G4VAY7_SCHMA Loading...

RNA helicase

AlphaFold DB , UniProt , Accession G4VAY7, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 771 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	35.2	Very low	48	Very low	221 Å²	221	113.1 Å²	113.1	100%	1.089	57%	0.569	S	S	*	*				0	129.4	0	-80.2	-179.9	172.1	0	0	107.2
2	N	43.6	Very low	46.5	Very low	164 Å²	164	117.7 Å²	117.7	88%	0.877	59%	0.587	S	S	*	*			trans	-64.2	142.1	172.7	-71.5	-13.7	0	0	0	108.9	R4	N2-R4 PolarHBondContact O-N 2.94Å
3	S	50.5	Low	45.1	Very low	38 Å²	38	128.4 Å²	128.4	27%	0.266	62%	0.617	S	S	.	*			trans	-46.6	133.2	175.2	173.3	0	0	0	0	110.1	F5 Y65 E68	S3-F5 WeakPolarHBondContact CB-O 3.33Å; S3-F5 PolarHBondContact O-N 3.19Å; S3-F5 PolarHBondContact OG-N 3.36Å; S3-F5 PolarHBondContact OG-O 3.4Å; S3-Y65 WeakPolarHBondContact OG-CD2 3.1Å; S3-E68 PolarHBondContact OG-OE2 2.67Å
4	R	62.7	Low	44.1	Very low	170 Å²	170	127.1 Å²	127.1	64%	0.642	61%	0.614	S	S	*	*	S	Bend	trans	-67.4	-17.8	175.8	-77.8	-174.1	-85.3	179.5	-6.7	111.7	N2 E68	N2-R4 PolarHBondContact O-N 2.94Å; R4-E68 PolarHBondContact N-OE2 3.41Å; R4-E68 IonicContact NE-OE1 2.88Å
5	F	62	Low	42.8	Very low	45 Å²	45	123.8 Å²	123.8	20%	0.197	63%	0.626	C	S	.	*	S	Bend	trans	-111.5	141.7	-179.8	-54.3	-74.6	0	0	0	110.8	S3 L64 Y65 E68 A94	S3-F5 WeakPolarHBondContact CB-O 3.33Å; S3-F5 PolarHBondContact O-N 3.19Å; S3-F5 PolarHBondContact OG-N 3.36Å; S3-F5 PolarHBondContact OG-O 3.4Å; F5-L64 HydrophobicContact CD1-CB 3.89Å; F5-L64 HydrophobicContact CD1-CD1 4.11Å; F5-L64 HydrophobicContact CD2-CB 3.92Å; F5-L64 HydrophobicContact CE1-CB 4.04Å; F5-L64 HydrophobicContact CE1-CD1 3.69Å; F5-L64 HydrophobicContact CE1-CG 4.44Å; F5-L64 HydrophobicContact CE2-CB 4.07Å; F5-L64 HydrophobicContact CG-CB 3.83Å; F5-L64 HydrophobicContact CZ-CB 4.14Å; F5-L64 HydrophobicContact CZ-CD1 4.11Å; F5-Y65 WeakPolarHBondContact O-CD2 3.45Å; F5-E68 WeakPolarHBondContact CD2-OE2 3.35Å; F5-A94 HydrophobicContact CZ-CB 3.85Å
6	I	50.5	Low	42.1	Very low	81 Å²	81	124.9 Å²	124.9	42%	0.415	63%	0.625	S	S	.	*			trans	-69.1	142.8	-178	-61.2	173.9	0	0	0	110	S10 L14	I6-S10 WeakPolarHBondContact CG2-OG 3.3Å; I6-L14 HydrophobicContact CD1-CD1 3.85Å; I6-L14 HydrophobicContact CD1-CG 4.29Å
7	H	52.8	Low	41.1	Very low	82 Å²	82	126.9 Å²	126.9	38%	0.38	64%	0.639	S	S	.	*			trans	-62	139.4	177.2	-170.4	-83.2	0	0	0	109.9	D9 S10 Y65	H7-D9 IonicContact CE1-OD2 3.2Å; H7-D9 PolarHBondContact CE1-OD2 3.01Å; H7-D9 PolarHBondContact ND1-N 3.13Å; H7-D9 IonicContact ND1-OD2 3.6Å; H7-D9 PolarHBondContact O-N 3.27Å; H7-S10 WeakPolarHBondContact CB-OG 3.49Å; H7-S10 PolarHBondContact N-OG 3.49Å; H7-S10 PolarHBondContact O-N 3.29Å; H7-S10 PolarHBondContact O-OG 3.01Å; H7-Y65 HydrophobicContact CB-CE2 4.34Å; H7-Y65 AromaticContact CD2-CE1 3.96Å; H7-Y65 AromaticContact CD2-CZ 3.52Å; H7-Y65 PolarHBondContact CD2-OH 3.3Å; H7-Y65 VanDerWaalsContact CD2-OH 3.25Å
8	P	47.5	Very low	40.3	Very low	54 Å²	54	128.4 Å²	128.4	35%	0.351	65%	0.648	S	S	.	*	T	Hydrogen-bonded Turn	trans	-58.8	-22.7	-174.5	17.8	-30.4	0	0	0	115.4	Q62 Y65	P8-Q62 HydrophobicContact CB-CB 4.45Å; P8-Q62 HydrophobicContact CB-CG 3.94Å; P8-Q62 HydrophobicContact CG-CG 4.24Å; P8-Y65 HydrophobicContact CG-CD1 4.42Å
9	D	49.4	Very low	39.5	Very low	139 Å²	139	127.5 Å²	127.5	74%	0.743	66%	0.655	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.9	-0.2	177.3	-57.1	-30.9	0	0	0	114.1	H7 E11	H7-D9 IonicContact CE1-OD2 3.2Å; H7-D9 PolarHBondContact CE1-OD2 3.01Å; H7-D9 PolarHBondContact ND1-N 3.13Å; H7-D9 IonicContact ND1-OD2 3.6Å; H7-D9 PolarHBondContact O-N 3.27Å; D9-E11 PolarHBondContact O-N 3.32Å
10	S	44	Very low	39	Very low	57 Å²	57	130.7 Å²	130.7	40%	0.399	67%	0.667	S	S	.	*			trans	-92.1	98.7	175	3.5	0	0	0	0	109.1	I6 H7 E12	I6-S10 WeakPolarHBondContact CG2-OG 3.3Å; H7-S10 WeakPolarHBondContact CB-OG 3.49Å; H7-S10 PolarHBondContact N-OG 3.49Å; H7-S10 PolarHBondContact O-N 3.29Å; H7-S10 PolarHBondContact O-OG 3.01Å; S10-E12 VanDerWaalsContact C-N 3.32Å; S10-E12 PolarHBondContact O-N 3.01Å
11	E	30.1	Very low	38.3	Very low	193 Å²	193	133.7 Å²	133.7	90%	0.902	68%	0.678	S	S	*	*			trans	-69.9	78.9	174	-73.9	-169.3	147.9	0	0	111.5	D9	D9-E11 PolarHBondContact O-N 3.32Å
12	E	30.1	Very low	38	Very low	168 Å²	168	129.5 Å²	129.5	79%	0.785	66%	0.664	S	S	*	*			trans	-129.4	118.1	157.2	-82.5	-169.9	159.6	0	0	110.6	S10 L14	S10-E12 VanDerWaalsContact C-N 3.32Å; S10-E12 PolarHBondContact O-N 3.01Å; E12-L14 PolarHBondContact O-N 3.3Å
13	R	28.2	Very low	37.2	Very low	257 Å²	257	127.2 Å²	127.2	97%	0.97	66%	0.659	S	S	*	*			trans	-67.7	112.9	179.5	-70	178	179.2	176.8	0.2	109.5	G15	R13-G15 PolarHBondContact O-N 3.13Å
14	L	30.8	Very low	36	Very low	111 Å²	111	134.1 Å²	134.1	58%	0.581	69%	0.687	S	S	*	*			trans	-79.6	114.9	168.6	-79.1	162.3	0	0	0	110.4	I6 E12 F16	I6-L14 HydrophobicContact CD1-CD1 3.85Å; I6-L14 HydrophobicContact CD1-CG 4.29Å; E12-L14 PolarHBondContact O-N 3.3Å; L14-F16 HydrophobicContact CB-CD2 4.16Å; L14-F16 HydrophobicContact CB-CE2 3.86Å; L14-F16 HydrophobicContact CD1-CE2 4.15Å; L14-F16 HydrophobicContact CD1-CZ 4.44Å
15	G	25.3	Very low	34.5	Very low	77 Å²	77	131.3 Å²	131.3	79%	0.794	69%	0.691	S	S	*	*	P	Polyproline II helix	trans	-76.7	120.4	157	0	0	0	0	0	108.8	R13	R13-G15 PolarHBondContact O-N 3.13Å
16	F	31.2	Very low	32.9	Very low	141 Å²	141	136.7 Å²	136.7	62%	0.618	72%	0.721	S	S	*	*	P	Polyproline II helix	trans	-98.3	118.8	172.5	-86.2	-86.6	0	0	0	109	L14	L14-F16 HydrophobicContact CB-CD2 4.16Å; L14-F16 HydrophobicContact CB-CE2 3.86Å; L14-F16 HydrophobicContact CD1-CE2 4.15Å; L14-F16 HydrophobicContact CD1-CZ 4.44Å
17	D	24.8	Very low	31.7	Very low	160 Å²	160	141.8 Å²	141.8	86%	0.856	74%	0.744	S	S	*	*	P	Polyproline II helix	trans	-76.3	123.7	161.9	-120.4	-21.8	0	0	0	108.1
18	L	27.1	Very low	30.8	Very low	154 Å²	154	145.6 Å²	145.6	81%	0.806	77%	0.767	S	S	*	*			trans	-112.3	90.3	175.7	-79.2	167.2	0	0	0	108.3
19	S	24.1	Very low	29.7	Very low	110 Å²	110	146.8 Å²	146.8	77%	0.769	79%	0.788	S	S	*	*			trans	-129.2	89.1	161.4	62	0	0	0	0	108.5
20	E	30.5	Very low	28.6	Very low	192 Å²	192	144 Å²	144	90%	0.897	79%	0.793	S	S	*	*			trans	-124.1	126.5	160.9	-89.4	-172	161.3	0	0	109.1
21	E	25	Very low	27.8	Very low	194 Å²	194	147.1 Å²	147.1	91%	0.907	81%	0.813	S	S	*	*	P	Polyproline II helix	trans	-66.3	134.1	-175.7	-68.3	175.3	146.3	0	0	111.6
22	V	27.1	Very low	27.5	Very low	132 Å²	132	142.2 Å²	142.2	80%	0.8	82%	0.815	S	S	*	*	P	Polyproline II helix	trans	-80.9	120.9	170.9	177.9	0	0	0	0	108.1
23	P	27.4	Very low	27.4	Very low	117 Å²	117	138.1 Å²	138.1	76%	0.76	80%	0.804	S	S	*	*	P	Polyproline II helix	trans	-76.6	133	170.4	11.6	0.8	0	0	0	110
24	E	24.7	Very low	27.4	Very low	182 Å²	182	131.8 Å²	131.8	85%	0.85	80%	0.8	S	S	*	*	P	Polyproline II helix	trans	-59.9	143.9	176.4	-67.6	-168.4	157.5	0	0	112.2	N26	E24-N26 PolarHBondContact O-N 3.33Å
25	P	31.1	Very low	27.6	Very low	112 Å²	112	131.8 Å²	131.8	73%	0.727	80%	0.799	S	S	*	*	P	Polyproline II helix	trans	-84.2	117.8	179.5	31.6	-29.3	0	0	0	111.3	E27	P25-E27 PolarHBondContact O-N 2.68Å
26	N	28.9	Very low	27.9	Very low	157 Å²	157	133.7 Å²	133.7	84%	0.84	79%	0.79	S	S	*	*	P	Polyproline II helix	trans	-62.9	131.7	164	-75.2	-19.9	0	0	0	110.8	E24	E24-N26 PolarHBondContact O-N 3.33Å
27	E	26.5	Very low	27.7	Very low	189 Å²	189	136 Å²	136	88%	0.883	80%	0.803	S	S	*	*	P	Polyproline II helix	trans	-70.7	120.4	169.8	-66.1	-173.3	150.1	0	0	109.8	P25	P25-E27 PolarHBondContact O-N 2.68Å
28	D	31.9	Very low	28.2	Very low	162 Å²	162	132.3 Å²	132.3	87%	0.866	78%	0.779	S	S	*	*			trans	-152.9	138.6	155.2	-99	-32.5	0	0	0	110.3
29	G	26.3	Very low	28.3	Very low	78 Å²	78	130.6 Å²	130.6	80%	0.804	78%	0.778	S	S	*	*			trans	-83.8	165.3	-157	0	0	0	0	0	117.3
30	G	25.6	Very low	28.8	Very low	81 Å²	81	133.1 Å²	133.1	84%	0.835	78%	0.781	S	S	*	*			trans	94.5	92.7	150.1	0	0	0	0	0	117.8
31	C	26.7	Very low	29.4	Very low	123 Å²	123	125.7 Å²	125.7	83%	0.831	75%	0.75	S	S	*	*				-165.2	108.8	124	-156.3	0	0	0	0	109.5	S33	C31-S33 PolarHBondContact O-N 3.41Å; C31-S33 VanDerWaalsContact O-N 3.13Å
32	G	24.3	Very low	29.9	Very low	90 Å²	90	123 Å²	123	93%	0.928	74%	0.742	S	S	*	*			trans	-71.8	101.6	177.4	0	0	0	0	0	111.1
33	S	28.8	Very low	30.7	Very low	81 Å²	81	118.9 Å²	118.9	57%	0.566	72%	0.719	S	S	*	*			trans	-122.5	130.2	158.4	48.5	0	0	0	0	107.5	C31 I35	C31-S33 PolarHBondContact O-N 3.41Å; C31-S33 VanDerWaalsContact O-N 3.13Å; S33-I35 VanDerWaalsContact C-N 3.26Å; S33-I35 PolarHBondContact O-N 3.19Å
34	S	27	Very low	31.6	Very low	125 Å²	125	123.4 Å²	123.4	87%	0.874	73%	0.727	S	S	*	*			trans	-68.3	82.2	-177.1	62.4	0	0	0	0	110.1	L36	S34-L36 PolarHBondContact O-N 3.3Å
35	I	35.5	Very low	33	Very low	111 Å²	111	118.9 Å²	118.9	57%	0.569	71%	0.706	S	S	*	*			trans	-81.2	117.5	175.2	-64.8	175.1	0	0	0	107.6	S33 Q37 I136	S33-I35 VanDerWaalsContact C-N 3.26Å; S33-I35 PolarHBondContact O-N 3.19Å; I35-Q37 PolarHBondContact O-N 3.39Å; I35-I136 HydrophobicContact CD1-CG2 4.34Å
36	L	31.3	Very low	34.9	Very low	117 Å²	117	116.6 Å²	116.6	61%	0.613	69%	0.693	S	S	*	*			trans	-63.7	97.8	171.2	-70	165.2	0	0	0	108.7	S34 F38 L356	S34-L36 PolarHBondContact O-N 3.3Å; L36-F38 HydrophobicContact CB-CE2 4.32Å; L36-F38 HydrophobicContact CB-CZ 4.42Å; L36-F38 PolarHBondContact O-N 3.24Å; L36-L356 HydrophobicContact CD1-CD1 4.27Å
37	Q	27.6	Very low	37.2	Very low	189 Å²	189	112.1 Å²	112.1	88%	0.883	67%	0.67	S	S	*	*			trans	-70.1	115	164	-85.6	177.9	-26.6	0	0	108.5	I35	I35-Q37 PolarHBondContact O-N 3.39Å
38	F	34.6	Very low	39.5	Very low	82 Å²	82	107 Å²	107	36%	0.36	65%	0.647	S	S	.	*	P	Polyproline II helix	trans	-83.3	135.8	169.2	-66.5	-79.6	0	0	0	109.3	L36 F359	L36-F38 HydrophobicContact CB-CE2 4.32Å; L36-F38 HydrophobicContact CB-CZ 4.42Å; L36-F38 PolarHBondContact O-N 3.24Å; F38-F359 HydrophobicContact CE1-CB 4.2Å; F38-F359 HydrophobicContact CZ-CB 4.39Å
39	P	30.1	Very low	41.7	Very low	119 Å²	119	103.3 Å²	103.3	77%	0.773	62%	0.624	S	S	*	*	P	Polyproline II helix	trans	-66.5	138.9	-176.9	24.9	-31.1	0	0	0	111.4	S41	P39-S41 PolarHBondContact O-N 3.41Å
40	I	34.6	Very low	44.1	Very low	163 Å²	163	101.8 Å²	101.8	84%	0.836	60%	0.596	S	S	*	*	P	Polyproline II helix	trans	-51	131.5	178.8	-61.4	165.9	0	0	0	109.3	D42	I40-D42 PolarHBondContact O-N 3.25Å
41	S	41.4	Very low	46.8	Very low	35 Å²	35	98.4 Å²	98.4	25%	0.245	56%	0.558	C	S	.	*	P	Polyproline II helix	trans	-65.2	128.1	169.3	57.2	0	0	0	0	109.7	P39 S43	P39-S41 PolarHBondContact O-N 3.41Å; S41-S43 PolarHBondContact O-N 2.93Å; S41-S43 PolarHBondContact O-OG 3.2Å
42	D	37.2	Very low	49.5	Very low	139 Å²	139	97.2 Å²	97.2	74%	0.743	54%	0.54	S	S	*	.			trans	-62.7	70.9	159.6	-72.5	-28.1	0	0	0	110.2	I40	I40-D42 PolarHBondContact O-N 3.25Å
43	S	42.3	Very low	52.3	Low	44 Å²	44	97.5 Å²	97.5	31%	0.308	52%	0.517	S	S	.	.			trans	-97.9	125.2	160.1	52.7	0	0	0	0	106.3	S41 H45 Q50	S41-S43 PolarHBondContact O-N 2.93Å; S41-S43 PolarHBondContact O-OG 3.2Å; S43-H45 PolarHBondContact O-N 3.32Å; S43-H45 PolarHBondContact OG-O 3.43Å; S43-Q50 VanDerWaalsContact CB-NE2 3.25Å; S43-Q50 PolarHBondContact OG-NE2 2.69Å
44	F	47.8	Very low	54.9	Low	212 Å²	212	94.7 Å²	94.7	93%	0.93	50%	0.496	S	S	*	.	S	Bend	trans	-59.7	-0.9	174.8	-72.9	-87.3	0	0	0	114.4
45	H	52.5	Low	57.6	Low	87 Å²	87	89.4 Å²	89.4	40%	0.403	46%	0.459	S	S	.	.	S	Bend	trans	-107.6	136.3	-179.2	-68.2	-54.6	0	0	0	110.8	S43 Q49 Q50	S43-H45 PolarHBondContact O-N 3.32Å; S43-H45 PolarHBondContact OG-O 3.43Å; H45-Q49 VanDerWaalsContact CA-OE1 3.27Å; H45-Q49 HydrophobicContact CB-CB 3.84Å; H45-Q49 PolarHBondContact ND1-OE1 3.04Å; H45-Q50 HydrophobicContact CB-CG 4.28Å
46	S	72.9	Confident	60.3	Low	65 Å²	65	84.1 Å²	84.1	46%	0.455	43%	0.432	S	S	.	.			trans	-58.7	156.9	168.4	66.6	0	0	0	0	110.1	E48 Q49 Q50	S46-E48 PolarHBondContact O-N 2.66Å; S46-E48 VanDerWaalsContact O-N 3.16Å; S46-Q49 WeakPolarHBondContact O-CB 3.39Å; S46-Q49 PolarHBondContact O-N 2.94Å; S46-Q49 WeakPolarHBondContact OG-CG 3.37Å; S46-Q49 PolarHBondContact OG-N 2.91Å; S46-Q50 PolarHBondContact O-N 2.99Å; S46-Q50 VanDerWaalsContact O-N 3.08Å
47	V	75.7	Confident	63	Low	62 Å²	62	82.4 Å²	82.4	38%	0.376	42%	0.42	S	S	.	.	H	α-helix	trans	-51.5	-39.7	176.9	173.1	0	0	0	0	111.2	Q49 Q50 R51 E131	V47-Q49 PolarHBondContact O-N 3.47Å; V47-Q50 WeakPolarHBondContact O-CB 3.32Å; V47-Q50 PolarHBondContact O-N 3.05Å; V47-R51 WeakPolarHBondContact O-CG 3.48Å; V47-R51 PolarHBondContact O-N 3.24Å; V47-E131 HydrophobicContact CG1-CB 4.15Å; V47-E131 HydrophobicContact CG1-CG 3.96Å
48	E	75.2	Confident	66	Low	83 Å²	83	78.7 Å²	78.7	39%	0.388	41%	0.41	S	S	.	.	H	α-helix	trans	-62.6	-43.8	178.1	-154.7	65.2	-162.5	0	0	112.4	S46 Q50 R51 Q52	S46-E48 PolarHBondContact O-N 2.66Å; S46-E48 VanDerWaalsContact O-N 3.16Å; E48-Q50 VanDerWaalsContact C-N 3.31Å; E48-Q50 PolarHBondContact O-N 2.94Å; E48-R51 WeakPolarHBondContact O-CB 3.48Å; E48-R51 PolarHBondContact O-N 2.81Å; E48-R51 VanDerWaalsContact O-N 3.16Å; E48-R51 IonicContact OE1-CZ 2.91Å; E48-R51 IonicContact OE1-NH1 2.7Å; E48-R51 PolarHBondContact OE1-NH1 3.1Å; E48-R51 IonicContact OE2-CZ 3.63Å; E48-R51 IonicContact OE2-NH1 3.51Å; E48-R51 PolarHBondContact OE2-NH1 3Å; E48-Q52 WeakPolarHBondContact O-CG 3.21Å; E48-Q52 PolarHBondContact O-N 3.33Å; E48-Q52 VanDerWaalsContact O-N 3.1Å
49	Q	77.8	Confident	68.7	Low	83 Å²	83	78 Å²	78	39%	0.388	41%	0.407	S	S	.	.	H	α-helix	trans	-64.3	-36.1	176.2	-74.6	175.3	-6.5	0	0	111.9	H45 S46 V47 R51 Q52 Q53	H45-Q49 VanDerWaalsContact CA-OE1 3.27Å; H45-Q49 HydrophobicContact CB-CB 3.84Å; H45-Q49 PolarHBondContact ND1-OE1 3.04Å; S46-Q49 WeakPolarHBondContact O-CB 3.39Å; S46-Q49 PolarHBondContact O-N 2.94Å; S46-Q49 WeakPolarHBondContact OG-CG 3.37Å; S46-Q49 PolarHBondContact OG-N 2.91Å; V47-Q49 PolarHBondContact O-N 3.47Å; Q49-R51 VanDerWaalsContact C-N 3.35Å; Q49-Q52 PolarHBondContact O-N 2.78Å; Q49-Q53 WeakPolarHBondContact O-CG 3.4Å; Q49-Q53 PolarHBondContact O-N 3Å
50	Q	76.5	Confident	71.8	Confident	46 Å²	46	75.1 Å²	75.1	22%	0.215	38%	0.381	C	S	.	.	H	α-helix	trans	-63.9	-40.7	173.4	-63.9	-175.9	-7.2	0	0	111.9	S43 H45 S46 V47 E48 Q52 Q53	S43-Q50 VanDerWaalsContact CB-NE2 3.25Å; S43-Q50 PolarHBondContact OG-NE2 2.69Å; H45-Q50 HydrophobicContact CB-CG 4.28Å; S46-Q50 PolarHBondContact O-N 2.99Å; S46-Q50 VanDerWaalsContact O-N 3.08Å; V47-Q50 WeakPolarHBondContact O-CB 3.32Å; V47-Q50 PolarHBondContact O-N 3.05Å; E48-Q50 VanDerWaalsContact C-N 3.31Å; E48-Q50 PolarHBondContact O-N 2.94Å; Q50-Q52 VanDerWaalsContact C-N 3.32Å; Q50-Q52 PolarHBondContact O-N 3.39Å; Q50-Q53 PolarHBondContact O-N 3.34Å
51	R	83.1	Confident	74.5	Confident	11 Å²	11	70.7 Å²	70.7	4%	0.042	36%	0.364	C	S	.	.	H	α-helix	trans	-61.6	-41.1	178.3	-69.1	170.2	66.4	-150.2	-1.6	111.4	V47 E48 Q49 Q53 L54 E93	V47-R51 WeakPolarHBondContact O-CG 3.48Å; V47-R51 PolarHBondContact O-N 3.24Å; E48-R51 WeakPolarHBondContact O-CB 3.48Å; E48-R51 PolarHBondContact O-N 2.81Å; E48-R51 VanDerWaalsContact O-N 3.16Å; E48-R51 IonicContact OE1-CZ 2.91Å; E48-R51 IonicContact OE1-NH1 2.7Å; E48-R51 PolarHBondContact OE1-NH1 3.1Å; E48-R51 IonicContact OE2-CZ 3.63Å; E48-R51 IonicContact OE2-NH1 3.51Å; E48-R51 PolarHBondContact OE2-NH1 3Å; Q49-R51 VanDerWaalsContact C-N 3.35Å; R51-Q53 VanDerWaalsContact C-N 3.27Å; R51-Q53 PolarHBondContact O-N 3.48Å; R51-L54 WeakPolarHBondContact O-CB 3.34Å; R51-L54 PolarHBondContact O-N 2.9Å; R51-E93 IonicContact CZ-OE1 2.8Å; R51-E93 IonicContact NH2-OE1 3.43Å; R51-E93 PolarHBondContact NH2-OE1 3.32Å
52	Q	83.4	Confident	77	Confident	98 Å²	98	71.7 Å²	71.7	46%	0.458	37%	0.365	S	S	.	.	H	α-helix	trans	-67.1	-25.7	179.7	-68.5	178	1.2	0	0	113.7	E48 Q49 Q50 L54 F57	E48-Q52 WeakPolarHBondContact O-CG 3.21Å; E48-Q52 PolarHBondContact O-N 3.33Å; E48-Q52 VanDerWaalsContact O-N 3.1Å; Q49-Q52 PolarHBondContact O-N 2.78Å; Q50-Q52 VanDerWaalsContact C-N 3.32Å; Q50-Q52 PolarHBondContact O-N 3.39Å; Q52-L54 VanDerWaalsContact C-N 3.29Å; Q52-F57 HydrophobicContact CB-CD1 4.31Å; Q52-F57 HydrophobicContact CB-CE1 4.25Å; Q52-F57 HydrophobicContact CB-CZ 4.42Å; Q52-F57 HydrophobicContact CG-CD1 4.5Å; Q52-F57 HydrophobicContact CG-CD2 4.39Å; Q52-F57 HydrophobicContact CG-CE1 4.05Å; Q52-F57 HydrophobicContact CG-CE2 3.94Å; Q52-F57 HydrophobicContact CG-CZ 3.76Å
53	Q	83.2	Confident	79.8	Confident	95 Å²	95	65.1 Å²	65.1	44%	0.444	33%	0.329	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79	-10.9	177	-69.4	177.6	11.6	0	0	113.4	Q49 Q50 R51	Q49-Q53 WeakPolarHBondContact O-CG 3.4Å; Q49-Q53 PolarHBondContact O-N 3Å; Q50-Q53 PolarHBondContact O-N 3.34Å; R51-Q53 VanDerWaalsContact C-N 3.27Å; R51-Q53 PolarHBondContact O-N 3.48Å
54	L	83.4	Confident	82.4	Confident	22 Å²	22	63.2 Å²	63.2	12%	0.115	32%	0.316	C	S	.	.	S	Bend	trans	-72.3	136.7	179.8	-66.1	172.1	0	0	0	110.5	R51 Q52 V56 F57 Q86	R51-L54 WeakPolarHBondContact O-CB 3.34Å; R51-L54 PolarHBondContact O-N 2.9Å; Q52-L54 VanDerWaalsContact C-N 3.29Å; L54-V56 HydrophobicContact CB-CG1 4.35Å; L54-V56 PolarHBondContact O-N 3.38Å; L54-V56 VanDerWaalsContact O-N 3.07Å; L54-F57 VanDerWaalsContact O-CB 3.24Å; L54-F57 WeakPolarHBondContact O-CB 3.45Å; L54-F57 PolarHBondContact O-N 2.69Å; L54-Q86 HydrophobicContact CD1-CG 3.66Å
55	P	84.3	Confident	84.6	Confident	15 Å²	15	55.1 Å²	55.1	10%	0.097	28%	0.279	C	S	.	.	G	3₁₀ helix	trans	-51.5	-37.6	-178.6	-29.8	33.9	0	0	0	114.5	F57 T58 V254 G256	P55-F57 PolarHBondContact O-N 3.23Å; P55-T58 PolarHBondContact O-N 2.72Å; P55-T58 PolarHBondContact O-OG1 2.94Å; P55-V254 HydrophobicContact CB-CG1 3.96Å; P55-G256 WeakPolarHBondContact CG-O 3.44Å
56	V	90.4	Very high	86.6	Confident	0 Å²	0	52 Å²	52	0%	0	27%	0.266	C	S	.	.	G	3₁₀ helix	trans	-63.6	-23.1	-179.8	73.4	0	0	0	0	113.7	L54 T58 K59 R60 S81 Q86 L87 Y90 V254	L54-V56 HydrophobicContact CB-CG1 4.35Å; L54-V56 PolarHBondContact O-N 3.38Å; L54-V56 VanDerWaalsContact O-N 3.07Å; V56-T58 VanDerWaalsContact C-N 3.31Å; V56-T58 PolarHBondContact O-N 3.38Å; V56-K59 CarbonylContact O-C 3.47Å; V56-K59 PolarHBondContact O-N 2.8Å; V56-R60 PolarHBondContact O-N 3.31Å; V56-S81 VanDerWaalsContact CB-O 3.3Å; V56-S81 WeakPolarHBondContact CB-O 3.36Å; V56-S81 VanDerWaalsContact CG1-O 3.27Å; V56-S81 WeakPolarHBondContact CG1-O 3.42Å; V56-S81 PolarHBondContact N-O 3.44Å; V56-S81 VanDerWaalsContact N-O 3.14Å; V56-Q86 HydrophobicContact CG1-CB 3.7Å; V56-Q86 HydrophobicContact CG1-CG 3.8Å; V56-L87 HydrophobicContact CG2-CD2 3.58Å; V56-L87 HydrophobicContact CG2-CG 4.27Å; V56-Y90 HydrophobicContact CG1-CE2 4.37Å; V56-Y90 HydrophobicContact CG2-CE2 4.39Å; V56-V254 HydrophobicContact CB-CG1 4.17Å; V56-V254 HydrophobicContact CG2-CG2 4.23Å
57	F	89.8	Confident	87.6	Confident	81 Å²	81	49 Å²	49	36%	0.355	25%	0.245	S	C	.	.	G	3₁₀ helix	trans	-61.3	-41	-179.6	-175.8	-99.8	0	0	0	111.7	Q52 L54 P55 K59 R60 Y90	Q52-F57 HydrophobicContact CB-CD1 4.31Å; Q52-F57 HydrophobicContact CB-CE1 4.25Å; Q52-F57 HydrophobicContact CB-CZ 4.42Å; Q52-F57 HydrophobicContact CG-CD1 4.5Å; Q52-F57 HydrophobicContact CG-CD2 4.39Å; Q52-F57 HydrophobicContact CG-CE1 4.05Å; Q52-F57 HydrophobicContact CG-CE2 3.94Å; Q52-F57 HydrophobicContact CG-CZ 3.76Å; L54-F57 VanDerWaalsContact O-CB 3.24Å; L54-F57 WeakPolarHBondContact O-CB 3.45Å; L54-F57 PolarHBondContact O-N 2.69Å; P55-F57 PolarHBondContact O-N 3.23Å; F57-K59 PolarHBondContact O-N 2.86Å; F57-K59 VanDerWaalsContact O-N 3.1Å; F57-R60 VanDerWaalsContact O-CB 3.32Å; F57-R60 WeakPolarHBondContact O-CB 3.41Å; F57-R60 PolarHBondContact O-N 2.96Å; F57-R60 VanDerWaalsContact O-N 3.1Å; F57-Y90 WeakPolarHBondContact CA-OH 3.17Å
58	T	89.7	Confident	88.4	Confident	111 Å²	111	47.5 Å²	47.5	68%	0.681	23%	0.233	S	C	*	.	G	3₁₀ helix	trans	-61.1	-21.9	177.2	66.1	0	0	0	0	113.3	P55 V56	P55-T58 PolarHBondContact O-N 2.72Å; P55-T58 PolarHBondContact O-OG1 2.94Å; V56-T58 VanDerWaalsContact C-N 3.31Å; V56-T58 PolarHBondContact O-N 3.38Å
59	K	92.2	Very high	89.1	Confident	67 Å²	67	45.3 Å²	45.3	29%	0.291	23%	0.225	S	C	.	.	G	3₁₀ helix	trans	-104.1	8	-178.5	-61.7	-58.4	-168.4	174.2	0	113.3	V56 F57 S61 Q62 F63 L252	V56-K59 CarbonylContact O-C 3.47Å; V56-K59 PolarHBondContact O-N 2.8Å; F57-K59 PolarHBondContact O-N 2.86Å; F57-K59 VanDerWaalsContact O-N 3.1Å; K59-S61 PolarHBondContact O-N 3.14Å; K59-Q62 PolarHBondContact O-N 2.83Å; K59-F63 WeakPolarHBondContact O-CB 2.89Å; K59-F63 PolarHBondContact O-N 2.67Å; K59-L252 HydrophobicContact CB-CD1 4.46Å; K59-L252 HydrophobicContact CB-CD2 4.43Å
60	R	93.6	Very high	89.8	Confident	59 Å²	59	41.5 Å²	41.5	22%	0.223	21%	0.207	C	C	.	.	H	α-helix	trans	-53.5	-52.6	-176.6	-179.7	177.1	-179.7	-105.7	6.2	112.8	V56 F57 F63 L64 Y90 E93	V56-R60 PolarHBondContact O-N 3.31Å; F57-R60 VanDerWaalsContact O-CB 3.32Å; F57-R60 WeakPolarHBondContact O-CB 3.41Å; F57-R60 PolarHBondContact O-N 2.96Å; F57-R60 VanDerWaalsContact O-N 3.1Å; R60-F63 WeakPolarHBondContact O-CB 3.22Å; R60-F63 PolarHBondContact O-N 2.72Å; R60-L64 HydrophobicContact CG-CD1 4.34Å; R60-L64 WeakPolarHBondContact O-CG 3.36Å; R60-L64 PolarHBondContact O-N 3.43Å; R60-Y90 HydrophobicContact CB-CD2 4.23Å; R60-Y90 HydrophobicContact CB-CE2 3.97Å; R60-Y90 HydrophobicContact CG-CD1 4.13Å; R60-Y90 HydrophobicContact CG-CD2 3.87Å; R60-Y90 HydrophobicContact CG-CE1 4.28Å; R60-Y90 HydrophobicContact CG-CE2 4Å; R60-Y90 HydrophobicContact CG-CG 3.94Å; R60-E93 IonicContact CZ-OE2 3.5Å; R60-E93 IonicContact NE-OE2 3.92Å; R60-E93 IonicContact NH2-OE2 3.65Å; R60-E93 PolarHBondContact NH2-OE2 3.41Å
61	S	92.9	Very high	90.6	Very high	70 Å²	70	39.4 Å²	39.4	49%	0.49	20%	0.197	S	C	.	.	H	α-helix	trans	-64.3	-43.4	-178.5	-52.5	0	0	0	0	112	K59 F63 L64 Y65	K59-S61 PolarHBondContact O-N 3.14Å; S61-F63 VanDerWaalsContact C-N 3.33Å; S61-F63 PolarHBondContact O-N 2.93Å; S61-L64 PolarHBondContact O-N 3.16Å; S61-Y65 WeakPolarHBondContact O-CB 3.39Å; S61-Y65 PolarHBondContact O-N 2.85Å
62	Q	93.7	Very high	91.2	Very high	56 Å²	56	38.9 Å²	38.9	26%	0.262	20%	0.195	S	C	.	.	H	α-helix	trans	-62.7	-40.6	176.9	-170.8	174.7	15.4	0	0	111.5	P8 K59 L66 L252	P8-Q62 HydrophobicContact CB-CB 4.45Å; P8-Q62 HydrophobicContact CB-CG 3.94Å; P8-Q62 HydrophobicContact CG-CG 4.24Å; K59-Q62 PolarHBondContact O-N 2.83Å; Q62-L66 HydrophobicContact CG-CD1 4.15Å; Q62-L66 WeakPolarHBondContact O-CB 3.42Å; Q62-L66 VanDerWaalsContact O-CG 3.27Å; Q62-L66 WeakPolarHBondContact O-CG 3.35Å; Q62-L66 PolarHBondContact O-N 2.98Å; Q62-L252 HydrophobicContact CB-CD1 4.35Å; Q62-L252 HydrophobicContact CG-CD1 3.81Å
63	F	96.2	Very high	91.8	Very high	0 Å²	0	34.3 Å²	34.3	0%	0	17%	0.174	C	C	.	.	H	α-helix	trans	-59.7	-49.5	174.3	166.7	-101.6	0	0	0	112	K59 R60 S61 L66 L67 L73 V75 L87 Y90 V91 I214 L252	K59-F63 WeakPolarHBondContact O-CB 2.89Å; K59-F63 PolarHBondContact O-N 2.67Å; R60-F63 WeakPolarHBondContact O-CB 3.22Å; R60-F63 PolarHBondContact O-N 2.72Å; S61-F63 VanDerWaalsContact C-N 3.33Å; S61-F63 PolarHBondContact O-N 2.93Å; F63-L66 PolarHBondContact O-N 3.46Å; F63-L67 HydrophobicContact CE1-CD2 4.32Å; F63-L67 HydrophobicContact CZ-CD2 4.22Å; F63-L67 WeakPolarHBondContact O-CB 3.25Å; F63-L67 PolarHBondContact O-N 3.27Å; F63-L73 HydrophobicContact CD2-CD2 3.55Å; F63-L73 HydrophobicContact CE2-CD2 3.72Å; F63-V75 HydrophobicContact CD2-CG2 4.39Å; F63-V75 HydrophobicContact CE2-CG2 4.47Å; F63-L87 HydrophobicContact CD1-CD2 4.01Å; F63-L87 HydrophobicContact CD2-CD2 3.67Å; F63-L87 HydrophobicContact CE1-CB 4.46Å; F63-L87 HydrophobicContact CE1-CD2 4.08Å; F63-L87 HydrophobicContact CE2-CB 4.33Å; F63-L87 HydrophobicContact CE2-CD1 4.22Å; F63-L87 HydrophobicContact CE2-CD2 3.75Å; F63-L87 HydrophobicContact CE2-CG 4.31Å; F63-L87 HydrophobicContact CG-CD2 3.81Å; F63-L87 HydrophobicContact CZ-CB 4.01Å; F63-L87 HydrophobicContact CZ-CD2 3.95Å; F63-L87 HydrophobicContact CZ-CG 4.43Å; F63-Y90 HydrophobicContact CD1-CD2 4.28Å; F63-V91 HydrophobicContact CE1-CG2 3.99Å; F63-V91 HydrophobicContact CZ-CG2 3.89Å; F63-I214 HydrophobicContact CE2-CD1 3.89Å; F63-I214 HydrophobicContact CE2-CG1 4.41Å; F63-I214 HydrophobicContact CZ-CD1 3.69Å; F63-L252 HydrophobicContact CB-CD2 3.69Å; F63-L252 HydrophobicContact CD2-CD2 4.23Å; F63-L252 HydrophobicContact CG-CD2 4.47Å
64	L	95.3	Very high	92.4	Very high	4 Å²	4	29.8 Å²	29.8	2%	0.021	15%	0.153	C	C	.	.	H	α-helix	trans	-64.5	-41.5	-179.2	-68.5	175.8	0	0	0	112.1	F5 R60 S61 L67 E68 A94	F5-L64 HydrophobicContact CD1-CB 3.89Å; F5-L64 HydrophobicContact CD1-CD1 4.11Å; F5-L64 HydrophobicContact CD2-CB 3.92Å; F5-L64 HydrophobicContact CE1-CB 4.04Å; F5-L64 HydrophobicContact CE1-CD1 3.69Å; F5-L64 HydrophobicContact CE1-CG 4.44Å; F5-L64 HydrophobicContact CE2-CB 4.07Å; F5-L64 HydrophobicContact CG-CB 3.83Å; F5-L64 HydrophobicContact CZ-CB 4.14Å; F5-L64 HydrophobicContact CZ-CD1 4.11Å; R60-L64 HydrophobicContact CG-CD1 4.34Å; R60-L64 WeakPolarHBondContact O-CG 3.36Å; R60-L64 PolarHBondContact O-N 3.43Å; S61-L64 PolarHBondContact O-N 3.16Å; L64-L67 PolarHBondContact O-N 2.89Å; L64-E68 PolarHBondContact O-N 3.3Å; L64-A94 HydrophobicContact CD1-CB 4.08Å; L64-A94 HydrophobicContact CD2-CB 3.57Å; L64-A94 HydrophobicContact CG-CB 4.44Å
65	Y	94.7	Very high	93	Very high	42 Å²	42	28.8 Å²	28.8	17%	0.165	15%	0.147	C	C	.	.	H	α-helix	trans	-57.3	-50.6	172.7	175.4	-94.2	0	0	0	111.6	S3 F5 H7 P8 S61 L67 E68 N69	S3-Y65 WeakPolarHBondContact OG-CD2 3.1Å; F5-Y65 WeakPolarHBondContact O-CD2 3.45Å; H7-Y65 HydrophobicContact CB-CE2 4.34Å; H7-Y65 AromaticContact CD2-CE1 3.96Å; H7-Y65 AromaticContact CD2-CZ 3.52Å; H7-Y65 PolarHBondContact CD2-OH 3.3Å; H7-Y65 VanDerWaalsContact CD2-OH 3.25Å; P8-Y65 HydrophobicContact CG-CD1 4.42Å; S61-Y65 WeakPolarHBondContact O-CB 3.39Å; S61-Y65 PolarHBondContact O-N 2.85Å; Y65-L67 VanDerWaalsContact C-N 3.35Å; Y65-L67 PolarHBondContact O-N 2.8Å; Y65-E68 PolarHBondContact O-N 3.26Å; Y65-N69 WeakPolarHBondContact CD2-ND2 3.21Å; Y65-N69 WeakPolarHBondContact CE2-ND2 3.11Å; Y65-N69 PolarHBondContact O-N 2.95Å; Y65-N69 VanDerWaalsContact O-N 3.16Å; Y65-N69 PolarHBondContact O-ND2 3.28Å
66	L	95	Very high	93.3	Very high	22 Å²	22	28.1 Å²	28.1	12%	0.115	14%	0.143	C	C	.	.	H	α-helix	trans	-67.6	-35.7	-178.5	-69.6	174.8	0	0	0	112.3	Q62 F63 E68 N69 S70 L73 L252	Q62-L66 HydrophobicContact CG-CD1 4.15Å; Q62-L66 WeakPolarHBondContact O-CB 3.42Å; Q62-L66 VanDerWaalsContact O-CG 3.27Å; Q62-L66 WeakPolarHBondContact O-CG 3.35Å; Q62-L66 PolarHBondContact O-N 2.98Å; F63-L66 PolarHBondContact O-N 3.46Å; L66-E68 VanDerWaalsContact C-N 3.33Å; L66-N69 PolarHBondContact O-N 3.48Å; L66-S70 WeakPolarHBondContact O-CB 3.46Å; L66-S70 PolarHBondContact O-N 3.3Å; L66-S70 PolarHBondContact O-OG 3.22Å; L66-L73 HydrophobicContact CB-CD1 3.8Å; L66-L73 HydrophobicContact CB-CD2 3.97Å; L66-L73 HydrophobicContact CD1-CD1 3.99Å; L66-L252 HydrophobicContact CD1-CB 3.98Å; L66-L252 HydrophobicContact CD1-CD1 4.23Å
67	L	94.1	Very high	93.2	Very high	2 Å²	2	28.4 Å²	28.4	1%	0.01	15%	0.146	C	C	.	.	H	α-helix	trans	-62.9	-39.7	175.8	-177.9	70.1	0	0	0	111.8	F63 L64 Y65 L73 V91 W96 V180 R212 I214	F63-L67 HydrophobicContact CE1-CD2 4.32Å; F63-L67 HydrophobicContact CZ-CD2 4.22Å; F63-L67 WeakPolarHBondContact O-CB 3.25Å; F63-L67 PolarHBondContact O-N 3.27Å; L64-L67 PolarHBondContact O-N 2.89Å; Y65-L67 VanDerWaalsContact C-N 3.35Å; Y65-L67 PolarHBondContact O-N 2.8Å; L67-L73 HydrophobicContact CB-CD2 4.41Å; L67-V91 HydrophobicContact CD2-CG2 3.72Å; L67-W96 HydrophobicContact CD2-CD2 4.47Å; L67-V180 HydrophobicContact CD1-CG1 4.49Å; L67-R212 HydrophobicContact CD1-CB 3.98Å; L67-R212 HydrophobicContact CD1-CG 4.36Å; L67-R212 VanDerWaalsContact O-CD 3.28Å; L67-R212 WeakPolarHBondContact O-CD 3.37Å; L67-R212 PolarHBondContact O-NE 2.86Å; L67-R212 VanDerWaalsContact O-NE 3.1Å; L67-I214 HydrophobicContact CD1-CD1 4.03Å; L67-I214 HydrophobicContact CD1-CG1 3.93Å
68	E	91.3	Very high	92.6	Very high	30 Å²	30	27.7 Å²	27.7	14%	0.14	14%	0.144	C	C	.	.	H	α-helix	trans	-67.1	-43.3	178.2	-171.5	164	-141.1	0	0	111.8	S3 R4 F5 L64 Y65 L66 W96 R212 L246	S3-E68 PolarHBondContact OG-OE2 2.67Å; R4-E68 PolarHBondContact N-OE2 3.41Å; R4-E68 IonicContact NE-OE1 2.88Å; F5-E68 WeakPolarHBondContact CD2-OE2 3.35Å; L64-E68 PolarHBondContact O-N 3.3Å; Y65-E68 PolarHBondContact O-N 3.26Å; L66-E68 VanDerWaalsContact C-N 3.33Å; E68-W96 HydrophobicContact CB-CZ2 3.94Å; E68-W96 HydrophobicContact CG-CZ2 4.11Å; E68-R212 PolarHBondContact O-NH2 3.14Å; E68-L246 WeakPolarHBondContact O-CD2 3.46Å
69	N	91.1	Very high	92	Very high	38 Å²	38	23.4 Å²	23.4	20%	0.203	12%	0.117	C	C	.	.	H	α-helix	trans	-92.8	-7.4	-170.5	-65.4	-69.2	0	0	0	114.9	Y65 L66 L246 T247	Y65-N69 WeakPolarHBondContact CD2-ND2 3.21Å; Y65-N69 WeakPolarHBondContact CE2-ND2 3.11Å; Y65-N69 PolarHBondContact O-N 2.95Å; Y65-N69 VanDerWaalsContact O-N 3.16Å; Y65-N69 PolarHBondContact O-ND2 3.28Å; L66-N69 PolarHBondContact O-N 3.48Å; N69-L246 WeakPolarHBondContact O-CA 3.3Å; N69-T247 PolarHBondContact O-N 3.07Å
70	S	92	Very high	91.2	Very high	2 Å²	2	21.5 Å²	21.5	1%	0.014	12%	0.117	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	145.2	-176.6	-40.5	0	0	0	0	112.1	L66 R212 T247 S250	L66-S70 WeakPolarHBondContact O-CB 3.46Å; L66-S70 PolarHBondContact O-N 3.3Å; L66-S70 PolarHBondContact O-OG 3.22Å; S70-R212 WeakPolarHBondContact O-CD 3.42Å; S70-R212 PolarHBondContact O-NE 3.32Å; S70-T247 CarbonylContact C-O 3.58Å; S70-T247 WeakPolarHBondContact CA-O 3.49Å; S70-S250 WeakPolarHBondContact OG-CB 3.21Å; S70-S250 PolarHBondContact OG-OG 2.97Å
71	R	92.4	Very high	90.8	Very high	3 Å²	3	18.8 Å²	18.8	1%	0.011	11%	0.107	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.6	-43.9	173.7	-63.2	-75.6	-63	153.9	7.9	111.3	L204 R207 P208 L211 V213 M232 I234 L246 T247 P248	R71-L204 VanDerWaalsContact NH2-CD2 3.26Å; R71-L204 PolarHBondContact NH2-O 2.88Å; R71-R207 PolarHBondContact NH1-O 3.39Å; R71-R207 PolarHBondContact NH2-O 3.49Å; R71-P208 VanDerWaalsContact CZ-C 3.43Å; R71-P208 VanDerWaalsContact CZ-O 3.23Å; R71-P208 PolarHBondContact NE-O 2.95Å; R71-P208 PolarHBondContact NH1-O 3.08Å; R71-L211 PolarHBondContact NH1-O 3.29Å; R71-L211 VanDerWaalsContact NH1-O 3.1Å; R71-V213 PolarHBondContact O-N 3.23Å; R71-V213 VanDerWaalsContact O-N 3.08Å; R71-M232 HydrophobicContact CB-CE 3.93Å; R71-M232 HydrophobicContact CG-CE 4.24Å; R71-I234 HydrophobicContact CG-CD1 4.04Å; R71-L246 HydrophobicContact CG-CB 4.13Å; R71-L246 HydrophobicContact CG-CD1 4.46Å; R71-T247 PolarHBondContact N-O 2.7Å; R71-P248 WeakPolarHBondContact CB-O 3.35Å
72	V	95.9	Very high	90.5	Very high	0 Å²	0	15.9 Å²	15.9	0%	0	9%	0.087	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	132.5	176.9	-174.7	0	0	0	0	108.9	L204 V213 I215 F229 P248 V249 S250	V72-L204 HydrophobicContact CG2-CD1 3.69Å; V72-V213 CarbonylContact C-O 3.49Å; V72-V213 VanDerWaalsContact CA-O 3.3Å; V72-V213 WeakPolarHBondContact CA-O 3.21Å; V72-V213 HydrophobicContact CG1-CG1 4.46Å; V72-V213 HydrophobicContact CG2-CB 4.41Å; V72-I215 HydrophobicContact CG1-CG1 3.79Å; V72-F229 HydrophobicContact CB-CB 4.45Å; V72-F229 HydrophobicContact CB-CG 4.36Å; V72-F229 HydrophobicContact CG1-CB 4.47Å; V72-F229 HydrophobicContact CG1-CD1 4.45Å; V72-F229 HydrophobicContact CG1-CD2 3.94Å; V72-F229 HydrophobicContact CG1-CE2 4.28Å; V72-F229 HydrophobicContact CG1-CG 4.05Å; V72-F229 HydrophobicContact CG2-CB 4.35Å; V72-F229 HydrophobicContact CG2-CD1 3.79Å; V72-F229 HydrophobicContact CG2-CE1 4.25Å; V72-F229 HydrophobicContact CG2-CG 4.05Å; V72-P248 PolarHBondContact N-O 2.92Å; V72-P248 VanDerWaalsContact N-O 3.14Å; V72-V249 HydrophobicContact CB-CB 4.3Å; V72-V249 HydrophobicContact CB-CG2 4.16Å; V72-V249 HydrophobicContact CG1-CG2 4.24Å; V72-V249 CarbonylContact O-C 3.54Å; V72-V249 VanDerWaalsContact O-CA 3.25Å; V72-V249 WeakPolarHBondContact O-CA 3.49Å; V72-S250 PolarHBondContact O-N 3.38Å
73	L	96.6	Very high	90.4	Very high	2 Å²	2	13.4 Å²	13.4	1%	0.01	8%	0.076	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	111.4	174.2	178.8	55.1	0	0	0	109.5	F63 L66 L67 V75 V213 I214 I215 L252	F63-L73 HydrophobicContact CD2-CD2 3.55Å; F63-L73 HydrophobicContact CE2-CD2 3.72Å; L66-L73 HydrophobicContact CB-CD1 3.8Å; L66-L73 HydrophobicContact CB-CD2 3.97Å; L66-L73 HydrophobicContact CD1-CD1 3.99Å; L67-L73 HydrophobicContact CB-CD2 4.41Å; L73-V75 HydrophobicContact CD2-CG2 4.19Å; L73-V75 HydrophobicContact CG-CG2 3.86Å; L73-V213 PolarHBondContact N-O 3.13Å; L73-I214 CarbonylContact O-C 3.59Å; L73-I214 WeakPolarHBondContact O-CA 3.19Å; L73-I215 PolarHBondContact O-N 3.13Å; L73-L252 HydrophobicContact CD1-CB 4.13Å
74	V	96.1	Very high	90.2	Very high	0 Å²	0	14.4 Å²	14.4	0%	0	8%	0.083	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.9	118.1	172.2	-177.2	0	0	0	0	108.1	I215 A222 F225 I226 V249 S250 H251 L252	V74-I215 CarbonylContact C-O 3.57Å; V74-I215 WeakPolarHBondContact CA-O 3.27Å; V74-I215 HydrophobicContact CG2-CB 4.24Å; V74-A222 HydrophobicContact CG1-CB 4.09Å; V74-F225 HydrophobicContact CG2-CB 4.09Å; V74-I226 HydrophobicContact CB-CG1 4.33Å; V74-I226 HydrophobicContact CG2-CG1 4.04Å; V74-V249 HydrophobicContact CG2-CG2 3.82Å; V74-S250 PolarHBondContact N-O 3.2Å; V74-H251 CarbonylContact O-C 3.5Å; V74-H251 WeakPolarHBondContact O-CA 3.49Å; V74-H251 PolarHBondContact O-CD2 2.9Å; V74-L252 PolarHBondContact O-N 3.24Å
75	V	95.2	Very high	90	Very high	0 Å²	0	15.2 Å²	15.2	0%	0	9%	0.088	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	112.9	176.8	-172.9	0	0	0	0	108.9	F63 L73 K83 L87 I214 I215 S216 S217 L252 V254	F63-V75 HydrophobicContact CD2-CG2 4.39Å; F63-V75 HydrophobicContact CE2-CG2 4.47Å; L73-V75 HydrophobicContact CD2-CG2 4.19Å; L73-V75 HydrophobicContact CG-CG2 3.86Å; V75-K83 HydrophobicContact CG1-CD 3.99Å; V75-K83 HydrophobicContact CG1-CG 4.33Å; V75-L87 HydrophobicContact CB-CD1 4.4Å; V75-L87 HydrophobicContact CG1-CD1 4.17Å; V75-L87 HydrophobicContact CG2-CD1 4.25Å; V75-I214 HydrophobicContact CG2-CG2 3.98Å; V75-I215 PolarHBondContact N-O 3.24Å; V75-S216 WeakPolarHBondContact O-CA 3.48Å; V75-S217 PolarHBondContact O-N 2.85Å; V75-L252 WeakPolarHBondContact CA-O 3.44Å; V75-L252 HydrophobicContact CG1-CD2 4.49Å; V75-L252 HydrophobicContact CG2-CB 4.45Å; V75-V254 HydrophobicContact CG1-CG2 3.95Å
76	T	92.1	Very high	90	Very high	2 Å²	2	13.2 Å²	13.2	1%	0.012	8%	0.08	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.7	143.7	169.3	51.4	0	0	0	0	110.7	S217 A222 H251 L252 N253 V254	T76-S217 WeakPolarHBondContact CA-O 3.4Å; T76-A222 HydrophobicContact CG2-CB 3.58Å; T76-H251 PolarHBondContact OG1-NE2 3.14Å; T76-L252 PolarHBondContact N-O 3.07Å; T76-N253 PolarHBondContact OG1-OD1 3.1Å; T76-V254 PolarHBondContact O-N 3.01Å
77	G	86.6	Confident	90	Very high	5 Å²	5	12.1 Å²	12.1	5%	0.052	8%	0.075	C	C	.	.	E	Extended strand (participates in β ladder)	trans	177	152.3	169.5	0	0	0	0	0	110.3	K83 S217 A218 V254	G77-K83 WeakPolarHBondContact O-CE 3.46Å; G77-K83 PolarHBondContact O-NZ 3.19Å; G77-S217 PolarHBondContact N-O 2.91Å; G77-S217 VanDerWaalsContact N-O 3.1Å; G77-A218 VanDerWaalsContact O-CA 3.3Å; G77-A218 WeakPolarHBondContact O-CA 3.46Å; G77-V254 WeakPolarHBondContact CA-O 3.24Å
78	E	78.8	Confident	90.2	Very high	67 Å²	67	12 Å²	12	31%	0.313	7%	0.074	S	C	.	.			trans	-66.8	165.2	-171.1	-62.4	-174.2	120.4	0	0	112.8	G80 S81 K83 R257	E78-G80 PolarHBondContact O-N 3.36Å; E78-S81 VanDerWaalsContact O-CB 3.32Å; E78-S81 WeakPolarHBondContact O-CB 3.38Å; E78-S81 PolarHBondContact O-N 2.91Å; E78-S81 VanDerWaalsContact O-N 3.16Å; E78-S81 PolarHBondContact O-OG 3.25Å; E78-K83 PolarHBondContact O-NZ 3.33Å; E78-K83 VanDerWaalsContact O-NZ 3.15Å; E78-R257 IonicContact OE1-CZ 3.07Å; E78-R257 VanDerWaalsContact OE1-CZ 3.3Å; E78-R257 IonicContact OE1-NE 3.26Å; E78-R257 PolarHBondContact OE1-NE 2.87Å; E78-R257 VanDerWaalsContact OE1-NE 3.07Å; E78-R257 IonicContact OE1-NH2 3.8Å; E78-R257 PolarHBondContact OE1-NH2 3.47Å; E78-R257 WeakPolarHBondContact OE2-CD 3.32Å; E78-R257 WeakPolarHBondContact OE2-CG 3.28Å; E78-R257 IonicContact OE2-CZ 3.38Å; E78-R257 IonicContact OE2-NE 3.59Å; E78-R257 PolarHBondContact OE2-NE 3.21Å; E78-R257 IonicContact OE2-NH2 2.92Å
79	T	76.3	Confident	90.4	Very high	20 Å²	20	10.6 Å²	10.6	12%	0.123	7%	0.067	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.8	132.7	-179	80.9	0	0	0	0	110	A218 R427	T79-A218 HydrophobicContact CG2-CB 3.66Å; T79-R427 PolarHBondContact OG1-NH2 3.43Å
80	G	75.9	Confident	90.6	Very high	28 Å²	28	8.9 Å²	8.9	29%	0.289	6%	0.058	S	C	.	.	T	Hydrogen-bonded Turn	trans	90.4	0.1	-173.1	0	0	0	0	0	114.6	E78 G82	E78-G80 PolarHBondContact O-N 3.36Å; G80-G82 PolarHBondContact O-N 3.49Å
81	S	84	Confident	90.7	Very high	2 Å²	2	8.8 Å²	8.8	1%	0.014	6%	0.057	C	C	.	.	S	Bend	trans	-69.7	-8.2	174.9	64.7	0	0	0	0	114.9	V56 E78 K83	V56-S81 VanDerWaalsContact CB-O 3.3Å; V56-S81 WeakPolarHBondContact CB-O 3.36Å; V56-S81 VanDerWaalsContact CG1-O 3.27Å; V56-S81 WeakPolarHBondContact CG1-O 3.42Å; V56-S81 PolarHBondContact N-O 3.44Å; V56-S81 VanDerWaalsContact N-O 3.14Å; E78-S81 VanDerWaalsContact O-CB 3.32Å; E78-S81 WeakPolarHBondContact O-CB 3.38Å; E78-S81 PolarHBondContact O-N 2.91Å; E78-S81 VanDerWaalsContact O-N 3.16Å; E78-S81 PolarHBondContact O-OG 3.25Å; S81-K83 WeakPolarHBondContact OG-CG 3.33Å; S81-K83 PolarHBondContact OG-NZ 3.07Å
82	G	86.7	Confident	90.8	Very high	8 Å²	8	12 Å²	12	8%	0.082	7%	0.07	C	C	.	.	S	Bend	trans	95.1	4.6	179	0	0	0	0	0	115.8	G80 S84 T85 Q86	G80-G82 PolarHBondContact O-N 3.49Å; G82-S84 PolarHBondContact O-N 2.8Å; G82-T85 PolarHBondContact O-N 2.78Å; G82-T85 PolarHBondContact O-OG1 3.35Å; G82-Q86 WeakPolarHBondContact O-CB 3.37Å; G82-Q86 WeakPolarHBondContact O-CG 3.46Å; G82-Q86 PolarHBondContact O-N 3.41Å
83	K	91.3	Very high	90.6	Very high	5 Å²	5	15 Å²	15	2%	0.022	8%	0.084	C	C	.	.	H	α-helix	trans	-51.5	-56.7	-176.3	-64.9	-179.6	-50.7	-62	0	113.4	V75 G77 E78 S81 T85 L87 S216	V75-K83 HydrophobicContact CG1-CD 3.99Å; V75-K83 HydrophobicContact CG1-CG 4.33Å; G77-K83 WeakPolarHBondContact O-CE 3.46Å; G77-K83 PolarHBondContact O-NZ 3.19Å; E78-K83 PolarHBondContact O-NZ 3.33Å; E78-K83 VanDerWaalsContact O-NZ 3.15Å; S81-K83 WeakPolarHBondContact OG-CG 3.33Å; S81-K83 PolarHBondContact OG-NZ 3.07Å; K83-T85 VanDerWaalsContact C-N 3.26Å; K83-T85 PolarHBondContact O-N 3.3Å; K83-L87 HydrophobicContact CB-CD1 3.99Å; K83-L87 HydrophobicContact CB-CG 4.49Å; K83-L87 HydrophobicContact CG-CD1 4.35Å; K83-L87 VanDerWaalsContact O-CB 3.29Å; K83-L87 WeakPolarHBondContact O-CB 3.44Å; K83-L87 VanDerWaalsContact O-CG 3.24Å; K83-L87 WeakPolarHBondContact O-CG 3.44Å; K83-L87 PolarHBondContact O-N 2.97Å; K83-L87 VanDerWaalsContact O-N 3.11Å; K83-S216 WeakPolarHBondContact CE-OG 3.34Å
84	S	92	Very high	90.4	Very high	20 Å²	20	15.7 Å²	15.7	14%	0.14	9%	0.09	C	C	.	.	H	α-helix	trans	-68.3	-23.1	-173	-39.1	0	0	0	0	113.8	G82 Y159 D184	G82-S84 PolarHBondContact O-N 2.8Å; S84-Y159 PolarHBondContact O-OH 3.1Å; S84-D184 WeakPolarHBondContact CB-OD2 3.3Å; S84-D184 PolarHBondContact OG-OD2 3.43Å
85	T	92	Very high	90.1	Very high	21 Å²	21	16.6 Å²	16.6	13%	0.129	10%	0.099	C	C	.	.	H	α-helix	trans	-97.6	-44.6	179.9	52.6	0	0	0	0	111.9	G82 K83 Q89 L124 R127	G82-T85 PolarHBondContact O-N 2.78Å; G82-T85 PolarHBondContact O-OG1 3.35Å; K83-T85 VanDerWaalsContact C-N 3.26Å; K83-T85 PolarHBondContact O-N 3.3Å; T85-Q89 WeakPolarHBondContact O-CG 3.29Å; T85-Q89 PolarHBondContact O-NE2 3.1Å; T85-L124 HydrophobicContact CG2-CD2 3.65Å; T85-R127 HydrophobicContact CG2-CG 4.18Å
86	Q	94.5	Very high	89.8	Confident	0 Å²	0	17.4 Å²	17.4	0%	0	10%	0.102	C	C	.	.	H	α-helix	trans	-88.6	-38.2	-171.2	-59.1	-51.6	-64.5	0	0	113.9	L54 V56 G82 Q89 Y90 E131	L54-Q86 HydrophobicContact CD1-CG 3.66Å; V56-Q86 HydrophobicContact CG1-CB 3.7Å; V56-Q86 HydrophobicContact CG1-CG 3.8Å; G82-Q86 WeakPolarHBondContact O-CB 3.37Å; G82-Q86 WeakPolarHBondContact O-CG 3.46Å; G82-Q86 PolarHBondContact O-N 3.41Å; Q86-Q89 WeakPolarHBondContact O-CA 3.33Å; Q86-Q89 WeakPolarHBondContact O-CB 3.48Å; Q86-Q89 PolarHBondContact O-N 3.48Å; Q86-Y90 HydrophobicContact CB-CE1 4.08Å; Q86-Y90 HydrophobicContact CB-CE2 3.88Å; Q86-Y90 WeakPolarHBondContact O-CD1 3.25Å; Q86-Y90 VanDerWaalsContact O-CG 3.3Å; Q86-Y90 PolarHBondContact O-N 3.17Å; Q86-E131 PolarHBondContact NE2-OE2 2.99Å
87	L	96.2	Very high	89.6	Confident	0 Å²	0	17.7 Å²	17.7	0%	0	10%	0.104	C	C	.	.	H	α-helix	trans	-58.9	-44.2	-177.3	-60.2	178	0	0	0	112.2	V56 F63 V75 K83 Q89 Y90 V91 M182	V56-L87 HydrophobicContact CG2-CD2 3.58Å; V56-L87 HydrophobicContact CG2-CG 4.27Å; F63-L87 HydrophobicContact CD1-CD2 4.01Å; F63-L87 HydrophobicContact CD2-CD2 3.67Å; F63-L87 HydrophobicContact CE1-CB 4.46Å; F63-L87 HydrophobicContact CE1-CD2 4.08Å; F63-L87 HydrophobicContact CE2-CB 4.33Å; F63-L87 HydrophobicContact CE2-CD1 4.22Å; F63-L87 HydrophobicContact CE2-CD2 3.75Å; F63-L87 HydrophobicContact CE2-CG 4.31Å; F63-L87 HydrophobicContact CG-CD2 3.81Å; F63-L87 HydrophobicContact CZ-CB 4.01Å; F63-L87 HydrophobicContact CZ-CD2 3.95Å; F63-L87 HydrophobicContact CZ-CG 4.43Å; V75-L87 HydrophobicContact CB-CD1 4.4Å; V75-L87 HydrophobicContact CG1-CD1 4.17Å; V75-L87 HydrophobicContact CG2-CD1 4.25Å; K83-L87 HydrophobicContact CB-CD1 3.99Å; K83-L87 HydrophobicContact CB-CG 4.49Å; K83-L87 HydrophobicContact CG-CD1 4.35Å; K83-L87 VanDerWaalsContact O-CB 3.29Å; K83-L87 WeakPolarHBondContact O-CB 3.44Å; K83-L87 VanDerWaalsContact O-CG 3.24Å; K83-L87 WeakPolarHBondContact O-CG 3.44Å; K83-L87 PolarHBondContact O-N 2.97Å; K83-L87 VanDerWaalsContact O-N 3.11Å; L87-Q89 VanDerWaalsContact C-N 3.28Å; L87-Q89 PolarHBondContact O-N 3.08Å; L87-Y90 HydrophobicContact CD2-CD2 4.2Å; L87-Y90 PolarHBondContact O-N 2.96Å; L87-V91 WeakPolarHBondContact O-CG2 3.42Å; L87-V91 PolarHBondContact O-N 2.69Å; L87-M182 HydrophobicContact CB-SD 4.5Å; L87-M182 HydrophobicContact CD1-CE 4.13Å
88	P	96.5	Very high	89.2	Confident	0 Å²	0	22.5 Å²	22.5	0%	0	13%	0.129	C	C	.	.	H	α-helix	trans	-61.2	-36.3	174.8	-24	36.2	0	0	0	113.4	V91 Y92 M111 V113 I157 M182	P88-V91 PolarHBondContact O-N 2.68Å; P88-Y92 PolarHBondContact O-N 2.92Å; P88-Y92 VanDerWaalsContact O-N 3.11Å; P88-M111 VanDerWaalsContact CA-SD 3.58Å; P88-M111 HydrophobicContact CB-CE 3.88Å; P88-M111 HydrophobicContact CB-SD 3.75Å; P88-M111 HydrophobicContact CG-CE 3.89Å; P88-M111 HydrophobicContact CG-SD 4.42Å; P88-V113 HydrophobicContact CB-CG2 4.14Å; P88-V113 HydrophobicContact CG-CG2 3.64Å; P88-I157 HydrophobicContact CB-CD1 4.02Å; P88-I157 HydrophobicContact CB-CG2 4.11Å; P88-M182 HydrophobicContact CG-SD 4.13Å
89	Q	95.4	Very high	88.6	Confident	0 Å²	0	22.9 Å²	22.9	0%	0	14%	0.139	C	C	.	.	H	α-helix	trans	-67.3	-41.3	176.2	-65.8	178.5	57.1	0	0	111.4	T85 Q86 L87 V91 Y92 E93 V128 E131 K132	T85-Q89 WeakPolarHBondContact O-CG 3.29Å; T85-Q89 PolarHBondContact O-NE2 3.1Å; Q86-Q89 WeakPolarHBondContact O-CA 3.33Å; Q86-Q89 WeakPolarHBondContact O-CB 3.48Å; Q86-Q89 PolarHBondContact O-N 3.48Å; L87-Q89 VanDerWaalsContact C-N 3.28Å; L87-Q89 PolarHBondContact O-N 3.08Å; Q89-V91 VanDerWaalsContact C-N 3.33Å; Q89-V91 PolarHBondContact O-N 3.45Å; Q89-Y92 PolarHBondContact O-N 2.84Å; Q89-E93 WeakPolarHBondContact O-CB 3.33Å; Q89-E93 WeakPolarHBondContact O-CG 3.29Å; Q89-E93 PolarHBondContact O-N 3.06Å; Q89-V128 HydrophobicContact CG-CG1 4.02Å; Q89-E131 PolarHBondContact NE2-OE2 3.19Å; Q89-K132 HydrophobicContact CG-CG 4.39Å; Q89-K132 VanDerWaalsContact OE1-CE 3.27Å
90	Y	95.6	Very high	87.6	Confident	1 Å²	1	31 Å²	31	0%	0.004	17%	0.172	C	C	.	.	H	α-helix	trans	-64.2	-38.7	176.7	-59.8	-19.3	0	0	0	112	V56 F57 R60 F63 Q86 L87 Y92 E93 A94	V56-Y90 HydrophobicContact CG1-CE2 4.37Å; V56-Y90 HydrophobicContact CG2-CE2 4.39Å; F57-Y90 WeakPolarHBondContact CA-OH 3.17Å; R60-Y90 HydrophobicContact CB-CD2 4.23Å; R60-Y90 HydrophobicContact CB-CE2 3.97Å; R60-Y90 HydrophobicContact CG-CD1 4.13Å; R60-Y90 HydrophobicContact CG-CD2 3.87Å; R60-Y90 HydrophobicContact CG-CE1 4.28Å; R60-Y90 HydrophobicContact CG-CE2 4Å; R60-Y90 HydrophobicContact CG-CG 3.94Å; F63-Y90 HydrophobicContact CD1-CD2 4.28Å; Q86-Y90 HydrophobicContact CB-CE1 4.08Å; Q86-Y90 HydrophobicContact CB-CE2 3.88Å; Q86-Y90 WeakPolarHBondContact O-CD1 3.25Å; Q86-Y90 VanDerWaalsContact O-CG 3.3Å; Q86-Y90 PolarHBondContact O-N 3.17Å; L87-Y90 HydrophobicContact CD2-CD2 4.2Å; L87-Y90 PolarHBondContact O-N 2.96Å; Y90-Y92 VanDerWaalsContact C-N 3.34Å; Y90-E93 PolarHBondContact O-N 3.2Å; Y90-A94 WeakPolarHBondContact O-CB 3.43Å; Y90-A94 PolarHBondContact O-N 3.29Å
91	V	95.3	Very high	86.5	Confident	0 Å²	0	33.3 Å²	33.3	0%	0	18%	0.184	C	C	.	.	H	α-helix	trans	-59.4	-47.2	173.7	173.5	0	0	0	0	110.7	F63 L67 L87 P88 Q89 A94 W96 L97 M111 V180 I214	F63-V91 HydrophobicContact CE1-CG2 3.99Å; F63-V91 HydrophobicContact CZ-CG2 3.89Å; L67-V91 HydrophobicContact CD2-CG2 3.72Å; L87-V91 WeakPolarHBondContact O-CG2 3.42Å; L87-V91 PolarHBondContact O-N 2.69Å; P88-V91 PolarHBondContact O-N 2.68Å; Q89-V91 VanDerWaalsContact C-N 3.33Å; Q89-V91 PolarHBondContact O-N 3.45Å; V91-A94 PolarHBondContact O-N 3.09Å; V91-W96 HydrophobicContact CG1-CB 3.78Å; V91-W96 HydrophobicContact CG1-CG 4.39Å; V91-W96 WeakPolarHBondContact O-CB 3.19Å; V91-W96 PolarHBondContact O-N 3.39Å; V91-L97 HydrophobicContact CG1-CD1 4.45Å; V91-L97 HydrophobicContact CG1-CD2 4.31Å; V91-L97 HydrophobicContact CG1-CG 4.25Å; V91-M111 HydrophobicContact CB-SD 3.9Å; V91-M111 HydrophobicContact CG1-SD 3.93Å; V91-M111 HydrophobicContact CG2-CE 4.27Å; V91-M111 HydrophobicContact CG2-SD 4.06Å; V91-V180 HydrophobicContact CG1-CB 4.25Å; V91-V180 HydrophobicContact CG1-CG1 4.46Å; V91-V180 HydrophobicContact CG1-CG2 3.8Å; V91-I214 HydrophobicContact CG2-CD1 4.27Å
92	Y	93.8	Very high	85.1	Confident	70 Å²	70	36 Å²	36	28%	0.275	20%	0.202	S	C	.	.	H	α-helix	trans	-62.3	-52	177.1	171.9	-99.3	0	0	0	112	P88 Q89 Y90 A94 G95 L97 W134 V156	P88-Y92 PolarHBondContact O-N 2.92Å; P88-Y92 VanDerWaalsContact O-N 3.11Å; Q89-Y92 PolarHBondContact O-N 2.84Å; Y90-Y92 VanDerWaalsContact C-N 3.34Å; Y92-A94 PolarHBondContact O-N 3.16Å; Y92-G95 PolarHBondContact O-N 2.91Å; Y92-L97 HydrophobicContact CD2-CB 4.43Å; Y92-L97 HydrophobicContact CD2-CD1 4.3Å; Y92-W134 AromaticContact CD1-CH2 3.62Å; Y92-W134 HydrophobicContact CD1-CH2 3.62Å; Y92-W134 AromaticContact CD1-CZ2 3.99Å; Y92-W134 HydrophobicContact CD1-CZ2 3.99Å; Y92-W134 HydrophobicContact CD2-CH2 4.27Å; Y92-W134 AromaticContact CE1-CH2 3.5Å; Y92-W134 HydrophobicContact CE1-CH2 3.5Å; Y92-W134 VanDerWaalsContact CE1-CH2 3.5Å; Y92-W134 AromaticContact CE1-CZ2 3.41Å; Y92-W134 HydrophobicContact CE1-CZ2 3.41Å; Y92-W134 VanDerWaalsContact CE1-CZ2 3.41Å; Y92-W134 HydrophobicContact CE2-CH2 4.17Å; Y92-W134 HydrophobicContact CE2-CZ2 4.47Å; Y92-W134 HydrophobicContact CG-CH2 4Å; Y92-W134 AromaticContact CZ-CH2 3.79Å; Y92-W134 AromaticContact CZ-CZ2 3.68Å; Y92-V156 HydrophobicContact CD2-CB 4.26Å; Y92-V156 HydrophobicContact CD2-CG2 3.84Å; Y92-V156 HydrophobicContact CE2-CB 4.39Å; Y92-V156 HydrophobicContact CE2-CG1 4.37Å; Y92-V156 HydrophobicContact CE2-CG2 3.88Å
93	E	92.8	Very high	83.5	Confident	63 Å²	63	43.6 Å²	43.6	29%	0.294	24%	0.241	S	C	.	.	H	α-helix	trans	-59.7	-29.1	179.8	-71.7	167	-171.2	0	0	113.2	R51 R60 Q89 Y90 G95 K132	R51-E93 IonicContact CZ-OE1 2.8Å; R51-E93 IonicContact NH2-OE1 3.43Å; R51-E93 PolarHBondContact NH2-OE1 3.32Å; R60-E93 IonicContact CZ-OE2 3.5Å; R60-E93 IonicContact NE-OE2 3.92Å; R60-E93 IonicContact NH2-OE2 3.65Å; R60-E93 PolarHBondContact NH2-OE2 3.41Å; Q89-E93 WeakPolarHBondContact O-CB 3.33Å; Q89-E93 WeakPolarHBondContact O-CG 3.29Å; Q89-E93 PolarHBondContact O-N 3.06Å; Y90-E93 PolarHBondContact O-N 3.2Å; E93-G95 PolarHBondContact O-N 2.83Å; E93-K132 WeakPolarHBondContact OE1-CE 3.47Å; E93-K132 IonicContact OE1-NZ 3.91Å; E93-K132 PolarHBondContact OE1-NZ 3.23Å
94	A	91.7	Very high	81.9	Confident	17 Å²	17	52.4 Å²	52.4	14%	0.14	28%	0.28	C	S	.	.	T	Hydrogen-bonded Turn	trans	-78.6	2.1	176.5	0	0	0	0	0	113.7	F5 L64 Y90 V91 Y92 W96	F5-A94 HydrophobicContact CZ-CB 3.85Å; L64-A94 HydrophobicContact CD1-CB 4.08Å; L64-A94 HydrophobicContact CD2-CB 3.57Å; L64-A94 HydrophobicContact CG-CB 4.44Å; Y90-A94 WeakPolarHBondContact O-CB 3.43Å; Y90-A94 PolarHBondContact O-N 3.29Å; V91-A94 PolarHBondContact O-N 3.09Å; Y92-A94 PolarHBondContact O-N 3.16Å; A94-W96 VanDerWaalsContact C-N 3.32Å; A94-W96 PolarHBondContact O-N 2.87Å
95	G	89.4	Confident	80.3	Confident	19 Å²	19	52 Å²	52	20%	0.196	28%	0.276	C	S	.	.	T	Hydrogen-bonded Turn	trans	72.6	19.5	177.7	0	0	0	0	0	114.6	Y92 E93 L97 D98	Y92-G95 PolarHBondContact O-N 2.91Å; E93-G95 PolarHBondContact O-N 2.83Å; G95-L97 PolarHBondContact O-N 3.37Å; G95-D98 WeakPolarHBondContact CA-OD2 3.36Å
96	W	88.6	Confident	78.6	Confident	17 Å²	17	54.4 Å²	54.4	6%	0.064	29%	0.292	C	S	.	.	T	Hydrogen-bonded Turn	trans	-67.2	-18.4	175.8	-85.2	76.7	0	0	0	113.1	L67 E68 V91 A94 R179 V180 R212	L67-W96 HydrophobicContact CD2-CD2 4.47Å; E68-W96 HydrophobicContact CB-CZ2 3.94Å; E68-W96 HydrophobicContact CG-CZ2 4.11Å; V91-W96 HydrophobicContact CG1-CB 3.78Å; V91-W96 HydrophobicContact CG1-CG 4.39Å; V91-W96 WeakPolarHBondContact O-CB 3.19Å; V91-W96 PolarHBondContact O-N 3.39Å; A94-W96 VanDerWaalsContact C-N 3.32Å; A94-W96 PolarHBondContact O-N 2.87Å; W96-R179 HydrophobicContact CE3-CG 4.17Å; W96-V180 HydrophobicContact CE3-CG2 4.21Å; W96-R212 HydrophobicContact CE3-CG 4.43Å; W96-R212 HydrophobicContact CH2-CG 3.91Å; W96-R212 HydrophobicContact CZ3-CG 3.58Å
97	L	88.3	Confident	77.1	Confident	8 Å²	8	59.1 Å²	59.1	4%	0.042	31%	0.313	C	S	.	.	T	Hydrogen-bonded Turn	trans	-109.2	5.6	-174.3	-52.4	-177.8	0	0	0	113.2	V91 Y92 G95 S99 M111 V156 I157 R179	V91-L97 HydrophobicContact CG1-CD1 4.45Å; V91-L97 HydrophobicContact CG1-CD2 4.31Å; V91-L97 HydrophobicContact CG1-CG 4.25Å; Y92-L97 HydrophobicContact CD2-CB 4.43Å; Y92-L97 HydrophobicContact CD2-CD1 4.3Å; G95-L97 PolarHBondContact O-N 3.37Å; L97-S99 VanDerWaalsContact C-N 3.28Å; L97-S99 PolarHBondContact O-N 2.96Å; L97-M111 HydrophobicContact CD1-CB 3.82Å; L97-M111 HydrophobicContact CD2-CB 4.1Å; L97-V156 HydrophobicContact CD1-CB 4.35Å; L97-I157 HydrophobicContact CD1-CG1 4.24Å; L97-R179 HydrophobicContact CD2-CB 4.47Å
98	D	78.1	Confident	75.9	Confident	107 Å²	107	59.8 Å²	59.8	57%	0.572	32%	0.319	S	S	*	.			trans	-82	0.7	-173.4	-65.6	-15.9	0	0	0	114.2	G95 K100	G95-D98 WeakPolarHBondContact CA-OD2 3.36Å; D98-K100 PolarHBondContact O-N 3.21Å; D98-K100 VanDerWaalsContact O-N 3.07Å
99	S	65.7	Low	75.1	Confident	75 Å²	75	60.8 Å²	60.8	52%	0.524	33%	0.325	S	S	.	.			trans	-67.3	115.7	-176.6	-166.9	0	0	0	0	110.6	L97	L97-S99 VanDerWaalsContact C-N 3.28Å; L97-S99 PolarHBondContact O-N 2.96Å
100	K	55.2	Low	74.9	Confident	191 Å²	191	61.2 Å²	61.2	83%	0.83	33%	0.328	S	S	*	.			trans	-55.1	149.5	172.7	-67.4	-174.9	179.1	-179.3	0	110.7	D98 S102	D98-K100 PolarHBondContact O-N 3.21Å; D98-K100 VanDerWaalsContact O-N 3.07Å; K100-S102 PolarHBondContact O-N 2.82Å
101	S	54.1	Low	75	Confident	75 Å²	75	61.1 Å²	61.1	52%	0.524	33%	0.328	S	S	.	.			trans	-44.8	131.2	173	178.9	0	0	0	0	110.9	N105 P106	S101-N105 WeakPolarHBondContact CA-O 2.98Å; S101-P106 WeakPolarHBondContact CB-O 3.26Å; S101-P106 VanDerWaalsContact OG-CA 3.26Å; S101-P106 WeakPolarHBondContact OG-CA 3.28Å; S101-P106 PolarHBondContact OG-O 2.86Å
102	S	54.7	Low	75	Confident	58 Å²	58	61.1 Å²	61.1	41%	0.406	33%	0.328	S	S	.	.	B	Isolated β-bridge	trans	-125.3	164.1	175.7	70.1	0	0	0	0	109.3	K100 F104 N105	K100-S102 PolarHBondContact O-N 2.82Å; S102-F104 PolarHBondContact O-N 3.3Å; S102-N105 PolarHBondContact N-O 3.45Å; S102-N105 VanDerWaalsContact N-O 3.08Å; S102-N105 CarbonylContact O-C 3.57Å; S102-N105 PolarHBondContact O-N 3.03Å; S102-N105 PolarHBondContact OG-N 2.93Å
103	N	52.4	Low	75.2	Confident	169 Å²	169	57.8 Å²	57.8	90%	0.904	32%	0.315	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.1	-28.9	176.6	-75.2	-7.6	0	0	0	113.3
104	F	57	Low	75.5	Confident	189 Å²	189	54.8 Å²	54.8	83%	0.829	30%	0.301	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.2	-16.9	177.7	-70.5	-79.1	0	0	0	113.8	S102	S102-F104 PolarHBondContact O-N 3.3Å
105	N	58.7	Low	75.5	Confident	13 Å²	13	54 Å²	54	7%	0.07	29%	0.294	C	S	.	.	B	Isolated β-bridge	trans	-142.5	80.5	175.3	-166.3	-2.1	0	0	0	109.7	S101 S102 F107 G108 V109 T176	S101-N105 WeakPolarHBondContact CA-O 2.98Å; S102-N105 PolarHBondContact N-O 3.45Å; S102-N105 VanDerWaalsContact N-O 3.08Å; S102-N105 CarbonylContact O-C 3.57Å; S102-N105 PolarHBondContact O-N 3.03Å; S102-N105 PolarHBondContact OG-N 2.93Å; N105-F107 PolarHBondContact O-N 3.31Å; N105-F107 VanDerWaalsContact O-N 3.1Å; N105-G108 VanDerWaalsContact CG-O 3.3Å; N105-G108 PolarHBondContact ND2-O 3.16Å; N105-G108 PolarHBondContact O-N 2.84Å; N105-G108 PolarHBondContact OD1-O 3.29Å; N105-G108 VanDerWaalsContact OD1-O 3.13Å; N105-V109 WeakPolarHBondContact ND2-CG1 3.3Å; N105-T176 PolarHBondContact ND2-O 2.85Å
106	P	57.7	Low	75.5	Confident	70 Å²	70	54.5 Å²	54.5	46%	0.455	29%	0.294	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.3	-18	-173.5	23.2	-31.9	0	0	0	112.4	S101 N153	S101-P106 WeakPolarHBondContact CB-O 3.26Å; S101-P106 VanDerWaalsContact OG-CA 3.26Å; S101-P106 WeakPolarHBondContact OG-CA 3.28Å; S101-P106 PolarHBondContact OG-O 2.86Å; P106-N153 PolarHBondContact O-OD1 3.4Å
107	F	62.9	Low	75.3	Confident	100 Å²	100	55.7 Å²	55.7	44%	0.439	30%	0.298	S	S	.	.	T	Hydrogen-bonded Turn	trans	-95.4	1.3	-177.6	-57	-67.1	0	0	0	115.5	N105 P152 N153	N105-F107 PolarHBondContact O-N 3.31Å; N105-F107 VanDerWaalsContact O-N 3.1Å; F107-P152 HydrophobicContact CD1-CB 3.78Å; F107-P152 HydrophobicContact CE1-CB 4.02Å; F107-N153 WeakPolarHBondContact CA-OD1 3.32Å; F107-N153 WeakPolarHBondContact CD1-OD1 3.23Å
108	G	69.2	Low	75.1	Confident	13 Å²	13	59.4 Å²	59.4	13%	0.134	31%	0.312	C	S	.	.			trans	73.2	167.9	-166.4	0	0	0	0	0	112	N105	N105-G108 VanDerWaalsContact CG-O 3.3Å; N105-G108 PolarHBondContact ND2-O 3.16Å; N105-G108 PolarHBondContact O-N 2.84Å; N105-G108 PolarHBondContact OD1-O 3.29Å; N105-G108 VanDerWaalsContact OD1-O 3.13Å
109	V	80.8	Confident	75.3	Confident	21 Å²	21	55.2 Å²	55.2	13%	0.127	29%	0.29	C	S	.	.			trans	-86.7	137	179.3	-69.1	0	0	0	0	111	N105 R177 R179	N105-V109 WeakPolarHBondContact ND2-CG1 3.3Å; V109-R177 WeakPolarHBondContact CA-O 3.47Å; V109-R179 HydrophobicContact CB-CB 3.94Å; V109-R179 HydrophobicContact CG1-CB 4.33Å; V109-R179 HydrophobicContact CG2-CB 4.46Å
110	T	92	Very high	76.3	Confident	9 Å²	9	51.6 Å²	51.6	6%	0.055	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	171.3	180	70.7	0	0	0	0	111.9	T155 V156 R177 F178 R179	T110-T155 WeakPolarHBondContact CG2-O 3.23Å; T110-V156 WeakPolarHBondContact CA-O 3.4Å; T110-V156 WeakPolarHBondContact CB-O 3.33Å; T110-R177 HydrophobicContact CG2-CG 4.4Å; T110-R177 PolarHBondContact N-O 2.81Å; T110-F178 WeakPolarHBondContact O-CA 3.47Å; T110-F178 WeakPolarHBondContact OG1-CD1 3.42Å; T110-F178 WeakPolarHBondContact OG1-CE1 3.4Å; T110-R179 PolarHBondContact O-N 3.34Å
111	M	95.8	Very high	78	Confident	0 Å²	0	42.5 Å²	42.5	0%	0	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	135.1	170.8	179.9	173.2	-177.8	0	0	111	P88 V91 L97 V113 V156 S158 V180 M182 I214	P88-M111 VanDerWaalsContact CA-SD 3.58Å; P88-M111 HydrophobicContact CB-CE 3.88Å; P88-M111 HydrophobicContact CB-SD 3.75Å; P88-M111 HydrophobicContact CG-CE 3.89Å; P88-M111 HydrophobicContact CG-SD 4.42Å; V91-M111 HydrophobicContact CB-SD 3.9Å; V91-M111 HydrophobicContact CG1-SD 3.93Å; V91-M111 HydrophobicContact CG2-CE 4.27Å; V91-M111 HydrophobicContact CG2-SD 4.06Å; L97-M111 HydrophobicContact CD1-CB 3.82Å; L97-M111 HydrophobicContact CD2-CB 4.1Å; M111-V113 HydrophobicContact CE-CG2 4.01Å; M111-V113 HydrophobicContact CG-CG2 4.45Å; M111-V156 PolarHBondContact N-O 3.24Å; M111-S158 PolarHBondContact O-N 2.94Å; M111-V180 VanDerWaalsContact CA-O 3.31Å; M111-V180 WeakPolarHBondContact CA-O 3.32Å; M111-V180 HydrophobicContact CE-CG1 4.13Å; M111-V180 HydrophobicContact CG-CB 4.14Å; M111-V180 HydrophobicContact CG-CG1 4.41Å; M111-V180 HydrophobicContact SD-CB 4.48Å; M111-V180 HydrophobicContact SD-CG1 4.36Å; M111-M182 HydrophobicContact CE-CB 3.75Å; M111-M182 HydrophobicContact CE-SD 4.27Å; M111-I214 HydrophobicContact CE-CD1 4.19Å
112	A	97.2	Very high	79.7	Confident	0 Å²	0	40.2 Å²	40.2	0%	0	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	132.6	171	0	0	0	0	0	110.6	L160 M165 F178 V180 I181 M182	A112-L160 HydrophobicContact CB-CD2 3.71Å; A112-M165 HydrophobicContact CB-SD 4.34Å; A112-F178 HydrophobicContact CB-CD1 3.62Å; A112-F178 HydrophobicContact CB-CD2 4.26Å; A112-F178 HydrophobicContact CB-CE1 3.52Å; A112-F178 HydrophobicContact CB-CE2 4.15Å; A112-F178 HydrophobicContact CB-CG 3.99Å; A112-F178 HydrophobicContact CB-CZ 3.76Å; A112-V180 PolarHBondContact N-O 2.95Å; A112-I181 HydrophobicContact CB-CG1 4.37Å; A112-I181 HydrophobicContact CB-CG2 4.49Å; A112-I181 CarbonylContact O-C 3.5Å; A112-I181 WeakPolarHBondContact O-CA 3.24Å; A112-M182 PolarHBondContact O-N 2.98Å
113	V	98	Very high	81.3	Confident	0 Å²	0	39 Å²	39	0%	0	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	109.9	171.3	-173.6	0	0	0	0	108.8	P88 M111 I157 S158 Y159 L160 M182 D184	P88-V113 HydrophobicContact CB-CG2 4.14Å; P88-V113 HydrophobicContact CG-CG2 3.64Å; M111-V113 HydrophobicContact CE-CG2 4.01Å; M111-V113 HydrophobicContact CG-CG2 4.45Å; V113-I157 HydrophobicContact CG2-CG2 4.41Å; V113-S158 PolarHBondContact N-O 3.19Å; V113-Y159 HydrophobicContact CB-CD1 3.7Å; V113-Y159 HydrophobicContact CB-CE1 3.79Å; V113-Y159 HydrophobicContact CB-CG 4.37Å; V113-Y159 HydrophobicContact CG1-CD1 3.82Å; V113-Y159 HydrophobicContact CG1-CE1 3.71Å; V113-Y159 HydrophobicContact CG2-CD1 4.36Å; V113-Y159 HydrophobicContact CG2-CE1 4.04Å; V113-Y159 WeakPolarHBondContact O-CA 3.46Å; V113-L160 PolarHBondContact O-N 2.77Å; V113-M182 WeakPolarHBondContact CA-O 3.2Å; V113-M182 HydrophobicContact CG1-CB 4.32Å; V113-M182 HydrophobicContact CG1-CG 4.27Å; V113-M182 HydrophobicContact CG1-SD 4.05Å; V113-M182 HydrophobicContact CG2-CB 4.29Å; V113-M182 HydrophobicContact CG2-SD 4.47Å; V113-D184 HydrophobicContact CG1-CB 4.41Å
114	T	97.2	Very high	83.1	Confident	0 Å²	0	31.9 Å²	31.9	0%	0	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.6	138.5	179.4	68.3	0	0	0	0	111.2	L160 M165 M182 L183 D184 L196	T114-L160 CarbonylContact C-O 3.52Å; T114-L160 VanDerWaalsContact CA-O 3.22Å; T114-L160 WeakPolarHBondContact CA-O 3.33Å; T114-L160 HydrophobicContact CG2-CD2 4.39Å; T114-L160 HydrophobicContact CG2-CG 4.44Å; T114-M165 HydrophobicContact CG2-CB 3.95Å; T114-M165 HydrophobicContact CG2-CG 4.03Å; T114-M182 PolarHBondContact N-O 3.32Å; T114-M182 PolarHBondContact OG1-O 3.19Å; T114-L183 HydrophobicContact CG2-CD2 3.87Å; T114-L183 WeakPolarHBondContact OG1-CA 3.22Å; T114-L183 WeakPolarHBondContact OG1-CD2 3.47Å; T114-D184 VanDerWaalsContact O-CB 3.3Å; T114-D184 WeakPolarHBondContact O-CB 3.37Å; T114-D184 PolarHBondContact O-N 3.35Å; T114-L196 HydrophobicContact CG2-CD2 4.03Å
115	Q	93.6	Very high	84.9	Confident	0 Å²	0	22.9 Å²	22.9	0%	0	12%	0.12	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	141.5	174.5	-68.7	-66.8	-29	0	0	110.5	R117 A120 A121 L124 L160 T161 D184	Q115-R117 VanDerWaalsContact C-N 3.26Å; Q115-R117 PolarHBondContact O-N 3.49Å; Q115-A120 HydrophobicContact CB-CB 4.2Å; Q115-A120 HydrophobicContact CG-CB 4.36Å; Q115-A121 HydrophobicContact CB-CB 4.16Å; Q115-A121 HydrophobicContact CG-CB 4.4Å; Q115-L124 VanDerWaalsContact CD-CD1 3.44Å; Q115-L124 HydrophobicContact CG-CD1 3.92Å; Q115-L160 PolarHBondContact N-O 2.91Å; Q115-T161 WeakPolarHBondContact O-CA 3.44Å; Q115-D184 PolarHBondContact NE2-OD2 2.98Å
116	P	88.1	Confident	86.5	Confident	29 Å²	29	24.4 Å²	24.4	19%	0.188	13%	0.131	C	C	.	.	S	Bend	trans	-68.1	-27.1	178.3	25.1	-32.9	0	0	0	112.3	E185 E188	P116-E185 HydrophobicContact CG-CB 4.06Å; P116-E188 HydrophobicContact CG-CG 4.42Å; P116-E188 WeakPolarHBondContact CG-OE1 3.48Å
117	R	85	Confident	87.9	Confident	43 Å²	43	25 Å²	25	16%	0.162	12%	0.123	C	C	.	.	S	Bend	trans	-115.8	139.7	-175.9	-59.1	-172.2	-173.1	77.3	16	112.7	Q115 V119 A120 A121 E188 A378 S379	Q115-R117 VanDerWaalsContact C-N 3.26Å; Q115-R117 PolarHBondContact O-N 3.49Å; R117-V119 PolarHBondContact O-N 3.29Å; R117-A120 HydrophobicContact CB-CB 4.12Å; R117-A120 WeakPolarHBondContact O-CB 3.25Å; R117-A120 PolarHBondContact O-N 2.97Å; R117-A121 PolarHBondContact O-N 2.66Å; R117-A121 VanDerWaalsContact O-N 3.14Å; R117-E188 IonicContact CZ-OE1 3.59Å; R117-E188 IonicContact CZ-OE2 3.82Å; R117-E188 IonicContact NH1-OE1 3.22Å; R117-E188 PolarHBondContact NH1-OE1 2.93Å; R117-E188 IonicContact NH1-OE2 3.88Å; R117-E188 IonicContact NH2-OE1 2.78Å; R117-E188 PolarHBondContact NH2-OE1 3.24Å; R117-E188 IonicContact NH2-OE2 4Å; R117-E188 PolarHBondContact NH2-OE2 3.21Å; R117-A378 VanDerWaalsContact NH1-CB 3.31Å; R117-A378 PolarHBondContact NH1-O 3.38Å; R117-S379 PolarHBondContact NH1-OG 3.17Å
118	R	84.4	Confident	89.4	Confident	86 Å²	86	20.2 Å²	20.2	33%	0.325	10%	0.103	S	C	.	.	H	α-helix	trans	-56.2	-46.1	174	-67.8	179.8	63.7	-162.8	-4.3	112.6	A120 A121 L122 I144 E147 T161	R118-A120 VanDerWaalsContact C-N 3.28Å; R118-A120 PolarHBondContact O-N 3.16Å; R118-A121 PolarHBondContact O-N 2.73Å; R118-L122 PolarHBondContact O-N 3.33Å; R118-L122 VanDerWaalsContact O-N 3.08Å; R118-I144 HydrophobicContact CB-CD1 4.3Å; R118-I144 HydrophobicContact CB-CG2 4.48Å; R118-I144 HydrophobicContact CG-CB 4.18Å; R118-I144 HydrophobicContact CG-CG2 4.49Å; R118-E147 IonicContact NH2-OE2 2.89Å; R118-T161 HydrophobicContact CG-CG2 3.94Å
119	V	82.1	Confident	90.6	Very high	18 Å²	18	19.9 Å²	19.9	11%	0.109	10%	0.099	C	C	.	.	H	α-helix	trans	-63.5	-36.1	-179.7	179.4	0	0	0	0	111.3	R117 S123 F359	R117-V119 PolarHBondContact O-N 3.29Å; V119-S123 WeakPolarHBondContact O-CB 3.4Å; V119-S123 PolarHBondContact O-N 3.03Å; V119-S123 PolarHBondContact O-OG 3Å; V119-F359 HydrophobicContact CG1-CE2 4.42Å
120	A	86.6	Confident	91.1	Very high	0 Å²	0	23.4 Å²	23.4	0%	0	11%	0.114	C	C	.	.	H	α-helix	trans	-65.2	-50	176.6	0	0	0	0	0	111.1	Q115 R117 R118 L122 S123 L124 S379	Q115-A120 HydrophobicContact CB-CB 4.2Å; Q115-A120 HydrophobicContact CG-CB 4.36Å; R117-A120 HydrophobicContact CB-CB 4.12Å; R117-A120 WeakPolarHBondContact O-CB 3.25Å; R117-A120 PolarHBondContact O-N 2.97Å; R118-A120 VanDerWaalsContact C-N 3.28Å; R118-A120 PolarHBondContact O-N 3.16Å; A120-L122 VanDerWaalsContact C-N 3.35Å; A120-L122 PolarHBondContact O-N 2.74Å; A120-S123 PolarHBondContact O-N 3.36Å; A120-S123 PolarHBondContact O-OG 3.26Å; A120-L124 WeakPolarHBondContact O-CB 3.31Å; A120-L124 WeakPolarHBondContact O-CG 3.49Å; A120-L124 PolarHBondContact O-N 2.87Å; A120-S379 VanDerWaalsContact CB-CB 3.43Å; A120-S379 VanDerWaalsContact CB-O 3.29Å; A120-S379 WeakPolarHBondContact CB-O 3.24Å
121	A	91.4	Very high	91	Very high	0 Å²	0	23.8 Å²	23.8	0%	0	12%	0.115	C	C	.	.	H	α-helix	trans	-54.8	-48.5	177.2	0	0	0	0	0	112.2	Q115 R117 R118 A125 I144 Y159	Q115-A121 HydrophobicContact CB-CB 4.16Å; Q115-A121 HydrophobicContact CG-CB 4.4Å; R117-A121 PolarHBondContact O-N 2.66Å; R117-A121 VanDerWaalsContact O-N 3.14Å; R118-A121 PolarHBondContact O-N 2.73Å; A121-A125 WeakPolarHBondContact O-CB 3.15Å; A121-A125 PolarHBondContact O-N 2.79Å; A121-I144 HydrophobicContact CB-CG2 3.91Å; A121-Y159 WeakPolarHBondContact O-CB 3.12Å
122	L	89.6	Confident	90.8	Very high	26 Å²	26	26.1 Å²	26.1	14%	0.136	13%	0.125	C	C	.	.	H	α-helix	trans	-62.7	-51.8	177.5	-178	67.8	0	0	0	111.5	R118 A120 L124 A125 T126 Y142 Q352	R118-L122 PolarHBondContact O-N 3.33Å; R118-L122 VanDerWaalsContact O-N 3.08Å; A120-L122 VanDerWaalsContact C-N 3.35Å; A120-L122 PolarHBondContact O-N 2.74Å; L122-L124 VanDerWaalsContact C-N 3.31Å; L122-L124 PolarHBondContact O-N 2.98Å; L122-A125 PolarHBondContact O-N 3.03Å; L122-T126 PolarHBondContact O-N 3.5Å; L122-T126 PolarHBondContact O-OG1 3.45Å; L122-T126 VanDerWaalsContact O-OG1 3.05Å; L122-Y142 HydrophobicContact CD1-CD1 3.66Å; L122-Y142 HydrophobicContact CD1-CD2 4.29Å; L122-Y142 HydrophobicContact CD1-CE1 3.33Å; L122-Y142 HydrophobicContact CD1-CE2 4.01Å; L122-Y142 HydrophobicContact CD1-CG 4.14Å; L122-Q352 VanDerWaalsContact CD2-NE2 3.27Å
123	S	86.8	Confident	90.6	Very high	32 Å²	32	33.4 Å²	33.4	22%	0.224	16%	0.164	C	C	.	.	H	α-helix	trans	-62.8	-36.4	-176.1	68.5	0	0	0	0	113	V119 A120 R127	V119-S123 WeakPolarHBondContact O-CB 3.4Å; V119-S123 PolarHBondContact O-N 3.03Å; V119-S123 PolarHBondContact O-OG 3Å; A120-S123 PolarHBondContact O-N 3.36Å; A120-S123 PolarHBondContact O-OG 3.26Å; S123-R127 VanDerWaalsContact O-CB 3.24Å; S123-R127 WeakPolarHBondContact O-CB 3.38Å; S123-R127 PolarHBondContact O-N 3.15Å
124	L	91.8	Very high	90.4	Very high	20 Å²	20	35.5 Å²	35.5	11%	0.105	17%	0.172	C	C	.	.	H	α-helix	trans	-72.9	-41	177.3	-71.8	168.2	0	0	0	111.5	T85 Q115 A120 L122 R127 V128 Y159	T85-L124 HydrophobicContact CG2-CD2 3.65Å; Q115-L124 VanDerWaalsContact CD-CD1 3.44Å; Q115-L124 HydrophobicContact CG-CD1 3.92Å; A120-L124 WeakPolarHBondContact O-CB 3.31Å; A120-L124 WeakPolarHBondContact O-CG 3.49Å; A120-L124 PolarHBondContact O-N 2.87Å; L122-L124 VanDerWaalsContact C-N 3.31Å; L122-L124 PolarHBondContact O-N 2.98Å; L124-R127 PolarHBondContact O-N 3.37Å; L124-V128 WeakPolarHBondContact O-CG2 3.47Å; L124-V128 PolarHBondContact O-N 2.92Å; L124-Y159 HydrophobicContact CB-CD1 3.73Å; L124-Y159 HydrophobicContact CB-CE1 3.6Å; L124-Y159 HydrophobicContact CB-CG 4.34Å; L124-Y159 HydrophobicContact CD1-CD1 4.29Å; L124-Y159 HydrophobicContact CD1-CE1 4.19Å; L124-Y159 HydrophobicContact CG-CE1 4.47Å
125	A	94.2	Very high	90.1	Very high	0 Å²	0	43.5 Å²	43.5	0%	0	20%	0.202	C	C	.	.	H	α-helix	trans	-59.5	-47	173.7	0	0	0	0	0	111.3	A121 L122 V128 A129 I136 V140 Y142 Y159	A121-A125 WeakPolarHBondContact O-CB 3.15Å; A121-A125 PolarHBondContact O-N 2.79Å; L122-A125 PolarHBondContact O-N 3.03Å; A125-V128 PolarHBondContact O-N 3.4Å; A125-A129 WeakPolarHBondContact O-CB 3.32Å; A125-A129 PolarHBondContact O-N 2.97Å; A125-I136 HydrophobicContact CB-CD1 4.2Å; A125-V140 HydrophobicContact CB-CG2 4.3Å; A125-Y142 HydrophobicContact CB-CD1 4.28Å; A125-Y159 HydrophobicContact CB-CD2 3.73Å; A125-Y159 HydrophobicContact CB-CG 4.21Å
126	T	91.4	Very high	90	Very high	46 Å²	46	45.7 Å²	45.7	28%	0.282	21%	0.213	S	C	.	.	H	α-helix	trans	-61.5	-45.4	175.2	-55.3	0	0	0	0	111.3	L122 V128 A129 E130 I136	L122-T126 PolarHBondContact O-N 3.5Å; L122-T126 PolarHBondContact O-OG1 3.45Å; L122-T126 VanDerWaalsContact O-OG1 3.05Å; T126-V128 PolarHBondContact O-N 3.46Å; T126-A129 WeakPolarHBondContact O-CB 3.45Å; T126-A129 PolarHBondContact O-N 3.01Å; T126-E130 WeakPolarHBondContact O-CG 3.26Å; T126-E130 PolarHBondContact O-N 2.96Å; T126-I136 WeakPolarHBondContact OG1-CD1 3.43Å
127	R	88.9	Confident	90.2	Very high	81 Å²	81	44.6 Å²	44.6	31%	0.306	21%	0.208	S	C	.	.	H	α-helix	trans	-63.2	-41.8	-179.8	179.5	57.4	-176.9	-176.7	2.3	112.6	T85 S123 L124 A129 E130 E131	T85-R127 HydrophobicContact CG2-CG 4.18Å; S123-R127 VanDerWaalsContact O-CB 3.24Å; S123-R127 WeakPolarHBondContact O-CB 3.38Å; S123-R127 PolarHBondContact O-N 3.15Å; L124-R127 PolarHBondContact O-N 3.37Å; R127-A129 VanDerWaalsContact C-N 3.33Å; R127-E130 IonicContact NH1-OE2 2.7Å; R127-E130 WeakPolarHBondContact O-CB 3.28Å; R127-E130 PolarHBondContact O-N 2.89Å; R127-E131 IonicContact CZ-OE1 4Å; R127-E131 IonicContact NE-OE1 2.84Å; R127-E131 PolarHBondContact NE-OE1 3.4Å; R127-E131 IonicContact NH2-OE1 3.21Å; R127-E131 PolarHBondContact NH2-OE1 3.34Å; R127-E131 WeakPolarHBondContact O-CG 3.36Å; R127-E131 PolarHBondContact O-N 3.25Å
128	V	93.4	Very high	90.6	Very high	0 Å²	0	47.6 Å²	47.6	0%	0	22%	0.222	C	C	.	.	H	α-helix	trans	-69.4	-34.3	176.5	172	0	0	0	0	111.4	Q89 L124 A125 T126 E130 E131 K132 V140 Y159	Q89-V128 HydrophobicContact CG-CG1 4.02Å; L124-V128 WeakPolarHBondContact O-CG2 3.47Å; L124-V128 PolarHBondContact O-N 2.92Å; A125-V128 PolarHBondContact O-N 3.4Å; T126-V128 PolarHBondContact O-N 3.46Å; V128-E130 VanDerWaalsContact C-N 3.33Å; V128-E131 PolarHBondContact O-N 3.24Å; V128-K132 PolarHBondContact O-N 3.18Å; V128-K132 VanDerWaalsContact O-N 3.09Å; V128-V140 HydrophobicContact CG1-CG2 4.4Å; V128-Y159 HydrophobicContact CB-CE2 4.39Å; V128-Y159 HydrophobicContact CG2-CE2 4.26Å; V128-Y159 VanDerWaalsContact CG2-OH 3.23Å; V128-Y159 WeakPolarHBondContact CG2-OH 3.43Å
129	A	94.4	Very high	91	Very high	7 Å²	7	45.9 Å²	45.9	6%	0.058	22%	0.218	C	C	.	.	H	α-helix	trans	-58.8	-47.1	171.4	0	0	0	0	0	110.9	A125 T126 R127 N133 W134 I136 V140	A125-A129 WeakPolarHBondContact O-CB 3.32Å; A125-A129 PolarHBondContact O-N 2.97Å; T126-A129 WeakPolarHBondContact O-CB 3.45Å; T126-A129 PolarHBondContact O-N 3.01Å; R127-A129 VanDerWaalsContact C-N 3.33Å; A129-N133 CarbonylContact O-C 3.54Å; A129-N133 WeakPolarHBondContact O-CA 3.4Å; A129-N133 PolarHBondContact O-N 3.09Å; A129-W134 PolarHBondContact O-N 2.86Å; A129-I136 HydrophobicContact CB-CB 4.41Å; A129-V140 HydrophobicContact CB-CG1 3.51Å
130	E	90.6	Very high	91.7	Very high	95 Å²	95	45 Å²	45	44%	0.444	21%	0.213	S	C	.	.	H	α-helix	trans	-62	-47	175.8	-68.9	168.6	-175.9	0	0	112.1	T126 R127 V128 K132 N133	T126-E130 WeakPolarHBondContact O-CG 3.26Å; T126-E130 PolarHBondContact O-N 2.96Å; R127-E130 IonicContact NH1-OE2 2.7Å; R127-E130 WeakPolarHBondContact O-CB 3.28Å; R127-E130 PolarHBondContact O-N 2.89Å; V128-E130 VanDerWaalsContact C-N 3.33Å; E130-K132 VanDerWaalsContact C-N 3.29Å; E130-K132 PolarHBondContact O-N 2.8Å; E130-N133 PolarHBondContact O-N 3.38Å
131	E	91.2	Very high	92.1	Very high	17 Å²	17	45 Å²	45	8%	0.079	21%	0.213	C	C	.	.	H	α-helix	trans	-64.3	-33.3	-175.7	-76.9	-177.5	-169.5	0	0	113.5	V47 Q86 Q89 R127 V128	V47-E131 HydrophobicContact CG1-CB 4.15Å; V47-E131 HydrophobicContact CG1-CG 3.96Å; Q86-E131 PolarHBondContact NE2-OE2 2.99Å; Q89-E131 PolarHBondContact NE2-OE2 3.19Å; R127-E131 IonicContact CZ-OE1 4Å; R127-E131 IonicContact NE-OE1 2.84Å; R127-E131 PolarHBondContact NE-OE1 3.4Å; R127-E131 IonicContact NH2-OE1 3.21Å; R127-E131 PolarHBondContact NH2-OE1 3.34Å; R127-E131 WeakPolarHBondContact O-CG 3.36Å; R127-E131 PolarHBondContact O-N 3.25Å; V128-E131 PolarHBondContact O-N 3.24Å
132	K	90.8	Very high	92.3	Very high	48 Å²	48	46.1 Å²	46.1	21%	0.209	22%	0.217	C	C	.	.	T	Hydrogen-bonded Turn	trans	-97.1	1.8	178.4	-73.8	-63.7	-162.6	178.3	0	114.2	Q89 E93 V128 E130 W134	Q89-K132 HydrophobicContact CG-CG 4.39Å; Q89-K132 VanDerWaalsContact OE1-CE 3.27Å; E93-K132 WeakPolarHBondContact OE1-CE 3.47Å; E93-K132 IonicContact OE1-NZ 3.91Å; E93-K132 PolarHBondContact OE1-NZ 3.23Å; V128-K132 PolarHBondContact O-N 3.18Å; V128-K132 VanDerWaalsContact O-N 3.09Å; E130-K132 VanDerWaalsContact C-N 3.29Å; E130-K132 PolarHBondContact O-N 2.8Å; K132-W134 HydrophobicContact CB-CB 4.45Å; K132-W134 HydrophobicContact CB-CD2 3.55Å; K132-W134 HydrophobicContact CB-CE3 3.95Å; K132-W134 HydrophobicContact CB-CG 3.77Å; K132-W134 HydrophobicContact CB-CZ2 4.26Å; K132-W134 HydrophobicContact CB-CZ3 4.48Å; K132-W134 HydrophobicContact CG-CD2 4.27Å; K132-W134 HydrophobicContact CG-CE3 4.31Å; K132-W134 HydrophobicContact CG-CH2 4.35Å; K132-W134 HydrophobicContact CG-CZ2 4.28Å; K132-W134 HydrophobicContact CG-CZ3 4.36Å; K132-W134 VanDerWaalsContact O-CD1 3.26Å; K132-W134 PolarHBondContact O-N 3.07Å
133	N	92.2	Very high	92.5	Very high	153 Å²	153	45.4 Å²	45.4	82%	0.818	21%	0.213	S	C	*	.	T	Hydrogen-bonded Turn	trans	51.4	42.6	-170.5	-164.4	33	0	0	0	112.6	A129 E130	A129-N133 CarbonylContact O-C 3.54Å; A129-N133 WeakPolarHBondContact O-CA 3.4Å; A129-N133 PolarHBondContact O-N 3.09Å; E130-N133 PolarHBondContact O-N 3.38Å
134	W	93.9	Very high	92.7	Very high	45 Å²	45	43.9 Å²	43.9	17%	0.17	20%	0.202	C	C	.	.	P	Polyproline II helix	trans	-100.3	161.1	177.6	-71.3	-9.3	0	0	0	111.9	Y92 A129 K132 Q139 V140 V156 I157	Y92-W134 AromaticContact CD1-CH2 3.62Å; Y92-W134 HydrophobicContact CD1-CH2 3.62Å; Y92-W134 AromaticContact CD1-CZ2 3.99Å; Y92-W134 HydrophobicContact CD1-CZ2 3.99Å; Y92-W134 HydrophobicContact CD2-CH2 4.27Å; Y92-W134 AromaticContact CE1-CH2 3.5Å; Y92-W134 HydrophobicContact CE1-CH2 3.5Å; Y92-W134 VanDerWaalsContact CE1-CH2 3.5Å; Y92-W134 AromaticContact CE1-CZ2 3.41Å; Y92-W134 HydrophobicContact CE1-CZ2 3.41Å; Y92-W134 VanDerWaalsContact CE1-CZ2 3.41Å; Y92-W134 HydrophobicContact CE2-CH2 4.17Å; Y92-W134 HydrophobicContact CE2-CZ2 4.47Å; Y92-W134 HydrophobicContact CG-CH2 4Å; Y92-W134 AromaticContact CZ-CH2 3.79Å; Y92-W134 AromaticContact CZ-CZ2 3.68Å; A129-W134 PolarHBondContact O-N 2.86Å; K132-W134 HydrophobicContact CB-CB 4.45Å; K132-W134 HydrophobicContact CB-CD2 3.55Å; K132-W134 HydrophobicContact CB-CE3 3.95Å; K132-W134 HydrophobicContact CB-CG 3.77Å; K132-W134 HydrophobicContact CB-CZ2 4.26Å; K132-W134 HydrophobicContact CB-CZ3 4.48Å; K132-W134 HydrophobicContact CG-CD2 4.27Å; K132-W134 HydrophobicContact CG-CE3 4.31Å; K132-W134 HydrophobicContact CG-CH2 4.35Å; K132-W134 HydrophobicContact CG-CZ2 4.28Å; K132-W134 HydrophobicContact CG-CZ3 4.36Å; K132-W134 VanDerWaalsContact O-CD1 3.26Å; K132-W134 PolarHBondContact O-N 3.07Å; W134-Q139 HydrophobicContact CB-CB 4.17Å; W134-Q139 HydrophobicContact CD2-CB 3.51Å; W134-Q139 HydrophobicContact CD2-CG 4.06Å; W134-Q139 HydrophobicContact CE3-CB 3.52Å; W134-Q139 HydrophobicContact CG-CB 3.83Å; W134-Q139 HydrophobicContact CG-CG 4.12Å; W134-Q139 HydrophobicContact CZ3-CB 4.07Å; W134-V140 HydrophobicContact CE3-CB 4.26Å; W134-V140 HydrophobicContact CE3-CG1 4.45Å; W134-V156 HydrophobicContact CH2-CG2 4.24Å; W134-V156 HydrophobicContact CZ3-CG2 4.25Å; W134-I157 HydrophobicContact CZ3-CD1 4.32Å
135	R	91.6	Very high	92.1	Very high	168 Å²	168	45.9 Å²	45.9	63%	0.634	21%	0.208	S	C	*	.	P	Polyproline II helix	trans	-90	129.1	171.5	-66.2	-174.4	-175.6	179.4	3.1	109.9	K138	R135-K138 HydrophobicContact CB-CB 4.11Å; R135-K138 PolarHBondContact O-N 2.75Å; R135-K138 VanDerWaalsContact O-N 3.1Å
136	I	92.4	Very high	91.2	Very high	45 Å²	45	49.5 Å²	49.5	23%	0.231	22%	0.224	C	C	.	.	B	Isolated β-bridge	trans	-61.5	139.4	170.4	-160.2	166.3	0	0	0	109.7	I35 A125 T126 A129 K138 V140 Y142	I35-I136 HydrophobicContact CD1-CG2 4.34Å; A125-I136 HydrophobicContact CB-CD1 4.2Å; T126-I136 WeakPolarHBondContact OG1-CD1 3.43Å; A129-I136 HydrophobicContact CB-CB 4.41Å; I136-K138 PolarHBondContact O-N 2.74Å; I136-V140 CarbonylContact C-O 3.59Å; I136-V140 WeakPolarHBondContact CA-O 3.41Å; I136-Y142 HydrophobicContact CD1-CD1 3.82Å; I136-Y142 HydrophobicContact CD1-CE1 3.77Å; I136-Y142 HydrophobicContact CG1-CD1 4.17Å; I136-Y142 HydrophobicContact CG1-CE1 4.19Å
137	G	92	Very high	90.7	Very high	7 Å²	7	50.3 Å²	50.3	7%	0.072	23%	0.225	C	C	.	.	T	Hydrogen-bonded Turn	trans	83.2	-14.7	-172.3	0	0	0	0	0	114.6	V140 C149 W150 T151 T155	G137-V140 PolarHBondContact N-O 2.73Å; G137-C149 VanDerWaalsContact CA-SG 3.54Å; G137-W150 CarbonylContact O-C 3.52Å; G137-T151 VanDerWaalsContact O-CB 3.31Å; G137-T151 WeakPolarHBondContact O-CB 3.3Å; G137-T151 PolarHBondContact O-N 2.82Å; G137-T151 PolarHBondContact O-OG1 3.26Å; G137-T155 PolarHBondContact O-OG1 3.13Å
138	K	92.5	Very high	90.7	Very high	105 Å²	105	51.1 Å²	51.1	46%	0.457	23%	0.232	S	C	.	.	T	Hydrogen-bonded Turn	trans	-97.9	-85.8	176.5	-168.8	173.9	-177.9	177.8	0	110.9	R135 I136 S154 T155	R135-K138 HydrophobicContact CB-CB 4.11Å; R135-K138 PolarHBondContact O-N 2.75Å; R135-K138 VanDerWaalsContact O-N 3.1Å; I136-K138 PolarHBondContact O-N 2.74Å; K138-S154 WeakPolarHBondContact CG-OG 3.3Å; K138-S154 CarbonylContact O-C 3.5Å; K138-S154 VanDerWaalsContact O-O 3.1Å; K138-S154 PolarHBondContact O-OG 3.02Å; K138-T155 WeakPolarHBondContact O-CA 3.26Å; K138-T155 WeakPolarHBondContact O-CB 3.39Å; K138-T155 PolarHBondContact O-N 3.27Å; K138-T155 PolarHBondContact O-OG1 2.99Å
139	Q	93.2	Very high	90.6	Very high	51 Å²	51	52.8 Å²	52.8	24%	0.238	24%	0.243	C	C	.	.	T	Hydrogen-bonded Turn	trans	-80.6	-35.2	-180	-65.4	89	-18.3	0	0	113.3	W134 S154 V156 I157	W134-Q139 HydrophobicContact CB-CB 4.17Å; W134-Q139 HydrophobicContact CD2-CB 3.51Å; W134-Q139 HydrophobicContact CD2-CG 4.06Å; W134-Q139 HydrophobicContact CE3-CB 3.52Å; W134-Q139 HydrophobicContact CG-CB 3.83Å; W134-Q139 HydrophobicContact CG-CG 4.12Å; W134-Q139 HydrophobicContact CZ3-CB 4.07Å; Q139-S154 WeakPolarHBondContact CA-O 3.4Å; Q139-V156 VanDerWaalsContact O-CG2 3.25Å; Q139-V156 WeakPolarHBondContact O-CG2 3.34Å; Q139-V156 PolarHBondContact O-N 2.98Å; Q139-I157 PolarHBondContact O-N 3.49Å
140	V	95.9	Very high	90.6	Very high	0 Å²	0	55.7 Å²	55.7	0%	0	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	136.5	174.1	62.7	0	0	0	0	109	A125 V128 A129 W134 I136 G137 I157 Y159	A125-V140 HydrophobicContact CB-CG2 4.3Å; V128-V140 HydrophobicContact CG1-CG2 4.4Å; A129-V140 HydrophobicContact CB-CG1 3.51Å; W134-V140 HydrophobicContact CE3-CB 4.26Å; W134-V140 HydrophobicContact CE3-CG1 4.45Å; I136-V140 CarbonylContact C-O 3.59Å; I136-V140 WeakPolarHBondContact CA-O 3.41Å; G137-V140 PolarHBondContact N-O 2.73Å; V140-I157 WeakPolarHBondContact CA-O 3.47Å; V140-I157 HydrophobicContact CG2-CB 4.4Å; V140-I157 HydrophobicContact CG2-CG2 4.45Å; V140-Y159 HydrophobicContact CG2-CD2 4Å; V140-Y159 HydrophobicContact CG2-CE2 3.9Å
141	G	95.6	Very high	90.6	Very high	0 Å²	0	54.3 Å²	54.3	0%	0	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.4	175.3	-178	0	0	0	0	0	112.5	C149 I157 S158 Y159	G141-C149 CarbonylContact C-O 3.57Å; G141-C149 WeakPolarHBondContact CA-O 3.1Å; G141-I157 PolarHBondContact N-O 3.35Å; G141-S158 WeakPolarHBondContact O-CA 3.1Å; G141-Y159 PolarHBondContact O-N 3.39Å
142	Y	95.6	Very high	90.3	Very high	23 Å²	23	56.4 Å²	56.4	9%	0.09	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.3	151.7	171.1	64.9	-91.1	0	0	0	112.8	L122 A125 I136 I144 E147 C149 Y159	L122-Y142 HydrophobicContact CD1-CD1 3.66Å; L122-Y142 HydrophobicContact CD1-CD2 4.29Å; L122-Y142 HydrophobicContact CD1-CE1 3.33Å; L122-Y142 HydrophobicContact CD1-CE2 4.01Å; L122-Y142 HydrophobicContact CD1-CG 4.14Å; A125-Y142 HydrophobicContact CB-CD1 4.28Å; I136-Y142 HydrophobicContact CD1-CD1 3.82Å; I136-Y142 HydrophobicContact CD1-CE1 3.77Å; I136-Y142 HydrophobicContact CG1-CD1 4.17Å; I136-Y142 HydrophobicContact CG1-CE1 4.19Å; Y142-I144 HydrophobicContact CD2-CD1 4.27Å; Y142-I144 HydrophobicContact CD2-CG1 4.16Å; Y142-I144 HydrophobicContact CD2-CG2 4.36Å; Y142-I144 HydrophobicContact CE2-CD1 4.25Å; Y142-I144 HydrophobicContact CE2-CG1 4.32Å; Y142-E147 HydrophobicContact CE2-CG 3.93Å; Y142-E147 PolarHBondContact OH-OE1 2.83Å; Y142-C149 HydrophobicContact CD1-CB 3.91Å; Y142-C149 HydrophobicContact CD2-CB 4.42Å; Y142-C149 HydrophobicContact CE1-CB 3.33Å; Y142-C149 HydrophobicContact CE2-CB 3.91Å; Y142-C149 HydrophobicContact CG-CB 4.41Å; Y142-C149 PolarHBondContact N-O 3.38Å; Y142-C149 PolarHBondContact O-N 2.92Å; Y142-C149 WeakPolarHBondContact OH-CB 3.39Å; Y142-Y159 CarbonylContact C-O 3.55Å; Y142-Y159 WeakPolarHBondContact CA-O 3.42Å; Y142-Y159 VanDerWaalsContact CB-O 3.27Å; Y142-Y159 WeakPolarHBondContact CB-O 2.86Å
143	I	94.4	Very high	89.8	Confident	10 Å²	10	59.7 Å²	59.7	5%	0.051	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.4	103.3	178.7	-53.6	175.9	0	0	0	107.6	E148 W150 Y159 L160 T161 M164	I143-E148 HydrophobicContact CG2-CG 3.89Å; I143-W150 HydrophobicContact CD1-CG 4.49Å; I143-W150 HydrophobicContact CG1-CG 4.45Å; I143-Y159 PolarHBondContact N-O 3.07Å; I143-L160 HydrophobicContact CB-CB 3.82Å; I143-L160 WeakPolarHBondContact O-CA 3.35Å; I143-L160 VanDerWaalsContact O-CB 3.23Å; I143-L160 WeakPolarHBondContact O-CB 3.45Å; I143-T161 PolarHBondContact O-N 2.87Å; I143-M164 HydrophobicContact CG2-CB 3.94Å; I143-M164 HydrophobicContact CG2-CG 4.09Å
144	I	90	Very high	89.7	Confident	0 Å²	0	54 Å²	54	0%	0	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	162.9	177.4	65.8	-178.2	0	0	0	109.4	R118 A121 Y142 F146 E147 T161	R118-I144 HydrophobicContact CB-CD1 4.3Å; R118-I144 HydrophobicContact CB-CG2 4.48Å; R118-I144 HydrophobicContact CG-CB 4.18Å; R118-I144 HydrophobicContact CG-CG2 4.49Å; A121-I144 HydrophobicContact CB-CG2 3.91Å; Y142-I144 HydrophobicContact CD2-CD1 4.27Å; Y142-I144 HydrophobicContact CD2-CG1 4.16Å; Y142-I144 HydrophobicContact CD2-CG2 4.36Å; Y142-I144 HydrophobicContact CE2-CD1 4.25Å; Y142-I144 HydrophobicContact CE2-CG1 4.32Å; I144-F146 PolarHBondContact O-N 2.98Å; I144-E147 CarbonylContact C-O 3.57Å; I144-E147 HydrophobicContact CD1-CB 4.25Å; I144-E147 HydrophobicContact CG1-CB 3.79Å; I144-E147 WeakPolarHBondContact CG1-O 3.44Å; I144-E147 PolarHBondContact N-O 2.86Å; I144-E147 CarbonylContact O-C 3.47Å; I144-E147 PolarHBondContact O-N 2.96Å; I144-T161 HydrophobicContact CB-CG2 4.45Å; I144-T161 HydrophobicContact CG2-CG2 4.04Å
145	R	80.3	Confident	89.6	Confident	62 Å²	62	52.1 Å²	52.1	23%	0.234	25%	0.252	C	S	.	.	T	Hydrogen-bonded Turn	trans	-56.3	122.5	-177.6	-166.4	-179.3	-82.3	165.7	-5.3	110.2	E147 M164 G524 D526	R145-E147 VanDerWaalsContact C-N 3.3Å; R145-E147 PolarHBondContact O-N 2.72Å; R145-M164 HydrophobicContact CB-CE 4.37Å; R145-M164 HydrophobicContact CB-SD 4.38Å; R145-M164 HydrophobicContact CG-CE 4.45Å; R145-G524 VanDerWaalsContact CZ-O 3.29Å; R145-G524 PolarHBondContact NH1-O 3.1Å; R145-D526 IonicContact NH1-OD1 4Å; R145-D526 IonicContact NH1-OD2 2.95Å; R145-D526 IonicContact NH2-OD1 3.73Å; R145-D526 PolarHBondContact NH2-OD1 3.2Å
146	F	73.9	Confident	89.7	Confident	77 Å²	77	45.4 Å²	45.4	34%	0.338	23%	0.229	S	C	.	.	T	Hydrogen-bonded Turn	trans	69.7	9.5	-179	-43.1	-64.2	0	0	0	117.1	I144 L625 R628	I144-F146 PolarHBondContact O-N 2.98Å; F146-L625 HydrophobicContact CE2-CD2 4.04Å; F146-R628 VanDerWaalsContact CG-NH1 3.32Å
147	E	81.6	Confident	89.9	Confident	63 Å²	63	43.3 Å²	43.3	29%	0.294	22%	0.218	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.7	116.5	-179.6	-169.3	-174.6	166.7	0	0	109.2	R118 Y142 I144 R145	R118-E147 IonicContact NH2-OE2 2.89Å; Y142-E147 HydrophobicContact CE2-CG 3.93Å; Y142-E147 PolarHBondContact OH-OE1 2.83Å; I144-E147 CarbonylContact C-O 3.57Å; I144-E147 HydrophobicContact CD1-CB 4.25Å; I144-E147 HydrophobicContact CG1-CB 3.79Å; I144-E147 WeakPolarHBondContact CG1-O 3.44Å; I144-E147 PolarHBondContact N-O 2.86Å; I144-E147 CarbonylContact O-C 3.47Å; I144-E147 PolarHBondContact O-N 2.96Å; R145-E147 VanDerWaalsContact C-N 3.3Å; R145-E147 PolarHBondContact O-N 2.72Å
148	E	88.7	Confident	90.1	Very high	98 Å²	98	43 Å²	43	46%	0.458	22%	0.216	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	131	177.7	-57.6	-168.3	-165.3	0	0	108.7	I143 W150	I143-E148 HydrophobicContact CG2-CG 3.89Å; E148-W150 PolarHBondContact OE2-NE1 2.79Å
149	C	92.7	Very high	90.3	Very high	35 Å²	35	38 Å²	38	24%	0.236	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.5	88.6	176.6	-174	0	0	0	0	108.2	G137 G141 Y142	G137-C149 VanDerWaalsContact CA-SG 3.54Å; G141-C149 CarbonylContact C-O 3.57Å; G141-C149 WeakPolarHBondContact CA-O 3.1Å; Y142-C149 HydrophobicContact CD1-CB 3.91Å; Y142-C149 HydrophobicContact CD2-CB 4.42Å; Y142-C149 HydrophobicContact CE1-CB 3.33Å; Y142-C149 HydrophobicContact CE2-CB 3.91Å; Y142-C149 HydrophobicContact CG-CB 4.41Å; Y142-C149 PolarHBondContact N-O 3.38Å; Y142-C149 PolarHBondContact O-N 2.92Å; Y142-C149 WeakPolarHBondContact OH-CB 3.39Å
150	W	93	Very high	90.5	Very high	67 Å²	67	35.7 Å²	35.7	25%	0.254	18%	0.183	S	C	.	.			trans	-157.6	154.9	177.4	69.5	-76.2	0	0	0	109.6	G137 I143 E148 P152 T155 R177	G137-W150 CarbonylContact O-C 3.52Å; I143-W150 HydrophobicContact CD1-CG 4.49Å; I143-W150 HydrophobicContact CG1-CG 4.45Å; E148-W150 PolarHBondContact OE2-NE1 2.79Å; W150-P152 HydrophobicContact CH2-CG 4.11Å; W150-P152 HydrophobicContact CZ3-CB 4.18Å; W150-P152 HydrophobicContact CZ3-CG 3.94Å; W150-T155 HydrophobicContact CB-CG2 4.1Å; W150-R177 VanDerWaalsContact CH2-NH1 3.32Å
151	T	90.4	Very high	90.4	Very high	66 Å²	66	36.5 Å²	36.5	41%	0.405	19%	0.188	S	C	.	.			trans	-118.3	123.9	179.6	-57.1	0	0	0	0	108.7	G137 S154 T155	G137-T151 VanDerWaalsContact O-CB 3.31Å; G137-T151 WeakPolarHBondContact O-CB 3.3Å; G137-T151 PolarHBondContact O-N 2.82Å; G137-T151 PolarHBondContact O-OG1 3.26Å; T151-S154 PolarHBondContact O-N 3.36Å; T151-T155 PolarHBondContact N-OG1 2.78Å; T151-T155 PolarHBondContact O-N 3.42Å; T151-T155 PolarHBondContact O-OG1 3.48Å
152	P	84.7	Confident	90.3	Very high	61 Å²	61	36.9 Å²	36.9	40%	0.396	19%	0.19	S	C	.	.	T	Hydrogen-bonded Turn	trans	-52.3	144.7	172.7	-24.6	33.3	0	0	0	111.5	F107 W150 S154	F107-P152 HydrophobicContact CD1-CB 3.78Å; F107-P152 HydrophobicContact CE1-CB 4.02Å; W150-P152 HydrophobicContact CH2-CG 4.11Å; W150-P152 HydrophobicContact CZ3-CB 4.18Å; W150-P152 HydrophobicContact CZ3-CG 3.94Å; P152-S154 PolarHBondContact O-N 3.23Å
153	N	81.6	Confident	90.1	Very high	117 Å²	117	36.5 Å²	36.5	63%	0.626	19%	0.193	S	C	*	.	T	Hydrogen-bonded Turn	trans	64.8	-17.2	-177.5	-51	-22.3	0	0	0	116.3	P106 F107	P106-N153 PolarHBondContact O-OD1 3.4Å; F107-N153 WeakPolarHBondContact CA-OD1 3.32Å; F107-N153 WeakPolarHBondContact CD1-OD1 3.23Å
154	S	88.7	Confident	90	Very high	34 Å²	34	36.7 Å²	36.7	24%	0.238	19%	0.193	C	C	.	.	T	Hydrogen-bonded Turn	trans	-103.8	-35.5	-179.7	-172	0	0	0	0	112.6	K138 Q139 T151 P152 V156	K138-S154 WeakPolarHBondContact CG-OG 3.3Å; K138-S154 CarbonylContact O-C 3.5Å; K138-S154 VanDerWaalsContact O-O 3.1Å; K138-S154 PolarHBondContact O-OG 3.02Å; Q139-S154 WeakPolarHBondContact CA-O 3.4Å; T151-S154 PolarHBondContact O-N 3.36Å; P152-S154 PolarHBondContact O-N 3.23Å; S154-V156 PolarHBondContact O-N 3.2Å
155	T	92.5	Very high	90.3	Very high	5 Å²	5	36.7 Å²	36.7	3%	0.031	19%	0.193	C	C	.	.			trans	-80.8	114.2	-176.8	-58.9	0	0	0	0	110.5	T110 G137 K138 W150 T151 I157	T110-T155 WeakPolarHBondContact CG2-O 3.23Å; G137-T155 PolarHBondContact O-OG1 3.13Å; K138-T155 WeakPolarHBondContact O-CA 3.26Å; K138-T155 WeakPolarHBondContact O-CB 3.39Å; K138-T155 PolarHBondContact O-N 3.27Å; K138-T155 PolarHBondContact O-OG1 2.99Å; W150-T155 HydrophobicContact CB-CG2 4.1Å; T151-T155 PolarHBondContact N-OG1 2.78Å; T151-T155 PolarHBondContact O-N 3.42Å; T151-T155 PolarHBondContact O-OG1 3.48Å; T155-I157 WeakPolarHBondContact CG2-O 3.34Å
156	V	94.2	Very high	90.9	Very high	28 Å²	28	34 Å²	34	17%	0.17	18%	0.184	C	C	.	.			trans	-95.8	-30.4	-179.7	-68.4	0	0	0	0	112.4	Y92 L97 T110 M111 W134 Q139 S154	Y92-V156 HydrophobicContact CD2-CB 4.26Å; Y92-V156 HydrophobicContact CD2-CG2 3.84Å; Y92-V156 HydrophobicContact CE2-CB 4.39Å; Y92-V156 HydrophobicContact CE2-CG1 4.37Å; Y92-V156 HydrophobicContact CE2-CG2 3.88Å; L97-V156 HydrophobicContact CD1-CB 4.35Å; T110-V156 WeakPolarHBondContact CA-O 3.4Å; T110-V156 WeakPolarHBondContact CB-O 3.33Å; M111-V156 PolarHBondContact N-O 3.24Å; W134-V156 HydrophobicContact CH2-CG2 4.24Å; W134-V156 HydrophobicContact CZ3-CG2 4.25Å; Q139-V156 VanDerWaalsContact O-CG2 3.25Å; Q139-V156 WeakPolarHBondContact O-CG2 3.34Å; Q139-V156 PolarHBondContact O-N 2.98Å; S154-V156 PolarHBondContact O-N 3.2Å
157	I	96.2	Very high	91.6	Very high	0 Å²	0	32.6 Å²	32.6	0%	0	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	124.8	177.4	-60	171.2	0	0	0	109.1	P88 L97 V113 W134 Q139 V140 G141 T155 Y159	P88-I157 HydrophobicContact CB-CD1 4.02Å; P88-I157 HydrophobicContact CB-CG2 4.11Å; L97-I157 HydrophobicContact CD1-CG1 4.24Å; V113-I157 HydrophobicContact CG2-CG2 4.41Å; W134-I157 HydrophobicContact CZ3-CD1 4.32Å; Q139-I157 PolarHBondContact O-N 3.49Å; V140-I157 WeakPolarHBondContact CA-O 3.47Å; V140-I157 HydrophobicContact CG2-CB 4.4Å; V140-I157 HydrophobicContact CG2-CG2 4.45Å; G141-I157 PolarHBondContact N-O 3.35Å; T155-I157 WeakPolarHBondContact CG2-O 3.34Å; I157-Y159 HydrophobicContact CG2-CD2 4.25Å; I157-Y159 HydrophobicContact CG2-CE2 3.74Å
158	S	96.4	Very high	92.1	Very high	2 Å²	2	31 Å²	31	1%	0.014	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	122.6	176.8	-59.6	0	0	0	0	111.2	M111 V113 G141 L160	M111-S158 PolarHBondContact O-N 2.94Å; V113-S158 PolarHBondContact N-O 3.19Å; G141-S158 WeakPolarHBondContact O-CA 3.1Å; S158-L160 WeakPolarHBondContact O-CD2 3.22Å
159	Y	97.6	Very high	92.3	Very high	0 Å²	0	26.6 Å²	26.6	0%	0	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92	121.8	169.6	-70.5	-92.4	0	0	0	109.9	S84 V113 A121 L124 A125 V128 V140 G141 Y142 I143 I157	S84-Y159 PolarHBondContact O-OH 3.1Å; V113-Y159 HydrophobicContact CB-CD1 3.7Å; V113-Y159 HydrophobicContact CB-CE1 3.79Å; V113-Y159 HydrophobicContact CB-CG 4.37Å; V113-Y159 HydrophobicContact CG1-CD1 3.82Å; V113-Y159 HydrophobicContact CG1-CE1 3.71Å; V113-Y159 HydrophobicContact CG2-CD1 4.36Å; V113-Y159 HydrophobicContact CG2-CE1 4.04Å; V113-Y159 WeakPolarHBondContact O-CA 3.46Å; A121-Y159 WeakPolarHBondContact O-CB 3.12Å; L124-Y159 HydrophobicContact CB-CD1 3.73Å; L124-Y159 HydrophobicContact CB-CE1 3.6Å; L124-Y159 HydrophobicContact CB-CG 4.34Å; L124-Y159 HydrophobicContact CD1-CD1 4.29Å; L124-Y159 HydrophobicContact CD1-CE1 4.19Å; L124-Y159 HydrophobicContact CG-CE1 4.47Å; A125-Y159 HydrophobicContact CB-CD2 3.73Å; A125-Y159 HydrophobicContact CB-CG 4.21Å; V128-Y159 HydrophobicContact CB-CE2 4.39Å; V128-Y159 HydrophobicContact CG2-CE2 4.26Å; V128-Y159 VanDerWaalsContact CG2-OH 3.23Å; V128-Y159 WeakPolarHBondContact CG2-OH 3.43Å; V140-Y159 HydrophobicContact CG2-CD2 4Å; V140-Y159 HydrophobicContact CG2-CE2 3.9Å; G141-Y159 PolarHBondContact O-N 3.39Å; Y142-Y159 CarbonylContact C-O 3.55Å; Y142-Y159 WeakPolarHBondContact CA-O 3.42Å; Y142-Y159 VanDerWaalsContact CB-O 3.27Å; Y142-Y159 WeakPolarHBondContact CB-O 2.86Å; I143-Y159 PolarHBondContact N-O 3.07Å; I157-Y159 HydrophobicContact CG2-CD2 4.25Å; I157-Y159 HydrophobicContact CG2-CE2 3.74Å
160	L	96.8	Very high	92.1	Very high	1 Å²	1	27.5 Å²	27.5	1%	0.005	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.8	158.3	-174.7	68.1	165	0	0	0	112.3	A112 V113 T114 Q115 I143 S158 M164 M165	A112-L160 HydrophobicContact CB-CD2 3.71Å; V113-L160 PolarHBondContact O-N 2.77Å; T114-L160 CarbonylContact C-O 3.52Å; T114-L160 VanDerWaalsContact CA-O 3.22Å; T114-L160 WeakPolarHBondContact CA-O 3.33Å; T114-L160 HydrophobicContact CG2-CD2 4.39Å; T114-L160 HydrophobicContact CG2-CG 4.44Å; Q115-L160 PolarHBondContact N-O 2.91Å; I143-L160 HydrophobicContact CB-CB 3.82Å; I143-L160 WeakPolarHBondContact O-CA 3.35Å; I143-L160 VanDerWaalsContact O-CB 3.23Å; I143-L160 WeakPolarHBondContact O-CB 3.45Å; S158-L160 WeakPolarHBondContact O-CD2 3.22Å; L160-M164 HydrophobicContact CB-CB 4.44Å; L160-M164 HydrophobicContact CD1-CB 4.34Å; L160-M165 HydrophobicContact CD1-CB 3.9Å; L160-M165 HydrophobicContact CD1-CG 4.5Å; L160-M165 HydrophobicContact CD1-SD 3.86Å
161	T	93.8	Very high	91.8	Very high	17 Å²	17	31.8 Å²	31.8	10%	0.104	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.1	152.5	170.7	58.3	0	0	0	0	111.2	Q115 R118 I143 I144 G163 M164 M165	Q115-T161 WeakPolarHBondContact O-CA 3.44Å; R118-T161 HydrophobicContact CG-CG2 3.94Å; I143-T161 PolarHBondContact O-N 2.87Å; I144-T161 HydrophobicContact CB-CG2 4.45Å; I144-T161 HydrophobicContact CG2-CG2 4.04Å; T161-G163 PolarHBondContact O-N 3.22Å; T161-M164 PolarHBondContact O-N 3.1Å; T161-M164 WeakPolarHBondContact OG1-CG 3.41Å; T161-M165 PolarHBondContact O-N 3.36Å; T161-M165 VanDerWaalsContact O-N 3.11Å
162	E	94	Very high	91.9	Very high	9 Å²	9	30.2 Å²	30.2	4%	0.042	16%	0.158	C	C	.	.	H	α-helix	trans	-52.3	-41	178.2	-59.1	161.7	163.8	0	0	112	M164 M165 I166 S190 Q192 T193	E162-M164 VanDerWaalsContact C-N 3.32Å; E162-M164 PolarHBondContact O-N 3.3Å; E162-M165 WeakPolarHBondContact O-CB 3.41Å; E162-M165 PolarHBondContact O-N 3.13Å; E162-M165 VanDerWaalsContact O-N 3.16Å; E162-I166 PolarHBondContact O-N 2.81Å; E162-S190 PolarHBondContact OE1-OG 3.33Å; E162-S190 PolarHBondContact OE2-OG 3Å; E162-Q192 HydrophobicContact CB-CB 3.71Å; E162-T193 PolarHBondContact OE1-OG1 3.21Å
163	G	90.8	Very high	92.3	Very high	15 Å²	15	31.4 Å²	31.4	16%	0.155	17%	0.165	C	C	.	.	H	α-helix	trans	-63.7	-33	176.7	0	0	0	0	0	113.9	T161 I166 Q167	T161-G163 PolarHBondContact O-N 3.22Å; G163-I166 PolarHBondContact O-N 3.38Å; G163-Q167 PolarHBondContact O-N 3.1Å
164	M	92.4	Very high	92.8	Very high	13 Å²	13	29.5 Å²	29.5	6%	0.064	16%	0.155	C	C	.	.	H	α-helix	trans	-73.6	-31.9	174.3	-61.3	-60.8	80.8	0	0	111.5	I143 R145 L160 T161 E162 Q167 E168	I143-M164 HydrophobicContact CG2-CB 3.94Å; I143-M164 HydrophobicContact CG2-CG 4.09Å; R145-M164 HydrophobicContact CB-CE 4.37Å; R145-M164 HydrophobicContact CB-SD 4.38Å; R145-M164 HydrophobicContact CG-CE 4.45Å; L160-M164 HydrophobicContact CB-CB 4.44Å; L160-M164 HydrophobicContact CD1-CB 4.34Å; T161-M164 PolarHBondContact O-N 3.1Å; T161-M164 WeakPolarHBondContact OG1-CG 3.41Å; E162-M164 VanDerWaalsContact C-N 3.32Å; E162-M164 PolarHBondContact O-N 3.3Å; M164-Q167 HydrophobicContact CE-CB 4.36Å; M164-Q167 PolarHBondContact O-N 3.06Å; M164-E168 PolarHBondContact O-N 3.39Å
165	M	95.1	Very high	93.1	Very high	0 Å²	0	27.9 Å²	27.9	0%	0	14%	0.144	C	C	.	.	H	α-helix	trans	-65.3	-39.7	172.5	-168.2	62.8	-179.3	0	0	112	A112 T114 L160 T161 E162 Q167 E168 L169 L175 F178 I181 L196	A112-M165 HydrophobicContact CB-SD 4.34Å; T114-M165 HydrophobicContact CG2-CB 3.95Å; T114-M165 HydrophobicContact CG2-CG 4.03Å; L160-M165 HydrophobicContact CD1-CB 3.9Å; L160-M165 HydrophobicContact CD1-CG 4.5Å; L160-M165 HydrophobicContact CD1-SD 3.86Å; T161-M165 PolarHBondContact O-N 3.36Å; T161-M165 VanDerWaalsContact O-N 3.11Å; E162-M165 WeakPolarHBondContact O-CB 3.41Å; E162-M165 PolarHBondContact O-N 3.13Å; E162-M165 VanDerWaalsContact O-N 3.16Å; M165-Q167 VanDerWaalsContact C-N 3.32Å; M165-E168 WeakPolarHBondContact O-CB 3.41Å; M165-E168 PolarHBondContact O-N 2.7Å; M165-L169 PolarHBondContact O-N 3.07Å; M165-L169 VanDerWaalsContact O-N 3.07Å; M165-L175 HydrophobicContact CE-CD1 3.42Å; M165-L175 VanDerWaalsContact CE-CD1 3.42Å; M165-L175 HydrophobicContact CE-CD2 3.7Å; M165-L175 HydrophobicContact CE-CG 4.12Å; M165-L175 HydrophobicContact SD-CD2 4.38Å; M165-F178 HydrophobicContact CE-CD2 3.89Å; M165-F178 HydrophobicContact CE-CE2 3.94Å; M165-F178 HydrophobicContact SD-CD2 4.4Å; M165-F178 HydrophobicContact SD-CE2 3.85Å; M165-F178 HydrophobicContact SD-CZ 4.49Å; M165-I181 HydrophobicContact CE-CD1 3.5Å; M165-I181 HydrophobicContact CE-CG1 3.93Å; M165-I181 HydrophobicContact CE-CG2 4.05Å; M165-L196 HydrophobicContact CB-CD1 4.35Å; M165-L196 HydrophobicContact CB-CD2 4.06Å; M165-L196 HydrophobicContact CG-CD1 3.77Å; M165-L196 HydrophobicContact CG-CD2 3.89Å; M165-L196 HydrophobicContact CG-CG 4.5Å
166	I	92.9	Very high	93	Very high	5 Å²	5	30.2 Å²	30.2	3%	0.026	16%	0.158	C	C	.	.	H	α-helix	trans	-65.8	-36.8	173.5	-68.2	165.4	0	0	0	111.2	E162 G163 E168 L169 L170 Q192 I195 L196 L469	E162-I166 PolarHBondContact O-N 2.81Å; G163-I166 PolarHBondContact O-N 3.38Å; I166-E168 VanDerWaalsContact C-N 3.32Å; I166-L169 WeakPolarHBondContact O-CB 3.42Å; I166-L169 PolarHBondContact O-N 3.25Å; I166-L170 PolarHBondContact O-N 2.83Å; I166-Q192 HydrophobicContact CD1-CB 3.99Å; I166-I195 HydrophobicContact CD1-CB 4.43Å; I166-I195 HydrophobicContact CD1-CG2 4.1Å; I166-L196 HydrophobicContact CG1-CD1 4.28Å; I166-L469 HydrophobicContact CG2-CD1 4.31Å
167	Q	89.3	Confident	92.8	Very high	49 Å²	49	29.8 Å²	29.8	23%	0.229	15%	0.153	C	C	.	.	H	α-helix	trans	-66.9	-34.7	174.3	-171.8	169.9	-0.2	0	0	112.2	G163 M164 M165 L169 L170 R171	G163-Q167 PolarHBondContact O-N 3.1Å; M164-Q167 HydrophobicContact CE-CB 4.36Å; M164-Q167 PolarHBondContact O-N 3.06Å; M165-Q167 VanDerWaalsContact C-N 3.32Å; Q167-L169 VanDerWaalsContact C-N 3.34Å; Q167-L170 WeakPolarHBondContact O-CB 3.44Å; Q167-L170 PolarHBondContact O-N 3.49Å; Q167-R171 PolarHBondContact O-N 3.22Å
168	E	91.4	Very high	92.6	Very high	29 Å²	29	29.8 Å²	29.8	14%	0.136	15%	0.153	C	C	.	.	H	α-helix	trans	-64.7	-39.9	173.2	-165.6	68.2	178.6	0	0	111.5	M164 M165 I166 L170 R171 D172 L175 R177 F178	M164-E168 PolarHBondContact O-N 3.39Å; M165-E168 WeakPolarHBondContact O-CB 3.41Å; M165-E168 PolarHBondContact O-N 2.7Å; I166-E168 VanDerWaalsContact C-N 3.32Å; E168-L170 PolarHBondContact O-N 2.82Å; E168-R171 PolarHBondContact O-N 3.04Å; E168-R171 IonicContact OE2-NH1 3.69Å; E168-D172 PolarHBondContact O-N 2.88Å; E168-L175 HydrophobicContact CB-CD2 4.23Å; E168-L175 HydrophobicContact CG-CD2 3.97Å; E168-R177 IonicContact OE1-CZ 3.6Å; E168-R177 VanDerWaalsContact OE1-CZ 3.26Å; E168-R177 IonicContact OE1-NE 2.7Å; E168-R177 IonicContact OE1-NH1 3.48Å; E168-R177 IonicContact OE1-NH2 2.75Å; E168-R177 PolarHBondContact OE1-NH2 3.17Å; E168-R177 IonicContact OE2-NH2 3.62Å; E168-F178 HydrophobicContact CG-CE2 4.1Å
169	L	93.6	Very high	92.4	Very high	5 Å²	5	33.3 Å²	33.3	3%	0.026	17%	0.166	C	C	.	.	H	α-helix	trans	-59.2	-28.8	173.9	-83.4	163.5	0	0	0	113.6	M165 I166 Q167 R171 D172 P173 L175 L196 L199 V203 L469	M165-L169 PolarHBondContact O-N 3.07Å; M165-L169 VanDerWaalsContact O-N 3.07Å; I166-L169 WeakPolarHBondContact O-CB 3.42Å; I166-L169 PolarHBondContact O-N 3.25Å; Q167-L169 VanDerWaalsContact C-N 3.34Å; L169-R171 VanDerWaalsContact C-N 3.34Å; L169-D172 CarbonylContact O-C 3.53Å; L169-P173 VanDerWaalsContact O-CA 3.29Å; L169-P173 WeakPolarHBondContact O-CA 3.32Å; L169-L175 HydrophobicContact CD1-CD1 4.47Å; L169-L175 HydrophobicContact CD2-CD1 3.58Å; L169-L175 HydrophobicContact CD2-CD2 4.05Å; L169-L175 HydrophobicContact CD2-CG 3.58Å; L169-L175 HydrophobicContact CG-CD1 3.94Å; L169-L175 HydrophobicContact CG-CD2 3.96Å; L169-L175 HydrophobicContact CG-CG 4.03Å; L169-L196 HydrophobicContact CD1-CD1 3.77Å; L169-L199 HydrophobicContact CD1-CB 3.89Å; L169-L199 HydrophobicContact CD1-CD1 3.82Å; L169-L199 HydrophobicContact CD1-CG 4.47Å; L169-V203 HydrophobicContact CD2-CG2 3.95Å; L169-L469 HydrophobicContact CB-CD2 3.92Å
170	L	87.8	Confident	92.4	Very high	54 Å²	54	33.3 Å²	33.3	28%	0.283	17%	0.166	S	C	.	.	H	α-helix	trans	-71.1	-31.1	173.9	-72.8	168.4	0	0	0	112.2	I166 Q167 E168 T468 L469 T521	I166-L170 PolarHBondContact O-N 2.83Å; Q167-L170 WeakPolarHBondContact O-CB 3.44Å; Q167-L170 PolarHBondContact O-N 3.49Å; E168-L170 PolarHBondContact O-N 2.82Å; L170-T468 HydrophobicContact CD2-CG2 3.7Å; L170-L469 HydrophobicContact CB-CD2 4.47Å; L170-L469 HydrophobicContact CD2-CD2 3.51Å; L170-L469 HydrophobicContact CD2-CG 3.65Å; L170-L469 HydrophobicContact CG-CD2 3.77Å; L170-L469 HydrophobicContact CG-CG 4.2Å; L170-T521 HydrophobicContact CD1-CG2 3.49Å; L170-T521 VanDerWaalsContact CD1-CG2 3.49Å
171	R	88	Confident	92.4	Very high	158 Å²	158	33.3 Å²	33.3	60%	0.596	17%	0.166	S	C	*	.	H	α-helix	trans	-84.3	-44.6	178.4	-65.3	176.8	174.8	165	-2.3	111.6	Q167 E168 L169	Q167-R171 PolarHBondContact O-N 3.22Å; E168-R171 PolarHBondContact O-N 3.04Å; E168-R171 IonicContact OE2-NH1 3.69Å; L169-R171 VanDerWaalsContact C-N 3.34Å
172	D	91.8	Very high	92.6	Very high	32 Å²	32	32.5 Å²	32.5	17%	0.171	16%	0.161	C	C	.	.			trans	-131.6	93.3	179.2	178	0.8	0	0	0	109.7	E168 L169 L174 L175 T176	E168-D172 PolarHBondContact O-N 2.88Å; L169-D172 CarbonylContact O-C 3.53Å; D172-L174 PolarHBondContact O-N 3.47Å; D172-L174 VanDerWaalsContact O-N 3.09Å; D172-L174 PolarHBondContact OD1-N 3.47Å; D172-L175 PolarHBondContact O-N 3.43Å; D172-L175 PolarHBondContact OD1-N 2.95Å; D172-L175 WeakPolarHBondContact OD2-CA 3.48Å; D172-T176 WeakPolarHBondContact OD2-CB 3.38Å; D172-T176 PolarHBondContact OD2-N 2.85Å; D172-T176 PolarHBondContact OD2-OG1 3.38Å
173	P	93	Very high	92.7	Very high	86 Å²	86	32 Å²	32	56%	0.558	16%	0.159	S	C	*	.	T	Hydrogen-bonded Turn	trans	-61.9	-16.4	-179.5	-25.6	35.3	0	0	0	115.1	L169 V203	L169-P173 VanDerWaalsContact O-CA 3.29Å; L169-P173 WeakPolarHBondContact O-CA 3.32Å; P173-V203 WeakPolarHBondContact O-CG2 3.48Å
174	L	93.1	Very high	92.9	Very high	77 Å²	77	31.3 Å²	31.3	40%	0.403	15%	0.152	S	C	.	.	T	Hydrogen-bonded Turn	trans	-102.2	-4.9	179	-67.2	179.9	0	0	0	112.9	D172 T176 V203 K206 R207	D172-L174 PolarHBondContact O-N 3.47Å; D172-L174 VanDerWaalsContact O-N 3.09Å; D172-L174 PolarHBondContact OD1-N 3.47Å; L174-T176 HydrophobicContact CB-CG2 3.71Å; L174-T176 PolarHBondContact O-N 2.89Å; L174-V203 WeakPolarHBondContact O-CG1 3.42Å; L174-K206 HydrophobicContact CD2-CB 3.85Å; L174-K206 HydrophobicContact CD2-CG 4.45Å; L174-R207 WeakPolarHBondContact O-CD 3.47Å; L174-R207 PolarHBondContact O-NH1 3.48Å
175	L	93.9	Very high	92.8	Very high	1 Å²	1	31.1 Å²	31.1	1%	0.005	15%	0.15	C	C	.	.			trans	51.8	38.3	179.9	-65.7	169.8	0	0	0	112	M165 E168 L169 D172 R177 F178 I181 V203 R207	M165-L175 HydrophobicContact CE-CD1 3.42Å; M165-L175 VanDerWaalsContact CE-CD1 3.42Å; M165-L175 HydrophobicContact CE-CD2 3.7Å; M165-L175 HydrophobicContact CE-CG 4.12Å; M165-L175 HydrophobicContact SD-CD2 4.38Å; E168-L175 HydrophobicContact CB-CD2 4.23Å; E168-L175 HydrophobicContact CG-CD2 3.97Å; L169-L175 HydrophobicContact CD1-CD1 4.47Å; L169-L175 HydrophobicContact CD2-CD1 3.58Å; L169-L175 HydrophobicContact CD2-CD2 4.05Å; L169-L175 HydrophobicContact CD2-CG 3.58Å; L169-L175 HydrophobicContact CG-CD1 3.94Å; L169-L175 HydrophobicContact CG-CD2 3.96Å; L169-L175 HydrophobicContact CG-CG 4.03Å; D172-L175 PolarHBondContact O-N 3.43Å; D172-L175 PolarHBondContact OD1-N 2.95Å; D172-L175 WeakPolarHBondContact OD2-CA 3.48Å; L175-R177 PolarHBondContact O-N 2.78Å; L175-R177 VanDerWaalsContact O-N 3.13Å; L175-F178 HydrophobicContact CB-CD2 4.16Å; L175-F178 HydrophobicContact CD2-CD2 4.07Å; L175-F178 HydrophobicContact CD2-CE2 4.18Å; L175-F178 PolarHBondContact O-N 2.9Å; L175-I181 HydrophobicContact CD1-CD1 3.78Å; L175-V203 HydrophobicContact CD1-CG2 4.45Å; L175-R207 VanDerWaalsContact C-NH1 3.29Å; L175-R207 PolarHBondContact O-NH1 3.12Å
176	T	90.9	Very high	92.6	Very high	54 Å²	54	31.1 Å²	31.1	33%	0.331	15%	0.15	S	C	.	.	T	Hydrogen-bonded Turn	trans	-56	-31.3	-170.8	59.4	0	0	0	0	112.9	N105 D172 L174 F178	N105-T176 PolarHBondContact ND2-O 2.85Å; D172-T176 WeakPolarHBondContact OD2-CB 3.38Å; D172-T176 PolarHBondContact OD2-N 2.85Å; D172-T176 PolarHBondContact OD2-OG1 3.38Å; L174-T176 HydrophobicContact CB-CG2 3.71Å; L174-T176 PolarHBondContact O-N 2.89Å; T176-F178 PolarHBondContact O-N 3.08Å
177	R	89.2	Confident	92.4	Very high	18 Å²	18	31.9 Å²	31.9	7%	0.068	15%	0.154	C	C	.	.	T	Hydrogen-bonded Turn	trans	-55.7	-37.7	172.3	-177	174.6	65.8	-171.2	-12.1	112.9	V109 T110 W150 E168 L175	V109-R177 WeakPolarHBondContact CA-O 3.47Å; T110-R177 HydrophobicContact CG2-CG 4.4Å; T110-R177 PolarHBondContact N-O 2.81Å; W150-R177 VanDerWaalsContact CH2-NH1 3.32Å; E168-R177 IonicContact OE1-CZ 3.6Å; E168-R177 VanDerWaalsContact OE1-CZ 3.26Å; E168-R177 IonicContact OE1-NE 2.7Å; E168-R177 IonicContact OE1-NH1 3.48Å; E168-R177 IonicContact OE1-NH2 2.75Å; E168-R177 PolarHBondContact OE1-NH2 3.17Å; E168-R177 IonicContact OE2-NH2 3.62Å; L175-R177 PolarHBondContact O-N 2.78Å; L175-R177 VanDerWaalsContact O-N 3.13Å
178	F	93.5	Very high	92.1	Very high	0 Å²	0	32.2 Å²	32.2	0%	0	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.1	129.4	-171.9	-57.4	-60.8	0	0	0	112.1	T110 A112 M165 E168 L175 T176 I181 R207	T110-F178 WeakPolarHBondContact O-CA 3.47Å; T110-F178 WeakPolarHBondContact OG1-CD1 3.42Å; T110-F178 WeakPolarHBondContact OG1-CE1 3.4Å; A112-F178 HydrophobicContact CB-CD1 3.62Å; A112-F178 HydrophobicContact CB-CD2 4.26Å; A112-F178 HydrophobicContact CB-CE1 3.52Å; A112-F178 HydrophobicContact CB-CE2 4.15Å; A112-F178 HydrophobicContact CB-CG 3.99Å; A112-F178 HydrophobicContact CB-CZ 3.76Å; M165-F178 HydrophobicContact CE-CD2 3.89Å; M165-F178 HydrophobicContact CE-CE2 3.94Å; M165-F178 HydrophobicContact SD-CD2 4.4Å; M165-F178 HydrophobicContact SD-CE2 3.85Å; M165-F178 HydrophobicContact SD-CZ 4.49Å; E168-F178 HydrophobicContact CG-CE2 4.1Å; L175-F178 HydrophobicContact CB-CD2 4.16Å; L175-F178 HydrophobicContact CD2-CD2 4.07Å; L175-F178 HydrophobicContact CD2-CE2 4.18Å; L175-F178 PolarHBondContact O-N 2.9Å; T176-F178 PolarHBondContact O-N 3.08Å; F178-I181 HydrophobicContact CB-CD1 4.28Å; F178-I181 HydrophobicContact CB-CG1 3.86Å; F178-I181 HydrophobicContact CG-CG1 4.38Å; F178-R207 PolarHBondContact O-NH1 3.05Å; F178-R207 PolarHBondContact O-NH2 3.27Å
179	R	92.6	Very high	92.1	Very high	77 Å²	77	31.1 Å²	31.1	29%	0.291	15%	0.15	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.5	-35.2	171	-178.1	79.4	177.7	179.4	5.5	111.6	W96 L97 V109 T110 D210 R212	W96-R179 HydrophobicContact CE3-CG 4.17Å; L97-R179 HydrophobicContact CD2-CB 4.47Å; V109-R179 HydrophobicContact CB-CB 3.94Å; V109-R179 HydrophobicContact CG1-CB 4.33Å; V109-R179 HydrophobicContact CG2-CB 4.46Å; T110-R179 PolarHBondContact O-N 3.34Å; R179-D210 VanDerWaalsContact CD-O 3.32Å; R179-D210 WeakPolarHBondContact CD-O 3.26Å; R179-D210 PolarHBondContact NE-O 2.97Å; R179-R212 PolarHBondContact O-N 2.78Å
180	V	96.1	Very high	92	Very high	0 Å²	0	31.5 Å²	31.5	0%	0	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.2	130.2	178.1	-172.8	0	0	0	0	108.8	L67 V91 W96 M111 A112 R212 I214	L67-V180 HydrophobicContact CD1-CG1 4.49Å; V91-V180 HydrophobicContact CG1-CB 4.25Å; V91-V180 HydrophobicContact CG1-CG1 4.46Å; V91-V180 HydrophobicContact CG1-CG2 3.8Å; W96-V180 HydrophobicContact CE3-CG2 4.21Å; M111-V180 VanDerWaalsContact CA-O 3.31Å; M111-V180 WeakPolarHBondContact CA-O 3.32Å; M111-V180 HydrophobicContact CE-CG1 4.13Å; M111-V180 HydrophobicContact CG-CB 4.14Å; M111-V180 HydrophobicContact CG-CG1 4.41Å; M111-V180 HydrophobicContact SD-CB 4.48Å; M111-V180 HydrophobicContact SD-CG1 4.36Å; A112-V180 PolarHBondContact N-O 2.95Å; V180-R212 WeakPolarHBondContact CA-O 3.35Å; V180-R212 HydrophobicContact CG1-CB 4.5Å; V180-R212 HydrophobicContact CG2-CB 4.32Å; V180-I214 HydrophobicContact CG1-CD1 3.83Å; V180-I214 HydrophobicContact CG1-CG1 4.31Å
181	I	97.9	Very high	92.2	Very high	0 Å²	0	29.7 Å²	29.7	0%	0	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	125.2	172.9	-60.2	163.7	0	0	0	108.2	A112 M165 L175 F178 L183 I200 L211 R212 V213 I214	A112-I181 HydrophobicContact CB-CG1 4.37Å; A112-I181 HydrophobicContact CB-CG2 4.49Å; A112-I181 CarbonylContact O-C 3.5Å; A112-I181 WeakPolarHBondContact O-CA 3.24Å; M165-I181 HydrophobicContact CE-CD1 3.5Å; M165-I181 HydrophobicContact CE-CG1 3.93Å; M165-I181 HydrophobicContact CE-CG2 4.05Å; L175-I181 HydrophobicContact CD1-CD1 3.78Å; F178-I181 HydrophobicContact CB-CD1 4.28Å; F178-I181 HydrophobicContact CB-CG1 3.86Å; F178-I181 HydrophobicContact CG-CG1 4.38Å; I181-L183 HydrophobicContact CG2-CD2 4.01Å; I181-I200 HydrophobicContact CD1-CD1 4.18Å; I181-I200 HydrophobicContact CG2-CD1 3.8Å; I181-L211 HydrophobicContact CD1-CD1 3.91Å; I181-L211 HydrophobicContact CD1-CD2 4.42Å; I181-L211 HydrophobicContact CG1-CD1 4.17Å; I181-R212 PolarHBondContact N-O 3.07Å; I181-V213 CarbonylContact O-C 3.58Å; I181-V213 VanDerWaalsContact O-CA 3.26Å; I181-V213 WeakPolarHBondContact O-CA 3.24Å; I181-I214 PolarHBondContact O-N 3.43Å
182	M	97.9	Very high	92.4	Very high	0 Å²	0	23.9 Å²	23.9	0%	0	12%	0.123	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.5	114.9	172.7	179.9	176.9	176.3	0	0	109.4	L87 P88 M111 A112 V113 T114 D184 I214 S216	L87-M182 HydrophobicContact CB-SD 4.5Å; L87-M182 HydrophobicContact CD1-CE 4.13Å; P88-M182 HydrophobicContact CG-SD 4.13Å; M111-M182 HydrophobicContact CE-CB 3.75Å; M111-M182 HydrophobicContact CE-SD 4.27Å; A112-M182 PolarHBondContact O-N 2.98Å; V113-M182 WeakPolarHBondContact CA-O 3.2Å; V113-M182 HydrophobicContact CG1-CB 4.32Å; V113-M182 HydrophobicContact CG1-CG 4.27Å; V113-M182 HydrophobicContact CG1-SD 4.05Å; V113-M182 HydrophobicContact CG2-CB 4.29Å; V113-M182 HydrophobicContact CG2-SD 4.47Å; T114-M182 PolarHBondContact N-O 3.32Å; T114-M182 PolarHBondContact OG1-O 3.19Å; M182-D184 HydrophobicContact CE-CB 4.13Å; M182-I214 CarbonylContact C-O 3.52Å; M182-I214 WeakPolarHBondContact CA-O 3.36Å; M182-I214 HydrophobicContact CB-CB 4.14Å; M182-I214 HydrophobicContact CG-CB 4.09Å; M182-I214 HydrophobicContact CG-CG2 4.07Å; M182-S216 VanDerWaalsContact CE-CB 3.45Å
183	L	96.5	Very high	92.5	Very high	0 Å²	0	22.3 Å²	22.3	0%	0	12%	0.115	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.6	103.4	166.4	-55.7	-171.4	0	0	0	108.3	T114 I181 V186 L196 L197 I200 I214 I215 S216	T114-L183 HydrophobicContact CG2-CD2 3.87Å; T114-L183 WeakPolarHBondContact OG1-CA 3.22Å; T114-L183 WeakPolarHBondContact OG1-CD2 3.47Å; I181-L183 HydrophobicContact CG2-CD2 4.01Å; L183-V186 HydrophobicContact CB-CG1 3.68Å; L183-V186 WeakPolarHBondContact O-CG1 3.38Å; L183-L196 HydrophobicContact CD2-CD2 3.44Å; L183-L196 VanDerWaalsContact CD2-CD2 3.44Å; L183-L196 HydrophobicContact CD2-CG 4.06Å; L183-L197 HydrophobicContact CD1-CD2 3.6Å; L183-L197 HydrophobicContact CD1-CG 4.12Å; L183-I200 HydrophobicContact CD1-CD1 4.18Å; L183-I200 HydrophobicContact CD2-CD1 3.88Å; L183-I200 HydrophobicContact CG-CD1 4.27Å; L183-I214 PolarHBondContact N-O 3.33Å; L183-I215 HydrophobicContact CB-CD1 3.89Å; L183-I215 HydrophobicContact CD1-CD1 3.73Å; L183-I215 HydrophobicContact CG-CD1 3.99Å; L183-S216 PolarHBondContact O-N 2.89Å
184	D	93.9	Very high	92.6	Very high	0 Å²	0	18.2 Å²	18.2	0%	0	9%	0.089	C	C	.	.			trans	-95.4	157.3	-178.2	-158.9	18	0	0	0	112.5	S84 V113 T114 Q115 M182 V186 S216	S84-D184 WeakPolarHBondContact CB-OD2 3.3Å; S84-D184 PolarHBondContact OG-OD2 3.43Å; V113-D184 HydrophobicContact CG1-CB 4.41Å; T114-D184 VanDerWaalsContact O-CB 3.3Å; T114-D184 WeakPolarHBondContact O-CB 3.37Å; T114-D184 PolarHBondContact O-N 3.35Å; Q115-D184 PolarHBondContact NE2-OD2 2.98Å; M182-D184 HydrophobicContact CE-CB 4.13Å; D184-V186 PolarHBondContact O-N 3.44Å; D184-V186 VanDerWaalsContact O-N 3.13Å; D184-S216 WeakPolarHBondContact OD1-CB 3.45Å; D184-S216 PolarHBondContact OD1-OG 2.84Å
185	E	90	Very high	92.6	Very high	8 Å²	8	14.6 Å²	14.6	4%	0.037	7%	0.07	C	C	.	.	S	Bend	trans	51.7	33.1	179.3	-55.4	-81.4	106.7	0	0	113.9	P116 H187 E188 S216 S379	P116-E185 HydrophobicContact CG-CB 4.06Å; E185-H187 VanDerWaalsContact CD-CE1 3.5Å; E185-H187 PolarHBondContact O-N 2.93Å; E185-H187 IonicContact OE1-CE1 2.73Å; E185-H187 IonicContact OE2-CE1 3.82Å; E185-H187 IonicContact OE2-NE2 3.86Å; E185-E188 PolarHBondContact O-N 3.44Å; E185-S216 PolarHBondContact N-O 3.32Å; E185-S216 VanDerWaalsContact N-O 3.11Å; E185-S379 PolarHBondContact OE2-N 3.32Å; E185-S379 PolarHBondContact OE2-OG 2.98Å
186	V	91.7	Very high	92.7	Very high	0 Å²	0	14.6 Å²	14.6	0%	0	7%	0.069	C	C	.	.	G	3₁₀ helix	trans	-60.8	-14.8	-174.5	-63	0	0	0	0	114.5	L183 D184 E188 R189 T193 I215 S216 F225	L183-V186 HydrophobicContact CB-CG1 3.68Å; L183-V186 WeakPolarHBondContact O-CG1 3.38Å; D184-V186 PolarHBondContact O-N 3.44Å; D184-V186 VanDerWaalsContact O-N 3.13Å; V186-E188 PolarHBondContact O-N 3.24Å; V186-R189 VanDerWaalsContact O-CD 3.23Å; V186-R189 WeakPolarHBondContact O-CD 3.5Å; V186-R189 PolarHBondContact O-N 3.46Å; V186-R189 VanDerWaalsContact O-N 3.13Å; V186-T193 HydrophobicContact CB-CG2 4.21Å; V186-T193 HydrophobicContact CG1-CG2 4.21Å; V186-I215 HydrophobicContact CB-CG2 4.38Å; V186-I215 HydrophobicContact CG1-CG2 4.07Å; V186-I215 HydrophobicContact CG2-CG2 3.57Å; V186-S216 PolarHBondContact N-O 2.84Å; V186-F225 HydrophobicContact CB-CE1 4.1Å; V186-F225 HydrophobicContact CB-CZ 3.96Å; V186-F225 HydrophobicContact CG2-CD1 4.5Å; V186-F225 HydrophobicContact CG2-CE1 3.8Å; V186-F225 HydrophobicContact CG2-CE2 3.84Å; V186-F225 HydrophobicContact CG2-CZ 3.43Å; V186-F225 VanDerWaalsContact CG2-CZ 3.43Å
187	H	87.4	Confident	92.9	Very high	21 Å²	21	12 Å²	12	10%	0.097	5%	0.054	C	C	.	.	G	3₁₀ helix	trans	-68.9	-13	174	59.6	-95.4	0	0	0	113.6	E185 R189 A218 T219 Q420	E185-H187 VanDerWaalsContact CD-CE1 3.5Å; E185-H187 PolarHBondContact O-N 2.93Å; E185-H187 IonicContact OE1-CE1 2.73Å; E185-H187 IonicContact OE2-CE1 3.82Å; E185-H187 IonicContact OE2-NE2 3.86Å; H187-R189 PolarHBondContact O-N 3.38Å; H187-A218 VanDerWaalsContact CE1-CB 3.46Å; H187-A218 WeakPolarHBondContact CE1-CB 3.44Å; H187-A218 PolarHBondContact ND1-N 2.99Å; H187-A218 VanDerWaalsContact ND1-N 3.15Å; H187-T219 HydrophobicContact CB-CG2 4.11Å; H187-Q420 PolarHBondContact CD2-NE2 3.08Å; H187-Q420 PolarHBondContact NE2-NE2 3.06Å
188	E	84.8	Confident	93.2	Very high	56 Å²	56	11.1 Å²	11.1	26%	0.262	5%	0.05	S	C	.	.	G	3₁₀ helix	trans	-67.4	-22.6	169	-72.1	-160.6	-158.7	0	0	112.3	P116 R117 E185 V186 S190 A378 S379	P116-E188 HydrophobicContact CG-CG 4.42Å; P116-E188 WeakPolarHBondContact CG-OE1 3.48Å; R117-E188 IonicContact CZ-OE1 3.59Å; R117-E188 IonicContact CZ-OE2 3.82Å; R117-E188 IonicContact NH1-OE1 3.22Å; R117-E188 PolarHBondContact NH1-OE1 2.93Å; R117-E188 IonicContact NH1-OE2 3.88Å; R117-E188 IonicContact NH2-OE1 2.78Å; R117-E188 PolarHBondContact NH2-OE1 3.24Å; R117-E188 IonicContact NH2-OE2 4Å; R117-E188 PolarHBondContact NH2-OE2 3.21Å; E185-E188 PolarHBondContact O-N 3.44Å; V186-E188 PolarHBondContact O-N 3.24Å; E188-S190 PolarHBondContact O-N 3.47Å; E188-A378 HydrophobicContact CG-CB 4.2Å; E188-A378 WeakPolarHBondContact OE1-CB 3.24Å; E188-S379 PolarHBondContact OE1-OG 2.95Å
189	R	91	Very high	93.2	Very high	7 Å²	7	11.7 Å²	11.7	3%	0.026	5%	0.053	C	C	.	.			trans	49.3	46.4	176.6	-62.6	-60.4	-56.3	-77.6	-4.9	112.9	V186 H187 D194 P452 E453 D481	V186-R189 VanDerWaalsContact O-CD 3.23Å; V186-R189 WeakPolarHBondContact O-CD 3.5Å; V186-R189 PolarHBondContact O-N 3.46Å; V186-R189 VanDerWaalsContact O-N 3.13Å; H187-R189 PolarHBondContact O-N 3.38Å; R189-D194 IonicContact CZ-OD1 3.46Å; R189-D194 IonicContact CZ-OD2 2.86Å; R189-D194 IonicContact NE-OD1 2.73Å; R189-D194 PolarHBondContact NE-OD1 2.87Å; R189-D194 IonicContact NE-OD2 3.73Å; R189-D194 IonicContact NH2-OD1 3.48Å; R189-D194 PolarHBondContact NH2-OD1 3.2Å; R189-D194 IonicContact NH2-OD2 2.75Å; R189-D194 PolarHBondContact NH2-OD2 2.83Å; R189-P452 HydrophobicContact CB-CB 3.68Å; R189-P452 HydrophobicContact CG-CB 4.32Å; R189-E453 PolarHBondContact O-N 3.22Å; R189-D481 IonicContact CZ-OD2 3.34Å; R189-D481 IonicContact NH1-OD2 2.74Å; R189-D481 PolarHBondContact NH1-OD2 2.78Å; R189-D481 IonicContact NH2-OD2 2.92Å; R189-D481 PolarHBondContact NH2-OD2 3.39Å
190	S	91.2	Very high	93.4	Very high	13 Å²	13	8 Å²	8	9%	0.091	4%	0.039	C	C	.	.			trans	-65.3	155.6	173.1	80.4	0	0	0	0	110.5	E162 E188 Q192 T193 D194 E453	E162-S190 PolarHBondContact OE1-OG 3.33Å; E162-S190 PolarHBondContact OE2-OG 3Å; E188-S190 PolarHBondContact O-N 3.47Å; S190-Q192 PolarHBondContact O-N 2.9Å; S190-Q192 PolarHBondContact OG-N 2.78Å; S190-T193 PolarHBondContact O-N 2.9Å; S190-T193 WeakPolarHBondContact OG-CB 3.49Å; S190-T193 PolarHBondContact OG-N 3.45Å; S190-D194 PolarHBondContact O-N 3.28Å; S190-D194 VanDerWaalsContact O-N 3.08Å; S190-E453 WeakPolarHBondContact CA-OE2 3.36Å
191	L	92.3	Very high	93.3	Very high	15 Å²	15	8.2 Å²	8.2	8%	0.079	4%	0.04	C	C	.	.	H	α-helix	trans	-61	-35.5	176.9	-179.7	59.6	0	0	0	111.6	I195 E453 V457 L459 A462 W479	L191-I195 HydrophobicContact CD1-CD1 4.27Å; L191-I195 HydrophobicContact CG-CD1 4.06Å; L191-I195 WeakPolarHBondContact O-CD1 3.32Å; L191-I195 VanDerWaalsContact O-CG1 3.24Å; L191-I195 WeakPolarHBondContact O-CG1 3.33Å; L191-I195 PolarHBondContact O-N 2.96Å; L191-I195 VanDerWaalsContact O-N 3.1Å; L191-E453 HydrophobicContact CB-CB 4Å; L191-E453 PolarHBondContact N-OE2 2.79Å; L191-V457 HydrophobicContact CD2-CG2 3.81Å; L191-L459 HydrophobicContact CD1-CD2 3.73Å; L191-L459 HydrophobicContact CD2-CD2 4.37Å; L191-A462 HydrophobicContact CD1-CB 4.12Å; L191-A462 HydrophobicContact CD2-CB 3.81Å; L191-A462 HydrophobicContact CG-CB 4.1Å; L191-W479 HydrophobicContact CD1-CH2 4.12Å; L191-W479 HydrophobicContact CD1-CZ3 4.09Å
192	Q	92.8	Very high	93	Very high	36 Å²	36	12.3 Å²	12.3	17%	0.168	6%	0.058	C	C	.	.	H	α-helix	trans	-69.4	-40.8	178.7	-54.1	-57.7	-38.6	0	0	111.7	E162 I166 S190 I195 L196 R465	E162-Q192 HydrophobicContact CB-CB 3.71Å; I166-Q192 HydrophobicContact CD1-CB 3.99Å; S190-Q192 PolarHBondContact O-N 2.9Å; S190-Q192 PolarHBondContact OG-N 2.78Å; Q192-I195 PolarHBondContact O-N 3.19Å; Q192-L196 WeakPolarHBondContact O-CB 3.5Å; Q192-L196 PolarHBondContact O-N 3.06Å; Q192-R465 VanDerWaalsContact CD-NH1 3.28Å
193	T	93.6	Very high	92.8	Very high	0 Å²	0	12.7 Å²	12.7	0%	0	6%	0.06	C	C	.	.	H	α-helix	trans	-62	-45.8	175.2	-94.4	0	0	0	0	111.2	E162 V186 S190 I195 L196 L197	E162-T193 PolarHBondContact OE1-OG1 3.21Å; V186-T193 HydrophobicContact CB-CG2 4.21Å; V186-T193 HydrophobicContact CG1-CG2 4.21Å; S190-T193 PolarHBondContact O-N 2.9Å; S190-T193 WeakPolarHBondContact OG-CB 3.49Å; S190-T193 PolarHBondContact OG-N 3.45Å; T193-I195 VanDerWaalsContact C-N 3.34Å; T193-I195 PolarHBondContact O-N 3.3Å; T193-L196 PolarHBondContact O-N 3.07Å; T193-L196 VanDerWaalsContact O-N 3.16Å; T193-L197 HydrophobicContact CG2-CD1 3.96Å; T193-L197 HydrophobicContact CG2-CG 4.39Å; T193-L197 VanDerWaalsContact O-CG 3.3Å; T193-L197 WeakPolarHBondContact O-CG 3.49Å; T193-L197 PolarHBondContact O-N 2.63Å
194	D	93.7	Very high	92.7	Very high	0 Å²	0	12.8 Å²	12.8	0%	0	6%	0.061	C	C	.	.	H	α-helix	trans	-62.4	-40.8	179.6	-83.5	14.3	0	0	0	111.7	R189 S190 G198 S454 W479	R189-D194 IonicContact CZ-OD1 3.46Å; R189-D194 IonicContact CZ-OD2 2.86Å; R189-D194 IonicContact NE-OD1 2.73Å; R189-D194 PolarHBondContact NE-OD1 2.87Å; R189-D194 IonicContact NE-OD2 3.73Å; R189-D194 IonicContact NH2-OD1 3.48Å; R189-D194 PolarHBondContact NH2-OD1 3.2Å; R189-D194 IonicContact NH2-OD2 2.75Å; R189-D194 PolarHBondContact NH2-OD2 2.83Å; S190-D194 PolarHBondContact O-N 3.28Å; S190-D194 VanDerWaalsContact O-N 3.08Å; D194-G198 PolarHBondContact O-N 3.14Å; D194-S454 PolarHBondContact OD2-OG 3.36Å; D194-W479 HydrophobicContact CB-CE3 4.12Å; D194-W479 HydrophobicContact CB-CZ3 4.1Å
195	I	94.1	Very high	92.5	Very high	1 Å²	1	16.9 Å²	16.9	1%	0.005	8%	0.076	C	C	.	.	H	α-helix	trans	-62.5	-47.9	172.4	-69.6	165.2	0	0	0	110.8	I166 L191 Q192 T193 L197 G198 L199 A462 L466 W479	I166-I195 HydrophobicContact CD1-CB 4.43Å; I166-I195 HydrophobicContact CD1-CG2 4.1Å; L191-I195 HydrophobicContact CD1-CD1 4.27Å; L191-I195 HydrophobicContact CG-CD1 4.06Å; L191-I195 WeakPolarHBondContact O-CD1 3.32Å; L191-I195 VanDerWaalsContact O-CG1 3.24Å; L191-I195 WeakPolarHBondContact O-CG1 3.33Å; L191-I195 PolarHBondContact O-N 2.96Å; L191-I195 VanDerWaalsContact O-N 3.1Å; Q192-I195 PolarHBondContact O-N 3.19Å; T193-I195 VanDerWaalsContact C-N 3.34Å; T193-I195 PolarHBondContact O-N 3.3Å; I195-L197 VanDerWaalsContact C-N 3.31Å; I195-L197 PolarHBondContact O-N 3.07Å; I195-G198 PolarHBondContact O-N 2.71Å; I195-L199 HydrophobicContact CG2-CD1 3.56Å; I195-L199 HydrophobicContact CG2-CG 4.18Å; I195-L199 WeakPolarHBondContact O-CG 3.47Å; I195-L199 PolarHBondContact O-N 2.89Å; I195-A462 HydrophobicContact CD1-CB 3.45Å; I195-A462 VanDerWaalsContact CD1-CB 3.45Å; I195-A462 HydrophobicContact CG1-CB 4.42Å; I195-L466 HydrophobicContact CG2-CD2 3.96Å; I195-W479 HydrophobicContact CG1-CH2 3.71Å; I195-W479 HydrophobicContact CG1-CZ3 3.82Å
196	L	95.3	Very high	92.6	Very high	0 Å²	0	24.3 Å²	24.3	0%	0	11%	0.108	C	C	.	.	H	α-helix	trans	-63.8	-36.5	-176.4	-174	60.5	0	0	0	111.7	T114 M165 I166 L169 L183 Q192 T193 L199 I200	T114-L196 HydrophobicContact CG2-CD2 4.03Å; M165-L196 HydrophobicContact CB-CD1 4.35Å; M165-L196 HydrophobicContact CB-CD2 4.06Å; M165-L196 HydrophobicContact CG-CD1 3.77Å; M165-L196 HydrophobicContact CG-CD2 3.89Å; M165-L196 HydrophobicContact CG-CG 4.5Å; I166-L196 HydrophobicContact CG1-CD1 4.28Å; L169-L196 HydrophobicContact CD1-CD1 3.77Å; L183-L196 HydrophobicContact CD2-CD2 3.44Å; L183-L196 VanDerWaalsContact CD2-CD2 3.44Å; L183-L196 HydrophobicContact CD2-CG 4.06Å; Q192-L196 WeakPolarHBondContact O-CB 3.5Å; Q192-L196 PolarHBondContact O-N 3.06Å; T193-L196 PolarHBondContact O-N 3.07Å; T193-L196 VanDerWaalsContact O-N 3.16Å; L196-L199 PolarHBondContact O-N 3.08Å; L196-I200 HydrophobicContact CD1-CD1 3.98Å; L196-I200 HydrophobicContact CD1-CG1 3.92Å; L196-I200 HydrophobicContact CG-CD1 3.93Å; L196-I200 HydrophobicContact CG-CG1 4.19Å; L196-I200 VanDerWaalsContact O-CB 3.3Å; L196-I200 WeakPolarHBondContact O-CB 3.34Å; L196-I200 WeakPolarHBondContact O-CG1 3.5Å; L196-I200 PolarHBondContact O-N 3.13Å
197	L	95.4	Very high	92.6	Very high	0 Å²	0	25.1 Å²	25.1	0%	0	11%	0.111	C	C	.	.	H	α-helix	trans	-58.4	-47	173.3	-74.7	167.3	0	0	0	111.7	L183 T193 I195 K201 I215 F225 Y228 F229 L480	L183-L197 HydrophobicContact CD1-CD2 3.6Å; L183-L197 HydrophobicContact CD1-CG 4.12Å; T193-L197 HydrophobicContact CG2-CD1 3.96Å; T193-L197 HydrophobicContact CG2-CG 4.39Å; T193-L197 VanDerWaalsContact O-CG 3.3Å; T193-L197 WeakPolarHBondContact O-CG 3.49Å; T193-L197 PolarHBondContact O-N 2.63Å; I195-L197 VanDerWaalsContact C-N 3.31Å; I195-L197 PolarHBondContact O-N 3.07Å; L197-K201 WeakPolarHBondContact O-CB 3.48Å; L197-K201 PolarHBondContact O-N 3.1Å; L197-I215 HydrophobicContact CD2-CD1 3.87Å; L197-F225 HydrophobicContact CD1-CD1 4.48Å; L197-F225 HydrophobicContact CD1-CE1 3.99Å; L197-Y228 HydrophobicContact CB-CE1 4.43Å; L197-F229 HydrophobicContact CD2-CE2 3.87Å; L197-F229 HydrophobicContact CD2-CZ 3.75Å; L197-L480 HydrophobicContact CD1-CD2 4.13Å
198	G	94.6	Very high	92.5	Very high	0 Å²	0	24.5 Å²	24.5	0%	0	11%	0.109	C	C	.	.	H	α-helix	trans	-64.9	-40.4	177	0	0	0	0	0	113.1	D194 I195 K202 D478	D194-G198 PolarHBondContact O-N 3.14Å; I195-G198 PolarHBondContact O-N 2.71Å; G198-K202 PolarHBondContact O-N 3.13Å; G198-D478 VanDerWaalsContact CA-O 3.29Å; G198-D478 WeakPolarHBondContact CA-O 3.34Å
199	L	95.2	Very high	92.4	Very high	11 Å²	11	23.8 Å²	23.8	6%	0.058	11%	0.107	C	C	.	.	H	α-helix	trans	-68.8	-48.6	177.7	-66.1	171.5	0	0	0	111.9	L169 I195 L196 K201 K202 V203 L466 L469 I471 F477	L169-L199 HydrophobicContact CD1-CB 3.89Å; L169-L199 HydrophobicContact CD1-CD1 3.82Å; L169-L199 HydrophobicContact CD1-CG 4.47Å; I195-L199 HydrophobicContact CG2-CD1 3.56Å; I195-L199 HydrophobicContact CG2-CG 4.18Å; I195-L199 WeakPolarHBondContact O-CG 3.47Å; I195-L199 PolarHBondContact O-N 2.89Å; L196-L199 PolarHBondContact O-N 3.08Å; L199-K201 VanDerWaalsContact C-N 3.28Å; L199-K201 PolarHBondContact O-N 3.39Å; L199-K202 WeakPolarHBondContact O-CA 3.43Å; L199-K202 WeakPolarHBondContact O-CB 3.37Å; L199-K202 PolarHBondContact O-N 3.34Å; L199-V203 PolarHBondContact O-N 2.85Å; L199-L466 HydrophobicContact CD2-CD2 4.22Å; L199-L469 HydrophobicContact CD1-CD1 3.53Å; L199-L469 HydrophobicContact CD2-CD1 4.06Å; L199-L469 HydrophobicContact CG-CD1 4.47Å; L199-I471 HydrophobicContact CD2-CD1 4.42Å; L199-I471 HydrophobicContact CD2-CG1 4.22Å; L199-F477 HydrophobicContact CD2-CE2 4.09Å; L199-F477 HydrophobicContact CD2-CZ 4.43Å; L199-F477 HydrophobicContact CG-CE2 4.38Å; L199-F477 HydrophobicContact CG-CZ 4.23Å
200	I	95.3	Very high	92.3	Very high	1 Å²	1	25.7 Å²	25.7	1%	0.005	12%	0.117	C	C	.	.	H	α-helix	trans	-61.4	-38	178.7	-75.7	-171.3	0	0	0	111.2	I181 L183 L196 K202 V203 L204 V213	I181-I200 HydrophobicContact CD1-CD1 4.18Å; I181-I200 HydrophobicContact CG2-CD1 3.8Å; L183-I200 HydrophobicContact CD1-CD1 4.18Å; L183-I200 HydrophobicContact CD2-CD1 3.88Å; L183-I200 HydrophobicContact CG-CD1 4.27Å; L196-I200 HydrophobicContact CD1-CD1 3.98Å; L196-I200 HydrophobicContact CD1-CG1 3.92Å; L196-I200 HydrophobicContact CG-CD1 3.93Å; L196-I200 HydrophobicContact CG-CG1 4.19Å; L196-I200 VanDerWaalsContact O-CB 3.3Å; L196-I200 WeakPolarHBondContact O-CB 3.34Å; L196-I200 WeakPolarHBondContact O-CG1 3.5Å; L196-I200 PolarHBondContact O-N 3.13Å; I200-K202 PolarHBondContact O-N 3.1Å; I200-V203 PolarHBondContact O-N 3.16Å; I200-V203 VanDerWaalsContact O-N 3.1Å; I200-L204 HydrophobicContact CG2-CD1 4.06Å; I200-L204 HydrophobicContact CG2-CG 4.21Å; I200-L204 WeakPolarHBondContact O-CB 3.37Å; I200-L204 WeakPolarHBondContact O-CG 3.47Å; I200-L204 PolarHBondContact O-N 3.22Å; I200-V213 HydrophobicContact CG2-CG1 4.3Å; I200-V213 HydrophobicContact CG2-CG2 3.54Å
201	K	93.8	Very high	92.3	Very high	4 Å²	4	25 Å²	25	2%	0.017	11%	0.113	C	C	.	.	H	α-helix	trans	-61.3	-32.1	174.3	-167.5	172.3	171.9	-164	0	112.3	L197 L199 R205 Y228 F229 M232 D478	L197-K201 WeakPolarHBondContact O-CB 3.48Å; L197-K201 PolarHBondContact O-N 3.1Å; L199-K201 VanDerWaalsContact C-N 3.28Å; L199-K201 PolarHBondContact O-N 3.39Å; K201-R205 WeakPolarHBondContact O-CG 3.41Å; K201-R205 PolarHBondContact O-N 2.96Å; K201-Y228 HydrophobicContact CD-CD1 4.29Å; K201-Y228 HydrophobicContact CD-CE1 3.54Å; K201-Y228 HydrophobicContact CD-CE2 4.26Å; K201-Y228 WeakPolarHBondContact CD-OH 3.24Å; K201-Y228 WeakPolarHBondContact CE-O 3.5Å; K201-Y228 PolarHBondContact NZ-O 2.64Å; K201-F229 HydrophobicContact CB-CE1 4.1Å; K201-F229 HydrophobicContact CD-CD1 4.3Å; K201-F229 HydrophobicContact CD-CE1 4.28Å; K201-F229 HydrophobicContact CG-CD1 4.35Å; K201-F229 HydrophobicContact CG-CE1 4.22Å; K201-M232 HydrophobicContact CG-SD 4.48Å; K201-D478 VanDerWaalsContact CD-OD2 3.25Å; K201-D478 WeakPolarHBondContact CD-OD2 3.33Å; K201-D478 WeakPolarHBondContact CE-OD2 3.29Å; K201-D478 IonicContact NZ-OD1 2.94Å; K201-D478 PolarHBondContact NZ-OD1 2.88Å; K201-D478 IonicContact NZ-OD2 3.04Å; K201-D478 PolarHBondContact NZ-OD2 3.3Å
202	K	92.6	Very high	92.4	Very high	86 Å²	86	24.9 Å²	24.9	37%	0.374	11%	0.112	S	C	.	.	H	α-helix	trans	-70.7	-43.2	170.7	-70.3	171.2	176.6	-85.8	0	111.9	G198 L199 I200 R205 K206 I471	G198-K202 PolarHBondContact O-N 3.13Å; L199-K202 WeakPolarHBondContact O-CA 3.43Å; L199-K202 WeakPolarHBondContact O-CB 3.37Å; L199-K202 PolarHBondContact O-N 3.34Å; I200-K202 PolarHBondContact O-N 3.1Å; K202-R205 PolarHBondContact O-N 3.41Å; K202-K206 PolarHBondContact O-N 3.43Å; K202-I471 HydrophobicContact CD-CD1 3.99Å
203	V	94.2	Very high	92.6	Very high	8 Å²	8	23.2 Å²	23.2	5%	0.048	10%	0.104	C	C	.	.	H	α-helix	trans	-61.8	-44	176.9	-178.9	0	0	0	0	111.2	L169 P173 L174 L175 L199 I200 R205 K206 R207 L211	L169-V203 HydrophobicContact CD2-CG2 3.95Å; P173-V203 WeakPolarHBondContact O-CG2 3.48Å; L174-V203 WeakPolarHBondContact O-CG1 3.42Å; L175-V203 HydrophobicContact CD1-CG2 4.45Å; L199-V203 PolarHBondContact O-N 2.85Å; I200-V203 PolarHBondContact O-N 3.16Å; I200-V203 VanDerWaalsContact O-N 3.1Å; V203-R205 PolarHBondContact O-N 3.31Å; V203-K206 CarbonylContact O-C 3.47Å; V203-K206 WeakPolarHBondContact O-CA 3.5Å; V203-K206 PolarHBondContact O-N 2.95Å; V203-R207 PolarHBondContact O-N 2.95Å; V203-L211 HydrophobicContact CG1-CD2 3.75Å
204	L	93.2	Very high	92.8	Very high	2 Å²	2	23.2 Å²	23.2	1%	0.01	10%	0.104	C	C	.	.	H	α-helix	trans	-56.9	-36.1	175.4	-78.1	170.9	0	0	0	112.5	R71 V72 I200 K206 R207 L211 V213 F229 M232	R71-L204 VanDerWaalsContact NH2-CD2 3.26Å; R71-L204 PolarHBondContact NH2-O 2.88Å; V72-L204 HydrophobicContact CG2-CD1 3.69Å; I200-L204 HydrophobicContact CG2-CD1 4.06Å; I200-L204 HydrophobicContact CG2-CG 4.21Å; I200-L204 WeakPolarHBondContact O-CB 3.37Å; I200-L204 WeakPolarHBondContact O-CG 3.47Å; I200-L204 PolarHBondContact O-N 3.22Å; L204-K206 VanDerWaalsContact C-N 3.27Å; L204-K206 PolarHBondContact O-N 3.07Å; L204-R207 CarbonylContact O-C 3.47Å; L204-R207 PolarHBondContact O-N 3.03Å; L204-L211 HydrophobicContact CD2-CB 4.34Å; L204-L211 HydrophobicContact CD2-CD2 4.01Å; L204-L211 HydrophobicContact CD2-CG 4.02Å; L204-L211 HydrophobicContact CG-CD2 4.41Å; L204-V213 HydrophobicContact CD1-CB 4.41Å; L204-V213 HydrophobicContact CD1-CG2 3.96Å; L204-V213 HydrophobicContact CD2-CG2 3.9Å; L204-V213 HydrophobicContact CG-CG2 4.11Å; L204-F229 HydrophobicContact CD1-CE1 4.41Å; L204-M232 HydrophobicContact CB-SD 3.8Å; L204-M232 HydrophobicContact CD1-SD 4.09Å
205	R	90.7	Very high	93	Very high	86 Å²	86	23.2 Å²	23.2	33%	0.325	10%	0.104	S	C	.	.	H	α-helix	trans	-68	-28.2	175.3	-68.2	173.2	-171.5	123.4	-7	112.5	K201 K202 V203 M232 D478	K201-R205 WeakPolarHBondContact O-CG 3.41Å; K201-R205 PolarHBondContact O-N 2.96Å; K202-R205 PolarHBondContact O-N 3.41Å; V203-R205 PolarHBondContact O-N 3.31Å; R205-M232 HydrophobicContact CG-CG 4.29Å; R205-D478 IonicContact CZ-OD2 3.75Å; R205-D478 IonicContact NH1-OD2 3.61Å; R205-D478 IonicContact NH2-OD2 2.91Å; R205-D478 PolarHBondContact NH2-OD2 3.34Å
206	K	91.8	Very high	93	Very high	163 Å²	163	23.2 Å²	23.2	71%	0.709	10%	0.104	S	C	*	.	H	α-helix	trans	-89.8	-18.2	178.3	-65.6	-63.2	-174	176.8	0	113.8	L174 K202 V203 L204 P208	L174-K206 HydrophobicContact CD2-CB 3.85Å; L174-K206 HydrophobicContact CD2-CG 4.45Å; K202-K206 PolarHBondContact O-N 3.43Å; V203-K206 CarbonylContact O-C 3.47Å; V203-K206 WeakPolarHBondContact O-CA 3.5Å; V203-K206 PolarHBondContact O-N 2.95Å; L204-K206 VanDerWaalsContact C-N 3.27Å; L204-K206 PolarHBondContact O-N 3.07Å; K206-P208 VanDerWaalsContact C-CD 3.44Å; K206-P208 WeakPolarHBondContact O-CD 3.47Å
207	R	91.4	Very high	92.7	Very high	17 Å²	17	23.2 Å²	23.2	6%	0.064	10%	0.104	C	C	.	.			trans	-121.2	65.3	177.8	-73.7	-175.7	65.9	-165	2	111.4	R71 L174 L175 F178 V203 L204 I209 D210 L211	R71-R207 PolarHBondContact NH1-O 3.39Å; R71-R207 PolarHBondContact NH2-O 3.49Å; L174-R207 WeakPolarHBondContact O-CD 3.47Å; L174-R207 PolarHBondContact O-NH1 3.48Å; L175-R207 VanDerWaalsContact C-NH1 3.29Å; L175-R207 PolarHBondContact O-NH1 3.12Å; F178-R207 PolarHBondContact O-NH1 3.05Å; F178-R207 PolarHBondContact O-NH2 3.27Å; V203-R207 PolarHBondContact O-N 2.95Å; L204-R207 CarbonylContact O-C 3.47Å; L204-R207 PolarHBondContact O-N 3.03Å; R207-I209 VanDerWaalsContact C-N 3.27Å; R207-I209 PolarHBondContact O-N 3.25Å; R207-D210 WeakPolarHBondContact CB-OD1 3.43Å; R207-D210 IonicContact CZ-OD2 2.65Å; R207-D210 IonicContact NE-OD1 3.12Å; R207-D210 PolarHBondContact NE-OD1 3.3Å; R207-D210 IonicContact NE-OD2 3.3Å; R207-D210 PolarHBondContact NE-OD2 2.55Å; R207-D210 IonicContact NH2-OD2 3.67Å; R207-D210 PolarHBondContact NH2-OD2 3.48Å; R207-L211 HydrophobicContact CB-CB 4.01Å
208	P	86.4	Confident	92	Very high	8 Å²	8	24 Å²	24	5%	0.052	11%	0.111	C	C	.	.	T	Hydrogen-bonded Turn	trans	-73.5	-9.8	-165.3	29.6	-35.7	0	0	0	115.3	R71 K206 P235 E238	R71-P208 VanDerWaalsContact CZ-C 3.43Å; R71-P208 VanDerWaalsContact CZ-O 3.23Å; R71-P208 PolarHBondContact NE-O 2.95Å; R71-P208 PolarHBondContact NH1-O 3.08Å; K206-P208 VanDerWaalsContact C-CD 3.44Å; K206-P208 WeakPolarHBondContact O-CD 3.47Å; P208-P235 HydrophobicContact CB-CG 4.21Å; P208-E238 HydrophobicContact CG-CB 4.34Å; P208-E238 WeakPolarHBondContact CG-OE2 3.39Å
209	I	82.6	Confident	91.1	Very high	42 Å²	42	24.9 Å²	24.9	22%	0.215	12%	0.116	C	C	.	.	T	Hydrogen-bonded Turn	trans	-114.7	-48.2	-175.3	-60.3	170.9	0	0	0	112.2	R207 R212 E238	R207-I209 VanDerWaalsContact C-N 3.27Å; R207-I209 PolarHBondContact O-N 3.25Å; I209-R212 PolarHBondContact O-NH1 2.99Å; I209-E238 HydrophobicContact CD1-CB 4.27Å
210	D	87.3	Confident	89.5	Confident	46 Å²	46	30.6 Å²	30.6	25%	0.246	15%	0.146	C	C	.	.	T	Hydrogen-bonded Turn	trans	-91.3	-39.5	-162.5	61.2	-37.9	0	0	0	114.5	R179 R207	R179-D210 VanDerWaalsContact CD-O 3.32Å; R179-D210 WeakPolarHBondContact CD-O 3.26Å; R179-D210 PolarHBondContact NE-O 2.97Å; R207-D210 WeakPolarHBondContact CB-OD1 3.43Å; R207-D210 IonicContact CZ-OD2 2.65Å; R207-D210 IonicContact NE-OD1 3.12Å; R207-D210 PolarHBondContact NE-OD1 3.3Å; R207-D210 IonicContact NE-OD2 3.3Å; R207-D210 PolarHBondContact NE-OD2 2.55Å; R207-D210 IonicContact NH2-OD2 3.67Å; R207-D210 PolarHBondContact NH2-OD2 3.48Å
211	L	92.6	Very high	88.5	Confident	0 Å²	0	31.5 Å²	31.5	0%	0	15%	0.15	C	C	.	.			trans	-75.8	136.9	-177.7	-176.1	60.6	0	0	0	112	R71 I181 V203 L204 R207	R71-L211 PolarHBondContact NH1-O 3.29Å; R71-L211 VanDerWaalsContact NH1-O 3.1Å; I181-L211 HydrophobicContact CD1-CD1 3.91Å; I181-L211 HydrophobicContact CD1-CD2 4.42Å; I181-L211 HydrophobicContact CG1-CD1 4.17Å; V203-L211 HydrophobicContact CG1-CD2 3.75Å; L204-L211 HydrophobicContact CD2-CB 4.34Å; L204-L211 HydrophobicContact CD2-CD2 4.01Å; L204-L211 HydrophobicContact CD2-CG 4.02Å; L204-L211 HydrophobicContact CG-CD2 4.41Å; R207-L211 HydrophobicContact CB-CB 4.01Å
212	R	94.5	Very high	87.9	Confident	12 Å²	12	31.6 Å²	31.6	5%	0.045	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	145.2	169.1	-64.1	-66.9	-178.3	-79.2	-1.1	110.8	L67 E68 S70 W96 R179 V180 I181 I209	L67-R212 HydrophobicContact CD1-CB 3.98Å; L67-R212 HydrophobicContact CD1-CG 4.36Å; L67-R212 VanDerWaalsContact O-CD 3.28Å; L67-R212 WeakPolarHBondContact O-CD 3.37Å; L67-R212 PolarHBondContact O-NE 2.86Å; L67-R212 VanDerWaalsContact O-NE 3.1Å; E68-R212 PolarHBondContact O-NH2 3.14Å; S70-R212 WeakPolarHBondContact O-CD 3.42Å; S70-R212 PolarHBondContact O-NE 3.32Å; W96-R212 HydrophobicContact CE3-CG 4.43Å; W96-R212 HydrophobicContact CH2-CG 3.91Å; W96-R212 HydrophobicContact CZ3-CG 3.58Å; R179-R212 PolarHBondContact O-N 2.78Å; V180-R212 WeakPolarHBondContact CA-O 3.35Å; V180-R212 HydrophobicContact CG1-CB 4.5Å; V180-R212 HydrophobicContact CG2-CB 4.32Å; I181-R212 PolarHBondContact N-O 3.07Å; I209-R212 PolarHBondContact O-NH1 2.99Å
213	V	97.2	Very high	87.6	Confident	1 Å²	1	34.9 Å²	34.9	1%	0.006	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	132.3	177.6	174.3	0	0	0	0	110.6	R71 V72 L73 I181 I200 L204 I215	R71-V213 PolarHBondContact O-N 3.23Å; R71-V213 VanDerWaalsContact O-N 3.08Å; V72-V213 CarbonylContact C-O 3.49Å; V72-V213 VanDerWaalsContact CA-O 3.3Å; V72-V213 WeakPolarHBondContact CA-O 3.21Å; V72-V213 HydrophobicContact CG1-CG1 4.46Å; V72-V213 HydrophobicContact CG2-CB 4.41Å; L73-V213 PolarHBondContact N-O 3.13Å; I181-V213 CarbonylContact O-C 3.58Å; I181-V213 VanDerWaalsContact O-CA 3.26Å; I181-V213 WeakPolarHBondContact O-CA 3.24Å; I200-V213 HydrophobicContact CG2-CG1 4.3Å; I200-V213 HydrophobicContact CG2-CG2 3.54Å; L204-V213 HydrophobicContact CD1-CB 4.41Å; L204-V213 HydrophobicContact CD1-CG2 3.96Å; L204-V213 HydrophobicContact CD2-CG2 3.9Å; L204-V213 HydrophobicContact CG-CG2 4.11Å; V213-I215 HydrophobicContact CG1-CD1 3.68Å; V213-I215 HydrophobicContact CG1-CG1 4.25Å
214	I	97.8	Very high	87.4	Confident	0 Å²	0	38.5 Å²	38.5	0%	0	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	127.6	173.4	-59	164.9	0	0	0	107.6	F63 L67 L73 V75 V91 M111 V180 I181 M182 L183	F63-I214 HydrophobicContact CE2-CD1 3.89Å; F63-I214 HydrophobicContact CE2-CG1 4.41Å; F63-I214 HydrophobicContact CZ-CD1 3.69Å; L67-I214 HydrophobicContact CD1-CD1 4.03Å; L67-I214 HydrophobicContact CD1-CG1 3.93Å; L73-I214 CarbonylContact O-C 3.59Å; L73-I214 WeakPolarHBondContact O-CA 3.19Å; V75-I214 HydrophobicContact CG2-CG2 3.98Å; V91-I214 HydrophobicContact CG2-CD1 4.27Å; M111-I214 HydrophobicContact CE-CD1 4.19Å; V180-I214 HydrophobicContact CG1-CD1 3.83Å; V180-I214 HydrophobicContact CG1-CG1 4.31Å; I181-I214 PolarHBondContact O-N 3.43Å; M182-I214 CarbonylContact C-O 3.52Å; M182-I214 WeakPolarHBondContact CA-O 3.36Å; M182-I214 HydrophobicContact CB-CB 4.14Å; M182-I214 HydrophobicContact CG-CB 4.09Å; M182-I214 HydrophobicContact CG-CG2 4.07Å; L183-I214 PolarHBondContact N-O 3.33Å
215	I	96.3	Very high	87.4	Confident	0 Å²	0	38.4 Å²	38.4	0%	0	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	108.2	174.8	-56.2	-59.2	0	0	0	107.5	V72 L73 V74 V75 L183 V186 L197 V213 F225 F229	V72-I215 HydrophobicContact CG1-CG1 3.79Å; L73-I215 PolarHBondContact O-N 3.13Å; V74-I215 CarbonylContact C-O 3.57Å; V74-I215 WeakPolarHBondContact CA-O 3.27Å; V74-I215 HydrophobicContact CG2-CB 4.24Å; V75-I215 PolarHBondContact N-O 3.24Å; L183-I215 HydrophobicContact CB-CD1 3.89Å; L183-I215 HydrophobicContact CD1-CD1 3.73Å; L183-I215 HydrophobicContact CG-CD1 3.99Å; V186-I215 HydrophobicContact CB-CG2 4.38Å; V186-I215 HydrophobicContact CG1-CG2 4.07Å; V186-I215 HydrophobicContact CG2-CG2 3.57Å; L197-I215 HydrophobicContact CD2-CD1 3.87Å; V213-I215 HydrophobicContact CG1-CD1 3.68Å; V213-I215 HydrophobicContact CG1-CG1 4.25Å; I215-F225 HydrophobicContact CG2-CB 4.44Å; I215-F225 HydrophobicContact CG2-CD1 4.03Å; I215-F225 HydrophobicContact CG2-CE1 4.46Å; I215-F225 HydrophobicContact CG2-CG 4.11Å; I215-F229 HydrophobicContact CD1-CE2 4.1Å; I215-F229 HydrophobicContact CD1-CZ 4.34Å; I215-F229 HydrophobicContact CG1-CE2 3.99Å
216	S	93.7	Very high	87.4	Confident	0 Å²	0	36.6 Å²	36.6	0%	0	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	125.2	-177.2	166.2	0	0	0	0	111.3	V75 K83 M182 L183 D184 E185 V186	V75-S216 WeakPolarHBondContact O-CA 3.48Å; K83-S216 WeakPolarHBondContact CE-OG 3.34Å; M182-S216 VanDerWaalsContact CE-CB 3.45Å; L183-S216 PolarHBondContact O-N 2.89Å; D184-S216 WeakPolarHBondContact OD1-CB 3.45Å; D184-S216 PolarHBondContact OD1-OG 2.84Å; E185-S216 PolarHBondContact N-O 3.32Å; E185-S216 VanDerWaalsContact N-O 3.11Å; V186-S216 PolarHBondContact N-O 2.84Å
217	S	89.4	Confident	87.5	Confident	0 Å²	0	34 Å²	34	0%	0	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.2	146.7	179.5	180	0	0	0	0	111.8	V75 T76 G77 T219	V75-S217 PolarHBondContact O-N 2.85Å; T76-S217 WeakPolarHBondContact CA-O 3.4Å; G77-S217 PolarHBondContact N-O 2.91Å; G77-S217 VanDerWaalsContact N-O 3.1Å; S217-T219 PolarHBondContact OG-N 3.48Å; S217-T219 VanDerWaalsContact OG-N 3.13Å; S217-T219 PolarHBondContact OG-O 2.95Å; S217-T219 PolarHBondContact OG-OG1 2.99Å
218	A	81.9	Confident	87.6	Confident	18 Å²	18	33.9 Å²	33.9	15%	0.149	17%	0.169	C	C	.	.	S	Bend	trans	-88	-12.1	172.5	0	0	0	0	0	113.6	G77 T79 H187	G77-A218 VanDerWaalsContact O-CA 3.3Å; G77-A218 WeakPolarHBondContact O-CA 3.46Å; T79-A218 HydrophobicContact CG2-CB 3.66Å; H187-A218 VanDerWaalsContact CE1-CB 3.46Å; H187-A218 WeakPolarHBondContact CE1-CB 3.44Å; H187-A218 PolarHBondContact ND1-N 2.99Å; H187-A218 VanDerWaalsContact ND1-N 3.15Å
219	T	74.4	Confident	88	Confident	18 Å²	18	33.5 Å²	33.5	11%	0.11	17%	0.167	C	C	.	.	S	Bend	trans	-117.4	163.9	-172.5	66.8	0	0	0	0	110.9	H187 S217 E221 A416	H187-T219 HydrophobicContact CB-CG2 4.11Å; S217-T219 PolarHBondContact OG-N 3.48Å; S217-T219 VanDerWaalsContact OG-N 3.13Å; S217-T219 PolarHBondContact OG-O 2.95Å; S217-T219 PolarHBondContact OG-OG1 2.99Å; T219-E221 PolarHBondContact O-N 2.9Å; T219-A416 HydrophobicContact CG2-CB 4.28Å
220	L	61.3	Low	88.4	Confident	130 Å²	130	34.4 Å²	34.4	68%	0.681	18%	0.176	S	C	*	.	S	Bend	trans	-78.1	12.3	-177.3	-68.2	166.7	0	0	0	114.3	A222	L220-A222 PolarHBondContact O-N 2.9Å
221	E	74.8	Confident	88.3	Confident	21 Å²	21	38.4 Å²	38.4	10%	0.098	19%	0.192	C	C	.	.	T	Hydrogen-bonded Turn	trans	-71	20.1	172.9	-71.8	-170.8	-121.2	0	0	113.7	T219 E223 K224 F225 F449	T219-E221 PolarHBondContact O-N 2.9Å; E221-E223 PolarHBondContact O-N 3.11Å; E221-E223 VanDerWaalsContact O-N 3.16Å; E221-K224 PolarHBondContact O-N 3.15Å; E221-F225 HydrophobicContact CB-CE2 4.39Å; E221-F225 VanDerWaalsContact O-CD2 3.23Å; E221-F225 WeakPolarHBondContact O-CD2 3.44Å; E221-F449 HydrophobicContact CG-CD1 3.86Å; E221-F449 HydrophobicContact CG-CD2 4.34Å; E221-F449 HydrophobicContact CG-CE1 3.48Å; E221-F449 VanDerWaalsContact CG-CE1 3.48Å; E221-F449 HydrophobicContact CG-CE2 4.01Å; E221-F449 HydrophobicContact CG-CG 4.27Å; E221-F449 HydrophobicContact CG-CZ 3.56Å; E221-F449 WeakPolarHBondContact OE1-CD1 3.31Å; E221-F449 WeakPolarHBondContact OE1-CE1 3.46Å; E221-F449 WeakPolarHBondContact OE1-CG 3.39Å
222	A	80.8	Confident	88	Confident	6 Å²	6	38.8 Å²	38.8	5%	0.05	19%	0.193	C	C	.	.	H	α-helix	trans	-52.8	-39.8	179.9	0	0	0	0	0	111.9	V74 T76 L220 K224 F225 I226	V74-A222 HydrophobicContact CG1-CB 4.09Å; T76-A222 HydrophobicContact CG2-CB 3.58Å; L220-A222 PolarHBondContact O-N 2.9Å; A222-K224 VanDerWaalsContact C-N 3.31Å; A222-K224 PolarHBondContact O-N 2.59Å; A222-F225 PolarHBondContact O-N 3.3Å; A222-F225 VanDerWaalsContact O-N 3.09Å; A222-I226 HydrophobicContact CB-CD1 4.01Å; A222-I226 WeakPolarHBondContact O-CD1 3.46Å; A222-I226 WeakPolarHBondContact O-CG1 3.47Å; A222-I226 PolarHBondContact O-N 3.23Å
223	E	87.5	Confident	87.1	Confident	154 Å²	154	47 Å²	47	72%	0.72	23%	0.229	S	C	*	.	H	α-helix	trans	-54.6	-43.3	-177.4	-67.9	174.7	-174.4	0	0	112.5	E221 F225 I226 E227	E221-E223 PolarHBondContact O-N 3.11Å; E221-E223 VanDerWaalsContact O-N 3.16Å; E223-F225 PolarHBondContact O-N 3.11Å; E223-I226 PolarHBondContact O-N 2.87Å; E223-E227 WeakPolarHBondContact O-CB 3.21Å; E223-E227 PolarHBondContact O-N 3.36Å
224	K	90.1	Very high	85.8	Confident	84 Å²	84	48.5 Å²	48.5	37%	0.365	24%	0.237	S	C	.	.	H	α-helix	trans	-62.7	-43.6	178.5	-75.3	-169.1	172.7	-167.8	0	112	E221 A222 Y228 D481	E221-K224 PolarHBondContact O-N 3.15Å; A222-K224 VanDerWaalsContact C-N 3.31Å; A222-K224 PolarHBondContact O-N 2.59Å; K224-Y228 WeakPolarHBondContact O-CB 3.12Å; K224-Y228 PolarHBondContact O-N 3.11Å; K224-D481 IonicContact NZ-OD1 3.81Å; K224-D481 IonicContact NZ-OD2 3.51Å
225	F	92.3	Very high	84.3	Confident	1 Å²	1	51 Å²	51	0%	0.004	25%	0.253	C	S	.	.	H	α-helix	trans	-68.2	-41.5	178.3	-61.8	-77.1	0	0	0	111.1	V74 V186 L197 I215 E221 A222 E223 Y228 F229 L480	V74-F225 HydrophobicContact CG2-CB 4.09Å; V186-F225 HydrophobicContact CB-CE1 4.1Å; V186-F225 HydrophobicContact CB-CZ 3.96Å; V186-F225 HydrophobicContact CG2-CD1 4.5Å; V186-F225 HydrophobicContact CG2-CE1 3.8Å; V186-F225 HydrophobicContact CG2-CE2 3.84Å; V186-F225 HydrophobicContact CG2-CZ 3.43Å; V186-F225 VanDerWaalsContact CG2-CZ 3.43Å; L197-F225 HydrophobicContact CD1-CD1 4.48Å; L197-F225 HydrophobicContact CD1-CE1 3.99Å; I215-F225 HydrophobicContact CG2-CB 4.44Å; I215-F225 HydrophobicContact CG2-CD1 4.03Å; I215-F225 HydrophobicContact CG2-CE1 4.46Å; I215-F225 HydrophobicContact CG2-CG 4.11Å; E221-F225 HydrophobicContact CB-CE2 4.39Å; E221-F225 VanDerWaalsContact O-CD2 3.23Å; E221-F225 WeakPolarHBondContact O-CD2 3.44Å; A222-F225 PolarHBondContact O-N 3.3Å; A222-F225 VanDerWaalsContact O-N 3.09Å; E223-F225 PolarHBondContact O-N 3.11Å; F225-Y228 PolarHBondContact O-N 3.45Å; F225-F229 VanDerWaalsContact O-CD2 3.26Å; F225-F229 WeakPolarHBondContact O-CD2 3.29Å; F225-F229 PolarHBondContact O-N 2.84Å; F225-L480 HydrophobicContact CD1-CD2 3.88Å; F225-L480 HydrophobicContact CE1-CD2 3.46Å; F225-L480 VanDerWaalsContact CE1-CD2 3.46Å; F225-L480 HydrophobicContact CZ-CD2 4.05Å
226	I	92.1	Very high	82.7	Confident	47 Å²	47	57.3 Å²	57.3	24%	0.241	28%	0.283	C	S	.	.	H	α-helix	trans	-60	-51.6	175.7	-65.4	161.5	0	0	0	109.6	V74 A222 E223 Y228 F229 S230 V249 H251	V74-I226 HydrophobicContact CB-CG1 4.33Å; V74-I226 HydrophobicContact CG2-CG1 4.04Å; A222-I226 HydrophobicContact CB-CD1 4.01Å; A222-I226 WeakPolarHBondContact O-CD1 3.46Å; A222-I226 WeakPolarHBondContact O-CG1 3.47Å; A222-I226 PolarHBondContact O-N 3.23Å; E223-I226 PolarHBondContact O-N 2.87Å; I226-Y228 VanDerWaalsContact C-N 3.33Å; I226-Y228 PolarHBondContact O-N 3.03Å; I226-F229 PolarHBondContact O-N 3.24Å; I226-S230 WeakPolarHBondContact O-CB 3.48Å; I226-S230 PolarHBondContact O-N 2.8Å; I226-S230 PolarHBondContact O-OG 3.35Å; I226-V249 HydrophobicContact CG1-CG2 4.45Å; I226-V249 HydrophobicContact CG2-CG1 4.04Å; I226-H251 HydrophobicContact CD1-CB 3.67Å; I226-H251 HydrophobicContact CG1-CB 4.34Å
227	E	93.1	Very high	81	Confident	108 Å²	108	62.1 Å²	62.1	51%	0.505	31%	0.312	S	S	.	.	H	α-helix	trans	-58.4	-46.7	178.4	-168.2	-165.6	153.8	0	0	111	E223 F229 S230 K231	E223-E227 WeakPolarHBondContact O-CB 3.21Å; E223-E227 PolarHBondContact O-N 3.36Å; E227-F229 PolarHBondContact O-N 3.46Å; E227-S230 WeakPolarHBondContact CA-OG 3.41Å; E227-S230 PolarHBondContact O-N 2.92Å; E227-S230 PolarHBondContact O-OG 3.03Å; E227-K231 PolarHBondContact O-N 3.2Å; E227-K231 WeakPolarHBondContact OE1-CE 3.22Å; E227-K231 IonicContact OE1-NZ 2.68Å; E227-K231 PolarHBondContact OE1-NZ 3Å
228	Y	93.7	Very high	79.4	Confident	15 Å²	15	66.8 Å²	66.8	6%	0.059	33%	0.334	C	S	.	.	H	α-helix	trans	-60.1	-42.7	-179	177.4	-105.5	0	0	0	113.4	L197 K201 K224 F225 I226 D478 W479 L480	L197-Y228 HydrophobicContact CB-CE1 4.43Å; K201-Y228 HydrophobicContact CD-CD1 4.29Å; K201-Y228 HydrophobicContact CD-CE1 3.54Å; K201-Y228 HydrophobicContact CD-CE2 4.26Å; K201-Y228 WeakPolarHBondContact CD-OH 3.24Å; K201-Y228 WeakPolarHBondContact CE-O 3.5Å; K201-Y228 PolarHBondContact NZ-O 2.64Å; K224-Y228 WeakPolarHBondContact O-CB 3.12Å; K224-Y228 PolarHBondContact O-N 3.11Å; F225-Y228 PolarHBondContact O-N 3.45Å; I226-Y228 VanDerWaalsContact C-N 3.33Å; I226-Y228 PolarHBondContact O-N 3.03Å; Y228-D478 VanDerWaalsContact CE2-OD1 3.29Å; Y228-D478 WeakPolarHBondContact CE2-OD1 3.34Å; Y228-D478 PolarHBondContact OH-O 3.06Å; Y228-D478 PolarHBondContact OH-OD1 3.48Å; Y228-W479 WeakPolarHBondContact CE2-O 3.15Å; Y228-L480 VanDerWaalsContact CB-CD1 3.47Å; Y228-L480 HydrophobicContact CD1-CD1 4.19Å; Y228-L480 HydrophobicContact CD2-CD1 3.88Å; Y228-L480 HydrophobicContact CG-CD1 3.58Å
229	F	93.6	Very high	78.3	Confident	1 Å²	1	66.5 Å²	66.5	0%	0.004	33%	0.33	C	S	.	.	H	α-helix	trans	-84.8	-22.9	178.6	-74.4	-70.7	0	0	0	113.6	V72 L197 K201 L204 I215 F225 I226 E227 K231 M232 V249	V72-F229 HydrophobicContact CB-CB 4.45Å; V72-F229 HydrophobicContact CB-CG 4.36Å; V72-F229 HydrophobicContact CG1-CB 4.47Å; V72-F229 HydrophobicContact CG1-CD1 4.45Å; V72-F229 HydrophobicContact CG1-CD2 3.94Å; V72-F229 HydrophobicContact CG1-CE2 4.28Å; V72-F229 HydrophobicContact CG1-CG 4.05Å; V72-F229 HydrophobicContact CG2-CB 4.35Å; V72-F229 HydrophobicContact CG2-CD1 3.79Å; V72-F229 HydrophobicContact CG2-CE1 4.25Å; V72-F229 HydrophobicContact CG2-CG 4.05Å; L197-F229 HydrophobicContact CD2-CE2 3.87Å; L197-F229 HydrophobicContact CD2-CZ 3.75Å; K201-F229 HydrophobicContact CB-CE1 4.1Å; K201-F229 HydrophobicContact CD-CD1 4.3Å; K201-F229 HydrophobicContact CD-CE1 4.28Å; K201-F229 HydrophobicContact CG-CD1 4.35Å; K201-F229 HydrophobicContact CG-CE1 4.22Å; L204-F229 HydrophobicContact CD1-CE1 4.41Å; I215-F229 HydrophobicContact CD1-CE2 4.1Å; I215-F229 HydrophobicContact CD1-CZ 4.34Å; I215-F229 HydrophobicContact CG1-CE2 3.99Å; F225-F229 VanDerWaalsContact O-CD2 3.26Å; F225-F229 WeakPolarHBondContact O-CD2 3.29Å; F225-F229 PolarHBondContact O-N 2.84Å; I226-F229 PolarHBondContact O-N 3.24Å; E227-F229 PolarHBondContact O-N 3.46Å; F229-K231 PolarHBondContact O-N 3.47Å; F229-M232 WeakPolarHBondContact O-CB 3.39Å; F229-M232 PolarHBondContact O-N 2.73Å; F229-V249 HydrophobicContact CB-CB 4.01Å; F229-V249 HydrophobicContact CB-CG1 4.44Å; F229-V249 HydrophobicContact CB-CG2 4.19Å
230	S	91	Very high	77.5	Confident	60 Å²	60	72.1 Å²	72.1	42%	0.42	36%	0.355	S	S	.	.	H	α-helix	trans	-61.5	-31.8	173.6	72.6	0	0	0	0	112.1	I226 E227 M232	I226-S230 WeakPolarHBondContact O-CB 3.48Å; I226-S230 PolarHBondContact O-N 2.8Å; I226-S230 PolarHBondContact O-OG 3.35Å; E227-S230 WeakPolarHBondContact CA-OG 3.41Å; E227-S230 PolarHBondContact O-N 2.92Å; E227-S230 PolarHBondContact O-OG 3.03Å; S230-M232 PolarHBondContact O-N 3.17Å
231	K	86.5	Confident	77.3	Confident	131 Å²	131	74.2 Å²	74.2	57%	0.57	36%	0.359	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.1	-1.8	175.3	-64.8	172.5	-174	169.8	0	113.3	E227 F229 K233	E227-K231 PolarHBondContact O-N 3.2Å; E227-K231 WeakPolarHBondContact OE1-CE 3.22Å; E227-K231 IonicContact OE1-NZ 2.68Å; E227-K231 PolarHBondContact OE1-NZ 3Å; F229-K231 PolarHBondContact O-N 3.47Å; K231-K233 PolarHBondContact O-N 3.17Å
232	M	85.5	Confident	76.6	Confident	7 Å²	7	78.5 Å²	78.5	3%	0.034	38%	0.379	C	S	.	.			trans	-74.9	113.5	177.3	-173	-178.9	68.2	0	0	110.5	R71 K201 L204 R205 F229 S230 I234	R71-M232 HydrophobicContact CB-CE 3.93Å; R71-M232 HydrophobicContact CG-CE 4.24Å; K201-M232 HydrophobicContact CG-SD 4.48Å; L204-M232 HydrophobicContact CB-SD 3.8Å; L204-M232 HydrophobicContact CD1-SD 4.09Å; R205-M232 HydrophobicContact CG-CG 4.29Å; F229-M232 WeakPolarHBondContact O-CB 3.39Å; F229-M232 PolarHBondContact O-N 2.73Å; S230-M232 PolarHBondContact O-N 3.17Å; M232-I234 HydrophobicContact CE-CG1 4.31Å; M232-I234 PolarHBondContact O-N 3.3Å
233	K	75.4	Confident	75.9	Confident	184 Å²	184	81.3 Å²	81.3	80%	0.8	41%	0.408	S	S	*	.			trans	-66.4	119.4	169.1	-63.6	-170.8	178.4	-172.9	0	109.9	K231	K231-K233 PolarHBondContact O-N 3.17Å
234	I	69.7	Low	74.9	Confident	34 Å²	34	76.8 Å²	76.8	17%	0.174	39%	0.389	C	S	.	.			trans	-86.5	127	170.7	-55.9	177	0	0	0	107.5	R71 M232 E236 T239 L246 P248	R71-I234 HydrophobicContact CG-CD1 4.04Å; M232-I234 HydrophobicContact CE-CG1 4.31Å; M232-I234 PolarHBondContact O-N 3.3Å; I234-E236 PolarHBondContact O-N 3.4Å; I234-T239 HydrophobicContact CG2-CG2 4.15Å; I234-L246 WeakPolarHBondContact CD1-O 3.39Å; I234-P248 HydrophobicContact CD1-CB 4.01Å; I234-P248 HydrophobicContact CD1-CG 3.61Å; I234-P248 HydrophobicContact CG1-CB 4.42Å; I234-P248 HydrophobicContact CG1-CG 4.22Å
235	P	67.8	Low	74.3	Confident	51 Å²	51	82.6 Å²	82.6	33%	0.331	41%	0.414	S	S	.	.			trans	-61.3	107	171.1	-19	31	0	0	0	110.3	P208 V237 T239	P208-P235 HydrophobicContact CB-CG 4.21Å; P235-V237 VanDerWaalsContact C-N 3.29Å; P235-V237 PolarHBondContact O-N 3.32Å; P235-T239 PolarHBondContact O-OG1 3.15Å
236	E	63	Low	73.9	Confident	133 Å²	133	83.3 Å²	83.3	62%	0.621	42%	0.418	S	S	*	.	H	α-helix	trans	-65.2	-32.6	-177.5	-67.4	-178	170.7	0	0	112.4	I234 E238 T239 Q240	I234-E236 PolarHBondContact O-N 3.4Å; E236-E238 VanDerWaalsContact C-N 3.31Å; E236-E238 PolarHBondContact O-N 2.68Å; E236-T239 WeakPolarHBondContact CA-OG1 3.34Å; E236-T239 PolarHBondContact O-N 2.84Å; E236-T239 PolarHBondContact O-OG1 3.28Å; E236-Q240 VanDerWaalsContact O-CB 3.32Å; E236-Q240 WeakPolarHBondContact O-CB 3.43Å; E236-Q240 VanDerWaalsContact O-CG 3.3Å; E236-Q240 WeakPolarHBondContact O-CG 3.38Å; E236-Q240 PolarHBondContact O-N 2.94Å
237	V	57.8	Low	73.7	Confident	101 Å²	101	84.1 Å²	84.1	61%	0.612	43%	0.425	S	S	*	.	H	α-helix	trans	-62.4	-35	-172.3	-176	0	0	0	0	112.7	P235 K241	P235-V237 VanDerWaalsContact C-N 3.29Å; P235-V237 PolarHBondContact O-N 3.32Å; V237-K241 WeakPolarHBondContact O-CG 3.17Å
238	E	56.2	Low	73.5	Confident	99 Å²	99	80.9 Å²	80.9	46%	0.463	41%	0.413	S	S	.	.	H	α-helix	trans	-87.4	-33.3	-178.8	-69.4	-173.4	-176	0	0	112.7	P208 I209 E236	P208-E238 HydrophobicContact CG-CB 4.34Å; P208-E238 WeakPolarHBondContact CG-OE2 3.39Å; I209-E238 HydrophobicContact CD1-CB 4.27Å; E236-E238 VanDerWaalsContact C-N 3.31Å; E236-E238 PolarHBondContact O-N 2.68Å
239	T	57.7	Low	73.5	Confident	11 Å²	11	81 Å²	81	7%	0.067	42%	0.415	C	S	.	.	H	α-helix	trans	-74.2	-39.5	179.4	35.7	0	0	0	0	111.9	I234 P235 E236 K241 Q242 G243 L244 L246	I234-T239 HydrophobicContact CG2-CG2 4.15Å; P235-T239 PolarHBondContact O-OG1 3.15Å; E236-T239 WeakPolarHBondContact CA-OG1 3.34Å; E236-T239 PolarHBondContact O-N 2.84Å; E236-T239 PolarHBondContact O-OG1 3.28Å; T239-K241 PolarHBondContact O-N 3.08Å; T239-Q242 PolarHBondContact O-N 3.46Å; T239-G243 PolarHBondContact O-N 2.9Å; T239-L244 WeakPolarHBondContact CB-O 3.48Å; T239-L244 PolarHBondContact O-N 3.17Å; T239-L244 VanDerWaalsContact O-N 3.13Å; T239-L246 HydrophobicContact CG2-CD1 4.43Å
240	Q	57.3	Low	73.6	Confident	136 Å²	136	81.9 Å²	81.9	64%	0.636	42%	0.422	S	S	*	.	H	α-helix	trans	-65.7	-36.4	176	-72.4	-179.4	3.5	0	0	112.7	E236 Q242 G243	E236-Q240 VanDerWaalsContact O-CB 3.32Å; E236-Q240 WeakPolarHBondContact O-CB 3.43Å; E236-Q240 VanDerWaalsContact O-CG 3.3Å; E236-Q240 WeakPolarHBondContact O-CG 3.38Å; E236-Q240 PolarHBondContact O-N 2.94Å; Q240-Q242 PolarHBondContact O-N 3.42Å; Q240-Q242 VanDerWaalsContact O-N 3.13Å; Q240-G243 PolarHBondContact O-N 3.3Å
241	K	57	Low	73.8	Confident	174 Å²	174	82.8 Å²	82.8	76%	0.757	42%	0.419	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.5	-24	177	-82.5	-179.5	179.9	-176.5	0	113.8	V237 T239	V237-K241 WeakPolarHBondContact O-CG 3.17Å; T239-K241 PolarHBondContact O-N 3.08Å
242	Q	59.9	Low	74.1	Confident	112 Å²	112	76.7 Å²	76.7	52%	0.523	39%	0.393	S	S	.	.	T	Hydrogen-bonded Turn	trans	-106.7	6.3	176.1	-68	-173.6	-2.6	0	0	113.7	T239 Q240 L244	T239-Q242 PolarHBondContact O-N 3.46Å; Q240-Q242 PolarHBondContact O-N 3.42Å; Q240-Q242 VanDerWaalsContact O-N 3.13Å; Q242-L244 HydrophobicContact CB-CD1 3.96Å; Q242-L244 PolarHBondContact O-N 2.97Å
243	G	66.3	Low	74.4	Confident	65 Å²	65	78.9 Å²	78.9	67%	0.67	41%	0.405	S	S	*	.	T	Hydrogen-bonded Turn	trans	63	22.5	-178	0	0	0	0	0	114.1	T239 Q240	T239-G243 PolarHBondContact O-N 2.9Å; Q240-G243 PolarHBondContact O-N 3.3Å
244	L	67.6	Low	75	Confident	59 Å²	59	70.2 Å²	70.2	31%	0.309	37%	0.367	S	S	.	.			trans	-100.6	108	-177.8	-84.8	154.3	0	0	0	109.7	T239 Q242 L246	T239-L244 WeakPolarHBondContact CB-O 3.48Å; T239-L244 PolarHBondContact O-N 3.17Å; T239-L244 VanDerWaalsContact O-N 3.13Å; Q242-L244 HydrophobicContact CB-CD1 3.96Å; Q242-L244 PolarHBondContact O-N 2.97Å; L244-L246 PolarHBondContact O-N 3.4Å
245	K	76.8	Confident	75.5	Confident	206 Å²	206	75.7 Å²	75.7	90%	0.896	39%	0.392	S	S	*	.			trans	-93.2	87	173.7	-163.9	176.3	-176.7	-179.3	0	109.6
246	L	83.3	Confident	75.4	Confident	15 Å²	15	75 Å²	75	8%	0.079	40%	0.395	C	S	.	.			trans	-83.8	135.7	-179.8	-65.8	173.5	0	0	0	111.7	E68 N69 R71 I234 T239 L244	E68-L246 WeakPolarHBondContact O-CD2 3.46Å; N69-L246 WeakPolarHBondContact O-CA 3.3Å; R71-L246 HydrophobicContact CG-CB 4.13Å; R71-L246 HydrophobicContact CG-CD1 4.46Å; I234-L246 WeakPolarHBondContact CD1-O 3.39Å; T239-L246 HydrophobicContact CG2-CD1 4.43Å; L244-L246 PolarHBondContact O-N 3.4Å
247	T	88.3	Confident	75.4	Confident	65 Å²	65	72.9 Å²	72.9	40%	0.399	38%	0.381	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.8	135.7	172.4	-53	0	0	0	0	110	N69 S70 R71 V249	N69-T247 PolarHBondContact O-N 3.07Å; S70-T247 CarbonylContact C-O 3.58Å; S70-T247 WeakPolarHBondContact CA-O 3.49Å; R71-T247 PolarHBondContact N-O 2.7Å; T247-V249 VanDerWaalsContact C-N 3.34Å; T247-V249 WeakPolarHBondContact CG2-O 3.32Å; T247-V249 PolarHBondContact O-N 3.16Å
248	P	90	Very high	75.7	Confident	39 Å²	39	71.1 Å²	71.1	25%	0.253	37%	0.366	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-59	-44	178.8	-20	27	0	0	0	113.2	R71 V72 I234	R71-P248 WeakPolarHBondContact CB-O 3.35Å; V72-P248 PolarHBondContact N-O 2.92Å; V72-P248 VanDerWaalsContact N-O 3.14Å; I234-P248 HydrophobicContact CD1-CB 4.01Å; I234-P248 HydrophobicContact CD1-CG 3.61Å; I234-P248 HydrophobicContact CG1-CB 4.42Å; I234-P248 HydrophobicContact CG1-CG 4.22Å
249	V	93.8	Very high	76.6	Confident	17 Å²	17	70.1 Å²	70.1	10%	0.103	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.4	139.1	179.5	62.3	0	0	0	0	110.2	V72 V74 I226 F229 T247	V72-V249 HydrophobicContact CB-CB 4.3Å; V72-V249 HydrophobicContact CB-CG2 4.16Å; V72-V249 HydrophobicContact CG1-CG2 4.24Å; V72-V249 CarbonylContact O-C 3.54Å; V72-V249 VanDerWaalsContact O-CA 3.25Å; V72-V249 WeakPolarHBondContact O-CA 3.49Å; V74-V249 HydrophobicContact CG2-CG2 3.82Å; I226-V249 HydrophobicContact CG1-CG2 4.45Å; I226-V249 HydrophobicContact CG2-CG1 4.04Å; F229-V249 HydrophobicContact CB-CB 4.01Å; F229-V249 HydrophobicContact CB-CG1 4.44Å; F229-V249 HydrophobicContact CB-CG2 4.19Å; T247-V249 VanDerWaalsContact C-N 3.34Å; T247-V249 WeakPolarHBondContact CG2-O 3.32Å; T247-V249 PolarHBondContact O-N 3.16Å
250	S	94.7	Very high	78	Confident	20 Å²	20	74.3 Å²	74.3	14%	0.14	38%	0.384	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	160.6	170.1	-63.4	0	0	0	0	110	S70 V72 V74	S70-S250 WeakPolarHBondContact OG-CB 3.21Å; S70-S250 PolarHBondContact OG-OG 2.97Å; V72-S250 PolarHBondContact O-N 3.38Å; V74-S250 PolarHBondContact N-O 3.2Å
251	H	94.5	Very high	79.5	Confident	80 Å²	80	68.9 Å²	68.9	37%	0.37	36%	0.36	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	134.8	179.5	176.8	-130.3	0	0	0	110.6	V74 T76 I226	V74-H251 CarbonylContact O-C 3.5Å; V74-H251 WeakPolarHBondContact O-CA 3.49Å; V74-H251 PolarHBondContact O-CD2 2.9Å; T76-H251 PolarHBondContact OG1-NE2 3.14Å; I226-H251 HydrophobicContact CD1-CB 3.67Å; I226-H251 HydrophobicContact CG1-CB 4.34Å
252	L	94	Very high	81.3	Confident	2 Å²	2	63.4 Å²	63.4	1%	0.01	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	118.3	171.4	178.8	64.3	0	0	0	108.9	K59 Q62 F63 L66 L73 V74 V75 T76	K59-L252 HydrophobicContact CB-CD1 4.46Å; K59-L252 HydrophobicContact CB-CD2 4.43Å; Q62-L252 HydrophobicContact CB-CD1 4.35Å; Q62-L252 HydrophobicContact CG-CD1 3.81Å; F63-L252 HydrophobicContact CB-CD2 3.69Å; F63-L252 HydrophobicContact CD2-CD2 4.23Å; F63-L252 HydrophobicContact CG-CD2 4.47Å; L66-L252 HydrophobicContact CD1-CB 3.98Å; L66-L252 HydrophobicContact CD1-CD1 4.23Å; L73-L252 HydrophobicContact CD1-CB 4.13Å; V74-L252 PolarHBondContact O-N 3.24Å; V75-L252 WeakPolarHBondContact CA-O 3.44Å; V75-L252 HydrophobicContact CG1-CD2 4.49Å; V75-L252 HydrophobicContact CG2-CB 4.45Å; T76-L252 PolarHBondContact N-O 3.07Å
253	N	91.8	Very high	83	Confident	53 Å²	53	61 Å²	61	28%	0.283	33%	0.334	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.4	122.8	170.9	-165.2	34	0	0	0	110.5	T76 E255	T76-N253 PolarHBondContact OG1-OD1 3.1Å; N253-E255 WeakPolarHBondContact ND2-CG 3.31Å; N253-E255 PolarHBondContact ND2-OE1 2.94Å; N253-E255 VanDerWaalsContact ND2-OE1 3.16Å
254	V	87.7	Confident	84.5	Confident	2 Å²	2	62.1 Å²	62.1	1%	0.012	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.3	95.4	172.2	-177.2	0	0	0	0	107.4	P55 V56 V75 T76 G77	P55-V254 HydrophobicContact CB-CG1 3.96Å; V56-V254 HydrophobicContact CB-CG1 4.17Å; V56-V254 HydrophobicContact CG2-CG2 4.23Å; V75-V254 HydrophobicContact CG1-CG2 3.95Å; T76-V254 PolarHBondContact O-N 3.01Å; G77-V254 WeakPolarHBondContact CA-O 3.24Å
255	E	79.7	Confident	86	Confident	149 Å²	149	62.1 Å²	62.1	70%	0.696	32%	0.317	S	S	*	.			trans	-78.4	147	178.5	-65.8	-176.8	-179.7	0	0	111.6	N253	N253-E255 WeakPolarHBondContact ND2-CG 3.31Å; N253-E255 PolarHBondContact ND2-OE1 2.94Å; N253-E255 VanDerWaalsContact ND2-OE1 3.16Å
256	G	65.8	Low	86.9	Confident	38 Å²	38	54 Å²	54	39%	0.392	29%	0.286	S	S	.	.			trans	103.6	140.2	174.1	0	0	0	0	0	114.5	P55	P55-G256 WeakPolarHBondContact CG-O 3.44Å
257	R	64.1	Low	87.4	Confident	88 Å²	88	61 Å²	61	33%	0.332	32%	0.323	S	S	.	.			trans	-93.3	155.6	159.9	-61.2	-169.6	-179.3	176.8	-0.7	109	E78 Y259	E78-R257 IonicContact OE1-CZ 3.07Å; E78-R257 VanDerWaalsContact OE1-CZ 3.3Å; E78-R257 IonicContact OE1-NE 3.26Å; E78-R257 PolarHBondContact OE1-NE 2.87Å; E78-R257 VanDerWaalsContact OE1-NE 3.07Å; E78-R257 IonicContact OE1-NH2 3.8Å; E78-R257 PolarHBondContact OE1-NH2 3.47Å; E78-R257 WeakPolarHBondContact OE2-CD 3.32Å; E78-R257 WeakPolarHBondContact OE2-CG 3.28Å; E78-R257 IonicContact OE2-CZ 3.38Å; E78-R257 IonicContact OE2-NE 3.59Å; E78-R257 PolarHBondContact OE2-NE 3.21Å; E78-R257 IonicContact OE2-NH2 2.92Å; R257-Y259 WeakPolarHBondContact CB-O 3.35Å; R257-Y259 WeakPolarHBondContact CD-O 3.27Å; R257-Y259 PolarHBondContact O-N 3.37Å
258	Q	63.2	Low	87.7	Confident	63 Å²	63	63.5 Å²	63.5	29%	0.294	33%	0.334	S	S	.	.	S	Bend	trans	-61.9	-36	164.1	-154.3	176.2	-8.5	0	0	111	R427	Q258-R427 PolarHBondContact OE1-O 3.16Å; Q258-R427 VanDerWaalsContact OE1-O 3.1Å
259	Y	75.9	Confident	87.9	Confident	78 Å²	78	66.7 Å²	66.7	31%	0.306	36%	0.355	S	S	.	.	S	Bend	trans	-147.5	153.4	177.4	-55.4	-83.8	0	0	0	114	R257 G426 R427 T428 R429	R257-Y259 WeakPolarHBondContact CB-O 3.35Å; R257-Y259 WeakPolarHBondContact CD-O 3.27Å; R257-Y259 PolarHBondContact O-N 3.37Å; Y259-G426 WeakPolarHBondContact CB-O 3.36Å; Y259-G426 PolarHBondContact N-O 2.79Å; Y259-R427 WeakPolarHBondContact CD2-O 3.36Å; Y259-R427 WeakPolarHBondContact CE2-O 3.45Å; Y259-T428 VanDerWaalsContact CD2-C 3.47Å; Y259-T428 VanDerWaalsContact CE2-O 3.31Å; Y259-T428 WeakPolarHBondContact CE2-O 3.24Å; Y259-R429 VanDerWaalsContact CB-O 3.24Å; Y259-R429 WeakPolarHBondContact CB-O 3.3Å; Y259-R429 VanDerWaalsContact CD2-N 3.29Å; Y259-R429 VanDerWaalsContact CG-CA 3.41Å
260	T	85.6	Confident	88	Confident	100 Å²	100	67.9 Å²	67.9	61%	0.613	36%	0.362	S	S	*	.			trans	-78.3	155.8	179.2	57.2	0	0	0	0	112.8	T430 G431	T260-T430 WeakPolarHBondContact O-CA 3.43Å; T260-G431 PolarHBondContact O-N 3.13Å
261	V	89.8	Confident	87.9	Confident	21 Å²	21	73.5 Å²	73.5	13%	0.127	40%	0.398	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.5	119.4	177.3	-177.1	0	0	0	0	109.9	I263 A425 G426 G431 A433	V261-I263 HydrophobicContact CG1-CD1 4.04Å; V261-A425 HydrophobicContact CG1-CB 4.06Å; V261-A425 HydrophobicContact CG2-CB 4.27Å; V261-G426 VanDerWaalsContact CG2-CA 3.42Å; V261-G431 VanDerWaalsContact CA-O 3.31Å; V261-G431 WeakPolarHBondContact CA-O 3.29Å; V261-A433 HydrophobicContact CG1-CB 4.08Å
262	S	94.9	Very high	87.9	Confident	59 Å²	59	72.5 Å²	72.5	41%	0.413	40%	0.399	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.8	133.8	172.4	-52.9	0	0	0	0	110.5	G431 Q432 A433	S262-G431 PolarHBondContact N-O 3.31Å; S262-Q432 CarbonylContact O-C 3.6Å; S262-Q432 WeakPolarHBondContact O-CA 3.42Å; S262-A433 PolarHBondContact O-N 3.24Å
263	I	96.2	Very high	88	Confident	62 Å²	62	74.7 Å²	74.7	32%	0.318	41%	0.407	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	129.1	-179.5	-50.3	-59	0	0	0	109.4	V261 Y265 A422 A433 R435	V261-I263 HydrophobicContact CG1-CD1 4.04Å; I263-Y265 HydrophobicContact CG2-CD2 4.44Å; I263-Y265 HydrophobicContact CG2-CE1 4.35Å; I263-Y265 HydrophobicContact CG2-CE2 3.87Å; I263-A422 HydrophobicContact CD1-CB 3.66Å; I263-A433 HydrophobicContact CD1-CB 3.79Å; I263-R435 HydrophobicContact CG2-CG 4.45Å
264	F	97.7	Very high	88.2	Confident	88 Å²	88	72.8 Å²	72.8	39%	0.386	40%	0.397	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	136.8	174.3	-58.8	-86.2	0	0	0	109.4	Q432 A433 Y434 R435	F264-Q432 HydrophobicContact CD2-CB 4.4Å; F264-Q432 HydrophobicContact CE2-CB 3.96Å; F264-Q432 HydrophobicContact CE2-CG 3.96Å; F264-A433 PolarHBondContact N-O 2.78Å; F264-Y434 HydrophobicContact CB-CD1 3.99Å; F264-Y434 HydrophobicContact CB-CE1 4.35Å; F264-Y434 HydrophobicContact CD2-CD1 4.22Å; F264-Y434 AromaticContact CD2-CE1 3.97Å; F264-Y434 HydrophobicContact CD2-CE1 3.97Å; F264-Y434 HydrophobicContact CG-CD1 4.29Å; F264-Y434 HydrophobicContact CG-CE1 4.17Å; F264-R435 PolarHBondContact O-N 3.34Å
265	Y	98	Very high	88.6	Confident	60 Å²	60	76.1 Å²	76.1	24%	0.235	42%	0.421	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110	156.5	176.2	-61.1	-87.4	0	0	0	110.9	I263 R435 E439 Y442	I263-Y265 HydrophobicContact CG2-CD2 4.44Å; I263-Y265 HydrophobicContact CG2-CE1 4.35Å; I263-Y265 HydrophobicContact CG2-CE2 3.87Å; Y265-R435 HydrophobicContact CD1-CB 3.97Å; Y265-R435 HydrophobicContact CD1-CG 4.48Å; Y265-R435 HydrophobicContact CE1-CB 4.45Å; Y265-R435 HydrophobicContact CE1-CG 4.5Å; Y265-R435 PolarHBondContact OH-NH1 3.34Å; Y265-E439 HydrophobicContact CD1-CB 4.03Å; Y265-E439 HydrophobicContact CD2-CB 3.74Å; Y265-E439 HydrophobicContact CD2-CG 4.1Å; Y265-E439 HydrophobicContact CE1-CB 4.27Å; Y265-E439 HydrophobicContact CE1-CG 4.43Å; Y265-E439 HydrophobicContact CE2-CB 3.99Å; Y265-E439 HydrophobicContact CE2-CG 3.83Å; Y265-E439 HydrophobicContact CG-CB 3.75Å; Y265-E439 HydrophobicContact CG-CG 4.49Å; Y265-Y442 HydrophobicContact CE1-CD1 4.3Å; Y265-Y442 HydrophobicContact CE1-CG 4.01Å
266	S	96.4	Very high	89.5	Confident	36 Å²	36	70.2 Å²	70.2	25%	0.252	40%	0.397	S	S	.	.			trans	-67.6	142.8	166.2	-168	0	0	0	0	109.4	D268 V270 R435 Y437 T438	S266-D268 WeakPolarHBondContact CB-O 3.47Å; S266-D268 PolarHBondContact OG-O 3.03Å; S266-V270 WeakPolarHBondContact OG-CG2 2.74Å; S266-R435 PolarHBondContact N-O 3.22Å; S266-R435 VanDerWaalsContact N-O 3.08Å; S266-Y437 PolarHBondContact N-O 3.44Å; S266-Y437 VanDerWaalsContact N-O 3.11Å; S266-T438 WeakPolarHBondContact O-CA 3.42Å
267	L	94.5	Very high	91	Very high	161 Å²	161	68.5 Å²	68.5	84%	0.843	38%	0.379	S	S	*	.	S	Bend	trans	-70.2	-46.8	174.8	-63.9	175.6	0	0	0	110.5	T438	L267-T438 WeakPolarHBondContact O-CG2 3.49Å
268	D	94.5	Very high	92.6	Very high	118 Å²	118	66.7 Å²	66.7	63%	0.631	37%	0.374	S	S	*	.	S	Bend	trans	-112.9	156.4	179.4	-59.1	-71.2	0	0	0	111.6	S266 V270	S266-D268 WeakPolarHBondContact CB-O 3.47Å; S266-D268 PolarHBondContact OG-O 3.03Å; D268-V270 PolarHBondContact O-N 3.23Å
269	P	93.9	Very high	94.2	Very high	106 Å²	106	67.9 Å²	67.9	69%	0.688	38%	0.379	S	S	*	.			trans	-54.2	132.3	171.7	-25.4	35.2	0	0	0	112	P271 T438	P269-P271 WeakPolarHBondContact O-CD 3.36Å; P269-T438 HydrophobicContact CG-CG2 4.33Å
270	V	94.7	Very high	95.3	Very high	41 Å²	41	64.5 Å²	64.5	25%	0.248	37%	0.367	C	S	.	.			trans	-89.7	116.7	-176.9	176.9	0	0	0	0	110.1	S266 D268 A276 L436	S266-V270 WeakPolarHBondContact OG-CG2 2.74Å; D268-V270 PolarHBondContact O-N 3.23Å; V270-A276 HydrophobicContact CG1-CB 3.49Å; V270-A276 VanDerWaalsContact CG1-CB 3.49Å; V270-L436 WeakPolarHBondContact CB-O 3.5Å; V270-L436 HydrophobicContact CG2-CB 4.38Å; V270-L436 VanDerWaalsContact CG2-O 3.24Å; V270-L436 WeakPolarHBondContact CG2-O 3.41Å
271	P	92.4	Very high	95.9	Very high	138 Å²	138	59.7 Å²	59.7	90%	0.896	34%	0.338	S	S	*	.	S	Bend	trans	-72	-33.8	-178.4	26.3	-33.5	0	0	0	113.1	P269	P269-P271 WeakPolarHBondContact O-CD 3.36Å
272	C	95.1	Very high	96.3	Very high	60 Å²	60	58.7 Å²	58.7	41%	0.405	33%	0.332	S	S	.	.			trans	-134.1	99.4	177.2	-179	0	0	0	0	110.9	I274 S275 A276	C272-I274 PolarHBondContact O-N 3.45Å; C272-S275 PolarHBondContact O-N 3.42Å; C272-A276 PolarHBondContact O-N 2.84Å; C272-A276 VanDerWaalsContact O-N 3.11Å
273	Y	96.1	Very high	96.3	Very high	47 Å²	47	61.3 Å²	61.3	18%	0.184	33%	0.332	C	S	.	.	H	α-helix	trans	-66.2	-23.7	-178.8	53.9	-105	0	0	0	113.3	A277 E303 C391 F393	Y273-A277 WeakPolarHBondContact O-CB 3.2Å; Y273-A277 PolarHBondContact O-N 2.78Å; Y273-E303 PolarHBondContact OH-OE1 3.46Å; Y273-C391 HydrophobicContact CD2-CB 3.83Å; Y273-C391 HydrophobicContact CG-CB 3.86Å; Y273-F393 AromaticContact CD1-CD2 3.98Å; Y273-F393 HydrophobicContact CD1-CD2 3.98Å; Y273-F393 HydrophobicContact CD1-CE2 4.02Å; Y273-F393 AromaticContact CE1-CD2 3.9Å; Y273-F393 HydrophobicContact CE1-CD2 3.9Å; Y273-F393 HydrophobicContact CE1-CE2 4.15Å
274	I	96.4	Very high	96.4	Very high	13 Å²	13	58.4 Å²	58.4	7%	0.067	32%	0.318	C	S	.	.	H	α-helix	trans	-66.8	-48.9	175.9	-60.6	-62.6	0	0	0	110.7	C272 A277 K278 V298 E303 L307	C272-I274 PolarHBondContact O-N 3.45Å; I274-A277 PolarHBondContact O-N 3.01Å; I274-K278 PolarHBondContact O-N 3.28Å; I274-V298 HydrophobicContact CD1-CG1 3.94Å; I274-E303 HydrophobicContact CD1-CB 3.93Å; I274-E303 HydrophobicContact CD1-CG 4.15Å; I274-L307 HydrophobicContact CG2-CB 4.38Å; I274-L307 HydrophobicContact CG2-CD1 4.16Å
275	S	96.5	Very high	96.2	Very high	72 Å²	72	54.5 Å²	54.5	50%	0.503	30%	0.301	S	S	.	.	H	α-helix	trans	-65.4	-42.3	177	-62	0	0	0	0	111.6	C272 A277 K278 E279	C272-S275 PolarHBondContact O-N 3.42Å; S275-A277 PolarHBondContact O-N 2.97Å; S275-K278 WeakPolarHBondContact O-CB 3.46Å; S275-K278 PolarHBondContact O-N 3.35Å; S275-E279 PolarHBondContact O-N 3.36Å
276	A	97.4	Very high	96	Very high	25 Å²	25	56.1 Å²	56.1	21%	0.207	31%	0.31	C	S	.	.	H	α-helix	trans	-65.5	-37.5	177.3	0	0	0	0	0	112.8	V270 C272 T280 L436	V270-A276 HydrophobicContact CG1-CB 3.49Å; V270-A276 VanDerWaalsContact CG1-CB 3.49Å; C272-A276 PolarHBondContact O-N 2.84Å; C272-A276 VanDerWaalsContact O-N 3.11Å; A276-T280 VanDerWaalsContact O-CB 3.31Å; A276-T280 WeakPolarHBondContact O-CB 3.42Å; A276-T280 PolarHBondContact O-N 2.82Å; A276-T280 PolarHBondContact O-OG1 3.04Å; A276-L436 HydrophobicContact CB-CD1 4.3Å; A276-L436 HydrophobicContact CB-CD2 4.37Å
277	A	98.1	Very high	95.8	Very high	2 Å²	2	58.9 Å²	58.9	2%	0.017	33%	0.325	C	S	.	.	H	α-helix	trans	-63	-46.4	173.2	0	0	0	0	0	111	Y273 I274 S275 E279 T280 V281 I296 L307 I389 L436	Y273-A277 WeakPolarHBondContact O-CB 3.2Å; Y273-A277 PolarHBondContact O-N 2.78Å; I274-A277 PolarHBondContact O-N 3.01Å; S275-A277 PolarHBondContact O-N 2.97Å; A277-E279 PolarHBondContact O-N 3.11Å; A277-T280 PolarHBondContact O-N 2.96Å; A277-V281 WeakPolarHBondContact O-CG2 3.31Å; A277-V281 PolarHBondContact O-N 3.47Å; A277-I296 HydrophobicContact CB-CG2 4.07Å; A277-L307 HydrophobicContact CB-CD2 4.04Å; A277-I389 HydrophobicContact CB-CG2 4.17Å; A277-L436 HydrophobicContact CB-CD1 3.88Å
278	K	98	Very high	95.8	Very high	51 Å²	51	54.5 Å²	54.5	22%	0.222	30%	0.3	C	S	.	.	H	α-helix	trans	-54.6	-52	176.1	-172.3	-172.7	70.8	156.3	0	111.4	I274 S275 T280 V281 F282 L307 N310 L311 E314	I274-K278 PolarHBondContact O-N 3.28Å; S275-K278 WeakPolarHBondContact O-CB 3.46Å; S275-K278 PolarHBondContact O-N 3.35Å; K278-T280 VanDerWaalsContact C-N 3.33Å; K278-T280 PolarHBondContact O-N 3.29Å; K278-V281 WeakPolarHBondContact O-CB 3.39Å; K278-V281 PolarHBondContact O-N 2.83Å; K278-F282 HydrophobicContact CG-CD2 4.36Å; K278-F282 HydrophobicContact CG-CE2 4.25Å; K278-F282 WeakPolarHBondContact O-CD2 3.47Å; K278-F282 PolarHBondContact O-N 2.97Å; K278-L307 HydrophobicContact CB-CD1 4.04Å; K278-N310 HydrophobicContact CD-CB 4.2Å; K278-L311 HydrophobicContact CG-CD2 4.04Å; K278-E314 HydrophobicContact CD-CB 4.21Å; K278-E314 HydrophobicContact CD-CG 4.27Å; K278-E314 IonicContact NZ-OE2 3.77Å; K278-E314 PolarHBondContact NZ-OE2 3.31Å
279	E	97.4	Very high	95.4	Very high	87 Å²	87	53.6 Å²	53.6	41%	0.407	30%	0.3	S	S	.	.	H	α-helix	trans	-63.7	-40.8	-179.3	-170.6	54.5	-136.9	0	0	111.8	S275 A277 V281 F282 R283 R318	S275-E279 PolarHBondContact O-N 3.36Å; A277-E279 PolarHBondContact O-N 3.11Å; E279-V281 VanDerWaalsContact C-N 3.32Å; E279-V281 PolarHBondContact O-N 3.13Å; E279-F282 PolarHBondContact O-N 3.01Å; E279-R283 WeakPolarHBondContact O-CB 3.46Å; E279-R283 PolarHBondContact O-N 3.49Å; E279-R318 IonicContact OE1-NH2 2.78Å; E279-R318 PolarHBondContact OE1-NH2 2.89Å; E279-R318 IonicContact OE2-NH2 2.96Å; E279-R318 PolarHBondContact OE2-NH2 2.88Å; E279-R318 VanDerWaalsContact OE2-NH2 3.11Å
280	T	97.8	Very high	95.1	Very high	7 Å²	7	52 Å²	52	4%	0.043	29%	0.286	C	S	.	.	H	α-helix	trans	-62.1	-39.3	176.9	-59.8	0	0	0	0	111.8	A276 A277 K278 F282 R283 I284 I389 Y434	A276-T280 VanDerWaalsContact O-CB 3.31Å; A276-T280 WeakPolarHBondContact O-CB 3.42Å; A276-T280 PolarHBondContact O-N 2.82Å; A276-T280 PolarHBondContact O-OG1 3.04Å; A277-T280 PolarHBondContact O-N 2.96Å; K278-T280 VanDerWaalsContact C-N 3.33Å; K278-T280 PolarHBondContact O-N 3.29Å; T280-F282 PolarHBondContact O-N 3.36Å; T280-R283 PolarHBondContact O-N 3.32Å; T280-R283 PolarHBondContact OG1-NH2 2.83Å; T280-I284 HydrophobicContact CG2-CD1 3.86Å; T280-I284 HydrophobicContact CG2-CG1 4.38Å; T280-I284 WeakPolarHBondContact O-CG1 3.37Å; T280-I284 PolarHBondContact O-N 2.65Å; T280-I389 HydrophobicContact CG2-CD1 3.63Å; T280-I389 HydrophobicContact CG2-CG1 3.88Å; T280-Y434 HydrophobicContact CG2-CD1 4.34Å; T280-Y434 HydrophobicContact CG2-CG 4.1Å
281	V	98.2	Very high	94.5	Very high	0 Å²	0	51.4 Å²	51.4	0%	0	29%	0.288	C	S	.	.	H	α-helix	trans	-57.7	-50.9	175.4	170.1	0	0	0	0	111.1	A277 K278 E279 I284 H285 I294 I296 L311 V369 I389	A277-V281 WeakPolarHBondContact O-CG2 3.31Å; A277-V281 PolarHBondContact O-N 3.47Å; K278-V281 WeakPolarHBondContact O-CB 3.39Å; K278-V281 PolarHBondContact O-N 2.83Å; E279-V281 VanDerWaalsContact C-N 3.32Å; E279-V281 PolarHBondContact O-N 3.13Å; V281-I284 PolarHBondContact O-N 3.28Å; V281-H285 WeakPolarHBondContact O-CB 3.47Å; V281-H285 PolarHBondContact O-N 3.29Å; V281-I294 HydrophobicContact CG1-CD1 4.02Å; V281-I294 HydrophobicContact CG2-CG2 4.38Å; V281-I296 HydrophobicContact CG2-CD1 3.24Å; V281-I296 HydrophobicContact CG2-CG1 4.19Å; V281-L311 HydrophobicContact CB-CD2 3.84Å; V281-L311 HydrophobicContact CG1-CD2 3.76Å; V281-L311 HydrophobicContact CG2-CD2 4.02Å; V281-V369 HydrophobicContact CG1-CG1 4.36Å; V281-V369 HydrophobicContact CG1-CG2 4.07Å; V281-V369 HydrophobicContact CG2-CG1 4.33Å; V281-I389 HydrophobicContact CG2-CD1 3.62Å
282	F	97.6	Very high	94.4	Very high	0 Å²	0	45 Å²	45	0%	0	25%	0.246	C	C	.	.	H	α-helix	trans	-70	-37.3	-177.1	-76.7	-75	0	0	0	112.6	K278 E279 T280 I284 H285 E286 L311 E314 R318 L341	K278-F282 HydrophobicContact CG-CD2 4.36Å; K278-F282 HydrophobicContact CG-CE2 4.25Å; K278-F282 WeakPolarHBondContact O-CD2 3.47Å; K278-F282 PolarHBondContact O-N 2.97Å; E279-F282 PolarHBondContact O-N 3.01Å; T280-F282 PolarHBondContact O-N 3.36Å; F282-I284 VanDerWaalsContact C-N 3.29Å; F282-I284 PolarHBondContact O-N 3.32Å; F282-H285 PolarHBondContact O-N 3.31Å; F282-H285 VanDerWaalsContact O-N 3.16Å; F282-E286 WeakPolarHBondContact O-CB 3.31Å; F282-E286 WeakPolarHBondContact O-CG 3.4Å; F282-E286 PolarHBondContact O-N 3.33Å; F282-L311 HydrophobicContact CD2-CD2 4.42Å; F282-L311 HydrophobicContact CE2-CD2 3.8Å; F282-L311 HydrophobicContact CZ-CD2 4.49Å; F282-L311 WeakPolarHBondContact CZ-O 3.27Å; F282-E314 HydrophobicContact CD2-CB 4.37Å; F282-E314 HydrophobicContact CD2-CG 3.61Å; F282-E314 HydrophobicContact CE1-CG 4.42Å; F282-E314 HydrophobicContact CE2-CB 3.48Å; F282-E314 VanDerWaalsContact CE2-CB 3.48Å; F282-E314 HydrophobicContact CE2-CG 3.18Å; F282-E314 HydrophobicContact CG-CG 4.4Å; F282-E314 HydrophobicContact CZ-CB 3.72Å; F282-E314 HydrophobicContact CZ-CG 3.65Å; F282-R318 VanDerWaalsContact CB-CZ 3.46Å; F282-R318 VanDerWaalsContact CD1-CD 3.42Å; F282-L341 HydrophobicContact CE1-CD2 4.15Å; F282-L341 HydrophobicContact CZ-CD2 4.15Å
283	R	96.5	Very high	94.3	Very high	114 Å²	114	42.6 Å²	42.6	43%	0.43	23%	0.23	S	C	.	.	H	α-helix	trans	-55.5	-46.2	170.5	-175.7	174.8	63.6	-141.2	-2.7	111.3	E279 T280 T287	E279-R283 WeakPolarHBondContact O-CB 3.46Å; E279-R283 PolarHBondContact O-N 3.49Å; T280-R283 PolarHBondContact O-N 3.32Å; T280-R283 PolarHBondContact OG1-NH2 2.83Å; R283-T287 WeakPolarHBondContact O-CB 3.41Å; R283-T287 WeakPolarHBondContact O-CG2 3.32Å; R283-T287 PolarHBondContact O-N 3.15Å; R283-T287 PolarHBondContact O-OG1 3.2Å
284	I	96.6	Very high	94.4	Very high	1 Å²	1	40.4 Å²	40.4	1%	0.005	22%	0.221	C	C	.	.	H	α-helix	trans	-67.1	-44.8	177.1	-60.7	167.1	0	0	0	110	T280 V281 F282 E286 K288 I294 R367 Y387 I389 Y434	T280-I284 HydrophobicContact CG2-CD1 3.86Å; T280-I284 HydrophobicContact CG2-CG1 4.38Å; T280-I284 WeakPolarHBondContact O-CG1 3.37Å; T280-I284 PolarHBondContact O-N 2.65Å; V281-I284 PolarHBondContact O-N 3.28Å; F282-I284 VanDerWaalsContact C-N 3.29Å; F282-I284 PolarHBondContact O-N 3.32Å; I284-E286 VanDerWaalsContact C-N 3.28Å; I284-E286 PolarHBondContact O-N 3.21Å; I284-K288 HydrophobicContact CB-CG 4.49Å; I284-K288 HydrophobicContact CG2-CB 4.17Å; I284-K288 HydrophobicContact CG2-CG 3.89Å; I284-K288 VanDerWaalsContact O-CB 3.28Å; I284-K288 WeakPolarHBondContact O-CB 3.37Å; I284-K288 PolarHBondContact O-N 2.92Å; I284-I294 HydrophobicContact CB-CD1 4.08Å; I284-I294 HydrophobicContact CG2-CD1 3.98Å; I284-I294 HydrophobicContact CG2-CG1 4.25Å; I284-R367 PolarHBondContact O-NH1 2.88Å; I284-Y387 HydrophobicContact CG2-CD1 3.78Å; I284-Y387 HydrophobicContact CG2-CD2 3.66Å; I284-Y387 HydrophobicContact CG2-CE1 4.05Å; I284-Y387 HydrophobicContact CG2-CE2 3.93Å; I284-Y387 HydrophobicContact CG2-CG 3.59Å; I284-I389 HydrophobicContact CD1-CD1 4.13Å; I284-I389 HydrophobicContact CD1-CG1 4.26Å; I284-Y434 HydrophobicContact CD1-CD2 3.71Å; I284-Y434 HydrophobicContact CD1-CE2 3.55Å; I284-Y434 HydrophobicContact CD1-CG 4.49Å; I284-Y434 HydrophobicContact CG1-CE2 4.01Å
285	H	95.1	Very high	94.4	Very high	6 Å²	6	39.9 Å²	39.9	3%	0.028	22%	0.218	C	C	.	.	H	α-helix	trans	-55.4	-41.1	179.4	-167.4	56.6	0	0	0	113.1	V281 F282 Y338 P339 L341	V281-H285 WeakPolarHBondContact O-CB 3.47Å; V281-H285 PolarHBondContact O-N 3.29Å; F282-H285 PolarHBondContact O-N 3.31Å; F282-H285 VanDerWaalsContact O-N 3.16Å; H285-Y338 AromaticContact CD2-CZ 3.97Å; H285-P339 PolarHBondContact CE1-O 2.83Å; H285-P339 PolarHBondContact NE2-O 2.93Å; H285-L341 WeakPolarHBondContact ND1-CD1 3.06Å
286	E	93.2	Very high	94.5	Very high	93 Å²	93	36.5 Å²	36.5	44%	0.435	20%	0.195	S	C	.	.	H	α-helix	trans	-89.5	-29.7	-173.7	-67.6	165.7	177	0	0	113.1	F282 I284 R318 Y338	F282-E286 WeakPolarHBondContact O-CB 3.31Å; F282-E286 WeakPolarHBondContact O-CG 3.4Å; F282-E286 PolarHBondContact O-N 3.33Å; I284-E286 VanDerWaalsContact C-N 3.28Å; I284-E286 PolarHBondContact O-N 3.21Å; E286-R318 VanDerWaalsContact CD-NH1 3.27Å; E286-R318 WeakPolarHBondContact OE1-CD 3.35Å; E286-R318 IonicContact OE1-CZ 3.92Å; E286-R318 IonicContact OE1-NH1 3.99Å; E286-R318 PolarHBondContact OE1-NH1 2.57Å; E286-R318 IonicContact OE2-NH1 3.73Å; E286-R318 PolarHBondContact OE2-NH1 3.27Å; E286-Y338 HydrophobicContact CG-CE2 4.39Å; E286-Y338 PolarHBondContact OE1-OH 2.91Å
287	T	92.9	Very high	94.5	Very high	94 Å²	94	35.3 Å²	35.3	58%	0.577	19%	0.185	S	C	*	.	H	α-helix	trans	-104.3	-19.6	-173	66.3	0	0	0	0	114.9	R283	R283-T287 WeakPolarHBondContact O-CB 3.41Å; R283-T287 WeakPolarHBondContact O-CG2 3.32Å; R283-T287 PolarHBondContact O-N 3.15Å; R283-T287 PolarHBondContact O-OG1 3.2Å
288	K	92.7	Very high	94.5	Very high	69 Å²	69	35.2 Å²	35.2	30%	0.3	18%	0.184	S	C	.	.	S	Bend	trans	-105.7	147.1	-175.7	-58.6	-58.6	-172.4	-171.4	0	112	I284 R367 Y387	I284-K288 HydrophobicContact CB-CG 4.49Å; I284-K288 HydrophobicContact CG2-CB 4.17Å; I284-K288 HydrophobicContact CG2-CG 3.89Å; I284-K288 VanDerWaalsContact O-CB 3.28Å; I284-K288 WeakPolarHBondContact O-CB 3.37Å; I284-K288 PolarHBondContact O-N 2.92Å; K288-R367 PolarHBondContact O-NH2 2.73Å; K288-Y387 HydrophobicContact CB-CE1 4.31Å; K288-Y387 HydrophobicContact CB-CE2 4.42Å; K288-Y387 WeakPolarHBondContact CB-OH 3.22Å; K288-Y387 HydrophobicContact CG-CE1 4.04Å
289	P	87.7	Confident	94.3	Very high	99 Å²	99	33 Å²	33	64%	0.643	18%	0.175	S	C	*	.			trans	-60.5	147	-178.4	24.9	-34.9	0	0	0	113	R367	P289-R367 VanDerWaalsContact C-NH2 3.35Å; P289-R367 PolarHBondContact O-NH2 3.34Å
290	L	86.3	Confident	93.9	Very high	73 Å²	73	29.4 Å²	29.4	38%	0.382	16%	0.161	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.6	159.7	176.6	-64.1	174.5	0	0	0	111.9	P339	L290-P339 HydrophobicContact CD1-CB 4.06Å; L290-P339 HydrophobicContact CD1-CG 4.28Å; L290-P339 HydrophobicContact CD2-CB 3.91Å; L290-P339 HydrophobicContact CD2-CG 4.48Å
291	G	83	Confident	93.3	Very high	28 Å²	28	32.2 Å²	32.2	29%	0.289	17%	0.174	S	C	.	.	T	Hydrogen-bonded Turn	trans	93.6	1.9	-177.7	0	0	0	0	0	115.4	R429	G291-R429 PolarHBondContact O-NH1 2.97Å; G291-R429 PolarHBondContact O-NH2 3.47Å
292	G	89.5	Confident	92.7	Very high	3 Å²	3	36.1 Å²	36.1	3%	0.031	20%	0.195	C	C	.	.			trans	-115.7	124.3	166.1	0	0	0	0	0	111	R367 S386	G292-R367 PolarHBondContact O-NE 3.32Å; G292-S386 WeakPolarHBondContact CA-OG 3.48Å
293	D	94.6	Very high	92.5	Very high	11 Å²	11	37.4 Å²	37.4	6%	0.059	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.7	160.5	-177.3	-67.6	-29.4	0	0	0	111.8	K368 G384 I385 S386 Y387	D293-K368 WeakPolarHBondContact CA-O 3.46Å; D293-K368 HydrophobicContact CB-CB 4.33Å; D293-K368 WeakPolarHBondContact CB-O 3.39Å; D293-K368 WeakPolarHBondContact OD1-CB 3.49Å; D293-K368 PolarHBondContact OD1-N 2.69Å; D293-K368 WeakPolarHBondContact OD2-CE 3.43Å; D293-K368 IonicContact OD2-NZ 2.9Å; D293-G384 WeakPolarHBondContact CB-O 3.45Å; D293-G384 PolarHBondContact N-O 2.83Å; D293-I385 HydrophobicContact CB-CD1 3.83Å; D293-S386 PolarHBondContact O-N 3.11Å; D293-Y387 PolarHBondContact O-N 2.78Å
294	I	96.9	Very high	92.3	Very high	0 Å²	0	32 Å²	32	0%	0	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	132.2	-176.5	-56.1	169.4	0	0	0	110	V281 I284 I296 K368 V369 I370 Y387 I389	V281-I294 HydrophobicContact CG1-CD1 4.02Å; V281-I294 HydrophobicContact CG2-CG2 4.38Å; I284-I294 HydrophobicContact CB-CD1 4.08Å; I284-I294 HydrophobicContact CG2-CD1 3.98Å; I284-I294 HydrophobicContact CG2-CG1 4.25Å; I294-I296 HydrophobicContact CG2-CG1 4Å; I294-K368 PolarHBondContact N-O 2.85Å; I294-V369 HydrophobicContact CB-CG1 4.22Å; I294-V369 HydrophobicContact CB-CG2 4.17Å; I294-V369 HydrophobicContact CD1-CG2 4.12Å; I294-V369 HydrophobicContact CG2-CG1 4.31Å; I294-V369 CarbonylContact O-C 3.59Å; I294-V369 WeakPolarHBondContact O-CA 3.48Å; I294-I370 PolarHBondContact O-N 3.3Å; I294-Y387 CarbonylContact C-O 3.49Å; I294-Y387 WeakPolarHBondContact CA-O 3.31Å; I294-Y387 HydrophobicContact CG1-CD2 4.14Å; I294-Y387 HydrophobicContact CG1-CG 4.45Å; I294-I389 HydrophobicContact CG2-CD1 3.85Å; I294-I389 HydrophobicContact CG2-CG1 4.23Å
295	L	97.1	Very high	92	Very high	2 Å²	2	33.6 Å²	33.6	1%	0.01	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	122.8	169.9	178	62.4	0	0	0	109.8	F297 I370 A372 A376 I382 I385 Y387 V388 I389 R424	L295-F297 HydrophobicContact CD2-CE2 3.77Å; L295-F297 HydrophobicContact CD2-CZ 3.73Å; L295-F297 HydrophobicContact CG-CE2 3.99Å; L295-F297 HydrophobicContact CG-CZ 4.22Å; L295-I370 CarbonylContact C-O 3.57Å; L295-I370 WeakPolarHBondContact CA-O 3.38Å; L295-I370 HydrophobicContact CD1-CB 3.94Å; L295-I370 HydrophobicContact CD1-CG2 3.86Å; L295-A372 HydrophobicContact CD1-CB 3.8Å; L295-A376 HydrophobicContact CD1-CB 4.08Å; L295-A376 HydrophobicContact CD2-CB 4.22Å; L295-I382 HydrophobicContact CD1-CD1 4.33Å; L295-I385 HydrophobicContact CB-CD1 4.01Å; L295-I385 HydrophobicContact CB-CG1 4.34Å; L295-I385 HydrophobicContact CB-CG2 3.81Å; L295-Y387 PolarHBondContact N-O 3.46Å; L295-V388 HydrophobicContact CB-CG2 4.37Å; L295-V388 CarbonylContact O-C 3.46Å; L295-V388 VanDerWaalsContact O-CA 3.27Å; L295-V388 WeakPolarHBondContact O-CA 3.36Å; L295-I389 PolarHBondContact O-N 3.35Å; L295-R424 HydrophobicContact CD2-CB 3.9Å; L295-R424 HydrophobicContact CD2-CG 4.08Å
296	I	98.4	Very high	91.9	Very high	1 Å²	1	37.6 Å²	37.6	1%	0.005	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	132.8	179.9	-43.8	-177.3	0	0	0	108.9	A277 V281 I294 V298 L307 L311 V369 I370 V371 A372 I389	A277-I296 HydrophobicContact CB-CG2 4.07Å; V281-I296 HydrophobicContact CG2-CD1 3.24Å; V281-I296 HydrophobicContact CG2-CG1 4.19Å; I294-I296 HydrophobicContact CG2-CG1 4Å; I296-V298 HydrophobicContact CG2-CG1 4.24Å; I296-L307 HydrophobicContact CD1-CD2 4.1Å; I296-L307 HydrophobicContact CG2-CD2 4.05Å; I296-L311 HydrophobicContact CD1-CD1 4.23Å; I296-V369 HydrophobicContact CD1-CG1 3.86Å; I296-V369 HydrophobicContact CG1-CG1 4.23Å; I296-I370 PolarHBondContact N-O 3.14Å; I296-V371 HydrophobicContact CD1-CG2 4.06Å; I296-A372 PolarHBondContact O-N 3.46Å; I296-I389 CarbonylContact C-O 3.49Å; I296-I389 WeakPolarHBondContact CA-O 3.48Å; I296-I389 HydrophobicContact CB-CB 4.45Å; I296-I389 HydrophobicContact CD1-CD1 4.37Å; I296-I389 HydrophobicContact CG1-CB 4.32Å; I296-I389 HydrophobicContact CG1-CD1 4.19Å; I296-I389 HydrophobicContact CG2-CB 4.1Å; I296-I389 HydrophobicContact CG2-CG2 4.17Å
297	F	98.2	Very high	92	Very high	0 Å²	0	33.1 Å²	33.1	0%	0	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.2	123.5	170.7	-70.6	-83.1	0	0	0	111.1	L295 A372 A376 E377 V388 I389 C391 R421 R424	L295-F297 HydrophobicContact CD2-CE2 3.77Å; L295-F297 HydrophobicContact CD2-CZ 3.73Å; L295-F297 HydrophobicContact CG-CE2 3.99Å; L295-F297 HydrophobicContact CG-CZ 4.22Å; F297-A372 CarbonylContact C-O 3.37Å; F297-A372 WeakPolarHBondContact CA-O 3.41Å; F297-A376 HydrophobicContact CE1-CB 3.82Å; F297-A376 HydrophobicContact CZ-CB 4.08Å; F297-E377 HydrophobicContact CE1-CB 4.07Å; F297-V388 HydrophobicContact CD2-CG1 4.06Å; F297-V388 HydrophobicContact CE2-CG1 4.03Å; F297-I389 PolarHBondContact N-O 3.37Å; F297-C391 WeakPolarHBondContact O-CB 3.21Å; F297-C391 PolarHBondContact O-N 2.88Å; F297-C391 PolarHBondContact O-SG 2.97Å; F297-R421 HydrophobicContact CD1-CG 4.16Å; F297-R421 HydrophobicContact CD2-CB 3.86Å; F297-R421 HydrophobicContact CD2-CG 3.77Å; F297-R421 HydrophobicContact CE1-CG 4.05Å; F297-R421 HydrophobicContact CE2-CB 3.62Å; F297-R421 HydrophobicContact CE2-CG 3.65Å; F297-R421 HydrophobicContact CG-CG 4.02Å; F297-R421 HydrophobicContact CZ-CB 4.16Å; F297-R421 HydrophobicContact CZ-CG 3.8Å; F297-R424 HydrophobicContact CZ-CG 4.36Å
298	V	97.1	Very high	92.2	Very high	1 Å²	1	29 Å²	29	1%	0.006	16%	0.164	C	C	.	.			trans	-130.2	174.9	172.1	-62.7	0	0	0	0	110.1	I274 I296 E303 V304 L307 V371 A372 T373	I274-V298 HydrophobicContact CD1-CG1 3.94Å; I296-V298 HydrophobicContact CG2-CG1 4.24Å; V298-E303 HydrophobicContact CB-CB 4.18Å; V298-E303 HydrophobicContact CG2-CB 4.19Å; V298-V304 HydrophobicContact CG2-CB 4.29Å; V298-V304 HydrophobicContact CG2-CG2 3.38Å; V298-L307 HydrophobicContact CG1-CD2 3.96Å; V298-V371 HydrophobicContact CG1-CG1 4.37Å; V298-V371 HydrophobicContact CG2-CG1 3.78Å; V298-A372 PolarHBondContact N-O 2.68Å; V298-T373 WeakPolarHBondContact O-CA 3.37Å
299	T	93.9	Very high	92.2	Very high	5 Å²	5	28.7 Å²	28.7	3%	0.031	17%	0.171	C	C	.	.	S	Bend	trans	-89.8	-26.8	-162.1	72.1	0	0	0	0	114.9	E303 F393 T410	T299-E303 WeakPolarHBondContact CB-OE2 3.39Å; T299-E303 PolarHBondContact N-OE2 3.11Å; T299-E303 PolarHBondContact OG1-OE1 2.97Å; T299-E303 VanDerWaalsContact OG1-OE1 3.1Å; T299-E303 PolarHBondContact OG1-OE2 3.4Å; T299-F393 HydrophobicContact CG2-CB 3.46Å; T299-F393 VanDerWaalsContact CG2-CB 3.46Å; T299-T410 HydrophobicContact CG2-CG2 3.99Å
300	G	89.5	Confident	92.6	Very high	11 Å²	11	26.9 Å²	26.9	11%	0.113	16%	0.156	C	C	.	.	S	Bend	trans	-161.9	171.4	-174.4	0	0	0	0	0	114.2	N302 E303 V304	G300-N302 PolarHBondContact O-N 2.88Å; G300-E303 PolarHBondContact O-N 3.24Å; G300-V304 WeakPolarHBondContact O-CG2 3.43Å; G300-V304 PolarHBondContact O-N 3.25Å
301	Q	85.1	Confident	93.2	Very high	65 Å²	65	23.4 Å²	23.4	30%	0.304	14%	0.137	S	C	.	.	H	α-helix	trans	-54.1	-46.6	-176.7	172.7	177.5	3	0	0	113.1	E303 V304 S305 H347 S349	Q301-E303 VanDerWaalsContact C-N 3.29Å; Q301-E303 PolarHBondContact O-N 3.05Å; Q301-V304 WeakPolarHBondContact O-CB 3.29Å; Q301-V304 PolarHBondContact O-N 3.32Å; Q301-V304 VanDerWaalsContact O-N 3.09Å; Q301-S305 PolarHBondContact O-N 3.23Å; Q301-S305 PolarHBondContact O-OG 3.27Å; Q301-H347 VanDerWaalsContact CG-CE1 3.48Å; Q301-H347 WeakPolarHBondContact CG-CE1 3.36Å; Q301-S349 PolarHBondContact OE1-OG 3.47Å
302	N	84.7	Confident	93.8	Very high	82 Å²	82	25 Å²	25	44%	0.439	14%	0.139	S	C	.	.	H	α-helix	trans	-56.3	-46.2	-179.1	-76.8	1.2	0	0	0	111.2	G300 S305 Q306 R557	G300-N302 PolarHBondContact O-N 2.88Å; N302-S305 PolarHBondContact O-N 3.22Å; N302-Q306 WeakPolarHBondContact O-CB 3.46Å; N302-Q306 PolarHBondContact O-N 3.03Å; N302-R557 PolarHBondContact ND2-NH2 3.09Å; N302-R557 VanDerWaalsContact ND2-NH2 3.16Å; N302-R557 PolarHBondContact OD1-NH1 2.86Å; N302-R557 PolarHBondContact OD1-NH2 2.98Å; N302-R557 VanDerWaalsContact OD1-NH2 3.1Å
303	E	92.9	Very high	94.1	Very high	28 Å²	28	29.1 Å²	29.1	13%	0.131	16%	0.157	C	C	.	.	H	α-helix	trans	-66.7	-37.7	177.1	-68.6	-178.3	177	0	0	112.2	Y273 I274 V298 T299 G300 Q301 L307	Y273-E303 PolarHBondContact OH-OE1 3.46Å; I274-E303 HydrophobicContact CD1-CB 3.93Å; I274-E303 HydrophobicContact CD1-CG 4.15Å; V298-E303 HydrophobicContact CB-CB 4.18Å; V298-E303 HydrophobicContact CG2-CB 4.19Å; T299-E303 WeakPolarHBondContact CB-OE2 3.39Å; T299-E303 PolarHBondContact N-OE2 3.11Å; T299-E303 PolarHBondContact OG1-OE1 2.97Å; T299-E303 VanDerWaalsContact OG1-OE1 3.1Å; T299-E303 PolarHBondContact OG1-OE2 3.4Å; G300-E303 PolarHBondContact O-N 3.24Å; Q301-E303 VanDerWaalsContact C-N 3.29Å; Q301-E303 PolarHBondContact O-N 3.05Å; E303-L307 VanDerWaalsContact O-CB 3.25Å; E303-L307 WeakPolarHBondContact O-CB 3.4Å; E303-L307 PolarHBondContact O-N 2.84Å
304	V	94	Very high	94.2	Very high	0 Å²	0	30.1 Å²	30.1	0%	0	16%	0.161	C	C	.	.	H	α-helix	trans	-59.2	-52.8	174.4	170.4	0	0	0	0	110.4	V298 G300 Q301 L307 V308 Q345 V371 T373	V298-V304 HydrophobicContact CG2-CB 4.29Å; V298-V304 HydrophobicContact CG2-CG2 3.38Å; G300-V304 WeakPolarHBondContact O-CG2 3.43Å; G300-V304 PolarHBondContact O-N 3.25Å; Q301-V304 WeakPolarHBondContact O-CB 3.29Å; Q301-V304 PolarHBondContact O-N 3.32Å; Q301-V304 VanDerWaalsContact O-N 3.09Å; V304-L307 PolarHBondContact O-N 3.16Å; V304-V308 WeakPolarHBondContact O-CB 3.49Å; V304-V308 WeakPolarHBondContact O-CG2 3.4Å; V304-V308 PolarHBondContact O-N 3.39Å; V304-Q345 HydrophobicContact CG1-CB 3.68Å; V304-Q345 HydrophobicContact CG1-CG 3.73Å; V304-V371 HydrophobicContact CB-CG1 4.29Å; V304-V371 HydrophobicContact CG1-CB 4.23Å; V304-V371 HydrophobicContact CG1-CG1 4.18Å; V304-V371 WeakPolarHBondContact CG1-O 3.31Å; V304-V371 HydrophobicContact CG2-CG1 4.23Å; V304-T373 HydrophobicContact CG2-CG2 3.95Å
305	S	90.3	Very high	94.2	Very high	34 Å²	34	31.8 Å²	31.8	24%	0.238	17%	0.168	C	C	.	.	H	α-helix	trans	-65.4	-42.9	-178.7	-57.3	0	0	0	0	111.4	Q301 N302 V308 S309 Q345	Q301-S305 PolarHBondContact O-N 3.23Å; Q301-S305 PolarHBondContact O-OG 3.27Å; N302-S305 PolarHBondContact O-N 3.22Å; S305-V308 PolarHBondContact O-N 2.87Å; S305-S309 PolarHBondContact O-N 3.48Å; S305-S309 PolarHBondContact O-OG 3.2Å; S305-Q345 PolarHBondContact OG-OE1 3.4Å
306	Q	91.3	Very high	94.1	Very high	90 Å²	90	38.5 Å²	38.5	42%	0.421	19%	0.193	S	C	.	.	H	α-helix	trans	-59.5	-49.9	176.3	-177.3	-172.9	2.3	0	0	111.5	N302 V308 S309 N310	N302-Q306 WeakPolarHBondContact O-CB 3.46Å; N302-Q306 PolarHBondContact O-N 3.03Å; Q306-V308 PolarHBondContact O-N 3.19Å; Q306-S309 PolarHBondContact O-N 2.76Å; Q306-N310 WeakPolarHBondContact O-CB 3.42Å; Q306-N310 PolarHBondContact O-N 3.49Å; Q306-N310 PolarHBondContact O-OD1 2.85Å
307	L	96.4	Very high	93.9	Very high	0 Å²	0	41 Å²	41	0%	0	21%	0.207	C	C	.	.	H	α-helix	trans	-66.7	-38.6	-178.5	-179.3	55.8	0	0	0	111.6	I274 A277 K278 I296 V298 E303 V304 N310 L311 V371	I274-L307 HydrophobicContact CG2-CB 4.38Å; I274-L307 HydrophobicContact CG2-CD1 4.16Å; A277-L307 HydrophobicContact CB-CD2 4.04Å; K278-L307 HydrophobicContact CB-CD1 4.04Å; I296-L307 HydrophobicContact CD1-CD2 4.1Å; I296-L307 HydrophobicContact CG2-CD2 4.05Å; V298-L307 HydrophobicContact CG1-CD2 3.96Å; E303-L307 VanDerWaalsContact O-CB 3.25Å; E303-L307 WeakPolarHBondContact O-CB 3.4Å; E303-L307 PolarHBondContact O-N 2.84Å; V304-L307 PolarHBondContact O-N 3.16Å; L307-N310 PolarHBondContact O-N 2.64Å; L307-L311 HydrophobicContact CD1-CD1 4.37Å; L307-L311 HydrophobicContact CD1-CG 4.1Å; L307-L311 HydrophobicContact CG-CD1 4.14Å; L307-L311 HydrophobicContact CG-CG 4.35Å; L307-L311 WeakPolarHBondContact O-CB 3.41Å; L307-L311 WeakPolarHBondContact O-CG 3.16Å; L307-L311 PolarHBondContact O-N 3.11Å; L307-V371 HydrophobicContact CB-CG1 4.23Å; L307-V371 HydrophobicContact CD2-CG1 3.87Å; L307-V371 HydrophobicContact CD2-CG2 4.34Å; L307-V371 HydrophobicContact CG-CG1 4.29Å; L307-V371 HydrophobicContact CG-CG2 4.29Å
308	V	96.1	Very high	93.7	Very high	7 Å²	7	42.9 Å²	42.9	4%	0.042	21%	0.214	C	C	.	.	H	α-helix	trans	-62	-44.6	174.4	167.4	0	0	0	0	111.7	V304 S305 Q306 N310 L311 I312 C343 Q345 V371	V304-V308 WeakPolarHBondContact O-CB 3.49Å; V304-V308 WeakPolarHBondContact O-CG2 3.4Å; V304-V308 PolarHBondContact O-N 3.39Å; S305-V308 PolarHBondContact O-N 2.87Å; Q306-V308 PolarHBondContact O-N 3.19Å; V308-N310 PolarHBondContact O-N 3.41Å; V308-L311 PolarHBondContact O-N 3.11Å; V308-I312 HydrophobicContact CG1-CD1 3.84Å; V308-I312 WeakPolarHBondContact O-CG1 3.25Å; V308-I312 PolarHBondContact O-N 3.38Å; V308-C343 HydrophobicContact CG1-CB 4.05Å; V308-Q345 HydrophobicContact CB-CG 4.09Å; V308-Q345 HydrophobicContact CG1-CG 4.21Å; V308-Q345 HydrophobicContact CG2-CG 3.66Å; V308-V371 HydrophobicContact CG2-CB 3.75Å; V308-V371 HydrophobicContact CG2-CG2 3.49Å; V308-V371 VanDerWaalsContact CG2-CG2 3.49Å
309	S	94	Very high	93.4	Very high	63 Å²	63	46.7 Å²	46.7	44%	0.441	23%	0.23	S	C	.	.	H	α-helix	trans	-59.8	-46.4	174.9	-65.3	0	0	0	0	111.6	S305 Q306 L311 I312 E313	S305-S309 PolarHBondContact O-N 3.48Å; S305-S309 PolarHBondContact O-OG 3.2Å; Q306-S309 PolarHBondContact O-N 2.76Å; S309-L311 VanDerWaalsContact C-N 3.33Å; S309-L311 PolarHBondContact O-N 2.92Å; S309-I312 PolarHBondContact O-N 2.88Å; S309-E313 PolarHBondContact O-N 2.76Å
310	N	95.9	Very high	93.3	Very high	61 Å²	61	51.9 Å²	51.9	33%	0.326	25%	0.254	S	S	.	.	H	α-helix	trans	-61.3	-38.9	177.8	-69.5	-9.1	0	0	0	112.6	K278 Q306 L307 V308 E314	K278-N310 HydrophobicContact CD-CB 4.2Å; Q306-N310 WeakPolarHBondContact O-CB 3.42Å; Q306-N310 PolarHBondContact O-N 3.49Å; Q306-N310 PolarHBondContact O-OD1 2.85Å; L307-N310 PolarHBondContact O-N 2.64Å; V308-N310 PolarHBondContact O-N 3.41Å; N310-E314 WeakPolarHBondContact O-CB 3.45Å; N310-E314 PolarHBondContact O-N 2.83Å
311	L	98	Very high	93.2	Very high	0 Å²	0	59 Å²	59	0%	0	28%	0.278	C	S	.	.	H	α-helix	trans	-67.6	-42.2	177.4	-73.7	171.2	0	0	0	111.9	K278 V281 F282 I296 L307 V308 S309 E313 Y315 V369 V371	K278-L311 HydrophobicContact CG-CD2 4.04Å; V281-L311 HydrophobicContact CB-CD2 3.84Å; V281-L311 HydrophobicContact CG1-CD2 3.76Å; V281-L311 HydrophobicContact CG2-CD2 4.02Å; F282-L311 HydrophobicContact CD2-CD2 4.42Å; F282-L311 HydrophobicContact CE2-CD2 3.8Å; F282-L311 HydrophobicContact CZ-CD2 4.49Å; F282-L311 WeakPolarHBondContact CZ-O 3.27Å; I296-L311 HydrophobicContact CD1-CD1 4.23Å; L307-L311 HydrophobicContact CD1-CD1 4.37Å; L307-L311 HydrophobicContact CD1-CG 4.1Å; L307-L311 HydrophobicContact CG-CD1 4.14Å; L307-L311 HydrophobicContact CG-CG 4.35Å; L307-L311 WeakPolarHBondContact O-CB 3.41Å; L307-L311 WeakPolarHBondContact O-CG 3.16Å; L307-L311 PolarHBondContact O-N 3.11Å; V308-L311 PolarHBondContact O-N 3.11Å; S309-L311 VanDerWaalsContact C-N 3.33Å; S309-L311 PolarHBondContact O-N 2.92Å; L311-E313 VanDerWaalsContact C-N 3.34Å; L311-Y315 WeakPolarHBondContact O-CB 3.38Å; L311-Y315 PolarHBondContact O-N 2.88Å; L311-V369 HydrophobicContact CD1-CG1 4.03Å; L311-V371 HydrophobicContact CD1-CG2 3.87Å
312	I	96.8	Very high	93.3	Very high	61 Å²	61	58.8 Å²	58.8	31%	0.313	28%	0.275	S	S	.	.	H	α-helix	trans	-63.5	-44.1	178.1	-69	166.5	0	0	0	110.3	V308 S309 Y315 R316 C343	V308-I312 HydrophobicContact CG1-CD1 3.84Å; V308-I312 WeakPolarHBondContact O-CG1 3.25Å; V308-I312 PolarHBondContact O-N 3.38Å; S309-I312 PolarHBondContact O-N 2.88Å; I312-Y315 PolarHBondContact O-N 3.39Å; I312-R316 WeakPolarHBondContact O-CG 3.37Å; I312-R316 PolarHBondContact O-N 2.87Å; I312-R316 VanDerWaalsContact O-N 3.14Å; I312-C343 HydrophobicContact CG1-CB 4.18Å
313	E	95.8	Very high	93.3	Very high	90 Å²	90	57.9 Å²	57.9	42%	0.421	27%	0.271	S	S	.	.	H	α-helix	trans	-68.1	-46.8	-179.6	-170.1	58.3	-161.2	0	0	112.2	S309 L311 Y315 R316 N317	S309-E313 PolarHBondContact O-N 2.76Å; L311-E313 VanDerWaalsContact C-N 3.34Å; E313-Y315 VanDerWaalsContact C-N 3.27Å; E313-Y315 PolarHBondContact O-N 2.94Å; E313-R316 WeakPolarHBondContact O-CB 3.33Å; E313-R316 PolarHBondContact O-N 3.36Å; E313-R316 VanDerWaalsContact O-N 3.14Å; E313-R316 IonicContact OE2-CZ 3.94Å; E313-R316 IonicContact OE2-NH1 3.13Å; E313-R316 PolarHBondContact OE2-NH1 2.73Å; E313-N317 PolarHBondContact O-N 3.35Å; E313-N317 VanDerWaalsContact O-N 3.1Å; E313-N317 PolarHBondContact O-ND2 2.98Å
314	E	96.2	Very high	92.9	Very high	31 Å²	31	60.3 Å²	60.3	15%	0.145	28%	0.284	C	S	.	.	H	α-helix	trans	-60.6	-37.5	175.6	-174.4	71.2	-143.9	0	0	111.8	K278 F282 N310 R316 N317 R318	K278-E314 HydrophobicContact CD-CB 4.21Å; K278-E314 HydrophobicContact CD-CG 4.27Å; K278-E314 IonicContact NZ-OE2 3.77Å; K278-E314 PolarHBondContact NZ-OE2 3.31Å; F282-E314 HydrophobicContact CD2-CB 4.37Å; F282-E314 HydrophobicContact CD2-CG 3.61Å; F282-E314 HydrophobicContact CE1-CG 4.42Å; F282-E314 HydrophobicContact CE2-CB 3.48Å; F282-E314 VanDerWaalsContact CE2-CB 3.48Å; F282-E314 HydrophobicContact CE2-CG 3.18Å; F282-E314 HydrophobicContact CG-CG 4.4Å; F282-E314 HydrophobicContact CZ-CB 3.72Å; F282-E314 HydrophobicContact CZ-CG 3.65Å; N310-E314 WeakPolarHBondContact O-CB 3.45Å; N310-E314 PolarHBondContact O-N 2.83Å; E314-R316 PolarHBondContact O-N 3.45Å; E314-N317 PolarHBondContact O-N 2.88Å; E314-R318 HydrophobicContact CG-CG 4.47Å; E314-R318 WeakPolarHBondContact O-CB 3.22Å; E314-R318 WeakPolarHBondContact O-CG 3.14Å; E314-R318 PolarHBondContact O-N 2.52Å; E314-R318 IonicContact OE1-CZ 2.8Å; E314-R318 IonicContact OE1-NE 3.55Å; E314-R318 PolarHBondContact OE1-NE 2.65Å; E314-R318 IonicContact OE1-NH2 2.61Å
315	Y	96.6	Very high	92.2	Very high	36 Å²	36	64.4 Å²	64.4	14%	0.141	31%	0.309	C	S	.	.	H	α-helix	trans	-62.5	-42.1	175.4	167.9	-94.1	0	0	0	112	L311 I312 E313 K319 Y338 P340 L341	L311-Y315 WeakPolarHBondContact O-CB 3.38Å; L311-Y315 PolarHBondContact O-N 2.88Å; I312-Y315 PolarHBondContact O-N 3.39Å; E313-Y315 VanDerWaalsContact C-N 3.27Å; E313-Y315 PolarHBondContact O-N 2.94Å; Y315-K319 HydrophobicContact CE1-CD 4.19Å; Y315-K319 WeakPolarHBondContact O-CB 3.47Å; Y315-K319 PolarHBondContact O-N 3.27Å; Y315-Y338 HydrophobicContact CD2-CD1 4.14Å; Y315-Y338 AromaticContact CD2-CE1 3.67Å; Y315-Y338 HydrophobicContact CD2-CE1 3.67Å; Y315-Y338 AromaticContact CE2-CD1 3.58Å; Y315-Y338 HydrophobicContact CE2-CD1 3.58Å; Y315-Y338 AromaticContact CE2-CE1 3.58Å; Y315-Y338 HydrophobicContact CE2-CE1 3.58Å; Y315-P340 WeakPolarHBondContact OH-CA 3.39Å; Y315-L341 HydrophobicContact CD2-CB 3.43Å; Y315-L341 VanDerWaalsContact CD2-CB 3.43Å; Y315-L341 HydrophobicContact CD2-CD2 4.19Å; Y315-L341 HydrophobicContact CD2-CG 4.46Å; Y315-L341 HydrophobicContact CE2-CB 3.67Å; Y315-L341 HydrophobicContact CG-CB 4.1Å; Y315-L341 HydrophobicContact CG-CD2 4.48Å
316	R	95.2	Very high	91.2	Very high	142 Å²	142	65.7 Å²	65.7	54%	0.536	31%	0.312	S	S	.	.	H	α-helix	trans	-60.2	-49.3	175.7	-70.5	175.1	-173.6	141.7	-2.7	110.7	I312 E313 E314 R318 K319 E320	I312-R316 WeakPolarHBondContact O-CG 3.37Å; I312-R316 PolarHBondContact O-N 2.87Å; I312-R316 VanDerWaalsContact O-N 3.14Å; E313-R316 WeakPolarHBondContact O-CB 3.33Å; E313-R316 PolarHBondContact O-N 3.36Å; E313-R316 VanDerWaalsContact O-N 3.14Å; E313-R316 IonicContact OE2-CZ 3.94Å; E313-R316 IonicContact OE2-NH1 3.13Å; E313-R316 PolarHBondContact OE2-NH1 2.73Å; E314-R316 PolarHBondContact O-N 3.45Å; R316-R318 PolarHBondContact O-N 3.03Å; R316-K319 PolarHBondContact O-N 2.97Å; R316-E320 WeakPolarHBondContact O-CB 3.48Å; R316-E320 PolarHBondContact O-N 2.94Å
317	N	94.6	Very high	89.9	Confident	55 Å²	55	68.8 Å²	68.8	29%	0.294	33%	0.326	S	S	.	.	H	α-helix	trans	-60.8	-45.3	-179.8	-67.4	-25.4	0	0	0	112.1	E313 E314 E320 R321	E313-N317 PolarHBondContact O-N 3.35Å; E313-N317 VanDerWaalsContact O-N 3.1Å; E313-N317 PolarHBondContact O-ND2 2.98Å; E314-N317 PolarHBondContact O-N 2.88Å; N317-E320 PolarHBondContact O-N 3.3Å; N317-R321 WeakPolarHBondContact O-CG 3.3Å; N317-R321 PolarHBondContact O-N 2.63Å
318	R	93.7	Very high	88.3	Confident	38 Å²	38	76.7 Å²	76.7	14%	0.143	36%	0.363	C	S	.	.	H	α-helix	trans	-69.1	-39.5	179	-71.8	179.1	176.1	-126.8	9.9	112.3	E279 F282 E286 E314 R316 R321 F322	E279-R318 IonicContact OE1-NH2 2.78Å; E279-R318 PolarHBondContact OE1-NH2 2.89Å; E279-R318 IonicContact OE2-NH2 2.96Å; E279-R318 PolarHBondContact OE2-NH2 2.88Å; E279-R318 VanDerWaalsContact OE2-NH2 3.11Å; F282-R318 VanDerWaalsContact CB-CZ 3.46Å; F282-R318 VanDerWaalsContact CD1-CD 3.42Å; E286-R318 VanDerWaalsContact CD-NH1 3.27Å; E286-R318 WeakPolarHBondContact OE1-CD 3.35Å; E286-R318 IonicContact OE1-CZ 3.92Å; E286-R318 IonicContact OE1-NH1 3.99Å; E286-R318 PolarHBondContact OE1-NH1 2.57Å; E286-R318 IonicContact OE2-NH1 3.73Å; E286-R318 PolarHBondContact OE2-NH1 3.27Å; E314-R318 HydrophobicContact CG-CG 4.47Å; E314-R318 WeakPolarHBondContact O-CB 3.22Å; E314-R318 WeakPolarHBondContact O-CG 3.14Å; E314-R318 PolarHBondContact O-N 2.52Å; E314-R318 IonicContact OE1-CZ 2.8Å; E314-R318 IonicContact OE1-NE 3.55Å; E314-R318 PolarHBondContact OE1-NE 2.65Å; E314-R318 IonicContact OE1-NH2 2.61Å; R316-R318 PolarHBondContact O-N 3.03Å; R318-R321 PolarHBondContact O-N 2.92Å; R318-F322 WeakPolarHBondContact O-CB 3.44Å; R318-F322 PolarHBondContact O-N 3.01Å
319	K	91	Very high	86.5	Confident	81 Å²	81	79.6 Å²	79.6	35%	0.352	38%	0.384	S	S	.	.	H	α-helix	trans	-60.4	-45.3	173.8	177.1	178.5	176.1	-173.5	0	111.3	Y315 R316 F322 L323 Y338	Y315-K319 HydrophobicContact CE1-CD 4.19Å; Y315-K319 WeakPolarHBondContact O-CB 3.47Å; Y315-K319 PolarHBondContact O-N 3.27Å; R316-K319 PolarHBondContact O-N 2.97Å; K319-F322 PolarHBondContact O-N 2.87Å; K319-L323 HydrophobicContact CG-CD1 4.08Å; K319-L323 VanDerWaalsContact O-CG 3.32Å; K319-L323 WeakPolarHBondContact O-CG 3.42Å; K319-L323 PolarHBondContact O-N 3.07Å; K319-Y338 HydrophobicContact CB-CD1 3.87Å; K319-Y338 HydrophobicContact CB-CE1 4.49Å; K319-Y338 HydrophobicContact CB-CG 4.33Å; K319-Y338 HydrophobicContact CG-CD1 4.36Å
320	E	90.5	Very high	84.6	Confident	114 Å²	114	82 Å²	82	53%	0.533	40%	0.4	S	S	.	.	H	α-helix	trans	-61	-48	177.7	-175.3	179.6	-174	0	0	111.4	R316 N317 F322 L323 N324	R316-E320 WeakPolarHBondContact O-CB 3.48Å; R316-E320 PolarHBondContact O-N 2.94Å; N317-E320 PolarHBondContact O-N 3.3Å; E320-F322 VanDerWaalsContact C-N 3.35Å; E320-F322 PolarHBondContact O-N 2.73Å; E320-L323 PolarHBondContact O-N 3.12Å; E320-N324 VanDerWaalsContact O-CG 3.28Å; E320-N324 PolarHBondContact O-N 2.9Å
321	R	88.9	Confident	82.5	Confident	162 Å²	162	88.7 Å²	88.7	61%	0.611	43%	0.427	S	S	*	.	H	α-helix	trans	-57.2	-46	175.5	-70.9	176.3	-168.1	170.9	4.5	112.2	N317 R318 L323 N324 T325	N317-R321 WeakPolarHBondContact O-CG 3.3Å; N317-R321 PolarHBondContact O-N 2.63Å; R318-R321 PolarHBondContact O-N 2.92Å; R321-L323 VanDerWaalsContact C-N 3.33Å; R321-L323 PolarHBondContact O-N 2.86Å; R321-N324 PolarHBondContact O-N 2.72Å; R321-T325 PolarHBondContact O-N 3.19Å; R321-T325 PolarHBondContact O-OG1 3.18Å; R321-T325 VanDerWaalsContact O-OG1 3.08Å
322	F	86.6	Confident	80.3	Confident	59 Å²	59	93.5 Å²	93.5	26%	0.259	46%	0.456	S	S	.	.	H	α-helix	trans	-58.8	-43.7	177.9	179.4	-91.5	0	0	0	112.1	R318 K319 E320 Q326 Y338	R318-F322 WeakPolarHBondContact O-CB 3.44Å; R318-F322 PolarHBondContact O-N 3.01Å; K319-F322 PolarHBondContact O-N 2.87Å; E320-F322 VanDerWaalsContact C-N 3.35Å; E320-F322 PolarHBondContact O-N 2.73Å; F322-Q326 HydrophobicContact CD1-CG 4.32Å; F322-Q326 HydrophobicContact CE1-CG 4Å; F322-Q326 HydrophobicContact CZ-CG 4.27Å; F322-Q326 VanDerWaalsContact CZ-NE2 3.25Å; F322-Q326 VanDerWaalsContact O-CG 3.29Å; F322-Q326 WeakPolarHBondContact O-CG 3.25Å; F322-Q326 PolarHBondContact O-N 2.84Å; F322-Q326 VanDerWaalsContact O-N 3.16Å; F322-Y338 HydrophobicContact CB-CD2 3.95Å; F322-Y338 HydrophobicContact CB-CG 4.46Å; F322-Y338 HydrophobicContact CD1-CD2 4.34Å; F322-Y338 HydrophobicContact CD2-CD2 4.07Å; F322-Y338 AromaticContact CG-CD2 3.86Å; F322-Y338 HydrophobicContact CG-CD2 3.86Å; F322-Y338 HydrophobicContact CG-CG 4.44Å
323	L	84.7	Confident	78.4	Confident	64 Å²	64	101.1 Å²	101.1	34%	0.335	49%	0.487	S	S	.	.	H	α-helix	trans	-67.3	-39	178.3	-69	171.4	0	0	0	112.1	K319 E320 R321 Q326 Q327	K319-L323 HydrophobicContact CG-CD1 4.08Å; K319-L323 VanDerWaalsContact O-CG 3.32Å; K319-L323 WeakPolarHBondContact O-CG 3.42Å; K319-L323 PolarHBondContact O-N 3.07Å; E320-L323 PolarHBondContact O-N 3.12Å; R321-L323 VanDerWaalsContact C-N 3.33Å; R321-L323 PolarHBondContact O-N 2.86Å; L323-Q326 PolarHBondContact O-N 2.75Å; L323-Q327 PolarHBondContact O-N 2.86Å
324	N	84.6	Confident	76.4	Confident	78 Å²	78	101.7 Å²	101.7	42%	0.417	49%	0.492	S	S	.	.	H	α-helix	trans	-66.6	-40.6	177.8	-68.9	-12.6	0	0	0	112	E320 R321 Q326 Q327	E320-N324 VanDerWaalsContact O-CG 3.28Å; E320-N324 PolarHBondContact O-N 2.9Å; R321-N324 PolarHBondContact O-N 2.72Å; N324-Q326 VanDerWaalsContact C-N 3.34Å; N324-Q326 PolarHBondContact O-N 3.31Å; N324-Q327 PolarHBondContact O-N 3.17Å
325	T	79.4	Confident	74.6	Confident	86 Å²	86	104.6 Å²	104.6	53%	0.528	51%	0.514	S	S	.	.	H	α-helix	trans	-66.9	-34.5	176.4	-54.1	0	0	0	0	112.4	R321 Q328 S329	R321-T325 PolarHBondContact O-N 3.19Å; R321-T325 PolarHBondContact O-OG1 3.18Å; R321-T325 VanDerWaalsContact O-OG1 3.08Å; T325-Q328 PolarHBondContact O-N 3.39Å; T325-S329 PolarHBondContact O-N 3.17Å; T325-S329 PolarHBondContact O-OG 3.07Å
326	Q	69.5	Low	73.1	Confident	61 Å²	61	108.7 Å²	108.7	29%	0.285	54%	0.543	S	S	.	.	H	α-helix	trans	-65.7	-39.1	176.1	-77.3	-108.3	1.3	0	0	112.7	F322 L323 N324 Q328 S329 P335	F322-Q326 HydrophobicContact CD1-CG 4.32Å; F322-Q326 HydrophobicContact CE1-CG 4Å; F322-Q326 HydrophobicContact CZ-CG 4.27Å; F322-Q326 VanDerWaalsContact CZ-NE2 3.25Å; F322-Q326 VanDerWaalsContact O-CG 3.29Å; F322-Q326 WeakPolarHBondContact O-CG 3.25Å; F322-Q326 PolarHBondContact O-N 2.84Å; F322-Q326 VanDerWaalsContact O-N 3.16Å; L323-Q326 PolarHBondContact O-N 2.75Å; N324-Q326 VanDerWaalsContact C-N 3.34Å; N324-Q326 PolarHBondContact O-N 3.31Å; Q326-Q328 PolarHBondContact O-N 2.89Å; Q326-S329 PolarHBondContact O-N 3.38Å; Q326-S329 VanDerWaalsContact O-N 3.13Å; Q326-P335 PolarHBondContact NE2-O 3.37Å; Q326-P335 VanDerWaalsContact NE2-O 3.1Å
327	Q	63.8	Low	72.3	Confident	155 Å²	155	106.1 Å²	106.1	72%	0.724	54%	0.543	S	S	*	.	H	α-helix	trans	-61.9	-26.5	177.7	-72.5	-179.7	9	0	0	112.9	L323 N324	L323-Q327 PolarHBondContact O-N 2.86Å; N324-Q327 PolarHBondContact O-N 3.17Å
328	Q	61.6	Low	71.9	Confident	166 Å²	166	104.3 Å²	104.3	78%	0.776	53%	0.532	S	S	*	.	H	α-helix	trans	-86.3	-16.1	178	-66.7	179.3	-5.1	0	0	114	T325 Q326	T325-Q328 PolarHBondContact O-N 3.39Å; Q326-Q328 PolarHBondContact O-N 2.89Å
329	S	59	Low	71.7	Confident	68 Å²	68	104.3 Å²	104.3	48%	0.476	54%	0.537	S	S	.	.			trans	-116.8	62.9	-170.5	-58.4	0	0	0	0	112.4	T325 Q326 K331	T325-S329 PolarHBondContact O-N 3.17Å; T325-S329 PolarHBondContact O-OG 3.07Å; Q326-S329 PolarHBondContact O-N 3.38Å; Q326-S329 VanDerWaalsContact O-N 3.13Å; S329-K331 PolarHBondContact O-N 3.47Å
330	S	53.4	Low	71.8	Confident	113 Å²	113	102.8 Å²	102.8	79%	0.79	54%	0.535	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.1	17.2	-169.5	-1.3	0	0	0	0	116.6
331	K	53	Low	72	Confident	203 Å²	203	98.4 Å²	98.4	88%	0.883	52%	0.515	S	S	*	.	T	Hydrogen-bonded Turn	trans	-131	5.9	-170.6	-82.7	-173.4	177.8	178.3	0	118.1	S329	S329-K331 PolarHBondContact O-N 3.47Å
332	T	52.2	Low	72.3	Confident	100 Å²	100	93.9 Å²	93.9	61%	0.613	50%	0.498	S	S	*	.			trans	-129.7	134.6	177	49.7	0	0	0	0	113.6	L334	T332-L334 PolarHBondContact O-N 3.36Å
333	K	55.4	Low	72.7	Confident	222 Å²	222	92 Å²	92	97%	0.965	49%	0.493	S	S	*	.			trans	-70.2	64	179.6	-69.9	-179.4	176.3	178.5	0	112
334	L	54.9	Low	73.2	Confident	102 Å²	102	89.7 Å²	89.7	53%	0.534	48%	0.481	S	S	.	.			trans	-91.3	157.5	169	-90.4	91	0	0	0	110.9	T332 T336	T332-L334 PolarHBondContact O-N 3.36Å; L334-T336 PolarHBondContact O-N 3.16Å
335	P	58.6	Low	73.7	Confident	92 Å²	92	89 Å²	89	60%	0.597	48%	0.475	S	S	*	.			trans	-53	131.6	-177.1	17.8	-30.7	0	0	0	111.9	Q326 T337	Q326-P335 PolarHBondContact NE2-O 3.37Å; Q326-P335 VanDerWaalsContact NE2-O 3.1Å; P335-T337 PolarHBondContact O-N 3.04Å
336	T	65.5	Low	74.3	Confident	121 Å²	121	85.1 Å²	85.1	74%	0.742	45%	0.451	S	S	*	.	S	Bend	trans	-72.3	-6.6	-170.5	50	0	0	0	0	114.3	L334	L334-T336 PolarHBondContact O-N 3.16Å
337	T	78	Confident	75.1	Confident	89 Å²	89	82.5 Å²	82.5	55%	0.546	44%	0.438	S	S	.	.	S	Bend	trans	-145.1	135.8	-174.8	-6.3	0	0	0	0	111.6	P335	P335-T337 PolarHBondContact O-N 3.04Å
338	Y	86.5	Confident	75.9	Confident	16 Å²	16	77.7 Å²	77.7	6%	0.063	43%	0.431	C	S	.	.	P	Polyproline II helix	trans	-64.2	126.4	169.7	-170.4	-106.7	0	0	0	109.3	H285 E286 Y315 K319 F322	H285-Y338 AromaticContact CD2-CZ 3.97Å; E286-Y338 HydrophobicContact CG-CE2 4.39Å; E286-Y338 PolarHBondContact OE1-OH 2.91Å; Y315-Y338 HydrophobicContact CD2-CD1 4.14Å; Y315-Y338 AromaticContact CD2-CE1 3.67Å; Y315-Y338 HydrophobicContact CD2-CE1 3.67Å; Y315-Y338 AromaticContact CE2-CD1 3.58Å; Y315-Y338 HydrophobicContact CE2-CD1 3.58Å; Y315-Y338 AromaticContact CE2-CE1 3.58Å; Y315-Y338 HydrophobicContact CE2-CE1 3.58Å; K319-Y338 HydrophobicContact CB-CD1 3.87Å; K319-Y338 HydrophobicContact CB-CE1 4.49Å; K319-Y338 HydrophobicContact CB-CG 4.33Å; K319-Y338 HydrophobicContact CG-CD1 4.36Å; F322-Y338 HydrophobicContact CB-CD2 3.95Å; F322-Y338 HydrophobicContact CB-CG 4.46Å; F322-Y338 HydrophobicContact CD1-CD2 4.34Å; F322-Y338 HydrophobicContact CD2-CD2 4.07Å; F322-Y338 AromaticContact CG-CD2 3.86Å; F322-Y338 HydrophobicContact CG-CD2 3.86Å; F322-Y338 HydrophobicContact CG-CG 4.44Å
339	P	89.2	Confident	76.5	Confident	38 Å²	38	72 Å²	72	25%	0.247	41%	0.409	C	S	.	.	P	Polyproline II helix	trans	-58.9	129.5	-173.1	-26.4	34.3	0	0	0	112.5	H285 L290	H285-P339 PolarHBondContact CE1-O 2.83Å; H285-P339 PolarHBondContact NE2-O 2.93Å; L290-P339 HydrophobicContact CD1-CB 4.06Å; L290-P339 HydrophobicContact CD1-CG 4.28Å; L290-P339 HydrophobicContact CD2-CB 3.91Å; L290-P339 HydrophobicContact CD2-CG 4.48Å
340	P	93	Very high	77.3	Confident	49 Å²	49	69.6 Å²	69.6	32%	0.318	39%	0.391	S	S	.	.	P	Polyproline II helix	trans	-64.7	138.4	-178	20.9	-29.7	0	0	0	113.1	Y315 S365 C366 R367	Y315-P340 WeakPolarHBondContact OH-CA 3.39Å; P340-S365 WeakPolarHBondContact CD-O 3.43Å; P340-C366 HydrophobicContact CB-CB 4.24Å; P340-C366 HydrophobicContact CG-CB 3.78Å; P340-C366 WeakPolarHBondContact O-CA 2.98Å; P340-C366 PolarHBondContact O-SG 3.4Å; P340-R367 PolarHBondContact O-N 3.11Å
341	L	94.3	Very high	78.2	Confident	22 Å²	22	66.2 Å²	66.2	12%	0.115	37%	0.366	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	122.5	178	-166.2	75.6	0	0	0	110.2	F282 H285 Y315 R367 V369	F282-L341 HydrophobicContact CE1-CD2 4.15Å; F282-L341 HydrophobicContact CZ-CD2 4.15Å; H285-L341 WeakPolarHBondContact ND1-CD1 3.06Å; Y315-L341 HydrophobicContact CD2-CB 3.43Å; Y315-L341 VanDerWaalsContact CD2-CB 3.43Å; Y315-L341 HydrophobicContact CD2-CD2 4.19Å; Y315-L341 HydrophobicContact CD2-CG 4.46Å; Y315-L341 HydrophobicContact CE2-CB 3.67Å; Y315-L341 HydrophobicContact CG-CB 4.1Å; Y315-L341 HydrophobicContact CG-CD2 4.48Å; L341-R367 WeakPolarHBondContact CA-O 3.43Å; L341-R367 HydrophobicContact CD1-CB 4.22Å; L341-R367 HydrophobicContact CD1-CG 4.37Å; L341-V369 HydrophobicContact CD1-CG2 3.44Å; L341-V369 VanDerWaalsContact CD1-CG2 3.44Å; L341-V369 HydrophobicContact CD2-CG2 4.4Å; L341-V369 HydrophobicContact CG-CG2 3.99Å
342	R	95	Very high	79.1	Confident	67 Å²	67	59.5 Å²	59.5	25%	0.253	34%	0.338	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	108.9	175.2	-173	178.7	-170.7	-164.3	2.7	110.2	R357 E360 R367 K368 V369	R342-R357 VanDerWaalsContact NH2-NH2 3.11Å; R342-E360 IonicContact CZ-OE2 3.3Å; R342-E360 IonicContact NH1-OE2 2.7Å; R342-E360 PolarHBondContact NH1-OE2 3.12Å; R342-E360 IonicContact NH2-OE2 2.7Å; R342-E360 PolarHBondContact NH2-OE2 2.91Å; R342-R367 PolarHBondContact N-O 2.87Å; R342-K368 CarbonylContact O-C 3.22Å; R342-K368 WeakPolarHBondContact O-CA 3.39Å; R342-V369 PolarHBondContact O-N 3.49Å
343	C	96.1	Very high	80.3	Confident	21 Å²	21	60 Å²	60	14%	0.142	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.7	130.8	178	-59.9	0	0	0	0	111.2	V308 I312 V369	V308-C343 HydrophobicContact CG1-CB 4.05Å; I312-C343 HydrophobicContact CG1-CB 4.18Å; C343-V369 CarbonylContact C-O 3.56Å; C343-V369 WeakPolarHBondContact CA-O 3.48Å
344	L	95	Very high	81.5	Confident	15 Å²	15	50.9 Å²	50.9	8%	0.079	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	149.6	178.9	-63.2	176.3	0	0	0	110.9	K368 V369 I370 V371	L344-K368 HydrophobicContact CD1-CD 3.82Å; L344-K368 HydrophobicContact CD1-CG 4.13Å; L344-V369 PolarHBondContact N-O 3.06Å; L344-I370 HydrophobicContact CB-CG1 4.37Å; L344-I370 WeakPolarHBondContact O-CA 3.34Å; L344-V371 PolarHBondContact O-N 2.82Å
345	Q	93.6	Very high	82.9	Confident	64 Å²	64	47 Å²	47	30%	0.299	27%	0.273	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99	146	177.5	-63.2	-178.5	50.2	0	0	110.2	V304 S305 V308 L350	V304-Q345 HydrophobicContact CG1-CB 3.68Å; V304-Q345 HydrophobicContact CG1-CG 3.73Å; S305-Q345 PolarHBondContact OG-OE1 3.4Å; V308-Q345 HydrophobicContact CB-CG 4.09Å; V308-Q345 HydrophobicContact CG1-CG 4.21Å; V308-Q345 HydrophobicContact CG2-CG 3.66Å; Q345-L350 HydrophobicContact CB-CD1 3.98Å; Q345-L350 WeakPolarHBondContact O-CD1 3.43Å
346	L	91.9	Very high	84.2	Confident	3 Å²	3	44 Å²	44	2%	0.016	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.6	101.5	171.9	-176.9	58.8	0	0	0	112.1	Q355 I358 I370 V371 A372 T373 V375 A376 I382	L346-Q355 HydrophobicContact CD1-CB 4.27Å; L346-Q355 HydrophobicContact CD1-CG 4.23Å; L346-I358 HydrophobicContact CB-CG2 4.38Å; L346-I358 HydrophobicContact CD1-CD1 4.04Å; L346-I358 HydrophobicContact CD1-CG2 4.36Å; L346-I358 HydrophobicContact CD2-CD1 3.69Å; L346-I358 HydrophobicContact CD2-CG2 4.34Å; L346-I370 HydrophobicContact CB-CG2 3.91Å; L346-I370 HydrophobicContact CD2-CG2 4.28Å; L346-V371 PolarHBondContact N-O 3.29Å; L346-A372 HydrophobicContact CB-CB 3.88Å; L346-A372 HydrophobicContact CD2-CB 4.14Å; L346-A372 HydrophobicContact CG-CB 4.26Å; L346-A372 CarbonylContact O-C 3.51Å; L346-A372 WeakPolarHBondContact O-CA 3.23Å; L346-T373 PolarHBondContact O-N 3.38Å; L346-T373 PolarHBondContact O-OG1 3.16Å; L346-V375 HydrophobicContact CD1-CG1 4.3Å; L346-V375 HydrophobicContact CG-CG1 4.36Å; L346-A376 HydrophobicContact CD2-CB 3.77Å; L346-I382 HydrophobicContact CD2-CD1 4.14Å
347	H	87.8	Confident	85.2	Confident	6 Å²	6	42.8 Å²	42.8	3%	0.028	23%	0.234	C	C	.	.			trans	-145	161.2	173.5	59.2	85.7	0	0	0	110.9	Q301 S349 L350 T373	Q301-H347 VanDerWaalsContact CG-CE1 3.48Å; Q301-H347 WeakPolarHBondContact CG-CE1 3.36Å; H347-S349 PolarHBondContact CE1-OG 3.1Å; H347-S349 PolarHBondContact ND1-OG 3.43Å; H347-S349 PolarHBondContact O-N 3.1Å; H347-S349 VanDerWaalsContact O-N 3.12Å; H347-L350 WeakPolarHBondContact NE2-CD2 3.39Å; H347-L350 WeakPolarHBondContact NE2-CG 3.46Å; H347-L350 WeakPolarHBondContact O-CB 3.41Å; H347-L350 PolarHBondContact O-N 3.08Å; H347-T373 HydrophobicContact CB-CG2 3.93Å
348	G	79.4	Confident	85.7	Confident	55 Å²	55	38.7 Å²	38.7	57%	0.567	21%	0.209	S	C	*	.	T	Hydrogen-bonded Turn	trans	-63.6	-21.4	-169	0	0	0	0	0	115.3
349	S	74.3	Confident	85.8	Confident	45 Å²	45	39.5 Å²	39.5	32%	0.315	21%	0.212	S	C	.	.	T	Hydrogen-bonded Turn	trans	-88.5	-2.7	177.1	49	0	0	0	0	114.9	Q301 H347 Q556	Q301-S349 PolarHBondContact OE1-OG 3.47Å; H347-S349 PolarHBondContact CE1-OG 3.1Å; H347-S349 PolarHBondContact ND1-OG 3.43Å; H347-S349 PolarHBondContact O-N 3.1Å; H347-S349 VanDerWaalsContact O-N 3.12Å; S349-Q556 VanDerWaalsContact CB-CD 3.46Å; S349-Q556 PolarHBondContact OG-OE1 3.18Å
350	L	77.2	Confident	85.6	Confident	19 Å²	19	40.9 Å²	40.9	10%	0.099	22%	0.215	C	C	.	.	S	Bend	trans	-67.5	141.7	172.4	-75	170.6	0	0	0	110.7	Q345 H347 Q355	Q345-L350 HydrophobicContact CB-CD1 3.98Å; Q345-L350 WeakPolarHBondContact O-CD1 3.43Å; H347-L350 WeakPolarHBondContact NE2-CD2 3.39Å; H347-L350 WeakPolarHBondContact NE2-CG 3.46Å; H347-L350 WeakPolarHBondContact O-CB 3.41Å; H347-L350 PolarHBondContact O-N 3.08Å; L350-Q355 HydrophobicContact CB-CG 3.63Å; L350-Q355 PolarHBondContact O-NE2 3.4Å
351	P	72	Confident	85	Confident	41 Å²	41	45.8 Å²	45.8	27%	0.266	23%	0.228	S	C	.	.			trans	-55.9	146.9	168.8	-23.1	33.1	0	0	0	111.8	H353 E354 Q355 R617	P351-H353 VanDerWaalsContact C-N 3.33Å; P351-H353 PolarHBondContact O-N 2.82Å; P351-E354 HydrophobicContact CB-CG 4.46Å; P351-E354 WeakPolarHBondContact O-CB 3.49Å; P351-E354 PolarHBondContact O-N 3.42Å; P351-Q355 PolarHBondContact O-N 3.42Å; P351-R617 HydrophobicContact CG-CB 4.38Å
352	Q	72.3	Confident	84.2	Confident	62 Å²	62	46.1 Å²	46.1	29%	0.29	23%	0.231	S	C	.	.	H	α-helix	trans	-54.7	-45.5	-175.6	-176.2	175.8	1.1	0	0	112.9	L122 E354 Q355 L356	L122-Q352 VanDerWaalsContact CD2-NE2 3.27Å; Q352-E354 PolarHBondContact O-N 3.02Å; Q352-Q355 PolarHBondContact O-N 2.97Å; Q352-Q355 VanDerWaalsContact O-N 3.16Å; Q352-L356 WeakPolarHBondContact O-CG 3.36Å; Q352-L356 PolarHBondContact O-N 2.95Å
353	H	77.1	Confident	83.6	Confident	111 Å²	111	47.5 Å²	47.5	51%	0.514	25%	0.247	S	C	.	.	H	α-helix	trans	-60.7	-30.5	178.2	72	-88.1	0	0	0	113	P351	P351-H353 VanDerWaalsContact C-N 3.33Å; P351-H353 PolarHBondContact O-N 2.82Å
354	E	80.6	Confident	82.7	Confident	30 Å²	30	56.2 Å²	56.2	14%	0.14	28%	0.277	C	S	.	.	H	α-helix	trans	-78.2	-38.7	175.3	-63.9	-154	132.5	0	0	112.3	P351 Q352 L356 R357 R617	P351-E354 HydrophobicContact CB-CG 4.46Å; P351-E354 WeakPolarHBondContact O-CB 3.49Å; P351-E354 PolarHBondContact O-N 3.42Å; Q352-E354 PolarHBondContact O-N 3.02Å; E354-L356 PolarHBondContact O-N 2.91Å; E354-R357 WeakPolarHBondContact O-CB 3.38Å; E354-R357 PolarHBondContact O-N 2.82Å; E354-R357 VanDerWaalsContact O-N 3.09Å; E354-R617 IonicContact OE1-CZ 3.84Å; E354-R617 IonicContact OE1-NH1 3.61Å; E354-R617 PolarHBondContact OE1-NH1 3.39Å; E354-R617 IonicContact OE1-NH2 3.51Å; E354-R617 PolarHBondContact OE1-NH2 2.99Å; E354-R617 IonicContact OE2-CZ 2.72Å; E354-R617 IonicContact OE2-NH1 3.03Å; E354-R617 PolarHBondContact OE2-NH1 2.96Å
355	Q	84.3	Confident	82.3	Confident	21 Å²	21	58.7 Å²	58.7	10%	0.098	30%	0.295	C	S	.	.	H	α-helix	trans	-58	-38.3	172.3	-64.5	-171.9	31.6	0	0	110.6	L346 L350 P351 Q352 R357 I358	L346-Q355 HydrophobicContact CD1-CB 4.27Å; L346-Q355 HydrophobicContact CD1-CG 4.23Å; L350-Q355 HydrophobicContact CB-CG 3.63Å; L350-Q355 PolarHBondContact O-NE2 3.4Å; P351-Q355 PolarHBondContact O-N 3.42Å; Q352-Q355 PolarHBondContact O-N 2.97Å; Q352-Q355 VanDerWaalsContact O-N 3.16Å; Q355-R357 PolarHBondContact O-N 2.77Å; Q355-I358 WeakPolarHBondContact O-CD1 3.32Å; Q355-I358 WeakPolarHBondContact O-CG1 3.35Å; Q355-I358 WeakPolarHBondContact O-CG2 3.39Å; Q355-I358 PolarHBondContact O-N 2.67Å
356	L	84.4	Confident	82.2	Confident	30 Å²	30	56.3 Å²	56.3	16%	0.157	29%	0.286	C	S	.	.	G	3₁₀ helix	trans	-65.8	-21	178.4	-68.4	176.4	0	0	0	113.8	L36 Q352 E354 I358 F359	L36-L356 HydrophobicContact CD1-CD1 4.27Å; Q352-L356 WeakPolarHBondContact O-CG 3.36Å; Q352-L356 PolarHBondContact O-N 2.95Å; E354-L356 PolarHBondContact O-N 2.91Å; L356-I358 PolarHBondContact O-N 3.08Å; L356-I358 VanDerWaalsContact O-N 3.09Å; L356-F359 HydrophobicContact CB-CD2 4.47Å; L356-F359 HydrophobicContact CD2-CD2 3.95Å; L356-F359 HydrophobicContact CD2-CE2 3.81Å; L356-F359 WeakPolarHBondContact O-CB 3.41Å; L356-F359 VanDerWaalsContact O-CD2 3.29Å; L356-F359 WeakPolarHBondContact O-CD2 3.43Å; L356-F359 PolarHBondContact O-N 2.99Å
357	R	87.5	Confident	82.3	Confident	95 Å²	95	56.2 Å²	56.2	36%	0.358	29%	0.285	S	S	.	.	G	3₁₀ helix	trans	-62.6	-20.1	178.9	-62.3	-178.9	62.4	-166.2	-5.3	113	R342 E354 Q355 F359 E360	R342-R357 VanDerWaalsContact NH2-NH2 3.11Å; E354-R357 WeakPolarHBondContact O-CB 3.38Å; E354-R357 PolarHBondContact O-N 2.82Å; E354-R357 VanDerWaalsContact O-N 3.09Å; Q355-R357 PolarHBondContact O-N 2.77Å; R357-F359 PolarHBondContact O-N 3.34Å; R357-E360 WeakPolarHBondContact CG-OE1 3.1Å; R357-E360 IonicContact NE-OE1 2.72Å; R357-E360 WeakPolarHBondContact O-CB 3.49Å; R357-E360 PolarHBondContact O-N 3.17Å
358	I	89.4	Confident	82.7	Confident	3 Å²	3	55.9 Å²	55.9	2%	0.015	28%	0.284	C	S	.	.	G	3₁₀ helix	trans	-62.5	-24.6	175.1	72.6	-171.6	0	0	0	112.6	L346 Q355 L356 K368 I370 V380 I382	L346-I358 HydrophobicContact CB-CG2 4.38Å; L346-I358 HydrophobicContact CD1-CD1 4.04Å; L346-I358 HydrophobicContact CD1-CG2 4.36Å; L346-I358 HydrophobicContact CD2-CD1 3.69Å; L346-I358 HydrophobicContact CD2-CG2 4.34Å; Q355-I358 WeakPolarHBondContact O-CD1 3.32Å; Q355-I358 WeakPolarHBondContact O-CG1 3.35Å; Q355-I358 WeakPolarHBondContact O-CG2 3.39Å; Q355-I358 PolarHBondContact O-N 2.67Å; L356-I358 PolarHBondContact O-N 3.08Å; L356-I358 VanDerWaalsContact O-N 3.09Å; I358-K368 PolarHBondContact O-NZ 3.48Å; I358-I370 HydrophobicContact CB-CD1 3.92Å; I358-I370 HydrophobicContact CG2-CD1 4.24Å; I358-I370 HydrophobicContact CG2-CG2 4.25Å; I358-V380 HydrophobicContact CD1-CG1 4.18Å; I358-I382 HydrophobicContact CD1-CD1 3.99Å; I358-I382 HydrophobicContact CD1-CG1 4.05Å; I358-I382 HydrophobicContact CG1-CD1 4.49Å; I358-I382 HydrophobicContact CG1-CG1 4.39Å
359	F	86.8	Confident	83.5	Confident	33 Å²	33	53.3 Å²	53.3	15%	0.145	26%	0.257	C	S	.	.	G	3₁₀ helix	trans	-83.2	-16.6	179.7	-58.5	-69.4	0	0	0	112.7	F38 V119 L356 R357 R361 V380 T381	F38-F359 HydrophobicContact CE1-CB 4.2Å; F38-F359 HydrophobicContact CZ-CB 4.39Å; V119-F359 HydrophobicContact CG1-CE2 4.42Å; L356-F359 HydrophobicContact CB-CD2 4.47Å; L356-F359 HydrophobicContact CD2-CD2 3.95Å; L356-F359 HydrophobicContact CD2-CE2 3.81Å; L356-F359 WeakPolarHBondContact O-CB 3.41Å; L356-F359 VanDerWaalsContact O-CD2 3.29Å; L356-F359 WeakPolarHBondContact O-CD2 3.43Å; L356-F359 PolarHBondContact O-N 2.99Å; R357-F359 PolarHBondContact O-N 3.34Å; F359-R361 PolarHBondContact O-N 3.1Å; F359-V380 HydrophobicContact CE1-CG1 3.81Å; F359-V380 HydrophobicContact CZ-CG1 3.58Å; F359-T381 WeakPolarHBondContact CE1-O 3.49Å
360	E	86.5	Confident	84.6	Confident	66 Å²	66	51.1 Å²	51.1	31%	0.308	24%	0.242	S	C	.	.	P	Polyproline II helix	trans	-60.6	129.1	173.9	-63.9	172	-160.8	0	0	110.1	R342 R357 K368	R342-E360 IonicContact CZ-OE2 3.3Å; R342-E360 IonicContact NH1-OE2 2.7Å; R342-E360 PolarHBondContact NH1-OE2 3.12Å; R342-E360 IonicContact NH2-OE2 2.7Å; R342-E360 PolarHBondContact NH2-OE2 2.91Å; R357-E360 WeakPolarHBondContact CG-OE1 3.1Å; R357-E360 IonicContact NE-OE1 2.72Å; R357-E360 WeakPolarHBondContact O-CB 3.49Å; R357-E360 PolarHBondContact O-N 3.17Å; E360-K368 PolarHBondContact O-NZ 3.38Å
361	R	80.2	Confident	85.6	Confident	152 Å²	152	50.2 Å²	50.2	57%	0.574	24%	0.237	S	C	*	.	P	Polyproline II helix	trans	-85.7	123.4	173.8	-72.5	-169.5	-179.4	-156.2	3	109.5	F359	F359-R361 PolarHBondContact O-N 3.1Å
362	P	77.7	Confident	86.7	Confident	30 Å²	30	48.3 Å²	48.3	20%	0.195	22%	0.224	C	C	.	.	P	Polyproline II helix	trans	-67.3	167.9	168.3	33.8	-37.7	0	0	0	110.4	C366 K368	P362-C366 HydrophobicContact CB-CB 3.91Å; P362-C366 WeakPolarHBondContact CG-O 3.37Å; P362-K368 HydrophobicContact CG-CB 3.92Å
363	T	82.2	Confident	87.7	Confident	95 Å²	95	45.8 Å²	45.8	58%	0.583	21%	0.213	S	C	*	.	P	Polyproline II helix	trans	-58.3	153.3	168.9	55	0	0	0	0	110.3	S365 C366	T363-S365 PolarHBondContact O-N 2.56Å; T363-S365 PolarHBondContact OG1-OG 3.34Å; T363-C366 PolarHBondContact O-N 2.88Å
364	R	77.7	Confident	88.3	Confident	205 Å²	205	43.3 Å²	43.3	77%	0.774	20%	0.204	S	C	*	.	T	Hydrogen-bonded Turn	trans	-57.5	-23	-177.9	-70.9	-173.6	176.8	172.3	2.2	114.1
365	S	85.3	Confident	88.6	Confident	66 Å²	66	43 Å²	43	46%	0.462	20%	0.204	S	C	.	.	T	Hydrogen-bonded Turn	trans	-83.2	-11.3	176.6	55.5	0	0	0	0	114.3	P340 T363	P340-S365 WeakPolarHBondContact CD-O 3.43Å; T363-S365 PolarHBondContact O-N 2.56Å; T363-S365 PolarHBondContact OG1-OG 3.34Å
366	C	91.4	Very high	88.8	Confident	15 Å²	15	42 Å²	42	10%	0.101	20%	0.2	C	C	.	.			trans	-107.3	132.9	-177.6	177.5	0	0	0	0	110.9	P340 P362 T363	P340-C366 HydrophobicContact CB-CB 4.24Å; P340-C366 HydrophobicContact CG-CB 3.78Å; P340-C366 WeakPolarHBondContact O-CA 2.98Å; P340-C366 PolarHBondContact O-SG 3.4Å; P362-C366 HydrophobicContact CB-CB 3.91Å; P362-C366 WeakPolarHBondContact CG-O 3.37Å; T363-C366 PolarHBondContact O-N 2.88Å
367	R	94.2	Very high	89	Confident	0 Å²	0	41.8 Å²	41.8	0%	0	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.7	130.2	172.5	-177.6	165.7	-67.8	175.3	10.1	110.2	I284 K288 P289 G292 P340 L341 R342	I284-R367 PolarHBondContact O-NH1 2.88Å; K288-R367 PolarHBondContact O-NH2 2.73Å; P289-R367 VanDerWaalsContact C-NH2 3.35Å; P289-R367 PolarHBondContact O-NH2 3.34Å; G292-R367 PolarHBondContact O-NE 3.32Å; P340-R367 PolarHBondContact O-N 3.11Å; L341-R367 WeakPolarHBondContact CA-O 3.43Å; L341-R367 HydrophobicContact CD1-CB 4.22Å; L341-R367 HydrophobicContact CD1-CG 4.37Å; R342-R367 PolarHBondContact N-O 2.87Å
368	K	95.5	Very high	88.4	Confident	0 Å²	0	37.3 Å²	37.3	0%	0	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.4	136.8	171.4	171.9	179	61.8	-179.1	0	110	D293 I294 R342 L344 I358 E360 P362 I370	D293-K368 WeakPolarHBondContact CA-O 3.46Å; D293-K368 HydrophobicContact CB-CB 4.33Å; D293-K368 WeakPolarHBondContact CB-O 3.39Å; D293-K368 WeakPolarHBondContact OD1-CB 3.49Å; D293-K368 PolarHBondContact OD1-N 2.69Å; D293-K368 WeakPolarHBondContact OD2-CE 3.43Å; D293-K368 IonicContact OD2-NZ 2.9Å; I294-K368 PolarHBondContact N-O 2.85Å; R342-K368 CarbonylContact O-C 3.22Å; R342-K368 WeakPolarHBondContact O-CA 3.39Å; L344-K368 HydrophobicContact CD1-CD 3.82Å; L344-K368 HydrophobicContact CD1-CG 4.13Å; I358-K368 PolarHBondContact O-NZ 3.48Å; E360-K368 PolarHBondContact O-NZ 3.38Å; P362-K368 HydrophobicContact CG-CB 3.92Å; K368-I370 HydrophobicContact CD-CD1 4.1Å; K368-I370 HydrophobicContact CD-CG1 4.19Å; K368-I370 HydrophobicContact CG-CD1 4.36Å; K368-I370 HydrophobicContact CG-CG1 3.97Å
369	V	97.3	Very high	87.5	Confident	0 Å²	0	37.9 Å²	37.9	0%	0	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	123.3	173.9	-176	0	0	0	0	108	V281 I294 I296 L311 L341 R342 C343 L344	V281-V369 HydrophobicContact CG1-CG1 4.36Å; V281-V369 HydrophobicContact CG1-CG2 4.07Å; V281-V369 HydrophobicContact CG2-CG1 4.33Å; I294-V369 HydrophobicContact CB-CG1 4.22Å; I294-V369 HydrophobicContact CB-CG2 4.17Å; I294-V369 HydrophobicContact CD1-CG2 4.12Å; I294-V369 HydrophobicContact CG2-CG1 4.31Å; I294-V369 CarbonylContact O-C 3.59Å; I294-V369 WeakPolarHBondContact O-CA 3.48Å; I296-V369 HydrophobicContact CD1-CG1 3.86Å; I296-V369 HydrophobicContact CG1-CG1 4.23Å; L311-V369 HydrophobicContact CD1-CG1 4.03Å; L341-V369 HydrophobicContact CD1-CG2 3.44Å; L341-V369 VanDerWaalsContact CD1-CG2 3.44Å; L341-V369 HydrophobicContact CD2-CG2 4.4Å; L341-V369 HydrophobicContact CG-CG2 3.99Å; R342-V369 PolarHBondContact O-N 3.49Å; C343-V369 CarbonylContact C-O 3.56Å; C343-V369 WeakPolarHBondContact CA-O 3.48Å; L344-V369 PolarHBondContact N-O 3.06Å
370	I	97	Very high	86.9	Confident	0 Å²	0	36.6 Å²	36.6	0%	0	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	120.3	178.8	-58.1	173	0	0	0	107.7	I294 L295 I296 L344 L346 I358 K368 A372 I382 I385	I294-I370 PolarHBondContact O-N 3.3Å; L295-I370 CarbonylContact C-O 3.57Å; L295-I370 WeakPolarHBondContact CA-O 3.38Å; L295-I370 HydrophobicContact CD1-CB 3.94Å; L295-I370 HydrophobicContact CD1-CG2 3.86Å; I296-I370 PolarHBondContact N-O 3.14Å; L344-I370 HydrophobicContact CB-CG1 4.37Å; L344-I370 WeakPolarHBondContact O-CA 3.34Å; L346-I370 HydrophobicContact CB-CG2 3.91Å; L346-I370 HydrophobicContact CD2-CG2 4.28Å; I358-I370 HydrophobicContact CB-CD1 3.92Å; I358-I370 HydrophobicContact CG2-CD1 4.24Å; I358-I370 HydrophobicContact CG2-CG2 4.25Å; K368-I370 HydrophobicContact CD-CD1 4.1Å; K368-I370 HydrophobicContact CD-CG1 4.19Å; K368-I370 HydrophobicContact CG-CD1 4.36Å; K368-I370 HydrophobicContact CG-CG1 3.97Å; I370-A372 HydrophobicContact CG2-CB 4.39Å; I370-I382 HydrophobicContact CD1-CD1 3.83Å; I370-I382 HydrophobicContact CD1-CG2 3.58Å; I370-I385 HydrophobicContact CD1-CD1 4.24Å
371	V	98	Very high	86.5	Confident	0 Å²	0	37.1 Å²	37.1	0%	0	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.5	114	172.7	-171.8	0	0	0	0	107.9	I296 V298 V304 L307 V308 L311 L344 L346	I296-V371 HydrophobicContact CD1-CG2 4.06Å; V298-V371 HydrophobicContact CG1-CG1 4.37Å; V298-V371 HydrophobicContact CG2-CG1 3.78Å; V304-V371 HydrophobicContact CB-CG1 4.29Å; V304-V371 HydrophobicContact CG1-CB 4.23Å; V304-V371 HydrophobicContact CG1-CG1 4.18Å; V304-V371 WeakPolarHBondContact CG1-O 3.31Å; V304-V371 HydrophobicContact CG2-CG1 4.23Å; L307-V371 HydrophobicContact CB-CG1 4.23Å; L307-V371 HydrophobicContact CD2-CG1 3.87Å; L307-V371 HydrophobicContact CD2-CG2 4.34Å; L307-V371 HydrophobicContact CG-CG1 4.29Å; L307-V371 HydrophobicContact CG-CG2 4.29Å; V308-V371 HydrophobicContact CG2-CB 3.75Å; V308-V371 HydrophobicContact CG2-CG2 3.49Å; V308-V371 VanDerWaalsContact CG2-CG2 3.49Å; L311-V371 HydrophobicContact CD1-CG2 3.87Å; L344-V371 PolarHBondContact O-N 2.82Å; L346-V371 PolarHBondContact N-O 3.29Å
372	A	96	Very high	86.7	Confident	0 Å²	0	30.5 Å²	30.5	0%	0	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	153.6	-169.3	0	0	0	0	0	113.1	L295 I296 F297 V298 L346 I370 A376	L295-A372 HydrophobicContact CD1-CB 3.8Å; I296-A372 PolarHBondContact O-N 3.46Å; F297-A372 CarbonylContact C-O 3.37Å; F297-A372 WeakPolarHBondContact CA-O 3.41Å; V298-A372 PolarHBondContact N-O 2.68Å; L346-A372 HydrophobicContact CB-CB 3.88Å; L346-A372 HydrophobicContact CD2-CB 4.14Å; L346-A372 HydrophobicContact CG-CB 4.26Å; L346-A372 CarbonylContact O-C 3.51Å; L346-A372 WeakPolarHBondContact O-CA 3.23Å; I370-A372 HydrophobicContact CG2-CB 4.39Å; A372-A376 HydrophobicContact CB-CB 3.63Å
373	T	93.3	Very high	86.9	Confident	9 Å²	9	30.3 Å²	30.3	6%	0.055	16%	0.162	C	C	.	.			trans	-84.3	-172	160.4	55.1	0	0	0	0	110.4	V298 V304 L346 H347 V375 A376	V298-T373 WeakPolarHBondContact O-CA 3.37Å; V304-T373 HydrophobicContact CG2-CG2 3.95Å; L346-T373 PolarHBondContact O-N 3.38Å; L346-T373 PolarHBondContact O-OG1 3.16Å; H347-T373 HydrophobicContact CB-CG2 3.93Å; T373-V375 PolarHBondContact O-N 3.18Å; T373-V375 WeakPolarHBondContact OG1-CG2 3.31Å; T373-A376 PolarHBondContact O-N 2.8Å
374	N	90	Very high	87.2	Confident	59 Å²	59	26.3 Å²	26.3	32%	0.316	14%	0.14	S	C	.	.	G	3₁₀ helix	trans	-58.9	-6.1	172	68.8	-37.2	0	0	0	114	A376 E377	N374-A376 PolarHBondContact O-N 3.2Å; N374-E377 HydrophobicContact CB-CB 4.35Å; N374-E377 WeakPolarHBondContact O-CB 3.24Å; N374-E377 PolarHBondContact O-N 3.12Å
375	V	86.6	Confident	87.9	Confident	24 Å²	24	16.7 Å²	16.7	15%	0.145	10%	0.104	C	C	.	.	G	3₁₀ helix	trans	-55.5	-31.6	170.1	174	0	0	0	0	112.9	L346 T373	L346-V375 HydrophobicContact CD1-CG1 4.3Å; L346-V375 HydrophobicContact CG-CG1 4.36Å; T373-V375 PolarHBondContact O-N 3.18Å; T373-V375 WeakPolarHBondContact OG1-CG2 3.31Å
376	A	89.1	Confident	88.3	Confident	1 Å²	1	13.8 Å²	13.8	1%	0.008	8%	0.084	C	C	.	.	G	3₁₀ helix	trans	-87.5	-4	177.3	0	0	0	0	0	114	L295 F297 L346 A372 T373 N374 R424	L295-A376 HydrophobicContact CD1-CB 4.08Å; L295-A376 HydrophobicContact CD2-CB 4.22Å; F297-A376 HydrophobicContact CE1-CB 3.82Å; F297-A376 HydrophobicContact CZ-CB 4.08Å; L346-A376 HydrophobicContact CD2-CB 3.77Å; A372-A376 HydrophobicContact CB-CB 3.63Å; T373-A376 PolarHBondContact O-N 2.8Å; N374-A376 PolarHBondContact O-N 3.2Å; A376-R424 WeakPolarHBondContact O-CD 3.26Å; A376-R424 PolarHBondContact O-NE 3.44Å
377	E	86.7	Confident	88.5	Confident	25 Å²	25	14 Å²	14	12%	0.117	8%	0.083	C	C	.	.	T	Hydrogen-bonded Turn	trans	-71.5	-34.5	-170.7	-176.3	172.4	143.8	0	0	112.7	F297 N374 S417 Q420 R421 R424	F297-E377 HydrophobicContact CE1-CB 4.07Å; N374-E377 HydrophobicContact CB-CB 4.35Å; N374-E377 WeakPolarHBondContact O-CB 3.24Å; N374-E377 PolarHBondContact O-N 3.12Å; E377-S417 WeakPolarHBondContact OE1-CA 3.03Å; E377-S417 WeakPolarHBondContact OE1-CB 3.36Å; E377-S417 PolarHBondContact OE1-OG 3.27Å; E377-S417 PolarHBondContact OE2-OG 2.92Å; E377-Q420 HydrophobicContact CG-CB 4.21Å; E377-R421 HydrophobicContact CG-CG 3.95Å; E377-R421 IonicContact OE2-CZ 2.83Å; E377-R421 IonicContact OE2-NE 3.77Å; E377-R421 PolarHBondContact OE2-NE 2.93Å; E377-R421 VanDerWaalsContact OE2-NE 3.12Å; E377-R421 IonicContact OE2-NH2 3.59Å; E377-R421 PolarHBondContact OE2-NH2 3.26Å; E377-R424 VanDerWaalsContact C-CZ 3.44Å; E377-R424 PolarHBondContact O-NE 3.06Å; E377-R424 PolarHBondContact O-NH2 3.42Å
378	A	75.6	Confident	88.7	Confident	1 Å²	1	14 Å²	14	1%	0.008	8%	0.083	C	C	.	.	S	Bend	trans	-135	160.1	-173.9	0	0	0	0	0	111.2	R117 E188 V380	R117-A378 VanDerWaalsContact NH1-CB 3.31Å; R117-A378 PolarHBondContact NH1-O 3.38Å; E188-A378 HydrophobicContact CG-CB 4.2Å; E188-A378 WeakPolarHBondContact OE1-CB 3.24Å; A378-V380 PolarHBondContact O-N 3.14Å
379	S	70.1	Confident	88.8	Confident	14 Å²	14	14 Å²	14	10%	0.098	8%	0.083	C	C	.	.	S	Bend	trans	56.1	-1.8	169.2	-21.1	0	0	0	0	120.4	R117 A120 E185 E188	R117-S379 PolarHBondContact NH1-OG 3.17Å; A120-S379 VanDerWaalsContact CB-CB 3.43Å; A120-S379 VanDerWaalsContact CB-O 3.29Å; A120-S379 WeakPolarHBondContact CB-O 3.24Å; E185-S379 PolarHBondContact OE2-N 3.32Å; E185-S379 PolarHBondContact OE2-OG 2.98Å; E188-S379 PolarHBondContact OE1-OG 2.95Å
380	V	75	Confident	88.8	Confident	7 Å²	7	14.2 Å²	14.2	4%	0.042	8%	0.084	C	C	.	.			trans	-121	126.3	176.6	178.8	0	0	0	0	111.2	I358 F359 A378 I382 R424 R427	I358-V380 HydrophobicContact CD1-CG1 4.18Å; F359-V380 HydrophobicContact CE1-CG1 3.81Å; F359-V380 HydrophobicContact CZ-CG1 3.58Å; A378-V380 PolarHBondContact O-N 3.14Å; V380-I382 HydrophobicContact CG1-CG1 3.99Å; V380-R424 PolarHBondContact O-NH1 3.12Å; V380-R427 PolarHBondContact O-NH1 3.46Å
381	T	76.9	Confident	88.9	Confident	76 Å²	76	14.3 Å²	14.3	47%	0.466	9%	0.085	S	C	.	.			trans	-99.9	102.1	174.4	-53.5	0	0	0	0	110.1	F359 P383 R427	F359-T381 WeakPolarHBondContact CE1-O 3.49Å; T381-P383 WeakPolarHBondContact O-CD 3.41Å; T381-R427 VanDerWaalsContact CA-NH1 3.27Å; T381-R427 PolarHBondContact OG1-NH1 3.07Å
382	I	84.8	Confident	88.8	Confident	14 Å²	14	14.5 Å²	14.5	7%	0.072	9%	0.087	C	C	.	.			trans	-87.6	117.1	174.8	-53.1	175.9	0	0	0	108.4	L295 L346 I358 I370 V380 I385	L295-I382 HydrophobicContact CD1-CD1 4.33Å; L346-I382 HydrophobicContact CD2-CD1 4.14Å; I358-I382 HydrophobicContact CD1-CD1 3.99Å; I358-I382 HydrophobicContact CD1-CG1 4.05Å; I358-I382 HydrophobicContact CG1-CD1 4.49Å; I358-I382 HydrophobicContact CG1-CG1 4.39Å; I370-I382 HydrophobicContact CD1-CD1 3.83Å; I370-I382 HydrophobicContact CD1-CG2 3.58Å; V380-I382 HydrophobicContact CG1-CG1 3.99Å; I382-I385 HydrophobicContact CB-CD1 4.4Å; I382-I385 HydrophobicContact CB-CG1 3.8Å; I382-I385 HydrophobicContact CG2-CD1 3.97Å; I382-I385 HydrophobicContact CG2-CG1 3.86Å
383	P	82.1	Confident	88.8	Confident	25 Å²	25	18 Å²	18	16%	0.162	10%	0.102	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68.3	139.4	-179.7	27.9	-33.6	0	0	0	110.8	T381	T381-P383 WeakPolarHBondContact O-CD 3.41Å
384	G	88.2	Confident	88.9	Confident	12 Å²	12	17.9 Å²	17.9	12%	0.124	10%	0.102	C	C	.	.	T	Hydrogen-bonded Turn	trans	92	-4.8	172.3	0	0	0	0	0	115.8	D293 S386	D293-G384 WeakPolarHBondContact CB-O 3.45Å; D293-G384 PolarHBondContact N-O 2.83Å; G384-S386 PolarHBondContact O-N 3.45Å
385	I	92.3	Very high	88.9	Confident	3 Å²	3	20.2 Å²	20.2	2%	0.015	11%	0.106	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-66	118.9	176.1	-57.1	-55.2	0	0	0	109.8	D293 L295 I370 I382 V388	D293-I385 HydrophobicContact CB-CD1 3.83Å; L295-I385 HydrophobicContact CB-CD1 4.01Å; L295-I385 HydrophobicContact CB-CG1 4.34Å; L295-I385 HydrophobicContact CB-CG2 3.81Å; I370-I385 HydrophobicContact CD1-CD1 4.24Å; I382-I385 HydrophobicContact CB-CD1 4.4Å; I382-I385 HydrophobicContact CB-CG1 3.8Å; I382-I385 HydrophobicContact CG2-CD1 3.97Å; I382-I385 HydrophobicContact CG2-CG1 3.86Å; I385-V388 HydrophobicContact CG2-CG2 4.16Å
386	S	93.6	Very high	89.1	Confident	4 Å²	4	20.3 Å²	20.3	3%	0.028	11%	0.105	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	-16.9	173.6	-55.7	0	0	0	0	112.3	G292 D293 G384 R429 G431 Q432	G292-S386 WeakPolarHBondContact CA-OG 3.48Å; D293-S386 PolarHBondContact O-N 3.11Å; G384-S386 PolarHBondContact O-N 3.45Å; S386-R429 WeakPolarHBondContact OG-CD 3.37Å; S386-G431 CarbonylContact O-C 3.55Å; S386-G431 WeakPolarHBondContact O-CA 3.08Å; S386-Q432 PolarHBondContact O-N 2.71Å
387	Y	96.7	Very high	89.1	Confident	21 Å²	21	26.8 Å²	26.8	8%	0.082	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	125.9	-177	-53.5	-73.7	0	0	0	109.9	I284 K288 D293 I294 L295 Q432 Y434	I284-Y387 HydrophobicContact CG2-CD1 3.78Å; I284-Y387 HydrophobicContact CG2-CD2 3.66Å; I284-Y387 HydrophobicContact CG2-CE1 4.05Å; I284-Y387 HydrophobicContact CG2-CE2 3.93Å; I284-Y387 HydrophobicContact CG2-CG 3.59Å; K288-Y387 HydrophobicContact CB-CE1 4.31Å; K288-Y387 HydrophobicContact CB-CE2 4.42Å; K288-Y387 WeakPolarHBondContact CB-OH 3.22Å; K288-Y387 HydrophobicContact CG-CE1 4.04Å; D293-Y387 PolarHBondContact O-N 2.78Å; I294-Y387 CarbonylContact C-O 3.49Å; I294-Y387 WeakPolarHBondContact CA-O 3.31Å; I294-Y387 HydrophobicContact CG1-CD2 4.14Å; I294-Y387 HydrophobicContact CG1-CG 4.45Å; L295-Y387 PolarHBondContact N-O 3.46Å; Y387-Q432 CarbonylContact C-O 3.59Å; Y387-Q432 VanDerWaalsContact CA-O 3.31Å; Y387-Q432 WeakPolarHBondContact CA-O 3.38Å; Y387-Q432 HydrophobicContact CD1-CB 4.1Å; Y387-Q432 HydrophobicContact CE1-CB 4.49Å; Y387-Q432 HydrophobicContact CE1-CG 4.48Å; Y387-Y434 HydrophobicContact CD1-CE2 4.28Å
388	V	97.2	Very high	89.2	Confident	0 Å²	0	27.1 Å²	27.1	0%	0	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	136.3	173	167.9	0	0	0	0	109.1	L295 F297 I385 R421 R424 A425 Q432 A433 Y434	L295-V388 HydrophobicContact CB-CG2 4.37Å; L295-V388 CarbonylContact O-C 3.46Å; L295-V388 VanDerWaalsContact O-CA 3.27Å; L295-V388 WeakPolarHBondContact O-CA 3.36Å; F297-V388 HydrophobicContact CD2-CG1 4.06Å; F297-V388 HydrophobicContact CE2-CG1 4.03Å; I385-V388 HydrophobicContact CG2-CG2 4.16Å; V388-R421 WeakPolarHBondContact CG2-O 3.28Å; V388-R424 HydrophobicContact CG2-CB 4Å; V388-A425 HydrophobicContact CB-CB 4.45Å; V388-A425 HydrophobicContact CG2-CB 3.84Å; V388-Q432 PolarHBondContact N-O 2.95Å; V388-A433 HydrophobicContact CB-CB 4.2Å; V388-A433 CarbonylContact O-C 3.55Å; V388-A433 WeakPolarHBondContact O-CA 3.33Å; V388-Y434 PolarHBondContact O-N 2.8Å
389	I	98.5	Very high	89.9	Confident	0 Å²	0	28.4 Å²	28.4	0%	0	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	121.9	170.3	-58.2	172.7	0	0	0	107.2	A277 T280 V281 I284 I294 L295 I296 F297 Y434 L436	A277-I389 HydrophobicContact CB-CG2 4.17Å; T280-I389 HydrophobicContact CG2-CD1 3.63Å; T280-I389 HydrophobicContact CG2-CG1 3.88Å; V281-I389 HydrophobicContact CG2-CD1 3.62Å; I284-I389 HydrophobicContact CD1-CD1 4.13Å; I284-I389 HydrophobicContact CD1-CG1 4.26Å; I294-I389 HydrophobicContact CG2-CD1 3.85Å; I294-I389 HydrophobicContact CG2-CG1 4.23Å; L295-I389 PolarHBondContact O-N 3.35Å; I296-I389 CarbonylContact C-O 3.49Å; I296-I389 WeakPolarHBondContact CA-O 3.48Å; I296-I389 HydrophobicContact CB-CB 4.45Å; I296-I389 HydrophobicContact CD1-CD1 4.37Å; I296-I389 HydrophobicContact CG1-CB 4.32Å; I296-I389 HydrophobicContact CG1-CD1 4.19Å; I296-I389 HydrophobicContact CG2-CB 4.1Å; I296-I389 HydrophobicContact CG2-CG2 4.17Å; F297-I389 PolarHBondContact N-O 3.37Å; I389-Y434 WeakPolarHBondContact CA-O 3.36Å; I389-L436 HydrophobicContact CG2-CD1 3.79Å; I389-L436 HydrophobicContact CG2-CD2 4.13Å; I389-L436 HydrophobicContact CG2-CG 3.97Å
390	D	98.2	Very high	90.5	Very high	3 Å²	3	31.1 Å²	31.1	2%	0.016	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119	115.9	-173.6	-178.8	19.8	0	0	0	111.2	G392 I413 R421 Y434 R435 L436 Y437	D390-G392 VanDerWaalsContact C-N 3.26Å; D390-G392 PolarHBondContact O-N 2.86Å; D390-G392 PolarHBondContact OD1-N 3.21Å; D390-I413 WeakPolarHBondContact OD2-CD1 3.15Å; D390-R421 VanDerWaalsContact OD1-CD 3.28Å; D390-R421 WeakPolarHBondContact OD1-CD 3.34Å; D390-R421 IonicContact OD1-CZ 2.83Å; D390-R421 IonicContact OD1-NE 3.28Å; D390-R421 IonicContact OD1-NH1 3.5Å; D390-R421 PolarHBondContact OD1-NH1 3.01Å; D390-Y434 PolarHBondContact N-O 3.26Å; D390-R435 HydrophobicContact CB-CG 4.48Å; D390-L436 PolarHBondContact O-N 2.96Å; D390-Y437 HydrophobicContact CB-CE1 4.38Å; D390-Y437 PolarHBondContact OD2-OH 3.41Å
391	C	97.3	Very high	90.6	Very high	3 Å²	3	32.3 Å²	32.3	2%	0.02	16%	0.163	C	C	.	.			trans	-71.4	-18.1	176.4	69.5	0	0	0	0	113.8	Y273 F297 F393	Y273-C391 HydrophobicContact CD2-CB 3.83Å; Y273-C391 HydrophobicContact CG-CB 3.86Å; F297-C391 WeakPolarHBondContact O-CB 3.21Å; F297-C391 PolarHBondContact O-N 2.88Å; F297-C391 PolarHBondContact O-SG 2.97Å; C391-F393 VanDerWaalsContact O-CD2 3.22Å; C391-F393 WeakPolarHBondContact O-CD2 3.42Å; C391-F393 PolarHBondContact SG-N 3.15Å
392	G	96.9	Very high	90.7	Very high	4 Å²	4	35.1 Å²	35.1	4%	0.041	18%	0.18	C	C	.	.	S	Bend	trans	82.7	7.1	-178.8	0	0	0	0	0	115.4	D390 P412 I413	D390-G392 VanDerWaalsContact C-N 3.26Å; D390-G392 PolarHBondContact O-N 2.86Å; D390-G392 PolarHBondContact OD1-N 3.21Å; G392-P412 WeakPolarHBondContact O-CA 3.33Å; G392-I413 WeakPolarHBondContact O-CG1 3.33Å; G392-I413 PolarHBondContact O-N 2.74Å
393	F	96.7	Very high	90.7	Very high	72 Å²	72	36.2 Å²	36.2	32%	0.316	19%	0.185	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-124	158.1	179.5	-61.2	-82.6	0	0	0	112.7	Y273 T299 C391 T410 I411 P412 I413 R421	Y273-F393 AromaticContact CD1-CD2 3.98Å; Y273-F393 HydrophobicContact CD1-CD2 3.98Å; Y273-F393 HydrophobicContact CD1-CE2 4.02Å; Y273-F393 AromaticContact CE1-CD2 3.9Å; Y273-F393 HydrophobicContact CE1-CD2 3.9Å; Y273-F393 HydrophobicContact CE1-CE2 4.15Å; T299-F393 HydrophobicContact CG2-CB 3.46Å; T299-F393 VanDerWaalsContact CG2-CB 3.46Å; C391-F393 VanDerWaalsContact O-CD2 3.22Å; C391-F393 WeakPolarHBondContact O-CD2 3.42Å; C391-F393 PolarHBondContact SG-N 3.15Å; F393-T410 HydrophobicContact CB-CG2 4.15Å; F393-T410 HydrophobicContact CD1-CG2 4.4Å; F393-I411 WeakPolarHBondContact CA-O 3.35Å; F393-P412 HydrophobicContact CD1-CG 4.45Å; F393-P412 HydrophobicContact CE1-CG 4.15Å; F393-I413 VanDerWaalsContact C-CG2 3.42Å; F393-R421 PolarHBondContact O-NH1 3.27Å; F393-R421 VanDerWaalsContact O-NH1 3.12Å; F393-R421 PolarHBondContact O-NH2 3.05Å; F393-R421 VanDerWaalsContact O-NH2 3.16Å
394	S	94.2	Very high	90.7	Very high	8 Å²	8	36 Å²	36	6%	0.056	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.2	156.2	168.9	66.6	0	0	0	0	110.5	T410 I411	S394-T410 WeakPolarHBondContact O-CA 3.38Å; S394-I411 PolarHBondContact N-O 3.09Å; S394-I411 PolarHBondContact O-N 3.36Å
395	R	91.1	Very high	90.7	Very high	107 Å²	107	36 Å²	36	40%	0.404	19%	0.185	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.2	127.1	168.2	-78.7	-178.1	178.7	-163.1	0.9	109.7	V409 T410	R395-V409 WeakPolarHBondContact CA-O 3.35Å; R395-T410 WeakPolarHBondContact CG-OG1 3.4Å; R395-T410 PolarHBondContact NE-OG1 3.31Å
396	I	90.4	Very high	90.5	Very high	26 Å²	26	38 Å²	38	13%	0.133	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	155	175.9	66.9	163.8	0	0	0	110.4	L408 V409 I411	I396-L408 WeakPolarHBondContact O-CA 3.04Å; I396-V409 PolarHBondContact N-O 2.97Å; I396-V409 PolarHBondContact O-N 3.45Å; I396-I411 HydrophobicContact CD1-CD1 3.34Å; I396-I411 HydrophobicContact CD1-CG1 4.01Å; I396-I411 HydrophobicContact CG1-CD1 3.88Å; I396-I411 HydrophobicContact CG1-CG1 3.97Å; I396-I411 HydrophobicContact CG1-CG2 4.49Å; I396-I411 HydrophobicContact CG2-CD1 4.35Å; I396-I411 HydrophobicContact CG2-CG1 4.39Å
397	R	88.9	Confident	90.3	Very high	138 Å²	138	38.4 Å²	38.4	52%	0.521	20%	0.198	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.2	132.1	169.4	-67	-177.7	-177.2	178.7	-0	109.8	L408 R456 V457	R397-L408 HydrophobicContact CB-CD2 4.5Å; R397-L408 HydrophobicContact CG-CD2 3.6Å; R397-R456 PolarHBondContact O-NH1 3.29Å; R397-V457 HydrophobicContact CB-CG1 4.09Å
398	A	89.6	Confident	89.9	Confident	32 Å²	32	41.4 Å²	41.4	26%	0.264	22%	0.215	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.4	129.9	173.7	0	0	0	0	0	109.5	E406 A407 V409 R456	A398-E406 WeakPolarHBondContact O-CA 3.33Å; A398-A407 PolarHBondContact N-O 2.93Å; A398-A407 PolarHBondContact O-N 3.01Å; A398-V409 HydrophobicContact CB-CG2 3.69Å; A398-R456 CarbonylContact C-O 3.39Å; A398-R456 WeakPolarHBondContact CA-O 3.36Å
399	Y	88.3	Confident	89.5	Confident	28 Å²	28	43.3 Å²	43.3	11%	0.11	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.3	127.5	173.4	179.5	-109.1	0	0	0	109.2	P401 E406 R456 D458 Q490	Y399-P401 HydrophobicContact CD1-CB 4.47Å; Y399-P401 HydrophobicContact CE1-CB 4.08Å; Y399-E406 HydrophobicContact CD2-CB 4.13Å; Y399-R456 PolarHBondContact N-O 3.23Å; Y399-D458 HydrophobicContact CD2-CB 4.01Å; Y399-D458 HydrophobicContact CE2-CB 4.2Å; Y399-D458 HydrophobicContact CG-CB 4.38Å; Y399-Q490 PolarHBondContact OH-OE1 2.7Å
400	N	84.4	Confident	89.2	Confident	70 Å²	70	46.1 Å²	46.1	37%	0.374	24%	0.244	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.7	111.3	171.1	179.4	-9.7	0	0	0	108.8	V402 N403 G404 L405	N400-V402 PolarHBondContact O-N 3.23Å; N400-V402 WeakPolarHBondContact OD1-CB 3.38Å; N400-V402 PolarHBondContact OD1-N 2.89Å; N400-N403 VanDerWaalsContact CB-OD1 3.25Å; N400-N403 WeakPolarHBondContact CB-OD1 3.42Å; N400-N403 PolarHBondContact O-OD1 2.94Å; N400-G404 VanDerWaalsContact O-CA 3.29Å; N400-G404 WeakPolarHBondContact O-CA 3.45Å; N400-G404 PolarHBondContact O-N 2.92Å; N400-L405 PolarHBondContact N-O 2.93Å; N400-L405 PolarHBondContact O-N 2.95Å
401	P	77.3	Confident	88.9	Confident	32 Å²	32	48.5 Å²	48.5	21%	0.208	26%	0.256	C	S	.	.	T	Hydrogen-bonded Turn	trans	-69.5	-19.3	-178.6	31.8	-39.3	0	0	0	113.1	Y399 H487 Q490	Y399-P401 HydrophobicContact CD1-CB 4.47Å; Y399-P401 HydrophobicContact CE1-CB 4.08Å; P401-H487 WeakPolarHBondContact CG-NE2 3.14Å; P401-Q490 PolarHBondContact O-NE2 3.08Å; P401-Q490 PolarHBondContact O-OE1 2.96Å
402	V	79.2	Confident	88.8	Confident	136 Å²	136	51.3 Å²	51.3	82%	0.824	27%	0.274	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.4	-45.1	-177.3	-178.4	0	0	0	0	110.6	N400	N400-V402 PolarHBondContact O-N 3.23Å; N400-V402 WeakPolarHBondContact OD1-CB 3.38Å; N400-V402 PolarHBondContact OD1-N 2.89Å
403	N	83.9	Confident	88.8	Confident	36 Å²	36	51.2 Å²	51.2	19%	0.193	27%	0.272	C	S	.	.	T	Hydrogen-bonded Turn	trans	-102.9	-4.4	179.4	64.6	11.4	0	0	0	113.4	N400 L405 H681	N400-N403 VanDerWaalsContact CB-OD1 3.25Å; N400-N403 WeakPolarHBondContact CB-OD1 3.42Å; N400-N403 PolarHBondContact O-OD1 2.94Å; N403-L405 VanDerWaalsContact C-N 3.25Å; N403-L405 HydrophobicContact CB-CD1 4.48Å; N403-L405 HydrophobicContact CB-CG 4.26Å; N403-L405 PolarHBondContact O-N 3.21Å; N403-L405 WeakPolarHBondContact OD1-CB 3.44Å; N403-L405 PolarHBondContact OD1-N 2.69Å; N403-L405 VanDerWaalsContact OD1-N 3.11Å; N403-H681 HydrophobicContact CB-CB 4.31Å
404	G	83	Confident	88.7	Confident	21 Å²	21	47.9 Å²	47.9	22%	0.216	26%	0.258	C	S	.	.	T	Hydrogen-bonded Turn	trans	67.7	21.9	179	0	0	0	0	0	114.2	N400	N400-G404 VanDerWaalsContact O-CA 3.29Å; N400-G404 WeakPolarHBondContact O-CA 3.45Å; N400-G404 PolarHBondContact O-N 2.92Å
405	L	87.3	Confident	88.7	Confident	13 Å²	13	48.6 Å²	48.6	7%	0.068	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.4	135.6	-177.7	-56.1	-177.1	0	0	0	111.3	N400 N403 L683 F704 V707 T733	N400-L405 PolarHBondContact N-O 2.93Å; N400-L405 PolarHBondContact O-N 2.95Å; N403-L405 VanDerWaalsContact C-N 3.25Å; N403-L405 HydrophobicContact CB-CD1 4.48Å; N403-L405 HydrophobicContact CB-CG 4.26Å; N403-L405 PolarHBondContact O-N 3.21Å; N403-L405 WeakPolarHBondContact OD1-CB 3.44Å; N403-L405 PolarHBondContact OD1-N 2.69Å; N403-L405 VanDerWaalsContact OD1-N 3.11Å; L405-L683 HydrophobicContact CD1-CD2 4.09Å; L405-F704 HydrophobicContact CD2-CE2 3.85Å; L405-F704 HydrophobicContact CD2-CZ 3.9Å; L405-V707 HydrophobicContact CD1-CG1 4.38Å; L405-V707 HydrophobicContact CD2-CG2 4.28Å; L405-T733 HydrophobicContact CD1-CG2 4.17Å
406	E	87.9	Confident	88.6	Confident	45 Å²	45	44 Å²	44	21%	0.21	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	131.6	170.7	-168.3	-178.4	-160.5	0	0	109.8	A398 Y399	A398-E406 WeakPolarHBondContact O-CA 3.33Å; Y399-E406 HydrophobicContact CD2-CB 4.13Å
407	A	89.2	Confident	88.7	Confident	11 Å²	11	43 Å²	43	9%	0.091	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.4	160.7	176.9	0	0	0	0	0	112	A398 V707 L709	A398-A407 PolarHBondContact N-O 2.93Å; A398-A407 PolarHBondContact O-N 3.01Å; A407-V707 HydrophobicContact CB-CB 4.48Å; A407-V707 HydrophobicContact CB-CG1 4.28Å; A407-L709 HydrophobicContact CB-CD1 4.44Å; A407-L709 HydrophobicContact CB-CD2 4.49Å; A407-L709 HydrophobicContact CB-CG 3.94Å
408	L	87.7	Confident	89	Confident	85 Å²	85	36.4 Å²	36.4	45%	0.445	22%	0.216	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.9	123.3	168.1	-73.1	170.7	0	0	0	109.9	I396 R397	I396-L408 WeakPolarHBondContact O-CA 3.04Å; R397-L408 HydrophobicContact CB-CD2 4.5Å; R397-L408 HydrophobicContact CG-CD2 3.6Å
409	V	90.2	Very high	89	Confident	39 Å²	39	40.7 Å²	40.7	24%	0.236	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117	132.3	-178.7	-167.6	0	0	0	0	109.3	R395 I396 A398 I411 L709	R395-V409 WeakPolarHBondContact CA-O 3.35Å; I396-V409 PolarHBondContact N-O 2.97Å; I396-V409 PolarHBondContact O-N 3.45Å; A398-V409 HydrophobicContact CB-CG2 3.69Å; V409-I411 HydrophobicContact CB-CG2 4.46Å; V409-I411 HydrophobicContact CG1-CG2 4.05Å; V409-L709 HydrophobicContact CG1-CD1 4.47Å; V409-L709 HydrophobicContact CG2-CD1 3.67Å
410	T	91.6	Very high	89	Confident	60 Å²	60	40.1 Å²	40.1	37%	0.368	22%	0.224	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.2	122.2	170.2	-57.7	0	0	0	0	108.7	T299 F393 S394 R395	T299-T410 HydrophobicContact CG2-CG2 3.99Å; F393-T410 HydrophobicContact CB-CG2 4.15Å; F393-T410 HydrophobicContact CD1-CG2 4.4Å; S394-T410 WeakPolarHBondContact O-CA 3.38Å; R395-T410 WeakPolarHBondContact CG-OG1 3.4Å; R395-T410 PolarHBondContact NE-OG1 3.31Å
411	I	92.4	Very high	89.5	Confident	52 Å²	52	36.8 Å²	36.8	27%	0.267	21%	0.206	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.5	159.9	177.1	65.5	158.7	0	0	0	110.9	F393 S394 I396 V409	F393-I411 WeakPolarHBondContact CA-O 3.35Å; S394-I411 PolarHBondContact N-O 3.09Å; S394-I411 PolarHBondContact O-N 3.36Å; I396-I411 HydrophobicContact CD1-CD1 3.34Å; I396-I411 HydrophobicContact CD1-CG1 4.01Å; I396-I411 HydrophobicContact CG1-CD1 3.88Å; I396-I411 HydrophobicContact CG1-CG1 3.97Å; I396-I411 HydrophobicContact CG1-CG2 4.49Å; I396-I411 HydrophobicContact CG2-CD1 4.35Å; I396-I411 HydrophobicContact CG2-CG1 4.39Å; V409-I411 HydrophobicContact CB-CG2 4.46Å; V409-I411 HydrophobicContact CG1-CG2 4.05Å
412	P	95.7	Very high	90.2	Very high	62 Å²	62	35.4 Å²	35.4	40%	0.403	20%	0.197	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-59.4	144.1	165.4	-20	32.3	0	0	0	111.1	G392 F393 L446	G392-P412 WeakPolarHBondContact O-CA 3.33Å; F393-P412 HydrophobicContact CD1-CG 4.45Å; F393-P412 HydrophobicContact CE1-CG 4.15Å; P412-L446 HydrophobicContact CB-CD2 3.6Å
413	I	96.2	Very high	90.6	Very high	2 Å²	2	29.2 Å²	29.2	1%	0.01	16%	0.16	C	C	.	.	P	Polyproline II helix	trans	-73.3	164.1	175.8	66.4	-177.9	0	0	0	112	D390 G392 F393 A418 L446	D390-I413 WeakPolarHBondContact OD2-CD1 3.15Å; G392-I413 WeakPolarHBondContact O-CG1 3.33Å; G392-I413 PolarHBondContact O-N 2.74Å; F393-I413 VanDerWaalsContact C-CG2 3.42Å; I413-A418 HydrophobicContact CD1-CB 3.75Å; I413-A418 HydrophobicContact CG1-CB 4.32Å; I413-L446 HydrophobicContact CG1-CD1 4.24Å; I413-L446 WeakPolarHBondContact O-CD2 3.38Å
414	S	94.3	Very high	90.8	Very high	3 Å²	3	28 Å²	28	2%	0.021	15%	0.153	C	C	.	.	P	Polyproline II helix	trans	-79.2	160.7	169.9	59.3	0	0	0	0	112.5	A416 S417 A418 P447 F449 T450	S414-A416 PolarHBondContact O-N 3.38Å; S414-S417 WeakPolarHBondContact O-CB 3.23Å; S414-S417 PolarHBondContact O-N 2.93Å; S414-S417 VanDerWaalsContact O-N 3.17Å; S414-S417 WeakPolarHBondContact OG-CB 3.27Å; S414-S417 PolarHBondContact OG-N 3.05Å; S414-A418 PolarHBondContact O-N 2.85Å; S414-P447 CarbonylContact C-O 3.55Å; S414-P447 WeakPolarHBondContact CA-O 3.36Å; S414-P447 WeakPolarHBondContact CB-O 3.24Å; S414-F449 VanDerWaalsContact CB-C 3.4Å; S414-T450 PolarHBondContact OG-N 2.66Å; S414-T450 PolarHBondContact OG-OG1 2.87Å
415	Q	94.2	Very high	91.1	Very high	23 Å²	23	27 Å²	27	11%	0.107	14%	0.143	C	C	.	.	H	α-helix	trans	-58.6	-37.9	171.4	-63.3	-179.1	16.3	0	0	111.4	A418 R419 Y442 L446 P447	Q415-A418 PolarHBondContact O-N 3.41Å; Q415-R419 VanDerWaalsContact O-CG 3.28Å; Q415-R419 WeakPolarHBondContact O-CG 3.44Å; Q415-R419 PolarHBondContact O-N 2.99Å; Q415-Y442 HydrophobicContact CB-CE2 4Å; Q415-Y442 HydrophobicContact CG-CD2 4.43Å; Q415-Y442 HydrophobicContact CG-CE2 3.99Å; Q415-Y442 PolarHBondContact NE2-O 3.18Å; Q415-L446 HydrophobicContact CG-CB 4.02Å; Q415-L446 PolarHBondContact NE2-O 2.83Å; Q415-P447 PolarHBondContact N-O 3.44Å
416	A	89.8	Confident	90.7	Very high	11 Å²	11	26.5 Å²	26.5	9%	0.091	14%	0.141	C	C	.	.	H	α-helix	trans	-59.4	-48.9	173.5	0	0	0	0	0	111.8	T219 S414 A418 R419 Q420 R448 F449	T219-A416 HydrophobicContact CG2-CB 4.28Å; S414-A416 PolarHBondContact O-N 3.38Å; A416-A418 PolarHBondContact O-N 3.14Å; A416-R419 WeakPolarHBondContact O-CB 3.03Å; A416-R419 PolarHBondContact O-N 3.32Å; A416-Q420 WeakPolarHBondContact O-CG 3.34Å; A416-Q420 PolarHBondContact O-N 2.93Å; A416-R448 WeakPolarHBondContact CB-O 3.43Å; A416-R448 PolarHBondContact N-O 2.85Å; A416-R448 VanDerWaalsContact N-O 3.07Å; A416-F449 HydrophobicContact CB-CD1 3.75Å; A416-F449 HydrophobicContact CB-CE1 4.15Å
417	S	92.2	Very high	90.1	Very high	4 Å²	4	25.5 Å²	25.5	3%	0.028	14%	0.135	C	C	.	.	H	α-helix	trans	-57.9	-47.6	175.2	175.9	0	0	0	0	111.7	E377 S414 R419 Q420 R421	E377-S417 WeakPolarHBondContact OE1-CA 3.03Å; E377-S417 WeakPolarHBondContact OE1-CB 3.36Å; E377-S417 PolarHBondContact OE1-OG 3.27Å; E377-S417 PolarHBondContact OE2-OG 2.92Å; S414-S417 WeakPolarHBondContact O-CB 3.23Å; S414-S417 PolarHBondContact O-N 2.93Å; S414-S417 VanDerWaalsContact O-N 3.17Å; S414-S417 WeakPolarHBondContact OG-CB 3.27Å; S414-S417 PolarHBondContact OG-N 3.05Å; S417-R419 VanDerWaalsContact C-N 3.27Å; S417-R419 PolarHBondContact O-N 2.95Å; S417-Q420 WeakPolarHBondContact O-CB 2.97Å; S417-Q420 PolarHBondContact O-N 2.75Å; S417-R421 WeakPolarHBondContact O-CG 3.44Å; S417-R421 PolarHBondContact O-N 2.9Å
418	A	94.1	Very high	89.4	Confident	0 Å²	0	27.4 Å²	27.4	0%	0	15%	0.146	C	C	.	.	H	α-helix	trans	-60.2	-34.1	177	0	0	0	0	0	113.2	I413 S414 Q415 A416 A422 R435 Y437 Y442	I413-A418 HydrophobicContact CD1-CB 3.75Å; I413-A418 HydrophobicContact CG1-CB 4.32Å; S414-A418 PolarHBondContact O-N 2.85Å; Q415-A418 PolarHBondContact O-N 3.41Å; A416-A418 PolarHBondContact O-N 3.14Å; A418-A422 WeakPolarHBondContact O-CB 3.07Å; A418-A422 PolarHBondContact O-N 3Å; A418-R435 PolarHBondContact O-NH2 3.22Å; A418-R435 VanDerWaalsContact O-NH2 3.17Å; A418-Y437 WeakPolarHBondContact CB-OH 3.22Å; A418-Y442 HydrophobicContact CB-CD2 4.28Å; A418-Y442 HydrophobicContact CB-CE2 3.92Å
419	R	90.4	Very high	89.1	Confident	122 Å²	122	28.6 Å²	28.6	46%	0.46	15%	0.145	S	C	.	.	H	α-helix	trans	-70.8	-39.6	174	-71.7	170	-167.2	169.8	2.5	111.6	Q415 A416 S417 A422 G423 Y442	Q415-R419 VanDerWaalsContact O-CG 3.28Å; Q415-R419 WeakPolarHBondContact O-CG 3.44Å; Q415-R419 PolarHBondContact O-N 2.99Å; A416-R419 WeakPolarHBondContact O-CB 3.03Å; A416-R419 PolarHBondContact O-N 3.32Å; S417-R419 VanDerWaalsContact C-N 3.27Å; S417-R419 PolarHBondContact O-N 2.95Å; R419-A422 PolarHBondContact O-N 2.89Å; R419-G423 PolarHBondContact O-N 3.28Å; R419-Y442 PolarHBondContact NE-OH 2.75Å; R419-Y442 VanDerWaalsContact NE-OH 3.13Å
420	Q	89	Confident	89	Confident	16 Å²	16	31.2 Å²	31.2	8%	0.075	16%	0.161	C	C	.	.	H	α-helix	trans	-66.9	-43.4	176.9	-69.5	-172.5	7.1	0	0	112.7	H187 E377 A416 S417 G423 R424	H187-Q420 PolarHBondContact CD2-NE2 3.08Å; H187-Q420 PolarHBondContact NE2-NE2 3.06Å; E377-Q420 HydrophobicContact CG-CB 4.21Å; A416-Q420 WeakPolarHBondContact O-CG 3.34Å; A416-Q420 PolarHBondContact O-N 2.93Å; S417-Q420 WeakPolarHBondContact O-CB 2.97Å; S417-Q420 PolarHBondContact O-N 2.75Å; Q420-G423 PolarHBondContact O-N 2.89Å; Q420-R424 PolarHBondContact O-N 3.37Å
421	R	93.2	Very high	89	Confident	0 Å²	0	28.5 Å²	28.5	0%	0	15%	0.145	C	C	.	.	H	α-helix	trans	-56.5	-50.7	173.5	-69.3	-178.3	-179.2	-164.6	-2.3	110.5	F297 E377 V388 D390 F393 S417 G423 R424	F297-R421 HydrophobicContact CD1-CG 4.16Å; F297-R421 HydrophobicContact CD2-CB 3.86Å; F297-R421 HydrophobicContact CD2-CG 3.77Å; F297-R421 HydrophobicContact CE1-CG 4.05Å; F297-R421 HydrophobicContact CE2-CB 3.62Å; F297-R421 HydrophobicContact CE2-CG 3.65Å; F297-R421 HydrophobicContact CG-CG 4.02Å; F297-R421 HydrophobicContact CZ-CB 4.16Å; F297-R421 HydrophobicContact CZ-CG 3.8Å; E377-R421 HydrophobicContact CG-CG 3.95Å; E377-R421 IonicContact OE2-CZ 2.83Å; E377-R421 IonicContact OE2-NE 3.77Å; E377-R421 PolarHBondContact OE2-NE 2.93Å; E377-R421 VanDerWaalsContact OE2-NE 3.12Å; E377-R421 IonicContact OE2-NH2 3.59Å; E377-R421 PolarHBondContact OE2-NH2 3.26Å; V388-R421 WeakPolarHBondContact CG2-O 3.28Å; D390-R421 VanDerWaalsContact OD1-CD 3.28Å; D390-R421 WeakPolarHBondContact OD1-CD 3.34Å; D390-R421 IonicContact OD1-CZ 2.83Å; D390-R421 IonicContact OD1-NE 3.28Å; D390-R421 IonicContact OD1-NH1 3.5Å; D390-R421 PolarHBondContact OD1-NH1 3.01Å; F393-R421 PolarHBondContact O-NH1 3.27Å; F393-R421 VanDerWaalsContact O-NH1 3.12Å; F393-R421 PolarHBondContact O-NH2 3.05Å; F393-R421 VanDerWaalsContact O-NH2 3.16Å; S417-R421 WeakPolarHBondContact O-CG 3.44Å; S417-R421 PolarHBondContact O-N 2.9Å; R421-G423 VanDerWaalsContact C-N 3.31Å; R421-G423 PolarHBondContact O-N 3.34Å; R421-R424 WeakPolarHBondContact O-CB 3.42Å; R421-R424 WeakPolarHBondContact O-CG 3.43Å; R421-R424 PolarHBondContact O-N 3.09Å; R421-R424 VanDerWaalsContact O-N 3.17Å
422	A	92	Very high	89.2	Confident	3 Å²	3	28 Å²	28	3%	0.025	14%	0.142	C	C	.	.	H	α-helix	trans	-60.5	-39.1	176.4	0	0	0	0	0	112.7	I263 A418 R419 R424 A425 A433	I263-A422 HydrophobicContact CD1-CB 3.66Å; A418-A422 WeakPolarHBondContact O-CB 3.07Å; A418-A422 PolarHBondContact O-N 3Å; R419-A422 PolarHBondContact O-N 2.89Å; A422-R424 PolarHBondContact O-N 3.47Å; A422-R424 VanDerWaalsContact O-N 3.07Å; A422-A425 PolarHBondContact O-N 3.26Å; A422-A425 VanDerWaalsContact O-N 3.12Å; A422-A433 HydrophobicContact CB-CB 3.68Å
423	G	87.6	Confident	89.2	Confident	5 Å²	5	25.2 Å²	25.2	5%	0.052	12%	0.123	C	C	.	.	H	α-helix	trans	-59.2	-17.8	177.3	0	0	0	0	0	114.7	R419 Q420 R421 A425 G426	R419-G423 PolarHBondContact O-N 3.28Å; Q420-G423 PolarHBondContact O-N 2.89Å; R421-G423 VanDerWaalsContact C-N 3.31Å; R421-G423 PolarHBondContact O-N 3.34Å; G423-A425 VanDerWaalsContact C-N 3.26Å; G423-A425 PolarHBondContact O-N 2.97Å; G423-G426 PolarHBondContact O-N 3.19Å
424	R	89.1	Confident	89.3	Confident	10 Å²	10	26.3 Å²	26.3	4%	0.038	13%	0.128	C	C	.	.	G	3₁₀ helix	trans	-67	-24.3	175.4	-57.4	-67.8	150.2	176.8	-15.1	113.2	L295 F297 A376 E377 V380 V388 Q420 R421 A422	L295-R424 HydrophobicContact CD2-CB 3.9Å; L295-R424 HydrophobicContact CD2-CG 4.08Å; F297-R424 HydrophobicContact CZ-CG 4.36Å; A376-R424 WeakPolarHBondContact O-CD 3.26Å; A376-R424 PolarHBondContact O-NE 3.44Å; E377-R424 VanDerWaalsContact C-CZ 3.44Å; E377-R424 PolarHBondContact O-NE 3.06Å; E377-R424 PolarHBondContact O-NH2 3.42Å; V380-R424 PolarHBondContact O-NH1 3.12Å; V388-R424 HydrophobicContact CG2-CB 4Å; Q420-R424 PolarHBondContact O-N 3.37Å; R421-R424 WeakPolarHBondContact O-CB 3.42Å; R421-R424 WeakPolarHBondContact O-CG 3.43Å; R421-R424 PolarHBondContact O-N 3.09Å; R421-R424 VanDerWaalsContact O-N 3.17Å; A422-R424 PolarHBondContact O-N 3.47Å; A422-R424 VanDerWaalsContact O-N 3.07Å
425	A	89.4	Confident	89.5	Confident	0 Å²	0	26.6 Å²	26.6	0%	0	13%	0.128	C	C	.	.	G	3₁₀ helix	trans	-79.5	-16.7	178.5	0	0	0	0	0	114.2	V261 V388 A422 G423 G431	V261-A425 HydrophobicContact CG1-CB 4.06Å; V261-A425 HydrophobicContact CG2-CB 4.27Å; V388-A425 HydrophobicContact CB-CB 4.45Å; V388-A425 HydrophobicContact CG2-CB 3.84Å; A422-A425 PolarHBondContact O-N 3.26Å; A422-A425 VanDerWaalsContact O-N 3.12Å; G423-A425 VanDerWaalsContact C-N 3.26Å; G423-A425 PolarHBondContact O-N 2.97Å; A425-G431 VanDerWaalsContact O-CA 3.31Å; A425-G431 WeakPolarHBondContact O-CA 3.43Å
426	G	79	Confident	89.7	Confident	4 Å²	4	26.3 Å²	26.3	4%	0.041	13%	0.127	C	C	.	.	G	3₁₀ helix	trans	-105.9	23.1	-169.1	0	0	0	0	0	115.3	Y259 V261 G423	Y259-G426 WeakPolarHBondContact CB-O 3.36Å; Y259-G426 PolarHBondContact N-O 2.79Å; V261-G426 VanDerWaalsContact CG2-CA 3.42Å; G423-G426 PolarHBondContact O-N 3.19Å
427	R	75.3	Confident	90.1	Very high	23 Å²	23	26.7 Å²	26.7	9%	0.087	13%	0.127	C	C	.	.	S	Bend	trans	-91.1	-44.9	-174.1	-67.6	-164.8	175.5	175	8.6	114.1	T79 Q258 Y259 V380 T381	T79-R427 PolarHBondContact OG1-NH2 3.43Å; Q258-R427 PolarHBondContact OE1-O 3.16Å; Q258-R427 VanDerWaalsContact OE1-O 3.1Å; Y259-R427 WeakPolarHBondContact CD2-O 3.36Å; Y259-R427 WeakPolarHBondContact CE2-O 3.45Å; V380-R427 PolarHBondContact O-NH1 3.46Å; T381-R427 VanDerWaalsContact CA-NH1 3.27Å; T381-R427 PolarHBondContact OG1-NH1 3.07Å
428	T	73.4	Confident	90.3	Very high	52 Å²	52	27.5 Å²	27.5	32%	0.319	13%	0.131	S	C	.	.	S	Bend	trans	-103.9	-19.3	-175.3	49.6	0	0	0	0	113.7	Y259	Y259-T428 VanDerWaalsContact CD2-C 3.47Å; Y259-T428 VanDerWaalsContact CE2-O 3.31Å; Y259-T428 WeakPolarHBondContact CE2-O 3.24Å
429	R	81.9	Confident	90.5	Very high	109 Å²	109	32.7 Å²	32.7	41%	0.411	16%	0.156	S	C	.	.	S	Bend	trans	-166.9	178.3	177.5	61.8	-176.1	72.6	155.5	11.3	109.5	Y259 G291 S386 G431	Y259-R429 VanDerWaalsContact CB-O 3.24Å; Y259-R429 WeakPolarHBondContact CB-O 3.3Å; Y259-R429 VanDerWaalsContact CD2-N 3.29Å; Y259-R429 VanDerWaalsContact CG-CA 3.41Å; G291-R429 PolarHBondContact O-NH1 2.97Å; G291-R429 PolarHBondContact O-NH2 3.47Å; S386-R429 WeakPolarHBondContact OG-CD 3.37Å; R429-G431 PolarHBondContact O-N 3.23Å
430	T	88	Confident	90.8	Very high	95 Å²	95	32.4 Å²	32.4	58%	0.583	16%	0.159	S	C	*	.			trans	-57.7	133.1	172	49.7	0	0	0	0	111	T260	T260-T430 WeakPolarHBondContact O-CA 3.43Å
431	G	92.3	Very high	91.1	Very high	3 Å²	3	32.5 Å²	32.5	3%	0.031	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	170.5	-171.5	0	0	0	0	0	113.8	T260 V261 S262 S386 A425 R429	T260-G431 PolarHBondContact O-N 3.13Å; V261-G431 VanDerWaalsContact CA-O 3.31Å; V261-G431 WeakPolarHBondContact CA-O 3.29Å; S262-G431 PolarHBondContact N-O 3.31Å; S386-G431 CarbonylContact O-C 3.55Å; S386-G431 WeakPolarHBondContact O-CA 3.08Å; A425-G431 VanDerWaalsContact O-CA 3.31Å; A425-G431 WeakPolarHBondContact O-CA 3.43Å; R429-G431 PolarHBondContact O-N 3.23Å
432	Q	95.7	Very high	91.3	Very high	42 Å²	42	33.3 Å²	33.3	20%	0.196	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.4	138.5	173.4	-59.8	-176.5	-6	0	0	110.3	S262 F264 S386 Y387 V388 Y434	S262-Q432 CarbonylContact O-C 3.6Å; S262-Q432 WeakPolarHBondContact O-CA 3.42Å; F264-Q432 HydrophobicContact CD2-CB 4.4Å; F264-Q432 HydrophobicContact CE2-CB 3.96Å; F264-Q432 HydrophobicContact CE2-CG 3.96Å; S386-Q432 PolarHBondContact O-N 2.71Å; Y387-Q432 CarbonylContact C-O 3.59Å; Y387-Q432 VanDerWaalsContact CA-O 3.31Å; Y387-Q432 WeakPolarHBondContact CA-O 3.38Å; Y387-Q432 HydrophobicContact CD1-CB 4.1Å; Y387-Q432 HydrophobicContact CE1-CB 4.49Å; Y387-Q432 HydrophobicContact CE1-CG 4.48Å; V388-Q432 PolarHBondContact N-O 2.95Å; Q432-Y434 HydrophobicContact CB-CE2 3.89Å; Q432-Y434 PolarHBondContact OE1-OH 2.9Å
433	A	96.9	Very high	91.5	Very high	2 Å²	2	37.3 Å²	37.3	2%	0.017	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	126.1	173.3	0	0	0	0	0	110.1	V261 S262 I263 F264 V388 A422	V261-A433 HydrophobicContact CG1-CB 4.08Å; S262-A433 PolarHBondContact O-N 3.24Å; I263-A433 HydrophobicContact CD1-CB 3.79Å; F264-A433 PolarHBondContact N-O 2.78Å; V388-A433 HydrophobicContact CB-CB 4.2Å; V388-A433 CarbonylContact O-C 3.55Å; V388-A433 WeakPolarHBondContact O-CA 3.33Å; A422-A433 HydrophobicContact CB-CB 3.68Å
434	Y	98.2	Very high	91.9	Very high	25 Å²	25	44.3 Å²	44.3	10%	0.098	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.1	104.6	178.5	-64.4	-93.1	0	0	0	108.9	F264 T280 I284 Y387 V388 I389 D390 Q432	F264-Y434 HydrophobicContact CB-CD1 3.99Å; F264-Y434 HydrophobicContact CB-CE1 4.35Å; F264-Y434 HydrophobicContact CD2-CD1 4.22Å; F264-Y434 AromaticContact CD2-CE1 3.97Å; F264-Y434 HydrophobicContact CD2-CE1 3.97Å; F264-Y434 HydrophobicContact CG-CD1 4.29Å; F264-Y434 HydrophobicContact CG-CE1 4.17Å; T280-Y434 HydrophobicContact CG2-CD1 4.34Å; T280-Y434 HydrophobicContact CG2-CG 4.1Å; I284-Y434 HydrophobicContact CD1-CD2 3.71Å; I284-Y434 HydrophobicContact CD1-CE2 3.55Å; I284-Y434 HydrophobicContact CD1-CG 4.49Å; I284-Y434 HydrophobicContact CG1-CE2 4.01Å; Y387-Y434 HydrophobicContact CD1-CE2 4.28Å; V388-Y434 PolarHBondContact O-N 2.8Å; I389-Y434 WeakPolarHBondContact CA-O 3.36Å; D390-Y434 PolarHBondContact N-O 3.26Å; Q432-Y434 HydrophobicContact CB-CE2 3.89Å; Q432-Y434 PolarHBondContact OE1-OH 2.9Å
435	R	98.2	Very high	92.1	Very high	10 Å²	10	50.2 Å²	50.2	4%	0.038	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.2	120.8	177	-68.9	175.8	168.8	177.9	-5.2	109.1	I263 F264 Y265 S266 D390 A418 Y437 Y442	I263-R435 HydrophobicContact CG2-CG 4.45Å; F264-R435 PolarHBondContact O-N 3.34Å; Y265-R435 HydrophobicContact CD1-CB 3.97Å; Y265-R435 HydrophobicContact CD1-CG 4.48Å; Y265-R435 HydrophobicContact CE1-CB 4.45Å; Y265-R435 HydrophobicContact CE1-CG 4.5Å; Y265-R435 PolarHBondContact OH-NH1 3.34Å; S266-R435 PolarHBondContact N-O 3.22Å; S266-R435 VanDerWaalsContact N-O 3.08Å; D390-R435 HydrophobicContact CB-CG 4.48Å; A418-R435 PolarHBondContact O-NH2 3.22Å; A418-R435 VanDerWaalsContact O-NH2 3.17Å; R435-Y437 HydrophobicContact CB-CD1 4.12Å; R435-Y437 HydrophobicContact CB-CD2 4.21Å; R435-Y437 HydrophobicContact CB-CE1 3.75Å; R435-Y437 HydrophobicContact CB-CE2 3.86Å; R435-Y437 HydrophobicContact CB-CG 4.34Å; R435-Y437 VanDerWaalsContact CD-OH 3.32Å; R435-Y437 WeakPolarHBondContact CD-OH 3.46Å; R435-Y437 HydrophobicContact CG-CE1 4.03Å; R435-Y437 HydrophobicContact CG-CE2 4.03Å; R435-Y437 WeakPolarHBondContact CG-OH 3.28Å; R435-Y437 PolarHBondContact NE-OH 2.87Å; R435-Y437 PolarHBondContact O-N 3.03Å; R435-Y442 VanDerWaalsContact NH1-CD2 3.26Å
436	L	97.8	Very high	92.4	Very high	16 Å²	16	51 Å²	51	8%	0.084	25%	0.252	C	S	.	.	S	Bend	trans	-81.9	34.4	-179.4	-54.9	-178.3	0	0	0	112.2	V270 A276 A277 I389 D390	V270-L436 WeakPolarHBondContact CB-O 3.5Å; V270-L436 HydrophobicContact CG2-CB 4.38Å; V270-L436 VanDerWaalsContact CG2-O 3.24Å; V270-L436 WeakPolarHBondContact CG2-O 3.41Å; A276-L436 HydrophobicContact CB-CD1 4.3Å; A276-L436 HydrophobicContact CB-CD2 4.37Å; A277-L436 HydrophobicContact CB-CD1 3.88Å; I389-L436 HydrophobicContact CG2-CD1 3.79Å; I389-L436 HydrophobicContact CG2-CD2 4.13Å; I389-L436 HydrophobicContact CG2-CG 3.97Å; D390-L436 PolarHBondContact O-N 2.96Å
437	Y	97.6	Very high	93.1	Very high	20 Å²	20	54 Å²	54	8%	0.078	27%	0.271	C	S	.	.	S	Bend	trans	-148	159.1	179.7	48	-89.3	0	0	0	108.6	S266 D390 A418 R435 Y442 L446	S266-Y437 PolarHBondContact N-O 3.44Å; S266-Y437 VanDerWaalsContact N-O 3.11Å; D390-Y437 HydrophobicContact CB-CE1 4.38Å; D390-Y437 PolarHBondContact OD2-OH 3.41Å; A418-Y437 WeakPolarHBondContact CB-OH 3.22Å; R435-Y437 HydrophobicContact CB-CD1 4.12Å; R435-Y437 HydrophobicContact CB-CD2 4.21Å; R435-Y437 HydrophobicContact CB-CE1 3.75Å; R435-Y437 HydrophobicContact CB-CE2 3.86Å; R435-Y437 HydrophobicContact CB-CG 4.34Å; R435-Y437 VanDerWaalsContact CD-OH 3.32Å; R435-Y437 WeakPolarHBondContact CD-OH 3.46Å; R435-Y437 HydrophobicContact CG-CE1 4.03Å; R435-Y437 HydrophobicContact CG-CE2 4.03Å; R435-Y437 WeakPolarHBondContact CG-OH 3.28Å; R435-Y437 PolarHBondContact NE-OH 2.87Å; R435-Y437 PolarHBondContact O-N 3.03Å; Y437-Y442 HydrophobicContact CE2-CD2 4.12Å; Y437-Y442 HydrophobicContact CE2-CG 4.46Å; Y437-L446 HydrophobicContact CE2-CD1 4.08Å
438	T	97.7	Very high	93.9	Very high	21 Å²	21	61.6 Å²	61.6	13%	0.129	30%	0.299	C	S	.	.			trans	-74.4	156	-175.9	65.9	0	0	0	0	111.5	S266 L267 P269 E440 A441 Y442	S266-T438 WeakPolarHBondContact O-CA 3.42Å; L267-T438 WeakPolarHBondContact O-CG2 3.49Å; P269-T438 HydrophobicContact CG-CG2 4.33Å; T438-E440 PolarHBondContact O-N 3.16Å; T438-A441 PolarHBondContact O-N 3.5Å; T438-A441 WeakPolarHBondContact OG1-CB 3.37Å; T438-A441 PolarHBondContact OG1-N 2.86Å; T438-A441 VanDerWaalsContact OG1-N 3.13Å; T438-Y442 PolarHBondContact O-N 3.4Å; T438-Y442 VanDerWaalsContact O-N 3.08Å
439	E	97.4	Very high	94.6	Very high	108 Å²	108	62.8 Å²	62.8	51%	0.505	30%	0.3	S	S	.	.	H	α-helix	trans	-62.6	-35.6	174.3	-177	163.8	-143.6	0	0	111.7	Y265 Y442 N443	Y265-E439 HydrophobicContact CD1-CB 4.03Å; Y265-E439 HydrophobicContact CD2-CB 3.74Å; Y265-E439 HydrophobicContact CD2-CG 4.1Å; Y265-E439 HydrophobicContact CE1-CB 4.27Å; Y265-E439 HydrophobicContact CE1-CG 4.43Å; Y265-E439 HydrophobicContact CE2-CB 3.99Å; Y265-E439 HydrophobicContact CE2-CG 3.83Å; Y265-E439 HydrophobicContact CG-CB 3.75Å; Y265-E439 HydrophobicContact CG-CG 4.49Å; E439-Y442 WeakPolarHBondContact O-CB 3.37Å; E439-Y442 PolarHBondContact O-N 2.67Å; E439-N443 WeakPolarHBondContact CG-ND2 3.4Å; E439-N443 PolarHBondContact O-N 3.08Å; E439-N443 PolarHBondContact O-ND2 2.89Å; E439-N443 VanDerWaalsContact O-ND2 3.17Å
440	E	96.8	Very high	95	Very high	116 Å²	116	60.3 Å²	60.3	54%	0.542	30%	0.298	S	S	.	.	H	α-helix	trans	-60.9	-45.6	173.5	-176.5	173	-163.3	0	0	111.8	T438 Y442 N443 K444	T438-E440 PolarHBondContact O-N 3.16Å; E440-Y442 VanDerWaalsContact C-N 3.31Å; E440-Y442 PolarHBondContact O-N 3Å; E440-N443 PolarHBondContact O-N 2.8Å; E440-K444 HydrophobicContact CG-CD 3.77Å; E440-K444 HydrophobicContact CG-CG 4.29Å; E440-K444 WeakPolarHBondContact O-CB 3.35Å; E440-K444 PolarHBondContact O-N 2.76Å; E440-K444 WeakPolarHBondContact OE1-CE 3.43Å; E440-K444 IonicContact OE1-NZ 3.33Å; E440-K444 PolarHBondContact OE1-NZ 2.86Å
441	A	96.1	Very high	95.2	Very high	19 Å²	19	61.3 Å²	61.3	16%	0.157	30%	0.298	C	S	.	.	H	α-helix	trans	-60.9	-41.6	176.8	0	0	0	0	0	111.6	T438 N443 L445 L446	T438-A441 PolarHBondContact O-N 3.5Å; T438-A441 WeakPolarHBondContact OG1-CB 3.37Å; T438-A441 PolarHBondContact OG1-N 2.86Å; T438-A441 VanDerWaalsContact OG1-N 3.13Å; A441-N443 PolarHBondContact O-N 3.23Å; A441-L445 HydrophobicContact CB-CD1 3.93Å; A441-L445 HydrophobicContact CB-CG 4.48Å; A441-L445 WeakPolarHBondContact O-CA 3.44Å; A441-L445 VanDerWaalsContact O-CB 3.31Å; A441-L445 WeakPolarHBondContact O-CB 3.44Å; A441-L445 PolarHBondContact O-N 2.7Å; A441-L446 PolarHBondContact O-N 3.35Å
442	Y	97.2	Very high	95.2	Very high	16 Å²	16	61.5 Å²	61.5	6%	0.063	30%	0.299	C	S	.	.	H	α-helix	trans	-58.9	-45.5	175.4	172.3	-99.1	0	0	0	112.5	Y265 Q415 A418 R419 R435 Y437 T438 E439 E440 L446	Y265-Y442 HydrophobicContact CE1-CD1 4.3Å; Y265-Y442 HydrophobicContact CE1-CG 4.01Å; Q415-Y442 HydrophobicContact CB-CE2 4Å; Q415-Y442 HydrophobicContact CG-CD2 4.43Å; Q415-Y442 HydrophobicContact CG-CE2 3.99Å; Q415-Y442 PolarHBondContact NE2-O 3.18Å; A418-Y442 HydrophobicContact CB-CD2 4.28Å; A418-Y442 HydrophobicContact CB-CE2 3.92Å; R419-Y442 PolarHBondContact NE-OH 2.75Å; R419-Y442 VanDerWaalsContact NE-OH 3.13Å; R435-Y442 VanDerWaalsContact NH1-CD2 3.26Å; Y437-Y442 HydrophobicContact CE2-CD2 4.12Å; Y437-Y442 HydrophobicContact CE2-CG 4.46Å; T438-Y442 PolarHBondContact O-N 3.4Å; T438-Y442 VanDerWaalsContact O-N 3.08Å; E439-Y442 WeakPolarHBondContact O-CB 3.37Å; E439-Y442 PolarHBondContact O-N 2.67Å; E440-Y442 VanDerWaalsContact C-N 3.31Å; E440-Y442 PolarHBondContact O-N 3Å; Y442-L446 HydrophobicContact CD2-CD1 3.96Å
443	N	96.3	Very high	95.1	Very high	88 Å²	88	62.3 Å²	62.3	47%	0.471	30%	0.303	S	S	.	.	H	α-helix	trans	-79.2	-37.7	-174.6	-72.2	-40.5	0	0	0	113.3	E439 E440 A441	E439-N443 WeakPolarHBondContact CG-ND2 3.4Å; E439-N443 PolarHBondContact O-N 3.08Å; E439-N443 PolarHBondContact O-ND2 2.89Å; E439-N443 VanDerWaalsContact O-ND2 3.17Å; E440-N443 PolarHBondContact O-N 2.8Å; A441-N443 PolarHBondContact O-N 3.23Å
444	K	95	Very high	94.9	Very high	152 Å²	152	62.2 Å²	62.2	66%	0.661	30%	0.302	S	S	*	.	H	α-helix	trans	-101.9	-35.5	-172.1	-62.9	-174.1	-175.2	171.6	0	114.5	E440	E440-K444 HydrophobicContact CG-CD 3.77Å; E440-K444 HydrophobicContact CG-CG 4.29Å; E440-K444 WeakPolarHBondContact O-CB 3.35Å; E440-K444 PolarHBondContact O-N 2.76Å; E440-K444 WeakPolarHBondContact OE1-CE 3.43Å; E440-K444 IonicContact OE1-NZ 3.33Å; E440-K444 PolarHBondContact OE1-NZ 2.86Å
445	L	94.4	Very high	94.6	Very high	133 Å²	133	63.1 Å²	63.1	70%	0.696	31%	0.309	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.8	-33.5	-171.8	-56.6	178.7	0	0	0	112.9	A441	A441-L445 HydrophobicContact CB-CD1 3.93Å; A441-L445 HydrophobicContact CB-CG 4.48Å; A441-L445 WeakPolarHBondContact O-CA 3.44Å; A441-L445 VanDerWaalsContact O-CB 3.31Å; A441-L445 WeakPolarHBondContact O-CB 3.44Å; A441-L445 PolarHBondContact O-N 2.7Å
446	L	95.3	Very high	94.3	Very high	16 Å²	16	64.2 Å²	64.2	8%	0.084	31%	0.313	C	S	.	.	S	Bend	trans	-79	130.2	-178.2	-57.5	-169.5	0	0	0	111.4	P412 I413 Q415 Y437 A441 Y442	P412-L446 HydrophobicContact CB-CD2 3.6Å; I413-L446 HydrophobicContact CG1-CD1 4.24Å; I413-L446 WeakPolarHBondContact O-CD2 3.38Å; Q415-L446 HydrophobicContact CG-CB 4.02Å; Q415-L446 PolarHBondContact NE2-O 2.83Å; Y437-L446 HydrophobicContact CE2-CD1 4.08Å; A441-L446 PolarHBondContact O-N 3.35Å; Y442-L446 HydrophobicContact CD2-CD1 3.96Å
447	P	94	Very high	94	Very high	67 Å²	67	63.9 Å²	63.9	44%	0.435	31%	0.312	S	S	.	.			trans	-65.3	153.2	174.5	29.2	-34.6	0	0	0	110.3	S414 Q415 F449	S414-P447 CarbonylContact C-O 3.55Å; S414-P447 WeakPolarHBondContact CA-O 3.36Å; S414-P447 WeakPolarHBondContact CB-O 3.24Å; Q415-P447 PolarHBondContact N-O 3.44Å; P447-F449 VanDerWaalsContact C-N 3.32Å; P447-F449 PolarHBondContact O-N 2.85Å
448	R	91.3	Very high	93.7	Very high	183 Å²	183	64.4 Å²	64.4	69%	0.691	32%	0.315	S	S	*	.	S	Bend	trans	-60.6	-43	178.7	-70.7	-174.7	177.4	-177.9	0.2	112.1	A416	A416-R448 WeakPolarHBondContact CB-O 3.43Å; A416-R448 PolarHBondContact N-O 2.85Å; A416-R448 VanDerWaalsContact N-O 3.07Å
449	F	89.6	Confident	93.5	Very high	78 Å²	78	63.4 Å²	63.4	34%	0.342	31%	0.309	S	S	.	.	S	Bend	trans	-135.2	154.6	-174.9	-54.4	-70.2	0	0	0	111.1	E221 S414 A416 P447	E221-F449 HydrophobicContact CG-CD1 3.86Å; E221-F449 HydrophobicContact CG-CD2 4.34Å; E221-F449 HydrophobicContact CG-CE1 3.48Å; E221-F449 VanDerWaalsContact CG-CE1 3.48Å; E221-F449 HydrophobicContact CG-CE2 4.01Å; E221-F449 HydrophobicContact CG-CG 4.27Å; E221-F449 HydrophobicContact CG-CZ 3.56Å; E221-F449 WeakPolarHBondContact OE1-CD1 3.31Å; E221-F449 WeakPolarHBondContact OE1-CE1 3.46Å; E221-F449 WeakPolarHBondContact OE1-CG 3.39Å; S414-F449 VanDerWaalsContact CB-C 3.4Å; A416-F449 HydrophobicContact CB-CD1 3.75Å; A416-F449 HydrophobicContact CB-CE1 4.15Å; P447-F449 VanDerWaalsContact C-N 3.32Å; P447-F449 PolarHBondContact O-N 2.85Å
450	T	89.8	Confident	93.3	Very high	57 Å²	57	58.3 Å²	58.3	35%	0.35	29%	0.286	S	S	.	.	P	Polyproline II helix	trans	-80.6	138	173.3	-52.9	0	0	0	0	108.6	S414	S414-T450 PolarHBondContact OG-N 2.66Å; S414-T450 PolarHBondContact OG-OG1 2.87Å
451	L	91.5	Very high	93.1	Very high	115 Å²	115	53.1 Å²	53.1	60%	0.602	26%	0.264	S	S	*	.	P	Polyproline II helix	trans	-61.9	135.9	176.1	-69.9	173.5	0	0	0	110.8	L455 R456	L451-L455 HydrophobicContact CD2-CD1 4.37Å; L451-R456 PolarHBondContact O-NE 3.21Å; L451-R456 VanDerWaalsContact O-NE 3.14Å
452	P	92.9	Very high	92.9	Very high	8 Å²	8	52.3 Å²	52.3	5%	0.052	26%	0.257	C	S	.	.	P	Polyproline II helix	trans	-61.1	150.5	178	29.7	-39.2	0	0	0	111.1	R189 S454 L455 D481	R189-P452 HydrophobicContact CB-CB 3.68Å; R189-P452 HydrophobicContact CG-CB 4.32Å; P452-S454 PolarHBondContact O-N 3.01Å; P452-L455 HydrophobicContact CG-CB 4.39Å; P452-L455 HydrophobicContact CG-CD1 3.64Å; P452-L455 HydrophobicContact CG-CG 3.73Å; P452-L455 PolarHBondContact O-N 2.88Å; P452-L455 VanDerWaalsContact O-N 3.12Å; P452-D481 HydrophobicContact CG-CB 4.36Å
453	E	93	Very high	92.7	Very high	58 Å²	58	51.6 Å²	51.6	27%	0.271	25%	0.254	S	S	.	.	G	3₁₀ helix	trans	-59.7	-35.7	-178	-78.9	-173.1	166.4	0	0	112.9	R189 S190 L191 L455 R456 V457	R189-E453 PolarHBondContact O-N 3.22Å; S190-E453 WeakPolarHBondContact CA-OE2 3.36Å; L191-E453 HydrophobicContact CB-CB 4Å; L191-E453 PolarHBondContact N-OE2 2.79Å; E453-L455 PolarHBondContact O-N 3.07Å; E453-R456 PolarHBondContact O-N 3.27Å; E453-R456 IonicContact OE1-NH2 3.39Å; E453-V457 HydrophobicContact CB-CG1 4.18Å; E453-V457 HydrophobicContact CB-CG2 4.36Å; E453-V457 HydrophobicContact CG-CG1 4.28Å; E453-V457 VanDerWaalsContact O-CG2 3.27Å; E453-V457 WeakPolarHBondContact O-CG2 3.31Å; E453-V457 PolarHBondContact O-N 3.09Å
454	S	92.3	Very high	92.7	Very high	0 Å²	0	47.5 Å²	47.5	0%	0	23%	0.232	C	C	.	.	G	3₁₀ helix	trans	-51.2	-28.6	175.7	50.2	0	0	0	0	113.9	D194 P452 P483	D194-S454 PolarHBondContact OD2-OG 3.36Å; P452-S454 PolarHBondContact O-N 3.01Å; S454-P483 WeakPolarHBondContact O-CB 3.23Å
455	L	92.8	Very high	92.5	Very high	45 Å²	45	41.2 Å²	41.2	24%	0.236	20%	0.204	C	C	.	.	G	3₁₀ helix	trans	-90.8	-14.3	179.6	-60.1	-177.9	0	0	0	114.3	L451 P452 E453 P482 H487	L451-L455 HydrophobicContact CD2-CD1 4.37Å; P452-L455 HydrophobicContact CG-CB 4.39Å; P452-L455 HydrophobicContact CG-CD1 3.64Å; P452-L455 HydrophobicContact CG-CG 3.73Å; P452-L455 PolarHBondContact O-N 2.88Å; P452-L455 VanDerWaalsContact O-N 3.12Å; E453-L455 PolarHBondContact O-N 3.07Å; L455-P482 WeakPolarHBondContact CD2-O 3.41Å; L455-H487 PolarHBondContact O-CE1 2.99Å
456	R	92	Very high	92.5	Very high	33 Å²	33	34.9 Å²	34.9	13%	0.125	17%	0.171	C	C	.	.	T	Hydrogen-bonded Turn	trans	-131.6	-2	-165.7	65.6	174.3	173.9	79.6	1.2	116	R397 A398 Y399 L451 E453	R397-R456 PolarHBondContact O-NH1 3.29Å; A398-R456 CarbonylContact C-O 3.39Å; A398-R456 WeakPolarHBondContact CA-O 3.36Å; Y399-R456 PolarHBondContact N-O 3.23Å; L451-R456 PolarHBondContact O-NE 3.21Å; L451-R456 VanDerWaalsContact O-NE 3.14Å; E453-R456 PolarHBondContact O-N 3.27Å; E453-R456 IonicContact OE1-NH2 3.39Å
457	V	91.6	Very high	92.4	Very high	9 Å²	9	34.7 Å²	34.7	6%	0.055	17%	0.17	C	C	.	.	S	Bend	trans	-118.7	164.9	179.4	-50.4	0	0	0	0	111.4	L191 R397 E453 L459	L191-V457 HydrophobicContact CD2-CG2 3.81Å; R397-V457 HydrophobicContact CB-CG1 4.09Å; E453-V457 HydrophobicContact CB-CG1 4.18Å; E453-V457 HydrophobicContact CB-CG2 4.36Å; E453-V457 HydrophobicContact CG-CG1 4.28Å; E453-V457 VanDerWaalsContact O-CG2 3.27Å; E453-V457 WeakPolarHBondContact O-CG2 3.31Å; E453-V457 PolarHBondContact O-N 3.09Å; V457-L459 PolarHBondContact O-N 2.85Å
458	D	90.5	Very high	92.2	Very high	30 Å²	30	33.7 Å²	33.7	16%	0.16	16%	0.162	C	C	.	.			trans	-64.9	126.8	172.2	174.8	26.8	0	0	0	110.5	Y399 S460 S491	Y399-D458 HydrophobicContact CD2-CB 4.01Å; Y399-D458 HydrophobicContact CE2-CB 4.2Å; Y399-D458 HydrophobicContact CG-CB 4.38Å; D458-S460 VanDerWaalsContact CG-OG 3.31Å; D458-S460 WeakPolarHBondContact OD1-CB 3.2Å; D458-S460 PolarHBondContact OD1-N 3.27Å; D458-S460 PolarHBondContact OD1-OG 3.11Å; D458-S460 WeakPolarHBondContact OD2-CB 3.47Å; D458-S460 PolarHBondContact OD2-OG 3.13Å; D458-S460 VanDerWaalsContact OD2-OG 3.14Å; D458-S491 PolarHBondContact OD1-OG 3Å
459	L	93	Very high	92.2	Very high	0 Å²	0	26.9 Å²	26.9	0%	0	14%	0.139	C	C	.	.			trans	-89.6	-3	-177.4	-58.7	177.2	0	0	0	112.9	L191 V457 G461 A462 L463 P483 H487 V488 S491	L191-L459 HydrophobicContact CD1-CD2 3.73Å; L191-L459 HydrophobicContact CD2-CD2 4.37Å; V457-L459 PolarHBondContact O-N 2.85Å; L459-G461 VanDerWaalsContact C-N 3.29Å; L459-G461 PolarHBondContact O-N 3.31Å; L459-A462 WeakPolarHBondContact O-CA 3.35Å; L459-A462 WeakPolarHBondContact O-CB 3.27Å; L459-A462 PolarHBondContact O-N 2.83Å; L459-L463 HydrophobicContact CB-CD1 4.48Å; L459-L463 HydrophobicContact CB-CG 4.15Å; L459-L463 WeakPolarHBondContact O-CG 3.14Å; L459-L463 PolarHBondContact O-N 3.44Å; L459-P483 HydrophobicContact CD1-CB 3.56Å; L459-P483 HydrophobicContact CD1-CG 3.81Å; L459-H487 HydrophobicContact CD1-CB 4.22Å; L459-V488 HydrophobicContact CD1-CG2 4.01Å; L459-S491 PolarHBondContact N-OG 2.89Å; L459-S491 VanDerWaalsContact N-OG 3.14Å
460	S	93.2	Very high	92.2	Very high	2 Å²	2	25.6 Å²	25.6	1%	0.014	15%	0.148	C	C	.	.	H	α-helix	trans	-52.8	-45.1	-174.6	-58.3	0	0	0	0	112.5	D458 L464 S491	D458-S460 VanDerWaalsContact CG-OG 3.31Å; D458-S460 WeakPolarHBondContact OD1-CB 3.2Å; D458-S460 PolarHBondContact OD1-N 3.27Å; D458-S460 PolarHBondContact OD1-OG 3.11Å; D458-S460 WeakPolarHBondContact OD2-CB 3.47Å; D458-S460 PolarHBondContact OD2-OG 3.13Å; D458-S460 VanDerWaalsContact OD2-OG 3.14Å; S460-L464 WeakPolarHBondContact O-CB 3.49Å; S460-L464 PolarHBondContact O-N 3.4Å; S460-S491 PolarHBondContact N-OG 2.89Å
461	G	92.6	Very high	92.4	Very high	7 Å²	7	24 Å²	24	7%	0.072	14%	0.137	C	C	.	.	H	α-helix	trans	-66.2	-38.5	176.8	0	0	0	0	0	113.6	L459 R465 D526	L459-G461 VanDerWaalsContact C-N 3.29Å; L459-G461 PolarHBondContact O-N 3.31Å; G461-R465 WeakPolarHBondContact O-CG 3.2Å; G461-R465 PolarHBondContact O-N 2.95Å; G461-R465 VanDerWaalsContact O-N 3.15Å; G461-D526 WeakPolarHBondContact CA-O 3.35Å
462	A	92.2	Very high	92.3	Very high	2 Å²	2	22.3 Å²	22.3	2%	0.017	13%	0.128	C	C	.	.	H	α-helix	trans	-67.7	-47.1	177	0	0	0	0	0	112.2	L191 I195 L459 L464 R465 L466	L191-A462 HydrophobicContact CD1-CB 4.12Å; L191-A462 HydrophobicContact CD2-CB 3.81Å; L191-A462 HydrophobicContact CG-CB 4.1Å; I195-A462 HydrophobicContact CD1-CB 3.45Å; I195-A462 VanDerWaalsContact CD1-CB 3.45Å; I195-A462 HydrophobicContact CG1-CB 4.42Å; L459-A462 WeakPolarHBondContact O-CA 3.35Å; L459-A462 WeakPolarHBondContact O-CB 3.27Å; L459-A462 PolarHBondContact O-N 2.83Å; A462-L464 VanDerWaalsContact C-N 3.31Å; A462-L464 PolarHBondContact O-N 3.34Å; A462-R465 PolarHBondContact O-N 3.4Å; A462-L466 WeakPolarHBondContact O-CG 3.25Å; A462-L466 PolarHBondContact O-N 3.43Å
463	L	94.3	Very high	92.1	Very high	1 Å²	1	30.4 Å²	30.4	1%	0.005	16%	0.158	C	C	.	.	H	α-helix	trans	-62.5	-40.2	179	-64.2	-171.8	0	0	0	111.2	L459 L466 K467 L474 V488 A492 L495	L459-L463 HydrophobicContact CB-CD1 4.48Å; L459-L463 HydrophobicContact CB-CG 4.15Å; L459-L463 WeakPolarHBondContact O-CG 3.14Å; L459-L463 PolarHBondContact O-N 3.44Å; L463-L466 HydrophobicContact CD2-CD1 4.4Å; L463-L466 PolarHBondContact O-N 2.91Å; L463-K467 WeakPolarHBondContact O-CB 3.46Å; L463-K467 WeakPolarHBondContact O-CG 3.48Å; L463-K467 PolarHBondContact O-N 3.38Å; L463-L474 HydrophobicContact CB-CD1 4.1Å; L463-L474 HydrophobicContact CD1-CD1 4.35Å; L463-L474 HydrophobicContact CD2-CB 4.25Å; L463-L474 HydrophobicContact CD2-CD1 4.21Å; L463-L474 HydrophobicContact CD2-CD2 4.09Å; L463-L474 HydrophobicContact CD2-CG 4.41Å; L463-L474 HydrophobicContact CG-CD1 4.44Å; L463-V488 HydrophobicContact CD1-CG1 4.09Å; L463-V488 HydrophobicContact CD2-CG1 4.39Å; L463-A492 HydrophobicContact CD1-CB 4.47Å; L463-L495 HydrophobicContact CB-CD1 3.82Å
464	L	94.6	Very high	91.8	Very high	1 Å²	1	28.4 Å²	28.4	1%	0.005	15%	0.149	C	C	.	.	H	α-helix	trans	-59.6	-48.3	174	-177	63.9	0	0	0	111.2	S460 A462 L466 K467 T468 L495 A500 L508 L516 A517 P528	S460-L464 WeakPolarHBondContact O-CB 3.49Å; S460-L464 PolarHBondContact O-N 3.4Å; A462-L464 VanDerWaalsContact C-N 3.31Å; A462-L464 PolarHBondContact O-N 3.34Å; L464-L466 PolarHBondContact O-N 2.88Å; L464-K467 WeakPolarHBondContact O-CB 3.31Å; L464-K467 PolarHBondContact O-N 2.92Å; L464-T468 PolarHBondContact O-N 2.82Å; L464-T468 PolarHBondContact O-OG1 2.94Å; L464-L495 HydrophobicContact CB-CD1 4.24Å; L464-L495 HydrophobicContact CB-CD2 4.06Å; L464-L495 HydrophobicContact CD1-CD2 4.4Å; L464-A500 HydrophobicContact CD1-CB 4.17Å; L464-L508 HydrophobicContact CD1-CD2 3.8Å; L464-L516 HydrophobicContact CD1-CD2 4.31Å; L464-L516 HydrophobicContact CD2-CD2 3.41Å; L464-L516 VanDerWaalsContact CD2-CD2 3.41Å; L464-A517 HydrophobicContact CD1-CB 4.07Å; L464-A517 HydrophobicContact CG-CB 4.36Å; L464-P528 HydrophobicContact CB-CG 4.5Å; L464-P528 HydrophobicContact CD2-CB 4.15Å; L464-P528 HydrophobicContact CD2-CG 4.01Å
465	R	91.8	Very high	91.5	Very high	20 Å²	20	32.8 Å²	32.8	8%	0.075	19%	0.185	C	C	.	.	H	α-helix	trans	-62.1	-42.4	177.9	-73.5	176.6	-170.1	167.7	10.2	112.7	Q192 G461 A462 K467 T468 L469 D526	Q192-R465 VanDerWaalsContact CD-NH1 3.28Å; G461-R465 WeakPolarHBondContact O-CG 3.2Å; G461-R465 PolarHBondContact O-N 2.95Å; G461-R465 VanDerWaalsContact O-N 3.15Å; A462-R465 PolarHBondContact O-N 3.4Å; R465-K467 VanDerWaalsContact C-N 3.3Å; R465-K467 PolarHBondContact O-N 3.24Å; R465-T468 WeakPolarHBondContact O-CB 3.4Å; R465-T468 PolarHBondContact O-N 2.83Å; R465-L469 WeakPolarHBondContact O-CG 3.32Å; R465-L469 PolarHBondContact O-N 2.85Å; R465-D526 IonicContact CZ-OD1 3.17Å; R465-D526 IonicContact NH1-OD1 2.72Å; R465-D526 IonicContact NH2-OD1 3.25Å; R465-D526 PolarHBondContact NH2-OD1 2.99Å
466	L	93.5	Very high	91.3	Very high	0 Å²	0	37 Å²	37	0%	0	20%	0.204	C	C	.	.	H	α-helix	trans	-59.4	-43.3	175.3	-74.3	175.3	0	0	0	111.1	I195 L199 A462 L463 L464 L469 G470 I471 L474 F477 W479	I195-L466 HydrophobicContact CG2-CD2 3.96Å; L199-L466 HydrophobicContact CD2-CD2 4.22Å; A462-L466 WeakPolarHBondContact O-CG 3.25Å; A462-L466 PolarHBondContact O-N 3.43Å; L463-L466 HydrophobicContact CD2-CD1 4.4Å; L463-L466 PolarHBondContact O-N 2.91Å; L464-L466 PolarHBondContact O-N 2.88Å; L466-L469 CarbonylContact O-C 3.54Å; L466-L469 WeakPolarHBondContact O-CB 3.34Å; L466-L469 PolarHBondContact O-N 3.32Å; L466-G470 PolarHBondContact O-N 3.36Å; L466-I471 HydrophobicContact CB-CB 4.16Å; L466-I471 HydrophobicContact CD2-CG1 4.25Å; L466-I471 VanDerWaalsContact O-CB 3.26Å; L466-I471 WeakPolarHBondContact O-CB 3.37Å; L466-I471 PolarHBondContact O-N 3.18Å; L466-L474 HydrophobicContact CB-CD2 3.77Å; L466-L474 HydrophobicContact CD1-CD2 4.2Å; L466-F477 HydrophobicContact CD1-CD1 4.35Å; L466-F477 HydrophobicContact CD1-CD2 4.4Å; L466-F477 HydrophobicContact CD1-CG 4.23Å; L466-F477 HydrophobicContact CD2-CD2 4Å; L466-F477 HydrophobicContact CD2-CE1 4.37Å; L466-F477 HydrophobicContact CD2-CE2 3.55Å; L466-F477 HydrophobicContact CD2-CZ 3.75Å; L466-W479 HydrophobicContact CD1-CH2 4.48Å; L466-W479 HydrophobicContact CD1-CZ2 4.05Å
467	K	92.9	Very high	91.4	Very high	13 Å²	13	36 Å²	36	6%	0.057	20%	0.2	C	C	.	.	H	α-helix	trans	-63.2	-41.7	174.9	-80.6	-79.3	169.4	175.2	0	112.5	L463 L464 R465 L469 G470 D472 L474 L501 G506 L508	L463-K467 WeakPolarHBondContact O-CB 3.46Å; L463-K467 WeakPolarHBondContact O-CG 3.48Å; L463-K467 PolarHBondContact O-N 3.38Å; L464-K467 WeakPolarHBondContact O-CB 3.31Å; L464-K467 PolarHBondContact O-N 2.92Å; R465-K467 VanDerWaalsContact C-N 3.3Å; R465-K467 PolarHBondContact O-N 3.24Å; K467-L469 PolarHBondContact O-N 3.43Å; K467-G470 PolarHBondContact O-N 2.82Å; K467-D472 WeakPolarHBondContact CE-O 3.16Å; K467-D472 VanDerWaalsContact NZ-CA 3.3Å; K467-D472 PolarHBondContact NZ-O 2.79Å; K467-D472 IonicContact NZ-OD1 3.76Å; K467-D472 PolarHBondContact NZ-OD1 3.49Å; K467-L474 HydrophobicContact CG-CD1 4.05Å; K467-L474 HydrophobicContact CG-CD2 4.17Å; K467-L474 HydrophobicContact CG-CG 4.4Å; K467-L501 HydrophobicContact CB-CD2 4.39Å; K467-L501 HydrophobicContact CD-CD2 4.13Å; K467-L501 HydrophobicContact CG-CD2 3.94Å; K467-G506 WeakPolarHBondContact CE-O 3.38Å; K467-G506 PolarHBondContact NZ-O 3.21Å; K467-L508 HydrophobicContact CB-CD1 4.31Å; K467-L508 HydrophobicContact CB-CD2 4.25Å; K467-L508 HydrophobicContact CB-CG 4.1Å
468	T	91	Very high	91.5	Very high	46 Å²	46	37.7 Å²	37.7	28%	0.282	21%	0.209	S	C	.	.	H	α-helix	trans	-61	-33.4	174.5	-45.3	0	0	0	0	112.3	L170 L464 R465 G470 A517	L170-T468 HydrophobicContact CD2-CG2 3.7Å; L464-T468 PolarHBondContact O-N 2.82Å; L464-T468 PolarHBondContact O-OG1 2.94Å; R465-T468 WeakPolarHBondContact O-CB 3.4Å; R465-T468 PolarHBondContact O-N 2.83Å; T468-G470 PolarHBondContact O-N 2.88Å; T468-A517 HydrophobicContact CG2-CB 4.25Å; T468-A517 WeakPolarHBondContact OG1-CB 3.36Å
469	L	91.3	Very high	91.5	Very high	40 Å²	40	36.9 Å²	36.9	21%	0.209	20%	0.203	C	C	.	.	T	Hydrogen-bonded Turn	trans	-77.2	3.2	174.1	-74.1	162.6	0	0	0	113.7	I166 L169 L170 L199 R465 L466 K467 I471	I166-L469 HydrophobicContact CG2-CD1 4.31Å; L169-L469 HydrophobicContact CB-CD2 3.92Å; L170-L469 HydrophobicContact CB-CD2 4.47Å; L170-L469 HydrophobicContact CD2-CD2 3.51Å; L170-L469 HydrophobicContact CD2-CG 3.65Å; L170-L469 HydrophobicContact CG-CD2 3.77Å; L170-L469 HydrophobicContact CG-CG 4.2Å; L199-L469 HydrophobicContact CD1-CD1 3.53Å; L199-L469 HydrophobicContact CD2-CD1 4.06Å; L199-L469 HydrophobicContact CG-CD1 4.47Å; R465-L469 WeakPolarHBondContact O-CG 3.32Å; R465-L469 PolarHBondContact O-N 2.85Å; L466-L469 CarbonylContact O-C 3.54Å; L466-L469 WeakPolarHBondContact O-CB 3.34Å; L466-L469 PolarHBondContact O-N 3.32Å; K467-L469 PolarHBondContact O-N 3.43Å; L469-I471 HydrophobicContact CB-CG1 4.45Å
470	G	90.4	Very high	91.5	Very high	50 Å²	50	37.8 Å²	37.8	52%	0.515	21%	0.208	S	C	.	.	T	Hydrogen-bonded Turn	trans	78.1	19.9	-178.8	0	0	0	0	0	114.3	L466 K467 T468 D472	L466-G470 PolarHBondContact O-N 3.36Å; K467-G470 PolarHBondContact O-N 2.82Å; T468-G470 PolarHBondContact O-N 2.88Å; G470-D472 PolarHBondContact O-N 3.5Å
471	I	92.8	Very high	91.4	Very high	24 Å²	24	39.4 Å²	39.4	12%	0.123	22%	0.217	C	C	.	.			trans	-87.2	99.8	174.2	-54.9	-58.1	0	0	0	109.5	L199 K202 L466 L469 F477	L199-I471 HydrophobicContact CD2-CD1 4.42Å; L199-I471 HydrophobicContact CD2-CG1 4.22Å; K202-I471 HydrophobicContact CD-CD1 3.99Å; L466-I471 HydrophobicContact CB-CB 4.16Å; L466-I471 HydrophobicContact CD2-CG1 4.25Å; L466-I471 VanDerWaalsContact O-CB 3.26Å; L466-I471 WeakPolarHBondContact O-CB 3.37Å; L466-I471 PolarHBondContact O-N 3.18Å; L469-I471 HydrophobicContact CB-CG1 4.45Å; I471-F477 HydrophobicContact CG2-CD2 3.82Å
472	D	88.5	Confident	91.4	Very high	79 Å²	79	43.6 Å²	43.6	42%	0.422	24%	0.243	S	C	.	.			trans	-83.1	-39.8	-175.4	-72.8	-46.4	0	0	0	115.3	K467 G470 L474 H507	K467-D472 WeakPolarHBondContact CE-O 3.16Å; K467-D472 VanDerWaalsContact NZ-CA 3.3Å; K467-D472 PolarHBondContact NZ-O 2.79Å; K467-D472 IonicContact NZ-OD1 3.76Å; K467-D472 PolarHBondContact NZ-OD1 3.49Å; G470-D472 PolarHBondContact O-N 3.5Å; D472-L474 VanDerWaalsContact C-N 3.31Å; D472-L474 PolarHBondContact O-N 2.98Å; D472-H507 IonicContact OD1-CD2 2.68Å; D472-H507 PolarHBondContact OD1-CD2 3.47Å; D472-H507 IonicContact OD1-NE2 3.2Å
473	R	89.9	Confident	91.5	Very high	179 Å²	179	44.2 Å²	44.2	68%	0.675	25%	0.247	S	C	*	.			trans	-86.2	71.8	-176.9	-58.6	-169.9	-173	179.3	-0.8	110.9	A475 Q476 F477	R473-A475 VanDerWaalsContact C-N 3.31Å; R473-A475 PolarHBondContact O-N 2.89Å; R473-Q476 HydrophobicContact CB-CB 4.07Å; R473-Q476 HydrophobicContact CB-CG 4.47Å; R473-Q476 CarbonylContact O-C 3.54Å; R473-Q476 PolarHBondContact O-N 3.03Å; R473-F477 PolarHBondContact O-N 3.46Å
474	L	87.2	Confident	91.2	Very high	16 Å²	16	46.7 Å²	46.7	8%	0.084	26%	0.263	C	S	.	.	G	3₁₀ helix	trans	-55.4	-42.2	-175.5	-65.7	176.2	0	0	0	113.3	L463 L466 K467 D472 Q476 F477	L463-L474 HydrophobicContact CB-CD1 4.1Å; L463-L474 HydrophobicContact CD1-CD1 4.35Å; L463-L474 HydrophobicContact CD2-CB 4.25Å; L463-L474 HydrophobicContact CD2-CD1 4.21Å; L463-L474 HydrophobicContact CD2-CD2 4.09Å; L463-L474 HydrophobicContact CD2-CG 4.41Å; L463-L474 HydrophobicContact CG-CD1 4.44Å; L466-L474 HydrophobicContact CB-CD2 3.77Å; L466-L474 HydrophobicContact CD1-CD2 4.2Å; K467-L474 HydrophobicContact CG-CD1 4.05Å; K467-L474 HydrophobicContact CG-CD2 4.17Å; K467-L474 HydrophobicContact CG-CG 4.4Å; D472-L474 VanDerWaalsContact C-N 3.31Å; D472-L474 PolarHBondContact O-N 2.98Å; L474-Q476 PolarHBondContact O-N 2.77Å; L474-F477 WeakPolarHBondContact O-CB 3.31Å; L474-F477 PolarHBondContact O-N 2.9Å
475	A	85.6	Confident	91	Very high	91 Å²	91	50.7 Å²	50.7	75%	0.752	30%	0.296	S	S	*	.	G	3₁₀ helix	trans	-66.8	-21.5	177.9	0	0	0	0	0	113.8	R473	R473-A475 VanDerWaalsContact C-N 3.31Å; R473-A475 PolarHBondContact O-N 2.89Å
476	Q	89.1	Confident	90.8	Very high	135 Å²	135	52.9 Å²	52.9	63%	0.631	31%	0.314	S	S	*	.	G	3₁₀ helix	trans	-104.6	11.8	179.7	-61	177	3.5	0	0	112	R473 L474 D478	R473-Q476 HydrophobicContact CB-CB 4.07Å; R473-Q476 HydrophobicContact CB-CG 4.47Å; R473-Q476 CarbonylContact O-C 3.54Å; R473-Q476 PolarHBondContact O-N 3.03Å; L474-Q476 PolarHBondContact O-N 2.77Å; Q476-D478 PolarHBondContact O-N 3.01Å
477	F	93.4	Very high	90.7	Very high	12 Å²	12	53.7 Å²	53.7	5%	0.053	32%	0.318	C	S	.	.			trans	-61.5	139.9	174.9	-176.4	-101.4	0	0	0	110.1	L199 L466 I471 R473 L474 W479	L199-F477 HydrophobicContact CD2-CE2 4.09Å; L199-F477 HydrophobicContact CD2-CZ 4.43Å; L199-F477 HydrophobicContact CG-CE2 4.38Å; L199-F477 HydrophobicContact CG-CZ 4.23Å; L466-F477 HydrophobicContact CD1-CD1 4.35Å; L466-F477 HydrophobicContact CD1-CD2 4.4Å; L466-F477 HydrophobicContact CD1-CG 4.23Å; L466-F477 HydrophobicContact CD2-CD2 4Å; L466-F477 HydrophobicContact CD2-CE1 4.37Å; L466-F477 HydrophobicContact CD2-CE2 3.55Å; L466-F477 HydrophobicContact CD2-CZ 3.75Å; I471-F477 HydrophobicContact CG2-CD2 3.82Å; R473-F477 PolarHBondContact O-N 3.46Å; L474-F477 WeakPolarHBondContact O-CB 3.31Å; L474-F477 PolarHBondContact O-N 2.9Å; F477-W479 VanDerWaalsContact C-N 3.25Å; F477-W479 AromaticContact CD1-CD1 3.74Å; F477-W479 AromaticContact CD1-CD2 3.66Å; F477-W479 HydrophobicContact CD1-CD2 3.66Å; F477-W479 AromaticContact CD1-CE2 3.47Å; F477-W479 VanDerWaalsContact CD1-CE2 3.47Å; F477-W479 HydrophobicContact CD1-CE3 4.3Å; F477-W479 AromaticContact CD1-CG 3.83Å; F477-W479 HydrophobicContact CD1-CG 3.83Å; F477-W479 AromaticContact CD1-CZ2 3.97Å; F477-W479 HydrophobicContact CD1-CZ2 3.97Å; F477-W479 AromaticContact CD1-NE1 3.54Å; F477-W479 HydrophobicContact CE1-CD2 4.12Å; F477-W479 HydrophobicContact CE1-CE3 4.32Å; F477-W479 HydrophobicContact CE1-CZ2 4.45Å; F477-W479 PolarHBondContact O-N 3.45Å
478	D	92.8	Very high	90.6	Very high	43 Å²	43	53.9 Å²	53.9	23%	0.23	32%	0.32	C	S	.	.			trans	-77.5	76.7	-175.7	-161.7	1	0	0	0	107.9	G198 K201 R205 Y228 Q476	G198-D478 VanDerWaalsContact CA-O 3.29Å; G198-D478 WeakPolarHBondContact CA-O 3.34Å; K201-D478 VanDerWaalsContact CD-OD2 3.25Å; K201-D478 WeakPolarHBondContact CD-OD2 3.33Å; K201-D478 WeakPolarHBondContact CE-OD2 3.29Å; K201-D478 IonicContact NZ-OD1 2.94Å; K201-D478 PolarHBondContact NZ-OD1 2.88Å; K201-D478 IonicContact NZ-OD2 3.04Å; K201-D478 PolarHBondContact NZ-OD2 3.3Å; R205-D478 IonicContact CZ-OD2 3.75Å; R205-D478 IonicContact NH1-OD2 3.61Å; R205-D478 IonicContact NH2-OD2 2.91Å; R205-D478 PolarHBondContact NH2-OD2 3.34Å; Y228-D478 VanDerWaalsContact CE2-OD1 3.29Å; Y228-D478 WeakPolarHBondContact CE2-OD1 3.34Å; Y228-D478 PolarHBondContact OH-O 3.06Å; Y228-D478 PolarHBondContact OH-OD1 3.48Å; Q476-D478 PolarHBondContact O-N 3.01Å
479	W	92	Very high	90.6	Very high	13 Å²	13	53.6 Å²	53.6	5%	0.049	33%	0.326	C	S	.	.			trans	-78.5	149.5	174	-65.6	97.7	0	0	0	110.4	L191 D194 I195 Y228 L466 F477 P482 P483	L191-W479 HydrophobicContact CD1-CH2 4.12Å; L191-W479 HydrophobicContact CD1-CZ3 4.09Å; D194-W479 HydrophobicContact CB-CE3 4.12Å; D194-W479 HydrophobicContact CB-CZ3 4.1Å; I195-W479 HydrophobicContact CG1-CH2 3.71Å; I195-W479 HydrophobicContact CG1-CZ3 3.82Å; Y228-W479 WeakPolarHBondContact CE2-O 3.15Å; L466-W479 HydrophobicContact CD1-CH2 4.48Å; L466-W479 HydrophobicContact CD1-CZ2 4.05Å; F477-W479 VanDerWaalsContact C-N 3.25Å; F477-W479 AromaticContact CD1-CD1 3.74Å; F477-W479 AromaticContact CD1-CD2 3.66Å; F477-W479 HydrophobicContact CD1-CD2 3.66Å; F477-W479 AromaticContact CD1-CE2 3.47Å; F477-W479 VanDerWaalsContact CD1-CE2 3.47Å; F477-W479 HydrophobicContact CD1-CE3 4.3Å; F477-W479 AromaticContact CD1-CG 3.83Å; F477-W479 HydrophobicContact CD1-CG 3.83Å; F477-W479 AromaticContact CD1-CZ2 3.97Å; F477-W479 HydrophobicContact CD1-CZ2 3.97Å; F477-W479 AromaticContact CD1-NE1 3.54Å; F477-W479 HydrophobicContact CE1-CD2 4.12Å; F477-W479 HydrophobicContact CE1-CE3 4.32Å; F477-W479 HydrophobicContact CE1-CZ2 4.45Å; F477-W479 PolarHBondContact O-N 3.45Å; W479-P482 HydrophobicContact CB-CB 4.45Å; W479-P482 HydrophobicContact CB-CG 4.41Å; W479-P483 VanDerWaalsContact CD1-CD 3.5Å; W479-P483 HydrophobicContact CD2-CG 4.37Å; W479-P483 HydrophobicContact CZ2-CG 4.45Å
480	L	92.2	Very high	90.5	Very high	20 Å²	20	54.3 Å²	54.3	11%	0.105	33%	0.329	C	S	.	.	S	Bend	trans	-65.6	-53.3	170	177.8	59.8	0	0	0	111	L197 F225 Y228	L197-L480 HydrophobicContact CD1-CD2 4.13Å; F225-L480 HydrophobicContact CD1-CD2 3.88Å; F225-L480 HydrophobicContact CE1-CD2 3.46Å; F225-L480 VanDerWaalsContact CE1-CD2 3.46Å; F225-L480 HydrophobicContact CZ-CD2 4.05Å; Y228-L480 VanDerWaalsContact CB-CD1 3.47Å; Y228-L480 HydrophobicContact CD1-CD1 4.19Å; Y228-L480 HydrophobicContact CD2-CD1 3.88Å; Y228-L480 HydrophobicContact CG-CD1 3.58Å
481	D	91.8	Very high	90.6	Very high	35 Å²	35	52 Å²	52	19%	0.187	30%	0.304	C	S	.	.	S	Bend	trans	-117.9	110.1	167.5	-66	-61.5	0	0	0	107.3	R189 K224 P452	R189-D481 IonicContact CZ-OD2 3.34Å; R189-D481 IonicContact NH1-OD2 2.74Å; R189-D481 PolarHBondContact NH1-OD2 2.78Å; R189-D481 IonicContact NH2-OD2 2.92Å; R189-D481 PolarHBondContact NH2-OD2 3.39Å; K224-D481 IonicContact NZ-OD1 3.81Å; K224-D481 IonicContact NZ-OD2 3.51Å; P452-D481 HydrophobicContact CG-CB 4.36Å
482	P	92.4	Very high	90.5	Very high	96 Å²	96	52.1 Å²	52.1	62%	0.623	31%	0.309	S	S	*	.	P	Polyproline II helix	trans	-63.1	132.3	-177.1	-24.5	34.2	0	0	0	112.9	L455 W479	L455-P482 WeakPolarHBondContact CD2-O 3.41Å; W479-P482 HydrophobicContact CB-CB 4.45Å; W479-P482 HydrophobicContact CB-CG 4.41Å
483	P	92.9	Very high	90.7	Very high	15 Å²	15	52.5 Å²	52.5	10%	0.097	31%	0.308	C	S	.	.	P	Polyproline II helix	trans	-63.3	153.3	173.7	26.5	-33.6	0	0	0	112.7	S454 L459 W479 A485 V488	S454-P483 WeakPolarHBondContact O-CB 3.23Å; L459-P483 HydrophobicContact CD1-CB 3.56Å; L459-P483 HydrophobicContact CD1-CG 3.81Å; W479-P483 VanDerWaalsContact CD1-CD 3.5Å; W479-P483 HydrophobicContact CD2-CG 4.37Å; W479-P483 HydrophobicContact CZ2-CG 4.45Å; P483-A485 PolarHBondContact O-N 2.78Å; P483-V488 HydrophobicContact CB-CG2 4.08Å; P483-V488 HydrophobicContact CG-CG2 3.58Å
484	P	89.9	Confident	90.7	Very high	52 Å²	52	45.9 Å²	45.9	34%	0.338	28%	0.283	S	S	.	.	P	Polyproline II helix	trans	-55.3	136	173	-22.7	33.9	0	0	0	110.6	S486 H487 V488	P484-S486 PolarHBondContact O-N 2.99Å; P484-S486 VanDerWaalsContact O-N 3.15Å; P484-H487 WeakPolarHBondContact O-CB 3.23Å; P484-H487 PolarHBondContact O-N 2.89Å; P484-V488 PolarHBondContact O-N 3.39Å
485	A	89.7	Confident	91.1	Very high	86 Å²	86	45.1 Å²	45.1	71%	0.711	28%	0.279	S	S	*	.	H	α-helix	trans	-57.8	-32.4	-179.5	0	0	0	0	0	112.3	P483 H487 V488 G489	P483-A485 PolarHBondContact O-N 2.78Å; A485-H487 PolarHBondContact O-N 2.68Å; A485-V488 PolarHBondContact O-N 2.8Å; A485-G489 PolarHBondContact O-N 2.97Å
486	S	88.2	Confident	91.5	Very high	65 Å²	65	43.1 Å²	43.1	46%	0.455	26%	0.258	S	S	.	.	H	α-helix	trans	-60.1	-42.3	173.7	52.5	0	0	0	0	112.6	P484 G489 Q490	P484-S486 PolarHBondContact O-N 2.99Å; P484-S486 VanDerWaalsContact O-N 3.15Å; S486-G489 PolarHBondContact O-N 2.93Å; S486-Q490 WeakPolarHBondContact O-CB 3.34Å; S486-Q490 VanDerWaalsContact O-CG 3.28Å; S486-Q490 WeakPolarHBondContact O-CG 3.38Å; S486-Q490 PolarHBondContact O-N 3.32Å
487	H	90.4	Very high	91.7	Very high	18 Å²	18	37 Å²	37	8%	0.083	23%	0.23	C	C	.	.	H	α-helix	trans	-66.3	-45.3	178.4	-68.3	-165.7	0	0	0	110.8	P401 L455 L459 P484 A485 G489 Q490 S491	P401-H487 WeakPolarHBondContact CG-NE2 3.14Å; L455-H487 PolarHBondContact O-CE1 2.99Å; L459-H487 HydrophobicContact CD1-CB 4.22Å; P484-H487 WeakPolarHBondContact O-CB 3.23Å; P484-H487 PolarHBondContact O-N 2.89Å; A485-H487 PolarHBondContact O-N 2.68Å; H487-G489 VanDerWaalsContact C-N 3.34Å; H487-G489 PolarHBondContact O-N 3.1Å; H487-Q490 PolarHBondContact O-N 3.08Å; H487-S491 WeakPolarHBondContact O-CB 3.03Å; H487-S491 PolarHBondContact O-N 3.1Å; H487-S491 PolarHBondContact O-OG 3.05Å
488	V	91.5	Very high	91.8	Very high	17 Å²	17	36.4 Å²	36.4	10%	0.103	23%	0.227	C	C	.	.	H	α-helix	trans	-61.7	-44.4	177.6	-178.9	0	0	0	0	110.9	L459 L463 P483 P484 A485 A492	L459-V488 HydrophobicContact CD1-CG2 4.01Å; L463-V488 HydrophobicContact CD1-CG1 4.09Å; L463-V488 HydrophobicContact CD2-CG1 4.39Å; P483-V488 HydrophobicContact CB-CG2 4.08Å; P483-V488 HydrophobicContact CG-CG2 3.58Å; P484-V488 PolarHBondContact O-N 3.39Å; A485-V488 PolarHBondContact O-N 2.8Å; V488-A492 WeakPolarHBondContact O-CB 3.29Å; V488-A492 PolarHBondContact O-N 2.93Å
489	G	90.6	Very high	91.9	Very high	39 Å²	39	35.2 Å²	35.2	40%	0.402	23%	0.225	S	C	.	.	H	α-helix	trans	-61.2	-47.2	178.4	0	0	0	0	0	112.7	A485 S486 H487 A492 E493	A485-G489 PolarHBondContact O-N 2.97Å; S486-G489 PolarHBondContact O-N 2.93Å; H487-G489 VanDerWaalsContact C-N 3.34Å; H487-G489 PolarHBondContact O-N 3.1Å; G489-A492 PolarHBondContact O-N 3.07Å; G489-E493 WeakPolarHBondContact O-CB 3.31Å; G489-E493 PolarHBondContact O-N 3.12Å
490	Q	88.9	Confident	92	Very high	56 Å²	56	34.6 Å²	34.6	26%	0.262	22%	0.223	S	C	.	.	H	α-helix	trans	-66.1	-42.7	178.9	-72.8	175.7	9.4	0	0	112.8	Y399 P401 S486 H487 A492 E493 R494	Y399-Q490 PolarHBondContact OH-OE1 2.7Å; P401-Q490 PolarHBondContact O-NE2 3.08Å; P401-Q490 PolarHBondContact O-OE1 2.96Å; S486-Q490 WeakPolarHBondContact O-CB 3.34Å; S486-Q490 VanDerWaalsContact O-CG 3.28Å; S486-Q490 WeakPolarHBondContact O-CG 3.38Å; S486-Q490 PolarHBondContact O-N 3.32Å; H487-Q490 PolarHBondContact O-N 3.08Å; Q490-A492 VanDerWaalsContact C-N 3.28Å; Q490-A492 PolarHBondContact O-N 3.38Å; Q490-E493 PolarHBondContact O-N 3.39Å; Q490-R494 WeakPolarHBondContact O-CB 3.32Å; Q490-R494 PolarHBondContact O-N 2.86Å
491	S	91.9	Very high	92.2	Very high	0 Å²	0	34 Å²	34	0%	0	22%	0.219	C	C	.	.	H	α-helix	trans	-63.8	-35.3	174.6	-66.6	0	0	0	0	111.5	D458 L459 S460 H487 R494 L495	D458-S491 PolarHBondContact OD1-OG 3Å; L459-S491 PolarHBondContact N-OG 2.89Å; L459-S491 VanDerWaalsContact N-OG 3.14Å; S460-S491 PolarHBondContact N-OG 2.89Å; H487-S491 WeakPolarHBondContact O-CB 3.03Å; H487-S491 PolarHBondContact O-N 3.1Å; H487-S491 PolarHBondContact O-OG 3.05Å; S491-R494 WeakPolarHBondContact O-CB 3.49Å; S491-L495 WeakPolarHBondContact O-CG 3.47Å; S491-L495 PolarHBondContact O-N 3.49Å; S491-L495 VanDerWaalsContact O-N 3.08Å
492	A	92.4	Very high	92.3	Very high	27 Å²	27	35 Å²	35	22%	0.223	23%	0.225	C	C	.	.	H	α-helix	trans	-68.5	-45.5	173.6	0	0	0	0	0	112.3	L463 V488 G489 Q490 R494 L495 V496	L463-A492 HydrophobicContact CD1-CB 4.47Å; V488-A492 WeakPolarHBondContact O-CB 3.29Å; V488-A492 PolarHBondContact O-N 2.93Å; G489-A492 PolarHBondContact O-N 3.07Å; Q490-A492 VanDerWaalsContact C-N 3.28Å; Q490-A492 PolarHBondContact O-N 3.38Å; A492-R494 PolarHBondContact O-N 2.94Å; A492-L495 PolarHBondContact O-N 2.79Å; A492-L495 VanDerWaalsContact O-N 3.08Å; A492-V496 WeakPolarHBondContact O-CG2 3.41Å; A492-V496 PolarHBondContact O-N 3.33Å
493	E	91.1	Very high	92.3	Very high	87 Å²	87	34.4 Å²	34.4	41%	0.407	23%	0.228	S	C	.	.	H	α-helix	trans	-56.6	-41.6	174.2	-174	-169.4	152	0	0	110.8	G489 Q490 L495 V496 A497 R678	G489-E493 WeakPolarHBondContact O-CB 3.31Å; G489-E493 PolarHBondContact O-N 3.12Å; Q490-E493 PolarHBondContact O-N 3.39Å; E493-L495 PolarHBondContact O-N 3.04Å; E493-V496 WeakPolarHBondContact O-CB 3.4Å; E493-V496 PolarHBondContact O-N 3.49Å; E493-A497 WeakPolarHBondContact O-CB 3.22Å; E493-A497 PolarHBondContact O-N 2.88Å; E493-R678 IonicContact OE1-CZ 3.29Å; E493-R678 VanDerWaalsContact OE1-CZ 3.28Å; E493-R678 IonicContact OE1-NH1 2.79Å; E493-R678 PolarHBondContact OE1-NH1 2.62Å; E493-R678 IonicContact OE1-NH2 3.73Å; E493-R678 PolarHBondContact OE1-NH2 2.86Å; E493-R678 IonicContact OE2-NH2 3.02Å
494	R	91	Very high	92.3	Very high	41 Å²	41	39.1 Å²	39.1	16%	0.155	26%	0.261	C	S	.	.	H	α-helix	trans	-61.3	-43.6	174.9	175.7	57	138.1	-96.7	-30.7	112.5	Q490 S491 A492 A497 L498 H662	Q490-R494 WeakPolarHBondContact O-CB 3.32Å; Q490-R494 PolarHBondContact O-N 2.86Å; S491-R494 WeakPolarHBondContact O-CB 3.49Å; A492-R494 PolarHBondContact O-N 2.94Å; R494-A497 PolarHBondContact O-N 2.81Å; R494-L498 HydrophobicContact CG-CD1 4.37Å; R494-L498 WeakPolarHBondContact O-CG 3.37Å; R494-L498 PolarHBondContact O-N 2.83Å; R494-H662 VanDerWaalsContact CZ-CE1 3.41Å; R494-H662 PolarHBondContact NE-CD2 3.23Å; R494-H662 PolarHBondContact NE-CE1 2.72Å; R494-H662 VanDerWaalsContact NE-CG 3.32Å; R494-H662 PolarHBondContact NE-ND1 3.22Å; R494-H662 VanDerWaalsContact NE-ND1 3.18Å; R494-H662 PolarHBondContact NE-NE2 3.39Å; R494-H662 PolarHBondContact NH1-CD2 3.34Å; R494-H662 PolarHBondContact NH2-CD2 3.2Å; R494-H662 PolarHBondContact NH2-NE2 3.28Å
495	L	94.7	Very high	92.4	Very high	0 Å²	0	39.4 Å²	39.4	0%	0	26%	0.264	C	S	.	.	H	α-helix	trans	-67	-36.9	176.6	-71.7	175.7	0	0	0	112.1	L463 L464 S491 A492 E493 L498 G499 A500 L501 P528	L463-L495 HydrophobicContact CB-CD1 3.82Å; L464-L495 HydrophobicContact CB-CD1 4.24Å; L464-L495 HydrophobicContact CB-CD2 4.06Å; L464-L495 HydrophobicContact CD1-CD2 4.4Å; S491-L495 WeakPolarHBondContact O-CG 3.47Å; S491-L495 PolarHBondContact O-N 3.49Å; S491-L495 VanDerWaalsContact O-N 3.08Å; A492-L495 PolarHBondContact O-N 2.79Å; A492-L495 VanDerWaalsContact O-N 3.08Å; E493-L495 PolarHBondContact O-N 3.04Å; L495-L498 PolarHBondContact O-N 3.11Å; L495-G499 PolarHBondContact O-N 3.36Å; L495-A500 HydrophobicContact CB-CB 4.24Å; L495-A500 HydrophobicContact CD2-CB 4.13Å; L495-A500 WeakPolarHBondContact O-CA 3.46Å; L495-A500 WeakPolarHBondContact O-CB 3.48Å; L495-A500 PolarHBondContact O-N 2.78Å; L495-L501 HydrophobicContact CB-CD1 3.74Å; L495-L501 HydrophobicContact CB-CG 3.84Å; L495-L501 HydrophobicContact CD1-CD1 3.85Å; L495-L501 HydrophobicContact CD1-CG 4.37Å; L495-L501 HydrophobicContact CG-CD1 4.48Å; L495-L501 PolarHBondContact O-N 3.3Å; L495-P528 HydrophobicContact CD2-CB 3.92Å; L495-P528 HydrophobicContact CD2-CG 3.84Å
496	V	95.2	Very high	92.4	Very high	49 Å²	49	36.5 Å²	36.5	30%	0.297	24%	0.243	S	C	.	.	H	α-helix	trans	-61.1	-46.6	170.8	172.7	0	0	0	0	110.1	A492 E493 L498 G499 L501 A503	A492-V496 WeakPolarHBondContact O-CG2 3.41Å; A492-V496 PolarHBondContact O-N 3.33Å; E493-V496 WeakPolarHBondContact O-CB 3.4Å; E493-V496 PolarHBondContact O-N 3.49Å; V496-L498 VanDerWaalsContact C-N 3.29Å; V496-L498 PolarHBondContact O-N 2.84Å; V496-G499 WeakPolarHBondContact O-CA 3.32Å; V496-G499 PolarHBondContact O-N 3.5Å; V496-L501 WeakPolarHBondContact CA-O 3.39Å; V496-L501 HydrophobicContact CG2-CB 3.89Å; V496-A503 HydrophobicContact CG1-CB 3.75Å
497	A	93.4	Very high	92.7	Very high	6 Å²	6	37.8 Å²	37.8	5%	0.05	24%	0.242	C	C	.	.	H	α-helix	trans	-63.2	-31.5	177.3	0	0	0	0	0	113	E493 R494 G499 F661 H752 Y753	E493-A497 WeakPolarHBondContact O-CB 3.22Å; E493-A497 PolarHBondContact O-N 2.88Å; R494-A497 PolarHBondContact O-N 2.81Å; A497-G499 PolarHBondContact O-N 3.42Å; A497-F661 HydrophobicContact CB-CE2 4.07Å; A497-F661 HydrophobicContact CB-CZ 3.86Å; A497-F661 VanDerWaalsContact O-CZ 3.22Å; A497-F661 WeakPolarHBondContact O-CZ 3.36Å; A497-H752 PolarHBondContact O-NE2 3.35Å; A497-Y753 HydrophobicContact CB-CD2 3.7Å; A497-Y753 HydrophobicContact CB-CE2 4.15Å
498	L	95	Very high	92.9	Very high	0 Å²	0	38.4 Å²	38.4	0%	0	25%	0.245	C	C	.	.	T	Hydrogen-bonded Turn	trans	-74.3	-6.8	173.3	-69.7	169.8	0	0	0	112.7	R494 L495 V496 A500 R512 L516 P528 A532 G659 F661	R494-L498 HydrophobicContact CG-CD1 4.37Å; R494-L498 WeakPolarHBondContact O-CG 3.37Å; R494-L498 PolarHBondContact O-N 2.83Å; L495-L498 PolarHBondContact O-N 3.11Å; V496-L498 VanDerWaalsContact C-N 3.29Å; V496-L498 PolarHBondContact O-N 2.84Å; L498-A500 VanDerWaalsContact C-N 3.25Å; L498-R512 PolarHBondContact O-NE 2.6Å; L498-R512 PolarHBondContact O-NH2 2.75Å; L498-R512 VanDerWaalsContact O-NH2 3.08Å; L498-L516 HydrophobicContact CB-CD1 4.23Å; L498-P528 HydrophobicContact CD1-CB 3.64Å; L498-A532 HydrophobicContact CD2-CB 3.84Å; L498-G659 WeakPolarHBondContact CD2-O 3.24Å; L498-F661 HydrophobicContact CD2-CE1 3.8Å; L498-F661 HydrophobicContact CD2-CZ 4.17Å
499	G	94.1	Very high	93.1	Very high	18 Å²	18	39 Å²	39	19%	0.186	25%	0.249	C	C	.	.	T	Hydrogen-bonded Turn	trans	73.1	18.2	-171.3	0	0	0	0	0	112.5	L495 V496 A497 T509	L495-G499 PolarHBondContact O-N 3.36Å; V496-G499 WeakPolarHBondContact O-CA 3.32Å; V496-G499 PolarHBondContact O-N 3.5Å; A497-G499 PolarHBondContact O-N 3.42Å; G499-T509 PolarHBondContact O-OG1 3Å
500	A	95.6	Very high	93.3	Very high	0 Å²	0	43.9 Å²	43.9	0%	0	26%	0.264	C	S	.	.	S	Bend	trans	-77.8	-40.4	178.2	0	0	0	0	0	111.6	L464 L495 L498 L508 T509 G513 L516	L464-A500 HydrophobicContact CD1-CB 4.17Å; L495-A500 HydrophobicContact CB-CB 4.24Å; L495-A500 HydrophobicContact CD2-CB 4.13Å; L495-A500 WeakPolarHBondContact O-CA 3.46Å; L495-A500 WeakPolarHBondContact O-CB 3.48Å; L495-A500 PolarHBondContact O-N 2.78Å; L498-A500 VanDerWaalsContact C-N 3.25Å; A500-L508 WeakPolarHBondContact O-CA 3.13Å; A500-T509 PolarHBondContact O-N 3.5Å; A500-G513 WeakPolarHBondContact O-CA 3.31Å; A500-L516 HydrophobicContact CB-CD1 4.15Å; A500-L516 HydrophobicContact CB-CD2 4.25Å
501	L	95.3	Very high	93.5	Very high	6 Å²	6	45.1 Å²	45.1	3%	0.031	28%	0.277	C	S	.	.	B	Isolated β-bridge	trans	-113.9	144.8	178.3	-58.8	179.5	0	0	0	111.2	K467 L495 V496 H507 L508	K467-L501 HydrophobicContact CB-CD2 4.39Å; K467-L501 HydrophobicContact CD-CD2 4.13Å; K467-L501 HydrophobicContact CG-CD2 3.94Å; L495-L501 HydrophobicContact CB-CD1 3.74Å; L495-L501 HydrophobicContact CB-CG 3.84Å; L495-L501 HydrophobicContact CD1-CD1 3.85Å; L495-L501 HydrophobicContact CD1-CG 4.37Å; L495-L501 HydrophobicContact CG-CD1 4.48Å; L495-L501 PolarHBondContact O-N 3.3Å; V496-L501 WeakPolarHBondContact CA-O 3.39Å; V496-L501 HydrophobicContact CG2-CB 3.89Å; L501-H507 CarbonylContact C-O 3.56Å; L501-H507 VanDerWaalsContact CA-O 3.3Å; L501-H507 WeakPolarHBondContact CA-O 3.45Å; L501-L508 HydrophobicContact CD2-CD2 3.92Å; L501-L508 HydrophobicContact CD2-CG 4.34Å
502	D	94.5	Very high	93.5	Very high	58 Å²	58	49.8 Å²	49.8	31%	0.31	30%	0.295	S	S	.	.			trans	-74	134.7	169.6	173.9	-111.7	0	0	0	110	S504 S505 G506 H507 T509	D502-S504 VanDerWaalsContact C-N 3.3Å; D502-S504 PolarHBondContact O-N 2.96Å; D502-S504 PolarHBondContact OD1-N 2.79Å; D502-S504 VanDerWaalsContact OD1-N 3.16Å; D502-S504 PolarHBondContact OD1-OG 2.84Å; D502-S505 WeakPolarHBondContact CB-OG 3.37Å; D502-S505 WeakPolarHBondContact OD1-CB 3.43Å; D502-S505 PolarHBondContact OD1-N 3.06Å; D502-S505 PolarHBondContact OD1-OG 2.95Å; D502-G506 WeakPolarHBondContact O-CA 3.42Å; D502-G506 PolarHBondContact O-N 3.02Å; D502-H507 PolarHBondContact N-O 2.72Å; D502-T509 HydrophobicContact CB-CG2 4.1Å; D502-T509 VanDerWaalsContact N-CG2 3.34Å
503	A	91.9	Very high	93.6	Very high	82 Å²	82	48.5 Å²	48.5	68%	0.678	29%	0.285	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.6	-31.7	-175.3	0	0	0	0	0	112.8	V496	V496-A503 HydrophobicContact CG1-CB 3.75Å
504	S	92.3	Very high	93.7	Very high	114 Å²	114	48.4 Å²	48.4	80%	0.797	29%	0.286	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.7	-43.7	-174.4	72.9	0	0	0	0	112.9	D502	D502-S504 VanDerWaalsContact C-N 3.3Å; D502-S504 PolarHBondContact O-N 2.96Å; D502-S504 PolarHBondContact OD1-N 2.79Å; D502-S504 VanDerWaalsContact OD1-N 3.16Å; D502-S504 PolarHBondContact OD1-OG 2.84Å
505	S	92.1	Very high	93.9	Very high	58 Å²	58	51.1 Å²	51.1	41%	0.406	30%	0.299	S	S	.	.	T	Hydrogen-bonded Turn	trans	-99.4	-22.1	-174.5	64.9	0	0	0	0	113.3	D502 H507	D502-S505 WeakPolarHBondContact CB-OG 3.37Å; D502-S505 WeakPolarHBondContact OD1-CB 3.43Å; D502-S505 PolarHBondContact OD1-N 3.06Å; D502-S505 PolarHBondContact OD1-OG 2.95Å; S505-H507 WeakPolarHBondContact CB-ND1 3.34Å; S505-H507 PolarHBondContact O-N 2.83Å; S505-H507 PolarHBondContact OG-N 3.42Å
506	G	91.4	Very high	93.9	Very high	25 Å²	25	51.1 Å²	51.1	26%	0.258	30%	0.299	S	S	.	.			trans	68	8.6	-172.2	0	0	0	0	0	114	K467 D502	K467-G506 WeakPolarHBondContact CE-O 3.38Å; K467-G506 PolarHBondContact NZ-O 3.21Å; D502-G506 WeakPolarHBondContact O-CA 3.42Å; D502-G506 PolarHBondContact O-N 3.02Å
507	H	94.2	Very high	93.8	Very high	92 Å²	92	48.9 Å²	48.9	43%	0.426	29%	0.286	S	S	.	.	S	Bend	trans	-79.1	162.1	174.5	-63	133.2	0	0	0	111.5	D472 L501 D502 S505 T509	D472-H507 IonicContact OD1-CD2 2.68Å; D472-H507 PolarHBondContact OD1-CD2 3.47Å; D472-H507 IonicContact OD1-NE2 3.2Å; L501-H507 CarbonylContact C-O 3.56Å; L501-H507 VanDerWaalsContact CA-O 3.3Å; L501-H507 WeakPolarHBondContact CA-O 3.45Å; D502-H507 PolarHBondContact N-O 2.72Å; S505-H507 WeakPolarHBondContact CB-ND1 3.34Å; S505-H507 PolarHBondContact O-N 2.83Å; S505-H507 PolarHBondContact OG-N 3.42Å; H507-T509 PolarHBondContact O-N 3.39Å
508	L	94.8	Very high	93.7	Very high	31 Å²	31	53.1 Å²	53.1	16%	0.162	30%	0.304	C	S	.	.	B	Isolated β-bridge	trans	-60.8	130.6	170.9	-72.7	167.6	0	0	0	109.9	L464 K467 A500 L501 L514 A517	L464-L508 HydrophobicContact CD1-CD2 3.8Å; K467-L508 HydrophobicContact CB-CD1 4.31Å; K467-L508 HydrophobicContact CB-CD2 4.25Å; K467-L508 HydrophobicContact CB-CG 4.1Å; A500-L508 WeakPolarHBondContact O-CA 3.13Å; L501-L508 HydrophobicContact CD2-CD2 3.92Å; L501-L508 HydrophobicContact CD2-CG 4.34Å; L508-L514 HydrophobicContact CB-CD2 4.45Å; L508-L514 HydrophobicContact CD1-CD2 4.14Å; L508-A517 HydrophobicContact CD2-CB 4.49Å
509	T	95.7	Very high	93.6	Very high	31 Å²	31	53.2 Å²	53.2	19%	0.19	31%	0.305	C	S	.	.	P	Polyproline II helix	trans	-71.4	149.1	176.6	69.3	0	0	0	0	110.8	G499 A500 D502 H507 G513 L514	G499-T509 PolarHBondContact O-OG1 3Å; A500-T509 PolarHBondContact O-N 3.5Å; D502-T509 HydrophobicContact CB-CG2 4.1Å; D502-T509 VanDerWaalsContact N-CG2 3.34Å; H507-T509 PolarHBondContact O-N 3.39Å; T509-G513 VanDerWaalsContact O-CA 3.31Å; T509-G513 WeakPolarHBondContact O-CA 3.35Å; T509-G513 PolarHBondContact O-N 2.7Å; T509-G513 WeakPolarHBondContact OG1-CA 3.27Å; T509-G513 PolarHBondContact OG1-N 3.4Å; T509-L514 PolarHBondContact O-N 3.32Å; T509-L514 VanDerWaalsContact O-N 3.13Å
510	I	94	Very high	93.5	Very high	140 Å²	140	52.3 Å²	52.3	72%	0.718	30%	0.296	S	S	*	.	T	Hydrogen-bonded Turn	trans	-112.8	130.2	176.2	-54.7	-178.8	0	0	0	108.4	L514	I510-L514 HydrophobicContact CD1-CD1 4.32Å; I510-L514 HydrophobicContact CG1-CD1 3.84Å; I510-L514 HydrophobicContact CG1-CG 4.49Å; I510-L514 HydrophobicContact CG2-CD1 4.43Å
511	P	92.8	Very high	93.1	Very high	82 Å²	82	53.6 Å²	53.6	53%	0.532	30%	0.304	S	S	.	.	T	Hydrogen-bonded Turn	cis	-88.9	-10.7	-3.5	35.1	-34.6	0	0	0	113.8	K515	P511-K515 WeakPolarHBondContact O-CG 3.2Å; P511-K515 PolarHBondContact O-N 3.19Å; P511-K515 VanDerWaalsContact O-N 3.1Å
512	R	93	Very high	92.6	Very high	99 Å²	99	54.3 Å²	54.3	37%	0.374	31%	0.309	S	S	.	.	H	α-helix	trans	-63	-50.9	-166.5	-178.2	173.7	174.9	137.9	-2.4	113	L498 K515 L516	L498-R512 PolarHBondContact O-NE 2.6Å; L498-R512 PolarHBondContact O-NH2 2.75Å; L498-R512 VanDerWaalsContact O-NH2 3.08Å; R512-K515 PolarHBondContact O-N 2.83Å; R512-L516 WeakPolarHBondContact O-CB 3.48Å; R512-L516 PolarHBondContact O-N 2.73Å
513	G	94.3	Very high	92.2	Very high	0 Å²	0	51.8 Å²	51.8	0%	0	30%	0.295	C	S	.	.	H	α-helix	trans	-65.8	-40	-177.2	0	0	0	0	0	113.5	A500 T509 L516 A517	A500-G513 WeakPolarHBondContact O-CA 3.31Å; T509-G513 VanDerWaalsContact O-CA 3.31Å; T509-G513 WeakPolarHBondContact O-CA 3.35Å; T509-G513 PolarHBondContact O-N 2.7Å; T509-G513 WeakPolarHBondContact OG1-CA 3.27Å; T509-G513 PolarHBondContact OG1-N 3.4Å; G513-L516 PolarHBondContact O-N 3.39Å; G513-A517 WeakPolarHBondContact O-CB 3.28Å; G513-A517 PolarHBondContact O-N 2.78Å
514	L	93.5	Very high	91.8	Very high	84 Å²	84	48.2 Å²	48.2	44%	0.44	27%	0.266	S	S	.	.	H	α-helix	trans	-60.5	-48.6	172.3	-74	174	0	0	0	112	L508 T509 I510 L516 A517 E518	L508-L514 HydrophobicContact CB-CD2 4.45Å; L508-L514 HydrophobicContact CD1-CD2 4.14Å; T509-L514 PolarHBondContact O-N 3.32Å; T509-L514 VanDerWaalsContact O-N 3.13Å; I510-L514 HydrophobicContact CD1-CD1 4.32Å; I510-L514 HydrophobicContact CG1-CD1 3.84Å; I510-L514 HydrophobicContact CG1-CG 4.49Å; I510-L514 HydrophobicContact CG2-CD1 4.43Å; L514-L516 VanDerWaalsContact C-N 3.3Å; L514-L516 PolarHBondContact O-N 3.34Å; L514-A517 PolarHBondContact O-N 3.32Å; L514-E518 WeakPolarHBondContact O-CB 3.46Å; L514-E518 PolarHBondContact O-N 3.42Å
515	K	94	Very high	91.5	Very high	99 Å²	99	43 Å²	43	43%	0.43	23%	0.23	S	C	.	.	H	α-helix	trans	-61.1	-40.3	176.6	-75.7	-177.3	177	-176.9	0	111.8	P511 R512 E518 V519 L535	P511-K515 WeakPolarHBondContact O-CG 3.2Å; P511-K515 PolarHBondContact O-N 3.19Å; P511-K515 VanDerWaalsContact O-N 3.1Å; R512-K515 PolarHBondContact O-N 2.83Å; K515-E518 PolarHBondContact O-N 3.04Å; K515-V519 WeakPolarHBondContact O-CB 3.31Å; K515-V519 WeakPolarHBondContact O-CG2 3.42Å; K515-V519 PolarHBondContact O-N 3.08Å; K515-L535 HydrophobicContact CB-CD1 4.07Å; K515-L535 HydrophobicContact CB-CD2 4.17Å
516	L	95.1	Very high	90.9	Very high	0 Å²	0	43.9 Å²	43.9	0%	0	23%	0.23	C	C	.	.	H	α-helix	trans	-64.6	-45.4	179.5	-168.8	158.3	0	0	0	110.9	L464 L498 A500 R512 G513 L514 S520 P528 A531 A532 L535	L464-L516 HydrophobicContact CD1-CD2 4.31Å; L464-L516 HydrophobicContact CD2-CD2 3.41Å; L464-L516 VanDerWaalsContact CD2-CD2 3.41Å; L498-L516 HydrophobicContact CB-CD1 4.23Å; A500-L516 HydrophobicContact CB-CD1 4.15Å; A500-L516 HydrophobicContact CB-CD2 4.25Å; R512-L516 WeakPolarHBondContact O-CB 3.48Å; R512-L516 PolarHBondContact O-N 2.73Å; G513-L516 PolarHBondContact O-N 3.39Å; L514-L516 VanDerWaalsContact C-N 3.3Å; L514-L516 PolarHBondContact O-N 3.34Å; L516-S520 WeakPolarHBondContact O-CB 3.36Å; L516-S520 PolarHBondContact O-N 3.06Å; L516-P528 HydrophobicContact CD2-CB 4.16Å; L516-A531 HydrophobicContact CD2-CB 4.4Å; L516-A531 HydrophobicContact CG-CB 4.38Å; L516-A532 HydrophobicContact CD1-CB 3.92Å; L516-L535 VanDerWaalsContact CA-CD1 3.48Å; L516-L535 HydrophobicContact CB-CD1 3.77Å; L516-L535 HydrophobicContact CG-CD1 4.33Å
517	A	93.4	Very high	90.8	Very high	2 Å²	2	45.8 Å²	45.8	2%	0.017	23%	0.232	C	C	.	.	H	α-helix	trans	-60.3	-43.8	173.5	0	0	0	0	0	112.5	L464 T468 L508 G513 L514 T521	L464-A517 HydrophobicContact CD1-CB 4.07Å; L464-A517 HydrophobicContact CG-CB 4.36Å; T468-A517 HydrophobicContact CG2-CB 4.25Å; T468-A517 WeakPolarHBondContact OG1-CB 3.36Å; L508-A517 HydrophobicContact CD2-CB 4.49Å; G513-A517 WeakPolarHBondContact O-CB 3.28Å; G513-A517 PolarHBondContact O-N 2.78Å; L514-A517 PolarHBondContact O-N 3.32Å; A517-T521 WeakPolarHBondContact O-CB 3.24Å; A517-T521 PolarHBondContact O-N 3.19Å; A517-T521 PolarHBondContact O-OG1 3Å
518	E	90.9	Very high	90.8	Very high	94 Å²	94	41.5 Å²	41.5	44%	0.439	21%	0.213	S	C	.	.	H	α-helix	trans	-66.1	-46.3	-179.6	-172.8	173.3	-155.7	0	0	111.8	L514 K515 T521 T522 L636	L514-E518 WeakPolarHBondContact O-CB 3.46Å; L514-E518 PolarHBondContact O-N 3.42Å; K515-E518 PolarHBondContact O-N 3.04Å; E518-T521 PolarHBondContact O-N 3.28Å; E518-T522 WeakPolarHBondContact O-CB 3.45Å; E518-T522 PolarHBondContact O-N 3.32Å; E518-T522 PolarHBondContact O-OG1 2.91Å; E518-L636 HydrophobicContact CG-CD1 4.26Å; E518-L636 HydrophobicContact CG-CD2 3.74Å; E518-L636 WeakPolarHBondContact OE1-CD2 3.43Å
519	V	92.9	Very high	90.8	Very high	2 Å²	2	40.4 Å²	40.4	1%	0.012	21%	0.207	C	C	.	.	H	α-helix	trans	-63.5	-47.2	175.1	170.3	0	0	0	0	110.7	K515 T521 T522 C523 L525 A531 L534 L535 L636 L638	K515-V519 WeakPolarHBondContact O-CB 3.31Å; K515-V519 WeakPolarHBondContact O-CG2 3.42Å; K515-V519 PolarHBondContact O-N 3.08Å; V519-T521 VanDerWaalsContact C-N 3.32Å; V519-T521 PolarHBondContact O-N 2.88Å; V519-T522 PolarHBondContact O-N 3.4Å; V519-C523 VanDerWaalsContact O-CB 3.23Å; V519-C523 WeakPolarHBondContact O-CB 3.44Å; V519-C523 PolarHBondContact O-N 3.06Å; V519-L525 HydrophobicContact CG1-CD1 4.48Å; V519-A531 HydrophobicContact CG1-CB 4.13Å; V519-L534 HydrophobicContact CG1-CB 4.36Å; V519-L534 HydrophobicContact CG1-CD1 4.33Å; V519-L535 HydrophobicContact CG2-CD2 3.85Å; V519-L535 HydrophobicContact CG2-CG 4.26Å; V519-L636 HydrophobicContact CG2-CD1 3.97Å; V519-L638 HydrophobicContact CG2-CD1 3.81Å
520	S	92.4	Very high	90.8	Very high	0 Å²	0	39.5 Å²	39.5	0%	0	20%	0.202	C	C	.	.	H	α-helix	trans	-57.1	-46.2	178.2	171.3	0	0	0	0	111.6	L516 G524 L525	L516-S520 WeakPolarHBondContact O-CB 3.36Å; L516-S520 PolarHBondContact O-N 3.06Å; S520-G524 PolarHBondContact O-N 3.49Å; S520-L525 PolarHBondContact O-N 3.01Å; S520-L525 PolarHBondContact OG-O 2.95Å
521	T	86.6	Confident	90.8	Very high	26 Å²	26	32.9 Å²	32.9	16%	0.16	17%	0.168	C	C	.	.	H	α-helix	trans	-69.1	-51.9	-179.8	-55.8	0	0	0	0	111.2	L170 A517 E518 V519 C523 G524	L170-T521 HydrophobicContact CD1-CG2 3.49Å; L170-T521 VanDerWaalsContact CD1-CG2 3.49Å; A517-T521 WeakPolarHBondContact O-CB 3.24Å; A517-T521 PolarHBondContact O-N 3.19Å; A517-T521 PolarHBondContact O-OG1 3Å; E518-T521 PolarHBondContact O-N 3.28Å; V519-T521 VanDerWaalsContact C-N 3.32Å; V519-T521 PolarHBondContact O-N 2.88Å; T521-C523 PolarHBondContact O-N 3.12Å; T521-G524 PolarHBondContact O-N 3.48Å; T521-G524 VanDerWaalsContact O-N 3.15Å
522	T	85.4	Confident	91	Very high	22 Å²	22	29.1 Å²	29.1	14%	0.135	14%	0.144	C	C	.	.	H	α-helix	trans	-64.5	-43	-174.3	-72.6	0	0	0	0	112.2	E518 V519 G524 M632 R635 L636	E518-T522 WeakPolarHBondContact O-CB 3.45Å; E518-T522 PolarHBondContact O-N 3.32Å; E518-T522 PolarHBondContact O-OG1 2.91Å; V519-T522 PolarHBondContact O-N 3.4Å; T522-G524 PolarHBondContact O-N 3.47Å; T522-M632 HydrophobicContact CG2-CB 3.54Å; T522-M632 HydrophobicContact CG2-CG 3.43Å; T522-M632 VanDerWaalsContact CG2-CG 3.43Å; T522-M632 HydrophobicContact CG2-SD 3.34Å; T522-M632 WeakPolarHBondContact CG2-SD 3.38Å; T522-R635 PolarHBondContact OG1-NH2 2.86Å; T522-L636 HydrophobicContact CG2-CD1 4.25Å
523	C	86.3	Confident	91.2	Very high	4 Å²	4	24.5 Å²	24.5	3%	0.027	13%	0.127	C	C	.	.	T	Hydrogen-bonded Turn	trans	-82.6	-2.3	178.5	-62.3	0	0	0	0	112.6	V519 T521 L525 I629	V519-C523 VanDerWaalsContact O-CB 3.23Å; V519-C523 WeakPolarHBondContact O-CB 3.44Å; V519-C523 PolarHBondContact O-N 3.06Å; T521-C523 PolarHBondContact O-N 3.12Å; C523-L525 VanDerWaalsContact C-N 3.35Å; C523-L525 HydrophobicContact CB-CD1 3.88Å; C523-L525 HydrophobicContact CB-CD2 4.44Å; C523-L525 HydrophobicContact CB-CG 3.79Å; C523-L525 PolarHBondContact O-N 2.87Å; C523-I629 HydrophobicContact CB-CG1 4.48Å
524	G	82.1	Confident	91.3	Very high	7 Å²	7	24.5 Å²	24.5	7%	0.072	13%	0.127	C	C	.	.	T	Hydrogen-bonded Turn	trans	66	35.2	178.8	0	0	0	0	0	113.5	R145 S520 T521 T522	R145-G524 VanDerWaalsContact CZ-O 3.29Å; R145-G524 PolarHBondContact NH1-O 3.1Å; S520-G524 PolarHBondContact O-N 3.49Å; T521-G524 PolarHBondContact O-N 3.48Å; T521-G524 VanDerWaalsContact O-N 3.15Å; T522-G524 PolarHBondContact O-N 3.47Å
525	L	86.9	Confident	91.4	Very high	5 Å²	5	21.7 Å²	21.7	3%	0.026	11%	0.112	C	C	.	.			trans	-89.8	124.5	-177.8	-55.2	171.4	0	0	0	109.6	V519 S520 C523 T530 A531 L534 V550	V519-L525 HydrophobicContact CG1-CD1 4.48Å; S520-L525 PolarHBondContact O-N 3.01Å; S520-L525 PolarHBondContact OG-O 2.95Å; C523-L525 VanDerWaalsContact C-N 3.35Å; C523-L525 HydrophobicContact CB-CD1 3.88Å; C523-L525 HydrophobicContact CB-CD2 4.44Å; C523-L525 HydrophobicContact CB-CG 3.79Å; C523-L525 PolarHBondContact O-N 2.87Å; L525-T530 HydrophobicContact CD1-CG2 4.24Å; L525-T530 HydrophobicContact CD2-CG2 4.09Å; L525-A531 HydrophobicContact CD1-CB 4.03Å; L525-L534 HydrophobicContact CD1-CD1 3.56Å; L525-V550 HydrophobicContact CD2-CG1 3.78Å
526	D	79.4	Confident	91.5	Very high	77 Å²	77	17.1 Å²	17.1	41%	0.412	9%	0.093	S	C	.	.	S	Bend	trans	-83.4	-25.5	-179.4	-60.7	-40.7	0	0	0	112.2	R145 G461 R465	R145-D526 IonicContact NH1-OD1 4Å; R145-D526 IonicContact NH1-OD2 2.95Å; R145-D526 IonicContact NH2-OD1 3.73Å; R145-D526 PolarHBondContact NH2-OD1 3.2Å; G461-D526 WeakPolarHBondContact CA-O 3.35Å; R465-D526 IonicContact CZ-OD1 3.17Å; R465-D526 IonicContact NH1-OD1 2.72Å; R465-D526 IonicContact NH2-OD1 3.25Å; R465-D526 PolarHBondContact NH2-OD1 2.99Å
527	Q	88.5	Confident	91.6	Very high	65 Å²	65	17.1 Å²	17.1	30%	0.304	9%	0.093	S	C	.	.			trans	-99.9	120.5	176.3	-73.9	-173.3	-15.3	0	0	111.7	S529 T530	Q527-S529 PolarHBondContact O-N 3.41Å; Q527-T530 WeakPolarHBondContact O-CB 3.48Å; Q527-T530 PolarHBondContact O-N 3.15Å
528	P	94.4	Very high	91.7	Very high	2 Å²	2	18.2 Å²	18.2	1%	0.013	10%	0.1	C	C	.	.	H	α-helix	trans	-57.6	-32.4	175.5	-29.6	38.2	0	0	0	114.1	L464 L495 L498 L516 T530 A531 A532	L464-P528 HydrophobicContact CB-CG 4.5Å; L464-P528 HydrophobicContact CD2-CB 4.15Å; L464-P528 HydrophobicContact CD2-CG 4.01Å; L495-P528 HydrophobicContact CD2-CB 3.92Å; L495-P528 HydrophobicContact CD2-CG 3.84Å; L498-P528 HydrophobicContact CD1-CB 3.64Å; L516-P528 HydrophobicContact CD2-CB 4.16Å; P528-T530 VanDerWaalsContact C-N 3.26Å; P528-T530 PolarHBondContact O-N 3.46Å; P528-A531 PolarHBondContact O-N 3.03Å; P528-A531 VanDerWaalsContact O-N 3.14Å; P528-A532 PolarHBondContact O-N 3.08Å
529	S	94.9	Very high	91.8	Very high	8 Å²	8	18.9 Å²	18.9	6%	0.056	11%	0.107	C	C	.	.	H	α-helix	trans	-55.9	-40.2	176.4	-51.6	0	0	0	0	112.5	Q527 A532 A533 G659 H662	Q527-S529 PolarHBondContact O-N 3.41Å; S529-A532 PolarHBondContact O-N 2.82Å; S529-A533 PolarHBondContact O-N 2.93Å; S529-G659 WeakPolarHBondContact CA-O 3.38Å; S529-G659 VanDerWaalsContact CB-O 3.23Å; S529-G659 WeakPolarHBondContact CB-O 3.36Å; S529-G659 VanDerWaalsContact O-CA 3.25Å; S529-G659 WeakPolarHBondContact O-CA 3.41Å; S529-H662 PolarHBondContact OG-CE1 2.7Å; S529-H662 PolarHBondContact OG-NE2 3.1Å
530	T	95.3	Very high	91.9	Very high	12 Å²	12	20.6 Å²	20.6	7%	0.074	12%	0.115	C	C	.	.	H	α-helix	trans	-68.2	-39.5	178.4	-46.6	0	0	0	0	111.7	L525 Q527 P528 A533 L534 V550	L525-T530 HydrophobicContact CD1-CG2 4.24Å; L525-T530 HydrophobicContact CD2-CG2 4.09Å; Q527-T530 WeakPolarHBondContact O-CB 3.48Å; Q527-T530 PolarHBondContact O-N 3.15Å; P528-T530 VanDerWaalsContact C-N 3.26Å; P528-T530 PolarHBondContact O-N 3.46Å; T530-A533 PolarHBondContact O-N 3.48Å; T530-L534 PolarHBondContact O-N 2.81Å; T530-L534 VanDerWaalsContact O-N 3.12Å; T530-V550 HydrophobicContact CG2-CB 3.93Å; T530-V550 HydrophobicContact CG2-CG1 3.34Å; T530-V550 HydrophobicContact CG2-CG2 3.4Å
531	A	95.6	Very high	92.1	Very high	0 Å²	0	21.7 Å²	21.7	0%	0	13%	0.126	C	C	.	.	H	α-helix	trans	-67.3	-37.9	174.1	0	0	0	0	0	111.5	L516 V519 L525 P528 L534 L535	L516-A531 HydrophobicContact CD2-CB 4.4Å; L516-A531 HydrophobicContact CG-CB 4.38Å; V519-A531 HydrophobicContact CG1-CB 4.13Å; L525-A531 HydrophobicContact CD1-CB 4.03Å; P528-A531 PolarHBondContact O-N 3.03Å; P528-A531 VanDerWaalsContact O-N 3.14Å; A531-L534 PolarHBondContact O-N 2.84Å; A531-L535 PolarHBondContact O-N 3.45Å
532	A	96.4	Very high	92.7	Very high	4 Å²	4	20.5 Å²	20.5	3%	0.033	12%	0.119	C	C	.	.	H	α-helix	trans	-65.1	-39.2	174.5	0	0	0	0	0	112.5	L498 L516 P528 S529 L535 G536	L498-A532 HydrophobicContact CD2-CB 3.84Å; L516-A532 HydrophobicContact CD1-CB 3.92Å; P528-A532 PolarHBondContact O-N 3.08Å; S529-A532 PolarHBondContact O-N 2.82Å; A532-L535 PolarHBondContact O-N 3.1Å; A532-G536 PolarHBondContact O-N 2.95Å
533	A	96.9	Very high	93.2	Very high	2 Å²	2	19.4 Å²	19.4	2%	0.017	11%	0.112	C	C	.	.	H	α-helix	trans	-62.4	-43.4	173.6	0	0	0	0	0	111.7	S529 T530 G536 A537 I546 A655 F660	S529-A533 PolarHBondContact O-N 2.93Å; T530-A533 PolarHBondContact O-N 3.48Å; A533-G536 PolarHBondContact O-N 3.46Å; A533-A537 WeakPolarHBondContact O-CB 3.44Å; A533-A537 PolarHBondContact O-N 3.3Å; A533-I546 HydrophobicContact CB-CG2 4.35Å; A533-A655 WeakPolarHBondContact CA-O 3.47Å; A533-F660 HydrophobicContact CB-CD2 4.3Å; A533-F660 HydrophobicContact CB-CE2 4.05Å
534	L	96.8	Very high	93.7	Very high	0 Å²	0	22 Å²	22	0%	0	12%	0.124	C	C	.	.	H	α-helix	trans	-62.1	-41.4	176.2	-87.1	170	0	0	0	113	V519 L525 T530 A531 A537 I546 A547 V550 I629 F633	V519-L534 HydrophobicContact CG1-CB 4.36Å; V519-L534 HydrophobicContact CG1-CD1 4.33Å; L525-L534 HydrophobicContact CD1-CD1 3.56Å; T530-L534 PolarHBondContact O-N 2.81Å; T530-L534 VanDerWaalsContact O-N 3.12Å; A531-L534 PolarHBondContact O-N 2.84Å; L534-A537 WeakPolarHBondContact O-CB 3.47Å; L534-A537 PolarHBondContact O-N 3.04Å; L534-I546 HydrophobicContact CD2-CG2 4.01Å; L534-I546 HydrophobicContact CG-CG2 4.25Å; L534-A547 HydrophobicContact CD2-CB 4.08Å; L534-V550 HydrophobicContact CD1-CG1 4.27Å; L534-V550 HydrophobicContact CD1-CG2 4.22Å; L534-V550 HydrophobicContact CD2-CG2 4.38Å; L534-V550 HydrophobicContact CG-CG2 3.96Å; L534-I629 HydrophobicContact CD1-CG2 4.36Å; L534-I629 HydrophobicContact CD2-CG2 4.11Å; L534-F633 HydrophobicContact CB-CE2 4.43Å; L534-F633 HydrophobicContact CB-CZ 3.95Å; L534-F633 HydrophobicContact CD1-CE2 4.43Å; L534-F633 HydrophobicContact CD2-CE2 4.03Å; L534-F633 HydrophobicContact CD2-CZ 3.74Å; L534-F633 HydrophobicContact CG-CZ 4.32Å
535	L	95.5	Very high	94.5	Very high	24 Å²	24	22.9 Å²	22.9	13%	0.126	13%	0.126	C	C	.	.	H	α-helix	trans	-67.6	-41.8	173.2	-75.4	177.1	0	0	0	112	K515 L516 V519 A531 A532 A537 C538 L638	K515-L535 HydrophobicContact CB-CD1 4.07Å; K515-L535 HydrophobicContact CB-CD2 4.17Å; L516-L535 VanDerWaalsContact CA-CD1 3.48Å; L516-L535 HydrophobicContact CB-CD1 3.77Å; L516-L535 HydrophobicContact CG-CD1 4.33Å; V519-L535 HydrophobicContact CG2-CD2 3.85Å; V519-L535 HydrophobicContact CG2-CG 4.26Å; A531-L535 PolarHBondContact O-N 3.45Å; A532-L535 PolarHBondContact O-N 3.1Å; L535-A537 PolarHBondContact O-N 3.31Å; L535-C538 VanDerWaalsContact O-CB 3.24Å; L535-C538 WeakPolarHBondContact O-CB 3.36Å; L535-C538 PolarHBondContact O-N 3.34Å; L535-L638 HydrophobicContact CD2-CD1 4.31Å
536	G	95.3	Very high	95	Very high	4 Å²	4	22.7 Å²	22.7	4%	0.041	13%	0.125	C	C	.	.	H	α-helix	trans	-61	-31.8	174.8	0	0	0	0	0	112.7	A532 A533 C538 D539 E540 R658	A532-G536 PolarHBondContact O-N 2.95Å; A533-G536 PolarHBondContact O-N 3.46Å; G536-C538 PolarHBondContact O-N 3.26Å; G536-D539 WeakPolarHBondContact O-CB 3.25Å; G536-D539 PolarHBondContact O-N 2.86Å; G536-D539 VanDerWaalsContact O-N 3.08Å; G536-E540 WeakPolarHBondContact O-CG 3.3Å; G536-E540 PolarHBondContact O-N 2.92Å; G536-R658 VanDerWaalsContact CA-CD 3.41Å
537	A	97.1	Very high	95.9	Very high	0 Å²	0	19 Å²	19	0%	0	11%	0.106	C	C	.	.	H	α-helix	trans	-65.2	-25.9	175.2	0	0	0	0	0	113.3	A533 L534 L535 D539 G541 C542 I546 A655	A533-A537 WeakPolarHBondContact O-CB 3.44Å; A533-A537 PolarHBondContact O-N 3.3Å; L534-A537 WeakPolarHBondContact O-CB 3.47Å; L534-A537 PolarHBondContact O-N 3.04Å; L535-A537 PolarHBondContact O-N 3.31Å; A537-D539 VanDerWaalsContact C-N 3.35Å; A537-G541 PolarHBondContact O-N 2.93Å; A537-C542 PolarHBondContact O-N 3.34Å; A537-I546 HydrophobicContact CB-CB 3.64Å; A537-I546 HydrophobicContact CB-CG1 3.62Å; A537-I546 HydrophobicContact CB-CG2 3.97Å; A537-A655 HydrophobicContact CB-CB 4.03Å
538	C	95.5	Very high	96.3	Very high	24 Å²	24	16 Å²	16	16%	0.162	9%	0.092	C	C	.	.	H	α-helix	trans	-67.8	-37.6	171.7	-59.2	0	0	0	0	111.3	L535 G536 P639	L535-C538 VanDerWaalsContact O-CB 3.24Å; L535-C538 WeakPolarHBondContact O-CB 3.36Å; L535-C538 PolarHBondContact O-N 3.34Å; G536-C538 PolarHBondContact O-N 3.26Å; C538-P639 HydrophobicContact CB-CG 4.31Å
539	D	93.7	Very high	96.4	Very high	109 Å²	109	16.2 Å²	16.2	58%	0.583	9%	0.093	S	C	*	.	H	α-helix	trans	-73.5	-38.6	179.2	-57	-25.6	0	0	0	111.3	G536 A537 R658	G536-D539 WeakPolarHBondContact O-CB 3.25Å; G536-D539 PolarHBondContact O-N 2.86Å; G536-D539 VanDerWaalsContact O-N 3.08Å; A537-D539 VanDerWaalsContact C-N 3.35Å; D539-R658 IonicContact OD2-CZ 2.8Å; D539-R658 IonicContact OD2-NH1 2.78Å; D539-R658 PolarHBondContact OD2-NH1 3.12Å
540	E	95.8	Very high	96.4	Very high	38 Å²	38	16 Å²	16	18%	0.178	9%	0.091	C	C	.	.	H	α-helix	trans	-85.9	-10.2	-178.3	-57.4	-67.3	151.9	0	0	113.2	G536 P651 R654 A655 R658	G536-E540 WeakPolarHBondContact O-CG 3.3Å; G536-E540 PolarHBondContact O-N 2.92Å; E540-P651 HydrophobicContact CB-CB 4.21Å; E540-R654 HydrophobicContact CG-CB 4.11Å; E540-R654 IonicContact OE1-CZ 3.67Å; E540-R654 IonicContact OE1-NE 2.97Å; E540-R654 IonicContact OE1-NH2 3.62Å; E540-R654 IonicContact OE2-CZ 2.81Å; E540-R654 IonicContact OE2-NE 3.07Å; E540-R654 PolarHBondContact OE2-NE 3.37Å; E540-R654 IonicContact OE2-NH2 3.73Å; E540-A655 HydrophobicContact CB-CB 4.45Å; E540-A655 HydrophobicContact CG-CB 4.25Å; E540-R658 IonicContact OE1-CZ 2.68Å; E540-R658 VanDerWaalsContact OE1-CZ 3.22Å; E540-R658 IonicContact OE1-NE 3.97Å; E540-R658 PolarHBondContact OE1-NE 3.19Å; E540-R658 IonicContact OE1-NH2 3.55Å; E540-R658 PolarHBondContact OE1-NH2 2.84Å
541	G	96.6	Very high	96.3	Very high	23 Å²	23	15.4 Å²	15.4	24%	0.237	9%	0.087	C	C	.	.	T	Hydrogen-bonded Turn	trans	76	35.1	178.4	0	0	0	0	0	114.9	A537 K642 A643	A537-G541 PolarHBondContact O-N 2.93Å; G541-K642 CarbonylContact O-C 3.58Å; G541-K642 VanDerWaalsContact O-O 3.07Å; G541-A643 WeakPolarHBondContact O-CA 3.44Å; G541-A643 PolarHBondContact O-N 2.94Å
542	C	97.4	Very high	96.2	Very high	0 Å²	0	15.5 Å²	15.5	0%	0	9%	0.088	C	C	.	.			trans	-138	37.5	-176.3	67.2	0	0	0	0	113.4	A537 Q544 E545 I546 A643 P651 V652	A537-C542 PolarHBondContact O-N 3.34Å; C542-Q544 VanDerWaalsContact C-N 3.31Å; C542-Q544 PolarHBondContact O-N 3.22Å; C542-E545 VanDerWaalsContact CA-OE2 3.28Å; C542-E545 WeakPolarHBondContact CA-OE2 3.39Å; C542-E545 PolarHBondContact O-N 3.28Å; C542-I546 WeakPolarHBondContact O-CG1 3.28Å; C542-I546 PolarHBondContact O-N 2.83Å; C542-I546 VanDerWaalsContact O-N 3.11Å; C542-A643 HydrophobicContact CB-CB 3.91Å; C542-P651 HydrophobicContact CB-CB 3.9Å; C542-P651 VanDerWaalsContact SG-C 3.51Å; C542-P651 PolarHBondContact SG-O 3.35Å; C542-P651 VanDerWaalsContact SG-O 3.38Å; C542-V652 HydrophobicContact CB-CG2 4.05Å
543	S	97.2	Very high	95.9	Very high	0 Å²	0	17.3 Å²	17.3	0%	0	10%	0.096	C	C	.	.	H	α-helix	trans	-60.8	-34.5	-174.2	58.5	0	0	0	0	114	A547 P639 W640 V641	S543-A547 VanDerWaalsContact O-CB 3.23Å; S543-A547 WeakPolarHBondContact O-CB 3.44Å; S543-A547 PolarHBondContact O-N 3.36Å; S543-P639 WeakPolarHBondContact CB-O 3.21Å; S543-P639 PolarHBondContact OG-O 3.29Å; S543-W640 VanDerWaalsContact OG-CA 3.3Å; S543-W640 WeakPolarHBondContact OG-CA 3.39Å; S543-V641 PolarHBondContact N-O 2.96Å; S543-V641 VanDerWaalsContact N-O 3.11Å; S543-V641 PolarHBondContact OG-N 2.96Å; S543-V641 PolarHBondContact OG-O 3.46Å
544	Q	97.2	Very high	95.3	Very high	58 Å²	58	21.3 Å²	21.3	27%	0.271	12%	0.115	S	C	.	.	H	α-helix	trans	-70	-42.8	-179.1	-67.2	-170.9	23.2	0	0	111.7	C542 A547 A548 W640 V641 K642	C542-Q544 VanDerWaalsContact C-N 3.31Å; C542-Q544 PolarHBondContact O-N 3.22Å; Q544-A547 PolarHBondContact O-N 3.45Å; Q544-A548 PolarHBondContact O-N 3.19Å; Q544-W640 HydrophobicContact CG-CD2 4Å; Q544-W640 HydrophobicContact CG-CG 4.31Å; Q544-W640 HydrophobicContact CG-CZ2 4Å; Q544-W640 PolarHBondContact NE2-O 3Å; Q544-W640 VanDerWaalsContact NE2-O 3.15Å; Q544-V641 PolarHBondContact N-O 3.48Å; Q544-V641 VanDerWaalsContact N-O 3.14Å; Q544-K642 HydrophobicContact CB-CG 4.2Å; Q544-K642 HydrophobicContact CG-CG 4.29Å; Q544-K642 VanDerWaalsContact OE1-CG 3.28Å
545	E	97.6	Very high	94.6	Very high	25 Å²	25	22.3 Å²	22.3	12%	0.117	12%	0.12	C	C	.	.	H	α-helix	trans	-65.6	-45.2	178.1	-64	82.3	177.2	0	0	110.9	C542 A548 I549 L587 K642 A643 V652	C542-E545 VanDerWaalsContact CA-OE2 3.28Å; C542-E545 WeakPolarHBondContact CA-OE2 3.39Å; C542-E545 PolarHBondContact O-N 3.28Å; E545-A548 WeakPolarHBondContact O-CB 3.38Å; E545-A548 PolarHBondContact O-N 3.01Å; E545-I549 WeakPolarHBondContact O-CG1 3.49Å; E545-I549 PolarHBondContact O-N 3.47Å; E545-L587 HydrophobicContact CB-CD1 4.5Å; E545-L587 HydrophobicContact CB-CD2 3.86Å; E545-L587 HydrophobicContact CG-CD2 4.03Å; E545-K642 WeakPolarHBondContact OE1-CA 3.49Å; E545-K642 WeakPolarHBondContact OE1-CB 3.41Å; E545-A643 PolarHBondContact OE1-N 3.37Å; E545-A643 PolarHBondContact OE2-N 3.34Å; E545-V652 HydrophobicContact CB-CG1 4.43Å; E545-V652 HydrophobicContact CB-CG2 3.78Å; E545-V652 HydrophobicContact CG-CG2 4.06Å
546	I	97.8	Very high	93.4	Very high	2 Å²	2	27.1 Å²	27.1	1%	0.01	14%	0.141	C	C	.	.	H	α-helix	trans	-68.2	-38.7	178.5	-65.1	-69.6	0	0	0	111	A533 L534 A537 C542 A548 I549 V550 V652 A655 I656	A533-I546 HydrophobicContact CB-CG2 4.35Å; L534-I546 HydrophobicContact CD2-CG2 4.01Å; L534-I546 HydrophobicContact CG-CG2 4.25Å; A537-I546 HydrophobicContact CB-CB 3.64Å; A537-I546 HydrophobicContact CB-CG1 3.62Å; A537-I546 HydrophobicContact CB-CG2 3.97Å; C542-I546 WeakPolarHBondContact O-CG1 3.28Å; C542-I546 PolarHBondContact O-N 2.83Å; C542-I546 VanDerWaalsContact O-N 3.11Å; I546-A548 VanDerWaalsContact C-N 3.3Å; I546-A548 PolarHBondContact O-N 2.92Å; I546-I549 HydrophobicContact CD1-CD1 4.32Å; I546-I549 PolarHBondContact O-N 2.86Å; I546-V550 HydrophobicContact CG2-CG2 4.19Å; I546-V550 WeakPolarHBondContact O-CB 3.21Å; I546-V550 VanDerWaalsContact O-CG2 3.3Å; I546-V550 WeakPolarHBondContact O-CG2 3.45Å; I546-V550 PolarHBondContact O-N 2.84Å; I546-V652 HydrophobicContact CD1-CG1 3.76Å; I546-V652 WeakPolarHBondContact CD1-O 3.42Å; I546-V652 HydrophobicContact CG1-CG1 4.49Å; I546-A655 HydrophobicContact CD1-CB 3.76Å; I546-A655 HydrophobicContact CG1-CB 3.73Å; I546-I656 HydrophobicContact CD1-CD1 4.47Å; I546-I656 HydrophobicContact CD1-CG1 3.7Å
547	A	97.2	Very high	92.6	Very high	0 Å²	0	31.7 Å²	31.7	0%	0	16%	0.158	C	C	.	.	H	α-helix	trans	-62.4	-36.7	173.2	0	0	0	0	0	112.8	L534 S543 Q544 S551 R626 I629 W640	L534-A547 HydrophobicContact CD2-CB 4.08Å; S543-A547 VanDerWaalsContact O-CB 3.23Å; S543-A547 WeakPolarHBondContact O-CB 3.44Å; S543-A547 PolarHBondContact O-N 3.36Å; Q544-A547 PolarHBondContact O-N 3.45Å; A547-S551 WeakPolarHBondContact O-CB 3.47Å; A547-S551 PolarHBondContact O-N 2.79Å; A547-S551 PolarHBondContact O-OG 2.73Å; A547-R626 HydrophobicContact CB-CG 4.32Å; A547-I629 HydrophobicContact CB-CB 4.3Å; A547-I629 HydrophobicContact CB-CG2 3.78Å; A547-W640 HydrophobicContact CB-CH2 3.4Å; A547-W640 HydrophobicContact CB-CZ3 3.66Å
548	A	97	Very high	92.2	Very high	2 Å²	2	32 Å²	32	2%	0.017	16%	0.159	C	C	.	.	H	α-helix	trans	-63.5	-48.9	171.2	0	0	0	0	0	111	Q544 E545 I546 V550 S551 L552 L587 F590 R626	Q544-A548 PolarHBondContact O-N 3.19Å; E545-A548 WeakPolarHBondContact O-CB 3.38Å; E545-A548 PolarHBondContact O-N 3.01Å; I546-A548 VanDerWaalsContact C-N 3.3Å; I546-A548 PolarHBondContact O-N 2.92Å; A548-V550 PolarHBondContact O-N 3.26Å; A548-S551 WeakPolarHBondContact O-CB 3.31Å; A548-S551 PolarHBondContact O-N 2.93Å; A548-S551 VanDerWaalsContact O-N 3.1Å; A548-L552 WeakPolarHBondContact O-CB 3.23Å; A548-L552 VanDerWaalsContact O-CG 3.23Å; A548-L552 WeakPolarHBondContact O-CG 3.19Å; A548-L552 PolarHBondContact O-N 3.12Å; A548-L587 HydrophobicContact CB-CD1 3.74Å; A548-F590 HydrophobicContact CB-CD1 3.89Å; A548-F590 HydrophobicContact CB-CE1 3.75Å; A548-F590 HydrophobicContact CB-CZ 4.35Å; A548-R626 HydrophobicContact CB-CG 4.09Å
549	I	96.5	Very high	91.8	Very high	5 Å²	5	31.7 Å²	31.7	3%	0.026	16%	0.155	C	C	.	.	H	α-helix	trans	-59.5	-46.6	177.6	-69.1	166	0	0	0	111.4	E545 I546 S551 L552 M553 H583 L587 V652 I656	E545-I549 WeakPolarHBondContact O-CG1 3.49Å; E545-I549 PolarHBondContact O-N 3.47Å; I546-I549 HydrophobicContact CD1-CD1 4.32Å; I546-I549 PolarHBondContact O-N 2.86Å; I549-S551 VanDerWaalsContact C-N 3.25Å; I549-S551 PolarHBondContact O-N 3.12Å; I549-L552 CarbonylContact O-C 3.48Å; I549-L552 WeakPolarHBondContact O-CB 3.21Å; I549-L552 PolarHBondContact O-N 2.77Å; I549-L552 VanDerWaalsContact O-N 3.11Å; I549-M553 HydrophobicContact CG2-CG 4.4Å; I549-M553 HydrophobicContact CG2-SD 4.3Å; I549-M553 VanDerWaalsContact O-CG 3.31Å; I549-M553 WeakPolarHBondContact O-CG 3.47Å; I549-M553 PolarHBondContact O-N 3.21Å; I549-H583 HydrophobicContact CD1-CB 4.32Å; I549-H583 HydrophobicContact CG2-CB 4.28Å; I549-L587 HydrophobicContact CD1-CD2 4.25Å; I549-L587 HydrophobicContact CG1-CB 4.23Å; I549-L587 HydrophobicContact CG1-CD1 4.43Å; I549-V652 HydrophobicContact CD1-CG1 3.45Å; I549-V652 VanDerWaalsContact CD1-CG1 3.45Å; I549-I656 HydrophobicContact CD1-CD1 4.18Å
550	V	95.2	Very high	91.3	Very high	3 Å²	3	29.2 Å²	29.2	2%	0.018	14%	0.144	C	C	.	.	H	α-helix	trans	-58.5	-39.3	175.7	166.4	0	0	0	0	111.6	L525 T530 L534 I546 A548 M553 Q554 I629	L525-V550 HydrophobicContact CD2-CG1 3.78Å; T530-V550 HydrophobicContact CG2-CB 3.93Å; T530-V550 HydrophobicContact CG2-CG1 3.34Å; T530-V550 HydrophobicContact CG2-CG2 3.4Å; L534-V550 HydrophobicContact CD1-CG1 4.27Å; L534-V550 HydrophobicContact CD1-CG2 4.22Å; L534-V550 HydrophobicContact CD2-CG2 4.38Å; L534-V550 HydrophobicContact CG-CG2 3.96Å; I546-V550 HydrophobicContact CG2-CG2 4.19Å; I546-V550 WeakPolarHBondContact O-CB 3.21Å; I546-V550 VanDerWaalsContact O-CG2 3.3Å; I546-V550 WeakPolarHBondContact O-CG2 3.45Å; I546-V550 PolarHBondContact O-N 2.84Å; A548-V550 PolarHBondContact O-N 3.26Å; V550-M553 PolarHBondContact O-N 3.39Å; V550-Q554 PolarHBondContact O-N 2.97Å; V550-I629 HydrophobicContact CB-CD1 4.43Å; V550-I629 HydrophobicContact CG1-CD1 3.91Å
551	S	93.3	Very high	90.2	Very high	0 Å²	0	30.5 Å²	30.5	0%	0	15%	0.154	C	C	.	.	H	α-helix	trans	-68	-39.1	176.7	-59.5	0	0	0	0	111.9	A547 A548 I549 Q554 A622 R626	A547-S551 WeakPolarHBondContact O-CB 3.47Å; A547-S551 PolarHBondContact O-N 2.79Å; A547-S551 PolarHBondContact O-OG 2.73Å; A548-S551 WeakPolarHBondContact O-CB 3.31Å; A548-S551 PolarHBondContact O-N 2.93Å; A548-S551 VanDerWaalsContact O-N 3.1Å; I549-S551 VanDerWaalsContact C-N 3.25Å; I549-S551 PolarHBondContact O-N 3.12Å; S551-Q554 PolarHBondContact O-N 3.06Å; S551-A622 WeakPolarHBondContact CB-O 3.35Å; S551-R626 VanDerWaalsContact OG-CA 3.29Å; S551-R626 WeakPolarHBondContact OG-CA 3.06Å; S551-R626 PolarHBondContact OG-N 3Å
552	L	93.7	Very high	88.8	Confident	2 Å²	2	30.9 Å²	30.9	1%	0.01	15%	0.153	C	C	.	.	H	α-helix	trans	-65.8	-38.7	175.5	-70	169.9	0	0	0	112	A548 I549 Q554 I555 I558 E586 F590 L619 A622	A548-L552 WeakPolarHBondContact O-CB 3.23Å; A548-L552 VanDerWaalsContact O-CG 3.23Å; A548-L552 WeakPolarHBondContact O-CG 3.19Å; A548-L552 PolarHBondContact O-N 3.12Å; I549-L552 CarbonylContact O-C 3.48Å; I549-L552 WeakPolarHBondContact O-CB 3.21Å; I549-L552 PolarHBondContact O-N 2.77Å; I549-L552 VanDerWaalsContact O-N 3.11Å; L552-Q554 PolarHBondContact O-N 3.49Å; L552-I555 WeakPolarHBondContact O-CA 3.38Å; L552-I555 WeakPolarHBondContact O-CB 3.3Å; L552-I555 PolarHBondContact O-N 3.34Å; L552-I555 VanDerWaalsContact O-O 3.06Å; L552-I558 HydrophobicContact CB-CD1 3.99Å; L552-I558 HydrophobicContact CD1-CD1 4.45Å; L552-I558 HydrophobicContact CD2-CD1 3.64Å; L552-I558 HydrophobicContact CD2-CG1 3.87Å; L552-I558 HydrophobicContact CG-CD1 4.21Å; L552-E586 HydrophobicContact CD1-CB 4.17Å; L552-F590 HydrophobicContact CD1-CB 3.82Å; L552-F590 HydrophobicContact CD1-CG 4.26Å; L552-F590 HydrophobicContact CD2-CB 4.17Å; L552-F590 HydrophobicContact CD2-CD2 3.97Å; L552-F590 HydrophobicContact CD2-CG 4.39Å; L552-F590 HydrophobicContact CG-CB 4.49Å; L552-F590 HydrophobicContact CG-CD2 4.45Å; L552-L619 HydrophobicContact CD2-CD2 3.95Å; L552-A622 HydrophobicContact CD2-CB 3.89Å
553	M	91.1	Very high	87	Confident	42 Å²	42	36.2 Å²	36.2	21%	0.207	18%	0.182	C	C	.	.	H	α-helix	trans	-61.6	-25	174.5	-69.9	177.8	70.2	0	0	113.1	I549 V550 I555 F660 T705	I549-M553 HydrophobicContact CG2-CG 4.4Å; I549-M553 HydrophobicContact CG2-SD 4.3Å; I549-M553 VanDerWaalsContact O-CG 3.31Å; I549-M553 WeakPolarHBondContact O-CG 3.47Å; I549-M553 PolarHBondContact O-N 3.21Å; V550-M553 PolarHBondContact O-N 3.39Å; M553-I555 VanDerWaalsContact C-N 3.25Å; M553-F660 HydrophobicContact CE-CE1 4.05Å; M553-F660 HydrophobicContact CE-CE2 4.37Å; M553-F660 HydrophobicContact CE-CZ 3.6Å; M553-F660 HydrophobicContact SD-CE2 4.42Å; M553-F660 HydrophobicContact SD-CZ 4.15Å; M553-T705 HydrophobicContact CE-CG2 3.7Å; M553-T705 HydrophobicContact SD-CG2 4.44Å
554	Q	84	Confident	85.2	Confident	87 Å²	87	46.5 Å²	46.5	41%	0.407	22%	0.222	S	C	.	.	T	Hydrogen-bonded Turn	trans	-79.6	-9.2	174.8	-63.9	-176.9	32	0	0	112.9	V550 S551 L552 L625	V550-Q554 PolarHBondContact O-N 2.97Å; S551-Q554 PolarHBondContact O-N 3.06Å; L552-Q554 PolarHBondContact O-N 3.49Å; Q554-L625 HydrophobicContact CB-CD1 4.1Å
555	I	82.3	Confident	83.8	Confident	21 Å²	21	50 Å²	50	11%	0.108	24%	0.237	C	C	.	.	S	Bend	trans	-104.2	127.8	179.5	-64.4	154.4	0	0	0	108.7	L552 M553 R557 G618 A622	L552-I555 WeakPolarHBondContact O-CA 3.38Å; L552-I555 WeakPolarHBondContact O-CB 3.3Å; L552-I555 PolarHBondContact O-N 3.34Å; L552-I555 VanDerWaalsContact O-O 3.06Å; M553-I555 VanDerWaalsContact C-N 3.25Å; I555-R557 PolarHBondContact O-N 3.32Å; I555-G618 WeakPolarHBondContact CD1-O 3.41Å; I555-A622 HydrophobicContact CD1-CB 3.22Å
556	Q	69.4	Low	82.6	Confident	124 Å²	124	54.9 Å²	54.9	58%	0.579	26%	0.259	S	S	*	.	S	Bend	trans	-63.9	-41.7	-171.3	-72.5	-175	-13.4	0	0	114.3	S349	S349-Q556 VanDerWaalsContact CB-CD 3.46Å; S349-Q556 PolarHBondContact OG-OE1 3.18Å
557	R	78.7	Confident	81.6	Confident	101 Å²	101	59.4 Å²	59.4	38%	0.381	29%	0.287	S	S	.	.			trans	-149.3	124.8	178.4	-68.2	-168.1	-171.9	141.5	12.8	111.7	N302 I555 N615	N302-R557 PolarHBondContact ND2-NH2 3.09Å; N302-R557 VanDerWaalsContact ND2-NH2 3.16Å; N302-R557 PolarHBondContact OD1-NH1 2.86Å; N302-R557 PolarHBondContact OD1-NH2 2.98Å; N302-R557 VanDerWaalsContact OD1-NH2 3.1Å; I555-R557 PolarHBondContact O-N 3.32Å; R557-N615 PolarHBondContact O-ND2 3.26Å
558	I	88.1	Confident	80.6	Confident	5 Å²	5	61.2 Å²	61.2	3%	0.026	30%	0.299	C	S	.	.	S	Bend	trans	-85.9	-38	174.1	-61.6	149.5	0	0	0	110.4	L552 E586 A589 L614 N615 L619	L552-I558 HydrophobicContact CB-CD1 3.99Å; L552-I558 HydrophobicContact CD1-CD1 4.45Å; L552-I558 HydrophobicContact CD2-CD1 3.64Å; L552-I558 HydrophobicContact CD2-CG1 3.87Å; L552-I558 HydrophobicContact CG-CD1 4.21Å; I558-E586 HydrophobicContact CD1-CB 3.65Å; I558-E586 HydrophobicContact CD1-CG 3.48Å; I558-E586 VanDerWaalsContact CD1-CG 3.48Å; I558-A589 HydrophobicContact CG2-CB 4.36Å; I558-L614 HydrophobicContact CG2-CD2 4.17Å; I558-N615 WeakPolarHBondContact O-CB 3.48Å; I558-N615 PolarHBondContact O-N 3Å; I558-L619 HydrophobicContact CG2-CD1 4.3Å; I558-L619 HydrophobicContact CG2-CD2 3.82Å; I558-L619 HydrophobicContact CG2-CG 4.19Å
559	F	88.7	Confident	79.7	Confident	18 Å²	18	62 Å²	62	8%	0.079	30%	0.303	C	S	.	.	B	Isolated β-bridge	trans	-89.7	130.6	177.2	-57.7	-75.3	0	0	0	110.6	R573 F576 T585 E586 A589 G613 L614	F559-R573 HydrophobicContact CD1-CB 4.28Å; F559-R573 HydrophobicContact CD1-CG 4.13Å; F559-R573 HydrophobicContact CD2-CG 4.11Å; F559-R573 HydrophobicContact CE1-CB 4.42Å; F559-R573 HydrophobicContact CE1-CG 4.02Å; F559-R573 HydrophobicContact CE2-CG 3.99Å; F559-R573 HydrophobicContact CG-CG 4.18Å; F559-R573 HydrophobicContact CZ-CG 3.95Å; F559-F576 AromaticContact CE1-CD2 3.83Å; F559-F576 HydrophobicContact CE1-CD2 3.83Å; F559-F576 HydrophobicContact CE1-CE2 4.49Å; F559-T585 HydrophobicContact CE2-CG2 4.37Å; F559-T585 HydrophobicContact CZ-CG2 4Å; F559-E586 HydrophobicContact CE2-CG 4.02Å; F559-A589 HydrophobicContact CE1-CB 4.16Å; F559-A589 HydrophobicContact CZ-CB 4.01Å; F559-G613 CarbonylContact C-O 3.59Å; F559-G613 WeakPolarHBondContact CA-O 3.41Å; F559-L614 HydrophobicContact CD1-CD2 3.82Å; F559-L614 HydrophobicContact CE1-CD2 3.73Å
560	T	82.5	Confident	78.9	Confident	57 Å²	57	67.9 Å²	67.9	35%	0.35	33%	0.325	S	S	.	.			trans	-74.7	141.3	171.4	56.3	0	0	0	0	109.4	G613 N615	T560-G613 PolarHBondContact N-O 2.97Å; T560-G613 VanDerWaalsContact OG1-CA 3.26Å; T560-G613 WeakPolarHBondContact OG1-CA 3.23Å; T560-G613 PolarHBondContact OG1-O 3Å; T560-N615 HydrophobicContact CG2-CB 4.28Å
561	V	72.1	Confident	78.3	Confident	65 Å²	65	72.4 Å²	72.4	39%	0.394	35%	0.348	S	S	.	.			trans	-117.5	133.4	178.4	-176.6	0	0	0	0	107.5
562	S	68.4	Low	77.9	Confident	31 Å²	31	74.8 Å²	74.8	22%	0.217	36%	0.357	C	S	.	.			trans	-103.2	139.6	173.9	66	0	0	0	0	109.9	Y564 K565 D569	S562-Y564 PolarHBondContact O-N 3.33Å; S562-K565 WeakPolarHBondContact OG-CA 3.42Å; S562-K565 WeakPolarHBondContact OG-CB 3.21Å; S562-K565 PolarHBondContact OG-N 3.16Å; S562-D569 PolarHBondContact N-OD2 2.9Å; S562-D569 PolarHBondContact OG-OD1 3.26Å; S562-D569 PolarHBondContact OG-OD2 2.83Å
563	D	58.2	Low	77.6	Confident	112 Å²	112	76.2 Å²	76.2	60%	0.599	36%	0.362	S	S	*	.	S	Bend	trans	-65.4	-24.2	-176.9	-65.1	-29.5	0	0	0	113
564	Y	60.8	Low	77.4	Confident	217 Å²	217	78.5 Å²	78.5	85%	0.851	37%	0.372	S	S	*	.	S	Bend	trans	-115.9	-6.1	-171.9	-57.6	-77.1	0	0	0	114.4	S562	S562-Y564 PolarHBondContact O-N 3.33Å
565	K	66.6	Low	77.7	Confident	132 Å²	132	79 Å²	79	57%	0.574	38%	0.381	S	S	*	.			trans	-129.6	45.2	-172.1	-42.3	-179	174.3	-177.7	0	113.8	S562 T567 S568 D569	S562-K565 WeakPolarHBondContact OG-CA 3.42Å; S562-K565 WeakPolarHBondContact OG-CB 3.21Å; S562-K565 PolarHBondContact OG-N 3.16Å; K565-T567 PolarHBondContact O-N 2.86Å; K565-T567 VanDerWaalsContact O-N 3.14Å; K565-S568 WeakPolarHBondContact CB-OG 3.25Å; K565-S568 WeakPolarHBondContact O-CA 3.17Å; K565-S568 WeakPolarHBondContact O-CB 3.49Å; K565-S568 PolarHBondContact O-N 3.23Å; K565-S568 PolarHBondContact O-OG 3.37Å; K565-D569 PolarHBondContact O-N 3.09Å
566	H	73	Confident	78.2	Confident	127 Å²	127	78.8 Å²	78.8	59%	0.588	38%	0.38	S	S	*	.	H	α-helix	trans	-48.7	-41.2	177.5	-64.5	-45.7	0	0	0	113.8	S568 D569 R570	H566-S568 PolarHBondContact O-N 2.88Å; H566-D569 PolarHBondContact O-N 3.27Å; H566-R570 WeakPolarHBondContact O-CB 3.36Å; H566-R570 PolarHBondContact O-N 2.81Å
567	T	76.3	Confident	79.2	Confident	97 Å²	97	74.5 Å²	74.5	60%	0.595	37%	0.369	S	S	*	.	H	α-helix	trans	-62.6	-43.6	176.2	-48.4	0	0	0	0	111.8	K565 R570 I571	K565-T567 PolarHBondContact O-N 2.86Å; K565-T567 VanDerWaalsContact O-N 3.14Å; T567-R570 PolarHBondContact O-N 2.77Å; T567-I571 HydrophobicContact CG2-CD1 4.22Å; T567-I571 VanDerWaalsContact O-CG1 3.31Å; T567-I571 WeakPolarHBondContact O-CG1 3.34Å; T567-I571 PolarHBondContact O-N 3.33Å
568	S	77.6	Confident	79.8	Confident	37 Å²	37	70.6 Å²	70.6	26%	0.259	36%	0.357	S	S	.	.	H	α-helix	trans	-69.2	-34.3	178.1	81	0	0	0	0	112.5	K565 H566 R570 I571 R572	K565-S568 WeakPolarHBondContact CB-OG 3.25Å; K565-S568 WeakPolarHBondContact O-CA 3.17Å; K565-S568 WeakPolarHBondContact O-CB 3.49Å; K565-S568 PolarHBondContact O-N 3.23Å; K565-S568 PolarHBondContact O-OG 3.37Å; H566-S568 PolarHBondContact O-N 2.88Å; S568-R570 VanDerWaalsContact C-N 3.31Å; S568-I571 PolarHBondContact O-N 3.45Å; S568-R572 WeakPolarHBondContact O-CB 3.46Å; S568-R572 WeakPolarHBondContact O-CG 3.49Å; S568-R572 PolarHBondContact O-N 2.91Å; S568-R572 PolarHBondContact O-NE 3.37Å; S568-R572 PolarHBondContact OG-NH2 2.82Å
569	D	77.8	Confident	79.8	Confident	18 Å²	18	77.5 Å²	77.5	10%	0.096	39%	0.389	C	S	.	.	H	α-helix	trans	-65.8	-40.2	175.7	-65	-30.4	0	0	0	109.9	S562 K565 H566 R572 R573	S562-D569 PolarHBondContact N-OD2 2.9Å; S562-D569 PolarHBondContact OG-OD1 3.26Å; S562-D569 PolarHBondContact OG-OD2 2.83Å; K565-D569 PolarHBondContact O-N 3.09Å; H566-D569 PolarHBondContact O-N 3.27Å; D569-R572 PolarHBondContact O-N 3.03Å; D569-R572 IonicContact OD1-CZ 2.83Å; D569-R572 VanDerWaalsContact OD1-CZ 3.22Å; D569-R572 IonicContact OD1-NH1 3.87Å; D569-R572 IonicContact OD1-NH2 2.94Å; D569-R572 PolarHBondContact OD1-NH2 2.92Å; D569-R573 WeakPolarHBondContact O-CB 3.35Å; D569-R573 PolarHBondContact O-N 3.38Å
570	R	79.8	Confident	80	Confident	129 Å²	129	80.2 Å²	80.2	49%	0.487	40%	0.402	S	S	.	.	H	α-helix	trans	-64.1	-45.3	175.8	-163.1	174.6	80.4	176.8	1.3	112	H566 T567 S568 R573 Q574	H566-R570 WeakPolarHBondContact O-CB 3.36Å; H566-R570 PolarHBondContact O-N 2.81Å; T567-R570 PolarHBondContact O-N 2.77Å; S568-R570 VanDerWaalsContact C-N 3.31Å; R570-R573 PolarHBondContact O-N 2.98Å; R570-Q574 WeakPolarHBondContact O-CG 3.46Å; R570-Q574 PolarHBondContact O-N 2.94Å
571	I	82.9	Confident	80.5	Confident	99 Å²	99	77.5 Å²	77.5	51%	0.508	39%	0.386	S	S	.	.	H	α-helix	trans	-60.8	-47.1	176.3	-67.9	164.6	0	0	0	110.4	T567 S568 R573 Q574 T575	T567-I571 HydrophobicContact CG2-CD1 4.22Å; T567-I571 VanDerWaalsContact O-CG1 3.31Å; T567-I571 WeakPolarHBondContact O-CG1 3.34Å; T567-I571 PolarHBondContact O-N 3.33Å; S568-I571 PolarHBondContact O-N 3.45Å; I571-R573 VanDerWaalsContact C-N 3.3Å; I571-R573 PolarHBondContact O-N 3.03Å; I571-Q574 WeakPolarHBondContact O-CB 3.08Å; I571-Q574 PolarHBondContact O-N 3.29Å; I571-Q574 VanDerWaalsContact O-N 3.07Å; I571-T575 PolarHBondContact O-N 3.3Å; I571-T575 PolarHBondContact O-OG1 3.03Å
572	R	85.1	Confident	81.5	Confident	49 Å²	49	74.5 Å²	74.5	19%	0.185	37%	0.367	C	S	.	.	H	α-helix	trans	-60	-38.3	177.7	-80.8	-179.2	-80.5	149.7	-9.9	112.8	S568 D569 T575 E611 V612	S568-R572 WeakPolarHBondContact O-CB 3.46Å; S568-R572 WeakPolarHBondContact O-CG 3.49Å; S568-R572 PolarHBondContact O-N 2.91Å; S568-R572 PolarHBondContact O-NE 3.37Å; S568-R572 PolarHBondContact OG-NH2 2.82Å; D569-R572 PolarHBondContact O-N 3.03Å; D569-R572 IonicContact OD1-CZ 2.83Å; D569-R572 VanDerWaalsContact OD1-CZ 3.22Å; D569-R572 IonicContact OD1-NH1 3.87Å; D569-R572 IonicContact OD1-NH2 2.94Å; D569-R572 PolarHBondContact OD1-NH2 2.92Å; R572-T575 VanDerWaalsContact O-CB 3.28Å; R572-T575 WeakPolarHBondContact O-CB 3.29Å; R572-T575 PolarHBondContact O-N 3.26Å; R572-T575 PolarHBondContact O-OG1 3.46Å; R572-E611 WeakPolarHBondContact CD-O 3.47Å; R572-V612 WeakPolarHBondContact CB-O 3.12Å
573	R	86.1	Confident	82.8	Confident	32 Å²	32	73.1 Å²	73.1	12%	0.121	36%	0.357	C	S	.	.	H	α-helix	trans	-67.9	-37.1	174	-172.4	171.1	178.1	142.3	-1.3	112.3	F559 D569 R570 I571 T575 F576 G577 D582 T585 E586 N688	F559-R573 HydrophobicContact CD1-CB 4.28Å; F559-R573 HydrophobicContact CD1-CG 4.13Å; F559-R573 HydrophobicContact CD2-CG 4.11Å; F559-R573 HydrophobicContact CE1-CB 4.42Å; F559-R573 HydrophobicContact CE1-CG 4.02Å; F559-R573 HydrophobicContact CE2-CG 3.99Å; F559-R573 HydrophobicContact CG-CG 4.18Å; F559-R573 HydrophobicContact CZ-CG 3.95Å; D569-R573 WeakPolarHBondContact O-CB 3.35Å; D569-R573 PolarHBondContact O-N 3.38Å; R570-R573 PolarHBondContact O-N 2.98Å; I571-R573 VanDerWaalsContact C-N 3.3Å; I571-R573 PolarHBondContact O-N 3.03Å; R573-T575 PolarHBondContact O-N 3.11Å; R573-F576 PolarHBondContact O-N 3.29Å; R573-F576 VanDerWaalsContact O-N 3.16Å; R573-G577 PolarHBondContact O-N 3.24Å; R573-D582 IonicContact CZ-OD1 2.94Å; R573-D582 IonicContact NH2-OD1 3.98Å; R573-D582 PolarHBondContact NH2-OD1 3.07Å; R573-T585 HydrophobicContact CG-CG2 4.44Å; R573-E586 IonicContact NH2-OE1 3.26Å; R573-N688 PolarHBondContact NE-O 3.47Å; R573-N688 VanDerWaalsContact NE-O 3.08Å; R573-N688 PolarHBondContact NH1-O 2.98Å; R573-N688 PolarHBondContact NH2-O 3.3Å
574	Q	87	Confident	84.6	Confident	90 Å²	90	68.2 Å²	68.2	42%	0.421	33%	0.331	S	S	.	.	H	α-helix	trans	-63.7	-24.7	176.3	-76.8	-176.7	-7.7	0	0	113.1	R570 I571 F576 G577 I690 S693	R570-Q574 WeakPolarHBondContact O-CG 3.46Å; R570-Q574 PolarHBondContact O-N 2.94Å; I571-Q574 WeakPolarHBondContact O-CB 3.08Å; I571-Q574 PolarHBondContact O-N 3.29Å; I571-Q574 VanDerWaalsContact O-N 3.07Å; Q574-F576 PolarHBondContact O-N 3.4Å; Q574-G577 PolarHBondContact O-N 3.44Å; Q574-I690 HydrophobicContact CG-CD1 4.08Å; Q574-S693 PolarHBondContact NE2-OG 2.97Å
575	T	90.3	Very high	86.2	Confident	97 Å²	97	57.9 Å²	57.9	60%	0.595	29%	0.29	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.2	-31.9	172.3	-50.9	0	0	0	0	113.1	I571 R572 R573	I571-T575 PolarHBondContact O-N 3.3Å; I571-T575 PolarHBondContact O-OG1 3.03Å; R572-T575 VanDerWaalsContact O-CB 3.28Å; R572-T575 WeakPolarHBondContact O-CB 3.29Å; R572-T575 PolarHBondContact O-N 3.26Å; R572-T575 PolarHBondContact O-OG1 3.46Å; R573-T575 PolarHBondContact O-N 3.11Å
576	F	93.5	Very high	87.6	Confident	18 Å²	18	53 Å²	53	8%	0.079	27%	0.27	C	S	.	.	T	Hydrogen-bonded Turn	trans	-104.1	2.1	176.7	-51.5	-76.1	0	0	0	112.3	F559 R573 Q574 C578 T585 N588 A589 A592 W608 V612 L614	F559-F576 AromaticContact CE1-CD2 3.83Å; F559-F576 HydrophobicContact CE1-CD2 3.83Å; F559-F576 HydrophobicContact CE1-CE2 4.49Å; R573-F576 PolarHBondContact O-N 3.29Å; R573-F576 VanDerWaalsContact O-N 3.16Å; Q574-F576 PolarHBondContact O-N 3.4Å; F576-C578 PolarHBondContact O-N 2.81Å; F576-T585 HydrophobicContact CB-CG2 4.37Å; F576-T585 WeakPolarHBondContact O-CA 3.43Å; F576-N588 HydrophobicContact CB-CB 4.36Å; F576-N588 PolarHBondContact O-ND2 3.45Å; F576-A589 HydrophobicContact CB-CB 4.11Å; F576-A589 HydrophobicContact CD1-CB 4.09Å; F576-A589 HydrophobicContact CD2-CB 4.25Å; F576-A589 HydrophobicContact CG-CB 3.87Å; F576-A592 HydrophobicContact CD1-CB 4.21Å; F576-A592 HydrophobicContact CE1-CB 3.75Å; F576-W608 HydrophobicContact CZ-CH2 4.5Å; F576-W608 HydrophobicContact CZ-CZ2 4.46Å; F576-V612 HydrophobicContact CE2-CB 4.1Å; F576-V612 HydrophobicContact CE2-CG2 4.43Å; F576-V612 HydrophobicContact CZ-CB 3.93Å; F576-V612 HydrophobicContact CZ-CG1 4.42Å; F576-V612 HydrophobicContact CZ-CG2 4.05Å; F576-L614 HydrophobicContact CD2-CD2 4.42Å; F576-L614 HydrophobicContact CE1-CD1 4.48Å; F576-L614 HydrophobicContact CE2-CD1 4.18Å; F576-L614 HydrophobicContact CE2-CD2 3.98Å; F576-L614 HydrophobicContact CE2-CG 4.12Å; F576-L614 HydrophobicContact CZ-CD1 3.83Å; F576-L614 HydrophobicContact CZ-CD2 4.45Å; F576-L614 HydrophobicContact CZ-CG 4.25Å
577	G	90.2	Very high	88.7	Confident	34 Å²	34	47.6 Å²	47.6	35%	0.351	25%	0.245	S	C	.	.			trans	-61.4	131.2	-167.4	0	0	0	0	0	112.7	R573 Q574	R573-G577 PolarHBondContact O-N 3.24Å; Q574-G577 PolarHBondContact O-N 3.44Å
578	C	90.5	Very high	89.6	Confident	19 Å²	19	46.4 Å²	46.4	13%	0.128	24%	0.235	C	C	.	.			trans	-117.5	127	173.2	-168.5	0	0	0	0	108.5	F576 Q580 G581 L584 T585	F576-C578 PolarHBondContact O-N 2.81Å; C578-Q580 PolarHBondContact O-N 3.25Å; C578-Q580 PolarHBondContact SG-OE1 3.16Å; C578-G581 PolarHBondContact O-N 3.35Å; C578-L584 HydrophobicContact CB-CB 3.82Å; C578-L584 VanDerWaalsContact SG-CB 3.59Å; C578-T585 PolarHBondContact N-OG1 3.27Å
579	Q	88.6	Confident	90.5	Very high	150 Å²	150	44.6 Å²	44.6	70%	0.701	22%	0.223	S	C	*	.	T	Hydrogen-bonded Turn	trans	-63.8	-22.5	-179.6	-68.1	-170.8	1	0	0	112.2	G581 L691	Q579-G581 PolarHBondContact O-N 2.75Å; Q579-L691 WeakPolarHBondContact O-CD2 3.32Å
580	Q	91.9	Very high	91.4	Very high	75 Å²	75	43.9 Å²	43.9	35%	0.35	22%	0.219	S	C	.	.	T	Hydrogen-bonded Turn	trans	-76.5	-5	176.3	-65.2	84.2	-15.4	0	0	113.2	C578 L584 L653 S739 V740	C578-Q580 PolarHBondContact O-N 3.25Å; C578-Q580 PolarHBondContact SG-OE1 3.16Å; Q580-L584 HydrophobicContact CB-CD1 3.48Å; Q580-L584 VanDerWaalsContact CB-CD1 3.48Å; Q580-L584 HydrophobicContact CG-CD1 4.34Å; Q580-L653 HydrophobicContact CB-CD1 4.2Å; Q580-L653 HydrophobicContact CG-CD1 4.36Å; Q580-S739 WeakPolarHBondContact O-CA 3.48Å; Q580-V740 PolarHBondContact O-N 3.35Å
581	G	93.3	Very high	92.2	Very high	0 Å²	0	40.7 Å²	40.7	0%	0	21%	0.214	C	C	.	.	B	Isolated β-bridge	trans	128.8	-176.2	165.5	0	0	0	0	0	116.5	C578 Q579 T585 V738	C578-G581 PolarHBondContact O-N 3.35Å; Q579-G581 PolarHBondContact O-N 2.75Å; G581-T585 WeakPolarHBondContact O-CB 3.47Å; G581-T585 PolarHBondContact O-N 2.82Å; G581-T585 VanDerWaalsContact O-N 3.08Å; G581-T585 PolarHBondContact O-OG1 3.31Å; G581-V738 CarbonylContact C-O 3.53Å; G581-V738 WeakPolarHBondContact CA-O 3.39Å
582	D	93.9	Very high	92.8	Very high	1 Å²	1	37.3 Å²	37.3	1%	0.005	20%	0.2	C	C	.	.	H	α-helix	trans	-64.2	-44.8	-176.7	-70.1	-36.7	0	0	0	112.3	R573 L584 T585 E586 C689 I690 G737 V738	R573-D582 IonicContact CZ-OD1 2.94Å; R573-D582 IonicContact NH2-OD1 3.98Å; R573-D582 PolarHBondContact NH2-OD1 3.07Å; D582-L584 VanDerWaalsContact C-N 3.29Å; D582-L584 PolarHBondContact O-N 2.88Å; D582-T585 CarbonylContact O-C 3.48Å; D582-T585 WeakPolarHBondContact O-CA 3.39Å; D582-T585 WeakPolarHBondContact O-CB 3.47Å; D582-T585 PolarHBondContact O-N 2.77Å; D582-T585 VanDerWaalsContact O-N 3.08Å; D582-E586 WeakPolarHBondContact O-CB 3.47Å; D582-E586 VanDerWaalsContact O-CG 3.28Å; D582-E586 WeakPolarHBondContact O-CG 3.38Å; D582-E586 PolarHBondContact O-N 3.05Å; D582-C689 WeakPolarHBondContact OD1-CA 3.38Å; D582-C689 PolarHBondContact OD2-SG 3.28Å; D582-I690 PolarHBondContact OD1-N 3.34Å; D582-G737 PolarHBondContact OD2-N 3.05Å; D582-V738 PolarHBondContact N-O 3.39Å; D582-V738 PolarHBondContact OD2-N 3.22Å; D582-V738 VanDerWaalsContact OD2-N 3.12Å
583	H	95.7	Very high	93.4	Very high	2 Å²	2	35.5 Å²	35.5	1%	0.009	19%	0.193	C	C	.	.	H	α-helix	trans	-60	-40.5	-176.9	-60.1	117.6	0	0	0	112.3	I549 L587 I656 T705 G737 S739	I549-H583 HydrophobicContact CD1-CB 4.32Å; I549-H583 HydrophobicContact CG2-CB 4.28Å; H583-L587 WeakPolarHBondContact O-CB 3.39Å; H583-L587 PolarHBondContact O-N 2.98Å; H583-I656 HydrophobicContact CB-CD1 3.94Å; H583-T705 VanDerWaalsContact NE2-CG2 3.28Å; H583-T705 WeakPolarHBondContact NE2-CG2 3.43Å; H583-T705 PolarHBondContact NE2-OG1 2.92Å; H583-G737 VanDerWaalsContact CE1-C 3.49Å; H583-G737 PolarHBondContact CE1-O 3.08Å; H583-G737 PolarHBondContact NE2-O 2.99Å; H583-S739 PolarHBondContact ND1-OG 3.36Å
584	L	96	Very high	93.9	Very high	9 Å²	9	35.8 Å²	35.8	5%	0.047	20%	0.196	C	C	.	.	H	α-helix	trans	-74.7	-34.4	176.4	-68.2	171.9	0	0	0	111.9	C578 Q580 D582 E586 L587 N588 P649 V652 L653	C578-L584 HydrophobicContact CB-CB 3.82Å; C578-L584 VanDerWaalsContact SG-CB 3.59Å; Q580-L584 HydrophobicContact CB-CD1 3.48Å; Q580-L584 VanDerWaalsContact CB-CD1 3.48Å; Q580-L584 HydrophobicContact CG-CD1 4.34Å; D582-L584 VanDerWaalsContact C-N 3.29Å; D582-L584 PolarHBondContact O-N 2.88Å; L584-E586 VanDerWaalsContact C-N 3.31Å; L584-E586 PolarHBondContact O-N 2.93Å; L584-L587 HydrophobicContact CD2-CD2 4.25Å; L584-L587 PolarHBondContact O-N 3.01Å; L584-N588 WeakPolarHBondContact O-CB 3.37Å; L584-N588 PolarHBondContact O-N 3.02Å; L584-N588 PolarHBondContact O-ND2 2.95Å; L584-N588 PolarHBondContact O-OD1 3.3Å; L584-P649 HydrophobicContact CD1-CB 3.62Å; L584-P649 HydrophobicContact CD2-CB 4.5Å; L584-V652 HydrophobicContact CD2-CB 4.21Å; L584-V652 HydrophobicContact CD2-CG1 3.91Å; L584-L653 HydrophobicContact CD1-CD1 4.15Å; L584-L653 HydrophobicContact CD1-CD2 3.84Å; L584-L653 HydrophobicContact CD1-CG 3.98Å; L584-L653 HydrophobicContact CG-CD2 4.37Å
585	T	94.9	Very high	94.3	Very high	0 Å²	0	35.3 Å²	35.3	0%	0	20%	0.197	C	C	.	.	H	α-helix	trans	-60.9	-42.7	171.9	-60.3	0	0	0	0	111.4	F559 R573 F576 C578 G581 D582 N588 A589	F559-T585 HydrophobicContact CE2-CG2 4.37Å; F559-T585 HydrophobicContact CZ-CG2 4Å; R573-T585 HydrophobicContact CG-CG2 4.44Å; F576-T585 HydrophobicContact CB-CG2 4.37Å; F576-T585 WeakPolarHBondContact O-CA 3.43Å; C578-T585 PolarHBondContact N-OG1 3.27Å; G581-T585 WeakPolarHBondContact O-CB 3.47Å; G581-T585 PolarHBondContact O-N 2.82Å; G581-T585 VanDerWaalsContact O-N 3.08Å; G581-T585 PolarHBondContact O-OG1 3.31Å; D582-T585 CarbonylContact O-C 3.48Å; D582-T585 WeakPolarHBondContact O-CA 3.39Å; D582-T585 WeakPolarHBondContact O-CB 3.47Å; D582-T585 PolarHBondContact O-N 2.77Å; D582-T585 VanDerWaalsContact O-N 3.08Å; T585-N588 PolarHBondContact O-N 2.85Å; T585-A589 PolarHBondContact O-N 2.94Å; T585-A589 VanDerWaalsContact O-N 3.11Å
586	E	95.3	Very high	94.6	Very high	29 Å²	29	33.5 Å²	33.5	14%	0.136	18%	0.181	C	C	.	.	H	α-helix	trans	-69.9	-39.6	177.8	-72.7	177	-177	0	0	111.6	L552 I558 F559 R573 D582 L584 A589 F590	L552-E586 HydrophobicContact CD1-CB 4.17Å; I558-E586 HydrophobicContact CD1-CB 3.65Å; I558-E586 HydrophobicContact CD1-CG 3.48Å; I558-E586 VanDerWaalsContact CD1-CG 3.48Å; F559-E586 HydrophobicContact CE2-CG 4.02Å; R573-E586 IonicContact NH2-OE1 3.26Å; D582-E586 WeakPolarHBondContact O-CB 3.47Å; D582-E586 VanDerWaalsContact O-CG 3.28Å; D582-E586 WeakPolarHBondContact O-CG 3.38Å; D582-E586 PolarHBondContact O-N 3.05Å; L584-E586 VanDerWaalsContact C-N 3.31Å; L584-E586 PolarHBondContact O-N 2.93Å; E586-A589 PolarHBondContact O-N 3.44Å; E586-F590 WeakPolarHBondContact O-CB 3.38Å; E586-F590 PolarHBondContact O-N 3.38Å
587	L	96.2	Very high	94.7	Very high	14 Å²	14	34.9 Å²	34.9	7%	0.073	19%	0.193	C	C	.	.	H	α-helix	trans	-61.2	-44.3	172.5	-178.3	63.2	0	0	0	111.6	E545 A548 I549 H583 L584 A589 F590 V591	E545-L587 HydrophobicContact CB-CD1 4.5Å; E545-L587 HydrophobicContact CB-CD2 3.86Å; E545-L587 HydrophobicContact CG-CD2 4.03Å; A548-L587 HydrophobicContact CB-CD1 3.74Å; I549-L587 HydrophobicContact CD1-CD2 4.25Å; I549-L587 HydrophobicContact CG1-CB 4.23Å; I549-L587 HydrophobicContact CG1-CD1 4.43Å; H583-L587 WeakPolarHBondContact O-CB 3.39Å; H583-L587 PolarHBondContact O-N 2.98Å; L584-L587 HydrophobicContact CD2-CD2 4.25Å; L584-L587 PolarHBondContact O-N 3.01Å; L587-A589 VanDerWaalsContact C-N 3.35Å; L587-A589 PolarHBondContact O-N 3.11Å; L587-F590 WeakPolarHBondContact O-CB 3.32Å; L587-F590 PolarHBondContact O-N 3.42Å; L587-F590 VanDerWaalsContact O-N 3.17Å; L587-V591 HydrophobicContact CD1-CG2 4.35Å; L587-V591 WeakPolarHBondContact O-CG2 3.37Å; L587-V591 PolarHBondContact O-N 3.14Å
588	N	96.2	Very high	95	Very high	72 Å²	72	40.3 Å²	40.3	39%	0.385	21%	0.207	S	C	.	.	H	α-helix	trans	-60.2	-44.6	176.3	-73.2	-13.7	0	0	0	111.7	F576 L584 T585 F590 V591 A592	F576-N588 HydrophobicContact CB-CB 4.36Å; F576-N588 PolarHBondContact O-ND2 3.45Å; L584-N588 WeakPolarHBondContact O-CB 3.37Å; L584-N588 PolarHBondContact O-N 3.02Å; L584-N588 PolarHBondContact O-ND2 2.95Å; L584-N588 PolarHBondContact O-OD1 3.3Å; T585-N588 PolarHBondContact O-N 2.85Å; N588-F590 VanDerWaalsContact C-N 3.3Å; N588-F590 PolarHBondContact O-N 2.79Å; N588-V591 PolarHBondContact O-N 3.18Å; N588-A592 VanDerWaalsContact O-CB 3.3Å; N588-A592 WeakPolarHBondContact O-CB 3.32Å; N588-A592 PolarHBondContact O-N 3.26Å
589	A	95.7	Very high	95.2	Very high	0 Å²	0	45.9 Å²	45.9	0%	0	24%	0.235	C	C	.	.	H	α-helix	trans	-61.7	-39.5	175.6	0	0	0	0	0	112	I558 F559 F576 T585 E586 L587 Y593 L614	I558-A589 HydrophobicContact CG2-CB 4.36Å; F559-A589 HydrophobicContact CE1-CB 4.16Å; F559-A589 HydrophobicContact CZ-CB 4.01Å; F576-A589 HydrophobicContact CB-CB 4.11Å; F576-A589 HydrophobicContact CD1-CB 4.09Å; F576-A589 HydrophobicContact CD2-CB 4.25Å; F576-A589 HydrophobicContact CG-CB 3.87Å; T585-A589 PolarHBondContact O-N 2.94Å; T585-A589 VanDerWaalsContact O-N 3.11Å; E586-A589 PolarHBondContact O-N 3.44Å; L587-A589 VanDerWaalsContact C-N 3.35Å; L587-A589 PolarHBondContact O-N 3.11Å; A589-Y593 WeakPolarHBondContact O-CB 3.38Å; A589-Y593 PolarHBondContact O-N 2.83Å; A589-L614 HydrophobicContact CB-CD2 3.91Å
590	F	96.7	Very high	95.6	Very high	2 Å²	2	41.3 Å²	41.3	1%	0.009	22%	0.215	C	C	.	.	H	α-helix	trans	-65.6	-47.4	176.7	174.9	-92.3	0	0	0	112.6	A548 L552 E586 L587 N588 A592 Y593 E594 L619 A622 V623 R626	A548-F590 HydrophobicContact CB-CD1 3.89Å; A548-F590 HydrophobicContact CB-CE1 3.75Å; A548-F590 HydrophobicContact CB-CZ 4.35Å; L552-F590 HydrophobicContact CD1-CB 3.82Å; L552-F590 HydrophobicContact CD1-CG 4.26Å; L552-F590 HydrophobicContact CD2-CB 4.17Å; L552-F590 HydrophobicContact CD2-CD2 3.97Å; L552-F590 HydrophobicContact CD2-CG 4.39Å; L552-F590 HydrophobicContact CG-CB 4.49Å; L552-F590 HydrophobicContact CG-CD2 4.45Å; E586-F590 WeakPolarHBondContact O-CB 3.38Å; E586-F590 PolarHBondContact O-N 3.38Å; L587-F590 WeakPolarHBondContact O-CB 3.32Å; L587-F590 PolarHBondContact O-N 3.42Å; L587-F590 VanDerWaalsContact O-N 3.17Å; N588-F590 VanDerWaalsContact C-N 3.3Å; N588-F590 PolarHBondContact O-N 2.79Å; F590-A592 VanDerWaalsContact C-N 3.35Å; F590-A592 PolarHBondContact O-N 2.74Å; F590-Y593 PolarHBondContact O-N 3.11Å; F590-E594 WeakPolarHBondContact O-CB 3.33Å; F590-E594 PolarHBondContact O-N 3.35Å; F590-L619 HydrophobicContact CB-CD2 4.22Å; F590-L619 HydrophobicContact CD2-CD2 4.05Å; F590-A622 HydrophobicContact CD2-CB 3.9Å; F590-A622 HydrophobicContact CE2-CB 3.68Å; F590-V623 HydrophobicContact CE2-CB 4.44Å; F590-V623 HydrophobicContact CE2-CG2 3.59Å; F590-V623 HydrophobicContact CZ-CG2 3.82Å; F590-R626 VanDerWaalsContact CE1-NH1 3.33Å; F590-R626 HydrophobicContact CZ-CB 4.49Å; F590-R626 HydrophobicContact CZ-CG 4.43Å
591	V	95.9	Very high	95.8	Very high	63 Å²	63	40.4 Å²	40.4	38%	0.382	22%	0.217	S	C	.	.	H	α-helix	trans	-63	-42.8	177.2	172.5	0	0	0	0	110.8	L587 N588 Y593 E594 N595	L587-V591 HydrophobicContact CD1-CG2 4.35Å; L587-V591 WeakPolarHBondContact O-CG2 3.37Å; L587-V591 PolarHBondContact O-N 3.14Å; N588-V591 PolarHBondContact O-N 3.18Å; V591-Y593 PolarHBondContact O-N 2.89Å; V591-E594 PolarHBondContact O-N 2.93Å; V591-N595 VanDerWaalsContact O-CG 3.31Å; V591-N595 PolarHBondContact O-N 3.24Å; V591-N595 PolarHBondContact O-ND2 3.21Å
592	A	96.3	Very high	95.7	Very high	27 Å²	27	47.6 Å²	47.6	22%	0.223	25%	0.248	C	C	.	.	H	α-helix	trans	-59.9	-45.7	175.6	0	0	0	0	0	111.5	F576 N588 F590 N595 Q596 W608	F576-A592 HydrophobicContact CD1-CB 4.21Å; F576-A592 HydrophobicContact CE1-CB 3.75Å; N588-A592 VanDerWaalsContact O-CB 3.3Å; N588-A592 WeakPolarHBondContact O-CB 3.32Å; N588-A592 PolarHBondContact O-N 3.26Å; F590-A592 VanDerWaalsContact C-N 3.35Å; F590-A592 PolarHBondContact O-N 2.74Å; A592-N595 PolarHBondContact O-N 3.15Å; A592-Q596 VanDerWaalsContact O-CG 3.32Å; A592-Q596 WeakPolarHBondContact O-CG 3.28Å; A592-Q596 PolarHBondContact O-N 2.82Å; A592-W608 HydrophobicContact CB-CH2 4.24Å
593	Y	97.1	Very high	95.7	Very high	11 Å²	11	51.1 Å²	51.1	4%	0.043	27%	0.273	C	S	.	.	H	α-helix	trans	-61	-46	175.2	170.7	-94	0	0	0	112.4	A589 F590 V591 N595 Q596 S597 L605 W608 E616 L619 V623	A589-Y593 WeakPolarHBondContact O-CB 3.38Å; A589-Y593 PolarHBondContact O-N 2.83Å; F590-Y593 PolarHBondContact O-N 3.11Å; V591-Y593 PolarHBondContact O-N 2.89Å; Y593-N595 VanDerWaalsContact C-N 3.31Å; Y593-N595 PolarHBondContact O-N 3Å; Y593-Q596 PolarHBondContact O-N 2.91Å; Y593-S597 WeakPolarHBondContact O-CB 3.47Å; Y593-S597 PolarHBondContact O-N 2.86Å; Y593-L605 HydrophobicContact CD2-CD1 4.25Å; Y593-L605 HydrophobicContact CE2-CD1 4.09Å; Y593-L605 HydrophobicContact CE2-CD2 3.9Å; Y593-L605 HydrophobicContact CE2-CG 4.13Å; Y593-W608 HydrophobicContact CD2-CZ3 4.25Å; Y593-E616 HydrophobicContact CE2-CB 4.45Å; Y593-E616 HydrophobicContact CE2-CG 4Å; Y593-L619 HydrophobicContact CD1-CB 3.62Å; Y593-L619 HydrophobicContact CD1-CD1 4.43Å; Y593-L619 HydrophobicContact CD2-CB 4.07Å; Y593-L619 HydrophobicContact CD2-CD1 3.88Å; Y593-L619 HydrophobicContact CE1-CB 3.74Å; Y593-L619 HydrophobicContact CE2-CB 4.19Å; Y593-L619 HydrophobicContact CG-CB 3.79Å; Y593-L619 HydrophobicContact CG-CD1 3.77Å; Y593-L619 HydrophobicContact CG-CG 4.31Å; Y593-V623 HydrophobicContact CE1-CG2 4.3Å
594	E	95.9	Very high	95.7	Very high	38 Å²	38	56 Å²	56	18%	0.178	30%	0.296	C	S	.	.	H	α-helix	trans	-60.4	-43	-180	-179.2	166.1	-135.3	0	0	111.4	F590 V591 S597 K598 R626	F590-E594 WeakPolarHBondContact O-CB 3.33Å; F590-E594 PolarHBondContact O-N 3.35Å; V591-E594 PolarHBondContact O-N 2.93Å; E594-S597 PolarHBondContact O-N 2.8Å; E594-S597 PolarHBondContact O-OG 3.41Å; E594-K598 WeakPolarHBondContact O-CG 3.42Å; E594-K598 PolarHBondContact O-N 3.25Å; E594-R626 VanDerWaalsContact CD-NH1 3.28Å; E594-R626 IonicContact OE1-CZ 3.71Å; E594-R626 VanDerWaalsContact OE1-CZ 3.26Å; E594-R626 IonicContact OE1-NH1 3.26Å; E594-R626 PolarHBondContact OE1-NH1 3.19Å; E594-R626 IonicContact OE1-NH2 3.86Å; E594-R626 PolarHBondContact OE1-NH2 3.32Å; E594-R626 IonicContact OE2-CZ 2.84Å; E594-R626 IonicContact OE2-NH1 3.6Å; E594-R626 PolarHBondContact OE2-NH1 3.39Å
595	N	96.3	Very high	95.7	Very high	81 Å²	81	56.2 Å²	56.2	43%	0.433	30%	0.297	S	S	.	.	H	α-helix	trans	-63.1	-45.3	175.9	-70.7	-19.8	0	0	0	111.8	V591 A592 Y593 S597 K598 L599	V591-N595 VanDerWaalsContact O-CG 3.31Å; V591-N595 PolarHBondContact O-N 3.24Å; V591-N595 PolarHBondContact O-ND2 3.21Å; A592-N595 PolarHBondContact O-N 3.15Å; Y593-N595 VanDerWaalsContact C-N 3.31Å; Y593-N595 PolarHBondContact O-N 3Å; N595-S597 VanDerWaalsContact C-N 3.34Å; N595-S597 PolarHBondContact O-N 3.47Å; N595-K598 PolarHBondContact O-N 2.79Å; N595-L599 WeakPolarHBondContact O-CG 3.3Å
596	Q	96.9	Very high	95.6	Very high	59 Å²	59	62.2 Å²	62.2	28%	0.276	32%	0.319	S	S	.	.	H	α-helix	trans	-67.6	-33.5	178.1	-67	-58.7	-30.3	0	0	112.9	A592 Y593 K598 L599 L600 L605 W608	A592-Q596 VanDerWaalsContact O-CG 3.32Å; A592-Q596 WeakPolarHBondContact O-CG 3.28Å; A592-Q596 PolarHBondContact O-N 2.82Å; Y593-Q596 PolarHBondContact O-N 2.91Å; Q596-K598 PolarHBondContact O-N 3.37Å; Q596-L599 PolarHBondContact O-N 2.9Å; Q596-L599 VanDerWaalsContact O-N 3.1Å; Q596-L600 HydrophobicContact CB-CD1 4.17Å; Q596-L600 WeakPolarHBondContact O-CB 3.35Å; Q596-L600 PolarHBondContact O-N 2.91Å; Q596-L605 HydrophobicContact CB-CD1 3.95Å; Q596-W608 HydrophobicContact CB-CD2 4.36Å; Q596-W608 HydrophobicContact CB-CE3 4.17Å; Q596-W608 HydrophobicContact CB-CH2 4.46Å; Q596-W608 HydrophobicContact CB-CZ3 4.22Å; Q596-W608 HydrophobicContact CG-CD2 4.07Å; Q596-W608 HydrophobicContact CG-CE3 4.25Å; Q596-W608 HydrophobicContact CG-CH2 4Å; Q596-W608 HydrophobicContact CG-CZ2 3.79Å; Q596-W608 HydrophobicContact CG-CZ3 4.23Å
597	S	95.2	Very high	95.6	Very high	47 Å²	47	63.6 Å²	63.6	33%	0.329	33%	0.33	S	S	.	.	H	α-helix	trans	-64.4	-23.7	178.9	75.9	0	0	0	0	113.5	Y593 E594 N595	Y593-S597 WeakPolarHBondContact O-CB 3.47Å; Y593-S597 PolarHBondContact O-N 2.86Å; E594-S597 PolarHBondContact O-N 2.8Å; E594-S597 PolarHBondContact O-OG 3.41Å; N595-S597 VanDerWaalsContact C-N 3.34Å; N595-S597 PolarHBondContact O-N 3.47Å
598	K	95.8	Very high	95.5	Very high	148 Å²	148	65.1 Å²	65.1	64%	0.643	34%	0.335	S	S	*	.	H	α-helix	trans	-84	-23.9	175.7	-65.8	169.6	-174.9	170.7	0	112.9	E594 N595 Q596	E594-K598 WeakPolarHBondContact O-CG 3.42Å; E594-K598 PolarHBondContact O-N 3.25Å; N595-K598 PolarHBondContact O-N 2.79Å; Q596-K598 PolarHBondContact O-N 3.37Å
599	L	96.3	Very high	95.4	Very high	135 Å²	135	61.8 Å²	61.8	71%	0.707	32%	0.317	S	S	*	.	H	α-helix	trans	-99.5	-37.1	-173.2	-64.1	173.2	0	0	0	113	N595 Q596	N595-L599 WeakPolarHBondContact O-CG 3.3Å; Q596-L599 PolarHBondContact O-N 2.9Å; Q596-L599 VanDerWaalsContact O-N 3.1Å
600	L	96	Very high	95.1	Very high	54 Å²	54	70.5 Å²	70.5	28%	0.283	35%	0.35	S	S	.	.	S	Bend	trans	-98.2	151.1	-171	-61.3	-179.9	0	0	0	112.3	Q596 E604 L605 W608	Q596-L600 HydrophobicContact CB-CD1 4.17Å; Q596-L600 WeakPolarHBondContact O-CB 3.35Å; Q596-L600 PolarHBondContact O-N 2.91Å; L600-E604 HydrophobicContact CB-CB 4Å; L600-E604 HydrophobicContact CD1-CB 4.48Å; L600-E604 HydrophobicContact CD2-CB 4.31Å; L600-L605 HydrophobicContact CB-CB 4.29Å; L600-W608 HydrophobicContact CD1-CB 4.04Å; L600-W608 HydrophobicContact CD1-CG 4.35Å
601	S	95.6	Very high	94.8	Very high	56 Å²	56	76.7 Å²	76.7	39%	0.392	38%	0.379	S	S	.	.			trans	-65.5	160.9	166.3	73	0	0	0	0	111.3	S603 E604 L605	S601-S603 PolarHBondContact O-N 3.47Å; S601-S603 VanDerWaalsContact O-N 3.08Å; S601-E604 WeakPolarHBondContact CB-OE2 3.28Å; S601-E604 PolarHBondContact N-OE2 2.86Å; S601-E604 PolarHBondContact O-N 3.36Å; S601-E604 VanDerWaalsContact O-N 3.14Å; S601-E604 VanDerWaalsContact OG-CD 3.25Å; S601-E604 WeakPolarHBondContact OG-CG 3.45Å; S601-E604 PolarHBondContact OG-N 2.69Å; S601-E604 PolarHBondContact OG-OE2 3.31Å; S601-L605 WeakPolarHBondContact O-CB 3.23Å; S601-L605 PolarHBondContact O-N 3.1Å
602	K	92	Very high	94.6	Very high	151 Å²	151	75 Å²	75	66%	0.657	37%	0.368	S	S	*	.	H	α-helix	trans	-60.4	-22.6	179.1	-165.6	173	-175.3	173.5	0	113.9	R606	K602-R606 WeakPolarHBondContact O-CG 3.45Å; K602-R606 PolarHBondContact O-NE 2.88Å
603	S	93.7	Very high	94.3	Very high	75 Å²	75	73.8 Å²	73.8	52%	0.524	36%	0.359	S	S	.	.	H	α-helix	trans	-77.5	-50.9	174.4	-170.5	0	0	0	0	110.6	S601 L605 R606 T607	S601-S603 PolarHBondContact O-N 3.47Å; S601-S603 VanDerWaalsContact O-N 3.08Å; S603-L605 PolarHBondContact O-N 3.01Å; S603-R606 PolarHBondContact O-N 3.44Å; S603-T607 PolarHBondContact O-N 3.07Å; S603-T607 VanDerWaalsContact O-N 3.09Å; S603-T607 PolarHBondContact O-OG1 3.12Å
604	E	96.7	Very high	94.1	Very high	106 Å²	106	73.5 Å²	73.5	50%	0.495	36%	0.358	S	S	.	.	H	α-helix	trans	-62.4	-42.2	179.9	-68.6	161.3	143.9	0	0	111.7	L600 S601 R606 T607 W608	L600-E604 HydrophobicContact CB-CB 4Å; L600-E604 HydrophobicContact CD1-CB 4.48Å; L600-E604 HydrophobicContact CD2-CB 4.31Å; S601-E604 WeakPolarHBondContact CB-OE2 3.28Å; S601-E604 PolarHBondContact N-OE2 2.86Å; S601-E604 PolarHBondContact O-N 3.36Å; S601-E604 VanDerWaalsContact O-N 3.14Å; S601-E604 VanDerWaalsContact OG-CD 3.25Å; S601-E604 WeakPolarHBondContact OG-CG 3.45Å; S601-E604 PolarHBondContact OG-N 2.69Å; S601-E604 PolarHBondContact OG-OE2 3.31Å; E604-R606 VanDerWaalsContact C-N 3.28Å; E604-R606 PolarHBondContact O-N 2.84Å; E604-T607 WeakPolarHBondContact O-CB 3.32Å; E604-T607 PolarHBondContact O-N 3.11Å; E604-W608 PolarHBondContact O-N 3.23Å
605	L	95	Very high	93.8	Very high	12 Å²	12	74.2 Å²	74.2	6%	0.063	36%	0.363	C	S	.	.	H	α-helix	trans	-58.6	-40.2	176.1	-176	65.9	0	0	0	112	Y593 Q596 L600 S601 S603 T607 W608 C609	Y593-L605 HydrophobicContact CD2-CD1 4.25Å; Y593-L605 HydrophobicContact CE2-CD1 4.09Å; Y593-L605 HydrophobicContact CE2-CD2 3.9Å; Y593-L605 HydrophobicContact CE2-CG 4.13Å; Q596-L605 HydrophobicContact CB-CD1 3.95Å; L600-L605 HydrophobicContact CB-CB 4.29Å; S601-L605 WeakPolarHBondContact O-CB 3.23Å; S601-L605 PolarHBondContact O-N 3.1Å; S603-L605 PolarHBondContact O-N 3.01Å; L605-T607 VanDerWaalsContact C-N 3.34Å; L605-W608 HydrophobicContact CD1-CE3 4.18Å; L605-W608 PolarHBondContact O-N 3.23Å; L605-C609 WeakPolarHBondContact O-CB 3.4Å; L605-C609 PolarHBondContact O-N 3.28Å; L605-C609 PolarHBondContact O-SG 2.92Å
606	R	92.7	Very high	93.5	Very high	126 Å²	126	72.1 Å²	72.1	48%	0.475	35%	0.351	S	S	.	.	H	α-helix	trans	-68.7	-33.8	176.8	-81.2	-175.2	-75.2	178	-2.6	112.2	K602 S603 E604 R610 E616	K602-R606 WeakPolarHBondContact O-CG 3.45Å; K602-R606 PolarHBondContact O-NE 2.88Å; S603-R606 PolarHBondContact O-N 3.44Å; E604-R606 VanDerWaalsContact C-N 3.28Å; E604-R606 PolarHBondContact O-N 2.84Å; R606-R610 WeakPolarHBondContact O-CB 3.44Å; R606-R610 PolarHBondContact O-N 3.2Å; R606-E616 HydrophobicContact CG-CG 4.25Å
607	T	95.2	Very high	92.8	Very high	58 Å²	58	74.8 Å²	74.8	36%	0.356	36%	0.358	S	S	.	.	H	α-helix	trans	-68.6	-50.4	173.6	-58.3	0	0	0	0	110.3	S603 E604 L605 C609 R610 E611	S603-T607 PolarHBondContact O-N 3.07Å; S603-T607 VanDerWaalsContact O-N 3.09Å; S603-T607 PolarHBondContact O-OG1 3.12Å; E604-T607 WeakPolarHBondContact O-CB 3.32Å; E604-T607 PolarHBondContact O-N 3.11Å; L605-T607 VanDerWaalsContact C-N 3.34Å; T607-C609 PolarHBondContact O-N 3.09Å; T607-R610 WeakPolarHBondContact O-CB 3.43Å; T607-R610 PolarHBondContact O-N 2.88Å; T607-E611 WeakPolarHBondContact O-CG 3.48Å; T607-E611 PolarHBondContact O-N 2.85Å
608	W	95.5	Very high	92.3	Very high	47 Å²	47	72.9 Å²	72.9	18%	0.178	35%	0.346	C	S	.	.	H	α-helix	trans	-55	-51.4	176.7	177.6	80	0	0	0	111.8	F576 A592 Y593 Q596 L600 E604 L605 R610 E611 V612 L614	F576-W608 HydrophobicContact CZ-CH2 4.5Å; F576-W608 HydrophobicContact CZ-CZ2 4.46Å; A592-W608 HydrophobicContact CB-CH2 4.24Å; Y593-W608 HydrophobicContact CD2-CZ3 4.25Å; Q596-W608 HydrophobicContact CB-CD2 4.36Å; Q596-W608 HydrophobicContact CB-CE3 4.17Å; Q596-W608 HydrophobicContact CB-CH2 4.46Å; Q596-W608 HydrophobicContact CB-CZ3 4.22Å; Q596-W608 HydrophobicContact CG-CD2 4.07Å; Q596-W608 HydrophobicContact CG-CE3 4.25Å; Q596-W608 HydrophobicContact CG-CH2 4Å; Q596-W608 HydrophobicContact CG-CZ2 3.79Å; Q596-W608 HydrophobicContact CG-CZ3 4.23Å; L600-W608 HydrophobicContact CD1-CB 4.04Å; L600-W608 HydrophobicContact CD1-CG 4.35Å; E604-W608 PolarHBondContact O-N 3.23Å; L605-W608 HydrophobicContact CD1-CE3 4.18Å; L605-W608 PolarHBondContact O-N 3.23Å; W608-R610 PolarHBondContact O-N 3.48Å; W608-E611 PolarHBondContact O-N 2.72Å; W608-V612 HydrophobicContact CD2-CG2 4.04Å; W608-V612 HydrophobicContact CE3-CG2 4.11Å; W608-V612 HydrophobicContact CH2-CG2 4.01Å; W608-V612 HydrophobicContact CZ2-CG1 4.19Å; W608-V612 HydrophobicContact CZ2-CG2 3.92Å; W608-V612 HydrophobicContact CZ3-CG2 4.1Å; W608-V612 VanDerWaalsContact O-CG2 3.25Å; W608-V612 WeakPolarHBondContact O-CG2 3.17Å; W608-V612 PolarHBondContact O-N 2.95Å; W608-L614 HydrophobicContact CH2-CD1 3.67Å; W608-L614 HydrophobicContact CZ3-CD1 3.73Å
609	C	93.5	Very high	92.2	Very high	2 Å²	2	65.9 Å²	65.9	1%	0.014	32%	0.316	C	S	.	.	H	α-helix	trans	-55.9	-38.4	177.9	-71	0	0	0	0	112	L605 T607 G613 L614 E616	L605-C609 WeakPolarHBondContact O-CB 3.4Å; L605-C609 PolarHBondContact O-N 3.28Å; L605-C609 PolarHBondContact O-SG 2.92Å; T607-C609 PolarHBondContact O-N 3.09Å; C609-G613 CarbonylContact O-C 3.52Å; C609-G613 WeakPolarHBondContact O-CA 3.42Å; C609-G613 PolarHBondContact O-N 3.04Å; C609-L614 HydrophobicContact CB-CB 4.29Å; C609-L614 PolarHBondContact O-N 3.28Å; C609-E616 HydrophobicContact CB-CB 3.98Å
610	R	89.3	Confident	91.9	Very high	182 Å²	182	60.9 Å²	60.9	69%	0.687	29%	0.294	S	S	*	.	H	α-helix	trans	-67.9	-41.9	178.4	-166.3	-170.5	-37.9	-149.3	5.8	111.9	R606 T607 W608 G613	R606-R610 WeakPolarHBondContact O-CB 3.44Å; R606-R610 PolarHBondContact O-N 3.2Å; T607-R610 WeakPolarHBondContact O-CB 3.43Å; T607-R610 PolarHBondContact O-N 2.88Å; W608-R610 PolarHBondContact O-N 3.48Å; R610-G613 PolarHBondContact O-N 2.91Å
611	E	90.3	Very high	91.4	Very high	133 Å²	133	62.2 Å²	62.2	62%	0.621	30%	0.299	S	S	*	.	H	α-helix	trans	-65.2	-44.3	178.3	-70.8	173.2	177.4	0	0	111.7	R572 T607 W608 G613	R572-E611 WeakPolarHBondContact CD-O 3.47Å; T607-E611 WeakPolarHBondContact O-CG 3.48Å; T607-E611 PolarHBondContact O-N 2.85Å; W608-E611 PolarHBondContact O-N 2.72Å; E611-G613 VanDerWaalsContact C-N 3.3Å; E611-G613 PolarHBondContact O-N 3.47Å
612	V	91.9	Very high	91.2	Very high	26 Å²	26	59.6 Å²	59.6	16%	0.158	28%	0.28	C	S	.	.	H	α-helix	trans	-83.9	-3.1	178.1	-61	0	0	0	0	113.8	R572 F576 W608 L614	R572-V612 WeakPolarHBondContact CB-O 3.12Å; F576-V612 HydrophobicContact CE2-CB 4.1Å; F576-V612 HydrophobicContact CE2-CG2 4.43Å; F576-V612 HydrophobicContact CZ-CB 3.93Å; F576-V612 HydrophobicContact CZ-CG1 4.42Å; F576-V612 HydrophobicContact CZ-CG2 4.05Å; W608-V612 HydrophobicContact CD2-CG2 4.04Å; W608-V612 HydrophobicContact CE3-CG2 4.11Å; W608-V612 HydrophobicContact CH2-CG2 4.01Å; W608-V612 HydrophobicContact CZ2-CG1 4.19Å; W608-V612 HydrophobicContact CZ2-CG2 3.92Å; W608-V612 HydrophobicContact CZ3-CG2 4.1Å; W608-V612 VanDerWaalsContact O-CG2 3.25Å; W608-V612 WeakPolarHBondContact O-CG2 3.17Å; W608-V612 PolarHBondContact O-N 2.95Å; V612-L614 HydrophobicContact CG2-CB 4.18Å; V612-L614 HydrophobicContact CG2-CD1 3.7Å; V612-L614 HydrophobicContact CG2-CG 3.65Å
613	G	90.4	Very high	91.3	Very high	2 Å²	2	53.8 Å²	53.8	2%	0.021	26%	0.257	C	S	.	.	T	Hydrogen-bonded Turn	trans	75.4	30	177.1	0	0	0	0	0	115.1	F559 T560 C609 R610 E611	F559-G613 CarbonylContact C-O 3.59Å; F559-G613 WeakPolarHBondContact CA-O 3.41Å; T560-G613 PolarHBondContact N-O 2.97Å; T560-G613 VanDerWaalsContact OG1-CA 3.26Å; T560-G613 WeakPolarHBondContact OG1-CA 3.23Å; T560-G613 PolarHBondContact OG1-O 3Å; C609-G613 CarbonylContact O-C 3.52Å; C609-G613 WeakPolarHBondContact O-CA 3.42Å; C609-G613 PolarHBondContact O-N 3.04Å; R610-G613 PolarHBondContact O-N 2.91Å; E611-G613 VanDerWaalsContact C-N 3.3Å; E611-G613 PolarHBondContact O-N 3.47Å
614	L	92.2	Very high	91.2	Very high	6 Å²	6	54 Å²	54	3%	0.031	25%	0.252	C	S	.	.	B	Isolated β-bridge	trans	-97.9	145.7	177.9	-64.4	-179	0	0	0	113.3	I558 F559 F576 A589 W608 C609 V612 E616 L619	I558-L614 HydrophobicContact CG2-CD2 4.17Å; F559-L614 HydrophobicContact CD1-CD2 3.82Å; F559-L614 HydrophobicContact CE1-CD2 3.73Å; F576-L614 HydrophobicContact CD2-CD2 4.42Å; F576-L614 HydrophobicContact CE1-CD1 4.48Å; F576-L614 HydrophobicContact CE2-CD1 4.18Å; F576-L614 HydrophobicContact CE2-CD2 3.98Å; F576-L614 HydrophobicContact CE2-CG 4.12Å; F576-L614 HydrophobicContact CZ-CD1 3.83Å; F576-L614 HydrophobicContact CZ-CD2 4.45Å; F576-L614 HydrophobicContact CZ-CG 4.25Å; A589-L614 HydrophobicContact CB-CD2 3.91Å; W608-L614 HydrophobicContact CH2-CD1 3.67Å; W608-L614 HydrophobicContact CZ3-CD1 3.73Å; C609-L614 HydrophobicContact CB-CB 4.29Å; C609-L614 PolarHBondContact O-N 3.28Å; V612-L614 HydrophobicContact CG2-CB 4.18Å; V612-L614 HydrophobicContact CG2-CD1 3.7Å; V612-L614 HydrophobicContact CG2-CG 3.65Å; L614-E616 PolarHBondContact O-N 3.36Å; L614-L619 HydrophobicContact CB-CD1 3.86Å; L614-L619 HydrophobicContact CD1-CD1 3.97Å; L614-L619 HydrophobicContact CD2-CD1 4.4Å; L614-L619 HydrophobicContact CG-CD1 4.3Å
615	N	88.6	Confident	90.8	Very high	52 Å²	52	49.3 Å²	49.3	28%	0.278	23%	0.23	S	C	.	.			trans	-84.7	88.4	173	179.8	7	0	0	0	110.3	R557 I558 T560 R617 G618 L619	R557-N615 PolarHBondContact O-ND2 3.26Å; I558-N615 WeakPolarHBondContact O-CB 3.48Å; I558-N615 PolarHBondContact O-N 3Å; T560-N615 HydrophobicContact CG2-CB 4.28Å; N615-R617 VanDerWaalsContact C-N 3.28Å; N615-R617 PolarHBondContact O-N 3.35Å; N615-G618 PolarHBondContact O-N 3.18Å; N615-G618 VanDerWaalsContact O-N 3.08Å; N615-G618 PolarHBondContact OD1-N 3.13Å; N615-L619 PolarHBondContact O-N 2.95Å
616	E	90	Very high	90.8	Very high	38 Å²	38	49.9 Å²	49.9	18%	0.178	23%	0.231	C	C	.	.	H	α-helix	trans	-49.2	-45.8	-179.2	179.3	-91.9	159.5	0	0	112.9	Y593 R606 C609 L614 L619 A620	Y593-E616 HydrophobicContact CE2-CB 4.45Å; Y593-E616 HydrophobicContact CE2-CG 4Å; R606-E616 HydrophobicContact CG-CG 4.25Å; C609-E616 HydrophobicContact CB-CB 3.98Å; L614-E616 PolarHBondContact O-N 3.36Å; E616-L619 PolarHBondContact O-N 3.1Å; E616-A620 WeakPolarHBondContact O-CB 3.48Å; E616-A620 PolarHBondContact O-N 3.16Å
617	R	82.6	Confident	90.9	Very high	114 Å²	114	47.6 Å²	47.6	43%	0.43	23%	0.229	S	C	.	.	H	α-helix	trans	-68.2	-38.9	-178.5	-63.6	172.8	176.9	176.3	-13.8	112.4	P351 E354 N615 H621	P351-R617 HydrophobicContact CG-CB 4.38Å; E354-R617 IonicContact OE1-CZ 3.84Å; E354-R617 IonicContact OE1-NH1 3.61Å; E354-R617 PolarHBondContact OE1-NH1 3.39Å; E354-R617 IonicContact OE1-NH2 3.51Å; E354-R617 PolarHBondContact OE1-NH2 2.99Å; E354-R617 IonicContact OE2-CZ 2.72Å; E354-R617 IonicContact OE2-NH1 3.03Å; E354-R617 PolarHBondContact OE2-NH1 2.96Å; N615-R617 VanDerWaalsContact C-N 3.28Å; N615-R617 PolarHBondContact O-N 3.35Å; R617-H621 WeakPolarHBondContact O-CB 3.38Å; R617-H621 PolarHBondContact O-N 2.8Å; R617-H621 VanDerWaalsContact O-N 3.12Å
618	G	85	Confident	90.6	Very high	8 Å²	8	48.4 Å²	48.4	8%	0.082	23%	0.225	C	C	.	.	H	α-helix	trans	-61.1	-49.3	174.2	0	0	0	0	0	110.6	I555 N615 H621 A622	I555-G618 WeakPolarHBondContact CD1-O 3.41Å; N615-G618 PolarHBondContact O-N 3.18Å; N615-G618 VanDerWaalsContact O-N 3.08Å; N615-G618 PolarHBondContact OD1-N 3.13Å; G618-H621 WeakPolarHBondContact O-CB 3.32Å; G618-H621 PolarHBondContact O-N 3.26Å; G618-A622 PolarHBondContact O-N 2.92Å
619	L	92.9	Very high	90.5	Very high	0 Å²	0	46.5 Å²	46.5	0%	0	22%	0.218	C	C	.	.	H	α-helix	trans	-66.4	-40.8	-179.6	-71.8	166.8	0	0	0	113	L552 I558 F590 Y593 L614 N615 E616 H621 A622 V623	L552-L619 HydrophobicContact CD2-CD2 3.95Å; I558-L619 HydrophobicContact CG2-CD1 4.3Å; I558-L619 HydrophobicContact CG2-CD2 3.82Å; I558-L619 HydrophobicContact CG2-CG 4.19Å; F590-L619 HydrophobicContact CB-CD2 4.22Å; F590-L619 HydrophobicContact CD2-CD2 4.05Å; Y593-L619 HydrophobicContact CD1-CB 3.62Å; Y593-L619 HydrophobicContact CD1-CD1 4.43Å; Y593-L619 HydrophobicContact CD2-CB 4.07Å; Y593-L619 HydrophobicContact CD2-CD1 3.88Å; Y593-L619 HydrophobicContact CE1-CB 3.74Å; Y593-L619 HydrophobicContact CE2-CB 4.19Å; Y593-L619 HydrophobicContact CG-CB 3.79Å; Y593-L619 HydrophobicContact CG-CD1 3.77Å; Y593-L619 HydrophobicContact CG-CG 4.31Å; L614-L619 HydrophobicContact CB-CD1 3.86Å; L614-L619 HydrophobicContact CD1-CD1 3.97Å; L614-L619 HydrophobicContact CD2-CD1 4.4Å; L614-L619 HydrophobicContact CG-CD1 4.3Å; N615-L619 PolarHBondContact O-N 2.95Å; E616-L619 PolarHBondContact O-N 3.1Å; L619-H621 VanDerWaalsContact C-N 3.26Å; L619-H621 PolarHBondContact O-N 2.94Å; L619-A622 WeakPolarHBondContact O-CA 3.29Å; L619-A622 VanDerWaalsContact O-CB 3.24Å; L619-A622 WeakPolarHBondContact O-CB 3.47Å; L619-A622 PolarHBondContact O-N 2.84Å; L619-V623 WeakPolarHBondContact O-CG2 3.22Å; L619-V623 PolarHBondContact O-N 3.48Å
620	A	90.7	Very high	90.6	Very high	31 Å²	31	46.5 Å²	46.5	26%	0.256	22%	0.219	S	C	.	.	H	α-helix	trans	-57.5	-41	172.1	0	0	0	0	0	111.6	E616 I624	E616-A620 WeakPolarHBondContact O-CB 3.48Å; E616-A620 PolarHBondContact O-N 3.16Å; A620-I624 WeakPolarHBondContact O-CG1 3.33Å; A620-I624 PolarHBondContact O-N 3.14Å
621	H	85	Confident	90.8	Very high	82 Å²	82	41.1 Å²	41.1	38%	0.38	21%	0.209	S	C	.	.	H	α-helix	trans	-68.6	-35.4	174.7	-171.5	-128.6	0	0	0	112.3	R617 G618 L619 V623 I624 L625	R617-H621 WeakPolarHBondContact O-CB 3.38Å; R617-H621 PolarHBondContact O-N 2.8Å; R617-H621 VanDerWaalsContact O-N 3.12Å; G618-H621 WeakPolarHBondContact O-CB 3.32Å; G618-H621 PolarHBondContact O-N 3.26Å; L619-H621 VanDerWaalsContact C-N 3.26Å; L619-H621 PolarHBondContact O-N 2.94Å; H621-V623 VanDerWaalsContact C-N 3.33Å; H621-V623 PolarHBondContact O-N 3.02Å; H621-I624 PolarHBondContact O-N 3.48Å; H621-L625 WeakPolarHBondContact O-CG 3.39Å; H621-L625 PolarHBondContact O-N 2.79Å
622	A	91.7	Very high	90.8	Very high	0 Å²	0	37.1 Å²	37.1	0%	0	19%	0.191	C	C	.	.	H	α-helix	trans	-59.7	-44.2	175.8	0	0	0	0	0	111.6	S551 L552 I555 F590 G618 L619 I624 L625 R626	S551-A622 WeakPolarHBondContact CB-O 3.35Å; L552-A622 HydrophobicContact CD2-CB 3.89Å; I555-A622 HydrophobicContact CD1-CB 3.22Å; F590-A622 HydrophobicContact CD2-CB 3.9Å; F590-A622 HydrophobicContact CE2-CB 3.68Å; G618-A622 PolarHBondContact O-N 2.92Å; L619-A622 WeakPolarHBondContact O-CA 3.29Å; L619-A622 VanDerWaalsContact O-CB 3.24Å; L619-A622 WeakPolarHBondContact O-CB 3.47Å; L619-A622 PolarHBondContact O-N 2.84Å; A622-I624 VanDerWaalsContact C-N 3.35Å; A622-I624 PolarHBondContact O-N 3.09Å; A622-L625 PolarHBondContact O-N 2.98Å; A622-R626 WeakPolarHBondContact O-CB 3.45Å; A622-R626 PolarHBondContact O-N 3.43Å
623	V	94.4	Very high	91	Very high	29 Å²	29	35.9 Å²	35.9	18%	0.176	18%	0.184	C	C	.	.	H	α-helix	trans	-56.2	-50.4	176.4	165.7	0	0	0	0	109.9	F590 Y593 L619 H621 L625 R626 D627	F590-V623 HydrophobicContact CE2-CB 4.44Å; F590-V623 HydrophobicContact CE2-CG2 3.59Å; F590-V623 HydrophobicContact CZ-CG2 3.82Å; Y593-V623 HydrophobicContact CE1-CG2 4.3Å; L619-V623 WeakPolarHBondContact O-CG2 3.22Å; L619-V623 PolarHBondContact O-N 3.48Å; H621-V623 VanDerWaalsContact C-N 3.33Å; H621-V623 PolarHBondContact O-N 3.02Å; V623-L625 VanDerWaalsContact C-N 3.34Å; V623-L625 PolarHBondContact O-N 2.88Å; V623-R626 PolarHBondContact O-N 3.44Å; V623-D627 PolarHBondContact O-N 2.92Å
624	I	91	Very high	91.2	Very high	80 Å²	80	41.4 Å²	41.4	41%	0.41	21%	0.209	S	C	.	.	H	α-helix	trans	-59.8	-43	178.7	-64.3	167.1	0	0	0	111.5	A620 H621 A622 R628	A620-I624 WeakPolarHBondContact O-CG1 3.33Å; A620-I624 PolarHBondContact O-N 3.14Å; H621-I624 PolarHBondContact O-N 3.48Å; A622-I624 VanDerWaalsContact C-N 3.35Å; A622-I624 PolarHBondContact O-N 3.09Å; I624-R628 WeakPolarHBondContact O-CB 3.5Å; I624-R628 WeakPolarHBondContact O-CD 3.38Å; I624-R628 VanDerWaalsContact O-CG 3.23Å; I624-R628 WeakPolarHBondContact O-CG 3.46Å; I624-R628 PolarHBondContact O-N 3.49Å; I624-R628 VanDerWaalsContact O-N 3.09Å
625	L	88.9	Confident	91.1	Very high	7 Å²	7	48 Å²	48	4%	0.037	23%	0.233	C	C	.	.	H	α-helix	trans	-66.1	-42.3	178.3	-69.3	175.8	0	0	0	112	F146 Q554 H621 A622 V623 R628 I629	F146-L625 HydrophobicContact CE2-CD2 4.04Å; Q554-L625 HydrophobicContact CB-CD1 4.1Å; H621-L625 WeakPolarHBondContact O-CG 3.39Å; H621-L625 PolarHBondContact O-N 2.79Å; A622-L625 PolarHBondContact O-N 2.98Å; V623-L625 VanDerWaalsContact C-N 3.34Å; V623-L625 PolarHBondContact O-N 2.88Å; L625-R628 WeakPolarHBondContact O-CB 3.24Å; L625-R628 PolarHBondContact O-N 2.87Å; L625-I629 WeakPolarHBondContact O-CG1 3.46Å; L625-I629 PolarHBondContact O-N 2.7Å
626	R	94.8	Very high	91.2	Very high	24 Å²	24	46.9 Å²	46.9	9%	0.091	23%	0.227	C	C	.	.	H	α-helix	trans	-64.6	-42.4	178.9	-179.7	-84.5	-39.8	-104.3	4.5	111.3	A547 A548 S551 F590 E594 A622 V623 R628 I629 G630	A547-R626 HydrophobicContact CB-CG 4.32Å; A548-R626 HydrophobicContact CB-CG 4.09Å; S551-R626 VanDerWaalsContact OG-CA 3.29Å; S551-R626 WeakPolarHBondContact OG-CA 3.06Å; S551-R626 PolarHBondContact OG-N 3Å; F590-R626 VanDerWaalsContact CE1-NH1 3.33Å; F590-R626 HydrophobicContact CZ-CB 4.49Å; F590-R626 HydrophobicContact CZ-CG 4.43Å; E594-R626 VanDerWaalsContact CD-NH1 3.28Å; E594-R626 IonicContact OE1-CZ 3.71Å; E594-R626 VanDerWaalsContact OE1-CZ 3.26Å; E594-R626 IonicContact OE1-NH1 3.26Å; E594-R626 PolarHBondContact OE1-NH1 3.19Å; E594-R626 IonicContact OE1-NH2 3.86Å; E594-R626 PolarHBondContact OE1-NH2 3.32Å; E594-R626 IonicContact OE2-CZ 2.84Å; E594-R626 IonicContact OE2-NH1 3.6Å; E594-R626 PolarHBondContact OE2-NH1 3.39Å; A622-R626 WeakPolarHBondContact O-CB 3.45Å; A622-R626 PolarHBondContact O-N 3.43Å; V623-R626 PolarHBondContact O-N 3.44Å; R626-R628 VanDerWaalsContact C-N 3.33Å; R626-R628 PolarHBondContact O-N 2.99Å; R626-I629 PolarHBondContact O-N 2.81Å; R626-G630 PolarHBondContact O-N 3.31Å
627	D	94.5	Very high	91.5	Very high	78 Å²	78	54.3 Å²	54.3	42%	0.417	26%	0.259	S	S	.	.	H	α-helix	trans	-67.2	-34.3	176.8	-63	-12.5	0	0	0	112	V623 G630 S631	V623-D627 PolarHBondContact O-N 2.92Å; D627-G630 PolarHBondContact O-N 2.91Å; D627-S631 PolarHBondContact O-N 3.5Å; D627-S631 PolarHBondContact O-OG 3.32Å
628	R	90.3	Very high	92.1	Very high	76 Å²	76	50 Å²	50	29%	0.287	24%	0.244	S	C	.	.	H	α-helix	trans	-66.5	-44.8	173	-76.7	169.8	175.7	177.3	-2.9	111.7	F146 I624 L625 R626 G630 S631 M632	F146-R628 VanDerWaalsContact CG-NH1 3.32Å; I624-R628 WeakPolarHBondContact O-CB 3.5Å; I624-R628 WeakPolarHBondContact O-CD 3.38Å; I624-R628 VanDerWaalsContact O-CG 3.23Å; I624-R628 WeakPolarHBondContact O-CG 3.46Å; I624-R628 PolarHBondContact O-N 3.49Å; I624-R628 VanDerWaalsContact O-N 3.09Å; L625-R628 WeakPolarHBondContact O-CB 3.24Å; L625-R628 PolarHBondContact O-N 2.87Å; R626-R628 VanDerWaalsContact C-N 3.33Å; R626-R628 PolarHBondContact O-N 2.99Å; R628-G630 VanDerWaalsContact C-N 3.28Å; R628-G630 PolarHBondContact O-N 3.02Å; R628-S631 PolarHBondContact O-N 3.31Å; R628-M632 WeakPolarHBondContact O-CG 3.48Å; R628-M632 PolarHBondContact O-N 2.8Å
629	I	93.2	Very high	92.6	Very high	6 Å²	6	52.6 Å²	52.6	3%	0.031	26%	0.26	C	S	.	.	H	α-helix	trans	-58.3	-46	173.1	-67.5	169.9	0	0	0	109.3	C523 L534 A547 V550 L625 R626 S631 M632 F633 W640	C523-I629 HydrophobicContact CB-CG1 4.48Å; L534-I629 HydrophobicContact CD1-CG2 4.36Å; L534-I629 HydrophobicContact CD2-CG2 4.11Å; A547-I629 HydrophobicContact CB-CB 4.3Å; A547-I629 HydrophobicContact CB-CG2 3.78Å; V550-I629 HydrophobicContact CB-CD1 4.43Å; V550-I629 HydrophobicContact CG1-CD1 3.91Å; L625-I629 WeakPolarHBondContact O-CG1 3.46Å; L625-I629 PolarHBondContact O-N 2.7Å; R626-I629 PolarHBondContact O-N 2.81Å; I629-S631 PolarHBondContact O-N 2.96Å; I629-M632 WeakPolarHBondContact O-CB 3.49Å; I629-M632 PolarHBondContact O-N 2.87Å; I629-M632 VanDerWaalsContact O-N 3.1Å; I629-F633 HydrophobicContact CG2-CD2 3.81Å; I629-F633 HydrophobicContact CG2-CE2 3.73Å; I629-F633 WeakPolarHBondContact O-CD2 3.49Å; I629-F633 PolarHBondContact O-N 2.9Å; I629-W640 HydrophobicContact CG2-CZ3 4.3Å
630	G	95.6	Very high	92.8	Very high	3 Å²	3	55.3 Å²	55.3	3%	0.031	27%	0.27	C	S	.	.	H	α-helix	trans	-57.2	-48.1	175.8	0	0	0	0	0	113	R626 D627 R628 M632 F633 H634	R626-G630 PolarHBondContact O-N 3.31Å; D627-G630 PolarHBondContact O-N 2.91Å; R628-G630 VanDerWaalsContact C-N 3.28Å; R628-G630 PolarHBondContact O-N 3.02Å; G630-M632 PolarHBondContact O-N 3.25Å; G630-F633 WeakPolarHBondContact O-CB 3.48Å; G630-F633 PolarHBondContact O-N 3.4Å; G630-F633 VanDerWaalsContact O-N 3.1Å; G630-H634 PolarHBondContact O-N 3.01Å; G630-H634 PolarHBondContact O-ND1 2.97Å
631	S	93.8	Very high	93	Very high	68 Å²	68	56.9 Å²	56.9	48%	0.476	28%	0.276	S	S	.	.	H	α-helix	trans	-57.1	-37.9	175.9	-57.6	0	0	0	0	112	D627 R628 I629 R635	D627-S631 PolarHBondContact O-N 3.5Å; D627-S631 PolarHBondContact O-OG 3.32Å; R628-S631 PolarHBondContact O-N 3.31Å; I629-S631 PolarHBondContact O-N 2.96Å; S631-R635 PolarHBondContact O-N 2.89Å; S631-R635 VanDerWaalsContact O-N 3.15Å
632	M	90.4	Very high	93.5	Very high	50 Å²	50	57.9 Å²	57.9	25%	0.246	28%	0.279	C	S	.	.	H	α-helix	trans	-71.7	-38.4	176.7	-69	-53.8	94.6	0	0	112.8	T522 R628 I629 G630 H634 R635 L636	T522-M632 HydrophobicContact CG2-CB 3.54Å; T522-M632 HydrophobicContact CG2-CG 3.43Å; T522-M632 VanDerWaalsContact CG2-CG 3.43Å; T522-M632 HydrophobicContact CG2-SD 3.34Å; T522-M632 WeakPolarHBondContact CG2-SD 3.38Å; R628-M632 WeakPolarHBondContact O-CG 3.48Å; R628-M632 PolarHBondContact O-N 2.8Å; I629-M632 WeakPolarHBondContact O-CB 3.49Å; I629-M632 PolarHBondContact O-N 2.87Å; I629-M632 VanDerWaalsContact O-N 3.1Å; G630-M632 PolarHBondContact O-N 3.25Å; M632-H634 VanDerWaalsContact C-N 3.33Å; M632-H634 PolarHBondContact O-N 2.97Å; M632-R635 PolarHBondContact O-N 2.91Å; M632-L636 WeakPolarHBondContact O-CB 3.4Å; M632-L636 VanDerWaalsContact O-CG 3.31Å; M632-L636 WeakPolarHBondContact O-CG 3.32Å; M632-L636 PolarHBondContact O-N 3.13Å
633	F	94.6	Very high	93.7	Very high	0 Å²	0	58 Å²	58	0%	0	28%	0.281	C	S	.	.	H	α-helix	trans	-59.4	-44.1	174.1	-93.1	-124.7	0	0	0	111.6	L534 I629 G630 R635 L636 K637 L638 W640	L534-F633 HydrophobicContact CB-CE2 4.43Å; L534-F633 HydrophobicContact CB-CZ 3.95Å; L534-F633 HydrophobicContact CD1-CE2 4.43Å; L534-F633 HydrophobicContact CD2-CE2 4.03Å; L534-F633 HydrophobicContact CD2-CZ 3.74Å; L534-F633 HydrophobicContact CG-CZ 4.32Å; I629-F633 HydrophobicContact CG2-CD2 3.81Å; I629-F633 HydrophobicContact CG2-CE2 3.73Å; I629-F633 WeakPolarHBondContact O-CD2 3.49Å; I629-F633 PolarHBondContact O-N 2.9Å; G630-F633 WeakPolarHBondContact O-CB 3.48Å; G630-F633 PolarHBondContact O-N 3.4Å; G630-F633 VanDerWaalsContact O-N 3.1Å; F633-R635 PolarHBondContact O-N 2.88Å; F633-L636 CarbonylContact O-C 3.54Å; F633-L636 PolarHBondContact O-N 3.33Å; F633-K637 PolarHBondContact O-N 3.15Å; F633-L638 HydrophobicContact CB-CB 4.35Å; F633-L638 HydrophobicContact CD1-CB 3.68Å; F633-L638 HydrophobicContact CD1-CD1 4.3Å; F633-L638 HydrophobicContact CE1-CB 4.21Å; F633-L638 HydrophobicContact CE1-CD1 4.3Å; F633-L638 HydrophobicContact CG-CB 4.14Å; F633-L638 HydrophobicContact CG-CD1 4.42Å; F633-L638 HydrophobicContact CZ-CD1 4.4Å; F633-L638 PolarHBondContact O-N 3.01Å; F633-W640 HydrophobicContact CB-CE3 3.88Å; F633-W640 HydrophobicContact CB-CZ3 4.39Å; F633-W640 AromaticContact CD1-CE3 3.82Å; F633-W640 HydrophobicContact CD1-CE3 3.82Å; F633-W640 HydrophobicContact CD1-CZ3 4.23Å; F633-W640 AromaticContact CG-CE3 3.9Å; F633-W640 HydrophobicContact CG-CE3 3.9Å; F633-W640 HydrophobicContact CG-CZ3 4.13Å
634	H	94.5	Very high	93.6	Very high	118 Å²	118	65 Å²	65	55%	0.546	31%	0.311	S	S	.	.	H	α-helix	trans	-60.5	-44.4	174.3	-69.5	87.5	0	0	0	111.8	G630 M632 L636 K637 W640	G630-H634 PolarHBondContact O-N 3.01Å; G630-H634 PolarHBondContact O-ND1 2.97Å; M632-H634 VanDerWaalsContact C-N 3.33Å; M632-H634 PolarHBondContact O-N 2.97Å; H634-L636 VanDerWaalsContact C-N 3.29Å; H634-L636 PolarHBondContact O-N 3.46Å; H634-K637 PolarHBondContact O-N 2.71Å; H634-W640 AromaticContact CE1-CD1 3.58Å; H634-W640 AromaticContact CE1-CG 3.68Å
635	R	91.5	Very high	93.7	Very high	143 Å²	143	65.8 Å²	65.8	54%	0.54	32%	0.322	S	S	.	.	H	α-helix	trans	-61	-38.4	177.1	-173.7	171.7	67.3	82.8	-2.8	112.4	T522 S631 M632 F633 K637	T522-R635 PolarHBondContact OG1-NH2 2.86Å; S631-R635 PolarHBondContact O-N 2.89Å; S631-R635 VanDerWaalsContact O-N 3.15Å; M632-R635 PolarHBondContact O-N 2.91Å; F633-R635 PolarHBondContact O-N 2.88Å; R635-K637 VanDerWaalsContact C-N 3.26Å; R635-K637 PolarHBondContact O-N 3.39Å
636	L	90.8	Very high	93.7	Very high	29 Å²	29	72.5 Å²	72.5	15%	0.152	35%	0.353	C	S	.	.	T	Hydrogen-bonded Turn	trans	-82.6	0.8	177.4	-63.4	-178.8	0	0	0	113.5	E518 V519 T522 M632 F633 H634 L638	E518-L636 HydrophobicContact CG-CD1 4.26Å; E518-L636 HydrophobicContact CG-CD2 3.74Å; E518-L636 WeakPolarHBondContact OE1-CD2 3.43Å; V519-L636 HydrophobicContact CG2-CD1 3.97Å; T522-L636 HydrophobicContact CG2-CD1 4.25Å; M632-L636 WeakPolarHBondContact O-CB 3.4Å; M632-L636 VanDerWaalsContact O-CG 3.31Å; M632-L636 WeakPolarHBondContact O-CG 3.32Å; M632-L636 PolarHBondContact O-N 3.13Å; F633-L636 CarbonylContact O-C 3.54Å; F633-L636 PolarHBondContact O-N 3.33Å; H634-L636 VanDerWaalsContact C-N 3.29Å; H634-L636 PolarHBondContact O-N 3.46Å; L636-L638 HydrophobicContact CB-CD1 4.04Å; L636-L638 HydrophobicContact CB-CG 3.95Å; L636-L638 HydrophobicContact CD1-CD1 4.21Å; L636-L638 PolarHBondContact O-N 2.88Å
637	K	94.8	Very high	93.3	Very high	194 Å²	194	74.7 Å²	74.7	84%	0.843	38%	0.383	S	S	*	.	T	Hydrogen-bonded Turn	trans	54.2	38.3	-175.9	-54.8	-179.7	-179.8	-180	0	112.8	F633 H634 R635	F633-K637 PolarHBondContact O-N 3.15Å; H634-K637 PolarHBondContact O-N 2.71Å; R635-K637 VanDerWaalsContact C-N 3.26Å; R635-K637 PolarHBondContact O-N 3.39Å
638	L	94.9	Very high	93.2	Very high	25 Å²	25	73.2 Å²	73.2	13%	0.131	38%	0.375	C	S	.	.			trans	-91.9	148.4	174.7	-64.7	175.8	0	0	0	110.7	V519 L535 F633 L636 W640	V519-L638 HydrophobicContact CG2-CD1 3.81Å; L535-L638 HydrophobicContact CD2-CD1 4.31Å; F633-L638 HydrophobicContact CB-CB 4.35Å; F633-L638 HydrophobicContact CD1-CB 3.68Å; F633-L638 HydrophobicContact CD1-CD1 4.3Å; F633-L638 HydrophobicContact CE1-CB 4.21Å; F633-L638 HydrophobicContact CE1-CD1 4.3Å; F633-L638 HydrophobicContact CG-CB 4.14Å; F633-L638 HydrophobicContact CG-CD1 4.42Å; F633-L638 HydrophobicContact CZ-CD1 4.4Å; F633-L638 PolarHBondContact O-N 3.01Å; L636-L638 HydrophobicContact CB-CD1 4.04Å; L636-L638 HydrophobicContact CB-CG 3.95Å; L636-L638 HydrophobicContact CD1-CD1 4.21Å; L636-L638 PolarHBondContact O-N 2.88Å; L638-W640 PolarHBondContact O-N 3.18Å
639	P	96	Very high	93.4	Very high	62 Å²	62	71 Å²	71	40%	0.403	37%	0.371	S	S	.	.			trans	-57	132.7	176.9	-24	33.7	0	0	0	112.2	C538 S543 V641	C538-P639 HydrophobicContact CB-CG 4.31Å; S543-P639 WeakPolarHBondContact CB-O 3.21Å; S543-P639 PolarHBondContact OG-O 3.29Å; P639-V641 HydrophobicContact CB-CG2 4.46Å
640	W	96.9	Very high	93.5	Very high	56 Å²	56	74.4 Å²	74.4	21%	0.212	39%	0.389	C	S	.	.			trans	-120.4	68	176.9	-170.2	-106.8	0	0	0	111.1	S543 Q544 A547 I629 F633 H634 L638	S543-W640 VanDerWaalsContact OG-CA 3.3Å; S543-W640 WeakPolarHBondContact OG-CA 3.39Å; Q544-W640 HydrophobicContact CG-CD2 4Å; Q544-W640 HydrophobicContact CG-CG 4.31Å; Q544-W640 HydrophobicContact CG-CZ2 4Å; Q544-W640 PolarHBondContact NE2-O 3Å; Q544-W640 VanDerWaalsContact NE2-O 3.15Å; A547-W640 HydrophobicContact CB-CH2 3.4Å; A547-W640 HydrophobicContact CB-CZ3 3.66Å; I629-W640 HydrophobicContact CG2-CZ3 4.3Å; F633-W640 HydrophobicContact CB-CE3 3.88Å; F633-W640 HydrophobicContact CB-CZ3 4.39Å; F633-W640 AromaticContact CD1-CE3 3.82Å; F633-W640 HydrophobicContact CD1-CE3 3.82Å; F633-W640 HydrophobicContact CD1-CZ3 4.23Å; F633-W640 AromaticContact CG-CE3 3.9Å; F633-W640 HydrophobicContact CG-CE3 3.9Å; F633-W640 HydrophobicContact CG-CZ3 4.13Å; H634-W640 AromaticContact CE1-CD1 3.58Å; H634-W640 AromaticContact CE1-CG 3.68Å; L638-W640 PolarHBondContact O-N 3.18Å
641	V	96.4	Very high	93.5	Very high	65 Å²	65	75 Å²	75	39%	0.394	39%	0.392	S	S	.	.			trans	-114.2	155.4	-172	-63.1	0	0	0	0	112.6	S543 Q544 P639	S543-V641 PolarHBondContact N-O 2.96Å; S543-V641 VanDerWaalsContact N-O 3.11Å; S543-V641 PolarHBondContact OG-N 2.96Å; S543-V641 PolarHBondContact OG-O 3.46Å; Q544-V641 PolarHBondContact N-O 3.48Å; Q544-V641 VanDerWaalsContact N-O 3.14Å; P639-V641 HydrophobicContact CB-CG2 4.46Å
642	K	95.4	Very high	93.7	Very high	102 Å²	102	71.9 Å²	71.9	44%	0.443	37%	0.371	S	S	.	.			trans	-92.7	155.3	169.5	-73.4	-174.2	168.5	-171.9	0	110.7	G541 Q544 E545 E646	G541-K642 CarbonylContact O-C 3.58Å; G541-K642 VanDerWaalsContact O-O 3.07Å; Q544-K642 HydrophobicContact CB-CG 4.2Å; Q544-K642 HydrophobicContact CG-CG 4.29Å; Q544-K642 VanDerWaalsContact OE1-CG 3.28Å; E545-K642 WeakPolarHBondContact OE1-CA 3.49Å; E545-K642 WeakPolarHBondContact OE1-CB 3.41Å; K642-E646 IonicContact NZ-OE1 3.22Å; K642-E646 PolarHBondContact NZ-OE1 3.08Å
643	A	95.4	Very high	94	Very high	4 Å²	4	69.8 Å²	69.8	3%	0.033	36%	0.36	C	S	.	.			trans	-65.4	137.3	175.3	0	0	0	0	0	111.9	G541 C542 E545 P645 E646 P651	G541-A643 WeakPolarHBondContact O-CA 3.44Å; G541-A643 PolarHBondContact O-N 2.94Å; C542-A643 HydrophobicContact CB-CB 3.91Å; E545-A643 PolarHBondContact OE1-N 3.37Å; E545-A643 PolarHBondContact OE2-N 3.34Å; A643-P645 CarbonylContact O-C 3.4Å; A643-E646 PolarHBondContact O-N 2.94Å; A643-P651 HydrophobicContact CB-CB 4.32Å; A643-P651 HydrophobicContact CB-CG 4.32Å
644	E	92.3	Very high	94.2	Very high	175 Å²	175	71.5 Å²	71.5	82%	0.818	37%	0.367	S	S	*	.	S	Bend	trans	-113.2	135.8	174.9	-68.7	-170.8	172.9	0	0	111.9
645	P	93.4	Very high	94.3	Very high	97 Å²	97	65.9 Å²	65.9	63%	0.63	34%	0.341	S	S	*	.	S	Bend	cis	-65.5	156.9	-12.6	30.1	-35.1	0	0	0	111.6	A643 G647 N648	A643-P645 CarbonylContact O-C 3.4Å; P645-G647 PolarHBondContact O-N 3.21Å; P645-N648 HydrophobicContact CG-CB 4.31Å; P645-N648 WeakPolarHBondContact O-CB 3.37Å; P645-N648 PolarHBondContact O-N 2.76Å
646	E	88.1	Confident	94.6	Very high	147 Å²	147	59.3 Å²	59.3	69%	0.687	32%	0.316	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.8	130.7	-178.5	-166.6	167.5	-149.9	0	0	110.6	K642 A643	K642-E646 IonicContact NZ-OE1 3.22Å; K642-E646 PolarHBondContact NZ-OE1 3.08Å; A643-E646 PolarHBondContact O-N 2.94Å
647	G	86	Confident	94.9	Very high	71 Å²	71	58 Å²	58	73%	0.732	31%	0.309	S	S	*	.	T	Hydrogen-bonded Turn	trans	88.5	-0.6	-175.2	0	0	0	0	0	115.5	P645 P649	P645-G647 PolarHBondContact O-N 3.21Å; G647-P649 VanDerWaalsContact O-CD 3.31Å; G647-P649 WeakPolarHBondContact O-CD 3.45Å
648	N	92.3	Very high	94.9	Very high	46 Å²	46	51 Å²	51	25%	0.246	28%	0.277	C	S	.	.			trans	-65.6	117.4	172.5	-177.1	1.5	0	0	0	111.1	P645 N650	P645-N648 HydrophobicContact CG-CB 4.31Å; P645-N648 WeakPolarHBondContact O-CB 3.37Å; P645-N648 PolarHBondContact O-N 2.76Å; N648-N650 PolarHBondContact OD1-N 3.08Å; N648-N650 VanDerWaalsContact OD1-N 3.13Å
649	P	94.8	Very high	94.9	Very high	29 Å²	29	49.8 Å²	49.8	19%	0.188	27%	0.271	C	S	.	.	H	α-helix	trans	-77.7	-21.5	-176.5	31.2	-35.7	0	0	0	113.5	L584 G647 V652 L653	L584-P649 HydrophobicContact CD1-CB 3.62Å; L584-P649 HydrophobicContact CD2-CB 4.5Å; G647-P649 VanDerWaalsContact O-CD 3.31Å; G647-P649 WeakPolarHBondContact O-CD 3.45Å; P649-V652 PolarHBondContact O-N 3.11Å; P649-L653 HydrophobicContact CB-CD1 4.28Å; P649-L653 WeakPolarHBondContact O-CG 3.19Å; P649-L653 PolarHBondContact O-N 3.48Å
650	N	95.6	Very high	94.9	Very high	78 Å²	78	47 Å²	47	42%	0.417	25%	0.253	S	S	.	.	H	α-helix	trans	-64.2	-48.2	-168.6	-74.1	-10.9	0	0	0	113.6	N648 V652 L653 R654	N648-N650 PolarHBondContact OD1-N 3.08Å; N648-N650 VanDerWaalsContact OD1-N 3.13Å; N650-V652 VanDerWaalsContact C-N 3.26Å; N650-V652 PolarHBondContact O-N 2.78Å; N650-L653 PolarHBondContact O-N 3.38Å; N650-R654 WeakPolarHBondContact O-CB 3.47Å; N650-R654 VanDerWaalsContact O-CG 3.28Å; N650-R654 WeakPolarHBondContact O-CG 3.49Å; N650-R654 PolarHBondContact O-N 2.93Å
651	P	96.6	Very high	94.8	Very high	16 Å²	16	44.4 Å²	44.4	10%	0.104	24%	0.243	C	C	.	.	H	α-helix	trans	-55.5	-43	176.1	-28.2	37.3	0	0	0	112.4	E540 C542 A643 R654 A655	E540-P651 HydrophobicContact CB-CB 4.21Å; C542-P651 HydrophobicContact CB-CB 3.9Å; C542-P651 VanDerWaalsContact SG-C 3.51Å; C542-P651 PolarHBondContact SG-O 3.35Å; C542-P651 VanDerWaalsContact SG-O 3.38Å; A643-P651 HydrophobicContact CB-CB 4.32Å; A643-P651 HydrophobicContact CB-CG 4.32Å; P651-R654 PolarHBondContact O-N 2.95Å; P651-A655 WeakPolarHBondContact O-CB 3.2Å; P651-A655 PolarHBondContact O-N 3.48Å
652	V	97.3	Very high	94.5	Very high	3 Å²	3	42.3 Å²	42.3	2%	0.018	23%	0.229	C	C	.	.	H	α-helix	trans	-64	-49.2	179.9	-175	0	0	0	0	110.7	C542 E545 I546 I549 L584 P649 N650 R654 A655 I656	C542-V652 HydrophobicContact CB-CG2 4.05Å; E545-V652 HydrophobicContact CB-CG1 4.43Å; E545-V652 HydrophobicContact CB-CG2 3.78Å; E545-V652 HydrophobicContact CG-CG2 4.06Å; I546-V652 HydrophobicContact CD1-CG1 3.76Å; I546-V652 WeakPolarHBondContact CD1-O 3.42Å; I546-V652 HydrophobicContact CG1-CG1 4.49Å; I549-V652 HydrophobicContact CD1-CG1 3.45Å; I549-V652 VanDerWaalsContact CD1-CG1 3.45Å; L584-V652 HydrophobicContact CD2-CB 4.21Å; L584-V652 HydrophobicContact CD2-CG1 3.91Å; P649-V652 PolarHBondContact O-N 3.11Å; N650-V652 VanDerWaalsContact C-N 3.26Å; N650-V652 PolarHBondContact O-N 2.78Å; V652-R654 PolarHBondContact O-N 2.72Å; V652-A655 PolarHBondContact O-N 3.18Å; V652-I656 HydrophobicContact CG1-CD1 4.32Å; V652-I656 WeakPolarHBondContact O-CG1 3.32Å; V652-I656 PolarHBondContact O-N 3.34Å
653	L	97.3	Very high	94.4	Very high	5 Å²	5	38.3 Å²	38.3	3%	0.026	21%	0.212	C	C	.	.	H	α-helix	trans	-63.5	-41.1	179.4	-67.2	170.5	0	0	0	112.1	Q580 L584 P649 N650 I656 V657 W745	Q580-L653 HydrophobicContact CB-CD1 4.2Å; Q580-L653 HydrophobicContact CG-CD1 4.36Å; L584-L653 HydrophobicContact CD1-CD1 4.15Å; L584-L653 HydrophobicContact CD1-CD2 3.84Å; L584-L653 HydrophobicContact CD1-CG 3.98Å; L584-L653 HydrophobicContact CG-CD2 4.37Å; P649-L653 HydrophobicContact CB-CD1 4.28Å; P649-L653 WeakPolarHBondContact O-CG 3.19Å; P649-L653 PolarHBondContact O-N 3.48Å; N650-L653 PolarHBondContact O-N 3.38Å; L653-I656 PolarHBondContact O-N 2.89Å; L653-V657 WeakPolarHBondContact O-CG2 3.49Å; L653-V657 PolarHBondContact O-N 2.97Å; L653-W745 HydrophobicContact CB-CH2 4.13Å; L653-W745 HydrophobicContact CB-CZ3 3.67Å; L653-W745 HydrophobicContact CD1-CH2 4.18Å; L653-W745 HydrophobicContact CD1-CZ3 4.22Å
654	R	97.6	Very high	94.5	Very high	37 Å²	37	38.2 Å²	38.2	14%	0.14	21%	0.211	C	C	.	.	H	α-helix	trans	-64.1	-41.1	176.6	-70.8	172.1	60	84.5	-2.3	111.9	E540 N650 P651 V652 I656 V657 R658 W745 E748 L749	E540-R654 HydrophobicContact CG-CB 4.11Å; E540-R654 IonicContact OE1-CZ 3.67Å; E540-R654 IonicContact OE1-NE 2.97Å; E540-R654 IonicContact OE1-NH2 3.62Å; E540-R654 IonicContact OE2-CZ 2.81Å; E540-R654 IonicContact OE2-NE 3.07Å; E540-R654 PolarHBondContact OE2-NE 3.37Å; E540-R654 IonicContact OE2-NH2 3.73Å; N650-R654 WeakPolarHBondContact O-CB 3.47Å; N650-R654 VanDerWaalsContact O-CG 3.28Å; N650-R654 WeakPolarHBondContact O-CG 3.49Å; N650-R654 PolarHBondContact O-N 2.93Å; P651-R654 PolarHBondContact O-N 2.95Å; V652-R654 PolarHBondContact O-N 2.72Å; R654-I656 PolarHBondContact O-N 3.29Å; R654-V657 WeakPolarHBondContact O-CB 3.43Å; R654-V657 PolarHBondContact O-N 2.93Å; R654-R658 WeakPolarHBondContact O-CG 3.35Å; R654-R658 PolarHBondContact O-N 3.08Å; R654-W745 HydrophobicContact CG-CD2 3.99Å; R654-W745 HydrophobicContact CG-CE3 4.2Å; R654-W745 HydrophobicContact CG-CG 4.43Å; R654-W745 HydrophobicContact CG-CZ2 4.37Å; R654-W745 HydrophobicContact CG-CZ3 4.48Å; R654-E748 IonicContact CZ-OE1 2.91Å; R654-E748 IonicContact CZ-OE2 2.81Å; R654-E748 IonicContact NH1-OE1 3.25Å; R654-E748 PolarHBondContact NH1-OE1 3.41Å; R654-E748 IonicContact NH1-OE2 3.82Å; R654-E748 PolarHBondContact NH1-OE2 3.43Å; R654-E748 IonicContact NH2-OE1 3.86Å; R654-E748 PolarHBondContact NH2-OE1 3.37Å; R654-E748 IonicContact NH2-OE2 3.8Å; R654-L749 HydrophobicContact CB-CD1 3.97Å; R654-L749 HydrophobicContact CG-CD1 4.25Å
655	A	97.4	Very high	94.6	Very high	0 Å²	0	29.9 Å²	29.9	0%	0	17%	0.172	C	C	.	.	H	α-helix	trans	-63.8	-38.8	174.3	0	0	0	0	0	112.5	A533 A537 E540 I546 P651 V652 R658 G659	A533-A655 WeakPolarHBondContact CA-O 3.47Å; A537-A655 HydrophobicContact CB-CB 4.03Å; E540-A655 HydrophobicContact CB-CB 4.45Å; E540-A655 HydrophobicContact CG-CB 4.25Å; I546-A655 HydrophobicContact CD1-CB 3.76Å; I546-A655 HydrophobicContact CG1-CB 3.73Å; P651-A655 WeakPolarHBondContact O-CB 3.2Å; P651-A655 PolarHBondContact O-N 3.48Å; V652-A655 PolarHBondContact O-N 3.18Å; A655-R658 PolarHBondContact O-N 3.01Å; A655-G659 PolarHBondContact O-N 2.79Å
656	I	97.1	Very high	94.7	Very high	5 Å²	5	29 Å²	29	3%	0.026	16%	0.156	C	C	.	.	H	α-helix	trans	-61.4	-45.3	171.9	-64.2	167	0	0	0	110.3	I546 I549 H583 V652 L653 R654 R658 G659 F660 L703	I546-I656 HydrophobicContact CD1-CD1 4.47Å; I546-I656 HydrophobicContact CD1-CG1 3.7Å; I549-I656 HydrophobicContact CD1-CD1 4.18Å; H583-I656 HydrophobicContact CB-CD1 3.94Å; V652-I656 HydrophobicContact CG1-CD1 4.32Å; V652-I656 WeakPolarHBondContact O-CG1 3.32Å; V652-I656 PolarHBondContact O-N 3.34Å; L653-I656 PolarHBondContact O-N 2.89Å; R654-I656 PolarHBondContact O-N 3.29Å; I656-R658 VanDerWaalsContact C-N 3.34Å; I656-R658 PolarHBondContact O-N 3.35Å; I656-G659 PolarHBondContact O-N 2.79Å; I656-G659 VanDerWaalsContact O-N 3.13Å; I656-F660 HydrophobicContact CG2-CD2 4.13Å; I656-F660 PolarHBondContact O-N 3.35Å; I656-L703 HydrophobicContact CG2-CD1 4.09Å; I656-L703 HydrophobicContact CG2-CD2 3.58Å; I656-L703 HydrophobicContact CG2-CG 4.45Å
657	V	97	Very high	95.1	Very high	0 Å²	0	23.1 Å²	23.1	0%	0	13%	0.129	C	C	.	.	H	α-helix	trans	-58.3	-44	176.9	172.6	0	0	0	0	111.1	L653 R654 G659 F660 F661 L703 I741 W745 L746 L749	L653-V657 WeakPolarHBondContact O-CG2 3.49Å; L653-V657 PolarHBondContact O-N 2.97Å; R654-V657 WeakPolarHBondContact O-CB 3.43Å; R654-V657 PolarHBondContact O-N 2.93Å; V657-G659 PolarHBondContact O-N 3Å; V657-G659 VanDerWaalsContact O-N 3.11Å; V657-F660 PolarHBondContact O-N 3.18Å; V657-F661 HydrophobicContact CG1-CB 4.28Å; V657-F661 WeakPolarHBondContact O-CA 3.31Å; V657-F661 WeakPolarHBondContact O-CB 3.47Å; V657-F661 PolarHBondContact O-N 2.96Å; V657-L703 HydrophobicContact CG2-CD1 4.09Å; V657-I741 HydrophobicContact CG2-CB 4.25Å; V657-I741 HydrophobicContact CG2-CG2 3.58Å; V657-W745 HydrophobicContact CG2-CE3 4.36Å; V657-L746 HydrophobicContact CG1-CD2 4.05Å; V657-L749 HydrophobicContact CB-CD1 3.91Å; V657-L749 HydrophobicContact CG1-CB 4.22Å; V657-L749 HydrophobicContact CG1-CD1 3.76Å
658	R	95.4	Very high	95.4	Very high	47 Å²	47	20.1 Å²	20.1	18%	0.177	10%	0.098	C	C	.	.	H	α-helix	trans	-55.4	-31.6	177.3	-72.6	178.2	-179.8	-96.9	-10.6	113.8	G536 D539 E540 R654 A655 I656 L749	G536-R658 VanDerWaalsContact CA-CD 3.41Å; D539-R658 IonicContact OD2-CZ 2.8Å; D539-R658 IonicContact OD2-NH1 2.78Å; D539-R658 PolarHBondContact OD2-NH1 3.12Å; E540-R658 IonicContact OE1-CZ 2.68Å; E540-R658 VanDerWaalsContact OE1-CZ 3.22Å; E540-R658 IonicContact OE1-NE 3.97Å; E540-R658 PolarHBondContact OE1-NE 3.19Å; E540-R658 IonicContact OE1-NH2 3.55Å; E540-R658 PolarHBondContact OE1-NH2 2.84Å; R654-R658 WeakPolarHBondContact O-CG 3.35Å; R654-R658 PolarHBondContact O-N 3.08Å; A655-R658 PolarHBondContact O-N 3.01Å; I656-R658 VanDerWaalsContact C-N 3.34Å; I656-R658 PolarHBondContact O-N 3.35Å; R658-L749 HydrophobicContact CG-CB 4.29Å; R658-L749 HydrophobicContact CG-CD1 4.24Å; R658-L749 HydrophobicContact CG-CD2 4.21Å
659	G	95.4	Very high	95.3	Very high	0 Å²	0	24 Å²	24	0%	0	13%	0.128	C	C	.	.	H	α-helix	trans	-90.9	-38	177.5	0	0	0	0	0	114.5	L498 S529 A655 I656 V657 H662	L498-G659 WeakPolarHBondContact CD2-O 3.24Å; S529-G659 WeakPolarHBondContact CA-O 3.38Å; S529-G659 VanDerWaalsContact CB-O 3.23Å; S529-G659 WeakPolarHBondContact CB-O 3.36Å; S529-G659 VanDerWaalsContact O-CA 3.25Å; S529-G659 WeakPolarHBondContact O-CA 3.41Å; A655-G659 PolarHBondContact O-N 2.79Å; I656-G659 PolarHBondContact O-N 2.79Å; I656-G659 VanDerWaalsContact O-N 3.13Å; V657-G659 PolarHBondContact O-N 3Å; V657-G659 VanDerWaalsContact O-N 3.11Å; G659-H662 PolarHBondContact O-CE1 3.03Å
660	F	95.4	Very high	95.1	Very high	4 Å²	4	26.4 Å²	26.4	2%	0.018	15%	0.146	C	C	.	.	H	α-helix	trans	-118	17.6	-167.1	-65.2	-86.8	0	0	0	113.6	A533 M553 I656 V657 H662 Q663 L703 T705	A533-F660 HydrophobicContact CB-CD2 4.3Å; A533-F660 HydrophobicContact CB-CE2 4.05Å; M553-F660 HydrophobicContact CE-CE1 4.05Å; M553-F660 HydrophobicContact CE-CE2 4.37Å; M553-F660 HydrophobicContact CE-CZ 3.6Å; M553-F660 HydrophobicContact SD-CE2 4.42Å; M553-F660 HydrophobicContact SD-CZ 4.15Å; I656-F660 HydrophobicContact CG2-CD2 4.13Å; I656-F660 PolarHBondContact O-N 3.35Å; V657-F660 PolarHBondContact O-N 3.18Å; F660-H662 PolarHBondContact O-N 3.08Å; F660-Q663 PolarHBondContact O-N 3.14Å; F660-L703 HydrophobicContact CB-CD1 3.73Å; F660-L703 HydrophobicContact CB-CD2 3.72Å; F660-L703 HydrophobicContact CB-CG 4.03Å; F660-L703 HydrophobicContact CG-CD2 4.46Å; F660-L703 WeakPolarHBondContact O-CD1 3.39Å; F660-T705 HydrophobicContact CD1-CG2 3.95Å; F660-T705 HydrophobicContact CD2-CG2 4.39Å; F660-T705 HydrophobicContact CE1-CG2 4Å; F660-T705 HydrophobicContact CE2-CG2 4.45Å; F660-T705 HydrophobicContact CG-CG2 4.15Å; F660-T705 HydrophobicContact CZ-CG2 4.26Å
661	F	94.5	Very high	94.7	Very high	2 Å²	2	24.1 Å²	24.1	1%	0.009	14%	0.141	C	C	.	.	T	Hydrogen-bonded Turn	trans	-49.4	-30.3	-177.7	58.7	-97.2	0	0	0	113.8	A497 L498 V657 A664 L746 A750 Y753 Y754	A497-F661 HydrophobicContact CB-CE2 4.07Å; A497-F661 HydrophobicContact CB-CZ 3.86Å; A497-F661 VanDerWaalsContact O-CZ 3.22Å; A497-F661 WeakPolarHBondContact O-CZ 3.36Å; L498-F661 HydrophobicContact CD2-CE1 3.8Å; L498-F661 HydrophobicContact CD2-CZ 4.17Å; V657-F661 HydrophobicContact CG1-CB 4.28Å; V657-F661 WeakPolarHBondContact O-CA 3.31Å; V657-F661 WeakPolarHBondContact O-CB 3.47Å; V657-F661 PolarHBondContact O-N 2.96Å; F661-A664 WeakPolarHBondContact O-CB 3.46Å; F661-L746 HydrophobicContact CB-CD2 4.37Å; F661-A750 HydrophobicContact CB-CB 3.98Å; F661-A750 HydrophobicContact CD1-CB 4.07Å; F661-A750 HydrophobicContact CD2-CB 3.87Å; F661-A750 HydrophobicContact CE2-CB 4.43Å; F661-A750 HydrophobicContact CG-CB 3.7Å; F661-Y753 AromaticContact CD2-CD1 3.79Å; F661-Y753 HydrophobicContact CD2-CD1 3.79Å; F661-Y753 HydrophobicContact CD2-CD2 4.42Å; F661-Y753 HydrophobicContact CD2-CE1 4.31Å; F661-Y753 AromaticContact CD2-CG 3.84Å; F661-Y753 HydrophobicContact CD2-CG 3.84Å; F661-Y753 AromaticContact CE2-CD1 3.93Å; F661-Y753 HydrophobicContact CE2-CD1 3.93Å; F661-Y753 AromaticContact CE2-CD2 3.73Å; F661-Y753 HydrophobicContact CE2-CD2 3.73Å; F661-Y753 HydrophobicContact CE2-CE1 4.41Å; F661-Y753 HydrophobicContact CE2-CE2 4.23Å; F661-Y753 AromaticContact CE2-CG 3.55Å; F661-Y753 HydrophobicContact CE2-CG 3.55Å; F661-Y754 HydrophobicContact CB-CE2 4.13Å; F661-Y754 HydrophobicContact CD2-CE2 4.17Å; F661-Y754 VanDerWaalsContact O-CE2 3.31Å; F661-Y754 WeakPolarHBondContact O-CE2 3.45Å; F661-Y754 PolarHBondContact O-OH 2.94Å
662	H	91.2	Very high	94.2	Very high	20 Å²	20	27 Å²	27	9%	0.093	16%	0.161	C	C	.	.	T	Hydrogen-bonded Turn	trans	-78.1	-14.3	-179.7	55.3	-97.7	0	0	0	114.3	R494 S529 G659 F660 A664 Y753	R494-H662 VanDerWaalsContact CZ-CE1 3.41Å; R494-H662 PolarHBondContact NE-CD2 3.23Å; R494-H662 PolarHBondContact NE-CE1 2.72Å; R494-H662 VanDerWaalsContact NE-CG 3.32Å; R494-H662 PolarHBondContact NE-ND1 3.22Å; R494-H662 VanDerWaalsContact NE-ND1 3.18Å; R494-H662 PolarHBondContact NE-NE2 3.39Å; R494-H662 PolarHBondContact NH1-CD2 3.34Å; R494-H662 PolarHBondContact NH2-CD2 3.2Å; R494-H662 PolarHBondContact NH2-NE2 3.28Å; S529-H662 PolarHBondContact OG-CE1 2.7Å; S529-H662 PolarHBondContact OG-NE2 3.1Å; G659-H662 PolarHBondContact O-CE1 3.03Å; F660-H662 PolarHBondContact O-N 3.08Å; H662-A664 VanDerWaalsContact C-N 3.32Å; H662-Y753 HydrophobicContact CB-CE1 4.25Å
663	Q	93.8	Very high	93.9	Very high	18 Å²	18	28.3 Å²	28.3	8%	0.084	17%	0.167	C	C	.	.	S	Bend	trans	-100	49.4	172.3	-56.8	-170.5	-53.6	0	0	109.9	F660 L703 F704	F660-Q663 PolarHBondContact O-N 3.14Å; Q663-L703 CarbonylContact O-C 3.45Å; Q663-L703 WeakPolarHBondContact O-CA 3.36Å; Q663-F704 VanDerWaalsContact C-CE1 3.49Å; Q663-F704 HydrophobicContact CB-CD1 4.37Å; Q663-F704 HydrophobicContact CB-CD2 4.11Å; Q663-F704 HydrophobicContact CB-CE1 4.15Å; Q663-F704 HydrophobicContact CB-CE2 3.88Å; Q663-F704 HydrophobicContact CB-CG 4.35Å; Q663-F704 HydrophobicContact CB-CZ 3.9Å; Q663-F704 WeakPolarHBondContact CB-O 3.44Å; Q663-F704 HydrophobicContact CG-CE2 4.28Å; Q663-F704 WeakPolarHBondContact O-CD1 3.36Å; Q663-F704 WeakPolarHBondContact O-CE1 3.44Å; Q663-F704 PolarHBondContact O-N 3.33Å; Q663-F704 PolarHBondContact OE1-O 3.43Å
664	A	95.4	Very high	93.8	Very high	2 Å²	2	28 Å²	28	2%	0.017	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	146.9	176.9	0	0	0	0	0	110.7	F661 H662 I677 I702 I741 L746	F661-A664 WeakPolarHBondContact O-CB 3.46Å; H662-A664 VanDerWaalsContact C-N 3.32Å; A664-I677 HydrophobicContact CB-CD1 3.46Å; A664-I677 VanDerWaalsContact CB-CD1 3.46Å; A664-I677 HydrophobicContact CB-CG1 4.15Å; A664-I677 PolarHBondContact O-N 3.34Å; A664-I702 CarbonylContact C-O 3.51Å; A664-I702 WeakPolarHBondContact CA-O 3.49Å; A664-I741 HydrophobicContact CB-CD1 4.1Å; A664-L746 HydrophobicContact CB-CD1 4.13Å; A664-L746 HydrophobicContact CB-CD2 4.12Å
665	A	95.7	Very high	93.7	Very high	0 Å²	0	27.6 Å²	27.6	0%	0	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.3	148.5	179.6	0	0	0	0	0	111.2	Y674 L675 L683 Y701 I702 F704	A665-Y674 HydrophobicContact CB-CD1 4.35Å; A665-L675 CarbonylContact C-O 3.58Å; A665-L675 WeakPolarHBondContact CA-O 3.45Å; A665-L675 VanDerWaalsContact CB-O 3.31Å; A665-L675 WeakPolarHBondContact CB-O 3.44Å; A665-L683 HydrophobicContact CB-CD1 3.97Å; A665-Y701 WeakPolarHBondContact O-CA 3.18Å; A665-I702 HydrophobicContact CB-CD1 4.43Å; A665-I702 HydrophobicContact CB-CG1 3.99Å; A665-I702 PolarHBondContact N-O 3.4Å; A665-I702 PolarHBondContact O-N 2.97Å; A665-F704 HydrophobicContact CB-CD1 4.26Å; A665-F704 HydrophobicContact CB-CE1 4.12Å
666	R	95.4	Very high	93.5	Very high	78 Å²	78	28 Å²	28	29%	0.294	17%	0.169	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	145.5	176.1	67.4	-174.2	-179.3	100.7	-4.5	110.3	A668 Y674 L675 D680 A700 Y701	R666-A668 PolarHBondContact O-N 2.93Å; R666-Y674 CarbonylContact O-C 3.01Å; R666-Y674 WeakPolarHBondContact O-CA 3.28Å; R666-L675 HydrophobicContact CG-CB 4.24Å; R666-L675 PolarHBondContact N-O 3.18Å; R666-L675 PolarHBondContact O-N 3.14Å; R666-D680 IonicContact CZ-OD1 2.85Å; R666-D680 IonicContact NE-OD1 3.95Å; R666-D680 PolarHBondContact NE-OD1 3.33Å; R666-D680 IonicContact NH2-OD1 3.11Å; R666-D680 PolarHBondContact NH2-OD1 3.48Å; R666-D680 IonicContact NH2-OD2 3.81Å; R666-A700 CarbonylContact C-O 3.06Å; R666-A700 WeakPolarHBondContact CA-O 3.44Å; R666-Y701 HydrophobicContact CB-CD1 4.07Å; R666-Y701 HydrophobicContact CB-CE1 3.74Å
667	L	95.3	Very high	93.2	Very high	24 Å²	24	30 Å²	30	13%	0.126	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-66.8	129.9	173.6	-172	68.1	0	0	0	109.1	Y674 W698 A700	L667-Y674 HydrophobicContact CB-CD1 4.3Å; L667-Y674 HydrophobicContact CB-CE1 4.02Å; L667-Y674 HydrophobicContact CD1-CD1 4.4Å; L667-Y674 HydrophobicContact CD1-CD2 4.38Å; L667-Y674 HydrophobicContact CD1-CE1 4.07Å; L667-Y674 HydrophobicContact CD1-CE2 4.05Å; L667-W698 HydrophobicContact CD1-CB 3.99Å; L667-W698 HydrophobicContact CD1-CE3 3.82Å; L667-W698 HydrophobicContact CD2-CB 4.19Å; L667-A700 PolarHBondContact N-O 3.31Å
668	A	93.9	Very high	92.7	Very high	8 Å²	8	36.5 Å²	36.5	7%	0.066	20%	0.203	C	C	.	.			trans	-63	154.6	174.9	0	0	0	0	0	110.7	R666 S670 G671 H673 L675	R666-A668 PolarHBondContact O-N 2.93Å; A668-S670 PolarHBondContact O-N 3.45Å; A668-S670 VanDerWaalsContact O-N 3.08Å; A668-G671 PolarHBondContact O-N 2.91Å; A668-H673 WeakPolarHBondContact CB-NE2 3.45Å; A668-H673 WeakPolarHBondContact CB-O 3.36Å; A668-H673 PolarHBondContact N-O 3.35Å; A668-L675 HydrophobicContact CB-CD1 4.19Å; A668-L675 HydrophobicContact CB-CG 4.22Å
669	S	90.2	Very high	92.2	Very high	127 Å²	127	37.7 Å²	37.7	89%	0.888	23%	0.231	S	C	*	.	T	Hydrogen-bonded Turn	trans	-58.2	-27	179.2	-47.1	0	0	0	0	112.9	G671	S669-G671 PolarHBondContact O-N 3.46Å
670	S	89.1	Confident	91.9	Very high	80 Å²	80	41.7 Å²	41.7	56%	0.559	25%	0.252	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.6	-18.1	174.1	64.7	0	0	0	0	114	A668 S672	A668-S670 PolarHBondContact O-N 3.45Å; A668-S670 VanDerWaalsContact O-N 3.08Å; S670-S672 PolarHBondContact O-N 3.36Å; S670-S672 PolarHBondContact OG-N 2.9Å; S670-S672 PolarHBondContact OG-OG 3.5Å
671	G	87.3	Confident	91.7	Very high	31 Å²	31	43.7 Å²	43.7	32%	0.32	26%	0.261	S	S	.	.	S	Bend	trans	71.2	3.2	-173.5	0	0	0	0	0	115.2	A668 S669	A668-G671 PolarHBondContact O-N 2.91Å; S669-G671 PolarHBondContact O-N 3.46Å
672	S	87.1	Confident	91.6	Very high	75 Å²	75	47.5 Å²	47.5	52%	0.524	28%	0.279	S	S	.	.	S	Bend	trans	-95.8	-17.7	-171.2	63.5	0	0	0	0	115.2	S670	S670-S672 PolarHBondContact O-N 3.36Å; S670-S672 PolarHBondContact OG-N 2.9Å; S670-S672 PolarHBondContact OG-OG 3.5Å
673	H	91.6	Very high	91.7	Very high	31 Å²	31	46.5 Å²	46.5	14%	0.144	28%	0.275	C	S	.	.	S	Bend	trans	-155.5	170.4	-177.3	60.5	-82.2	0	0	0	110.1	A668 Q682 L683	A668-H673 WeakPolarHBondContact CB-NE2 3.45Å; A668-H673 WeakPolarHBondContact CB-O 3.36Å; A668-H673 PolarHBondContact N-O 3.35Å; H673-Q682 HydrophobicContact CB-CG 4.3Å; H673-L683 WeakPolarHBondContact CB-O 3.46Å
674	Y	94.8	Very high	91.7	Very high	0 Å²	0	50.4 Å²	50.4	0%	0	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.4	155	173.7	-73.2	-93.2	0	0	0	110.5	A665 R666 L667 L683 L685 W698 P699 I702	A665-Y674 HydrophobicContact CB-CD1 4.35Å; R666-Y674 CarbonylContact O-C 3.01Å; R666-Y674 WeakPolarHBondContact O-CA 3.28Å; L667-Y674 HydrophobicContact CB-CD1 4.3Å; L667-Y674 HydrophobicContact CB-CE1 4.02Å; L667-Y674 HydrophobicContact CD1-CD1 4.4Å; L667-Y674 HydrophobicContact CD1-CD2 4.38Å; L667-Y674 HydrophobicContact CD1-CE1 4.07Å; L667-Y674 HydrophobicContact CD1-CE2 4.05Å; Y674-L683 PolarHBondContact N-O 2.97Å; Y674-L683 PolarHBondContact O-N 3.41Å; Y674-L685 HydrophobicContact CD2-CD2 4.37Å; Y674-L685 HydrophobicContact CD2-CG 4.2Å; Y674-L685 HydrophobicContact CE2-CD1 3.91Å; Y674-L685 HydrophobicContact CE2-CD2 4.08Å; Y674-L685 HydrophobicContact CE2-CG 3.87Å; Y674-W698 HydrophobicContact CD2-CE3 4.32Å; Y674-W698 HydrophobicContact CE2-CD2 4.28Å; Y674-W698 AromaticContact CE2-CE3 3.65Å; Y674-W698 HydrophobicContact CE2-CE3 3.65Å; Y674-W698 HydrophobicContact CE2-CZ3 4.22Å; Y674-P699 WeakPolarHBondContact CE1-O 3.47Å; Y674-P699 PolarHBondContact OH-O 3.46Å; Y674-I702 HydrophobicContact CD1-CD1 3.52Å; Y674-I702 HydrophobicContact CD1-CG1 3.63Å; Y674-I702 HydrophobicContact CD2-CD1 3.89Å; Y674-I702 HydrophobicContact CE1-CB 4.27Å; Y674-I702 HydrophobicContact CE1-CD1 3.53Å; Y674-I702 HydrophobicContact CE1-CG1 3.57Å; Y674-I702 HydrophobicContact CE1-CG2 3.79Å; Y674-I702 HydrophobicContact CE2-CD1 3.9Å; Y674-I702 HydrophobicContact CG-CD1 3.7Å; Y674-I702 HydrophobicContact CG-CG1 4.29Å
675	L	94.3	Very high	91.5	Very high	27 Å²	27	50.6 Å²	50.6	14%	0.141	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	134.6	172.2	-61.2	173	0	0	0	108.1	A665 R666 A668 I677 H681 Q682	A665-L675 CarbonylContact C-O 3.58Å; A665-L675 WeakPolarHBondContact CA-O 3.45Å; A665-L675 VanDerWaalsContact CB-O 3.31Å; A665-L675 WeakPolarHBondContact CB-O 3.44Å; R666-L675 HydrophobicContact CG-CB 4.24Å; R666-L675 PolarHBondContact N-O 3.18Å; R666-L675 PolarHBondContact O-N 3.14Å; A668-L675 HydrophobicContact CB-CD1 4.19Å; A668-L675 HydrophobicContact CB-CG 4.22Å; L675-I677 PolarHBondContact O-N 2.85Å; L675-H681 WeakPolarHBondContact CA-O 3.36Å; L675-Q682 HydrophobicContact CD2-CB 4.34Å
676	T	93.4	Very high	91.1	Very high	9 Å²	9	52.5 Å²	52.5	6%	0.055	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-57.3	141.4	169.7	54.2	0	0	0	0	109.6	R678 D680 H681 L683 F704	T676-R678 VanDerWaalsContact C-N 3.25Å; T676-R678 WeakPolarHBondContact CB-O 3.45Å; T676-R678 PolarHBondContact O-N 3Å; T676-R678 PolarHBondContact OG1-O 3.31Å; T676-D680 WeakPolarHBondContact O-CA 3.49Å; T676-D680 PolarHBondContact O-N 3.1Å; T676-H681 HydrophobicContact CG2-CB 4.03Å; T676-H681 PolarHBondContact N-O 3.48Å; T676-H681 WeakPolarHBondContact OG1-CB 3.34Å; T676-H681 PolarHBondContact OG1-N 3.49Å; T676-L683 HydrophobicContact CG2-CD1 3.59Å; T676-L683 HydrophobicContact CG2-CD2 4.42Å; T676-L683 HydrophobicContact CG2-CG 4.12Å; T676-F704 HydrophobicContact CG2-CE1 4.49Å; T676-F704 HydrophobicContact CG2-CZ 4.31Å
677	I	91.3	Very high	90.6	Very high	47 Å²	47	52.3 Å²	52.3	24%	0.241	31%	0.307	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63.1	-38.8	178.6	-61.4	-179.8	0	0	0	110.4	A664 L675 Y701 L746 Y754	A664-I677 HydrophobicContact CB-CD1 3.46Å; A664-I677 VanDerWaalsContact CB-CD1 3.46Å; A664-I677 HydrophobicContact CB-CG1 4.15Å; A664-I677 PolarHBondContact O-N 3.34Å; L675-I677 PolarHBondContact O-N 2.85Å; I677-Y701 HydrophobicContact CD1-CD1 4.07Å; I677-Y701 HydrophobicContact CD1-CE1 4.15Å; I677-L746 HydrophobicContact CD1-CD1 3.36Å; I677-Y754 HydrophobicContact CB-CE1 4.16Å; I677-Y754 HydrophobicContact CD1-CE1 4.29Å; I677-Y754 HydrophobicContact CG2-CD1 4.21Å; I677-Y754 HydrophobicContact CG2-CE1 3.59Å
678	R	85.4	Confident	90	Very high	136 Å²	136	54 Å²	54	51%	0.513	32%	0.316	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.6	120.3	172.4	-168	172.2	-178.9	170.7	-0.1	109.5	E493 T676 D680 Y753	E493-R678 IonicContact OE1-CZ 3.29Å; E493-R678 VanDerWaalsContact OE1-CZ 3.28Å; E493-R678 IonicContact OE1-NH1 2.79Å; E493-R678 PolarHBondContact OE1-NH1 2.62Å; E493-R678 IonicContact OE1-NH2 3.73Å; E493-R678 PolarHBondContact OE1-NH2 2.86Å; E493-R678 IonicContact OE2-NH2 3.02Å; T676-R678 VanDerWaalsContact C-N 3.25Å; T676-R678 WeakPolarHBondContact CB-O 3.45Å; T676-R678 PolarHBondContact O-N 3Å; T676-R678 PolarHBondContact OG1-O 3.31Å; R678-D680 PolarHBondContact O-N 3.47Å; R678-Y753 WeakPolarHBondContact CD-OH 3.34Å; R678-Y753 PolarHBondContact NH1-OH 3.22Å
679	G	85.2	Confident	89.7	Confident	73 Å²	73	53.8 Å²	53.8	75%	0.753	31%	0.314	S	S	*	.	T	Hydrogen-bonded Turn	trans	82.2	2.4	171.8	0	0	0	0	0	116.5	H681	G679-H681 PolarHBondContact O-N 2.8Å; G679-H681 VanDerWaalsContact O-N 3.11Å
680	D	89.9	Confident	89.6	Confident	84 Å²	84	48.5 Å²	48.5	45%	0.449	28%	0.276	S	S	.	.	T	Hydrogen-bonded Turn	trans	49.4	38	176.2	-69.6	-47.4	0	0	0	114.5	R666 T676 R678	R666-D680 IonicContact CZ-OD1 2.85Å; R666-D680 IonicContact NE-OD1 3.95Å; R666-D680 PolarHBondContact NE-OD1 3.33Å; R666-D680 IonicContact NH2-OD1 3.11Å; R666-D680 PolarHBondContact NH2-OD1 3.48Å; R666-D680 IonicContact NH2-OD2 3.81Å; T676-D680 WeakPolarHBondContact O-CA 3.49Å; T676-D680 PolarHBondContact O-N 3.1Å; R678-D680 PolarHBondContact O-N 3.47Å
681	H	91	Very high	89.6	Confident	46 Å²	46	45 Å²	45	21%	0.213	25%	0.251	C	S	.	.			trans	-72.9	131.4	178.2	-173.3	73.5	0	0	0	110.4	N403 L675 T676 G679 T733	N403-H681 HydrophobicContact CB-CB 4.31Å; L675-H681 WeakPolarHBondContact CA-O 3.36Å; T676-H681 HydrophobicContact CG2-CB 4.03Å; T676-H681 PolarHBondContact N-O 3.48Å; T676-H681 WeakPolarHBondContact OG1-CB 3.34Å; T676-H681 PolarHBondContact OG1-N 3.49Å; G679-H681 PolarHBondContact O-N 2.8Å; G679-H681 VanDerWaalsContact O-N 3.11Å; H681-T733 PolarHBondContact NE2-OG1 2.92Å
682	Q	93.1	Very high	89.4	Confident	81 Å²	81	49 Å²	49	38%	0.379	26%	0.257	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.5	128.3	-176.8	-179.1	169.9	5.1	0	0	112.5	H673 L675	H673-Q682 HydrophobicContact CB-CG 4.3Å; L675-Q682 HydrophobicContact CD2-CB 4.34Å
683	L	93.3	Very high	88.8	Confident	0 Å²	0	46.4 Å²	46.4	0%	0	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	137.6	-178.5	-57	175.5	0	0	0	111.1	L405 A665 H673 Y674 T676 F704 T733 I735	L405-L683 HydrophobicContact CD1-CD2 4.09Å; A665-L683 HydrophobicContact CB-CD1 3.97Å; H673-L683 WeakPolarHBondContact CB-O 3.46Å; Y674-L683 PolarHBondContact N-O 2.97Å; Y674-L683 PolarHBondContact O-N 3.41Å; T676-L683 HydrophobicContact CG2-CD1 3.59Å; T676-L683 HydrophobicContact CG2-CD2 4.42Å; T676-L683 HydrophobicContact CG2-CG 4.12Å; L683-F704 HydrophobicContact CD1-CD1 4.17Å; L683-F704 HydrophobicContact CD1-CE1 3.65Å; L683-F704 HydrophobicContact CD1-CZ 3.95Å; L683-T733 HydrophobicContact CD2-CG2 3.55Å; L683-I735 HydrophobicContact CB-CD1 4.26Å; L683-I735 HydrophobicContact CB-CG1 4.36Å; L683-I735 HydrophobicContact CB-CG2 4.3Å; L683-I735 HydrophobicContact CD1-CD1 4.24Å; L683-I735 HydrophobicContact CD1-CG2 4.02Å; L683-I735 HydrophobicContact CD2-CG2 3.91Å; L683-I735 HydrophobicContact CG-CG2 4.31Å
684	R	92.6	Very high	87.9	Confident	99 Å²	99	46.8 Å²	46.8	37%	0.374	25%	0.245	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	144.1	170.3	-67.9	-175.1	-179.3	177	0.1	110.6	H686 T733 C734 I735	R684-H686 PolarHBondContact O-N 3.45Å; R684-T733 PolarHBondContact N-O 3.35Å; R684-C734 CarbonylContact O-C 3.47Å; R684-C734 WeakPolarHBondContact O-CA 3.49Å; R684-I735 WeakPolarHBondContact O-CG1 3.22Å; R684-I735 PolarHBondContact O-N 3.29Å
685	L	91.1	Very high	86.6	Confident	6 Å²	6	54 Å²	54	3%	0.031	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.4	133.2	170.4	-69.3	178.4	0	0	0	109.8	Y674 L691 Y692 W698 I702 I735 V738	Y674-L685 HydrophobicContact CD2-CD2 4.37Å; Y674-L685 HydrophobicContact CD2-CG 4.2Å; Y674-L685 HydrophobicContact CE2-CD1 3.91Å; Y674-L685 HydrophobicContact CE2-CD2 4.08Å; Y674-L685 HydrophobicContact CE2-CG 3.87Å; L685-L691 HydrophobicContact CD1-CB 4.05Å; L685-Y692 HydrophobicContact CB-CD2 4.09Å; L685-W698 HydrophobicContact CD1-CD2 4.05Å; L685-W698 HydrophobicContact CD1-CE3 4.26Å; L685-W698 HydrophobicContact CD1-CH2 4.24Å; L685-W698 HydrophobicContact CD1-CZ2 4Å; L685-W698 HydrophobicContact CD1-CZ3 4.36Å; L685-I702 HydrophobicContact CD2-CD1 4.2Å; L685-I735 HydrophobicContact CD2-CD1 4.13Å; L685-I735 HydrophobicContact CD2-CG1 4.24Å; L685-V738 HydrophobicContact CD2-CG1 4.39Å; L685-V738 HydrophobicContact CD2-CG2 3.81Å
686	H	88	Confident	85.6	Confident	41 Å²	41	56.3 Å²	56.3	19%	0.19	30%	0.304	C	S	.	.			trans	-64.4	142.3	171.3	-172.7	-87	0	0	0	109.5	R684 N688 C689 I735	R684-H686 PolarHBondContact O-N 3.45Å; H686-N688 VanDerWaalsContact CE1-CG 3.47Å; H686-N688 PolarHBondContact CE1-ND2 3.44Å; H686-N688 WeakPolarHBondContact ND1-CB 3.45Å; H686-N688 PolarHBondContact ND1-N 3.49Å; H686-N688 VanDerWaalsContact ND1-N 3.18Å; H686-N688 PolarHBondContact O-N 3.45Å; H686-C689 WeakPolarHBondContact O-CB 3.44Å; H686-C689 PolarHBondContact O-N 2.88Å; H686-I735 WeakPolarHBondContact CB-O 3.31Å; H686-I735 PolarHBondContact N-O 2.93Å
687	P	84.1	Confident	85.1	Confident	74 Å²	74	66.3 Å²	66.3	48%	0.481	34%	0.341	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.2	-21	-177.7	-28.5	35.6	0	0	0	115.2	Y692	P687-Y692 HydrophobicContact CB-CD1 4.45Å; P687-Y692 HydrophobicContact CB-CE1 4.32Å
688	N	82.7	Confident	85	Confident	60 Å²	60	67 Å²	67	32%	0.321	34%	0.341	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.6	-12.3	177.3	-64.5	-9.3	0	0	0	113.6	R573 H686	R573-N688 PolarHBondContact NE-O 3.47Å; R573-N688 VanDerWaalsContact NE-O 3.08Å; R573-N688 PolarHBondContact NH1-O 2.98Å; R573-N688 PolarHBondContact NH2-O 3.3Å; H686-N688 VanDerWaalsContact CE1-CG 3.47Å; H686-N688 PolarHBondContact CE1-ND2 3.44Å; H686-N688 WeakPolarHBondContact ND1-CB 3.45Å; H686-N688 PolarHBondContact ND1-N 3.49Å; H686-N688 VanDerWaalsContact ND1-N 3.18Å; H686-N688 PolarHBondContact O-N 3.45Å
689	C	88.4	Confident	85.4	Confident	2 Å²	2	61.9 Å²	61.9	1%	0.014	33%	0.325	C	S	.	.	S	Bend	trans	-63.2	138.3	178.3	-71.2	0	0	0	0	110.6	D582 H686 L691 Y692 I735 S736	D582-C689 WeakPolarHBondContact OD1-CA 3.38Å; D582-C689 PolarHBondContact OD2-SG 3.28Å; H686-C689 WeakPolarHBondContact O-CB 3.44Å; H686-C689 PolarHBondContact O-N 2.88Å; C689-L691 PolarHBondContact O-N 3.17Å; C689-Y692 WeakPolarHBondContact O-CB 3.2Å; C689-Y692 PolarHBondContact O-N 3.23Å; C689-I735 PolarHBondContact SG-O 3.2Å; C689-S736 VanDerWaalsContact SG-CA 3.59Å
690	I	88.5	Confident	85.8	Confident	17 Å²	17	61.3 Å²	61.3	9%	0.087	31%	0.313	C	S	.	.	G	3₁₀ helix	trans	-57.5	-38.3	178.8	-166.6	63.5	0	0	0	111.3	Q574 D582 Y692 S693	Q574-I690 HydrophobicContact CG-CD1 4.08Å; D582-I690 PolarHBondContact OD1-N 3.34Å; I690-Y692 VanDerWaalsContact C-N 3.28Å; I690-Y692 PolarHBondContact O-N 3.16Å; I690-S693 PolarHBondContact O-N 3.17Å; I690-S693 PolarHBondContact O-OG 2.88Å
691	L	87.7	Confident	86.1	Confident	7 Å²	7	61 Å²	61	4%	0.037	31%	0.306	C	S	.	.	G	3₁₀ helix	trans	-66	-25.1	177.4	-63.9	177.8	0	0	0	113.7	Q579 L685 C689 S693 S694 W698 P699 I702 V738 V740	Q579-L691 WeakPolarHBondContact O-CD2 3.32Å; L685-L691 HydrophobicContact CD1-CB 4.05Å; C689-L691 PolarHBondContact O-N 3.17Å; L691-S693 PolarHBondContact O-N 3.07Å; L691-S694 WeakPolarHBondContact O-CB 3.43Å; L691-S694 PolarHBondContact O-N 3.31Å; L691-W698 PolarHBondContact O-NE1 3.01Å; L691-P699 HydrophobicContact CD1-CG 4.29Å; L691-P699 HydrophobicContact CD2-CG 4.18Å; L691-I702 HydrophobicContact CD1-CG2 4.37Å; L691-V738 HydrophobicContact CD1-CB 4.44Å; L691-V738 HydrophobicContact CD1-CG1 3.74Å; L691-V740 HydrophobicContact CD1-CG2 4.19Å; L691-V740 HydrophobicContact CD2-CG2 4.39Å
692	Y	84.8	Confident	86.4	Confident	114 Å²	114	58.8 Å²	58.8	45%	0.447	30%	0.296	S	S	.	.	G	3₁₀ helix	trans	-63.1	-34.4	178.1	-172.6	-89.4	0	0	0	111.4	L685 P687 C689 I690 S694	L685-Y692 HydrophobicContact CB-CD2 4.09Å; P687-Y692 HydrophobicContact CB-CD1 4.45Å; P687-Y692 HydrophobicContact CB-CE1 4.32Å; C689-Y692 WeakPolarHBondContact O-CB 3.2Å; C689-Y692 PolarHBondContact O-N 3.23Å; I690-Y692 VanDerWaalsContact C-N 3.28Å; I690-Y692 PolarHBondContact O-N 3.16Å; Y692-S694 VanDerWaalsContact C-N 3.33Å
693	S	74.3	Confident	86.5	Confident	20 Å²	20	54.9 Å²	54.9	14%	0.14	28%	0.278	C	S	.	.	G	3₁₀ helix	trans	-88.9	1.4	-179.9	70.7	0	0	0	0	114.2	Q574 I690 L691	Q574-S693 PolarHBondContact NE2-OG 2.97Å; I690-S693 PolarHBondContact O-N 3.17Å; I690-S693 PolarHBondContact O-OG 2.88Å; L691-S693 PolarHBondContact O-N 3.07Å
694	S	72.8	Confident	86.7	Confident	40 Å²	40	55 Å²	55	28%	0.28	28%	0.278	S	S	.	.			trans	-70.8	133.7	-176.3	-160.1	0	0	0	0	111.2	L691 Y692 T696	L691-S694 WeakPolarHBondContact O-CB 3.43Å; L691-S694 PolarHBondContact O-N 3.31Å; Y692-S694 VanDerWaalsContact C-N 3.33Å; S694-T696 VanDerWaalsContact C-N 3.27Å; S694-T696 PolarHBondContact OG-N 3.23Å; S694-T696 PolarHBondContact OG-OG1 3.38Å
695	T	66.2	Low	86.7	Confident	150 Å²	150	50.7 Å²	50.7	92%	0.92	26%	0.263	S	S	*	.	S	Bend	trans	-79.8	-14	169.6	51.1	0	0	0	0	112.1
696	T	73.2	Confident	86.6	Confident	76 Å²	76	53.4 Å²	53.4	47%	0.466	28%	0.278	S	S	.	.	S	Bend	trans	-82.9	155.1	175.6	57.1	0	0	0	0	111.4	S694 W698	S694-T696 VanDerWaalsContact C-N 3.27Å; S694-T696 PolarHBondContact OG-N 3.23Å; S694-T696 PolarHBondContact OG-OG1 3.38Å; T696-W698 PolarHBondContact O-N 2.97Å
697	R	83.2	Confident	86.8	Confident	220 Å²	220	52.1 Å²	52.1	83%	0.83	27%	0.273	S	S	*	.	P	Polyproline II helix	trans	-52.8	134.9	172	-173.6	178.7	-179.4	-178.2	1.4	109.6
698	W	90.3	Very high	87	Confident	60 Å²	60	52.5 Å²	52.5	23%	0.227	27%	0.267	C	S	.	.	P	Polyproline II helix	trans	-58.4	141.4	178.2	-73.6	-1.8	0	0	0	111.9	L667 Y674 L685 L691 T696	L667-W698 HydrophobicContact CD1-CB 3.99Å; L667-W698 HydrophobicContact CD1-CE3 3.82Å; L667-W698 HydrophobicContact CD2-CB 4.19Å; Y674-W698 HydrophobicContact CD2-CE3 4.32Å; Y674-W698 HydrophobicContact CE2-CD2 4.28Å; Y674-W698 AromaticContact CE2-CE3 3.65Å; Y674-W698 HydrophobicContact CE2-CE3 3.65Å; Y674-W698 HydrophobicContact CE2-CZ3 4.22Å; L685-W698 HydrophobicContact CD1-CD2 4.05Å; L685-W698 HydrophobicContact CD1-CE3 4.26Å; L685-W698 HydrophobicContact CD1-CH2 4.24Å; L685-W698 HydrophobicContact CD1-CZ2 4Å; L685-W698 HydrophobicContact CD1-CZ3 4.36Å; L691-W698 PolarHBondContact O-NE1 3.01Å; T696-W698 PolarHBondContact O-N 2.97Å
699	P	93.4	Very high	87	Confident	30 Å²	30	53 Å²	53	20%	0.195	27%	0.269	C	S	.	.	P	Polyproline II helix	trans	-57.5	146.2	177.3	-25.1	34.4	0	0	0	112.6	Y674 L691 Y701 I702 V740	Y674-P699 WeakPolarHBondContact CE1-O 3.47Å; Y674-P699 PolarHBondContact OH-O 3.46Å; L691-P699 HydrophobicContact CD1-CG 4.29Å; L691-P699 HydrophobicContact CD2-CG 4.18Å; P699-Y701 PolarHBondContact O-N 3.34Å; P699-I702 HydrophobicContact CB-CG2 4.27Å; P699-V740 HydrophobicContact CB-CG1 3.83Å; P699-V740 HydrophobicContact CB-CG2 4Å; P699-V740 HydrophobicContact CG-CG1 4.21Å; P699-V740 HydrophobicContact CG-CG2 3.56Å
700	A	93.7	Very high	86.2	Confident	60 Å²	60	54.8 Å²	54.8	50%	0.496	28%	0.28	S	S	.	.	S	Bend	trans	-67.3	-36.9	-177.5	0	0	0	0	0	112.8	R666 L667	R666-A700 CarbonylContact C-O 3.06Å; R666-A700 WeakPolarHBondContact CA-O 3.44Å; L667-A700 PolarHBondContact N-O 3.31Å
701	Y	96	Very high	85	Confident	77 Å²	77	59.1 Å²	59.1	30%	0.302	31%	0.31	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.5	137.4	-179.3	-72.2	-94.3	0	0	0	110.7	A665 R666 I677 P699 I741 P743	A665-Y701 WeakPolarHBondContact O-CA 3.18Å; R666-Y701 HydrophobicContact CB-CD1 4.07Å; R666-Y701 HydrophobicContact CB-CE1 3.74Å; I677-Y701 HydrophobicContact CD1-CD1 4.07Å; I677-Y701 HydrophobicContact CD1-CE1 4.15Å; P699-Y701 PolarHBondContact O-N 3.34Å; Y701-I741 PolarHBondContact O-N 3.47Å; Y701-P743 HydrophobicContact CD2-CB 4Å; Y701-P743 HydrophobicContact CD2-CG 4.19Å; Y701-P743 HydrophobicContact CE2-CB 3.97Å; Y701-P743 HydrophobicContact CE2-CG 4.26Å; Y701-P743 HydrophobicContact CG-CB 4.3Å
702	I	96.8	Very high	83.1	Confident	0 Å²	0	60.6 Å²	60.6	0%	0	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.5	158.8	177.8	63.4	169.9	0	0	0	110.9	A664 A665 Y674 L685 L691 P699 I735 V738 S739	A664-I702 CarbonylContact C-O 3.51Å; A664-I702 WeakPolarHBondContact CA-O 3.49Å; A665-I702 HydrophobicContact CB-CD1 4.43Å; A665-I702 HydrophobicContact CB-CG1 3.99Å; A665-I702 PolarHBondContact N-O 3.4Å; A665-I702 PolarHBondContact O-N 2.97Å; Y674-I702 HydrophobicContact CD1-CD1 3.52Å; Y674-I702 HydrophobicContact CD1-CG1 3.63Å; Y674-I702 HydrophobicContact CD2-CD1 3.89Å; Y674-I702 HydrophobicContact CE1-CB 4.27Å; Y674-I702 HydrophobicContact CE1-CD1 3.53Å; Y674-I702 HydrophobicContact CE1-CG1 3.57Å; Y674-I702 HydrophobicContact CE1-CG2 3.79Å; Y674-I702 HydrophobicContact CE2-CD1 3.9Å; Y674-I702 HydrophobicContact CG-CD1 3.7Å; Y674-I702 HydrophobicContact CG-CG1 4.29Å; L685-I702 HydrophobicContact CD2-CD1 4.2Å; L691-I702 HydrophobicContact CD1-CG2 4.37Å; P699-I702 HydrophobicContact CB-CG2 4.27Å; I702-I735 HydrophobicContact CD1-CD1 3.6Å; I702-V738 HydrophobicContact CB-CG1 3.65Å; I702-V738 HydrophobicContact CD1-CG1 3.64Å; I702-V738 HydrophobicContact CG1-CG1 4.17Å; I702-V738 HydrophobicContact CG2-CG1 3.81Å; I702-S739 CarbonylContact C-O 3.34Å; I702-S739 VanDerWaalsContact CA-O 3.25Å; I702-S739 WeakPolarHBondContact CA-O 3.4Å
703	L	96.4	Very high	81	Confident	0 Å²	0	61.8 Å²	61.8	0%	0	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	145.1	164.2	-174.9	148.8	0	0	0	108.5	I656 V657 F660 Q663 T705 V738 S739 I741	I656-L703 HydrophobicContact CG2-CD1 4.09Å; I656-L703 HydrophobicContact CG2-CD2 3.58Å; I656-L703 HydrophobicContact CG2-CG 4.45Å; V657-L703 HydrophobicContact CG2-CD1 4.09Å; F660-L703 HydrophobicContact CB-CD1 3.73Å; F660-L703 HydrophobicContact CB-CD2 3.72Å; F660-L703 HydrophobicContact CB-CG 4.03Å; F660-L703 HydrophobicContact CG-CD2 4.46Å; F660-L703 WeakPolarHBondContact O-CD1 3.39Å; Q663-L703 CarbonylContact O-C 3.45Å; Q663-L703 WeakPolarHBondContact O-CA 3.36Å; L703-T705 HydrophobicContact CD2-CG2 4.08Å; L703-V738 CarbonylContact O-C 3.49Å; L703-V738 WeakPolarHBondContact O-CA 3.3Å; L703-S739 PolarHBondContact N-O 2.96Å; L703-S739 PolarHBondContact O-N 3.16Å; L703-I741 HydrophobicContact CB-CD1 4.34Å; L703-I741 HydrophobicContact CB-CG2 3.88Å
704	F	95.5	Very high	79.1	Confident	1 Å²	1	66.9 Å²	66.9	0%	0.004	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	152.6	175.8	61	-87.6	0	0	0	110.9	L405 Q663 A665 T676 L683 V707 I735 G737 V738	L405-F704 HydrophobicContact CD2-CE2 3.85Å; L405-F704 HydrophobicContact CD2-CZ 3.9Å; Q663-F704 VanDerWaalsContact C-CE1 3.49Å; Q663-F704 HydrophobicContact CB-CD1 4.37Å; Q663-F704 HydrophobicContact CB-CD2 4.11Å; Q663-F704 HydrophobicContact CB-CE1 4.15Å; Q663-F704 HydrophobicContact CB-CE2 3.88Å; Q663-F704 HydrophobicContact CB-CG 4.35Å; Q663-F704 HydrophobicContact CB-CZ 3.9Å; Q663-F704 WeakPolarHBondContact CB-O 3.44Å; Q663-F704 HydrophobicContact CG-CE2 4.28Å; Q663-F704 WeakPolarHBondContact O-CD1 3.36Å; Q663-F704 WeakPolarHBondContact O-CE1 3.44Å; Q663-F704 PolarHBondContact O-N 3.33Å; Q663-F704 PolarHBondContact OE1-O 3.43Å; A665-F704 HydrophobicContact CB-CD1 4.26Å; A665-F704 HydrophobicContact CB-CE1 4.12Å; T676-F704 HydrophobicContact CG2-CE1 4.49Å; T676-F704 HydrophobicContact CG2-CZ 4.31Å; L683-F704 HydrophobicContact CD1-CD1 4.17Å; L683-F704 HydrophobicContact CD1-CE1 3.65Å; L683-F704 HydrophobicContact CD1-CZ 3.95Å; F704-V707 HydrophobicContact CD2-CG2 4.02Å; F704-V707 HydrophobicContact CE2-CG2 3.79Å; F704-I735 HydrophobicContact CB-CB 3.98Å; F704-I735 HydrophobicContact CB-CD1 3.97Å; F704-I735 HydrophobicContact CB-CG2 4.29Å; F704-I735 HydrophobicContact CD1-CD1 4.16Å; F704-I735 HydrophobicContact CD1-CG2 4.44Å; F704-I735 HydrophobicContact CD2-CB 4.3Å; F704-I735 HydrophobicContact CD2-CG2 3.72Å; F704-I735 HydrophobicContact CE2-CG2 4.14Å; F704-I735 HydrophobicContact CG-CB 4.14Å; F704-I735 HydrophobicContact CG-CD1 4.16Å; F704-I735 HydrophobicContact CG-CG2 3.89Å; F704-G737 WeakPolarHBondContact CA-O 3.49Å; F704-V738 HydrophobicContact CB-CG2 4.43Å
705	T	93	Very high	77	Confident	10 Å²	10	75.5 Å²	75.5	6%	0.061	39%	0.387	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	-24	179.5	51.5	0	0	0	0	113.8	M553 H583 F660 L703 S736 G737	M553-T705 HydrophobicContact CE-CG2 3.7Å; M553-T705 HydrophobicContact SD-CG2 4.44Å; H583-T705 VanDerWaalsContact NE2-CG2 3.28Å; H583-T705 WeakPolarHBondContact NE2-CG2 3.43Å; H583-T705 PolarHBondContact NE2-OG1 2.92Å; F660-T705 HydrophobicContact CD1-CG2 3.95Å; F660-T705 HydrophobicContact CD2-CG2 4.39Å; F660-T705 HydrophobicContact CE1-CG2 4Å; F660-T705 HydrophobicContact CE2-CG2 4.45Å; F660-T705 HydrophobicContact CG-CG2 4.15Å; F660-T705 HydrophobicContact CZ-CG2 4.26Å; L703-T705 HydrophobicContact CD2-CG2 4.08Å; T705-S736 PolarHBondContact N-O 2.75Å; T705-G737 PolarHBondContact N-O 3.26Å; T705-G737 PolarHBondContact OG1-O 3.42Å
706	N	90.4	Very high	75.1	Confident	63 Å²	63	75.1 Å²	75.1	34%	0.337	38%	0.38	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	138.3	-178.6	-68.7	-47.2	0	0	0	111.4	F708 I735 S736	N706-F708 HydrophobicContact CB-CE2 3.75Å; N706-F708 HydrophobicContact CB-CZ 4.09Å; N706-I735 CarbonylContact O-C 3.47Å; N706-I735 VanDerWaalsContact O-CA 3.29Å; N706-I735 WeakPolarHBondContact O-CA 3.48Å; N706-S736 WeakPolarHBondContact CB-OG 3.26Å; N706-S736 PolarHBondContact N-O 3.46Å; N706-S736 PolarHBondContact O-N 3.25Å
707	V	90.8	Very high	72.8	Confident	14 Å²	14	78.4 Å²	78.4	9%	0.085	40%	0.395	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	134.8	177.9	-173.1	0	0	0	0	109.7	L405 A407 F704 T733 C734 I735	L405-V707 HydrophobicContact CD1-CG1 4.38Å; L405-V707 HydrophobicContact CD2-CG2 4.28Å; A407-V707 HydrophobicContact CB-CB 4.48Å; A407-V707 HydrophobicContact CB-CG1 4.28Å; F704-V707 HydrophobicContact CD2-CG2 4.02Å; F704-V707 HydrophobicContact CE2-CG2 3.79Å; V707-T733 HydrophobicContact CG1-CG2 3.47Å; V707-T733 VanDerWaalsContact CG1-CG2 3.47Å; V707-C734 CarbonylContact C-O 3.58Å; V707-C734 WeakPolarHBondContact CA-O 3.46Å; V707-I735 HydrophobicContact CG2-CG2 4.38Å
708	F	88	Confident	70.1	Confident	81 Å²	81	75 Å²	75	36%	0.355	39%	0.393	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	137.8	178.1	-56.1	-90.5	0	0	0	109.2	N706 C734 S736	N706-F708 HydrophobicContact CB-CE2 3.75Å; N706-F708 HydrophobicContact CB-CZ 4.09Å; F708-C734 HydrophobicContact CB-CB 4.26Å; F708-C734 PolarHBondContact N-O 3.06Å; F708-C734 PolarHBondContact O-N 3.39Å; F708-S736 VanDerWaalsContact CE2-OG 3.3Å; F708-S736 WeakPolarHBondContact CE2-OG 3.49Å
709	L	84.5	Confident	67.1	Low	70 Å²	70	78.6 Å²	78.6	37%	0.366	42%	0.421	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.5	129.2	166.3	-59.6	-176.9	0	0	0	108.6	A407 V409 T733	A407-L709 HydrophobicContact CB-CD1 4.44Å; A407-L709 HydrophobicContact CB-CD2 4.49Å; A407-L709 HydrophobicContact CB-CG 3.94Å; V409-L709 HydrophobicContact CG1-CD1 4.47Å; V409-L709 HydrophobicContact CG2-CD1 3.67Å; L709-T733 HydrophobicContact CD2-CG2 4.46Å
710	T	71.3	Confident	63.8	Low	40 Å²	40	87.6 Å²	87.6	25%	0.245	46%	0.458	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	139.8	172.9	47.1	0	0	0	0	109	S712 S731 S732 C734	T710-S712 PolarHBondContact O-N 3.15Å; T710-S731 CarbonylContact O-C 3.6Å; T710-S731 VanDerWaalsContact O-CA 3.28Å; T710-S731 WeakPolarHBondContact O-CA 3.28Å; T710-S731 WeakPolarHBondContact O-CB 3.38Å; T710-S732 PolarHBondContact N-O 3.23Å; T710-S732 PolarHBondContact O-N 3.17Å; T710-S732 PolarHBondContact OG1-O 2.83Å; T710-S732 PolarHBondContact OG1-OG 2.94Å; T710-C734 HydrophobicContact CG2-CB 4.41Å; T710-C734 PolarHBondContact OG1-SG 2.94Å; T710-C734 VanDerWaalsContact OG1-SG 3.39Å
711	P	62.2	Low	60.7	Low	109 Å²	109	88.8 Å²	88.8	71%	0.708	46%	0.462	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-55.6	131.9	166.7	-15.4	27.8	0	0	0	108	L713	P711-L713 PolarHBondContact O-N 2.93Å; P711-L713 VanDerWaalsContact O-N 3.12Å
712	S	48.5	Very low	57.4	Low	38 Å²	38	92.7 Å²	92.7	27%	0.266	49%	0.488	S	S	.	.			trans	-56.8	120.2	175.4	54.1	0	0	0	0	109	T710 D714 L730	T710-S712 PolarHBondContact O-N 3.15Å; S712-D714 PolarHBondContact O-N 3.14Å; S712-D714 VanDerWaalsContact O-N 3.08Å; S712-L730 PolarHBondContact N-O 2.79Å; S712-L730 PolarHBondContact OG-O 3.34Å; S712-L730 VanDerWaalsContact OG-O 3.09Å
713	L	41.4	Very low	54.1	Low	139 Å²	139	100.6 Å²	100.6	73%	0.728	53%	0.529	S	S	*	.			trans	-69.6	4.7	178.2	-96.7	150.2	0	0	0	113.7	P711 Y715	P711-L713 PolarHBondContact O-N 2.93Å; P711-L713 VanDerWaalsContact O-N 3.12Å; L713-Y715 PolarHBondContact O-N 3.49Å
714	D	34.1	Very low	50.9	Low	126 Å²	126	107.4 Å²	107.4	67%	0.674	57%	0.565	S	S	*	*			trans	-81.1	51.7	-176.8	-62.8	-17.8	0	0	0	112	S712	S712-D714 PolarHBondContact O-N 3.14Å; S712-D714 VanDerWaalsContact O-N 3.08Å
715	Y	28.2	Very low	47.6	Very low	221 Å²	221	114.1 Å²	114.1	87%	0.867	60%	0.601	S	S	*	*			trans	-126.1	32.1	166.2	-123.3	-82.9	0	0	0	111.5	L713	L713-Y715 PolarHBondContact O-N 3.49Å
716	N	25.8	Very low	44.7	Very low	143 Å²	143	120.4 Å²	120.4	77%	0.765	64%	0.635	S	S	*	*	S	Bend	trans	-115.7	132.7	164.2	-86.1	-23	0	0	0	110.2
717	N	26.1	Very low	41.9	Very low	145 Å²	145	127.4 Å²	127.4	78%	0.775	66%	0.662	S	S	*	*	S	Bend	trans	-33.2	152	178.5	-65.1	-38.9	0	0	0	116.5
718	D	26.6	Very low	39.4	Very low	148 Å²	148	133.7 Å²	133.7	79%	0.791	70%	0.695	S	S	*	*			trans	88.1	67.4	165.1	-52.3	-25.3	0	0	0	117.2
719	T	26.7	Very low	37.1	Very low	135 Å²	135	135.2 Å²	135.2	83%	0.828	71%	0.707	S	S	*	*				-178.2	95.9	124.1	25.3	0	0	0	0	111	S721	T719-S721 VanDerWaalsContact C-N 3.32Å; T719-S721 PolarHBondContact O-N 2.89Å
720	K	24.8	Very low	35.4	Very low	220 Å²	220	138.9 Å²	138.9	96%	0.957	73%	0.726	S	S	*	*			trans	-74.2	83.2	163	-76.1	-179.3	177.3	175.6	0	109.3
721	S	26.9	Very low	34.8	Very low	85 Å²	85	139.4 Å²	139.4	59%	0.594	73%	0.731	S	S	*	*			trans	-164.8	86.2	162.2	57.4	0	0	0	0	112.2	T719	T719-S721 VanDerWaalsContact C-N 3.32Å; T719-S721 PolarHBondContact O-N 2.89Å
722	N	27.4	Very low	35.4	Very low	159 Å²	159	135.2 Å²	135.2	85%	0.85	71%	0.705	S	S	*	*			trans	153.3	87.1	136	-81.4	-23.3	0	0	0	109.9	N724	N722-N724 PolarHBondContact O-N 2.78Å
723	I	27.8	Very low	37.4	Very low	166 Å²	166	134 Å²	134	85%	0.851	70%	0.696	S	S	*	*			trans	-73	100.2	162.8	-63.7	167.7	0	0	0	106
724	N	28.8	Very low	39.8	Very low	143 Å²	143	127.8 Å²	127.8	77%	0.765	66%	0.664	S	S	*	*			trans	-147.2	102.9	156.5	-95.8	-20.6	0	0	0	110.1	N722	N722-N724 PolarHBondContact O-N 2.78Å
725	N	27.1	Very low	42.6	Very low	141 Å²	141	121.8 Å²	121.8	75%	0.754	63%	0.632	S	S	*	*	S	Bend	trans	48.7	70.4	143.7	-62.3	-16.7	0	0	0	119.9
726	N	31	Very low	45.6	Very low	143 Å²	143	112.1 Å²	112.1	77%	0.765	60%	0.597	S	S	*	*			trans	-159.2	92.8	138.1	-96.5	-20	0	0	0	110.8	N728	N726-N728 PolarHBondContact O-N 2.61Å; N726-N728 VanDerWaalsContact O-N 3.11Å
727	K	32.8	Very low	48.8	Very low	209 Å²	209	105.4 Å²	105.4	91%	0.909	56%	0.561	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.6	14.8	-178.4	-84.4	-178.8	174.1	175.3	0	114.7
728	N	37.3	Very low	52.1	Low	146 Å²	146	98.5 Å²	98.5	78%	0.781	52%	0.524	S	S	*	.	T	Hydrogen-bonded Turn	trans	-106.5	-7.4	-170.6	-75.5	-5.5	0	0	0	116.1	N726 L730	N726-N728 PolarHBondContact O-N 2.61Å; N726-N728 VanDerWaalsContact O-N 3.11Å; N728-L730 PolarHBondContact O-N 2.9Å
729	D	40.8	Very low	55.4	Low	113 Å²	113	91.5 Å²	91.5	60%	0.604	49%	0.487	S	S	*	.			trans	-100.5	59.2	-176.5	-82	-28.3	0	0	0	113.5	S731	D729-S731 PolarHBondContact O-N 2.82Å
730	L	47.9	Very low	58.7	Low	147 Å²	147	86.8 Å²	86.8	77%	0.77	46%	0.458	S	S	*	.	S	Bend	trans	-78.1	-0.7	173.9	-139.4	79.6	0	0	0	113.4	S712 N728	S712-L730 PolarHBondContact N-O 2.79Å; S712-L730 PolarHBondContact OG-O 3.34Å; S712-L730 VanDerWaalsContact OG-O 3.09Å; N728-L730 PolarHBondContact O-N 2.9Å
731	S	58.1	Low	62.1	Low	51 Å²	51	76.7 Å²	76.7	36%	0.357	41%	0.414	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-145	124.6	-179.6	63.1	0	0	0	0	111.9	T710 D729	T710-S731 CarbonylContact O-C 3.6Å; T710-S731 VanDerWaalsContact O-CA 3.28Å; T710-S731 WeakPolarHBondContact O-CA 3.28Å; T710-S731 WeakPolarHBondContact O-CB 3.38Å; D729-S731 PolarHBondContact O-N 2.82Å
732	S	76	Confident	65.3	Low	22 Å²	22	77.5 Å²	77.5	15%	0.154	41%	0.408	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.8	130.4	172.5	46.3	0	0	0	0	111	T710 C734	T710-S732 PolarHBondContact N-O 3.23Å; T710-S732 PolarHBondContact O-N 3.17Å; T710-S732 PolarHBondContact OG1-O 2.83Å; T710-S732 PolarHBondContact OG1-OG 2.94Å; S732-C734 PolarHBondContact O-N 3.38Å
733	T	89.6	Confident	68.3	Low	12 Å²	12	72.5 Å²	72.5	7%	0.074	38%	0.384	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81	116.4	173.4	-54.4	0	0	0	0	109	L405 H681 L683 R684 V707 L709	L405-T733 HydrophobicContact CD1-CG2 4.17Å; H681-T733 PolarHBondContact NE2-OG1 2.92Å; L683-T733 HydrophobicContact CD2-CG2 3.55Å; R684-T733 PolarHBondContact N-O 3.35Å; V707-T733 HydrophobicContact CG1-CG2 3.47Å; V707-T733 VanDerWaalsContact CG1-CG2 3.47Å; L709-T733 HydrophobicContact CD2-CG2 4.46Å
734	C	92.2	Very high	71.4	Confident	9 Å²	9	69.5 Å²	69.5	6%	0.061	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102	144.8	174.9	-73.4	0	0	0	0	110.8	R684 V707 F708 T710 S732	R684-C734 CarbonylContact O-C 3.47Å; R684-C734 WeakPolarHBondContact O-CA 3.49Å; V707-C734 CarbonylContact C-O 3.58Å; V707-C734 WeakPolarHBondContact CA-O 3.46Å; F708-C734 HydrophobicContact CB-CB 4.26Å; F708-C734 PolarHBondContact N-O 3.06Å; F708-C734 PolarHBondContact O-N 3.39Å; T710-C734 HydrophobicContact CG2-CB 4.41Å; T710-C734 PolarHBondContact OG1-SG 2.94Å; T710-C734 VanDerWaalsContact OG1-SG 3.39Å; S732-C734 PolarHBondContact O-N 3.38Å
735	I	93.3	Very high	74.6	Confident	0 Å²	0	63.6 Å²	63.6	0%	0	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	148.7	177.3	53.4	164.6	0	0	0	111.9	L683 R684 L685 H686 C689 I702 F704 N706 V707 V738	L683-I735 HydrophobicContact CB-CD1 4.26Å; L683-I735 HydrophobicContact CB-CG1 4.36Å; L683-I735 HydrophobicContact CB-CG2 4.3Å; L683-I735 HydrophobicContact CD1-CD1 4.24Å; L683-I735 HydrophobicContact CD1-CG2 4.02Å; L683-I735 HydrophobicContact CD2-CG2 3.91Å; L683-I735 HydrophobicContact CG-CG2 4.31Å; R684-I735 WeakPolarHBondContact O-CG1 3.22Å; R684-I735 PolarHBondContact O-N 3.29Å; L685-I735 HydrophobicContact CD2-CD1 4.13Å; L685-I735 HydrophobicContact CD2-CG1 4.24Å; H686-I735 WeakPolarHBondContact CB-O 3.31Å; H686-I735 PolarHBondContact N-O 2.93Å; C689-I735 PolarHBondContact SG-O 3.2Å; I702-I735 HydrophobicContact CD1-CD1 3.6Å; F704-I735 HydrophobicContact CB-CB 3.98Å; F704-I735 HydrophobicContact CB-CD1 3.97Å; F704-I735 HydrophobicContact CB-CG2 4.29Å; F704-I735 HydrophobicContact CD1-CD1 4.16Å; F704-I735 HydrophobicContact CD1-CG2 4.44Å; F704-I735 HydrophobicContact CD2-CB 4.3Å; F704-I735 HydrophobicContact CD2-CG2 3.72Å; F704-I735 HydrophobicContact CE2-CG2 4.14Å; F704-I735 HydrophobicContact CG-CB 4.14Å; F704-I735 HydrophobicContact CG-CD1 4.16Å; F704-I735 HydrophobicContact CG-CG2 3.89Å; N706-I735 CarbonylContact O-C 3.47Å; N706-I735 VanDerWaalsContact O-CA 3.29Å; N706-I735 WeakPolarHBondContact O-CA 3.48Å; V707-I735 HydrophobicContact CG2-CG2 4.38Å; I735-V738 HydrophobicContact CD1-CG2 4.27Å; I735-V738 HydrophobicContact CG1-CG2 4.5Å
736	S	91.6	Very high	77.7	Confident	18 Å²	18	57.2 Å²	57.2	13%	0.126	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.3	177.1	169.5	92.7	0	0	0	0	112	C689 T705 N706 F708	C689-S736 VanDerWaalsContact SG-CA 3.59Å; T705-S736 PolarHBondContact N-O 2.75Å; N706-S736 WeakPolarHBondContact CB-OG 3.26Å; N706-S736 PolarHBondContact N-O 3.46Å; N706-S736 PolarHBondContact O-N 3.25Å; F708-S736 VanDerWaalsContact CE2-OG 3.3Å; F708-S736 WeakPolarHBondContact CE2-OG 3.49Å
737	G	92.4	Very high	80.6	Confident	1 Å²	1	52.9 Å²	52.9	1%	0.01	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	67.2	51.5	-171.6	0	0	0	0	0	108.4	D582 H583 F704 T705	D582-G737 PolarHBondContact OD2-N 3.05Å; H583-G737 VanDerWaalsContact CE1-C 3.49Å; H583-G737 PolarHBondContact CE1-O 3.08Å; H583-G737 PolarHBondContact NE2-O 2.99Å; F704-G737 WeakPolarHBondContact CA-O 3.49Å; T705-G737 PolarHBondContact N-O 3.26Å; T705-G737 PolarHBondContact OG1-O 3.42Å
738	V	95.4	Very high	83.5	Confident	1 Å²	1	48.1 Å²	48.1	1%	0.006	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.2	134.6	-172.1	-177.6	0	0	0	0	110.3	G581 D582 L685 L691 I702 L703 F704 I735	G581-V738 CarbonylContact C-O 3.53Å; G581-V738 WeakPolarHBondContact CA-O 3.39Å; D582-V738 PolarHBondContact N-O 3.39Å; D582-V738 PolarHBondContact OD2-N 3.22Å; D582-V738 VanDerWaalsContact OD2-N 3.12Å; L685-V738 HydrophobicContact CD2-CG1 4.39Å; L685-V738 HydrophobicContact CD2-CG2 3.81Å; L691-V738 HydrophobicContact CD1-CB 4.44Å; L691-V738 HydrophobicContact CD1-CG1 3.74Å; I702-V738 HydrophobicContact CB-CG1 3.65Å; I702-V738 HydrophobicContact CD1-CG1 3.64Å; I702-V738 HydrophobicContact CG1-CG1 4.17Å; I702-V738 HydrophobicContact CG2-CG1 3.81Å; L703-V738 CarbonylContact O-C 3.49Å; L703-V738 WeakPolarHBondContact O-CA 3.3Å; F704-V738 HydrophobicContact CB-CG2 4.43Å; I735-V738 HydrophobicContact CD1-CG2 4.27Å; I735-V738 HydrophobicContact CG1-CG2 4.5Å
739	S	96.6	Very high	86.1	Confident	1 Å²	1	42 Å²	42	1%	0.007	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	137.2	171.1	-86.7	0	0	0	0	110.5	Q580 H583 I702 L703	Q580-S739 WeakPolarHBondContact O-CA 3.48Å; H583-S739 PolarHBondContact ND1-OG 3.36Å; I702-S739 CarbonylContact C-O 3.34Å; I702-S739 VanDerWaalsContact CA-O 3.25Å; I702-S739 WeakPolarHBondContact CA-O 3.4Å; L703-S739 PolarHBondContact N-O 2.96Å; L703-S739 PolarHBondContact O-N 3.16Å
740	V	95.9	Very high	88.5	Confident	36 Å²	36	36.6 Å²	36.6	22%	0.218	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.4	132.6	171.8	-176.7	0	0	0	0	108.7	Q580 L691 P699	Q580-V740 PolarHBondContact O-N 3.35Å; L691-V740 HydrophobicContact CD1-CG2 4.19Å; L691-V740 HydrophobicContact CD2-CG2 4.39Å; P699-V740 HydrophobicContact CB-CG1 3.83Å; P699-V740 HydrophobicContact CB-CG2 4Å; P699-V740 HydrophobicContact CG-CG1 4.21Å; P699-V740 HydrophobicContact CG-CG2 3.56Å
741	I	95.5	Very high	90.5	Very high	7 Å²	7	33.2 Å²	33.2	4%	0.036	19%	0.186	C	C	.	.			trans	-129.5	150.6	-179.8	62.3	171.3	0	0	0	110.1	V657 A664 Y701 L703 W745 L746	V657-I741 HydrophobicContact CG2-CB 4.25Å; V657-I741 HydrophobicContact CG2-CG2 3.58Å; A664-I741 HydrophobicContact CB-CD1 4.1Å; Y701-I741 PolarHBondContact O-N 3.47Å; L703-I741 HydrophobicContact CB-CD1 4.34Å; L703-I741 HydrophobicContact CB-CG2 3.88Å; I741-W745 HydrophobicContact CB-CE3 4.26Å; I741-L746 HydrophobicContact CD1-CD1 4.02Å; I741-L746 HydrophobicContact CD1-CD2 3.87Å; I741-L746 HydrophobicContact CD1-CG 4.05Å
742	Q	93.8	Very high	91.8	Very high	103 Å²	103	36 Å²	36	48%	0.481	19%	0.193	S	C	.	.			trans	-84	139.1	167.3	-61.9	-171.6	-31.4	0	0	109.4	D744 W745	Q742-D744 PolarHBondContact O-N 2.89Å; Q742-W745 HydrophobicContact CB-CD2 3.82Å; Q742-W745 HydrophobicContact CB-CE3 4.32Å; Q742-W745 HydrophobicContact CB-CG 4.04Å; Q742-W745 HydrophobicContact CB-CZ2 4.23Å; Q742-W745 HydrophobicContact CG-CD2 4.3Å; Q742-W745 HydrophobicContact CG-CH2 4.19Å; Q742-W745 HydrophobicContact CG-CZ2 3.8Å; Q742-W745 WeakPolarHBondContact O-CB 3.21Å; Q742-W745 PolarHBondContact O-N 3.41Å
743	P	90.7	Very high	92.4	Very high	53 Å²	53	37.4 Å²	37.4	34%	0.344	20%	0.195	S	C	.	.	H	α-helix	trans	-61.2	-34.9	-179.8	24.7	-33.3	0	0	0	111.9	Y701 W745 L746	Y701-P743 HydrophobicContact CD2-CB 4Å; Y701-P743 HydrophobicContact CD2-CG 4.19Å; Y701-P743 HydrophobicContact CE2-CB 3.97Å; Y701-P743 HydrophobicContact CE2-CG 4.26Å; Y701-P743 HydrophobicContact CG-CB 4.3Å; P743-W745 PolarHBondContact O-N 3.13Å; P743-L746 WeakPolarHBondContact O-CB 3.45Å; P743-L746 PolarHBondContact O-N 3.21Å
744	D	93.3	Very high	92.3	Very high	104 Å²	104	38.1 Å²	38.1	56%	0.556	20%	0.197	S	C	*	.	H	α-helix	trans	-60.8	-30.7	179.6	-57.8	-22.9	0	0	0	112.3	Q742 L746 L747 E748	Q742-D744 PolarHBondContact O-N 2.89Å; D744-L746 VanDerWaalsContact C-N 3.27Å; D744-L746 PolarHBondContact O-N 3.44Å; D744-L747 PolarHBondContact O-N 3.46Å; D744-E748 WeakPolarHBondContact O-CB 3.35Å; D744-E748 PolarHBondContact O-N 3.35Å
745	W	94.8	Very high	91.7	Very high	19 Å²	19	43.2 Å²	43.2	7%	0.072	22%	0.22	C	C	.	.	H	α-helix	trans	-66.3	-29.4	176.8	-60	-11.6	0	0	0	112.4	L653 R654 V657 I741 Q742 P743 L747 L749	L653-W745 HydrophobicContact CB-CH2 4.13Å; L653-W745 HydrophobicContact CB-CZ3 3.67Å; L653-W745 HydrophobicContact CD1-CH2 4.18Å; L653-W745 HydrophobicContact CD1-CZ3 4.22Å; R654-W745 HydrophobicContact CG-CD2 3.99Å; R654-W745 HydrophobicContact CG-CE3 4.2Å; R654-W745 HydrophobicContact CG-CG 4.43Å; R654-W745 HydrophobicContact CG-CZ2 4.37Å; R654-W745 HydrophobicContact CG-CZ3 4.48Å; V657-W745 HydrophobicContact CG2-CE3 4.36Å; I741-W745 HydrophobicContact CB-CE3 4.26Å; Q742-W745 HydrophobicContact CB-CD2 3.82Å; Q742-W745 HydrophobicContact CB-CE3 4.32Å; Q742-W745 HydrophobicContact CB-CG 4.04Å; Q742-W745 HydrophobicContact CB-CZ2 4.23Å; Q742-W745 HydrophobicContact CG-CD2 4.3Å; Q742-W745 HydrophobicContact CG-CH2 4.19Å; Q742-W745 HydrophobicContact CG-CZ2 3.8Å; Q742-W745 WeakPolarHBondContact O-CB 3.21Å; Q742-W745 PolarHBondContact O-N 3.41Å; P743-W745 PolarHBondContact O-N 3.13Å; W745-L747 VanDerWaalsContact C-N 3.34Å; W745-L749 HydrophobicContact CB-CD1 4.1Å; W745-L749 WeakPolarHBondContact O-CB 3.4Å; W745-L749 VanDerWaalsContact O-CG 3.27Å; W745-L749 WeakPolarHBondContact O-CG 3.46Å; W745-L749 PolarHBondContact O-N 3.03Å
746	L	93.6	Very high	90.7	Very high	7 Å²	7	52.1 Å²	52.1	4%	0.037	26%	0.259	C	S	.	.	H	α-helix	trans	-66.9	-40.5	175.9	-65.1	177.1	0	0	0	110.7	V657 F661 A664 I677 I741 P743 D744 A750 Y754	V657-L746 HydrophobicContact CG1-CD2 4.05Å; F661-L746 HydrophobicContact CB-CD2 4.37Å; A664-L746 HydrophobicContact CB-CD1 4.13Å; A664-L746 HydrophobicContact CB-CD2 4.12Å; I677-L746 HydrophobicContact CD1-CD1 3.36Å; I741-L746 HydrophobicContact CD1-CD1 4.02Å; I741-L746 HydrophobicContact CD1-CD2 3.87Å; I741-L746 HydrophobicContact CD1-CG 4.05Å; P743-L746 WeakPolarHBondContact O-CB 3.45Å; P743-L746 PolarHBondContact O-N 3.21Å; D744-L746 VanDerWaalsContact C-N 3.27Å; D744-L746 PolarHBondContact O-N 3.44Å; L746-A750 CarbonylContact O-C 3.55Å; L746-A750 WeakPolarHBondContact O-CA 3.32Å; L746-A750 PolarHBondContact O-N 3.23Å; L746-A750 VanDerWaalsContact O-N 3.09Å; L746-Y754 HydrophobicContact CB-CD2 3.65Å; L746-Y754 HydrophobicContact CB-CE2 4Å; L746-Y754 HydrophobicContact CB-CG 4.09Å; L746-Y754 HydrophobicContact CD1-CE2 4.36Å; L746-Y754 HydrophobicContact CD2-CD2 4.26Å; L746-Y754 HydrophobicContact CD2-CE2 3.75Å; L746-Y754 HydrophobicContact CG-CD2 4.4Å; L746-Y754 HydrophobicContact CG-CE2 4.26Å
747	L	91.3	Very high	89.6	Confident	52 Å²	52	52.5 Å²	52.5	27%	0.272	27%	0.266	S	S	.	.	H	α-helix	trans	-71.4	-41.9	177	-62	169.7	0	0	0	111.3	D744 W745 P751 F756	D744-L747 PolarHBondContact O-N 3.46Å; W745-L747 VanDerWaalsContact C-N 3.34Å; L747-P751 VanDerWaalsContact O-CA 3.24Å; L747-P751 WeakPolarHBondContact O-CA 3.29Å; L747-P751 VanDerWaalsContact O-CB 3.24Å; L747-P751 WeakPolarHBondContact O-CB 3.32Å; L747-P751 WeakPolarHBondContact O-CD 3.46Å; L747-F756 HydrophobicContact CD1-CB 3.93Å; L747-F756 HydrophobicContact CD1-CD2 4.05Å; L747-F756 HydrophobicContact CD1-CG 4.33Å; L747-F756 HydrophobicContact CD2-CB 4.07Å
748	E	93	Very high	88.2	Confident	109 Å²	109	56.3 Å²	56.3	51%	0.509	29%	0.289	S	S	.	.	H	α-helix	trans	-70.5	-46.4	-178.5	-171.7	-162.8	155.8	0	0	112.4	R654 D744 P751	R654-E748 IonicContact CZ-OE1 2.91Å; R654-E748 IonicContact CZ-OE2 2.81Å; R654-E748 IonicContact NH1-OE1 3.25Å; R654-E748 PolarHBondContact NH1-OE1 3.41Å; R654-E748 IonicContact NH1-OE2 3.82Å; R654-E748 PolarHBondContact NH1-OE2 3.43Å; R654-E748 IonicContact NH2-OE1 3.86Å; R654-E748 PolarHBondContact NH2-OE1 3.37Å; R654-E748 IonicContact NH2-OE2 3.8Å; D744-E748 WeakPolarHBondContact O-CB 3.35Å; D744-E748 PolarHBondContact O-N 3.35Å; E748-P751 WeakPolarHBondContact O-CD 3.48Å
749	L	92.9	Very high	86.8	Confident	17 Å²	17	62.9 Å²	62.9	9%	0.089	32%	0.324	C	S	.	.	H	α-helix	trans	-91.7	-19.6	-170.6	-58.2	175.5	0	0	0	113.1	R654 V657 R658 W745	R654-L749 HydrophobicContact CB-CD1 3.97Å; R654-L749 HydrophobicContact CG-CD1 4.25Å; V657-L749 HydrophobicContact CB-CD1 3.91Å; V657-L749 HydrophobicContact CG1-CB 4.22Å; V657-L749 HydrophobicContact CG1-CD1 3.76Å; R658-L749 HydrophobicContact CG-CB 4.29Å; R658-L749 HydrophobicContact CG-CD1 4.24Å; R658-L749 HydrophobicContact CG-CD2 4.21Å; W745-L749 HydrophobicContact CB-CD1 4.1Å; W745-L749 WeakPolarHBondContact O-CB 3.4Å; W745-L749 VanDerWaalsContact O-CG 3.27Å; W745-L749 WeakPolarHBondContact O-CG 3.46Å; W745-L749 PolarHBondContact O-N 3.03Å
750	A	91.8	Very high	85.3	Confident	0 Å²	0	71 Å²	71	0%	0	36%	0.355	C	S	.	.			trans	-138.6	56.6	175.7	0	0	0	0	0	112.5	F661 L746 H752 Y753 Y754	F661-A750 HydrophobicContact CB-CB 3.98Å; F661-A750 HydrophobicContact CD1-CB 4.07Å; F661-A750 HydrophobicContact CD2-CB 3.87Å; F661-A750 HydrophobicContact CE2-CB 4.43Å; F661-A750 HydrophobicContact CG-CB 3.7Å; L746-A750 CarbonylContact O-C 3.55Å; L746-A750 WeakPolarHBondContact O-CA 3.32Å; L746-A750 PolarHBondContact O-N 3.23Å; L746-A750 VanDerWaalsContact O-N 3.09Å; A750-H752 PolarHBondContact O-N 2.71Å; A750-Y753 PolarHBondContact O-N 3.41Å; A750-Y754 HydrophobicContact CB-CD2 4.22Å; A750-Y754 PolarHBondContact O-N 2.81Å
751	P	89	Confident	83.9	Confident	76 Å²	76	74.3 Å²	74.3	49%	0.494	37%	0.367	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.6	-23.4	-177.3	25.2	-34.3	0	0	0	113.4	L747 E748 Y753	L747-P751 VanDerWaalsContact O-CA 3.24Å; L747-P751 WeakPolarHBondContact O-CA 3.29Å; L747-P751 VanDerWaalsContact O-CB 3.24Å; L747-P751 WeakPolarHBondContact O-CB 3.32Å; L747-P751 WeakPolarHBondContact O-CD 3.46Å; E748-P751 WeakPolarHBondContact O-CD 3.48Å; P751-Y753 VanDerWaalsContact C-N 3.28Å
752	H	85.2	Confident	82.4	Confident	110 Å²	110	76.6 Å²	76.6	51%	0.509	38%	0.378	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.8	-15	174.7	58.8	-78.2	0	0	0	113.1	A497 A750	A497-H752 PolarHBondContact O-NE2 3.35Å; A750-H752 PolarHBondContact O-N 2.71Å
753	Y	88.1	Confident	80.8	Confident	51 Å²	51	76.4 Å²	76.4	20%	0.2	38%	0.38	C	S	.	.	T	Hydrogen-bonded Turn	trans	-110.3	-32.4	-178.5	-165.7	-91.7	0	0	0	112.5	A497 F661 H662 R678 A750 P751	A497-Y753 HydrophobicContact CB-CD2 3.7Å; A497-Y753 HydrophobicContact CB-CE2 4.15Å; F661-Y753 AromaticContact CD2-CD1 3.79Å; F661-Y753 HydrophobicContact CD2-CD1 3.79Å; F661-Y753 HydrophobicContact CD2-CD2 4.42Å; F661-Y753 HydrophobicContact CD2-CE1 4.31Å; F661-Y753 AromaticContact CD2-CG 3.84Å; F661-Y753 HydrophobicContact CD2-CG 3.84Å; F661-Y753 AromaticContact CE2-CD1 3.93Å; F661-Y753 HydrophobicContact CE2-CD1 3.93Å; F661-Y753 AromaticContact CE2-CD2 3.73Å; F661-Y753 HydrophobicContact CE2-CD2 3.73Å; F661-Y753 HydrophobicContact CE2-CE1 4.41Å; F661-Y753 HydrophobicContact CE2-CE2 4.23Å; F661-Y753 AromaticContact CE2-CG 3.55Å; F661-Y753 HydrophobicContact CE2-CG 3.55Å; H662-Y753 HydrophobicContact CB-CE1 4.25Å; R678-Y753 WeakPolarHBondContact CD-OH 3.34Å; R678-Y753 PolarHBondContact NH1-OH 3.22Å; A750-Y753 PolarHBondContact O-N 3.41Å; P751-Y753 VanDerWaalsContact C-N 3.28Å
754	Y	88.5	Confident	79.5	Confident	27 Å²	27	76.1 Å²	76.1	11%	0.106	37%	0.374	C	S	.	.			trans	-117.7	135.8	178.5	-67.2	-68.1	0	0	0	111.4	F661 I677 L746 A750	F661-Y754 HydrophobicContact CB-CE2 4.13Å; F661-Y754 HydrophobicContact CD2-CE2 4.17Å; F661-Y754 VanDerWaalsContact O-CE2 3.31Å; F661-Y754 WeakPolarHBondContact O-CE2 3.45Å; F661-Y754 PolarHBondContact O-OH 2.94Å; I677-Y754 HydrophobicContact CB-CE1 4.16Å; I677-Y754 HydrophobicContact CD1-CE1 4.29Å; I677-Y754 HydrophobicContact CG2-CD1 4.21Å; I677-Y754 HydrophobicContact CG2-CE1 3.59Å; L746-Y754 HydrophobicContact CB-CD2 3.65Å; L746-Y754 HydrophobicContact CB-CE2 4Å; L746-Y754 HydrophobicContact CB-CG 4.09Å; L746-Y754 HydrophobicContact CD1-CE2 4.36Å; L746-Y754 HydrophobicContact CD2-CD2 4.26Å; L746-Y754 HydrophobicContact CD2-CE2 3.75Å; L746-Y754 HydrophobicContact CG-CD2 4.4Å; L746-Y754 HydrophobicContact CG-CE2 4.26Å; A750-Y754 HydrophobicContact CB-CD2 4.22Å; A750-Y754 PolarHBondContact O-N 2.81Å
755	Q	79.6	Confident	78	Confident	116 Å²	116	77 Å²	77	54%	0.542	37%	0.374	S	S	.	.			trans	-128.5	147.9	171.7	-72.2	179.1	6.3	0	0	109.3	H762	Q755-H762 PolarHBondContact O-CE1 3.32Å
756	F	71.4	Confident	76.5	Confident	186 Å²	186	80.4 Å²	80.4	82%	0.816	40%	0.401	S	S	*	.			trans	-102	132.4	177.3	-164.1	-91.5	0	0	0	109.9	L747	L747-F756 HydrophobicContact CD1-CB 3.93Å; L747-F756 HydrophobicContact CD1-CD2 4.05Å; L747-F756 HydrophobicContact CD1-CG 4.33Å; L747-F756 HydrophobicContact CD2-CB 4.07Å
757	G	67.9	Low	75.3	Confident	27 Å²	27	85.4 Å²	85.4	28%	0.278	43%	0.427	S	S	.	.	S	Bend	trans	159.2	164.5	178.3	0	0	0	0	0	112.8	E761 H762	G757-E761 VanDerWaalsContact CA-OE2 3.26Å; G757-E761 WeakPolarHBondContact CA-OE2 3.25Å; G757-H762 PolarHBondContact N-NE2 3.1Å; G757-H762 PolarHBondContact O-CD2 3.49Å; G757-H762 VanDerWaalsContact O-CD2 3.31Å; G757-H762 PolarHBondContact O-NE2 3.18Å
758	T	64.8	Low	73.5	Confident	80 Å²	80	85.9 Å²	85.9	49%	0.491	45%	0.445	S	S	.	.			trans	-71.4	153.9	166.4	56.5	0	0	0	0	110.5	R760 E761 H762	T758-R760 CarbonylContact O-C 3.56Å; T758-R760 PolarHBondContact O-N 3.23Å; T758-E761 PolarHBondContact N-OE2 3.18Å; T758-E761 WeakPolarHBondContact O-CA 3.37Å; T758-E761 WeakPolarHBondContact O-CB 3.39Å; T758-E761 PolarHBondContact O-N 3.4Å; T758-E761 VanDerWaalsContact OG1-CG 3.31Å; T758-E761 WeakPolarHBondContact OG1-CG 3.49Å; T758-E761 PolarHBondContact OG1-N 2.9Å; T758-E761 PolarHBondContact OG1-OE2 2.96Å; T758-H762 PolarHBondContact O-CD2 3.23Å; T758-H762 PolarHBondContact O-N 3.07Å
759	D	65.5	Low	71.6	Confident	139 Å²	139	85.7 Å²	85.7	74%	0.743	45%	0.446	S	S	*	.	H	α-helix	trans	-49.4	-34.4	178.1	-67.5	-24.7	0	0	0	112.5	L763	D759-L763 WeakPolarHBondContact O-CB 3.02Å; D759-L763 PolarHBondContact O-N 3.46Å
760	R	63.9	Low	69.5	Low	173 Å²	173	93.5 Å²	93.5	65%	0.653	48%	0.479	S	S	*	.	H	α-helix	trans	-65.8	-46.1	174.3	-174.7	-179.7	168.9	162.1	3.2	112.9	T758 H762 L763 E764	T758-R760 CarbonylContact O-C 3.56Å; T758-R760 PolarHBondContact O-N 3.23Å; R760-H762 VanDerWaalsContact C-N 3.31Å; R760-H762 PolarHBondContact O-N 3.48Å; R760-L763 WeakPolarHBondContact O-CB 3.1Å; R760-L763 PolarHBondContact O-N 3.38Å; R760-E764 HydrophobicContact CG-CG 4.48Å; R760-E764 IonicContact CZ-OE1 3.77Å; R760-E764 IonicContact NE-OE1 3.91Å; R760-E764 PolarHBondContact NE-OE1 3.14Å; R760-E764 IonicContact NH2-OE1 2.98Å; R760-E764 PolarHBondContact NH2-OE1 2.93Å; R760-E764 WeakPolarHBondContact O-CB 3.32Å; R760-E764 WeakPolarHBondContact O-CG 3.47Å; R760-E764 PolarHBondContact O-N 2.94Å
761	E	66.9	Low	67	Low	104 Å²	104	105.2 Å²	105.2	49%	0.486	53%	0.53	S	S	.	.	H	α-helix	trans	-64.1	-36.8	177	-73.4	164.7	154.2	0	0	111.5	G757 T758 E764 H765	G757-E761 VanDerWaalsContact CA-OE2 3.26Å; G757-E761 WeakPolarHBondContact CA-OE2 3.25Å; T758-E761 PolarHBondContact N-OE2 3.18Å; T758-E761 WeakPolarHBondContact O-CA 3.37Å; T758-E761 WeakPolarHBondContact O-CB 3.39Å; T758-E761 PolarHBondContact O-N 3.4Å; T758-E761 VanDerWaalsContact OG1-CG 3.31Å; T758-E761 WeakPolarHBondContact OG1-CG 3.49Å; T758-E761 PolarHBondContact OG1-N 2.9Å; T758-E761 PolarHBondContact OG1-OE2 2.96Å; E761-E764 PolarHBondContact O-N 3.08Å; E761-H765 VanDerWaalsContact O-CB 3.24Å; E761-H765 WeakPolarHBondContact O-CB 3.48Å; E761-H765 PolarHBondContact O-N 3Å
762	H	63.7	Low	65.9	Low	55 Å²	55	106.7 Å²	106.7	26%	0.255	53%	0.532	S	S	.	.	H	α-helix	trans	-66.3	-39.6	172.5	-68.1	-81.7	0	0	0	112	Q755 G757 T758 R760 H765 S766	Q755-H762 PolarHBondContact O-CE1 3.32Å; G757-H762 PolarHBondContact N-NE2 3.1Å; G757-H762 PolarHBondContact O-CD2 3.49Å; G757-H762 VanDerWaalsContact O-CD2 3.31Å; G757-H762 PolarHBondContact O-NE2 3.18Å; T758-H762 PolarHBondContact O-CD2 3.23Å; T758-H762 PolarHBondContact O-N 3.07Å; R760-H762 VanDerWaalsContact C-N 3.31Å; R760-H762 PolarHBondContact O-N 3.48Å; H762-H765 PolarHBondContact O-N 3.04Å; H762-S766 WeakPolarHBondContact O-CB 3.42Å; H762-S766 PolarHBondContact O-N 2.81Å; H762-S766 PolarHBondContact O-OG 3.09Å
763	L	61.2	Low	64.9	Low	100 Å²	100	106.5 Å²	106.5	52%	0.524	53%	0.533	S	S	.	.	H	α-helix	trans	-64.2	-46	173.8	-110.3	147	0	0	0	111.9	D759 R760 H765 S766 L767	D759-L763 WeakPolarHBondContact O-CB 3.02Å; D759-L763 PolarHBondContact O-N 3.46Å; R760-L763 WeakPolarHBondContact O-CB 3.1Å; R760-L763 PolarHBondContact O-N 3.38Å; L763-H765 VanDerWaalsContact C-N 3.33Å; L763-H765 PolarHBondContact O-N 3.29Å; L763-S766 WeakPolarHBondContact CA-OG 3.46Å; L763-S766 PolarHBondContact O-N 2.85Å; L763-S766 PolarHBondContact O-OG 3.3Å; L763-L767 HydrophobicContact CD2-CD1 3.91Å; L763-L767 VanDerWaalsContact O-CB 3.31Å; L763-L767 WeakPolarHBondContact O-CB 3.37Å; L763-L767 WeakPolarHBondContact O-CD1 3.16Å; L763-L767 VanDerWaalsContact O-CG 3.25Å; L763-L767 WeakPolarHBondContact O-CG 3.45Å; L763-L767 PolarHBondContact O-N 2.96Å
764	E	62.7	Low	63.6	Low	47 Å²	47	109.6 Å²	109.6	22%	0.22	55%	0.552	C	S	.	*	H	α-helix	trans	-62.3	-41.6	176.6	-73.5	176.2	-175.9	0	0	110.8	R760 E761 G768 I769	R760-E764 HydrophobicContact CG-CG 4.48Å; R760-E764 IonicContact CZ-OE1 3.77Å; R760-E764 IonicContact NE-OE1 3.91Å; R760-E764 PolarHBondContact NE-OE1 3.14Å; R760-E764 IonicContact NH2-OE1 2.98Å; R760-E764 PolarHBondContact NH2-OE1 2.93Å; R760-E764 WeakPolarHBondContact O-CB 3.32Å; R760-E764 WeakPolarHBondContact O-CG 3.47Å; R760-E764 PolarHBondContact O-N 2.94Å; E761-E764 PolarHBondContact O-N 3.08Å; E764-G768 PolarHBondContact O-N 3.42Å; E764-I769 PolarHBondContact O-N 2.61Å
765	H	62.3	Low	62.1	Low	121 Å²	121	114.5 Å²	114.5	56%	0.56	58%	0.578	S	S	*	*	H	α-helix	trans	-68.6	-42.2	177.3	-164.7	-89.8	0	0	0	113	E761 H762 L763 L767 G768	E761-H765 VanDerWaalsContact O-CB 3.24Å; E761-H765 WeakPolarHBondContact O-CB 3.48Å; E761-H765 PolarHBondContact O-N 3Å; H762-H765 PolarHBondContact O-N 3.04Å; L763-H765 VanDerWaalsContact C-N 3.33Å; L763-H765 PolarHBondContact O-N 3.29Å; H765-L767 VanDerWaalsContact C-N 3.34Å; H765-G768 PolarHBondContact O-N 3.49Å
766	S	63	Low	61	Low	92 Å²	92	114.4 Å²	114.4	64%	0.643	58%	0.581	S	S	*	*	H	α-helix	trans	-69.7	-29.1	177.5	57.7	0	0	0	0	113.3	H762 L763 G768	H762-S766 WeakPolarHBondContact O-CB 3.42Å; H762-S766 PolarHBondContact O-N 2.81Å; H762-S766 PolarHBondContact O-OG 3.09Å; L763-S766 WeakPolarHBondContact CA-OG 3.46Å; L763-S766 PolarHBondContact O-N 2.85Å; L763-S766 PolarHBondContact O-OG 3.3Å; S766-G768 VanDerWaalsContact C-N 3.26Å; S766-G768 PolarHBondContact O-N 3.07Å
767	L	69.4	Low	60.4	Low	112 Å²	112	109.6 Å²	109.6	59%	0.586	57%	0.565	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.1	-2.1	173	-69.6	168.6	0	0	0	113.4	L763 H765 I769	L763-L767 HydrophobicContact CD2-CD1 3.91Å; L763-L767 VanDerWaalsContact O-CB 3.31Å; L763-L767 WeakPolarHBondContact O-CB 3.37Å; L763-L767 WeakPolarHBondContact O-CD1 3.16Å; L763-L767 VanDerWaalsContact O-CG 3.25Å; L763-L767 WeakPolarHBondContact O-CG 3.45Å; L763-L767 PolarHBondContact O-N 2.96Å; H765-L767 VanDerWaalsContact C-N 3.34Å; L767-I769 HydrophobicContact CB-CD1 3.88Å; L767-I769 HydrophobicContact CB-CG1 3.9Å; L767-I769 HydrophobicContact CD1-CD1 4.2Å; L767-I769 PolarHBondContact O-N 2.9Å
768	G	52.3	Low	59.8	Low	62 Å²	62	115.5 Å²	115.5	64%	0.639	59%	0.585	S	S	*	*	T	Hydrogen-bonded Turn	trans	67	15.5	-177.7	0	0	0	0	0	113.8	E764 H765 S766 K770	E764-G768 PolarHBondContact O-N 3.42Å; H765-G768 PolarHBondContact O-N 3.49Å; S766-G768 VanDerWaalsContact C-N 3.26Å; S766-G768 PolarHBondContact O-N 3.07Å; G768-K770 VanDerWaalsContact C-N 3.34Å; G768-K770 PolarHBondContact O-N 3.39Å
769	I	52.7	Low	59.4	Low	104 Å²	104	118.2 Å²	118.2	53%	0.533	59%	0.593	S	S	.	*			trans	-84.1	84.3	178.4	-54.8	173.1	0	0	0	106.7	E764 L767	E764-I769 PolarHBondContact O-N 2.61Å; L767-I769 HydrophobicContact CB-CD1 3.88Å; L767-I769 HydrophobicContact CB-CG1 3.9Å; L767-I769 HydrophobicContact CD1-CD1 4.2Å; L767-I769 PolarHBondContact O-N 2.9Å
770	K	49.3	Very low	58.9	Low	182 Å²	182	116.5 Å²	116.5	79%	0.791	58%	0.58	S	S	*	*			trans	-75.1	126.4	161.6	-78.6	-173.7	175.7	-178.5	0	107.9	G768	G768-K770 VanDerWaalsContact C-N 3.34Å; G768-K770 PolarHBondContact O-N 3.39Å
771	K	39.7	Very low	58.5	Low	246 Å²	246	111.4 Å²	111.4	100%	1.07	57%	0.573	S	S	*	*			trans	-52.5	0	170	-92.9	-178.2	177.2	171	0	112.2

Retrieved 771 of 771 residues in 375.6 ms (Link to these results)

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