PolarHBondContact O-N 2.93Å; D963-A966 PolarHBondContact O-N 2.93Å; E964-A966 PolarHBondContact O-N 3.41Å
967	Y	86.3	Confident	74	Confident	15 Å²	15	63.1 Å²	63.1	6%	0.059	31%	0.314	C	S	.	.	H	α-helix	trans	-71.2	-41.1	174.3	-173	-105.6	0	0	0	112	D867 A923 L926 A927 D963 E964 Q965 R970 F971	D867-Y967 PolarHBondContact OD1-OH 3.25Å; D867-Y967 VanDerWaalsContact OD2-CE2 3.24Å; D867-Y967 WeakPolarHBondContact OD2-CE2 3.06Å; D867-Y967 VanDerWaalsContact OD2-CZ 3.26Å; D867-Y967 PolarHBondContact OD2-OH 3.2Å; A923-Y967 HydrophobicContact CB-CD1 3.95Å; A923-Y967 HydrophobicContact CB-CE1 3.95Å; A923-Y967 WeakPolarHBondContact O-CD1 3.35Å; L926-Y967 HydrophobicContact CB-CE1 4.13Å; A927-Y967 HydrophobicContact CB-CD1 4Å; A927-Y967 HydrophobicContact CB-CG 4.37Å; D963-Y967 PolarHBondContact O-N 3.38Å; D963-Y967 VanDerWaalsContact O-N 3.14Å; E964-Y967 PolarHBondContact O-N 3.47Å; Q965-Y967 VanDerWaalsContact C-N 3.27Å; Q965-Y967 PolarHBondContact O-N 3.17Å; Y967-R970 WeakPolarHBondContact O-CB 3.39Å; Y967-R970 PolarHBondContact O-N 3.24Å; Y967-F971 HydrophobicContact CD1-CE2 4.38Å; Y967-F971 HydrophobicContact CE1-CE2 4.09Å; Y967-F971 HydrophobicContact CE1-CZ 4.47Å; Y967-F971 WeakPolarHBondContact O-CE2 3.4Å
968	V	89.7	Confident	76.9	Confident	2 Å²	2	53.4 Å²	53.4	1%	0.012	28%	0.278	C	S	.	.	H	α-helix	trans	-63.8	-41.5	176.5	174.9	0	0	0	0	111.9	H920 A923 R924 E964 Q965 R970 F971	H920-V968 HydrophobicContact CB-CG1 3.85Å; A923-V968 HydrophobicContact CB-CG2 4.06Å; R924-V968 HydrophobicContact CG-CG2 3.65Å; E964-V968 WeakPolarHBondContact O-CG2 3.46Å; E964-V968 PolarHBondContact O-N 3.28Å; Q965-V968 PolarHBondContact O-N 3.26Å; V968-R970 PolarHBondContact O-N 3.36Å; V968-F971 PolarHBondContact O-N 2.93Å; V968-F971 VanDerWaalsContact O-N 3.11Å
969	D	86.7	Confident	79.6	Confident	67 Å²	67	48.5 Å²	48.5	36%	0.358	25%	0.252	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.1	-12.8	-178.1	-96	32.8	0	0	0	114.3	K899 Q965 F971	K899-D969 IonicContact NZ-OD2 2.7Å; K899-D969 PolarHBondContact NZ-OD2 2.96Å; Q965-D969 PolarHBondContact NE2-OD1 3.1Å; Q965-D969 WeakPolarHBondContact O-CB 3.32Å; Q965-D969 PolarHBondContact O-N 3.48Å; D969-F971 VanDerWaalsContact C-N 3.28Å
970	R	86.4	Confident	82.1	Confident	129 Å²	129	43.8 Å²	43.8	49%	0.487	23%	0.228	S	C	.	.	T	Hydrogen-bonded Turn	trans	-69.1	-26	174.4	-62.7	-178.3	-176.9	-177	2.2	112.7	T937 Y967 V968	T937-R970 PolarHBondContact O-NH2 3.33Å; Y967-R970 WeakPolarHBondContact O-CB 3.39Å; Y967-R970 PolarHBondContact O-N 3.24Å; V968-R970 PolarHBondContact O-N 3.36Å
971	F	91	Very high	84.7	Confident	11 Å²	11	39.8 Å²	39.8	5%	0.048	21%	0.208	C	C	.	.	S	Bend	trans	-100	96.4	-175.4	-50.8	-71.7	0	0	0	110.2	D867 M870 C894 F895 I919 H920 A923 Y967 V968 D969	D867-F971 HydrophobicContact CB-CE1 4.22Å; D867-F971 HydrophobicContact CB-CZ 4.16Å; M870-F971 HydrophobicContact CB-CZ 4.31Å; M870-F971 HydrophobicContact CG-CE1 4.25Å; M870-F971 HydrophobicContact CG-CZ 3.99Å; C894-F971 WeakPolarHBondContact O-CA 3.45Å; F895-F971 AromaticContact CD1-CD1 3.57Å; F895-F971 HydrophobicContact CD1-CD1 3.57Å; F895-F971 AromaticContact CD1-CE1 3.56Å; F895-F971 HydrophobicContact CD1-CE1 3.56Å; F895-F971 AromaticContact CE1-CD1 3.69Å; F895-F971 HydrophobicContact CE1-CD1 3.69Å; F895-F971 AromaticContact CE1-CE1 3.69Å; F895-F971 HydrophobicContact CE1-CE1 3.69Å; I919-F971 HydrophobicContact CG2-CB 3.84Å; I919-F971 HydrophobicContact CG2-CD2 4.39Å; I919-F971 HydrophobicContact CG2-CG 4Å; H920-F971 PolarHBondContact NE2-O 2.91Å; A923-F971 HydrophobicContact CB-CD2 3.99Å; A923-F971 HydrophobicContact CB-CE2 3.76Å; Y967-F971 HydrophobicContact CD1-CE2 4.38Å; Y967-F971 HydrophobicContact CE1-CE2 4.09Å; Y967-F971 HydrophobicContact CE1-CZ 4.47Å; Y967-F971 WeakPolarHBondContact O-CE2 3.4Å; V968-F971 PolarHBondContact O-N 2.93Å; V968-F971 VanDerWaalsContact O-N 3.11Å; D969-F971 VanDerWaalsContact C-N 3.28Å
972	V	86.9	Confident	87.1	Confident	16 Å²	16	34.8 Å²	34.8	10%	0.097	18%	0.182	C	C	.	.			trans	-103.1	129.2	-172	-179.5	0	0	0	0	111.3	C894 K899 D974	C894-V972 VanDerWaalsContact CA-O 3.24Å; C894-V972 WeakPolarHBondContact CA-O 3.43Å; C894-V972 WeakPolarHBondContact CB-O 3.49Å; C894-V972 PolarHBondContact O-N 2.81Å; K899-V972 HydrophobicContact CB-CG2 4.1Å; K899-V972 HydrophobicContact CG-CG2 4.31Å; V972-D974 HydrophobicContact CG1-CB 3.89Å; V972-D974 WeakPolarHBondContact CG1-OD2 3.49Å
973	G	87.8	Confident	88.7	Confident	7 Å²	7	29.6 Å²	29.6	7%	0.072	16%	0.155	C	C	.	.			trans	-87.2	-2.6	-177.3	0	0	0	0	0	115.7	L908 L975 M976	L908-G973 WeakPolarHBondContact CD2-O 3.38Å; G973-L975 PolarHBondContact O-N 2.93Å; G973-M976 VanDerWaalsContact CA-SD 3.55Å; G973-M976 WeakPolarHBondContact O-CB 3.44Å; G973-M976 VanDerWaalsContact O-CG 3.23Å; G973-M976 WeakPolarHBondContact O-CG 3.45Å; G973-M976 PolarHBondContact O-N 3.49Å
974	D	86.7	Confident	89.9	Confident	46 Å²	46	34.4 Å²	34.4	25%	0.246	18%	0.176	C	C	.	.	T	Hydrogen-bonded Turn	trans	-57.1	-28.4	-165.8	-64.9	-5.4	0	0	0	114.8	I906 V972	I906-D974 HydrophobicContact CD1-CB 3.93Å; I906-D974 WeakPolarHBondContact CD1-O 3.36Å; V972-D974 HydrophobicContact CG1-CB 3.89Å; V972-D974 WeakPolarHBondContact CG1-OD2 3.49Å
975	L	90.5	Very high	90.5	Very high	12 Å²	12	33.9 Å²	33.9	6%	0.063	19%	0.187	C	C	.	.	T	Hydrogen-bonded Turn	trans	-104.3	3.8	-178.9	-63.6	179.2	0	0	0	114	A897 G973 D977 V978 V979 C1005	A897-L975 HydrophobicContact CB-CD1 4.19Å; G973-L975 PolarHBondContact O-N 2.93Å; L975-D977 PolarHBondContact O-N 2.96Å; L975-V978 HydrophobicContact CD2-CB 4.29Å; L975-V978 HydrophobicContact CD2-CG1 4.48Å; L975-V978 HydrophobicContact CD2-CG2 4.08Å; L975-V978 WeakPolarHBondContact O-CB 3.29Å; L975-V978 PolarHBondContact O-N 3.37Å; L975-V979 WeakPolarHBondContact O-CG2 3.45Å; L975-V979 PolarHBondContact O-N 3.34Å; L975-C1005 HydrophobicContact CD1-CB 3.84Å; L975-C1005 VanDerWaalsContact CD1-SG 3.55Å
976	M	93.6	Very high	90.9	Very high	0 Å²	0	31.5 Å²	31.5	0%	0	18%	0.178	C	C	.	.	H	α-helix	trans	-60.3	-50.8	-174.2	-65.5	172.5	83.1	0	0	112.3	G890 V891 S893 L908 M912 A915 I916 G973 V978 V979 C980	G890-M976 WeakPolarHBondContact CA-O 3.38Å; G890-M976 WeakPolarHBondContact O-CA 3.46Å; G890-M976 WeakPolarHBondContact O-CB 3.34Å; G890-M976 VanDerWaalsContact O-CG 3.29Å; G890-M976 WeakPolarHBondContact O-CG 3.23Å; V891-M976 HydrophobicContact CB-CE 4.27Å; V891-M976 HydrophobicContact CG2-CE 3.88Å; S893-M976 WeakPolarHBondContact OG-CA 3.4Å; L908-M976 HydrophobicContact CD1-SD 4.28Å; L908-M976 HydrophobicContact CD2-CB 4.16Å; M912-M976 HydrophobicContact CB-CB 4.35Å; M912-M976 HydrophobicContact CB-CE 3.86Å; M912-M976 HydrophobicContact CB-SD 4.16Å; M912-M976 HydrophobicContact CG-CB 4.15Å; M912-M976 HydrophobicContact CG-CE 4.2Å; M912-M976 HydrophobicContact SD-CB 4.13Å; M912-M976 HydrophobicContact SD-CE 3.51Å; M912-M976 VanDerWaalsContact SD-CE 3.51Å; A915-M976 HydrophobicContact CB-CE 4.2Å; I916-M976 HydrophobicContact CB-SD 4.18Å; I916-M976 HydrophobicContact CD1-SD 4.3Å; G973-M976 VanDerWaalsContact CA-SD 3.55Å; G973-M976 WeakPolarHBondContact O-CB 3.44Å; G973-M976 VanDerWaalsContact O-CG 3.23Å; G973-M976 WeakPolarHBondContact O-CG 3.45Å; G973-M976 PolarHBondContact O-N 3.49Å; M976-V978 VanDerWaalsContact C-N 3.33Å; M976-V979 PolarHBondContact O-N 2.96Å; M976-C980 PolarHBondContact O-N 3.32Å; M976-C980 PolarHBondContact O-SG 3.36Å
977	D	92.2	Very high	91.4	Very high	41 Å²	41	31.2 Å²	31.2	22%	0.219	17%	0.173	C	C	.	.	H	α-helix	trans	-73	-27	179.1	-72.6	-36.2	0	0	0	112.1	L908 S909 M912 L975 C980 A981	L908-D977 WeakPolarHBondContact CA-OD2 3.41Å; S909-D977 WeakPolarHBondContact CB-OD1 3.44Å; S909-D977 PolarHBondContact N-OD2 2.66Å; S909-D977 PolarHBondContact OG-OD1 2.99Å; M912-D977 WeakPolarHBondContact CG-OD1 3.33Å; L975-D977 PolarHBondContact O-N 2.96Å; D977-C980 PolarHBondContact O-N 3.06Å; D977-A981 WeakPolarHBondContact O-CB 3.49Å; D977-A981 PolarHBondContact O-N 3.06Å
978	V	92.7	Very high	91.7	Very high	5 Å²	5	30.6 Å²	30.6	3%	0.03	17%	0.171	C	C	.	.	H	α-helix	trans	-63	-51.3	172.2	-179.9	0	0	0	0	109	L975 M976 C980 A981 W982 L991 L994 V1002	L975-V978 HydrophobicContact CD2-CB 4.29Å; L975-V978 HydrophobicContact CD2-CG1 4.48Å; L975-V978 HydrophobicContact CD2-CG2 4.08Å; L975-V978 WeakPolarHBondContact O-CB 3.29Å; L975-V978 PolarHBondContact O-N 3.37Å; M976-V978 VanDerWaalsContact C-N 3.33Å; V978-C980 VanDerWaalsContact C-N 3.31Å; V978-C980 PolarHBondContact O-N 2.89Å; V978-A981 PolarHBondContact O-N 2.71Å; V978-W982 PolarHBondContact O-N 3.1Å; V978-L991 HydrophobicContact CB-CD1 4.41Å; V978-L991 HydrophobicContact CG1-CD1 3.48Å; V978-L991 VanDerWaalsContact CG1-CD1 3.48Å; V978-L991 HydrophobicContact CG1-CD2 4.2Å; V978-L991 HydrophobicContact CG1-CG 3.68Å; V978-L991 WeakPolarHBondContact O-CD1 3.44Å; V978-L994 HydrophobicContact CG2-CB 4.25Å; V978-V1002 HydrophobicContact CG1-CG1 4.41Å
979	V	94.9	Very high	91.7	Very high	2 Å²	2	32.5 Å²	32.5	1%	0.012	18%	0.184	C	C	.	.	H	α-helix	trans	-64	-35.7	177.9	173.1	0	0	0	0	111.9	A889 L975 M976 W982 A983 I1006 L1009	A889-V979 HydrophobicContact CB-CG1 3.92Å; A889-V979 WeakPolarHBondContact O-CG1 3.46Å; L975-V979 WeakPolarHBondContact O-CG2 3.45Å; L975-V979 PolarHBondContact O-N 3.34Å; M976-V979 PolarHBondContact O-N 2.96Å; V979-W982 PolarHBondContact O-N 3.33Å; V979-A983 WeakPolarHBondContact O-CB 3.37Å; V979-A983 PolarHBondContact O-N 3.2Å; V979-I1006 HydrophobicContact CG2-CD1 4.49Å; V979-I1006 HydrophobicContact CG2-CG1 4.11Å; V979-L1009 HydrophobicContact CG1-CD2 3.51Å; V979-L1009 HydrophobicContact CG2-CD2 4.31Å
980	C	94.9	Very high	91.9	Very high	10 Å²	10	35.7 Å²	35.7	7%	0.068	19%	0.191	C	C	.	.	H	α-helix	trans	-60.3	-50.4	172.1	-68.4	0	0	0	0	111.5	V886 M912 M976 D977 V978 W982 A983 E984	V886-C980 HydrophobicContact CG1-CB 4.17Å; M912-C980 WeakPolarHBondContact CE-SG 3.46Å; M976-C980 PolarHBondContact O-N 3.32Å; M976-C980 PolarHBondContact O-SG 3.36Å; D977-C980 PolarHBondContact O-N 3.06Å; V978-C980 VanDerWaalsContact C-N 3.31Å; V978-C980 PolarHBondContact O-N 2.89Å; C980-W982 PolarHBondContact O-N 3.41Å; C980-A983 CarbonylContact O-C 3.47Å; C980-A983 PolarHBondContact O-N 3.43Å; C980-E984 WeakPolarHBondContact O-CG 3.38Å; C980-E984 PolarHBondContact O-N 3.48Å
981	A	94.3	Very high	92.1	Very high	10 Å²	10	29.6 Å²	29.6	8%	0.083	17%	0.168	C	C	.	.	H	α-helix	trans	-57.4	-39.7	177.4	0	0	0	0	0	111.6	D977 V978 E984 G985 V986 L991 L994	D977-A981 WeakPolarHBondContact O-CB 3.49Å; D977-A981 PolarHBondContact O-N 3.06Å; V978-A981 PolarHBondContact O-N 2.71Å; A981-E984 PolarHBondContact O-N 3.35Å; A981-G985 PolarHBondContact O-N 3.43Å; A981-V986 HydrophobicContact CB-CB 4.25Å; A981-V986 HydrophobicContact CB-CG2 4Å; A981-V986 WeakPolarHBondContact O-CB 3.06Å; A981-V986 WeakPolarHBondContact O-CG2 3.43Å; A981-V986 PolarHBondContact O-N 3.09Å; A981-L991 HydrophobicContact CB-CD1 4.13Å; A981-L994 HydrophobicContact CB-CD1 3.83Å
982	W	95.7	Very high	91.9	Very high	0 Å²	0	30.2 Å²	30.2	0%	0	17%	0.174	C	C	.	.	H	α-helix	trans	-62.8	-46.6	173.4	-177.5	-107.3	0	0	0	112.5	V978 V979 C980 E984 G985 F988 L991 I1006 I1039 R1041 D1042 I1044	V978-W982 PolarHBondContact O-N 3.1Å; V979-W982 PolarHBondContact O-N 3.33Å; C980-W982 PolarHBondContact O-N 3.41Å; W982-E984 PolarHBondContact O-N 3.47Å; W982-G985 PolarHBondContact O-N 3.2Å; W982-G985 VanDerWaalsContact O-N 3.16Å; W982-F988 HydrophobicContact CH2-CB 4.43Å; W982-F988 HydrophobicContact CH2-CD2 4.46Å; W982-F988 HydrophobicContact CZ3-CB 3.89Å; W982-F988 HydrophobicContact CZ3-CD2 4.06Å; W982-F988 HydrophobicContact CZ3-CG 4.49Å; W982-L991 HydrophobicContact CB-CD1 3.98Å; W982-L991 HydrophobicContact CB-CD2 4.2Å; W982-L991 HydrophobicContact CD2-CD2 4.29Å; W982-L991 HydrophobicContact CE3-CD2 3.81Å; W982-L991 HydrophobicContact CG-CD2 4.48Å; W982-I1006 HydrophobicContact CB-CD1 4.36Å; W982-I1006 HydrophobicContact CG-CD1 4.07Å; W982-I1039 PolarHBondContact NE1-O 3.11Å; W982-R1041 VanDerWaalsContact CE3-NH2 3.31Å; W982-R1041 HydrophobicContact CH2-CG 4.19Å; W982-R1041 HydrophobicContact CZ2-CG 3.49Å; W982-R1041 VanDerWaalsContact CZ2-CG 3.49Å; W982-R1041 WeakPolarHBondContact CZ2-O 3.1Å; W982-R1041 PolarHBondContact O-NE 2.97Å; W982-R1041 PolarHBondContact O-NH2 2.91Å; W982-D1042 HydrophobicContact CH2-CB 4.05Å; W982-I1044 HydrophobicContact CD2-CD1 3.75Å; W982-I1044 HydrophobicContact CE3-CD1 4.27Å; W982-I1044 HydrophobicContact CG-CD1 4.27Å; W982-I1044 HydrophobicContact CH2-CD1 3.94Å; W982-I1044 HydrophobicContact CH2-CG1 3.82Å; W982-I1044 HydrophobicContact CZ2-CB 4.14Å; W982-I1044 HydrophobicContact CZ2-CD1 3.4Å; W982-I1044 VanDerWaalsContact CZ2-CD1 3.4Å; W982-I1044 HydrophobicContact CZ2-CG1 3.48Å; W982-I1044 VanDerWaalsContact CZ2-CG1 3.48Å; W982-I1044 HydrophobicContact CZ3-CD1 4.35Å
983	A	95.6	Very high	91.9	Very high	7 Å²	7	35.3 Å²	35.3	6%	0.058	20%	0.196	C	C	.	.	H	α-helix	trans	-66.8	-22.9	177.1	0	0	0	0	0	113.1	V886 A889 V979 C980 G985 L1038 I1039	V886-A983 HydrophobicContact CB-CB 4.27Å; V886-A983 HydrophobicContact CG1-CB 4.06Å; V886-A983 HydrophobicContact CG2-CB 4.14Å; A889-A983 HydrophobicContact CB-CB 4.45Å; V979-A983 WeakPolarHBondContact O-CB 3.37Å; V979-A983 PolarHBondContact O-N 3.2Å; C980-A983 CarbonylContact O-C 3.47Å; C980-A983 PolarHBondContact O-N 3.43Å; A983-G985 VanDerWaalsContact C-N 3.3Å; A983-L1038 HydrophobicContact CB-CB 4.15Å; A983-I1039 HydrophobicContact CB-CG2 4.27Å
984	E	95.3	Very high	91.8	Very high	139 Å²	139	38.7 Å²	38.7	65%	0.65	21%	0.212	S	C	*	.	T	Hydrogen-bonded Turn	trans	-80.4	-3.4	174.4	-71.9	175.2	171.7	0	0	114.1	V886 C980 A981 W982	V886-E984 HydrophobicContact CG1-CG 3.63Å; V886-E984 HydrophobicContact CG2-CG 4.41Å; C980-E984 WeakPolarHBondContact O-CG 3.38Å; C980-E984 PolarHBondContact O-N 3.48Å; A981-E984 PolarHBondContact O-N 3.35Å; W982-E984 PolarHBondContact O-N 3.47Å
985	G	93.3	Very high	91.8	Very high	47 Å²	47	37.4 Å²	37.4	49%	0.485	21%	0.206	S	C	.	.	T	Hydrogen-bonded Turn	trans	94.5	10	178.2	0	0	0	0	0	115.1	A981 W982 A983 R1041	A981-G985 PolarHBondContact O-N 3.43Å; W982-G985 PolarHBondContact O-N 3.2Å; W982-G985 VanDerWaalsContact O-N 3.16Å; A983-G985 VanDerWaalsContact C-N 3.3Å; G985-R1041 VanDerWaalsContact CA-NH2 3.26Å
986	V	93.3	Very high	91.6	Very high	42 Å²	42	39.7 Å²	39.7	26%	0.255	22%	0.223	S	C	.	.			trans	-63	139.1	176	179.1	0	0	0	0	110.5	A981 R990 R1041	A981-V986 HydrophobicContact CB-CB 4.25Å; A981-V986 HydrophobicContact CB-CG2 4Å; A981-V986 WeakPolarHBondContact O-CB 3.06Å; A981-V986 WeakPolarHBondContact O-CG2 3.43Å; A981-V986 PolarHBondContact O-N 3.09Å; V986-R990 HydrophobicContact CG1-CB 3.64Å; V986-R990 HydrophobicContact CG1-CG 3.62Å; V986-R1041 PolarHBondContact O-NH2 3.13Å
987	S	92.4	Very high	91.3	Very high	47 Å²	47	40.5 Å²	40.5	33%	0.329	23%	0.23	S	C	.	.			trans	-64.7	151.9	178.7	68.3	0	0	0	0	111.9	S989 R990 L991	S987-S989 VanDerWaalsContact C-N 3.28Å; S987-S989 PolarHBondContact O-N 3.34Å; S987-R990 PolarHBondContact O-N 3.3Å; S987-R990 VanDerWaalsContact O-N 3.12Å; S987-L991 WeakPolarHBondContact O-CB 3.4Å; S987-L991 PolarHBondContact O-N 3.34Å
988	F	92.3	Very high	91.1	Very high	3 Å²	3	41.1 Å²	41.1	1%	0.013	23%	0.231	C	C	.	.	H	α-helix	trans	-62.5	-36.4	-178.1	-169.5	-101.7	0	0	0	112.1	L386 L408 W982 R990 L991 C992 E999 V1002 I1003 I1043 I1044	L386-F988 HydrophobicContact CD1-CD1 3.76Å; L386-F988 HydrophobicContact CD1-CE1 4.2Å; L386-F988 HydrophobicContact CD2-CD1 4.04Å; L408-F988 HydrophobicContact CD2-CE1 3.88Å; L408-F988 HydrophobicContact CD2-CZ 4.2Å; W982-F988 HydrophobicContact CH2-CB 4.43Å; W982-F988 HydrophobicContact CH2-CD2 4.46Å; W982-F988 HydrophobicContact CZ3-CB 3.89Å; W982-F988 HydrophobicContact CZ3-CD2 4.06Å; W982-F988 HydrophobicContact CZ3-CG 4.49Å; F988-R990 VanDerWaalsContact C-N 3.32Å; F988-R990 PolarHBondContact O-N 3.22Å; F988-L991 HydrophobicContact CD2-CD2 3.87Å; F988-L991 HydrophobicContact CE2-CD2 4.11Å; F988-L991 VanDerWaalsContact O-CB 3.27Å; F988-L991 WeakPolarHBondContact O-CB 3.31Å; F988-L991 PolarHBondContact O-N 3.12Å; F988-L991 VanDerWaalsContact O-N 3.17Å; F988-C992 WeakPolarHBondContact CE1-SG 3.34Å; F988-C992 PolarHBondContact O-N 3.09Å; F988-C992 PolarHBondContact O-SG 3.38Å; F988-E999 HydrophobicContact CE1-CB 3.92Å; F988-E999 HydrophobicContact CE1-CG 4.11Å; F988-E999 HydrophobicContact CZ-CB 4Å; F988-V1002 HydrophobicContact CE2-CG1 4.29Å; F988-I1003 HydrophobicContact CE2-CD1 4.45Å; F988-I1003 HydrophobicContact CE2-CG1 3.92Å; F988-I1003 HydrophobicContact CZ-CD1 4.08Å; F988-I1003 HydrophobicContact CZ-CG1 3.84Å; F988-I1043 HydrophobicContact CB-CG2 3.71Å; F988-I1043 HydrophobicContact CD1-CD1 4.34Å; F988-I1043 HydrophobicContact CD1-CG2 3.89Å; F988-I1043 HydrophobicContact CD2-CG2 3.75Å; F988-I1043 HydrophobicContact CE1-CG2 4.45Å; F988-I1043 HydrophobicContact CE2-CG2 4.34Å; F988-I1043 HydrophobicContact CG-CG2 3.5Å; F988-I1043 VanDerWaalsContact CG-CG2 3.5Å; F988-I1044 HydrophobicContact CD2-CD1 4.3Å; F988-I1044 HydrophobicContact CD2-CG1 4.18Å; F988-I1044 HydrophobicContact CE2-CD1 4.28Å; F988-I1044 HydrophobicContact CE2-CG1 4.21Å
989	S	90	Very high	91	Very high	42 Å²	42	42.6 Å²	42.6	29%	0.294	24%	0.237	S	C	.	.	H	α-helix	trans	-56.8	-45	173.9	-174.1	0	0	0	0	112.2	S987	S987-S989 VanDerWaalsContact C-N 3.28Å; S987-S989 PolarHBondContact O-N 3.34Å
990	R	89.9	Confident	90.8	Very high	134 Å²	134	42.8 Å²	42.8	51%	0.506	24%	0.24	S	C	.	.	H	α-helix	trans	-72.8	-32.9	178.8	-177.6	61.1	-179.8	179.9	12.3	111.7	V986 S987 F988 C992 E993	V986-R990 HydrophobicContact CG1-CB 3.64Å; V986-R990 HydrophobicContact CG1-CG 3.62Å; S987-R990 PolarHBondContact O-N 3.3Å; S987-R990 VanDerWaalsContact O-N 3.12Å; F988-R990 VanDerWaalsContact C-N 3.32Å; F988-R990 PolarHBondContact O-N 3.22Å; R990-C992 VanDerWaalsContact C-N 3.34Å; R990-E993 WeakPolarHBondContact CD-OE2 3.43Å; R990-E993 IonicContact CZ-OE2 3.35Å; R990-E993 IonicContact NE-OE2 3.74Å; R990-E993 IonicContact NH1-OE2 2.6Å; R990-E993 PolarHBondContact NH1-OE2 3.16Å; R990-E993 WeakPolarHBondContact O-CB 3.5Å; R990-E993 PolarHBondContact O-N 2.92Å
991	L	90.4	Very high	90.5	Very high	0 Å²	0	43.5 Å²	43.5	0%	0	25%	0.245	C	C	.	.	H	α-helix	trans	-59	-44.6	174.9	-169.9	75	0	0	0	111.7	V978 A981 W982 S987 F988 E993 L994 V1002 I1006	V978-L991 HydrophobicContact CB-CD1 4.41Å; V978-L991 HydrophobicContact CG1-CD1 3.48Å; V978-L991 VanDerWaalsContact CG1-CD1 3.48Å; V978-L991 HydrophobicContact CG1-CD2 4.2Å; V978-L991 HydrophobicContact CG1-CG 3.68Å; V978-L991 WeakPolarHBondContact O-CD1 3.44Å; A981-L991 HydrophobicContact CB-CD1 4.13Å; W982-L991 HydrophobicContact CB-CD1 3.98Å; W982-L991 HydrophobicContact CB-CD2 4.2Å; W982-L991 HydrophobicContact CD2-CD2 4.29Å; W982-L991 HydrophobicContact CE3-CD2 3.81Å; W982-L991 HydrophobicContact CG-CD2 4.48Å; S987-L991 WeakPolarHBondContact O-CB 3.4Å; S987-L991 PolarHBondContact O-N 3.34Å; F988-L991 HydrophobicContact CD2-CD2 3.87Å; F988-L991 HydrophobicContact CE2-CD2 4.11Å; F988-L991 VanDerWaalsContact O-CB 3.27Å; F988-L991 WeakPolarHBondContact O-CB 3.31Å; F988-L991 PolarHBondContact O-N 3.12Å; F988-L991 VanDerWaalsContact O-N 3.17Å; L991-E993 PolarHBondContact O-N 3.41Å; L991-L994 WeakPolarHBondContact O-CB 3.2Å; L991-L994 PolarHBondContact O-N 3.46Å; L991-V1002 HydrophobicContact CD2-CG1 3.9Å; L991-I1006 HydrophobicContact CD2-CD1 4.44Å
992	C	86.9	Confident	90.4	Very high	25 Å²	25	43.2 Å²	43.2	17%	0.169	24%	0.242	C	C	.	.	H	α-helix	trans	-63.7	-24.6	179.3	-68.1	0	0	0	0	113.3	F988 R990 L994 E999	F988-C992 WeakPolarHBondContact CE1-SG 3.34Å; F988-C992 PolarHBondContact O-N 3.09Å; F988-C992 PolarHBondContact O-SG 3.38Å; R990-C992 VanDerWaalsContact C-N 3.34Å; C992-L994 VanDerWaalsContact C-N 3.27Å; C992-L994 PolarHBondContact O-N 3.31Å; C992-E999 VanDerWaalsContact SG-CG 3.56Å
993	E	86.9	Confident	90.2	Very high	122 Å²	122	43.2 Å²	43.2	57%	0.57	24%	0.242	S	C	*	.	T	Hydrogen-bonded Turn	trans	-73.4	-18.7	174.9	-63	174.1	-166.6	0	0	113.1	R990 L991 T995	R990-E993 WeakPolarHBondContact CD-OE2 3.43Å; R990-E993 IonicContact CZ-OE2 3.35Å; R990-E993 IonicContact NE-OE2 3.74Å; R990-E993 IonicContact NH1-OE2 2.6Å; R990-E993 PolarHBondContact NH1-OE2 3.16Å; R990-E993 WeakPolarHBondContact O-CB 3.5Å; R990-E993 PolarHBondContact O-N 2.92Å; L991-E993 PolarHBondContact O-N 3.41Å; E993-T995 VanDerWaalsContact C-N 3.34Å
994	L	86.6	Confident	89.9	Confident	79 Å²	79	47.4 Å²	47.4	41%	0.414	26%	0.257	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.1	-9.8	-178.4	-58.7	177.9	0	0	0	113.2	V978 A981 L991 C992	V978-L994 HydrophobicContact CG2-CB 4.25Å; A981-L994 HydrophobicContact CB-CD1 3.83Å; L991-L994 WeakPolarHBondContact O-CB 3.2Å; L991-L994 PolarHBondContact O-N 3.46Å; C992-L994 VanDerWaalsContact C-N 3.27Å; C992-L994 PolarHBondContact O-N 3.31Å
995	T	86.7	Confident	89.7	Confident	18 Å²	18	41.2 Å²	41.2	11%	0.11	23%	0.229	C	C	.	.			trans	-142.8	151.1	-175.3	-170.8	0	0	0	0	112	Q900 E993 A997 V1002	Q900-T995 PolarHBondContact NE2-OG1 3.34Å; E993-T995 VanDerWaalsContact C-N 3.34Å; T995-A997 VanDerWaalsContact C-N 3.29Å; T995-A997 HydrophobicContact CG2-CB 4.05Å; T995-A997 PolarHBondContact OG1-N 2.77Å; T995-V1002 HydrophobicContact CG2-CG2 3.86Å
996	S	86	Confident	89.7	Confident	60 Å²	60	39 Å²	39	42%	0.42	21%	0.206	S	C	.	.	S	Bend	trans	-86	0.5	170.4	54.3	0	0	0	0	113.6	Q900 H904	Q900-S996 PolarHBondContact OE1-OG 3.39Å; Q900-S996 VanDerWaalsContact OE1-OG 3.14Å; H904-S996 PolarHBondContact CD2-OG 3.3Å
997	A	86.3	Confident	89.6	Confident	18 Å²	18	40.6 Å²	40.6	15%	0.149	21%	0.207	C	C	.	.	S	Bend	trans	-66.1	144	175.3	0	0	0	0	0	111	T995 V1002	T995-A997 VanDerWaalsContact C-N 3.29Å; T995-A997 HydrophobicContact CG2-CB 4.05Å; T995-A997 PolarHBondContact OG1-N 2.77Å; A997-V1002 HydrophobicContact CB-CG2 3.88Å
998	F	88.7	Confident	89.6	Confident	53 Å²	53	43 Å²	43	23%	0.232	21%	0.209	C	C	.	.			trans	-57.6	144.8	166.5	-70.3	-82.6	0	0	0	110.9	K344 M345 G1000 S1001 V1002	K344-F998 HydrophobicContact CB-CE2 4.07Å; K344-F998 HydrophobicContact CB-CZ 3.95Å; K344-F998 HydrophobicContact CD-CD2 3.99Å; K344-F998 HydrophobicContact CD-CE2 4Å; M345-F998 HydrophobicContact CG-CZ 3.93Å; F998-G1000 VanDerWaalsContact C-N 3.29Å; F998-G1000 PolarHBondContact O-N 3.14Å; F998-S1001 WeakPolarHBondContact O-CA 3.37Å; F998-S1001 VanDerWaalsContact O-CB 3.29Å; F998-S1001 WeakPolarHBondContact O-CB 3.5Å; F998-S1001 PolarHBondContact O-N 2.92Å; F998-V1002 PolarHBondContact O-N 2.56Å; F998-V1002 VanDerWaalsContact O-N 3.14Å
999	E	91.6	Very high	89.7	Confident	36 Å²	36	42.8 Å²	42.8	17%	0.168	21%	0.208	C	C	.	.	H	α-helix	trans	-55.8	-43.1	-177.8	-62.1	90.6	157.9	0	0	111.7	Q388 L408 F988 C992 S1001 V1002 I1003	Q388-E999 PolarHBondContact NE2-OE2 3.21Å; Q388-E999 VanDerWaalsContact NE2-OE2 3.14Å; L408-E999 HydrophobicContact CD2-CB 3.92Å; L408-E999 HydrophobicContact CG-CB 4.34Å; F988-E999 HydrophobicContact CE1-CB 3.92Å; F988-E999 HydrophobicContact CE1-CG 4.11Å; F988-E999 HydrophobicContact CZ-CB 4Å; C992-E999 VanDerWaalsContact SG-CG 3.56Å; E999-S1001 VanDerWaalsContact C-N 3.3Å; E999-S1001 PolarHBondContact O-N 2.96Å; E999-V1002 PolarHBondContact O-N 2.77Å; E999-I1003 PolarHBondContact O-N 3.36Å
1000	G	89.9	Confident	89.9	Confident	6 Å²	6	42 Å²	42	6%	0.062	20%	0.2	C	C	.	.	H	α-helix	trans	-64.7	-29.5	175.3	0	0	0	0	0	114.1	G406 L407 F998 R1004	G406-G1000 WeakPolarHBondContact O-CA 3.47Å; G406-G1000 PolarHBondContact O-N 2.67Å; L407-G1000 WeakPolarHBondContact O-CA 3.31Å; F998-G1000 VanDerWaalsContact C-N 3.29Å; F998-G1000 PolarHBondContact O-N 3.14Å; G1000-R1004 WeakPolarHBondContact O-CB 3.24Å; G1000-R1004 PolarHBondContact O-N 2.93Å
1001	S	88.6	Confident	89.9	Confident	26 Å²	26	38.8 Å²	38.8	18%	0.182	19%	0.19	C	C	.	.	H	α-helix	trans	-70.5	-39.1	173.6	-77.7	0	0	0	0	111.4	K344 F998 E999 R1004 C1005	K344-S1001 PolarHBondContact NZ-OG 3.22Å; F998-S1001 WeakPolarHBondContact O-CA 3.37Å; F998-S1001 VanDerWaalsContact O-CB 3.29Å; F998-S1001 WeakPolarHBondContact O-CB 3.5Å; F998-S1001 PolarHBondContact O-N 2.92Å; E999-S1001 VanDerWaalsContact C-N 3.3Å; E999-S1001 PolarHBondContact O-N 2.96Å; S1001-R1004 PolarHBondContact O-N 3.41Å; S1001-C1005 PolarHBondContact O-N 2.91Å
1002	V	92.1	Very high	90.1	Very high	3 Å²	3	38.8 Å²	38.8	2%	0.018	19%	0.19	C	C	.	.	H	α-helix	trans	-63.4	-46.8	174.9	179.7	0	0	0	0	110.4	V978 F988 L991 T995 A997 F998 E999 R1004 C1005 I1006	V978-V1002 HydrophobicContact CG1-CG1 4.41Å; F988-V1002 HydrophobicContact CE2-CG1 4.29Å; L991-V1002 HydrophobicContact CD2-CG1 3.9Å; T995-V1002 HydrophobicContact CG2-CG2 3.86Å; A997-V1002 HydrophobicContact CB-CG2 3.88Å; F998-V1002 PolarHBondContact O-N 2.56Å; F998-V1002 VanDerWaalsContact O-N 3.14Å; E999-V1002 PolarHBondContact O-N 2.77Å; V1002-R1004 VanDerWaalsContact C-N 3.35Å; V1002-R1004 PolarHBondContact O-N 2.86Å; V1002-C1005 WeakPolarHBondContact O-CB 3.46Å; V1002-C1005 PolarHBondContact O-N 3.25Å; V1002-I1006 HydrophobicContact CG1-CD1 4.02Å; V1002-I1006 PolarHBondContact O-N 2.97Å
1003	I	92.3	Very high	90.6	Very high	1 Å²	1	37.6 Å²	37.6	1%	0.005	18%	0.182	C	C	.	.	H	α-helix	trans	-58.2	-46.1	176	-69.1	-178.2	0	0	0	111.3	L408 P409 F988 E999 C1005 I1006 R1007 I1044	L408-I1003 HydrophobicContact CD2-CD1 3.32Å; L408-I1003 HydrophobicContact CD2-CG1 4.47Å; P409-I1003 HydrophobicContact CG-CG2 3.93Å; F988-I1003 HydrophobicContact CE2-CD1 4.45Å; F988-I1003 HydrophobicContact CE2-CG1 3.92Å; F988-I1003 HydrophobicContact CZ-CD1 4.08Å; F988-I1003 HydrophobicContact CZ-CG1 3.84Å; E999-I1003 PolarHBondContact O-N 3.36Å; I1003-C1005 VanDerWaalsContact C-N 3.34Å; I1003-C1005 PolarHBondContact O-N 3.44Å; I1003-I1006 PolarHBondContact O-N 3.48Å; I1003-R1007 HydrophobicContact CG2-CG 4.32Å; I1003-R1007 WeakPolarHBondContact O-CG 3.48Å; I1003-R1007 PolarHBondContact O-N 3.28Å; I1003-I1044 HydrophobicContact CG1-CG1 4.2Å; I1003-I1044 HydrophobicContact CG2-CG2 4.18Å
1004	R	88.4	Confident	90.9	Very high	95 Å²	95	34 Å²	34	36%	0.358	17%	0.17	S	C	.	.	H	α-helix	trans	-61.1	-43	178.5	-171.4	-169.8	-55.9	163.9	0.1	112	G405 E898 G1000 S1001 V1002 I1006 R1007 R1008	G405-R1004 PolarHBondContact O-NH2 2.8Å; E898-R1004 IonicContact OE1-NH1 3.5Å; G1000-R1004 WeakPolarHBondContact O-CB 3.24Å; G1000-R1004 PolarHBondContact O-N 2.93Å; S1001-R1004 PolarHBondContact O-N 3.41Å; V1002-R1004 VanDerWaalsContact C-N 3.35Å; V1002-R1004 PolarHBondContact O-N 2.86Å; R1004-I1006 VanDerWaalsContact C-N 3.34Å; R1004-I1006 PolarHBondContact O-N 3.3Å; R1004-R1007 PolarHBondContact O-N 3.27Å; R1004-R1008 WeakPolarHBondContact O-CG 3.38Å; R1004-R1008 PolarHBondContact O-N 3.26Å
1005	C	91.4	Very high	91.2	Very high	9 Å²	9	31.1 Å²	31.1	6%	0.061	15%	0.154	C	C	.	.	H	α-helix	trans	-59	-46.6	177.2	-174.8	0	0	0	0	111.1	L975 S1001 V1002 I1003 R1008 L1009	L975-C1005 HydrophobicContact CD1-CB 3.84Å; L975-C1005 VanDerWaalsContact CD1-SG 3.55Å; S1001-C1005 PolarHBondContact O-N 2.91Å; V1002-C1005 WeakPolarHBondContact O-CB 3.46Å; V1002-C1005 PolarHBondContact O-N 3.25Å; I1003-C1005 VanDerWaalsContact C-N 3.34Å; I1003-C1005 PolarHBondContact O-N 3.44Å; C1005-R1008 PolarHBondContact O-N 3.06Å; C1005-L1009 VanDerWaalsContact O-CB 3.32Å; C1005-L1009 WeakPolarHBondContact O-CB 3.39Å; C1005-L1009 PolarHBondContact O-N 3.46Å
1006	I	94	Very high	91.7	Very high	1 Å²	1	30.2 Å²	30.2	1%	0.005	15%	0.149	C	C	.	.	H	α-helix	trans	-71.2	-35.5	-178.1	-65.5	170.6	0	0	0	111.7	V979 W982 L991 V1002 I1003 R1004 L1009 E1010 I1039 I1044 F1045	V979-I1006 HydrophobicContact CG2-CD1 4.49Å; V979-I1006 HydrophobicContact CG2-CG1 4.11Å; W982-I1006 HydrophobicContact CB-CD1 4.36Å; W982-I1006 HydrophobicContact CG-CD1 4.07Å; L991-I1006 HydrophobicContact CD2-CD1 4.44Å; V1002-I1006 HydrophobicContact CG1-CD1 4.02Å; V1002-I1006 PolarHBondContact O-N 2.97Å; I1003-I1006 PolarHBondContact O-N 3.48Å; R1004-I1006 VanDerWaalsContact C-N 3.34Å; R1004-I1006 PolarHBondContact O-N 3.3Å; I1006-L1009 WeakPolarHBondContact O-CB 3.28Å; I1006-L1009 PolarHBondContact O-N 3.08Å; I1006-E1010 PolarHBondContact O-N 3.38Å; I1006-I1039 HydrophobicContact CG2-CB 4.13Å; I1006-I1039 HydrophobicContact CG2-CD1 4.25Å; I1006-I1044 HydrophobicContact CB-CD1 4.07Å; I1006-I1044 HydrophobicContact CB-CG2 4Å; I1006-I1044 HydrophobicContact CD1-CD1 3.32Å; I1006-I1044 HydrophobicContact CG1-CD1 4.26Å; I1006-I1044 HydrophobicContact CG2-CD1 3.97Å; I1006-I1044 HydrophobicContact CG2-CG2 3.79Å; I1006-F1045 HydrophobicContact CG2-CE2 4.18Å; I1006-F1045 HydrophobicContact CG2-CZ 4.5Å
1007	R	91.1	Very high	92.1	Very high	75 Å²	75	29.1 Å²	29.1	28%	0.283	14%	0.137	S	C	.	.	H	α-helix	trans	-64.2	-43.7	172.2	-73.1	-175.7	179.5	-164.4	-2.1	112.5	I1003 R1004 L1009 E1010 E1011 I1044 F1045 C1046	I1003-R1007 HydrophobicContact CG2-CG 4.32Å; I1003-R1007 WeakPolarHBondContact O-CG 3.48Å; I1003-R1007 PolarHBondContact O-N 3.28Å; R1004-R1007 PolarHBondContact O-N 3.27Å; R1007-L1009 VanDerWaalsContact C-N 3.29Å; R1007-L1009 PolarHBondContact O-N 3.31Å; R1007-E1010 PolarHBondContact O-N 3.33Å; R1007-E1011 PolarHBondContact O-N 3.24Å; R1007-I1044 HydrophobicContact CG-CG2 4.27Å; R1007-I1044 VanDerWaalsContact CZ-O 3.25Å; R1007-I1044 PolarHBondContact NE-O 3.19Å; R1007-I1044 PolarHBondContact NH2-O 2.8Å; R1007-F1045 HydrophobicContact CG-CE1 4.43Å; R1007-C1046 PolarHBondContact NH2-O 3.38Å
1008	R	90.9	Very high	92.5	Very high	96 Å²	96	31.1 Å²	31.1	36%	0.362	15%	0.145	S	C	.	.	H	α-helix	trans	-65.8	-34.2	174.3	-71.2	179.2	70.9	-177.1	2.3	112.1	V896 E898 R1004 C1005 E1011 L1012	V896-R1008 HydrophobicContact CB-CB 4.08Å; V896-R1008 HydrophobicContact CG1-CB 4.23Å; E898-R1008 IonicContact OE1-NH1 3.26Å; R1004-R1008 WeakPolarHBondContact O-CG 3.38Å; R1004-R1008 PolarHBondContact O-N 3.26Å; C1005-R1008 PolarHBondContact O-N 3.06Å; R1008-E1011 PolarHBondContact O-N 3.23Å; R1008-L1012 PolarHBondContact O-N 3.07Å
1009	L	94.7	Very high	92.8	Very high	0 Å²	0	28.6 Å²	28.6	0%	0	13%	0.134	C	C	.	.	H	α-helix	trans	-64.1	-41.7	173.8	176.4	62.1	0	0	0	111.4	M892 V896 V979 C1005 I1006 R1007 E1011 L1012 L1013 I1039	M892-L1009 HydrophobicContact CB-CD1 3.51Å; V896-L1009 HydrophobicContact CG2-CB 3.99Å; V896-L1009 HydrophobicContact CG2-CD1 4.49Å; V979-L1009 HydrophobicContact CG1-CD2 3.51Å; V979-L1009 HydrophobicContact CG2-CD2 4.31Å; C1005-L1009 VanDerWaalsContact O-CB 3.32Å; C1005-L1009 WeakPolarHBondContact O-CB 3.39Å; C1005-L1009 PolarHBondContact O-N 3.46Å; I1006-L1009 WeakPolarHBondContact O-CB 3.28Å; I1006-L1009 PolarHBondContact O-N 3.08Å; R1007-L1009 VanDerWaalsContact C-N 3.29Å; R1007-L1009 PolarHBondContact O-N 3.31Å; L1009-E1011 VanDerWaalsContact C-N 3.34Å; L1009-E1011 PolarHBondContact O-N 3.35Å; L1009-L1012 PolarHBondContact O-N 3.34Å; L1009-L1013 HydrophobicContact CD1-CD1 4.15Å; L1009-L1013 HydrophobicContact CD1-CG 4.02Å; L1009-L1013 HydrophobicContact CG-CD1 3.92Å; L1009-L1013 HydrophobicContact CG-CG 4.26Å; L1009-L1013 WeakPolarHBondContact O-CB 3.49Å; L1009-L1013 VanDerWaalsContact O-CG 3.29Å; L1009-L1013 WeakPolarHBondContact O-CG 3.32Å; L1009-L1013 PolarHBondContact O-N 3.46Å; L1009-I1039 HydrophobicContact CD2-CD1 4.17Å; L1009-I1039 HydrophobicContact CG-CD1 4.07Å
1010	E	94.2	Very high	93.1	Very high	25 Å²	25	26.9 Å²	26.9	12%	0.117	13%	0.126	C	C	.	.	H	α-helix	trans	-59.8	-45.3	175.4	-173.5	-103	-163.4	0	0	111.6	I1006 R1007 L1012 L1013 C1014 V1036 I1039 K1040 F1045	I1006-E1010 PolarHBondContact O-N 3.38Å; R1007-E1010 PolarHBondContact O-N 3.33Å; E1010-L1012 VanDerWaalsContact C-N 3.35Å; E1010-L1012 PolarHBondContact O-N 3.12Å; E1010-L1013 PolarHBondContact O-N 3.1Å; E1010-C1014 WeakPolarHBondContact O-CB 3.45Å; E1010-C1014 PolarHBondContact O-N 3.06Å; E1010-C1014 PolarHBondContact O-SG 3.37Å; E1010-C1014 VanDerWaalsContact O-SG 3.33Å; E1010-V1036 HydrophobicContact CG-CG1 4Å; E1010-I1039 HydrophobicContact CB-CD1 3.9Å; E1010-K1040 IonicContact OE1-NZ 2.7Å; E1010-K1040 PolarHBondContact OE1-NZ 2.93Å; E1010-F1045 HydrophobicContact CB-CE1 4.08Å; E1010-F1045 HydrophobicContact CB-CZ 3.82Å; E1010-F1045 HydrophobicContact CG-CE1 3.99Å; E1010-F1045 HydrophobicContact CG-CZ 4.02Å
1011	E	90.1	Very high	93.4	Very high	66 Å²	66	32.5 Å²	32.5	31%	0.308	15%	0.149	S	C	.	.	H	α-helix	trans	-59.1	-45.1	174.7	-176.4	175	-173.9	0	0	111.9	R1007 R1008 L1009 C1014 Q1015	R1007-E1011 PolarHBondContact O-N 3.24Å; R1008-E1011 PolarHBondContact O-N 3.23Å; L1009-E1011 VanDerWaalsContact C-N 3.34Å; L1009-E1011 PolarHBondContact O-N 3.35Å; E1011-C1014 PolarHBondContact O-N 3.41Å; E1011-Q1015 WeakPolarHBondContact O-CG 3.41Å; E1011-Q1015 PolarHBondContact O-N 3.02Å
1012	L	94.7	Very high	93.6	Very high	0 Å²	0	34 Å²	34	0%	0	16%	0.157	C	C	.	.	H	α-helix	trans	-63	-45.1	176	172.8	55.3	0	0	0	112.2	T865 L871 M892 F895 V896 R1008 L1009 E1010 C1014 Q1015 M1016	T865-L1012 HydrophobicContact CG2-CB 3.97Å; T865-L1012 VanDerWaalsContact O-CD1 3.32Å; T865-L1012 WeakPolarHBondContact O-CD1 3.42Å; L871-L1012 HydrophobicContact CD1-CD1 3.65Å; M892-L1012 HydrophobicContact CE-CD1 3.97Å; M892-L1012 HydrophobicContact CE-CD2 3.54Å; M892-L1012 HydrophobicContact CE-CG 3.51Å; F895-L1012 HydrophobicContact CB-CD2 3.69Å; V896-L1012 HydrophobicContact CG1-CB 4.16Å; V896-L1012 HydrophobicContact CG1-CD2 3.69Å; R1008-L1012 PolarHBondContact O-N 3.07Å; L1009-L1012 PolarHBondContact O-N 3.34Å; E1010-L1012 VanDerWaalsContact C-N 3.35Å; E1010-L1012 PolarHBondContact O-N 3.12Å; L1012-C1014 VanDerWaalsContact C-N 3.31Å; L1012-C1014 PolarHBondContact O-N 3.15Å; L1012-Q1015 WeakPolarHBondContact O-CB 3.47Å; L1012-Q1015 PolarHBondContact O-N 3.09Å; L1012-M1016 HydrophobicContact CD1-CG 3.92Å; L1012-M1016 HydrophobicContact CD1-SD 4.47Å; L1012-M1016 HydrophobicContact CG-CG 4.43Å; L1012-M1016 WeakPolarHBondContact O-CG 3.47Å; L1012-M1016 PolarHBondContact O-N 3.15Å
1013	L	96.2	Very high	93.8	Very high	0 Å²	0	35.1 Å²	35.1	0%	0	17%	0.167	C	C	.	.	H	α-helix	trans	-63.2	-38.3	178.3	-71.1	169.3	0	0	0	111.4	M892 L1009 E1010 M1016 H1017 F1032 A1035 V1036 I1039	M892-L1013 HydrophobicContact CB-CD2 4.11Å; M892-L1013 HydrophobicContact CG-CD2 3.89Å; L1009-L1013 HydrophobicContact CD1-CD1 4.15Å; L1009-L1013 HydrophobicContact CD1-CG 4.02Å; L1009-L1013 HydrophobicContact CG-CD1 3.92Å; L1009-L1013 HydrophobicContact CG-CG 4.26Å; L1009-L1013 WeakPolarHBondContact O-CB 3.49Å; L1009-L1013 VanDerWaalsContact O-CG 3.29Å; L1009-L1013 WeakPolarHBondContact O-CG 3.32Å; L1009-L1013 PolarHBondContact O-N 3.46Å; E1010-L1013 PolarHBondContact O-N 3.1Å; L1013-M1016 PolarHBondContact O-N 3.15Å; L1013-H1017 WeakPolarHBondContact O-CB 3.48Å; L1013-H1017 PolarHBondContact O-N 3.35Å; L1013-F1032 HydrophobicContact CD2-CD1 3.81Å; L1013-F1032 HydrophobicContact CD2-CE1 4.42Å; L1013-A1035 HydrophobicContact CD1-CB 4.08Å; L1013-A1035 HydrophobicContact CD2-CB 4.2Å; L1013-V1036 HydrophobicContact CB-CG2 3.45Å; L1013-V1036 VanDerWaalsContact CB-CG2 3.45Å; L1013-V1036 HydrophobicContact CD1-CG2 4.24Å; L1013-V1036 HydrophobicContact CG-CG2 4.49Å; L1013-I1039 HydrophobicContact CD1-CD1 3.64Å
1014	C	93.6	Very high	93.9	Very high	46 Å²	46	38.1 Å²	38.1	31%	0.311	20%	0.198	S	C	.	.	H	α-helix	trans	-62.3	-41.1	172.6	-74	0	0	0	0	112.2	E1010 E1011 L1012 H1017 N1018	E1010-C1014 WeakPolarHBondContact O-CB 3.45Å; E1010-C1014 PolarHBondContact O-N 3.06Å; E1010-C1014 PolarHBondContact O-SG 3.37Å; E1010-C1014 VanDerWaalsContact O-SG 3.33Å; E1011-C1014 PolarHBondContact O-N 3.41Å; L1012-C1014 VanDerWaalsContact C-N 3.31Å; L1012-C1014 PolarHBondContact O-N 3.15Å; C1014-H1017 WeakPolarHBondContact O-CB 3.45Å; C1014-H1017 PolarHBondContact O-N 3.41Å; C1014-N1018 PolarHBondContact O-N 3.25Å; C1014-N1018 VanDerWaalsContact O-N 3.17Å; C1014-N1018 PolarHBondContact O-ND2 3.44Å
1015	Q	93.7	Very high	94.1	Very high	19 Å²	19	36.1 Å²	36.1	9%	0.089	19%	0.194	C	C	.	.	H	α-helix	trans	-65.7	-41.6	173.8	-70.4	173.1	17.8	0	0	111.9	E862 S864 T865 E1011 L1012 H1017 N1018 A1019	E862-Q1015 WeakPolarHBondContact O-CB 3.37Å; S864-Q1015 PolarHBondContact OG-NE2 3.09Å; T865-Q1015 PolarHBondContact OG1-NE2 3.4Å; T865-Q1015 PolarHBondContact OG1-OE1 2.85Å; E1011-Q1015 WeakPolarHBondContact O-CG 3.41Å; E1011-Q1015 PolarHBondContact O-N 3.02Å; L1012-Q1015 WeakPolarHBondContact O-CB 3.47Å; L1012-Q1015 PolarHBondContact O-N 3.09Å; Q1015-H1017 VanDerWaalsContact C-N 3.34Å; Q1015-H1017 PolarHBondContact O-N 3.2Å; Q1015-N1018 PolarHBondContact O-N 3.42Å; Q1015-A1019 WeakPolarHBondContact O-CB 3.42Å; Q1015-A1019 PolarHBondContact O-N 3.16Å
1016	M	96.5	Very high	94.3	Very high	0 Å²	0	39.1 Å²	39.1	0%	0	22%	0.215	C	C	.	.	H	α-helix	trans	-67.3	-32.8	176.5	-70	-57.4	-66.6	0	0	112.9	I863 L871 L875 F880 M892 L1012 L1013 A1019 A1020 F1032	I863-M1016 HydrophobicContact CD1-SD 3.71Å; I863-M1016 HydrophobicContact CG1-SD 4.14Å; L871-M1016 HydrophobicContact CB-CE 4.38Å; L871-M1016 HydrophobicContact CB-SD 3.99Å; L871-M1016 HydrophobicContact CD1-SD 4.32Å; L871-M1016 HydrophobicContact CD2-CE 4.46Å; L871-M1016 HydrophobicContact CD2-SD 4.18Å; L871-M1016 HydrophobicContact CG-SD 4.4Å; L875-M1016 HydrophobicContact CB-CE 4.22Å; L875-M1016 HydrophobicContact CD1-CE 4.06Å; L875-M1016 HydrophobicContact CD2-CE 4.39Å; L875-M1016 HydrophobicContact CG-CE 4.47Å; F880-M1016 HydrophobicContact CD2-CE 4.33Å; F880-M1016 HydrophobicContact CE2-CE 3.81Å; F880-M1016 HydrophobicContact CZ-CE 4.43Å; M892-M1016 HydrophobicContact CE-CG 3.57Å; M892-M1016 HydrophobicContact CE-SD 4.48Å; L1012-M1016 HydrophobicContact CD1-CG 3.92Å; L1012-M1016 HydrophobicContact CD1-SD 4.47Å; L1012-M1016 HydrophobicContact CG-CG 4.43Å; L1012-M1016 WeakPolarHBondContact O-CG 3.47Å; L1012-M1016 PolarHBondContact O-N 3.15Å; L1013-M1016 PolarHBondContact O-N 3.15Å; M1016-A1019 PolarHBondContact O-N 2.91Å; M1016-A1020 VanDerWaalsContact O-CB 3.3Å; M1016-A1020 WeakPolarHBondContact O-CB 3.4Å; M1016-A1020 PolarHBondContact O-N 3.46Å; M1016-F1032 HydrophobicContact CB-CD1 3.85Å; M1016-F1032 HydrophobicContact CB-CD2 4Å; M1016-F1032 HydrophobicContact CB-CE1 3.78Å; M1016-F1032 HydrophobicContact CB-CE2 3.95Å; M1016-F1032 HydrophobicContact CB-CG 3.98Å; M1016-F1032 HydrophobicContact CB-CZ 3.84Å; M1016-F1032 HydrophobicContact CE-CE1 4.48Å; M1016-F1032 HydrophobicContact CE-CE2 4.28Å; M1016-F1032 HydrophobicContact CE-CZ 3.8Å; M1016-F1032 HydrophobicContact CG-CE1 4.3Å; M1016-F1032 HydrophobicContact CG-CZ 4.41Å
1017	H	95.6	Very high	94.3	Very high	36 Å²	36	44.7 Å²	44.7	17%	0.167	24%	0.241	C	C	.	.	H	α-helix	trans	-59.1	-49.4	169	165.6	81.9	0	0	0	110.8	L1013 C1014 Q1015 A1019 A1020 K1021 E1029 F1032	L1013-H1017 WeakPolarHBondContact O-CB 3.48Å; L1013-H1017 PolarHBondContact O-N 3.35Å; C1014-H1017 WeakPolarHBondContact O-CB 3.45Å; C1014-H1017 PolarHBondContact O-N 3.41Å; Q1015-H1017 VanDerWaalsContact C-N 3.34Å; Q1015-H1017 PolarHBondContact O-N 3.2Å; H1017-A1019 PolarHBondContact O-N 3.33Å; H1017-A1020 PolarHBondContact O-N 3.44Å; H1017-K1021 PolarHBondContact O-N 3.42Å; H1017-E1029 WeakPolarHBondContact CE1-CG 3.31Å; H1017-E1029 IonicContact CE1-OE1 3.64Å; H1017-E1029 WeakPolarHBondContact ND1-CG 3.49Å; H1017-E1029 PolarHBondContact ND1-O 3.42Å; H1017-F1032 HydrophobicContact CB-CB 4.1Å
1018	N	93.9	Very high	94.5	Very high	60 Å²	60	41.1 Å²	41.1	32%	0.321	23%	0.228	S	C	.	.	H	α-helix	trans	-63.5	-40.2	175.7	-68.1	-37.5	0	0	0	112.2	E862 C1014 Q1015 K1021 V1022	E862-N1018 HydrophobicContact CB-CB 4.41Å; C1014-N1018 PolarHBondContact O-N 3.25Å; C1014-N1018 VanDerWaalsContact O-N 3.17Å; C1014-N1018 PolarHBondContact O-ND2 3.44Å; Q1015-N1018 PolarHBondContact O-N 3.42Å; N1018-K1021 WeakPolarHBondContact O-CB 3.31Å; N1018-K1021 PolarHBondContact O-N 2.85Å; N1018-V1022 WeakPolarHBondContact O-CG2 3.48Å; N1018-V1022 PolarHBondContact O-N 3.31Å
1019	A	95.6	Very high	94.7	Very high	0 Å²	0	38.4 Å²	38.4	0%	0	22%	0.219	C	C	.	.	H	α-helix	trans	-62.6	-42.7	176.6	0	0	0	0	0	111.8	I859 E862 I863 L875 Q1015 M1016 H1017 K1021 V1022 A1023	I859-A1019 HydrophobicContact CG2-CB 3.85Å; E862-A1019 HydrophobicContact CB-CB 4.48Å; I863-A1019 HydrophobicContact CD1-CB 4.22Å; I863-A1019 HydrophobicContact CG1-CB 4.08Å; L875-A1019 HydrophobicContact CD2-CB 4.29Å; Q1015-A1019 WeakPolarHBondContact O-CB 3.42Å; Q1015-A1019 PolarHBondContact O-N 3.16Å; M1016-A1019 PolarHBondContact O-N 2.91Å; H1017-A1019 PolarHBondContact O-N 3.33Å; A1019-K1021 VanDerWaalsContact C-N 3.34Å; A1019-V1022 PolarHBondContact O-N 3.34Å; A1019-A1023 WeakPolarHBondContact O-CB 3.33Å; A1019-A1023 PolarHBondContact O-N 3.06Å
1020	A	96.7	Very high	94.8	Very high	0 Å²	0	43.1 Å²	43.1	0%	0	24%	0.244	C	C	.	.	H	α-helix	trans	-65.2	-36.8	175.3	0	0	0	0	0	112.3	M1016 H1017 A1023 G1024 N1025 L1028 E1029 F1032	M1016-A1020 VanDerWaalsContact O-CB 3.3Å; M1016-A1020 WeakPolarHBondContact O-CB 3.4Å; M1016-A1020 PolarHBondContact O-N 3.46Å; H1017-A1020 PolarHBondContact O-N 3.44Å; A1020-A1023 CarbonylContact O-C 3.54Å; A1020-A1023 WeakPolarHBondContact O-CB 3.44Å; A1020-A1023 PolarHBondContact O-N 3.28Å; A1020-G1024 PolarHBondContact O-N 3Å; A1020-G1024 VanDerWaalsContact O-N 3.08Å; A1020-N1025 PolarHBondContact O-N 3.06Å; A1020-L1028 HydrophobicContact CB-CB 4.08Å; A1020-E1029 HydrophobicContact CB-CB 4.27Å; A1020-F1032 HydrophobicContact CB-CD2 4.09Å; A1020-F1032 HydrophobicContact CB-CE2 4.22Å
1021	K	96	Very high	94.9	Very high	125 Å²	125	43.1 Å²	43.1	54%	0.543	24%	0.244	S	C	.	.	H	α-helix	trans	-62.9	-45.8	172.8	-176	177.4	-177.6	173.5	0	111.8	H1017 N1018 A1019 A1023 G1024 E1029	H1017-K1021 PolarHBondContact O-N 3.42Å; N1018-K1021 WeakPolarHBondContact O-CB 3.31Å; N1018-K1021 PolarHBondContact O-N 2.85Å; A1019-K1021 VanDerWaalsContact C-N 3.34Å; K1021-A1023 VanDerWaalsContact C-N 3.27Å; K1021-A1023 PolarHBondContact O-N 3.48Å; K1021-G1024 PolarHBondContact O-N 3.19Å; K1021-G1024 VanDerWaalsContact O-N 3.09Å; K1021-E1029 HydrophobicContact CB-CG 4.46Å
1022	V	94.6	Very high	95.3	Very high	56 Å²	56	40 Å²	40	34%	0.339	23%	0.229	S	C	.	.	H	α-helix	trans	-63.6	-35	174.3	174.5	0	0	0	0	111.5	R858 I859 E862 N1018 A1019 G1024	R858-V1022 HydrophobicContact CB-CG1 3.97Å; I859-V1022 HydrophobicContact CG1-CB 4.37Å; I859-V1022 HydrophobicContact CG1-CG1 3.97Å; E862-V1022 HydrophobicContact CG-CG2 4.01Å; N1018-V1022 WeakPolarHBondContact O-CG2 3.48Å; N1018-V1022 PolarHBondContact O-N 3.31Å; A1019-V1022 PolarHBondContact O-N 3.34Å; V1022-G1024 PolarHBondContact O-N 3.26Å
1023	A	94.6	Very high	95.3	Very high	28 Å²	28	43.5 Å²	43.5	23%	0.231	25%	0.248	C	C	.	.	T	Hydrogen-bonded Turn	trans	-71.5	-12.3	175	0	0	0	0	0	113.9	I859 L875 A1019 A1020 K1021 N1025	I859-A1023 HydrophobicContact CD1-CB 3.57Å; I859-A1023 HydrophobicContact CG1-CB 4.1Å; L875-A1023 HydrophobicContact CD2-CB 4.39Å; A1019-A1023 WeakPolarHBondContact O-CB 3.33Å; A1019-A1023 PolarHBondContact O-N 3.06Å; A1020-A1023 CarbonylContact O-C 3.54Å; A1020-A1023 WeakPolarHBondContact O-CB 3.44Å; A1020-A1023 PolarHBondContact O-N 3.28Å; K1021-A1023 VanDerWaalsContact C-N 3.27Å; K1021-A1023 PolarHBondContact O-N 3.48Å; A1023-N1025 VanDerWaalsContact C-N 3.34Å
1024	G	94.6	Very high	95.3	Very high	64 Å²	64	48.4 Å²	48.4	66%	0.66	27%	0.271	S	S	*	.	T	Hydrogen-bonded Turn	trans	73.1	22.2	-175.7	0	0	0	0	0	114.2	A1020 K1021 V1022	A1020-G1024 PolarHBondContact O-N 3Å; A1020-G1024 VanDerWaalsContact O-N 3.08Å; K1021-G1024 PolarHBondContact O-N 3.19Å; K1021-G1024 VanDerWaalsContact O-N 3.09Å; V1022-G1024 PolarHBondContact O-N 3.26Å
1025	N	93.9	Very high	95.5	Very high	53 Å²	53	46.2 Å²	46.2	28%	0.283	26%	0.256	S	S	.	.			trans	-102.8	86.5	179.9	-171.1	-26	0	0	0	111.1	A1020 A1023 E1027 L1028 E1029	A1020-N1025 PolarHBondContact O-N 3.06Å; A1023-N1025 VanDerWaalsContact C-N 3.34Å; N1025-E1027 VanDerWaalsContact C-N 3.26Å; N1025-E1027 PolarHBondContact O-N 3.07Å; N1025-E1027 PolarHBondContact OD1-N 3.42Å; N1025-L1028 HydrophobicContact CB-CB 4.39Å; N1025-L1028 VanDerWaalsContact ND2-CD1 3.3Å; N1025-L1028 WeakPolarHBondContact ND2-CD1 3.5Å; N1025-L1028 WeakPolarHBondContact ND2-CG 3.08Å; N1025-L1028 PolarHBondContact O-N 3.05Å; N1025-L1028 PolarHBondContact OD1-N 3.34Å; N1025-E1029 WeakPolarHBondContact O-CB 3.35Å; N1025-E1029 PolarHBondContact O-N 3.25Å
1026	S	94.4	Very high	95.6	Very high	71 Å²	71	45.8 Å²	45.8	50%	0.497	25%	0.254	S	S	.	.	H	α-helix	trans	-65.1	-24.9	-179.6	-55.7	0	0	0	0	113.8	N1030	S1026-N1030 PolarHBondContact O-N 3.18Å; S1026-N1030 PolarHBondContact O-ND2 3.33Å
1027	E	94.9	Very high	95.5	Very high	118 Å²	118	51.3 Å²	51.3	55%	0.551	28%	0.283	S	S	*	.	H	α-helix	trans	-67.1	-48.8	175.9	-168.7	-160.2	140.3	0	0	110.5	N1025 N1030 K1031	N1025-E1027 VanDerWaalsContact C-N 3.26Å; N1025-E1027 PolarHBondContact O-N 3.07Å; N1025-E1027 PolarHBondContact OD1-N 3.42Å; E1027-N1030 PolarHBondContact O-N 3.02Å; E1027-K1031 WeakPolarHBondContact O-CB 3.38Å; E1027-K1031 PolarHBondContact O-N 3.13Å; E1027-K1031 IonicContact OE1-NZ 2.84Å; E1027-K1031 PolarHBondContact OE1-NZ 3.47Å
1028	L	95.4	Very high	95.5	Very high	0 Å²	0	52 Å²	52	0%	0	29%	0.288	C	S	.	.	H	α-helix	trans	-69.8	-37.2	177.3	-71.7	-178	0	0	0	112.2	L875 F880 A1020 N1025 N1030 K1031 F1032	L875-L1028 HydrophobicContact CD1-CD1 3.55Å; F880-L1028 HydrophobicContact CB-CD2 4.14Å; A1020-L1028 HydrophobicContact CB-CB 4.08Å; N1025-L1028 HydrophobicContact CB-CB 4.39Å; N1025-L1028 VanDerWaalsContact ND2-CD1 3.3Å; N1025-L1028 WeakPolarHBondContact ND2-CD1 3.5Å; N1025-L1028 WeakPolarHBondContact ND2-CG 3.08Å; N1025-L1028 PolarHBondContact O-N 3.05Å; N1025-L1028 PolarHBondContact OD1-N 3.34Å; L1028-N1030 VanDerWaalsContact C-N 3.28Å; L1028-N1030 PolarHBondContact O-N 3.28Å; L1028-K1031 HydrophobicContact CD2-CD 4.31Å; L1028-K1031 PolarHBondContact O-N 3.14Å; L1028-K1031 VanDerWaalsContact O-N 3.17Å; L1028-F1032 HydrophobicContact CB-CD2 4.26Å; L1028-F1032 HydrophobicContact CB-CE2 4.03Å; L1028-F1032 WeakPolarHBondContact O-CD2 3.3Å; L1028-F1032 PolarHBondContact O-N 3.15Å
1029	E	95.5	Very high	95.5	Very high	40 Å²	40	49.2 Å²	49.2	19%	0.187	27%	0.272	C	S	.	.	H	α-helix	trans	-51.3	-48.8	173.1	-177.6	-175.6	174.4	0	0	111.3	H1017 A1020 K1021 N1025 L1033	H1017-E1029 WeakPolarHBondContact CE1-CG 3.31Å; H1017-E1029 IonicContact CE1-OE1 3.64Å; H1017-E1029 WeakPolarHBondContact ND1-CG 3.49Å; H1017-E1029 PolarHBondContact ND1-O 3.42Å; A1020-E1029 HydrophobicContact CB-CB 4.27Å; K1021-E1029 HydrophobicContact CB-CG 4.46Å; N1025-E1029 WeakPolarHBondContact O-CB 3.35Å; N1025-E1029 PolarHBondContact O-N 3.25Å; E1029-L1033 WeakPolarHBondContact O-CB 3.25Å; E1029-L1033 PolarHBondContact O-N 2.98Å
1030	N	96.2	Very high	95.4	Very high	99 Å²	99	54.5 Å²	54.5	53%	0.529	30%	0.295	S	S	.	.	H	α-helix	trans	-69.7	-40.3	177.6	-72.7	-48.3	0	0	0	112.3	S1026 E1027 L1028 L1033 E1034	S1026-N1030 PolarHBondContact O-N 3.18Å; S1026-N1030 PolarHBondContact O-ND2 3.33Å; E1027-N1030 PolarHBondContact O-N 3.02Å; L1028-N1030 VanDerWaalsContact C-N 3.28Å; L1028-N1030 PolarHBondContact O-N 3.28Å; N1030-L1033 PolarHBondContact O-N 3.02Å; N1030-E1034 WeakPolarHBondContact O-CB 3.45Å; N1030-E1034 PolarHBondContact O-N 3.24Å
1031	K	96.4	Very high	95.1	Very high	25 Å²	25	57.1 Å²	57.1	11%	0.109	31%	0.305	C	S	.	.	H	α-helix	trans	-65.3	-39.8	-179.6	-162.7	177.6	-72.5	165.2	0	112.5	S881 F883 P885 L888 E1027 L1028 E1034 A1035	S881-K1031 PolarHBondContact O-NZ 3.45Å; F883-K1031 WeakPolarHBondContact O-CD 3.42Å; P885-K1031 HydrophobicContact CG-CG 4.19Å; L888-K1031 HydrophobicContact CD2-CB 4.36Å; L888-K1031 HydrophobicContact CD2-CD 4.14Å; L888-K1031 HydrophobicContact CD2-CG 3.79Å; E1027-K1031 WeakPolarHBondContact O-CB 3.38Å; E1027-K1031 PolarHBondContact O-N 3.13Å; E1027-K1031 IonicContact OE1-NZ 2.84Å; E1027-K1031 PolarHBondContact OE1-NZ 3.47Å; L1028-K1031 HydrophobicContact CD2-CD 4.31Å; L1028-K1031 PolarHBondContact O-N 3.14Å; L1028-K1031 VanDerWaalsContact O-N 3.17Å; K1031-E1034 PolarHBondContact O-N 3.38Å; K1031-A1035 PolarHBondContact O-N 3.39Å
1032	F	97.1	Very high	94.7	Very high	0 Å²	0	55.5 Å²	55.5	0%	0	30%	0.303	C	S	.	.	H	α-helix	trans	-65.8	-42.3	172.9	-73.7	-58.3	0	0	0	111.4	L875 F880 L888 M892 L1013 M1016 H1017 A1020 L1028 A1035 V1036	L875-F1032 HydrophobicContact CD1-CE2 3.84Å; L875-F1032 HydrophobicContact CD1-CZ 4.19Å; F880-F1032 HydrophobicContact CB-CZ 4.23Å; F880-F1032 HydrophobicContact CD2-CZ 4.02Å; F880-F1032 HydrophobicContact CG-CZ 4.08Å; L888-F1032 HydrophobicContact CD1-CE1 3.91Å; L888-F1032 HydrophobicContact CD2-CD1 3.65Å; L888-F1032 HydrophobicContact CD2-CE1 3.77Å; L888-F1032 HydrophobicContact CD2-CG 4.37Å; L888-F1032 HydrophobicContact CG-CD1 4.27Å; L888-F1032 HydrophobicContact CG-CE1 4.09Å; M892-F1032 HydrophobicContact CG-CE1 4.49Å; M892-F1032 HydrophobicContact SD-CE1 4.34Å; L1013-F1032 HydrophobicContact CD2-CD1 3.81Å; L1013-F1032 HydrophobicContact CD2-CE1 4.42Å; M1016-F1032 HydrophobicContact CB-CD1 3.85Å; M1016-F1032 HydrophobicContact CB-CD2 4Å; M1016-F1032 HydrophobicContact CB-CE1 3.78Å; M1016-F1032 HydrophobicContact CB-CE2 3.95Å; M1016-F1032 HydrophobicContact CB-CG 3.98Å; M1016-F1032 HydrophobicContact CB-CZ 3.84Å; M1016-F1032 HydrophobicContact CE-CE1 4.48Å; M1016-F1032 HydrophobicContact CE-CE2 4.28Å; M1016-F1032 HydrophobicContact CE-CZ 3.8Å; M1016-F1032 HydrophobicContact CG-CE1 4.3Å; M1016-F1032 HydrophobicContact CG-CZ 4.41Å; H1017-F1032 HydrophobicContact CB-CB 4.1Å; A1020-F1032 HydrophobicContact CB-CD2 4.09Å; A1020-F1032 HydrophobicContact CB-CE2 4.22Å; L1028-F1032 HydrophobicContact CB-CD2 4.26Å; L1028-F1032 HydrophobicContact CB-CE2 4.03Å; L1028-F1032 WeakPolarHBondContact O-CD2 3.3Å; L1028-F1032 PolarHBondContact O-N 3.15Å; F1032-A1035 WeakPolarHBondContact O-CB 3.49Å; F1032-A1035 PolarHBondContact O-N 3.24Å; F1032-V1036 WeakPolarHBondContact O-CG2 3.46Å; F1032-V1036 PolarHBondContact O-N 3.37Å
1033	L	95.8	Very high	94.4	Very high	74 Å²	74	53.2 Å²	53.2	39%	0.387	29%	0.288	S	S	.	.	H	α-helix	trans	-62.5	-41.9	175.7	-178.1	61.9	0	0	0	111.9	E1029 N1030 A1035 V1036 I1037	E1029-L1033 WeakPolarHBondContact O-CB 3.25Å; E1029-L1033 PolarHBondContact O-N 2.98Å; N1030-L1033 PolarHBondContact O-N 3.02Å; L1033-A1035 PolarHBondContact O-N 3.05Å; L1033-V1036 WeakPolarHBondContact O-CB 3.47Å; L1033-V1036 PolarHBondContact O-N 3.21Å; L1033-I1037 HydrophobicContact CG-CD1 4.34Å; L1033-I1037 WeakPolarHBondContact O-CG1 3.37Å; L1033-I1037 PolarHBondContact O-N 3.44Å
1034	E	96.6	Very high	94.1	Very high	102 Å²	102	51.9 Å²	51.9	48%	0.477	28%	0.277	S	S	.	.	H	α-helix	trans	-62.8	-41.8	175.2	-169	177.6	172.4	0	0	111.5	P885 N1030 K1031 V1036 I1037 L1038	P885-E1034 HydrophobicContact CB-CB 4.16Å; P885-E1034 HydrophobicContact CB-CG 3.93Å; P885-E1034 HydrophobicContact CG-CB 4.19Å; P885-E1034 HydrophobicContact CG-CG 3.9Å; P885-E1034 VanDerWaalsContact CG-OE2 3.28Å; P885-E1034 WeakPolarHBondContact CG-OE2 3.48Å; N1030-E1034 WeakPolarHBondContact O-CB 3.45Å; N1030-E1034 PolarHBondContact O-N 3.24Å; K1031-E1034 PolarHBondContact O-N 3.38Å; E1034-V1036 VanDerWaalsContact C-N 3.33Å; E1034-V1036 PolarHBondContact O-N 3.04Å; E1034-I1037 PolarHBondContact O-N 3.08Å; E1034-I1037 VanDerWaalsContact O-N 3.17Å; E1034-L1038 WeakPolarHBondContact O-CG 3.41Å; E1034-L1038 PolarHBondContact O-N 3.37Å
1035	A	97	Very high	93.6	Very high	0 Å²	0	51.3 Å²	51.3	0%	0	26%	0.257	C	S	.	.	H	α-helix	trans	-60.6	-39.4	173.5	0	0	0	0	0	112.5	A889 L1013 K1031 F1032 L1033 L1038 I1039	A889-A1035 HydrophobicContact CB-CB 4.36Å; L1013-A1035 HydrophobicContact CD1-CB 4.08Å; L1013-A1035 HydrophobicContact CD2-CB 4.2Å; K1031-A1035 PolarHBondContact O-N 3.39Å; F1032-A1035 WeakPolarHBondContact O-CB 3.49Å; F1032-A1035 PolarHBondContact O-N 3.24Å; L1033-A1035 PolarHBondContact O-N 3.05Å; A1035-L1038 PolarHBondContact O-N 3.04Å; A1035-I1039 WeakPolarHBondContact O-CG1 3.45Å; A1035-I1039 PolarHBondContact O-N 3.24Å
1036	V	95.3	Very high	93.2	Very high	10 Å²	10	50.3 Å²	50.3	6%	0.061	25%	0.254	C	S	.	.	H	α-helix	trans	-59.2	-47.3	172.6	170.5	0	0	0	0	110.7	E1010 L1013 F1032 L1033 E1034 L1038 I1039 K1040	E1010-V1036 HydrophobicContact CG-CG1 4Å; L1013-V1036 HydrophobicContact CB-CG2 3.45Å; L1013-V1036 VanDerWaalsContact CB-CG2 3.45Å; L1013-V1036 HydrophobicContact CD1-CG2 4.24Å; L1013-V1036 HydrophobicContact CG-CG2 4.49Å; F1032-V1036 WeakPolarHBondContact O-CG2 3.46Å; F1032-V1036 PolarHBondContact O-N 3.37Å; L1033-V1036 WeakPolarHBondContact O-CB 3.47Å; L1033-V1036 PolarHBondContact O-N 3.21Å; E1034-V1036 VanDerWaalsContact C-N 3.33Å; E1034-V1036 PolarHBondContact O-N 3.04Å; V1036-L1038 VanDerWaalsContact C-N 3.33Å; V1036-L1038 PolarHBondContact O-N 3.32Å; V1036-I1039 WeakPolarHBondContact O-CG1 3.38Å; V1036-I1039 PolarHBondContact O-N 3.31Å; V1036-K1040 WeakPolarHBondContact O-CB 3.5Å; V1036-K1040 PolarHBondContact O-N 3.16Å
1037	I	95.5	Very high	92.5	Very high	116 Å²	116	50.3 Å²	50.3	60%	0.595	26%	0.258	S	S	*	.	H	α-helix	trans	-60.9	-42.1	-179.5	-66.4	164.7	0	0	0	111	L1033 E1034 I1039 K1040	L1033-I1037 HydrophobicContact CG-CD1 4.34Å; L1033-I1037 WeakPolarHBondContact O-CG1 3.37Å; L1033-I1037 PolarHBondContact O-N 3.44Å; E1034-I1037 PolarHBondContact O-N 3.08Å; E1034-I1037 VanDerWaalsContact O-N 3.17Å; I1037-I1039 PolarHBondContact O-N 3.45Å; I1037-K1040 PolarHBondContact O-N 3.38Å
1038	L	95.6	Very high	91.8	Very high	52 Å²	52	45.3 Å²	45.3	27%	0.272	24%	0.236	S	C	.	.	H	α-helix	trans	-65.5	-35.8	-178.8	-69.5	172.7	0	0	0	113.5	P885 V886 A983 E1034 A1035 V1036	P885-L1038 HydrophobicContact CB-CD1 3.7Å; V886-L1038 HydrophobicContact CG2-CD1 3.82Å; A983-L1038 HydrophobicContact CB-CB 4.15Å; E1034-L1038 WeakPolarHBondContact O-CG 3.41Å; E1034-L1038 PolarHBondContact O-N 3.37Å; A1035-L1038 PolarHBondContact O-N 3.04Å; V1036-L1038 VanDerWaalsContact C-N 3.33Å; V1036-L1038 PolarHBondContact O-N 3.32Å
1039	I	94.5	Very high	91.1	Very high	0 Å²	0	48 Å²	48	0%	0	25%	0.25	C	S	.	.	H	α-helix	trans	-85.9	-23	179.9	67.7	172.3	0	0	0	112.8	A889 W982 A983 I1006 L1009 E1010 L1013 A1035 V1036 I1037 R1041 F1045	A889-I1039 HydrophobicContact CB-CG2 3.96Å; W982-I1039 PolarHBondContact NE1-O 3.11Å; A983-I1039 HydrophobicContact CB-CG2 4.27Å; I1006-I1039 HydrophobicContact CG2-CB 4.13Å; I1006-I1039 HydrophobicContact CG2-CD1 4.25Å; L1009-I1039 HydrophobicContact CD2-CD1 4.17Å; L1009-I1039 HydrophobicContact CG-CD1 4.07Å; E1010-I1039 HydrophobicContact CB-CD1 3.9Å; L1013-I1039 HydrophobicContact CD1-CD1 3.64Å; A1035-I1039 WeakPolarHBondContact O-CG1 3.45Å; A1035-I1039 PolarHBondContact O-N 3.24Å; V1036-I1039 WeakPolarHBondContact O-CG1 3.38Å; V1036-I1039 PolarHBondContact O-N 3.31Å; I1037-I1039 PolarHBondContact O-N 3.45Å; I1039-R1041 PolarHBondContact O-N 3.38Å; I1039-F1045 VanDerWaalsContact O-CE2 3.23Å; I1039-F1045 WeakPolarHBondContact O-CE2 3.17Å
1040	K	92	Very high	90.1	Very high	111 Å²	111	47.5 Å²	47.5	48%	0.483	25%	0.247	S	C	.	.			trans	-83	73	-173.5	-167.8	169.5	-170.5	153	0	112.8	E1010 V1036 I1037 F1045	E1010-K1040 IonicContact OE1-NZ 2.7Å; E1010-K1040 PolarHBondContact OE1-NZ 2.93Å; V1036-K1040 WeakPolarHBondContact O-CB 3.5Å; V1036-K1040 PolarHBondContact O-N 3.16Å; I1037-K1040 PolarHBondContact O-N 3.38Å; K1040-F1045 HydrophobicContact CB-CD2 4.37Å; K1040-F1045 HydrophobicContact CB-CE2 4.28Å; K1040-F1045 HydrophobicContact CB-CZ 4.42Å; K1040-F1045 HydrophobicContact CG-CD1 3.95Å; K1040-F1045 HydrophobicContact CG-CD2 4.15Å; K1040-F1045 HydrophobicContact CG-CE1 4.15Å; K1040-F1045 HydrophobicContact CG-CE2 4.37Å; K1040-F1045 HydrophobicContact CG-CG 3.93Å; K1040-F1045 HydrophobicContact CG-CZ 4.36Å
1041	R	91	Very high	89	Confident	55 Å²	55	47.4 Å²	47.4	21%	0.208	25%	0.246	C	C	.	.			trans	-144.8	163.9	179.3	64.6	-175.2	-176.5	87.9	0.6	113.9	W982 G985 V986 I1039	W982-R1041 VanDerWaalsContact CE3-NH2 3.31Å; W982-R1041 HydrophobicContact CH2-CG 4.19Å; W982-R1041 HydrophobicContact CZ2-CG 3.49Å; W982-R1041 VanDerWaalsContact CZ2-CG 3.49Å; W982-R1041 WeakPolarHBondContact CZ2-O 3.1Å; W982-R1041 PolarHBondContact O-NE 2.97Å; W982-R1041 PolarHBondContact O-NH2 2.91Å; G985-R1041 VanDerWaalsContact CA-NH2 3.26Å; V986-R1041 PolarHBondContact O-NH2 3.13Å; I1039-R1041 PolarHBondContact O-N 3.38Å
1042	D	87.2	Confident	88.7	Confident	92 Å²	92	48.6 Å²	48.6	49%	0.492	25%	0.253	S	S	.	.	G	3₁₀ helix	trans	47.8	-145.4	167.2	-49.9	-45.9	0	0	0	115.2	W982 I1044 F1045 C1046	W982-D1042 HydrophobicContact CH2-CB 4.05Å; D1042-I1044 PolarHBondContact O-N 3.23Å; D1042-F1045 PolarHBondContact O-N 2.78Å; D1042-F1045 VanDerWaalsContact O-N 3.09Å; D1042-C1046 PolarHBondContact O-N 3.18Å
1043	I	89.1	Confident	88.2	Confident	7 Å²	7	51.1 Å²	51.1	4%	0.036	27%	0.266	C	S	.	.	G	3₁₀ helix	trans	-53.3	-29.5	-172.8	-166.4	172.6	0	0	0	114.8	L379 D383 L386 L408 F988 F1045 C1046	L379-I1043 HydrophobicContact CD2-CG1 4.12Å; D383-I1043 HydrophobicContact CB-CD1 4.05Å; L386-I1043 HydrophobicContact CD1-CD1 3.54Å; L408-I1043 HydrophobicContact CD1-CD1 3.84Å; L408-I1043 HydrophobicContact CD2-CD1 3.79Å; L408-I1043 HydrophobicContact CD2-CG1 4.43Å; L408-I1043 HydrophobicContact CG-CD1 4.43Å; F988-I1043 HydrophobicContact CB-CG2 3.71Å; F988-I1043 HydrophobicContact CD1-CD1 4.34Å; F988-I1043 HydrophobicContact CD1-CG2 3.89Å; F988-I1043 HydrophobicContact CD2-CG2 3.75Å; F988-I1043 HydrophobicContact CE1-CG2 4.45Å; F988-I1043 HydrophobicContact CE2-CG2 4.34Å; F988-I1043 HydrophobicContact CG-CG2 3.5Å; F988-I1043 VanDerWaalsContact CG-CG2 3.5Å; I1043-F1045 VanDerWaalsContact C-N 3.28Å; I1043-F1045 PolarHBondContact O-N 2.61Å; I1043-C1046 PolarHBondContact O-N 2.91Å
1044	I	88	Confident	87.8	Confident	0 Å²	0	49.8 Å²	49.8	0%	0	26%	0.259	C	S	.	.	G	3₁₀ helix	trans	-65.3	-35.6	-178	-56.2	-162.9	0	0	0	110.8	W982 F988 I1003 I1006 R1007 D1042	W982-I1044 HydrophobicContact CD2-CD1 3.75Å; W982-I1044 HydrophobicContact CE3-CD1 4.27Å; W982-I1044 HydrophobicContact CG-CD1 4.27Å; W982-I1044 HydrophobicContact CH2-CD1 3.94Å; W982-I1044 HydrophobicContact CH2-CG1 3.82Å; W982-I1044 HydrophobicContact CZ2-CB 4.14Å; W982-I1044 HydrophobicContact CZ2-CD1 3.4Å; W982-I1044 VanDerWaalsContact CZ2-CD1 3.4Å; W982-I1044 HydrophobicContact CZ2-CG1 3.48Å; W982-I1044 VanDerWaalsContact CZ2-CG1 3.48Å; W982-I1044 HydrophobicContact CZ3-CD1 4.35Å; F988-I1044 HydrophobicContact CD2-CD1 4.3Å; F988-I1044 HydrophobicContact CD2-CG1 4.18Å; F988-I1044 HydrophobicContact CE2-CD1 4.28Å; F988-I1044 HydrophobicContact CE2-CG1 4.21Å; I1003-I1044 HydrophobicContact CG1-CG1 4.2Å; I1003-I1044 HydrophobicContact CG2-CG2 4.18Å; I1006-I1044 HydrophobicContact CB-CD1 4.07Å; I1006-I1044 HydrophobicContact CB-CG2 4Å; I1006-I1044 HydrophobicContact CD1-CD1 3.32Å; I1006-I1044 HydrophobicContact CG1-CD1 4.26Å; I1006-I1044 HydrophobicContact CG2-CD1 3.97Å; I1006-I1044 HydrophobicContact CG2-CG2 3.79Å; R1007-I1044 HydrophobicContact CG-CG2 4.27Å; R1007-I1044 VanDerWaalsContact CZ-O 3.25Å; R1007-I1044 PolarHBondContact NE-O 3.19Å; R1007-I1044 PolarHBondContact NH2-O 2.8Å; D1042-I1044 PolarHBondContact O-N 3.23Å
1045	F	85	Confident	87.3	Confident	53 Å²	53	46.8 Å²	46.8	23%	0.232	25%	0.247	C	C	.	.	G	3₁₀ helix	trans	-112.4	20.2	-177.4	-66.7	-91.4	0	0	0	112.8	I1006 R1007 E1010 I1039 K1040 D1042 I1043 A1047	I1006-F1045 HydrophobicContact CG2-CE2 4.18Å; I1006-F1045 HydrophobicContact CG2-CZ 4.5Å; R1007-F1045 HydrophobicContact CG-CE1 4.43Å; E1010-F1045 HydrophobicContact CB-CE1 4.08Å; E1010-F1045 HydrophobicContact CB-CZ 3.82Å; E1010-F1045 HydrophobicContact CG-CE1 3.99Å; E1010-F1045 HydrophobicContact CG-CZ 4.02Å; I1039-F1045 VanDerWaalsContact O-CE2 3.23Å; I1039-F1045 WeakPolarHBondContact O-CE2 3.17Å; K1040-F1045 HydrophobicContact CB-CD2 4.37Å; K1040-F1045 HydrophobicContact CB-CE2 4.28Å; K1040-F1045 HydrophobicContact CB-CZ 4.42Å; K1040-F1045 HydrophobicContact CG-CD1 3.95Å; K1040-F1045 HydrophobicContact CG-CD2 4.15Å; K1040-F1045 HydrophobicContact CG-CE1 4.15Å; K1040-F1045 HydrophobicContact CG-CE2 4.37Å; K1040-F1045 HydrophobicContact CG-CG 3.93Å; K1040-F1045 HydrophobicContact CG-CZ 4.36Å; D1042-F1045 PolarHBondContact O-N 2.78Å; D1042-F1045 VanDerWaalsContact O-N 3.09Å; I1043-F1045 VanDerWaalsContact C-N 3.28Å; I1043-F1045 PolarHBondContact O-N 2.61Å; F1045-A1047 PolarHBondContact O-N 2.78Å
1046	C	83.8	Confident	86.7	Confident	31 Å²	31	49.7 Å²	49.7	21%	0.209	26%	0.262	C	S	.	.	P	Polyproline II helix	trans	-54.2	134.9	169	-173.7	0	0	0	0	110.5	L379 R1007 D1042 I1043	L379-C1046 HydrophobicContact CD2-CB 4.47Å; R1007-C1046 PolarHBondContact NH2-O 3.38Å; D1042-C1046 PolarHBondContact O-N 3.18Å; I1043-C1046 PolarHBondContact O-N 2.91Å
1047	A	80.5	Confident	86.1	Confident	71 Å²	71	52.3 Å²	52.3	59%	0.587	28%	0.275	S	S	*	.	P	Polyproline II helix	trans	-61.2	150.3	177.2	0	0	0	0	0	110.9	F1045	F1045-A1047 PolarHBondContact O-N 2.78Å
1048	S	80.8	Confident	85.4	Confident	14 Å²	14	47.8 Å²	47.8	10%	0.098	25%	0.253	C	S	.	.	P	Polyproline II helix	trans	-71.6	140.8	174.3	-178.3	0	0	0	0	109.9	E413 Y1050 L1051	E413-S1048 WeakPolarHBondContact OE1-CB 3.43Å; E413-S1048 PolarHBondContact OE1-OG 3.44Å; E413-S1048 VanDerWaalsContact OE2-CA 3.3Å; E413-S1048 WeakPolarHBondContact OE2-CA 3.29Å; E413-S1048 PolarHBondContact OE2-OG 3.23Å; S1048-Y1050 PolarHBondContact O-N 2.83Å; S1048-Y1050 PolarHBondContact OG-N 3.21Å; S1048-L1051 PolarHBondContact O-N 3.15Å
1049	L	80.6	Confident	84.6	Confident	57 Å²	57	47.5 Å²	47.5	30%	0.298	25%	0.251	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.3	-12	173.7	-62.7	176.3	0	0	0	113.3	A375 I410 E413 I414 L1051	A375-L1049 HydrophobicContact CB-CD1 3.96Å; A375-L1049 HydrophobicContact CB-CD2 4.05Å; I410-L1049 HydrophobicContact CG1-CD1 4.1Å; I410-L1049 HydrophobicContact CG1-CD2 4.48Å; I410-L1049 HydrophobicContact CG1-CG 4.25Å; E413-L1049 HydrophobicContact CB-CB 4.23Å; E413-L1049 HydrophobicContact CB-CD1 3.93Å; E413-L1049 HydrophobicContact CB-CG 4.31Å; E413-L1049 PolarHBondContact OE2-N 3.29Å; I414-L1049 HydrophobicContact CG1-CD1 3.53Å; L1049-L1051 VanDerWaalsContact C-N 3.32Å
1050	Y	73.3	Confident	83.8	Confident	29 Å²	29	51.4 Å²	51.4	11%	0.114	27%	0.272	C	S	.	.	T	Hydrogen-bonded Turn	trans	-80.5	-14.4	174.8	-68.9	-62.9	0	0	0	113.8	N141 E413 E416 S1048	N141-Y1050 HydrophobicContact CB-CG 4.43Å; E413-Y1050 HydrophobicContact CB-CE2 4.39Å; E413-Y1050 HydrophobicContact CG-CD2 4.12Å; E413-Y1050 HydrophobicContact CG-CE2 3.81Å; E416-Y1050 WeakPolarHBondContact CB-OH 3.48Å; E416-Y1050 VanDerWaalsContact OE2-CE2 3.25Å; E416-Y1050 WeakPolarHBondContact OE2-CE2 3.37Å; E416-Y1050 VanDerWaalsContact OE2-CZ 3.3Å; E416-Y1050 PolarHBondContact OE2-OH 2.84Å; S1048-Y1050 PolarHBondContact O-N 2.83Å; S1048-Y1050 PolarHBondContact OG-N 3.21Å
1051	L	74.5	Confident	83.1	Confident	97 Å²	97	46 Å²	46	51%	0.508	25%	0.253	S	S	.	.			trans	-106.7	0	178.6	-59	176.4	0	0	0	109.1	F144 L156 I161 I163 S1048 L1049	F144-L1051 HydrophobicContact CD1-CD2 4.14Å; F144-L1051 HydrophobicContact CE1-CD2 4.36Å; L156-L1051 HydrophobicContact CD2-CD2 3.79Å; I161-L1051 HydrophobicContact CD1-CD1 3.27Å; I161-L1051 HydrophobicContact CG1-CD1 4.46Å; I161-L1051 HydrophobicContact CG2-CD1 4.04Å; I163-L1051 HydrophobicContact CD1-CD1 4.5Å; I163-L1051 HydrophobicContact CD1-CD2 3.89Å; S1048-L1051 PolarHBondContact O-N 3.15Å; L1049-L1051 VanDerWaalsContact C-N 3.32Å

Retrieved 1,051 of 1,051 residues in 764.3 ms (Link to these results)

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