G4LVJ1_SCHMA Loading...

Fuse-binding protein-interacting repressor siahbp1, putative

AlphaFold DB , UniProt , Accession G4LVJ1, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 522 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	35.4	Very low	44.6	Very low	244 Å²	244	138.9 Å²	138.9	100%	1.202	84%	0.836	S	S	*	*				0	96.7	0	-70.4	165.4	70.1	0	0	108.8
2	I	42.2	Very low	44.6	Very low	158 Å²	158	142.4 Å²	142.4	81%	0.81	85%	0.845	S	S	*	*			trans	-139.7	132.2	165.1	-60.6	-177.9	0	0	0	105.2
3	N	41.8	Very low	44.6	Very low	157 Å²	157	149.8 Å²	149.8	84%	0.84	85%	0.849	S	S	*	*			trans	-78.1	140.2	174.4	-66.7	-36.4	0	0	0	109.2
4	V	48	Very low	44.9	Very low	138 Å²	138	154 Å²	154	84%	0.836	85%	0.854	S	S	*	*			trans	-118.9	131	168.8	-178.9	0	0	0	0	107.2
5	D	47.1	Very low	45	Very low	143 Å²	143	151.9 Å²	151.9	77%	0.765	85%	0.854	S	S	*	*			trans	-70.2	145.2	-158.9	-82.1	-69.1	0	0	0	116.3	S7	D5-S7 PolarHBondContact O-N 3.35Å
6	L	41.5	Very low	44.8	Very low	170 Å²	170	148 Å²	148	89%	0.89	86%	0.858	S	S	*	*	S	Bend	trans	-78.8	55.3	-177.9	-167.2	71	0	0	0	112
7	S	48.7	Very low	44.7	Very low	98 Å²	98	143.6 Å²	143.6	69%	0.685	85%	0.852	S	S	*	*			trans	-106.5	-19.6	-168.8	-159.7	0	0	0	0	115.2	D5	D5-S7 PolarHBondContact O-N 3.35Å
8	V	47.1	Very low	44.8	Very low	138 Å²	138	145.1 Å²	145.1	84%	0.836	85%	0.853	S	S	*	*	G	3₁₀ helix	trans	-87.5	-13	-169.3	-173.5	0	0	0	0	113.9	A10	V8-A10 VanDerWaalsContact C-N 3.28Å; V8-A10 PolarHBondContact O-N 3.38Å; V8-A10 VanDerWaalsContact O-N 3.14Å
9	A	43.9	Very low	44.9	Very low	97 Å²	97	145.1 Å²	145.1	80%	0.802	85%	0.847	S	S	*	*	G	3₁₀ helix	trans	-76.6	1.6	-168.6	0	0	0	0	0	116.4
10	A	46.7	Very low	44.7	Very low	91 Å²	91	143.8 Å²	143.8	75%	0.752	85%	0.846	S	S	*	*	G	3₁₀ helix	trans	-97.8	-17.2	-167.1	0	0	0	0	0	116.1	V8 L12	V8-A10 VanDerWaalsContact C-N 3.28Å; V8-A10 PolarHBondContact O-N 3.38Å; V8-A10 VanDerWaalsContact O-N 3.14Å; A10-L12 PolarHBondContact O-N 2.9Å
11	A	47.8	Very low	44.5	Very low	94 Å²	94	143.6 Å²	143.6	78%	0.777	84%	0.841	S	S	*	*	S	Bend	trans	-80.2	-19	-162.3	0	0	0	0	0	116.4
12	L	44.5	Very low	45	Very low	181 Å²	181	140.8 Å²	140.8	95%	0.948	83%	0.827	S	S	*	*	S	Bend	trans	-102.7	31.1	-162.8	-88.9	164.8	0	0	0	115.8	A10	A10-L12 PolarHBondContact O-N 2.9Å
13	R	45	Very low	45.2	Very low	238 Å²	238	138.6 Å²	138.6	90%	0.898	82%	0.823	S	S	*	*			trans	-129.7	38.2	-179.6	-154.6	-178.3	-84.3	-149.3	-3.3	115
14	K	48.8	Very low	45.4	Very low	209 Å²	209	140 Å²	140	91%	0.909	83%	0.827	S	S	*	*			trans	-140.1	76.3	169.6	-89.9	-169.3	172.6	-176.9	0	113
15	S	46.6	Very low	45.2	Very low	123 Å²	123	137.3 Å²	137.3	86%	0.86	83%	0.827	S	S	*	*			trans	-139.3	117.4	147.9	58.7	0	0	0	0	109.1
16	G	42.2	Very low	45.3	Very low	89 Å²	89	137.9 Å²	137.9	92%	0.918	83%	0.83	S	S	*	*			trans	-109.1	90.9	177.5	0	0	0	0	0	109.3
17	G	43	Very low	45.7	Very low	73 Å²	73	134.4 Å²	134.4	75%	0.753	82%	0.82	S	S	*	*			trans	-112.8	79.4	-166.1	0	0	0	0	0	114.9
18	I	46.4	Very low	45.9	Very low	171 Å²	171	136.8 Å²	136.8	88%	0.877	82%	0.823	S	S	*	*			trans	67.2	141.7	159.1	-62.3	173.3	0	0	0	117.3
19	I	45.5	Very low	46.2	Very low	144 Å²	144	138.3 Å²	138.3	74%	0.738	82%	0.821	S	S	*	*			trans	-99.7	143.6	-178.2	-66.7	159.5	0	0	0	109.8	L21	I19-L21 HydrophobicContact CG2-CD1 3.55Å; I19-L21 HydrophobicContact CG2-CG 4.39Å
20	S	42	Very low	46.2	Very low	119 Å²	119	142.7 Å²	142.7	83%	0.832	82%	0.822	S	S	*	*			trans	-139.4	125.9	154.3	-170.5	0	0	0	0	109.6
21	L	40.9	Very low	46.3	Very low	141 Å²	141	141.6 Å²	141.6	74%	0.738	82%	0.819	S	S	*	*			trans	-92.7	133.8	179.5	-72.6	94.4	0	0	0	111.1	I19	I19-L21 HydrophobicContact CG2-CD1 3.55Å; I19-L21 HydrophobicContact CG2-CG 4.39Å
22	M	44.9	Very low	46.4	Very low	185 Å²	185	143.6 Å²	143.6	91%	0.911	82%	0.822	S	S	*	*			trans	-126.3	113.4	150.1	-85.3	-168.2	167	0	0	109.3
23	P	46.1	Very low	46.6	Very low	111 Å²	111	141.2 Å²	141.2	72%	0.721	81%	0.811	S	S	*	*			trans	-89	110.9	173.4	32.9	-29.2	0	0	0	110.3
24	M	46.4	Very low	47.2	Very low	188 Å²	188	137.2 Å²	137.2	93%	0.926	81%	0.805	S	S	*	*			trans	-127.4	114.6	157.5	-76.7	-65.5	160.1	0	0	107.6
25	G	44.7	Very low	47.6	Very low	80 Å²	80	135 Å²	135	83%	0.825	80%	0.796	S	S	*	*			trans	-89	129.5	176.9	0	0	0	0	0	110.1
26	D	47.9	Very low	47.8	Very low	156 Å²	156	137.8 Å²	137.8	83%	0.834	80%	0.795	S	S	*	*			trans	-138	155.4	161.4	-130.7	-35.8	0	0	0	110.4	I28	D26-I28 PolarHBondContact O-N 3.18Å
27	S	51.3	Low	48.6	Very low	97 Å²	97	140.9 Å²	140.9	68%	0.678	79%	0.786	S	S	*	*			trans	-77.6	117.5	-156.8	-66	0	0	0	0	114.2	H29	S27-H29 PolarHBondContact O-N 2.88Å
28	I	52.7	Low	49.3	Very low	147 Å²	147	142.3 Å²	142.3	75%	0.754	78%	0.782	S	S	*	*			trans	-68.2	92.8	170.5	-55.6	177.1	0	0	0	110	D26 F30	D26-I28 PolarHBondContact O-N 3.18Å; I28-F30 HydrophobicContact CG2-CD2 4.05Å; I28-F30 HydrophobicContact CG2-CE2 3.92Å; I28-F30 PolarHBondContact O-N 2.86Å
29	H	52.2	Low	50	Low	171 Å²	171	144.6 Å²	144.6	79%	0.792	79%	0.786	S	S	*	*			trans	-75	111.4	166.2	-93.5	56.7	0	0	0	110	S27 G31	S27-H29 PolarHBondContact O-N 2.88Å; H29-G31 VanDerWaalsContact C-N 3.26Å; H29-G31 PolarHBondContact O-N 2.92Å
30	F	44.6	Very low	50.7	Low	189 Å²	189	143.1 Å²	143.1	83%	0.829	78%	0.784	S	S	*	*			trans	-70.8	82.3	168	-89.8	-91	0	0	0	110.4	I28 T32	I28-F30 HydrophobicContact CG2-CD2 4.05Å; I28-F30 HydrophobicContact CG2-CE2 3.92Å; I28-F30 PolarHBondContact O-N 2.86Å; F30-T32 PolarHBondContact O-N 3.16Å
31	G	48.6	Very low	51.4	Low	67 Å²	67	145.3 Å²	145.3	69%	0.691	79%	0.785	S	S	*	*			trans	-66.3	109.1	179.8	0	0	0	0	0	112.5	H29 N33	H29-G31 VanDerWaalsContact C-N 3.26Å; H29-G31 PolarHBondContact O-N 2.92Å; G31-N33 VanDerWaalsContact C-N 3.27Å; G31-N33 PolarHBondContact O-N 2.94Å
32	T	51.1	Low	52.7	Low	136 Å²	136	146.3 Å²	146.3	83%	0.834	79%	0.79	S	S	*	*			trans	-73.6	74.5	176.9	52	0	0	0	0	111.9	F30	F30-T32 PolarHBondContact O-N 3.16Å
33	N	48.6	Very low	54.1	Low	132 Å²	132	143.1 Å²	143.1	71%	0.706	78%	0.782	S	S	*	*			trans	-149.8	54.3	169.9	-132	-103.5	0	0	0	113.1	G31 K35	G31-N33 VanDerWaalsContact C-N 3.27Å; G31-N33 PolarHBondContact O-N 2.94Å; N33-K35 VanDerWaalsContact C-N 3.33Å; N33-K35 PolarHBondContact O-N 2.75Å
34	I	56.4	Low	55.5	Low	153 Å²	153	141.6 Å²	141.6	79%	0.785	77%	0.767	S	S	*	*			trans	-71.4	90.6	172.1	-55.5	174	0	0	0	108.7	Q36	I34-Q36 HydrophobicContact CG2-CG 4.01Å; I34-Q36 PolarHBondContact O-N 3.12Å; I34-Q36 VanDerWaalsContact O-N 3.16Å
35	K	57.3	Low	57.3	Low	163 Å²	163	136.1 Å²	136.1	71%	0.709	74%	0.744	S	S	*	*			trans	-68.5	104.6	159.1	-73.4	-174.2	177.5	-177.6	0	107.8	N33 E37	N33-K35 VanDerWaalsContact C-N 3.33Å; N33-K35 PolarHBondContact O-N 2.75Å; K35-E37 PolarHBondContact O-N 3.36Å
36	Q	50.4	Low	59.3	Low	182 Å²	182	138.3 Å²	138.3	85%	0.85	74%	0.737	S	S	*	*			trans	-73.5	78.9	169.1	-67.2	-177	-51.1	0	0	109.3	I34	I34-Q36 HydrophobicContact CG2-CG 4.01Å; I34-Q36 PolarHBondContact O-N 3.12Å; I34-Q36 VanDerWaalsContact O-N 3.16Å
37	E	59.7	Low	61.2	Low	153 Å²	153	137.1 Å²	137.1	72%	0.715	73%	0.731	S	S	*	*			trans	-69	139	158.4	-63	-159.4	174.9	0	0	108.4	K35	K35-E37 PolarHBondContact O-N 3.36Å
38	P	57.8	Low	62.9	Low	104 Å²	104	137 Å²	137	68%	0.675	72%	0.72	S	S	*	*			trans	-64.4	142.8	-179.4	27.6	-34.5	0	0	0	109.8	T40	P38-T40 PolarHBondContact O-N 3.5Å
39	F	61.1	Low	64.5	Low	218 Å²	218	136.2 Å²	136.2	96%	0.956	71%	0.707	S	S	*	*			trans	-66.5	81.3	175.1	-66.4	-87	0	0	0	110.8	L41	F39-L41 PolarHBondContact O-N 3.14Å
40	T	59.7	Low	66.3	Low	113 Å²	113	133.8 Å²	133.8	69%	0.693	69%	0.694	S	S	*	*	P	Polyproline II helix	trans	-69	118.5	168	39.4	0	0	0	0	108.5	P38 L42	P38-T40 PolarHBondContact O-N 3.5Å; T40-L42 PolarHBondContact O-N 3.27Å; T40-L42 VanDerWaalsContact O-N 3.12Å
41	L	57.1	Low	68.4	Low	165 Å²	165	127.3 Å²	127.3	86%	0.864	68%	0.676	S	S	*	*	P	Polyproline II helix	trans	-58.6	118.1	169.5	-75.2	168.5	0	0	0	108.2	F39 T43	F39-L41 PolarHBondContact O-N 3.14Å; L41-T43 PolarHBondContact O-N 3.21Å
42	L	67.7	Low	70.4	Confident	162 Å²	162	127.4 Å²	127.4	85%	0.848	66%	0.66	S	S	*	*	P	Polyproline II helix	trans	-57	116.5	172.6	-89.1	68.6	0	0	0	108.1	T40 L44	T40-L42 PolarHBondContact O-N 3.27Å; T40-L42 VanDerWaalsContact O-N 3.12Å; L42-L44 PolarHBondContact O-N 3.05Å
43	T	74.3	Confident	72.2	Confident	119 Å²	119	127.3 Å²	127.3	73%	0.73	65%	0.65	S	S	*	*	P	Polyproline II helix	trans	-65.1	118.9	173.5	50.2	0	0	0	0	108.4	L41 T45	L41-T43 PolarHBondContact O-N 3.21Å; T43-T45 PolarHBondContact O-N 2.91Å
44	L	75.2	Confident	74.3	Confident	78 Å²	78	128.5 Å²	128.5	41%	0.408	64%	0.644	S	S	.	*			trans	-45.7	128.1	176.5	-65.2	165.2	0	0	0	110.4	L42 Q48 R49 I52	L42-L44 PolarHBondContact O-N 3.05Å; L44-Q48 HydrophobicContact CB-CB 4.24Å; L44-Q48 HydrophobicContact CD2-CB 4.06Å; L44-R49 HydrophobicContact CB-CG 3.73Å; L44-R49 HydrophobicContact CD1-CG 4.47Å; L44-R49 PolarHBondContact O-NE 2.87Å; L44-I52 HydrophobicContact CD1-CD1 3.75Å; L44-I52 HydrophobicContact CD2-CD1 3.83Å; L44-I52 HydrophobicContact CG-CD1 4.44Å
45	T	85.1	Confident	76	Confident	74 Å²	74	124 Å²	124	45%	0.454	63%	0.629	S	S	.	*			trans	-64.8	158.4	170.9	62.2	0	0	0	0	109.8	T43 D47 Q48 R49	T43-T45 PolarHBondContact O-N 2.91Å; T45-D47 PolarHBondContact O-N 3.46Å; T45-Q48 WeakPolarHBondContact O-CA 3.45Å; T45-Q48 WeakPolarHBondContact O-CB 3.45Å; T45-Q48 PolarHBondContact O-N 2.91Å; T45-Q48 WeakPolarHBondContact OG1-CG 3.44Å; T45-R49 WeakPolarHBondContact O-CG 3.33Å; T45-R49 PolarHBondContact O-N 2.89Å
46	D	86.4	Confident	77.8	Confident	126 Å²	126	123.2 Å²	123.2	67%	0.674	63%	0.626	S	S	*	*	H	α-helix	trans	-63.5	-33	-174.3	-59.4	-50	0	0	0	112.3	Q48 R49 F50	D46-Q48 PolarHBondContact O-N 3.26Å; D46-R49 PolarHBondContact O-N 2.85Å; D46-R49 IonicContact OD1-NE 3.69Å; D46-F50 WeakPolarHBondContact O-CB 3.4Å; D46-F50 PolarHBondContact O-N 3.21Å
47	D	87.7	Confident	79.8	Confident	131 Å²	131	121.2 Å²	121.2	70%	0.701	62%	0.615	S	S	*	*	H	α-helix	trans	-58.9	-43.1	169	-58.5	-49.3	0	0	0	112.6	T45 A51	T45-D47 PolarHBondContact O-N 3.46Å; D47-A51 VanDerWaalsContact O-CB 3.29Å; D47-A51 WeakPolarHBondContact O-CB 3.33Å; D47-A51 PolarHBondContact O-N 2.94Å
48	Q	87.8	Confident	81.4	Confident	95 Å²	95	121.1 Å²	121.1	44%	0.444	61%	0.609	S	S	.	*	H	α-helix	trans	-69.2	-37.6	177.6	-69.8	171.8	-12.9	0	0	111.6	L44 T45 D46 A51 I52	L44-Q48 HydrophobicContact CB-CB 4.24Å; L44-Q48 HydrophobicContact CD2-CB 4.06Å; T45-Q48 WeakPolarHBondContact O-CA 3.45Å; T45-Q48 WeakPolarHBondContact O-CB 3.45Å; T45-Q48 PolarHBondContact O-N 2.91Å; T45-Q48 WeakPolarHBondContact OG1-CG 3.44Å; D46-Q48 PolarHBondContact O-N 3.26Å; Q48-A51 PolarHBondContact O-N 2.95Å; Q48-I52 WeakPolarHBondContact O-CB 3.32Å; Q48-I52 WeakPolarHBondContact O-CD1 3.39Å; Q48-I52 VanDerWaalsContact O-CG1 3.25Å; Q48-I52 WeakPolarHBondContact O-CG1 3.41Å; Q48-I52 PolarHBondContact O-N 3.49Å
49	R	85.9	Confident	83.1	Confident	130 Å²	130	119 Å²	119	49%	0.491	60%	0.6	S	S	.	*	H	α-helix	trans	-62.1	-49.8	174.6	-66.1	173.3	-175.6	-120.4	2.3	110.7	L44 T45 D46 A51 I52 E53	L44-R49 HydrophobicContact CB-CG 3.73Å; L44-R49 HydrophobicContact CD1-CG 4.47Å; L44-R49 PolarHBondContact O-NE 2.87Å; T45-R49 WeakPolarHBondContact O-CG 3.33Å; T45-R49 PolarHBondContact O-N 2.89Å; D46-R49 PolarHBondContact O-N 2.85Å; D46-R49 IonicContact OD1-NE 3.69Å; R49-A51 VanDerWaalsContact C-N 3.35Å; R49-A51 PolarHBondContact O-N 3.5Å; R49-I52 PolarHBondContact O-N 2.84Å; R49-E53 WeakPolarHBondContact O-CB 3.29Å; R49-E53 PolarHBondContact O-N 3.38Å
50	F	89.4	Confident	84.6	Confident	120 Å²	120	113.9 Å²	113.9	53%	0.526	58%	0.582	S	S	.	*	H	α-helix	trans	-63.4	-38.3	178.8	-178.1	-133.2	0	0	0	112.3	D46 E53 R54	D46-F50 WeakPolarHBondContact O-CB 3.4Å; D46-F50 PolarHBondContact O-N 3.21Å; F50-E53 PolarHBondContact O-N 3.29Å; F50-R54 WeakPolarHBondContact O-CB 3.33Å; F50-R54 PolarHBondContact O-N 3.39Å
51	A	89.7	Confident	86.2	Confident	53 Å²	53	113.6 Å²	113.6	44%	0.438	57%	0.573	S	S	.	*	H	α-helix	trans	-64.1	-44.1	172.6	0	0	0	0	0	112.4	D47 Q48 R49 R54 A55	D47-A51 VanDerWaalsContact O-CB 3.29Å; D47-A51 WeakPolarHBondContact O-CB 3.33Å; D47-A51 PolarHBondContact O-N 2.94Å; Q48-A51 PolarHBondContact O-N 2.95Å; R49-A51 VanDerWaalsContact C-N 3.35Å; R49-A51 PolarHBondContact O-N 3.5Å; A51-R54 PolarHBondContact O-N 2.93Å; A51-A55 WeakPolarHBondContact O-CB 3.28Å; A51-A55 PolarHBondContact O-N 3.47Å
52	I	89.2	Confident	87.7	Confident	69 Å²	69	108.5 Å²	108.5	35%	0.354	55%	0.545	S	S	.	.	H	α-helix	trans	-66	-39.2	176.7	-72.7	164.5	0	0	0	111.4	L44 Q48 R49 A55 K56	L44-I52 HydrophobicContact CD1-CD1 3.75Å; L44-I52 HydrophobicContact CD2-CD1 3.83Å; L44-I52 HydrophobicContact CG-CD1 4.44Å; Q48-I52 WeakPolarHBondContact O-CB 3.32Å; Q48-I52 WeakPolarHBondContact O-CD1 3.39Å; Q48-I52 VanDerWaalsContact O-CG1 3.25Å; Q48-I52 WeakPolarHBondContact O-CG1 3.41Å; Q48-I52 PolarHBondContact O-N 3.49Å; R49-I52 PolarHBondContact O-N 2.84Å; I52-A55 PolarHBondContact O-N 2.9Å; I52-K56 HydrophobicContact CG2-CD 4.33Å; I52-K56 WeakPolarHBondContact O-CB 3.46Å; I52-K56 WeakPolarHBondContact O-CG 3.25Å; I52-K56 PolarHBondContact O-N 3.27Å
53	E	89.7	Confident	88.9	Confident	133 Å²	133	104.3 Å²	104.3	62%	0.621	53%	0.529	S	S	*	.	H	α-helix	trans	-66.2	-44.2	177.4	-174.9	164.8	-141.2	0	0	111.8	R49 F50 A55 K56 K57	R49-E53 WeakPolarHBondContact O-CB 3.29Å; R49-E53 PolarHBondContact O-N 3.38Å; F50-E53 PolarHBondContact O-N 3.29Å; E53-A55 PolarHBondContact O-N 3.47Å; E53-K56 PolarHBondContact O-N 2.99Å; E53-K57 PolarHBondContact O-N 3.41Å
54	R	92	Very high	89.8	Confident	158 Å²	158	102.8 Å²	102.8	60%	0.596	52%	0.515	S	S	*	.	H	α-helix	trans	-59.5	-44.5	171.6	-169.4	-172.3	-56.9	-177.8	2.6	111.8	F50 A51 K57 Y58	F50-R54 WeakPolarHBondContact O-CB 3.33Å; F50-R54 PolarHBondContact O-N 3.39Å; A51-R54 PolarHBondContact O-N 2.93Å; R54-K57 PolarHBondContact O-N 2.9Å; R54-Y58 PolarHBondContact O-N 3.28Å
55	A	92.7	Very high	90.5	Very high	57 Å²	57	104.7 Å²	104.7	47%	0.471	52%	0.522	S	S	.	.	H	α-helix	trans	-64.7	-38.5	177.4	0	0	0	0	0	112.4	A51 I52 E53 A59	A51-A55 WeakPolarHBondContact O-CB 3.28Å; A51-A55 PolarHBondContact O-N 3.47Å; I52-A55 PolarHBondContact O-N 2.9Å; E53-A55 PolarHBondContact O-N 3.47Å; A55-A59 VanDerWaalsContact O-CB 3.28Å; A55-A59 WeakPolarHBondContact O-CB 3.35Å; A55-A59 PolarHBondContact O-N 3Å
56	K	94.3	Very high	90.9	Very high	147 Å²	147	105.7 Å²	105.7	64%	0.639	53%	0.525	S	S	*	.	H	α-helix	trans	-63	-45.4	172.7	-78.4	175.4	178.6	-178	0	112	I52 E53 A59 L60	I52-K56 HydrophobicContact CG2-CD 4.33Å; I52-K56 WeakPolarHBondContact O-CB 3.46Å; I52-K56 WeakPolarHBondContact O-CG 3.25Å; I52-K56 PolarHBondContact O-N 3.27Å; E53-K56 PolarHBondContact O-N 2.99Å; K56-A59 PolarHBondContact O-N 2.96Å; K56-L60 WeakPolarHBondContact O-CB 3.29Å; K56-L60 PolarHBondContact O-N 3.34Å
57	K	92.9	Very high	91.2	Very high	141 Å²	141	102.6 Å²	102.6	61%	0.613	52%	0.516	S	S	*	.	H	α-helix	trans	-58	-52.3	176.1	-177	-175.4	170.9	-173	0	110.2	E53 R54 A59 L60 E61	E53-K57 PolarHBondContact O-N 3.41Å; R54-K57 PolarHBondContact O-N 2.9Å; K57-A59 PolarHBondContact O-N 3.23Å; K57-L60 PolarHBondContact O-N 2.87Å; K57-E61 WeakPolarHBondContact CE-OE2 3.44Å; K57-E61 VanDerWaalsContact O-CB 3.29Å; K57-E61 WeakPolarHBondContact O-CB 3.29Å; K57-E61 PolarHBondContact O-N 3.37Å
58	Y	94.2	Very high	91.4	Very high	151 Å²	151	101.2 Å²	101.2	59%	0.592	51%	0.509	S	S	*	.	H	α-helix	trans	-60	-42	179.4	178.7	-111.6	0	0	0	112.7	R54 L60 E61 Q62	R54-Y58 PolarHBondContact O-N 3.28Å; Y58-L60 PolarHBondContact O-N 2.96Å; Y58-E61 PolarHBondContact O-N 2.94Å; Y58-Q62 WeakPolarHBondContact O-CB 3.29Å; Y58-Q62 PolarHBondContact O-N 3.23Å; Y58-Q62 PolarHBondContact OH-OE1 3.49Å
59	A	93	Very high	91.5	Very high	59 Å²	59	100.4 Å²	100.4	49%	0.488	51%	0.513	S	S	.	.	H	α-helix	trans	-65.7	-36.7	176.8	0	0	0	0	0	113.1	A55 K56 K57 S63	A55-A59 VanDerWaalsContact O-CB 3.28Å; A55-A59 WeakPolarHBondContact O-CB 3.35Å; A55-A59 PolarHBondContact O-N 3Å; K56-A59 PolarHBondContact O-N 2.96Å; K57-A59 PolarHBondContact O-N 3.23Å; A59-S63 VanDerWaalsContact O-CB 3.29Å; A59-S63 WeakPolarHBondContact O-CB 3.43Å; A59-S63 PolarHBondContact O-N 3.15Å
60	L	92.8	Very high	91.9	Very high	111 Å²	111	100.8 Å²	100.8	58%	0.581	52%	0.519	S	S	*	.	H	α-helix	trans	-68	-45.5	173.8	177.6	61.3	0	0	0	111.3	K56 K57 Y58 S63 I64	K56-L60 WeakPolarHBondContact O-CB 3.29Å; K56-L60 PolarHBondContact O-N 3.34Å; K57-L60 PolarHBondContact O-N 2.87Å; Y58-L60 PolarHBondContact O-N 2.96Å; L60-S63 WeakPolarHBondContact O-CB 3.31Å; L60-S63 PolarHBondContact O-N 3.02Å; L60-S63 VanDerWaalsContact O-N 3.17Å; L60-I64 HydrophobicContact CD1-CD1 4.03Å; L60-I64 HydrophobicContact CD1-CG1 4.34Å; L60-I64 HydrophobicContact CG-CD1 3.95Å; L60-I64 WeakPolarHBondContact O-CG1 3.35Å; L60-I64 PolarHBondContact O-N 3.43Å
61	E	92.3	Very high	92	Very high	107 Å²	107	99.5 Å²	99.5	50%	0.5	51%	0.514	S	S	.	.	H	α-helix	trans	-59.8	-46.9	178.2	-168.3	163.6	179.5	0	0	111	K57 Y58 S63 I64 Q65	K57-E61 WeakPolarHBondContact CE-OE2 3.44Å; K57-E61 VanDerWaalsContact O-CB 3.29Å; K57-E61 WeakPolarHBondContact O-CB 3.29Å; K57-E61 PolarHBondContact O-N 3.37Å; Y58-E61 PolarHBondContact O-N 2.94Å; E61-S63 PolarHBondContact O-N 2.92Å; E61-I64 PolarHBondContact O-N 3.29Å; E61-Q65 WeakPolarHBondContact O-CB 3.45Å; E61-Q65 PolarHBondContact O-N 3.49Å
62	Q	90.6	Very high	92	Very high	57 Å²	57	99.8 Å²	99.8	27%	0.266	52%	0.517	S	S	.	.	H	α-helix	trans	-64.9	-36.7	173.9	-162.9	65.4	69.1	0	0	112.5	Y58 Q65 N66	Y58-Q62 WeakPolarHBondContact O-CB 3.29Å; Y58-Q62 PolarHBondContact O-N 3.23Å; Y58-Q62 PolarHBondContact OH-OE1 3.49Å; Q62-Q65 PolarHBondContact O-N 3.04Å; Q62-N66 PolarHBondContact NE2-OD1 2.91Å; Q62-N66 VanDerWaalsContact NE2-OD1 3.15Å; Q62-N66 VanDerWaalsContact O-CB 3.31Å; Q62-N66 WeakPolarHBondContact O-CB 3.33Å; Q62-N66 PolarHBondContact O-N 2.89Å; Q62-N66 PolarHBondContact O-OD1 3.47Å
63	S	92.5	Very high	92	Very high	74 Å²	74	99.2 Å²	99.2	52%	0.517	52%	0.522	S	S	.	.	H	α-helix	trans	-66	-39	175.5	-172	0	0	0	0	112.2	A59 L60 E61 A67	A59-S63 VanDerWaalsContact O-CB 3.29Å; A59-S63 WeakPolarHBondContact O-CB 3.43Å; A59-S63 PolarHBondContact O-N 3.15Å; L60-S63 WeakPolarHBondContact O-CB 3.31Å; L60-S63 PolarHBondContact O-N 3.02Å; L60-S63 VanDerWaalsContact O-N 3.17Å; E61-S63 PolarHBondContact O-N 2.92Å; S63-A67 WeakPolarHBondContact O-CB 3.34Å; S63-A67 PolarHBondContact O-N 2.88Å
64	I	91.9	Very high	92.1	Very high	87 Å²	87	98.1 Å²	98.1	45%	0.446	52%	0.517	S	S	.	.	H	α-helix	trans	-67.7	-46.2	175.4	-69.2	165	0	0	0	109.9	L60 E61 N66 A67 L68	L60-I64 HydrophobicContact CD1-CD1 4.03Å; L60-I64 HydrophobicContact CD1-CG1 4.34Å; L60-I64 HydrophobicContact CG-CD1 3.95Å; L60-I64 WeakPolarHBondContact O-CG1 3.35Å; L60-I64 PolarHBondContact O-N 3.43Å; E61-I64 PolarHBondContact O-N 3.29Å; I64-N66 PolarHBondContact O-N 3.47Å; I64-A67 PolarHBondContact O-N 3.2Å; I64-L68 HydrophobicContact CG2-CD1 3.82Å; I64-L68 HydrophobicContact CG2-CG 4.37Å; I64-L68 WeakPolarHBondContact O-CB 3.32Å; I64-L68 WeakPolarHBondContact O-CG 3.24Å; I64-L68 PolarHBondContact O-N 2.95Å
65	Q	91.2	Very high	91.9	Very high	118 Å²	118	94.4 Å²	94.4	55%	0.551	51%	0.509	S	S	*	.	H	α-helix	trans	-59.6	-44.4	177.6	-168.4	-178.6	23	0	0	111.8	E61 Q62 L68 S69	E61-Q65 WeakPolarHBondContact O-CB 3.45Å; E61-Q65 PolarHBondContact O-N 3.49Å; Q62-Q65 PolarHBondContact O-N 3.04Å; Q65-L68 PolarHBondContact O-N 2.92Å; Q65-S69 VanDerWaalsContact O-CB 3.24Å; Q65-S69 WeakPolarHBondContact O-CB 3.4Å; Q65-S69 PolarHBondContact O-N 3.48Å
66	N	93	Very high	91.6	Very high	96 Å²	96	97.4 Å²	97.4	51%	0.513	51%	0.513	S	S	.	.	H	α-helix	trans	-67.1	-36.5	177.9	-68.4	1.6	0	0	0	112.1	Q62 I64 K70	Q62-N66 PolarHBondContact NE2-OD1 2.91Å; Q62-N66 VanDerWaalsContact NE2-OD1 3.15Å; Q62-N66 VanDerWaalsContact O-CB 3.31Å; Q62-N66 WeakPolarHBondContact O-CB 3.33Å; Q62-N66 PolarHBondContact O-N 2.89Å; Q62-N66 PolarHBondContact O-OD1 3.47Å; I64-N66 PolarHBondContact O-N 3.47Å; N66-K70 VanDerWaalsContact O-CB 3.29Å; N66-K70 WeakPolarHBondContact O-CB 3.46Å; N66-K70 PolarHBondContact O-N 3.17Å
67	A	92	Very high	91.2	Very high	60 Å²	60	96.4 Å²	96.4	50%	0.496	51%	0.51	S	S	.	.	H	α-helix	trans	-67.1	-45.9	175.4	0	0	0	0	0	112	S63 I64 K70 Q71	S63-A67 WeakPolarHBondContact O-CB 3.34Å; S63-A67 PolarHBondContact O-N 2.88Å; I64-A67 PolarHBondContact O-N 3.2Å; A67-K70 PolarHBondContact O-N 3.26Å; A67-Q71 WeakPolarHBondContact O-CB 3.48Å; A67-Q71 PolarHBondContact O-N 2.9Å
68	L	92.1	Very high	90.9	Very high	102 Å²	102	95.5 Å²	95.5	53%	0.534	51%	0.508	S	S	.	.	H	α-helix	trans	-64	-44.6	176.5	-71.8	171.2	0	0	0	111.9	I64 Q65 K70 Q71 A72	I64-L68 HydrophobicContact CG2-CD1 3.82Å; I64-L68 HydrophobicContact CG2-CG 4.37Å; I64-L68 WeakPolarHBondContact O-CB 3.32Å; I64-L68 WeakPolarHBondContact O-CG 3.24Å; I64-L68 PolarHBondContact O-N 2.95Å; Q65-L68 PolarHBondContact O-N 2.92Å; L68-K70 PolarHBondContact O-N 3.46Å; L68-Q71 PolarHBondContact O-N 3.37Å; L68-A72 WeakPolarHBondContact O-CB 3.4Å; L68-A72 PolarHBondContact O-N 3.49Å
69	S	91.1	Very high	90.4	Very high	78 Å²	78	92.5 Å²	92.5	55%	0.545	50%	0.502	S	S	.	.	H	α-helix	trans	-59.5	-45.1	175.6	175.9	0	0	0	0	111.6	Q65 Q71 A72 A73	Q65-S69 VanDerWaalsContact O-CB 3.24Å; Q65-S69 WeakPolarHBondContact O-CB 3.4Å; Q65-S69 PolarHBondContact O-N 3.48Å; S69-Q71 PolarHBondContact O-N 3.4Å; S69-A72 PolarHBondContact O-N 2.87Å; S69-A73 WeakPolarHBondContact O-CB 3.38Å; S69-A73 PolarHBondContact O-N 2.86Å
70	K	92.7	Very high	89.9	Confident	139 Å²	139	92.6 Å²	92.6	60%	0.604	50%	0.495	S	S	*	.	H	α-helix	trans	-63.7	-40.6	175.9	-173.9	174.8	-179	178.1	0	112.4	N66 A67 L68 A73 Q74	N66-K70 VanDerWaalsContact O-CB 3.29Å; N66-K70 WeakPolarHBondContact O-CB 3.46Å; N66-K70 PolarHBondContact O-N 3.17Å; A67-K70 PolarHBondContact O-N 3.26Å; L68-K70 PolarHBondContact O-N 3.46Å; K70-A73 PolarHBondContact O-N 2.79Å; K70-Q74 WeakPolarHBondContact O-CB 3.5Å; K70-Q74 VanDerWaalsContact O-CG 3.3Å; K70-Q74 WeakPolarHBondContact O-CG 3.44Å; K70-Q74 PolarHBondContact O-N 2.78Å
71	Q	91.3	Very high	89.3	Confident	92 Å²	92	91.6 Å²	91.6	43%	0.43	49%	0.49	S	S	.	.	H	α-helix	trans	-65.4	-43.2	176.3	-176.6	177.7	-8.5	0	0	111.7	A67 L68 S69 Q74 L75	A67-Q71 WeakPolarHBondContact O-CB 3.48Å; A67-Q71 PolarHBondContact O-N 2.9Å; L68-Q71 PolarHBondContact O-N 3.37Å; S69-Q71 PolarHBondContact O-N 3.4Å; Q71-Q74 PolarHBondContact O-N 3.41Å; Q71-L75 HydrophobicContact CG-CD1 4.43Å; Q71-L75 WeakPolarHBondContact O-CG 3.42Å; Q71-L75 PolarHBondContact O-N 3.34Å
72	A	90.6	Very high	88.8	Confident	59 Å²	59	89.6 Å²	89.6	49%	0.488	49%	0.485	S	S	.	.	H	α-helix	trans	-62.9	-43.6	176.2	0	0	0	0	0	111.8	L68 S69 Q74 L75 H76	L68-A72 WeakPolarHBondContact O-CB 3.4Å; L68-A72 PolarHBondContact O-N 3.49Å; S69-A72 PolarHBondContact O-N 2.87Å; A72-Q74 VanDerWaalsContact C-N 3.33Å; A72-Q74 PolarHBondContact O-N 3.02Å; A72-L75 PolarHBondContact O-N 3.3Å; A72-H76 WeakPolarHBondContact O-CB 3.43Å; A72-H76 PolarHBondContact O-N 2.93Å
73	A	90.1	Very high	88.4	Confident	57 Å²	57	91.9 Å²	91.9	47%	0.471	50%	0.498	S	S	.	.	H	α-helix	trans	-62.5	-37.7	175.4	0	0	0	0	0	112.6	S69 K70 Q77	S69-A73 WeakPolarHBondContact O-CB 3.38Å; S69-A73 PolarHBondContact O-N 2.86Å; K70-A73 PolarHBondContact O-N 2.79Å; A73-Q77 WeakPolarHBondContact O-CB 3.3Å; A73-Q77 PolarHBondContact O-N 2.96Å
74	Q	89.9	Confident	87.9	Confident	111 Å²	111	93.9 Å²	93.9	52%	0.519	50%	0.497	S	S	.	.	H	α-helix	trans	-67.1	-43.2	175.6	-76.4	177.5	-39.2	0	0	112.6	K70 Q71 A72 Q77 Q78	K70-Q74 WeakPolarHBondContact O-CB 3.5Å; K70-Q74 VanDerWaalsContact O-CG 3.3Å; K70-Q74 WeakPolarHBondContact O-CG 3.44Å; K70-Q74 PolarHBondContact O-N 2.78Å; Q71-Q74 PolarHBondContact O-N 3.41Å; A72-Q74 VanDerWaalsContact C-N 3.33Å; A72-Q74 PolarHBondContact O-N 3.02Å; Q74-Q77 PolarHBondContact O-N 3.44Å; Q74-Q78 PolarHBondContact O-N 3.28Å; Q74-Q78 VanDerWaalsContact O-N 3.07Å
75	L	89.1	Confident	87.2	Confident	80 Å²	80	91.8 Å²	91.8	42%	0.419	48%	0.484	S	S	.	.	H	α-helix	trans	-63.7	-49.1	175.2	-70.1	171.7	0	0	0	111	Q71 A72 Q77 Q78 D79	Q71-L75 HydrophobicContact CG-CD1 4.43Å; Q71-L75 WeakPolarHBondContact O-CG 3.42Å; Q71-L75 PolarHBondContact O-N 3.34Å; A72-L75 PolarHBondContact O-N 3.3Å; L75-Q77 VanDerWaalsContact C-N 3.3Å; L75-Q77 PolarHBondContact O-N 2.91Å; L75-Q78 CarbonylContact O-C 3.6Å; L75-Q78 WeakPolarHBondContact O-CA 3.48Å; L75-Q78 WeakPolarHBondContact O-CB 3.27Å; L75-Q78 PolarHBondContact O-N 3.09Å; L75-D79 PolarHBondContact O-N 3.45Å
76	H	85.5	Confident	86.7	Confident	120 Å²	120	89.3 Å²	89.3	56%	0.556	47%	0.474	S	S	*	.	H	α-helix	trans	-57	-41.6	176.4	-178.4	75.8	0	0	0	112.3	A72 Q78 D79 L80	A72-H76 WeakPolarHBondContact O-CB 3.43Å; A72-H76 PolarHBondContact O-N 2.93Å; H76-Q78 VanDerWaalsContact C-N 3.33Å; H76-Q78 PolarHBondContact O-N 2.95Å; H76-D79 PolarHBondContact O-N 3.5Å; H76-L80 VanDerWaalsContact CE1-CD2 3.43Å; H76-L80 WeakPolarHBondContact CE1-CD2 3.33Å; H76-L80 WeakPolarHBondContact O-CB 3.44Å; H76-L80 WeakPolarHBondContact O-CD2 3.43Å; H76-L80 PolarHBondContact O-N 3.35Å
77	Q	87.2	Confident	86.1	Confident	125 Å²	125	90.5 Å²	90.5	58%	0.584	48%	0.477	S	S	*	.	H	α-helix	trans	-64	-36.5	175.1	-170.7	175.6	22.7	0	0	112.5	A73 Q74 L75 N81	A73-Q77 WeakPolarHBondContact O-CB 3.3Å; A73-Q77 PolarHBondContact O-N 2.96Å; Q74-Q77 PolarHBondContact O-N 3.44Å; L75-Q77 VanDerWaalsContact C-N 3.3Å; L75-Q77 PolarHBondContact O-N 2.91Å; Q77-N81 WeakPolarHBondContact O-CB 3.37Å; Q77-N81 PolarHBondContact O-N 3.14Å; Q77-N81 VanDerWaalsContact O-N 3.14Å; Q77-N81 PolarHBondContact O-ND2 3.14Å
78	Q	85.4	Confident	85.6	Confident	123 Å²	123	87.7 Å²	87.7	58%	0.575	45%	0.454	S	S	*	.	H	α-helix	trans	-68.4	-41.9	174.8	-179.5	176.6	-16.1	0	0	112	Q74 L75 H76 N81 T82	Q74-Q78 PolarHBondContact O-N 3.28Å; Q74-Q78 VanDerWaalsContact O-N 3.07Å; L75-Q78 CarbonylContact O-C 3.6Å; L75-Q78 WeakPolarHBondContact O-CA 3.48Å; L75-Q78 WeakPolarHBondContact O-CB 3.27Å; L75-Q78 PolarHBondContact O-N 3.09Å; H76-Q78 VanDerWaalsContact C-N 3.33Å; H76-Q78 PolarHBondContact O-N 2.95Å; Q78-N81 PolarHBondContact O-N 3.17Å; Q78-T82 WeakPolarHBondContact O-CB 3.49Å; Q78-T82 PolarHBondContact O-N 3.37Å; Q78-T82 PolarHBondContact O-OG1 3.49Å
79	D	84.4	Confident	85.2	Confident	87 Å²	87	83.6 Å²	83.6	47%	0.465	43%	0.432	S	S	.	.	H	α-helix	trans	-63.9	-46.2	177.3	-64.9	-32.7	0	0	0	110.9	L75 H76 N81 T82 I83	L75-D79 PolarHBondContact O-N 3.45Å; H76-D79 PolarHBondContact O-N 3.5Å; D79-N81 VanDerWaalsContact C-N 3.32Å; D79-N81 PolarHBondContact O-N 3.36Å; D79-T82 CarbonylContact O-C 3.59Å; D79-T82 WeakPolarHBondContact O-CA 3.46Å; D79-T82 WeakPolarHBondContact O-CB 3.22Å; D79-T82 PolarHBondContact O-N 3.38Å; D79-I83 WeakPolarHBondContact O-CG1 3.48Å; D79-I83 PolarHBondContact O-N 3.07Å
80	L	81.4	Confident	84.8	Confident	62 Å²	62	84.6 Å²	84.6	33%	0.325	43%	0.431	S	S	.	.	H	α-helix	trans	-60.5	-38.2	176.3	-93.6	-73.3	0	0	0	112.7	H76 K84	H76-L80 VanDerWaalsContact CE1-CD2 3.43Å; H76-L80 WeakPolarHBondContact CE1-CD2 3.33Å; H76-L80 WeakPolarHBondContact O-CB 3.44Å; H76-L80 WeakPolarHBondContact O-CD2 3.43Å; H76-L80 PolarHBondContact O-N 3.35Å; L80-K84 WeakPolarHBondContact O-CB 3.41Å; L80-K84 VanDerWaalsContact O-CG 3.27Å; L80-K84 WeakPolarHBondContact O-CG 3.46Å; L80-K84 PolarHBondContact O-N 3.3Å; L80-K84 VanDerWaalsContact O-N 3.11Å
81	N	81.9	Confident	84.4	Confident	89 Å²	89	81 Å²	81	48%	0.476	42%	0.418	S	S	.	.	H	α-helix	trans	-68.8	-35.2	173.6	-71.6	-13.2	0	0	0	111.9	Q77 Q78 D79 R85	Q77-N81 WeakPolarHBondContact O-CB 3.37Å; Q77-N81 PolarHBondContact O-N 3.14Å; Q77-N81 VanDerWaalsContact O-N 3.14Å; Q77-N81 PolarHBondContact O-ND2 3.14Å; Q78-N81 PolarHBondContact O-N 3.17Å; D79-N81 VanDerWaalsContact C-N 3.32Å; D79-N81 PolarHBondContact O-N 3.36Å; N81-R85 WeakPolarHBondContact O-CB 3.45Å; N81-R85 PolarHBondContact O-N 3.01Å
82	T	82	Confident	84.2	Confident	66 Å²	66	76.7 Å²	76.7	41%	0.405	40%	0.397	S	S	.	.	H	α-helix	trans	-68.9	-41.8	177.2	-55.7	0	0	0	0	111.6	Q78 D79 R85 N86	Q78-T82 WeakPolarHBondContact O-CB 3.49Å; Q78-T82 PolarHBondContact O-N 3.37Å; Q78-T82 PolarHBondContact O-OG1 3.49Å; D79-T82 CarbonylContact O-C 3.59Å; D79-T82 WeakPolarHBondContact O-CA 3.46Å; D79-T82 WeakPolarHBondContact O-CB 3.22Å; D79-T82 PolarHBondContact O-N 3.38Å; T82-R85 PolarHBondContact O-N 3.48Å; T82-N86 VanDerWaalsContact O-CG 3.27Å; T82-N86 PolarHBondContact O-N 2.98Å
83	I	81.8	Confident	84.1	Confident	104 Å²	104	74.2 Å²	74.2	53%	0.533	38%	0.377	S	S	.	.	H	α-helix	trans	-61.6	-50.1	174.7	-67.5	163.1	0	0	0	110.3	D79 R85 N86 Q87	D79-I83 WeakPolarHBondContact O-CG1 3.48Å; D79-I83 PolarHBondContact O-N 3.07Å; I83-R85 VanDerWaalsContact C-N 3.31Å; I83-R85 PolarHBondContact O-N 3.37Å; I83-N86 PolarHBondContact O-N 2.97Å; I83-Q87 WeakPolarHBondContact O-CB 3.39Å; I83-Q87 PolarHBondContact O-N 2.98Å
84	K	80.5	Confident	84.2	Confident	117 Å²	117	76.5 Å²	76.5	51%	0.509	37%	0.373	S	S	.	.	H	α-helix	trans	-56.9	-42.9	175.9	-74.2	170.1	-179.1	176.4	0	112.2	L80 Q87 A88	L80-K84 WeakPolarHBondContact O-CB 3.41Å; L80-K84 VanDerWaalsContact O-CG 3.27Å; L80-K84 WeakPolarHBondContact O-CG 3.46Å; L80-K84 PolarHBondContact O-N 3.3Å; L80-K84 VanDerWaalsContact O-N 3.11Å; K84-Q87 PolarHBondContact O-N 3.44Å; K84-A88 WeakPolarHBondContact O-CB 3.47Å; K84-A88 PolarHBondContact O-N 2.88Å
85	R	77.7	Confident	84.3	Confident	43 Å²	43	71.2 Å²	71.2	16%	0.162	35%	0.348	C	S	.	.	H	α-helix	trans	-61	-47.9	175.2	176.4	164.4	-156.5	147	6.2	112	N81 T82 I83 Q87 A88 L89 L182 E185 L268	N81-R85 WeakPolarHBondContact O-CB 3.45Å; N81-R85 PolarHBondContact O-N 3.01Å; T82-R85 PolarHBondContact O-N 3.48Å; I83-R85 VanDerWaalsContact C-N 3.31Å; I83-R85 PolarHBondContact O-N 3.37Å; R85-Q87 PolarHBondContact O-N 3.47Å; R85-A88 WeakPolarHBondContact O-CB 3.3Å; R85-A88 PolarHBondContact O-N 2.96Å; R85-L89 HydrophobicContact CG-CD1 4Å; R85-L89 HydrophobicContact CG-CG 4.39Å; R85-L89 VanDerWaalsContact O-CG 3.3Å; R85-L89 WeakPolarHBondContact O-CG 3.36Å; R85-L89 PolarHBondContact O-N 3.48Å; R85-L182 HydrophobicContact CG-CD2 3.77Å; R85-E185 IonicContact CZ-OE1 2.71Å; R85-E185 IonicContact CZ-OE2 3.37Å; R85-E185 VanDerWaalsContact CZ-OE2 3.24Å; R85-E185 IonicContact NH1-OE1 3.62Å; R85-E185 PolarHBondContact NH1-OE1 3.41Å; R85-E185 IonicContact NH1-OE2 2.69Å; R85-E185 PolarHBondContact NH1-OE2 2.84Å; R85-E185 IonicContact NH2-OE1 3.51Å; R85-E185 IonicContact NH2-OE2 3.42Å; R85-E185 PolarHBondContact NH2-OE2 2.79Å; R85-L268 PolarHBondContact NH2-O 2.87Å
86	N	81.8	Confident	84.5	Confident	65 Å²	65	71.3 Å²	71.3	35%	0.348	34%	0.344	S	S	.	.	H	α-helix	trans	-65.5	-40.7	-178.9	-69.1	-14.2	0	0	0	111.5	T82 I83 L89 I90	T82-N86 VanDerWaalsContact O-CG 3.27Å; T82-N86 PolarHBondContact O-N 2.98Å; I83-N86 PolarHBondContact O-N 2.97Å; N86-L89 PolarHBondContact O-N 3.12Å; N86-I90 VanDerWaalsContact O-CG1 3.31Å; N86-I90 WeakPolarHBondContact O-CG1 3.12Å; N86-I90 PolarHBondContact O-N 3.38Å
87	Q	80.7	Confident	84.9	Confident	121 Å²	121	65.6 Å²	65.6	57%	0.565	32%	0.317	S	S	*	.	H	α-helix	trans	-60.3	-44.5	172.4	-169.9	-178.6	24.8	0	0	111.7	I83 K84 R85 I90 L91	I83-Q87 WeakPolarHBondContact O-CB 3.39Å; I83-Q87 PolarHBondContact O-N 2.98Å; K84-Q87 PolarHBondContact O-N 3.44Å; R85-Q87 PolarHBondContact O-N 3.47Å; Q87-I90 PolarHBondContact O-N 3.2Å; Q87-L91 HydrophobicContact CG-CD1 4.34Å; Q87-L91 WeakPolarHBondContact O-CG 3.43Å; Q87-L91 PolarHBondContact O-N 3.45Å
88	A	80.1	Confident	85.2	Confident	2 Å²	2	59.7 Å²	59.7	2%	0.017	29%	0.29	C	S	.	.	H	α-helix	trans	-61.4	-44	175.7	0	0	0	0	0	112.6	K84 R85 I90 L91 L92 L178 L182	K84-A88 WeakPolarHBondContact O-CB 3.47Å; K84-A88 PolarHBondContact O-N 2.88Å; R85-A88 WeakPolarHBondContact O-CB 3.3Å; R85-A88 PolarHBondContact O-N 2.96Å; A88-I90 PolarHBondContact O-N 3.44Å; A88-L91 PolarHBondContact O-N 3.05Å; A88-L92 WeakPolarHBondContact O-CB 3.43Å; A88-L92 WeakPolarHBondContact O-CD1 3.17Å; A88-L92 WeakPolarHBondContact O-CG 3Å; A88-L92 PolarHBondContact O-N 3.15Å; A88-L178 HydrophobicContact CB-CB 3.94Å; A88-L178 HydrophobicContact CB-CD1 3.98Å; A88-L178 HydrophobicContact CB-CD2 4.3Å; A88-L178 HydrophobicContact CB-CG 4.29Å; A88-L182 HydrophobicContact CB-CD1 3.91Å
89	L	83.7	Confident	85.5	Confident	16 Å²	16	55.5 Å²	55.5	8%	0.084	27%	0.274	C	S	.	.	H	α-helix	trans	-61.3	-42.5	176.1	-67.5	167.9	0	0	0	111.4	R85 N86 L92 S93 P144 L182	R85-L89 HydrophobicContact CG-CD1 4Å; R85-L89 HydrophobicContact CG-CG 4.39Å; R85-L89 VanDerWaalsContact O-CG 3.3Å; R85-L89 WeakPolarHBondContact O-CG 3.36Å; R85-L89 PolarHBondContact O-N 3.48Å; N86-L89 PolarHBondContact O-N 3.12Å; L89-L92 PolarHBondContact O-N 3.35Å; L89-S93 PolarHBondContact O-N 3.01Å; L89-S93 PolarHBondContact O-OG 2.94Å; L89-P144 HydrophobicContact CB-CG 4.37Å; L89-P144 HydrophobicContact CD2-CG 3.68Å; L89-L182 HydrophobicContact CD2-CD1 4.11Å; L89-L182 HydrophobicContact CG-CD1 4.4Å
90	I	84	Confident	85.9	Confident	99 Å²	99	51.4 Å²	51.4	51%	0.508	25%	0.252	S	S	.	.	H	α-helix	trans	-63.4	-44.1	176.5	-67.4	163.2	0	0	0	111.5	N86 Q87 A88 L92 S93	N86-I90 VanDerWaalsContact O-CG1 3.31Å; N86-I90 WeakPolarHBondContact O-CG1 3.12Å; N86-I90 PolarHBondContact O-N 3.38Å; Q87-I90 PolarHBondContact O-N 3.2Å; A88-I90 PolarHBondContact O-N 3.44Å; I90-L92 VanDerWaalsContact C-N 3.32Å; I90-L92 PolarHBondContact O-N 3.39Å; I90-S93 PolarHBondContact O-N 2.94Å
91	L	84.5	Confident	86.3	Confident	64 Å²	64	49.1 Å²	49.1	34%	0.335	24%	0.241	S	C	.	.	H	α-helix	trans	-63.4	-38.3	175.7	-70.2	170.4	0	0	0	111.9	Q87 A88 R94 A172	Q87-L91 HydrophobicContact CG-CD1 4.34Å; Q87-L91 WeakPolarHBondContact O-CG 3.43Å; Q87-L91 PolarHBondContact O-N 3.45Å; A88-L91 PolarHBondContact O-N 3.05Å; L91-R94 PolarHBondContact O-N 3.38Å; L91-A172 HydrophobicContact CD1-CB 4.37Å; L91-A172 HydrophobicContact CD2-CB 4.27Å
92	L	85.8	Confident	86.6	Confident	1 Å²	1	49.9 Å²	49.9	1%	0.005	24%	0.24	C	C	.	.	H	α-helix	trans	-71.4	-26.6	177.4	-74.3	168.1	0	0	0	113.8	A88 L89 I90 R94 P144 A147 R168 T175 E179 L182	A88-L92 WeakPolarHBondContact O-CB 3.43Å; A88-L92 WeakPolarHBondContact O-CD1 3.17Å; A88-L92 WeakPolarHBondContact O-CG 3Å; A88-L92 PolarHBondContact O-N 3.15Å; L89-L92 PolarHBondContact O-N 3.35Å; I90-L92 VanDerWaalsContact C-N 3.32Å; I90-L92 PolarHBondContact O-N 3.39Å; L92-R94 PolarHBondContact O-N 2.76Å; L92-P144 HydrophobicContact CB-CB 3.64Å; L92-A147 WeakPolarHBondContact O-CB 3.36Å; L92-R168 PolarHBondContact O-NH1 2.77Å; L92-T175 HydrophobicContact CD2-CG2 3.36Å; L92-T175 HydrophobicContact CG-CG2 4.01Å; L92-E179 HydrophobicContact CD1-CB 4.28Å; L92-E179 HydrophobicContact CD1-CG 4.16Å; L92-E179 HydrophobicContact CD2-CB 3.79Å; L92-E179 HydrophobicContact CD2-CG 3.58Å; L92-E179 VanDerWaalsContact CD2-OE2 3.23Å; L92-E179 WeakPolarHBondContact CD2-OE2 3.42Å; L92-L182 HydrophobicContact CD1-CD1 3.8Å
93	S	89.5	Confident	86.8	Confident	7 Å²	7	54.9 Å²	54.9	5%	0.049	26%	0.259	C	S	.	.	T	Hydrogen-bonded Turn	trans	-70.9	-12.2	173.9	-75.5	0	0	0	0	114.3	L89 I90 E140 F141 P144	L89-S93 PolarHBondContact O-N 3.01Å; L89-S93 PolarHBondContact O-OG 2.94Å; I90-S93 PolarHBondContact O-N 2.94Å; S93-E140 WeakPolarHBondContact O-CA 3.32Å; S93-F141 VanDerWaalsContact CB-O 3.31Å; S93-F141 WeakPolarHBondContact CB-O 3.22Å; S93-F141 PolarHBondContact O-N 3.23Å; S93-P144 WeakPolarHBondContact OG-CA 3.46Å; S93-P144 WeakPolarHBondContact OG-CD 3.27Å
94	R	90.7	Very high	87.1	Confident	105 Å²	105	50.3 Å²	50.3	40%	0.396	24%	0.236	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.8	130.6	-179.1	-169.4	170.3	174.7	163.7	-2.3	111.9	L91 L92 V139 P169	L91-R94 PolarHBondContact O-N 3.38Å; L92-R94 PolarHBondContact O-N 2.76Å; R94-V139 WeakPolarHBondContact CA-O 3.49Å; R94-P169 HydrophobicContact CG-CG 4.44Å; R94-P169 VanDerWaalsContact O-CD 3.28Å; R94-P169 WeakPolarHBondContact O-CD 3.29Å
95	I	93.3	Very high	87.5	Confident	0 Å²	0	46.7 Å²	46.7	0%	0	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	152.1	170.4	58.5	169.5	0	0	0	111.3	V97 F113 F138 V139 F141 A147 A150 V166	I95-V97 HydrophobicContact CD1-CG2 3.84Å; I95-V97 HydrophobicContact CG1-CG2 4.18Å; I95-F113 HydrophobicContact CD1-CD1 3.96Å; I95-F113 HydrophobicContact CD1-CE1 3.64Å; I95-F113 HydrophobicContact CD1-CZ 4.33Å; I95-F138 WeakPolarHBondContact O-CA 3.38Å; I95-V139 HydrophobicContact CD1-CB 4.16Å; I95-V139 HydrophobicContact CG1-CB 3.8Å; I95-V139 PolarHBondContact N-O 3.1Å; I95-V139 PolarHBondContact O-N 3.38Å; I95-F141 HydrophobicContact CD1-CE2 3.89Å; I95-F141 HydrophobicContact CG1-CE2 4.2Å; I95-A147 HydrophobicContact CG2-CB 4.01Å; I95-A147 WeakPolarHBondContact CG2-O 3.4Å; I95-A150 HydrophobicContact CD1-CB 4.06Å; I95-V166 HydrophobicContact CB-CG1 4.35Å; I95-V166 HydrophobicContact CD1-CG1 3.89Å
96	Y	93.4	Very high	88.1	Confident	81 Å²	81	48.2 Å²	48.2	32%	0.318	24%	0.241	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.4	134.6	163.2	168.7	-93.7	0	0	0	109.2	F136 F138 V166 G167	Y96-F136 HydrophobicContact CD2-CD2 4.5Å; Y96-F136 HydrophobicContact CE2-CB 3.64Å; Y96-F136 AromaticContact CE2-CD2 3.85Å; Y96-F136 HydrophobicContact CE2-CD2 3.85Å; Y96-F136 AromaticContact CE2-CG 3.93Å; Y96-F136 HydrophobicContact CE2-CG 3.93Å; Y96-F138 HydrophobicContact CD2-CD1 4.4Å; Y96-F138 AromaticContact CD2-CE1 3.89Å; Y96-F138 HydrophobicContact CD2-CE1 3.89Å; Y96-F138 HydrophobicContact CD2-CZ 4.24Å; Y96-V166 WeakPolarHBondContact O-CA 3.21Å; Y96-G167 PolarHBondContact N-O 3.36Å; Y96-G167 PolarHBondContact O-N 3.1Å; Y96-G167 VanDerWaalsContact O-N 3.1Å
97	V	93.6	Very high	88.6	Confident	1 Å²	1	51 Å²	51	1%	0.006	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	106.5	174.7	-175.5	0	0	0	0	108.2	I95 I100 F113 F136 A137 V139 L164 V166	I95-V97 HydrophobicContact CD1-CG2 3.84Å; I95-V97 HydrophobicContact CG1-CG2 4.18Å; V97-I100 HydrophobicContact CB-CD1 4.34Å; V97-I100 HydrophobicContact CG1-CD1 3.96Å; V97-I100 HydrophobicContact CG1-CG1 3.99Å; V97-I100 WeakPolarHBondContact O-CD1 3.47Å; V97-F113 HydrophobicContact CB-CZ 4.44Å; V97-F113 HydrophobicContact CG1-CE2 3.95Å; V97-F113 HydrophobicContact CG1-CZ 3.95Å; V97-F113 HydrophobicContact CG2-CE1 4.24Å; V97-F113 HydrophobicContact CG2-CE2 3.87Å; V97-F113 HydrophobicContact CG2-CZ 3.57Å; V97-F136 CarbonylContact O-C 3.55Å; V97-F136 VanDerWaalsContact O-CA 3.25Å; V97-F136 WeakPolarHBondContact O-CA 3.45Å; V97-A137 PolarHBondContact N-O 2.89Å; V97-A137 PolarHBondContact O-N 3.09Å; V97-V139 HydrophobicContact CG2-CG2 4.01Å; V97-L164 HydrophobicContact CG1-CD1 4.41Å; V97-L164 HydrophobicContact CG1-CD2 4.29Å; V97-V166 HydrophobicContact CG1-CG2 4.38Å; V97-V166 HydrophobicContact CG2-CG2 4.45Å
98	G	92.9	Very high	89.1	Confident	0 Å²	0	48.9 Å²	48.9	0%	0	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110	172.3	-179.5	0	0	0	0	0	113.9	I100 G135 K165	G98-I100 PolarHBondContact O-N 3.33Å; G98-G135 CarbonylContact C-O 3.6Å; G98-K165 PolarHBondContact N-O 3.4Å; G98-K165 PolarHBondContact O-N 3.25Å
99	S	92.1	Very high	89.7	Confident	36 Å²	36	48.9 Å²	48.9	25%	0.252	24%	0.241	S	C	.	.	S	Bend	trans	67.4	12	179.2	-56.5	0	0	0	0	115.6	G135 R162 N163	S99-G135 PolarHBondContact N-O 2.93Å; S99-R162 PolarHBondContact O-NE 3.21Å; S99-R162 PolarHBondContact O-NH2 3.42Å; S99-N163 WeakPolarHBondContact CB-O 3.48Å
100	I	91.9	Very high	90.2	Very high	1 Å²	1	51.6 Å²	51.6	1%	0.005	25%	0.251	C	S	.	.			trans	-52.8	139.1	175.8	-51.3	173.4	0	0	0	110.5	V97 G98 I104 I109 L124 G135 A137 L164	V97-I100 HydrophobicContact CB-CD1 4.34Å; V97-I100 HydrophobicContact CG1-CD1 3.96Å; V97-I100 HydrophobicContact CG1-CG1 3.99Å; V97-I100 WeakPolarHBondContact O-CD1 3.47Å; G98-I100 PolarHBondContact O-N 3.33Å; I100-I104 HydrophobicContact CG2-CB 3.78Å; I100-I104 HydrophobicContact CG2-CD1 3.85Å; I100-I104 HydrophobicContact CG2-CG1 4.37Å; I100-I104 HydrophobicContact CG2-CG2 4.04Å; I100-I109 HydrophobicContact CD1-CD1 3.8Å; I100-I109 HydrophobicContact CG2-CD1 4.47Å; I100-L124 HydrophobicContact CD1-CD1 4.45Å; I100-G135 PolarHBondContact N-O 3.39Å; I100-A137 HydrophobicContact CD1-CB 3.75Å; I100-L164 HydrophobicContact CB-CD2 4.47Å; I100-L164 HydrophobicContact CG1-CD2 3.97Å
101	S	90.7	Very high	90.6	Very high	14 Å²	14	52.5 Å²	52.5	10%	0.098	25%	0.251	C	S	.	.			trans	-71.6	142.2	174.2	-161.8	0	0	0	0	112	E103 I104 H133	S101-E103 PolarHBondContact O-N 3.28Å; S101-I104 WeakPolarHBondContact O-CB 3.37Å; S101-I104 PolarHBondContact O-N 3.03Å; S101-H133 PolarHBondContact O-CE1 2.64Å; S101-H133 PolarHBondContact O-NE2 3.12Å
102	F	88.2	Confident	90.9	Very high	104 Å²	104	50.6 Å²	50.6	46%	0.456	24%	0.242	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.4	1.3	-176	-62.1	-64.1	0	0	0	116	K132 H133	F102-K132 HydrophobicContact CB-CD 4.32Å; F102-H133 VanDerWaalsContact CA-NE2 3.29Å; F102-H133 WeakPolarHBondContact CA-NE2 3.29Å; F102-H133 VanDerWaalsContact CD1-O 3.25Å; F102-H133 WeakPolarHBondContact CD1-O 3.29Å; F102-H133 VanDerWaalsContact CE1-O 3.3Å; F102-H133 WeakPolarHBondContact CE1-O 3.25Å
103	E	86.6	Confident	91.3	Very high	171 Å²	171	50.6 Å²	50.6	80%	0.799	24%	0.242	S	C	*	.	T	Hydrogen-bonded Turn	trans	-105.2	-5.5	-179.3	-63	168.7	169.1	0	0	111.8	S101	S101-E103 PolarHBondContact O-N 3.28Å
104	I	87.9	Confident	91.4	Very high	9 Å²	9	53.6 Å²	53.6	5%	0.046	26%	0.263	C	S	.	.			trans	-100.2	107.1	-172.7	-56.9	170.2	0	0	0	109.5	I100 S101 E108 I109 H133 L159 A160	I100-I104 HydrophobicContact CG2-CB 3.78Å; I100-I104 HydrophobicContact CG2-CD1 3.85Å; I100-I104 HydrophobicContact CG2-CG1 4.37Å; I100-I104 HydrophobicContact CG2-CG2 4.04Å; S101-I104 WeakPolarHBondContact O-CB 3.37Å; S101-I104 PolarHBondContact O-N 3.03Å; I104-E108 HydrophobicContact CG2-CB 3.96Å; I104-E108 HydrophobicContact CG2-CG 4.3Å; I104-I109 HydrophobicContact CG2-CG1 3.82Å; I104-H133 PolarHBondContact O-NE2 3.3Å; I104-L159 HydrophobicContact CD1-CB 4.33Å; I104-L159 HydrophobicContact CD1-CD2 3.78Å; I104-L159 HydrophobicContact CD1-CG 3.71Å; I104-L159 HydrophobicContact CG2-CD2 4.35Å; I104-A160 HydrophobicContact CD1-CB 3.81Å; I104-A160 HydrophobicContact CG1-CB 4.05Å
105	G	88.1	Confident	91.5	Very high	41 Å²	41	50.8 Å²	50.8	42%	0.423	26%	0.258	S	S	.	.			trans	-75.3	172.5	171.6	0	0	0	0	0	113.7	E107 E108 I109	G105-E107 VanDerWaalsContact C-N 3.26Å; G105-E107 PolarHBondContact O-N 3.17Å; G105-E108 PolarHBondContact O-N 2.66Å; G105-I109 PolarHBondContact O-N 3.35Å
106	E	90.8	Very high	91.4	Very high	74 Å²	74	51 Å²	51	35%	0.346	26%	0.259	S	S	.	.	H	α-helix	trans	-52.9	-41.5	179.3	-164.8	-150	123.8	0	0	112.8	E108 I109 R110 V122	E106-E108 PolarHBondContact O-N 3.02Å; E106-I109 WeakPolarHBondContact O-CB 3.43Å; E106-I109 PolarHBondContact O-N 2.96Å; E106-R110 WeakPolarHBondContact O-CB 3.35Å; E106-R110 PolarHBondContact O-N 3.36Å; E106-R110 IonicContact OE1-CZ 2.89Å; E106-R110 IonicContact OE1-NE 3.88Å; E106-R110 PolarHBondContact OE1-NE 2.94Å; E106-R110 IonicContact OE1-NH2 3.71Å; E106-R110 PolarHBondContact OE1-NH2 2.86Å; E106-V122 HydrophobicContact CG-CB 3.6Å; E106-V122 HydrophobicContact CG-CG1 3.53Å; E106-V122 HydrophobicContact CG-CG2 4.44Å
107	E	91.8	Very high	91.3	Very high	125 Å²	125	47.4 Å²	47.4	58%	0.584	25%	0.247	S	C	*	.	H	α-helix	trans	-64.1	-37.3	-176.3	-175.2	56.5	-155.5	0	0	112.9	G105 R110 K111	G105-E107 VanDerWaalsContact C-N 3.26Å; G105-E107 PolarHBondContact O-N 3.17Å; E107-R110 PolarHBondContact O-N 3.11Å; E107-K111 WeakPolarHBondContact O-CB 3.33Å; E107-K111 PolarHBondContact O-N 3.03Å
108	E	91.9	Very high	91.1	Very high	75 Å²	75	48 Å²	48	35%	0.35	25%	0.25	S	S	.	.	H	α-helix	trans	-75	-29.5	178.3	-168.1	64.5	-156	0	0	111.1	I104 G105 E106 K111 T112	I104-E108 HydrophobicContact CG2-CB 3.96Å; I104-E108 HydrophobicContact CG2-CG 4.3Å; G105-E108 PolarHBondContact O-N 2.66Å; E106-E108 PolarHBondContact O-N 3.02Å; E108-K111 IonicContact OE1-NZ 3.7Å; E108-K111 PolarHBondContact OE1-NZ 2.91Å; E108-K111 IonicContact OE2-NZ 2.69Å; E108-K111 PolarHBondContact OE2-NZ 3.5Å; E108-T112 VanDerWaalsContact O-CB 3.28Å; E108-T112 WeakPolarHBondContact O-CB 3.47Å; E108-T112 PolarHBondContact O-N 2.78Å; E108-T112 PolarHBondContact O-OG1 3.43Å
109	I	92.6	Very high	91.1	Very high	2 Å²	2	49 Å²	49	1%	0.01	26%	0.256	C	S	.	.	H	α-helix	trans	-64.4	-52.7	168.2	-59	166.3	0	0	0	109.2	I100 I104 G105 E106 K111 T112 F113 V122 L124 A137 V139	I100-I109 HydrophobicContact CD1-CD1 3.8Å; I100-I109 HydrophobicContact CG2-CD1 4.47Å; I104-I109 HydrophobicContact CG2-CG1 3.82Å; G105-I109 PolarHBondContact O-N 3.35Å; E106-I109 WeakPolarHBondContact O-CB 3.43Å; E106-I109 PolarHBondContact O-N 2.96Å; I109-K111 VanDerWaalsContact C-N 3.32Å; I109-K111 PolarHBondContact O-N 2.96Å; I109-T112 PolarHBondContact O-N 3.07Å; I109-F113 HydrophobicContact CG2-CD2 3.76Å; I109-F113 HydrophobicContact CG2-CE2 4.06Å; I109-F113 WeakPolarHBondContact O-CD2 3.45Å; I109-F113 PolarHBondContact O-N 3.24Å; I109-V122 HydrophobicContact CG2-CG1 4.25Å; I109-L124 HydrophobicContact CD1-CD1 3.84Å; I109-A137 HydrophobicContact CD1-CB 4.09Å; I109-V139 HydrophobicContact CG2-CG2 3.88Å
110	R	93.4	Very high	91	Very high	73 Å²	73	52.8 Å²	52.8	28%	0.275	27%	0.267	S	S	.	.	H	α-helix	trans	-53.5	-47.9	178.4	-177.5	179	-69.5	-86.4	4.9	111.3	E106 E107 F113 S114 I119 V122	E106-R110 WeakPolarHBondContact O-CB 3.35Å; E106-R110 PolarHBondContact O-N 3.36Å; E106-R110 IonicContact OE1-CZ 2.89Å; E106-R110 IonicContact OE1-NE 3.88Å; E106-R110 PolarHBondContact OE1-NE 2.94Å; E106-R110 IonicContact OE1-NH2 3.71Å; E106-R110 PolarHBondContact OE1-NH2 2.86Å; E107-R110 PolarHBondContact O-N 3.11Å; R110-F113 PolarHBondContact O-N 3.37Å; R110-S114 VanDerWaalsContact O-CB 3.27Å; R110-S114 WeakPolarHBondContact O-CB 3.23Å; R110-S114 PolarHBondContact O-N 3Å; R110-I119 HydrophobicContact CG-CD1 4.24Å; R110-I119 VanDerWaalsContact O-CD1 3.31Å; R110-I119 WeakPolarHBondContact O-CD1 3.47Å; R110-V122 HydrophobicContact CB-CG2 4.4Å
111	K	92.5	Very high	91	Very high	119 Å²	119	55 Å²	55	52%	0.517	28%	0.283	S	S	.	.	H	α-helix	trans	-62.3	-40.3	175	173.7	170.8	158.1	-109.9	0	113.4	E107 E108 I109	E107-K111 WeakPolarHBondContact O-CB 3.33Å; E107-K111 PolarHBondContact O-N 3.03Å; E108-K111 IonicContact OE1-NZ 3.7Å; E108-K111 PolarHBondContact OE1-NZ 2.91Å; E108-K111 IonicContact OE2-NZ 2.69Å; E108-K111 PolarHBondContact OE2-NZ 3.5Å; I109-K111 VanDerWaalsContact C-N 3.32Å; I109-K111 PolarHBondContact O-N 2.96Å
112	T	92.1	Very high	91.1	Very high	23 Å²	23	55 Å²	55	14%	0.141	28%	0.282	C	S	.	.	H	α-helix	trans	-67.9	-38.1	177.6	-59.4	0	0	0	0	112.3	E108 I109 P115 M154 L159	E108-T112 VanDerWaalsContact O-CB 3.28Å; E108-T112 WeakPolarHBondContact O-CB 3.47Å; E108-T112 PolarHBondContact O-N 2.78Å; E108-T112 PolarHBondContact O-OG1 3.43Å; I109-T112 PolarHBondContact O-N 3.07Å; T112-P115 WeakPolarHBondContact O-CD 3.41Å; T112-M154 HydrophobicContact CG2-CE 3.38Å; T112-L159 HydrophobicContact CG2-CD2 4.37Å
113	F	93.4	Very high	91.3	Very high	1 Å²	1	52.2 Å²	52.2	0%	0.004	28%	0.278	C	S	.	.	H	α-helix	trans	-91	-16.6	-177.6	-77.6	-84.1	0	0	0	114.3	I95 V97 I109 R110 F116 I119 V139 F141 A150 M154 L164 V166	I95-F113 HydrophobicContact CD1-CD1 3.96Å; I95-F113 HydrophobicContact CD1-CE1 3.64Å; I95-F113 HydrophobicContact CD1-CZ 4.33Å; V97-F113 HydrophobicContact CB-CZ 4.44Å; V97-F113 HydrophobicContact CG1-CE2 3.95Å; V97-F113 HydrophobicContact CG1-CZ 3.95Å; V97-F113 HydrophobicContact CG2-CE1 4.24Å; V97-F113 HydrophobicContact CG2-CE2 3.87Å; V97-F113 HydrophobicContact CG2-CZ 3.57Å; I109-F113 HydrophobicContact CG2-CD2 3.76Å; I109-F113 HydrophobicContact CG2-CE2 4.06Å; I109-F113 WeakPolarHBondContact O-CD2 3.45Å; I109-F113 PolarHBondContact O-N 3.24Å; R110-F113 PolarHBondContact O-N 3.37Å; F113-F116 HydrophobicContact CD1-CD2 4.32Å; F113-F116 WeakPolarHBondContact O-CD2 3.5Å; F113-F116 PolarHBondContact O-N 3.18Å; F113-F116 VanDerWaalsContact O-N 3.13Å; F113-I119 HydrophobicContact CB-CD1 3.74Å; F113-V139 HydrophobicContact CD2-CG2 4.43Å; F113-F141 HydrophobicContact CB-CZ 4.1Å; F113-F141 HydrophobicContact CD1-CZ 4.2Å; F113-A150 HydrophobicContact CD1-CB 3.89Å; F113-A150 HydrophobicContact CE1-CB 4.07Å; F113-M154 HydrophobicContact CD1-CG 4.16Å; F113-M154 HydrophobicContact CE1-CB 3.74Å; F113-M154 HydrophobicContact CE1-CG 3.61Å; F113-M154 HydrophobicContact CZ-CB 3.98Å; F113-M154 HydrophobicContact CZ-CE 4.41Å; F113-M154 HydrophobicContact CZ-CG 4.12Å; F113-L164 HydrophobicContact CE2-CD1 4.49Å; F113-V166 HydrophobicContact CZ-CG2 4.12Å
114	S	92	Very high	91.5	Very high	71 Å²	71	45.7 Å²	45.7	50%	0.497	25%	0.249	S	C	.	.	G	3₁₀ helix	trans	-49.9	-39.9	178.2	-176.9	0	0	0	0	115.3	R110 F116 G117	R110-S114 VanDerWaalsContact O-CB 3.27Å; R110-S114 WeakPolarHBondContact O-CB 3.23Å; R110-S114 PolarHBondContact O-N 3Å; S114-F116 PolarHBondContact O-N 3.35Å; S114-F116 VanDerWaalsContact O-N 3.15Å; S114-G117 PolarHBondContact O-N 3.29Å; S114-G117 VanDerWaalsContact O-N 3.14Å
115	P	91.3	Very high	91.5	Very high	46 Å²	46	46.8 Å²	46.8	30%	0.299	26%	0.257	S	S	.	.	G	3₁₀ helix	trans	-63.3	-20.6	180	-24.1	35.9	0	0	0	114.9	T112 S196	T112-P115 WeakPolarHBondContact O-CD 3.41Å; P115-S196 WeakPolarHBondContact O-CB 3.41Å; P115-S196 PolarHBondContact O-N 2.94Å
116	F	92.8	Very high	91.4	Very high	5 Å²	5	50.4 Å²	50.4	2%	0.022	26%	0.258	C	S	.	.	G	3₁₀ helix	trans	-79.3	-20.8	178.5	-61.9	-77.6	0	0	0	113	F113 S114 F141 A146 L149 A150 Q153 M154 Y193 A195 R263	F113-F116 HydrophobicContact CD1-CD2 4.32Å; F113-F116 WeakPolarHBondContact O-CD2 3.5Å; F113-F116 PolarHBondContact O-N 3.18Å; F113-F116 VanDerWaalsContact O-N 3.13Å; S114-F116 PolarHBondContact O-N 3.35Å; S114-F116 VanDerWaalsContact O-N 3.15Å; F116-F141 HydrophobicContact CB-CE1 4.21Å; F116-F141 HydrophobicContact CB-CZ 4.35Å; F116-A146 WeakPolarHBondContact O-CA 3.43Å; F116-A146 WeakPolarHBondContact O-CB 3.43Å; F116-L149 HydrophobicContact CD1-CB 4.04Å; F116-A150 HydrophobicContact CB-CB 4.13Å; F116-A150 HydrophobicContact CD1-CB 4.37Å; F116-A150 HydrophobicContact CD2-CB 4.08Å; F116-A150 HydrophobicContact CG-CB 3.91Å; F116-Q153 HydrophobicContact CE1-CB 3.76Å; F116-Q153 HydrophobicContact CE1-CG 4.29Å; F116-Q153 HydrophobicContact CZ-CB 4.02Å; F116-M154 HydrophobicContact CD2-CG 4.33Å; F116-M154 HydrophobicContact CE2-CG 3.39Å; F116-M154 HydrophobicContact CE2-SD 3.55Å; F116-M154 VanDerWaalsContact CE2-SD 3.55Å; F116-M154 HydrophobicContact CZ-CG 3.56Å; F116-M154 HydrophobicContact CZ-SD 3.65Å; F116-Y193 PolarHBondContact O-OH 3.29Å; F116-A195 VanDerWaalsContact O-CB 3.28Å; F116-A195 WeakPolarHBondContact O-CB 3.33Å; F116-R263 HydrophobicContact CD1-CG 4.02Å; F116-R263 HydrophobicContact CE1-CG 4.19Å
117	G	90.1	Very high	91.2	Very high	5 Å²	5	48.7 Å²	48.7	5%	0.052	25%	0.252	C	S	.	.	S	Bend	trans	151.8	176	-178.9	0	0	0	0	0	112.8	S114 I119 Y193	S114-G117 PolarHBondContact O-N 3.29Å; S114-G117 VanDerWaalsContact O-N 3.14Å; G117-I119 PolarHBondContact O-N 3.4Å; G117-Y193 WeakPolarHBondContact CA-OH 3.31Å
118	P	90.2	Very high	90.8	Very high	12 Å²	12	48 Å²	48	8%	0.078	26%	0.256	C	S	.	.			trans	-68.5	129.1	-176.1	31.1	-38.6	0	0	0	111.9	F141 E142 V143 F234	P118-F141 CarbonylContact O-C 3.59Å; P118-F141 WeakPolarHBondContact O-CA 3.15Å; P118-E142 HydrophobicContact CB-CB 4.39Å; P118-E142 HydrophobicContact CB-CG 4.06Å; P118-E142 HydrophobicContact CG-CB 3.88Å; P118-E142 HydrophobicContact CG-CG 4.12Å; P118-E142 PolarHBondContact O-N 2.71Å; P118-V143 HydrophobicContact CG-CG2 4.15Å; P118-F234 HydrophobicContact CB-CE1 3.95Å; P118-F234 HydrophobicContact CB-CZ 4.46Å; P118-F234 HydrophobicContact CG-CD1 4.05Å; P118-F234 HydrophobicContact CG-CE1 3.49Å; P118-F234 VanDerWaalsContact CG-CE1 3.49Å; P118-F234 HydrophobicContact CG-CE2 4.32Å; P118-F234 HydrophobicContact CG-CZ 3.65Å
119	I	92.5	Very high	90.5	Very high	22 Å²	22	50.3 Å²	50.3	11%	0.113	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.7	117.5	-179.9	-61.6	171.9	0	0	0	109.9	R110 F113 G117 S121 V122 V139 E140 F141	R110-I119 HydrophobicContact CG-CD1 4.24Å; R110-I119 VanDerWaalsContact O-CD1 3.31Å; R110-I119 WeakPolarHBondContact O-CD1 3.47Å; F113-I119 HydrophobicContact CB-CD1 3.74Å; G117-I119 PolarHBondContact O-N 3.4Å; I119-S121 WeakPolarHBondContact CG2-O 3.49Å; I119-V122 HydrophobicContact CG2-CG2 3.58Å; I119-V139 HydrophobicContact CD1-CG1 4.22Å; I119-V139 HydrophobicContact CG1-CG1 4.2Å; I119-V139 HydrophobicContact CG2-CG1 3.93Å; I119-E140 CarbonylContact C-O 3.48Å; I119-F141 HydrophobicContact CD1-CE1 4.5Å; I119-F141 HydrophobicContact CG1-CD1 3.98Å; I119-F141 HydrophobicContact CG1-CE1 3.77Å; I119-F141 HydrophobicContact CG1-CZ 4.43Å
120	K	90.5	Very high	89.9	Confident	115 Å²	115	56 Å²	56	50%	0.5	31%	0.305	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74	-50.6	175.6	176.5	179.4	159.4	-158.6	0	111.2	E140 E142	K120-E140 WeakPolarHBondContact CA-O 3.31Å; K120-E140 HydrophobicContact CB-CG 4.34Å; K120-E140 VanDerWaalsContact CD-CD 3.48Å; K120-E140 HydrophobicContact CD-CG 4.24Å; K120-E140 WeakPolarHBondContact CD-OE2 3.36Å; K120-E140 WeakPolarHBondContact CE-OE1 3.45Å; K120-E140 WeakPolarHBondContact CE-OE2 3.2Å; K120-E140 PolarHBondContact N-O 2.89Å; K120-E140 IonicContact NZ-OE1 2.69Å; K120-E140 PolarHBondContact NZ-OE1 2.89Å; K120-E140 IonicContact NZ-OE2 3.36Å; K120-E142 HydrophobicContact CB-CG 4.04Å
121	S	91.5	Very high	89.4	Confident	47 Å²	47	58.4 Å²	58.4	33%	0.329	32%	0.319	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.5	155.4	178.8	74.3	0	0	0	0	112.7	I119 E140	I119-S121 WeakPolarHBondContact CG2-O 3.49Å; S121-E140 PolarHBondContact N-O 2.77Å; S121-E140 VanDerWaalsContact N-O 3.14Å; S121-E140 PolarHBondContact O-N 3.4Å; S121-E140 VanDerWaalsContact OG-CB 3.26Å; S121-E140 WeakPolarHBondContact OG-CB 3.46Å; S121-E140 PolarHBondContact OG-OE2 3.02Å
122	V	93	Very high	89	Confident	15 Å²	15	58 Å²	58	9%	0.091	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.4	121.7	169.5	-175.6	0	0	0	0	107.5	E106 I109 R110 I119 F138 V139	E106-V122 HydrophobicContact CG-CB 3.6Å; E106-V122 HydrophobicContact CG-CG1 3.53Å; E106-V122 HydrophobicContact CG-CG2 4.44Å; I109-V122 HydrophobicContact CG2-CG1 4.25Å; R110-V122 HydrophobicContact CB-CG2 4.4Å; I119-V122 HydrophobicContact CG2-CG2 3.58Å; V122-F138 CarbonylContact C-O 3.56Å; V122-F138 WeakPolarHBondContact CA-O 3.35Å; V122-V139 HydrophobicContact CG1-CG2 4.25Å; V122-V139 HydrophobicContact CG2-CG1 4.41Å; V122-V139 HydrophobicContact CG2-CG2 4.45Å
123	A	91.6	Very high	88.9	Confident	45 Å²	45	57.2 Å²	57.2	37%	0.372	31%	0.312	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	91.7	178.3	0	0	0	0	0	109.3	A137 F138	A123-A137 CarbonylContact O-C 3.58Å; A123-A137 VanDerWaalsContact O-CA 3.28Å; A123-A137 WeakPolarHBondContact O-CA 3.28Å; A123-F138 HydrophobicContact CB-CB 4.45Å; A123-F138 PolarHBondContact N-O 2.93Å; A123-F138 PolarHBondContact O-N 2.77Å
124	L	90.5	Very high	88.7	Confident	35 Å²	35	62.8 Å²	62.8	18%	0.183	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.6	118.2	174.2	-178.5	63.1	0	0	0	109.5	I100 I109 W126 H133 A137	I100-L124 HydrophobicContact CD1-CD1 4.45Å; I109-L124 HydrophobicContact CD1-CD1 3.84Å; L124-W126 PolarHBondContact O-N 2.71Å; L124-H133 HydrophobicContact CD1-CB 3.68Å; L124-H133 HydrophobicContact CD2-CB 3.94Å; L124-H133 HydrophobicContact CG-CB 3.65Å; L124-A137 HydrophobicContact CB-CB 4.43Å; L124-A137 HydrophobicContact CD1-CB 3.87Å
125	S	89.6	Confident	88.6	Confident	31 Å²	31	59.7 Å²	59.7	22%	0.217	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78	109.8	-175	-64.6	0	0	0	0	111.8	H133 K134 F136	S125-H133 CarbonylContact O-C 3.53Å; S125-H133 WeakPolarHBondContact O-CA 3.36Å; S125-K134 PolarHBondContact O-N 3.37Å; S125-F136 PolarHBondContact N-O 3.4Å; S125-F136 WeakPolarHBondContact OG-CE2 3.47Å
126	W	86.2	Confident	88.6	Confident	118 Å²	118	60.3 Å²	60.3	45%	0.447	31%	0.314	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.6	155.2	-179.1	-154.8	-112.7	0	0	0	113.6	L124 Q131 H133 K134	L124-W126 PolarHBondContact O-N 2.71Å; W126-Q131 VanDerWaalsContact CZ2-O 3.26Å; W126-Q131 WeakPolarHBondContact CZ2-O 3.28Å; W126-H133 HydrophobicContact CE3-CB 3.79Å; W126-H133 HydrophobicContact CZ3-CB 4.03Å; W126-K134 WeakPolarHBondContact O-CD 3.44Å; W126-K134 WeakPolarHBondContact O-CE 3.27Å; W126-K134 PolarHBondContact O-NZ 2.9Å
127	D	86	Confident	88.6	Confident	38 Å²	38	60 Å²	60	20%	0.203	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	109.8	164.1	-174.4	-18.1	0	0	0	108.3	V129 L130 Q131 K132 K134	D127-V129 VanDerWaalsContact C-N 3.27Å; D127-V129 PolarHBondContact O-N 3.25Å; D127-V129 WeakPolarHBondContact OD1-CB 3.42Å; D127-V129 PolarHBondContact OD1-N 2.98Å; D127-L130 HydrophobicContact CB-CB 4.44Å; D127-L130 PolarHBondContact OD1-N 3.25Å; D127-Q131 WeakPolarHBondContact O-CA 3.01Å; D127-Q131 PolarHBondContact O-N 2.72Å; D127-K132 WeakPolarHBondContact CA-O 3.38Å; D127-K132 VanDerWaalsContact CB-O 3.27Å; D127-K132 WeakPolarHBondContact CB-O 3.45Å; D127-K132 PolarHBondContact N-O 3.27Å; D127-K132 PolarHBondContact O-N 2.85Å; D127-K134 HydrophobicContact CB-CG 3.96Å
128	T	83.9	Confident	88.8	Confident	109 Å²	109	61.9 Å²	61.9	67%	0.669	32%	0.319	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.1	-23.3	-179.2	46.9	0	0	0	0	113.1	Q131	T128-Q131 PolarHBondContact O-NE2 2.73Å
129	V	84.7	Confident	89	Confident	125 Å²	125	61.3 Å²	61.3	76%	0.758	32%	0.316	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.6	-44.7	-179.9	-176	0	0	0	0	110.5	D127	D127-V129 VanDerWaalsContact C-N 3.27Å; D127-V129 PolarHBondContact O-N 3.25Å; D127-V129 WeakPolarHBondContact OD1-CB 3.42Å; D127-V129 PolarHBondContact OD1-N 2.98Å
130	L	80.6	Confident	89	Confident	121 Å²	121	61.7 Å²	61.7	63%	0.634	32%	0.317	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.4	-7.8	-178.7	-63.7	-178.1	0	0	0	114.2	D127 K132	D127-L130 HydrophobicContact CB-CB 4.44Å; D127-L130 PolarHBondContact OD1-N 3.25Å; L130-K132 VanDerWaalsContact C-N 3.26Å; L130-K132 PolarHBondContact O-N 2.73Å
131	Q	82.3	Confident	89.1	Confident	124 Å²	124	56.3 Å²	56.3	58%	0.579	29%	0.294	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.2	45.2	-174.9	-67.7	-63.7	-30.5	0	0	112.7	W126 D127 T128	W126-Q131 VanDerWaalsContact CZ2-O 3.26Å; W126-Q131 WeakPolarHBondContact CZ2-O 3.28Å; D127-Q131 WeakPolarHBondContact O-CA 3.01Å; D127-Q131 PolarHBondContact O-N 2.72Å; T128-Q131 PolarHBondContact O-NE2 2.73Å
132	K	84	Confident	89	Confident	111 Å²	111	55.7 Å²	55.7	48%	0.483	29%	0.286	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.1	159.9	178.6	-67.8	-173.2	178.7	-164.6	0	109.7	F102 D127 L130	F102-K132 HydrophobicContact CB-CD 4.32Å; D127-K132 WeakPolarHBondContact CA-O 3.38Å; D127-K132 VanDerWaalsContact CB-O 3.27Å; D127-K132 WeakPolarHBondContact CB-O 3.45Å; D127-K132 PolarHBondContact N-O 3.27Å; D127-K132 PolarHBondContact O-N 2.85Å; L130-K132 VanDerWaalsContact C-N 3.26Å; L130-K132 PolarHBondContact O-N 2.73Å
133	H	89.3	Confident	88.8	Confident	5 Å²	5	55 Å²	55	2%	0.023	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.1	151	171.3	64.7	96.1	0	0	0	111.9	S101 F102 I104 L124 S125 W126 G135	S101-H133 PolarHBondContact O-CE1 2.64Å; S101-H133 PolarHBondContact O-NE2 3.12Å; F102-H133 VanDerWaalsContact CA-NE2 3.29Å; F102-H133 WeakPolarHBondContact CA-NE2 3.29Å; F102-H133 VanDerWaalsContact CD1-O 3.25Å; F102-H133 WeakPolarHBondContact CD1-O 3.29Å; F102-H133 VanDerWaalsContact CE1-O 3.3Å; F102-H133 WeakPolarHBondContact CE1-O 3.25Å; I104-H133 PolarHBondContact O-NE2 3.3Å; L124-H133 HydrophobicContact CD1-CB 3.68Å; L124-H133 HydrophobicContact CD2-CB 3.94Å; L124-H133 HydrophobicContact CG-CB 3.65Å; S125-H133 CarbonylContact O-C 3.53Å; S125-H133 WeakPolarHBondContact O-CA 3.36Å; W126-H133 HydrophobicContact CE3-CB 3.79Å; W126-H133 HydrophobicContact CZ3-CB 4.03Å; H133-G135 PolarHBondContact ND1-N 2.96Å; H133-G135 PolarHBondContact O-N 2.72Å
134	K	89.1	Confident	88.7	Confident	118 Å²	118	53.1 Å²	53.1	51%	0.513	27%	0.265	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.6	18.9	-176.7	-66.9	171.3	172.8	152.6	0	114	S125 W126 D127 F136	S125-K134 PolarHBondContact O-N 3.37Å; W126-K134 WeakPolarHBondContact O-CD 3.44Å; W126-K134 WeakPolarHBondContact O-CE 3.27Å; W126-K134 PolarHBondContact O-NZ 2.9Å; D127-K134 HydrophobicContact CB-CG 3.96Å; K134-F136 VanDerWaalsContact C-N 3.29Å; K134-F136 HydrophobicContact CB-CD1 3.97Å; K134-F136 HydrophobicContact CB-CE1 3.63Å; K134-F136 HydrophobicContact CB-CZ 4.48Å; K134-F136 WeakPolarHBondContact O-CD1 3.43Å; K134-F136 PolarHBondContact O-N 2.71Å
135	G	90	Very high	88.6	Confident	7 Å²	7	51.5 Å²	51.5	7%	0.072	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	73.2	10.3	-179.5	0	0	0	0	0	115.7	G98 S99 I100 H133	G98-G135 CarbonylContact C-O 3.6Å; S99-G135 PolarHBondContact N-O 2.93Å; I100-G135 PolarHBondContact N-O 3.39Å; H133-G135 PolarHBondContact ND1-N 2.96Å; H133-G135 PolarHBondContact O-N 2.72Å
136	F	92.6	Very high	88.8	Confident	58 Å²	58	50 Å²	50	25%	0.254	25%	0.247	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.4	157	175.4	70.6	-90	0	0	0	113.2	Y96 V97 S125 K134 F138	Y96-F136 HydrophobicContact CD2-CD2 4.5Å; Y96-F136 HydrophobicContact CE2-CB 3.64Å; Y96-F136 AromaticContact CE2-CD2 3.85Å; Y96-F136 HydrophobicContact CE2-CD2 3.85Å; Y96-F136 AromaticContact CE2-CG 3.93Å; Y96-F136 HydrophobicContact CE2-CG 3.93Å; V97-F136 CarbonylContact O-C 3.55Å; V97-F136 VanDerWaalsContact O-CA 3.25Å; V97-F136 WeakPolarHBondContact O-CA 3.45Å; S125-F136 PolarHBondContact N-O 3.4Å; S125-F136 WeakPolarHBondContact OG-CE2 3.47Å; K134-F136 VanDerWaalsContact C-N 3.29Å; K134-F136 HydrophobicContact CB-CD1 3.97Å; K134-F136 HydrophobicContact CB-CE1 3.63Å; K134-F136 HydrophobicContact CB-CZ 4.48Å; K134-F136 WeakPolarHBondContact O-CD1 3.43Å; K134-F136 PolarHBondContact O-N 2.71Å; F136-F138 HydrophobicContact CD2-CE2 4.38Å; F136-F138 HydrophobicContact CE2-CE2 4.12Å
137	A	92.9	Very high	89	Confident	0 Å²	0	44.4 Å²	44.4	0%	0	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.1	162.8	176.1	0	0	0	0	0	110.7	V97 I100 I109 A123 L124	V97-A137 PolarHBondContact N-O 2.89Å; V97-A137 PolarHBondContact O-N 3.09Å; I100-A137 HydrophobicContact CD1-CB 3.75Å; I109-A137 HydrophobicContact CD1-CB 4.09Å; A123-A137 CarbonylContact O-C 3.58Å; A123-A137 VanDerWaalsContact O-CA 3.28Å; A123-A137 WeakPolarHBondContact O-CA 3.28Å; L124-A137 HydrophobicContact CB-CB 4.43Å; L124-A137 HydrophobicContact CD1-CB 3.87Å
138	F	93.7	Very high	89.2	Confident	43 Å²	43	43.4 Å²	43.4	19%	0.189	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	138.8	161.1	-59.4	-85	0	0	0	109.6	I95 Y96 V122 A123 F136 P169	I95-F138 WeakPolarHBondContact O-CA 3.38Å; Y96-F138 HydrophobicContact CD2-CD1 4.4Å; Y96-F138 AromaticContact CD2-CE1 3.89Å; Y96-F138 HydrophobicContact CD2-CE1 3.89Å; Y96-F138 HydrophobicContact CD2-CZ 4.24Å; V122-F138 CarbonylContact C-O 3.56Å; V122-F138 WeakPolarHBondContact CA-O 3.35Å; A123-F138 HydrophobicContact CB-CB 4.45Å; A123-F138 PolarHBondContact N-O 2.93Å; A123-F138 PolarHBondContact O-N 2.77Å; F136-F138 HydrophobicContact CD2-CE2 4.38Å; F136-F138 HydrophobicContact CE2-CE2 4.12Å; F138-P169 HydrophobicContact CD1-CB 4.44Å; F138-P169 HydrophobicContact CE1-CB 4.13Å
139	V	94	Very high	89.5	Confident	0 Å²	0	38.7 Å²	38.7	0%	0	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	131.1	172.6	-179.3	0	0	0	0	107.7	R94 I95 V97 I109 F113 I119 V122 F141	R94-V139 WeakPolarHBondContact CA-O 3.49Å; I95-V139 HydrophobicContact CD1-CB 4.16Å; I95-V139 HydrophobicContact CG1-CB 3.8Å; I95-V139 PolarHBondContact N-O 3.1Å; I95-V139 PolarHBondContact O-N 3.38Å; V97-V139 HydrophobicContact CG2-CG2 4.01Å; I109-V139 HydrophobicContact CG2-CG2 3.88Å; F113-V139 HydrophobicContact CD2-CG2 4.43Å; I119-V139 HydrophobicContact CD1-CG1 4.22Å; I119-V139 HydrophobicContact CG1-CG1 4.2Å; I119-V139 HydrophobicContact CG2-CG1 3.93Å; V122-V139 HydrophobicContact CG1-CG2 4.25Å; V122-V139 HydrophobicContact CG2-CG1 4.41Å; V122-V139 HydrophobicContact CG2-CG2 4.45Å; V139-F141 HydrophobicContact CG1-CD2 4.26Å; V139-F141 HydrophobicContact CG1-CE2 3.84Å; V139-F141 HydrophobicContact CG1-CZ 4.13Å
140	E	92.6	Very high	89.9	Confident	30 Å²	30	32.8 Å²	32.8	14%	0.14	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115	121.3	176.4	-172.2	-169	-161.9	0	0	108.8	S93 I119 K120 S121	S93-E140 WeakPolarHBondContact O-CA 3.32Å; I119-E140 CarbonylContact C-O 3.48Å; K120-E140 WeakPolarHBondContact CA-O 3.31Å; K120-E140 HydrophobicContact CB-CG 4.34Å; K120-E140 VanDerWaalsContact CD-CD 3.48Å; K120-E140 HydrophobicContact CD-CG 4.24Å; K120-E140 WeakPolarHBondContact CD-OE2 3.36Å; K120-E140 WeakPolarHBondContact CE-OE1 3.45Å; K120-E140 WeakPolarHBondContact CE-OE2 3.2Å; K120-E140 PolarHBondContact N-O 2.89Å; K120-E140 IonicContact NZ-OE1 2.69Å; K120-E140 PolarHBondContact NZ-OE1 2.89Å; K120-E140 IonicContact NZ-OE2 3.36Å; S121-E140 PolarHBondContact N-O 2.77Å; S121-E140 VanDerWaalsContact N-O 3.14Å; S121-E140 PolarHBondContact O-N 3.4Å; S121-E140 VanDerWaalsContact OG-CB 3.26Å; S121-E140 WeakPolarHBondContact OG-CB 3.46Å; S121-E140 PolarHBondContact OG-OE2 3.02Å
141	F	93.2	Very high	90.4	Very high	2 Å²	2	28.7 Å²	28.7	1%	0.009	14%	0.135	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.9	159.6	174.5	-68.5	-91.3	0	0	0	111.3	S93 I95 F113 F116 P118 I119 V139 V143 A146 A147 A150	S93-F141 VanDerWaalsContact CB-O 3.31Å; S93-F141 WeakPolarHBondContact CB-O 3.22Å; S93-F141 PolarHBondContact O-N 3.23Å; I95-F141 HydrophobicContact CD1-CE2 3.89Å; I95-F141 HydrophobicContact CG1-CE2 4.2Å; F113-F141 HydrophobicContact CB-CZ 4.1Å; F113-F141 HydrophobicContact CD1-CZ 4.2Å; F116-F141 HydrophobicContact CB-CE1 4.21Å; F116-F141 HydrophobicContact CB-CZ 4.35Å; P118-F141 CarbonylContact O-C 3.59Å; P118-F141 WeakPolarHBondContact O-CA 3.15Å; I119-F141 HydrophobicContact CD1-CE1 4.5Å; I119-F141 HydrophobicContact CG1-CD1 3.98Å; I119-F141 HydrophobicContact CG1-CE1 3.77Å; I119-F141 HydrophobicContact CG1-CZ 4.43Å; V139-F141 HydrophobicContact CG1-CD2 4.26Å; V139-F141 HydrophobicContact CG1-CE2 3.84Å; V139-F141 HydrophobicContact CG1-CZ 4.13Å; F141-V143 WeakPolarHBondContact CB-O 3.3Å; F141-V143 PolarHBondContact O-N 3.22Å; F141-A146 HydrophobicContact CB-CB 4.15Å; F141-A146 HydrophobicContact CD1-CB 3.56Å; F141-A146 HydrophobicContact CE1-CB 4.05Å; F141-A146 HydrophobicContact CG-CB 3.86Å; F141-A147 HydrophobicContact CD2-CB 3.74Å; F141-A147 HydrophobicContact CE2-CB 4.33Å; F141-A147 HydrophobicContact CG-CB 4.48Å; F141-A150 HydrophobicContact CE2-CB 4.04Å; F141-A150 HydrophobicContact CZ-CB 3.9Å
142	E	88.7	Confident	90.8	Very high	35 Å²	35	28.1 Å²	28.1	16%	0.164	14%	0.136	C	C	.	.	S	Bend	trans	-72.8	-13	165.9	-53.6	171.9	-160.2	0	0	111.8	P118 K120 R232 F277	P118-E142 HydrophobicContact CB-CB 4.39Å; P118-E142 HydrophobicContact CB-CG 4.06Å; P118-E142 HydrophobicContact CG-CB 3.88Å; P118-E142 HydrophobicContact CG-CG 4.12Å; P118-E142 PolarHBondContact O-N 2.71Å; K120-E142 HydrophobicContact CB-CG 4.04Å; E142-R232 IonicContact OE1-CZ 3.24Å; E142-R232 IonicContact OE1-NH1 2.9Å; E142-R232 PolarHBondContact OE1-NH1 3.49Å; E142-R232 IonicContact OE1-NH2 2.71Å; E142-R232 PolarHBondContact OE1-NH2 3.22Å; E142-R232 IonicContact OE2-CZ 3.2Å; E142-R232 IonicContact OE2-NH1 2.66Å; E142-R232 PolarHBondContact OE2-NH1 3.33Å; E142-R232 IonicContact OE2-NH2 2.69Å; E142-F277 WeakPolarHBondContact OE2-CD1 3.32Å
143	V	89	Confident	91	Very high	0 Å²	0	25 Å²	25	0%	0	12%	0.122	C	C	.	.	S	Bend	trans	-136.7	124	-169.7	-177.7	0	0	0	0	110.5	P118 F141 E145 A146 Y193 F234 L275	P118-V143 HydrophobicContact CG-CG2 4.15Å; F141-V143 WeakPolarHBondContact CB-O 3.3Å; F141-V143 PolarHBondContact O-N 3.22Å; V143-E145 VanDerWaalsContact C-N 3.32Å; V143-E145 HydrophobicContact CG1-CB 3.98Å; V143-E145 HydrophobicContact CG1-CG 4.48Å; V143-E145 WeakPolarHBondContact CG1-OE2 3.3Å; V143-E145 PolarHBondContact O-N 3.32Å; V143-A146 HydrophobicContact CB-CB 4.39Å; V143-A146 WeakPolarHBondContact O-CB 3.48Å; V143-A146 PolarHBondContact O-N 2.97Å; V143-Y193 HydrophobicContact CG1-CD2 4.25Å; V143-Y193 HydrophobicContact CG1-CE2 3.8Å; V143-F234 HydrophobicContact CG2-CE2 4.3Å; V143-L275 HydrophobicContact CG2-CD1 3.86Å; V143-L275 HydrophobicContact CG2-CD2 4.16Å
144	P	89.1	Confident	91.2	Very high	5 Å²	5	25.1 Å²	25.1	3%	0.032	12%	0.123	C	C	.	.	H	α-helix	trans	-71.8	-22.5	-176.3	24.4	-30	0	0	0	114.2	L89 L92 S93 A146 A147 S148	L89-P144 HydrophobicContact CB-CG 4.37Å; L89-P144 HydrophobicContact CD2-CG 3.68Å; L92-P144 HydrophobicContact CB-CB 3.64Å; S93-P144 WeakPolarHBondContact OG-CA 3.46Å; S93-P144 WeakPolarHBondContact OG-CD 3.27Å; P144-A146 VanDerWaalsContact C-N 3.35Å; P144-A147 WeakPolarHBondContact O-CB 3.39Å; P144-A147 PolarHBondContact O-N 3.01Å; P144-S148 PolarHBondContact O-N 2.72Å
145	E	89.9	Confident	91.3	Very high	2 Å²	2	24 Å²	24	1%	0.009	12%	0.123	C	C	.	.	H	α-helix	trans	-61.4	-41.5	170.7	-66.7	87.9	153.1	0	0	112.2	V143 A147 S148 L149 Y193 R266 A267 L268 T269	V143-E145 VanDerWaalsContact C-N 3.32Å; V143-E145 HydrophobicContact CG1-CB 3.98Å; V143-E145 HydrophobicContact CG1-CG 4.48Å; V143-E145 WeakPolarHBondContact CG1-OE2 3.3Å; V143-E145 PolarHBondContact O-N 3.32Å; E145-A147 VanDerWaalsContact C-N 3.32Å; E145-A147 PolarHBondContact O-N 2.87Å; E145-S148 WeakPolarHBondContact O-CB 3.46Å; E145-S148 PolarHBondContact O-N 3.38Å; E145-L149 PolarHBondContact O-N 3.05Å; E145-Y193 HydrophobicContact CB-CD1 3.57Å; E145-Y193 HydrophobicContact CB-CD2 4.2Å; E145-Y193 HydrophobicContact CB-CE1 4.16Å; E145-Y193 HydrophobicContact CB-CG 3.58Å; E145-Y193 HydrophobicContact CG-CG 4.14Å; E145-R266 WeakPolarHBondContact CG-O 3.36Å; E145-A267 WeakPolarHBondContact OE1-CA 3.43Å; E145-L268 HydrophobicContact CG-CG 4.48Å; E145-L268 PolarHBondContact OE1-N 3.38Å; E145-T269 WeakPolarHBondContact OE1-CB 3.43Å; E145-T269 PolarHBondContact OE1-N 3.18Å; E145-T269 PolarHBondContact OE1-OG1 3.03Å; E145-T269 VanDerWaalsContact OE1-OG1 3.1Å; E145-T269 PolarHBondContact OE2-OG1 2.96Å; E145-T269 VanDerWaalsContact OE2-OG1 3.05Å
146	A	92.1	Very high	91.4	Very high	0 Å²	0	25.3 Å²	25.3	0%	0	14%	0.136	C	C	.	.	H	α-helix	trans	-62.5	-41.2	176.2	0	0	0	0	0	111.4	F116 F141 V143 P144 S148 L149 A150 Y193	F116-A146 WeakPolarHBondContact O-CA 3.43Å; F116-A146 WeakPolarHBondContact O-CB 3.43Å; F141-A146 HydrophobicContact CB-CB 4.15Å; F141-A146 HydrophobicContact CD1-CB 3.56Å; F141-A146 HydrophobicContact CE1-CB 4.05Å; F141-A146 HydrophobicContact CG-CB 3.86Å; V143-A146 HydrophobicContact CB-CB 4.39Å; V143-A146 WeakPolarHBondContact O-CB 3.48Å; V143-A146 PolarHBondContact O-N 2.97Å; P144-A146 VanDerWaalsContact C-N 3.35Å; A146-S148 PolarHBondContact O-N 3.42Å; A146-L149 PolarHBondContact O-N 3.07Å; A146-A150 VanDerWaalsContact O-CB 3.23Å; A146-A150 WeakPolarHBondContact O-CB 3.33Å; A146-A150 PolarHBondContact O-N 3.18Å; A146-Y193 HydrophobicContact CB-CE1 4.15Å
147	A	91.9	Very high	91.4	Very high	0 Å²	0	28 Å²	28	0%	0	15%	0.145	C	C	.	.	H	α-helix	trans	-63.3	-37.8	174.8	0	0	0	0	0	112.8	L92 I95 F141 P144 E145 L151	L92-A147 WeakPolarHBondContact O-CB 3.36Å; I95-A147 HydrophobicContact CG2-CB 4.01Å; I95-A147 WeakPolarHBondContact CG2-O 3.4Å; F141-A147 HydrophobicContact CD2-CB 3.74Å; F141-A147 HydrophobicContact CE2-CB 4.33Å; F141-A147 HydrophobicContact CG-CB 4.48Å; P144-A147 WeakPolarHBondContact O-CB 3.39Å; P144-A147 PolarHBondContact O-N 3.01Å; E145-A147 VanDerWaalsContact C-N 3.32Å; E145-A147 PolarHBondContact O-N 2.87Å; A147-L151 WeakPolarHBondContact O-CB 3.15Å; A147-L151 PolarHBondContact O-N 3.29Å; A147-L151 VanDerWaalsContact O-N 3.07Å
148	S	89.6	Confident	91.3	Very high	17 Å²	17	31.7 Å²	31.7	12%	0.119	17%	0.168	C	C	.	.	H	α-helix	trans	-65.7	-50.1	173.8	-161.5	0	0	0	0	111.5	P144 E145 A146 A150 L151 D152	P144-S148 PolarHBondContact O-N 2.72Å; E145-S148 WeakPolarHBondContact O-CB 3.46Å; E145-S148 PolarHBondContact O-N 3.38Å; A146-S148 PolarHBondContact O-N 3.42Å; S148-A150 VanDerWaalsContact C-N 3.31Å; S148-A150 PolarHBondContact O-N 2.99Å; S148-L151 WeakPolarHBondContact O-CB 3.42Å; S148-L151 PolarHBondContact O-N 2.96Å; S148-L151 VanDerWaalsContact O-N 3.1Å; S148-D152 PolarHBondContact O-N 3.4Å
149	L	91.1	Very high	91.1	Very high	10 Å²	10	30.7 Å²	30.7	5%	0.052	17%	0.165	C	C	.	.	H	α-helix	trans	-63.3	-36.8	179.8	-71.4	173.3	0	0	0	112.6	F116 E145 A146 Q153 Y193 R263 V264	F116-L149 HydrophobicContact CD1-CB 4.04Å; E145-L149 PolarHBondContact O-N 3.05Å; A146-L149 PolarHBondContact O-N 3.07Å; L149-Q153 WeakPolarHBondContact O-CB 3.42Å; L149-Q153 WeakPolarHBondContact O-CG 3.45Å; L149-Q153 PolarHBondContact O-N 3.27Å; L149-Q153 VanDerWaalsContact O-N 3.12Å; L149-Y193 HydrophobicContact CD1-CD1 3.81Å; L149-Y193 HydrophobicContact CD1-CE1 4.2Å; L149-R263 HydrophobicContact CD1-CB 4.27Å; L149-V264 WeakPolarHBondContact CD2-O 3.37Å
150	A	92.9	Very high	90.8	Very high	0 Å²	0	33.4 Å²	33.4	0%	0	19%	0.187	C	C	.	.	H	α-helix	trans	-63.7	-41.1	172.7	0	0	0	0	0	111.9	I95 F113 F116 F141 A146 S148 M154	I95-A150 HydrophobicContact CD1-CB 4.06Å; F113-A150 HydrophobicContact CD1-CB 3.89Å; F113-A150 HydrophobicContact CE1-CB 4.07Å; F116-A150 HydrophobicContact CB-CB 4.13Å; F116-A150 HydrophobicContact CD1-CB 4.37Å; F116-A150 HydrophobicContact CD2-CB 4.08Å; F116-A150 HydrophobicContact CG-CB 3.91Å; F141-A150 HydrophobicContact CE2-CB 4.04Å; F141-A150 HydrophobicContact CZ-CB 3.9Å; A146-A150 VanDerWaalsContact O-CB 3.23Å; A146-A150 WeakPolarHBondContact O-CB 3.33Å; A146-A150 PolarHBondContact O-N 3.18Å; S148-A150 VanDerWaalsContact C-N 3.31Å; S148-A150 PolarHBondContact O-N 2.99Å; A150-M154 WeakPolarHBondContact O-CB 3.22Å; A150-M154 PolarHBondContact O-N 3.37Å
151	L	91.1	Very high	90.6	Very high	36 Å²	36	35.3 Å²	35.3	19%	0.188	22%	0.215	C	C	.	.	H	α-helix	trans	-62.4	-48.9	176.6	-171.1	159.5	0	0	0	111.3	A147 S148 Q153 N155 V166 R168	A147-L151 WeakPolarHBondContact O-CB 3.15Å; A147-L151 PolarHBondContact O-N 3.29Å; A147-L151 VanDerWaalsContact O-N 3.07Å; S148-L151 WeakPolarHBondContact O-CB 3.42Å; S148-L151 PolarHBondContact O-N 2.96Å; S148-L151 VanDerWaalsContact O-N 3.1Å; L151-Q153 VanDerWaalsContact C-N 3.34Å; L151-Q153 PolarHBondContact O-N 3.13Å; L151-N155 VanDerWaalsContact O-CB 3.3Å; L151-N155 WeakPolarHBondContact O-CB 3.32Å; L151-N155 PolarHBondContact O-N 3.43Å; L151-V166 HydrophobicContact CB-CG1 4.39Å; L151-R168 HydrophobicContact CD1-CG 3.98Å
152	D	89.4	Confident	90.5	Very high	112 Å²	112	39.8 Å²	39.8	60%	0.599	23%	0.232	S	C	*	.	H	α-helix	trans	-66.9	-32	-176.5	-64.7	-33.2	0	0	0	113.1	S148	S148-D152 PolarHBondContact O-N 3.4Å
153	Q	89.6	Confident	90.7	Very high	44 Å²	44	42.6 Å²	42.6	21%	0.206	25%	0.248	C	C	.	.	H	α-helix	trans	-105.2	-25.9	-172	-61.2	-176.4	44.6	0	0	114.7	F116 L149 L151 N253 C254	F116-Q153 HydrophobicContact CE1-CB 3.76Å; F116-Q153 HydrophobicContact CE1-CG 4.29Å; F116-Q153 HydrophobicContact CZ-CB 4.02Å; L149-Q153 WeakPolarHBondContact O-CB 3.42Å; L149-Q153 WeakPolarHBondContact O-CG 3.45Å; L149-Q153 PolarHBondContact O-N 3.27Å; L149-Q153 VanDerWaalsContact O-N 3.12Å; L151-Q153 VanDerWaalsContact C-N 3.34Å; L151-Q153 PolarHBondContact O-N 3.13Å; Q153-N253 PolarHBondContact NE2-ND2 3.17Å; Q153-N253 PolarHBondContact NE2-OD1 3.16Å; Q153-C254 PolarHBondContact OE1-SG 2.87Å
154	M	91.9	Very high	91	Very high	8 Å²	8	42.7 Å²	42.7	4%	0.039	25%	0.248	C	C	.	.	H	α-helix	trans	-96	-11.6	-179.1	-62.2	-62	-58.9	0	0	113.7	T112 F113 F116 A150 G156 Y157 L164 V166	T112-M154 HydrophobicContact CG2-CE 3.38Å; F113-M154 HydrophobicContact CD1-CG 4.16Å; F113-M154 HydrophobicContact CE1-CB 3.74Å; F113-M154 HydrophobicContact CE1-CG 3.61Å; F113-M154 HydrophobicContact CZ-CB 3.98Å; F113-M154 HydrophobicContact CZ-CE 4.41Å; F113-M154 HydrophobicContact CZ-CG 4.12Å; F116-M154 HydrophobicContact CD2-CG 4.33Å; F116-M154 HydrophobicContact CE2-CG 3.39Å; F116-M154 HydrophobicContact CE2-SD 3.55Å; F116-M154 VanDerWaalsContact CE2-SD 3.55Å; F116-M154 HydrophobicContact CZ-CG 3.56Å; F116-M154 HydrophobicContact CZ-SD 3.65Å; A150-M154 WeakPolarHBondContact O-CB 3.22Å; A150-M154 PolarHBondContact O-N 3.37Å; M154-G156 PolarHBondContact O-N 2.98Å; M154-Y157 HydrophobicContact CE-CD1 3.46Å; M154-Y157 VanDerWaalsContact CE-CD1 3.46Å; M154-Y157 HydrophobicContact CE-CD2 4.07Å; M154-Y157 HydrophobicContact CE-CE1 4.02Å; M154-Y157 HydrophobicContact CE-CG 3.49Å; M154-Y157 VanDerWaalsContact CE-CG 3.49Å; M154-Y157 VanDerWaalsContact O-CB 3.26Å; M154-Y157 WeakPolarHBondContact O-CB 3.44Å; M154-Y157 PolarHBondContact O-N 3.33Å; M154-Y157 VanDerWaalsContact O-N 3.09Å; M154-Y157 HydrophobicContact SD-CD2 4.15Å; M154-Y157 HydrophobicContact SD-CG 4.09Å; M154-L164 HydrophobicContact CE-CD1 4.01Å; M154-V166 HydrophobicContact CB-CG2 3.85Å
155	N	92.3	Very high	91.2	Very high	95 Å²	95	48.8 Å²	48.8	51%	0.508	27%	0.274	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.6	117.6	174.9	-170.9	27.7	0	0	0	110.7	L151 V166	L151-N155 VanDerWaalsContact O-CB 3.3Å; L151-N155 WeakPolarHBondContact O-CB 3.32Å; L151-N155 PolarHBondContact O-N 3.43Å; N155-V166 HydrophobicContact CB-CB 4.17Å; N155-V166 PolarHBondContact OD1-N 3.33Å
156	G	91.6	Very high	91.3	Very high	34 Å²	34	49.1 Å²	49.1	35%	0.351	28%	0.276	S	S	.	.	T	Hydrogen-bonded Turn	trans	90	-8	-172.9	0	0	0	0	0	115.2	M154 T158 N163 L164	M154-G156 PolarHBondContact O-N 2.98Å; G156-T158 PolarHBondContact O-N 3.24Å; G156-N163 WeakPolarHBondContact O-CB 3.41Å; G156-N163 PolarHBondContact O-ND2 3.02Å; G156-L164 WeakPolarHBondContact CA-O 3.31Å; G156-L164 PolarHBondContact N-O 3.49Å
157	Y	92.1	Very high	91.2	Very high	114 Å²	114	50 Å²	50	45%	0.447	29%	0.286	S	S	.	.			trans	-61.4	132.8	-178.4	-177.2	-87.4	0	0	0	112.1	M154 L159 N163 L164	M154-Y157 HydrophobicContact CE-CD1 3.46Å; M154-Y157 VanDerWaalsContact CE-CD1 3.46Å; M154-Y157 HydrophobicContact CE-CD2 4.07Å; M154-Y157 HydrophobicContact CE-CE1 4.02Å; M154-Y157 HydrophobicContact CE-CG 3.49Å; M154-Y157 VanDerWaalsContact CE-CG 3.49Å; M154-Y157 VanDerWaalsContact O-CB 3.26Å; M154-Y157 WeakPolarHBondContact O-CB 3.44Å; M154-Y157 PolarHBondContact O-N 3.33Å; M154-Y157 VanDerWaalsContact O-N 3.09Å; M154-Y157 HydrophobicContact SD-CD2 4.15Å; M154-Y157 HydrophobicContact SD-CG 4.09Å; Y157-L159 HydrophobicContact CD1-CB 4.22Å; Y157-L159 HydrophobicContact CE1-CB 4.27Å; Y157-L159 HydrophobicContact CE1-CD1 4.23Å; Y157-L159 PolarHBondContact O-N 3.02Å; Y157-N163 CarbonylContact O-C 3.57Å; Y157-N163 WeakPolarHBondContact O-CA 3.47Å; Y157-L164 HydrophobicContact CD1-CD1 4.37Å; Y157-L164 PolarHBondContact O-N 2.89Å
158	T	91.9	Very high	91	Very high	78 Å²	78	53 Å²	53	48%	0.479	30%	0.297	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.4	106.8	-176.5	-48.8	0	0	0	0	111.7	G156 R162 N163	G156-T158 PolarHBondContact O-N 3.24Å; T158-R162 CarbonylContact C-O 3.52Å; T158-R162 WeakPolarHBondContact CA-O 3.44Å; T158-N163 PolarHBondContact OG1-OD1 3.17Å
159	L	89.7	Confident	90.6	Very high	23 Å²	23	53 Å²	53	12%	0.12	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	127.6	176.9	-168.5	65.4	0	0	0	109.9	I104 T112 Y157 G161 R162 L164	I104-L159 HydrophobicContact CD1-CB 4.33Å; I104-L159 HydrophobicContact CD1-CD2 3.78Å; I104-L159 HydrophobicContact CD1-CG 3.71Å; I104-L159 HydrophobicContact CG2-CD2 4.35Å; T112-L159 HydrophobicContact CG2-CD2 4.37Å; Y157-L159 HydrophobicContact CD1-CB 4.22Å; Y157-L159 HydrophobicContact CE1-CB 4.27Å; Y157-L159 HydrophobicContact CE1-CD1 4.23Å; Y157-L159 PolarHBondContact O-N 3.02Å; L159-G161 VanDerWaalsContact C-N 3.26Å; L159-G161 PolarHBondContact O-N 2.9Å; L159-R162 PolarHBondContact N-O 3.18Å; L159-R162 PolarHBondContact O-N 3.5Å; L159-R162 VanDerWaalsContact O-O 3.09Å; L159-L164 HydrophobicContact CB-CD1 4.12Å; L159-L164 HydrophobicContact CB-CD2 4.32Å; L159-L164 HydrophobicContact CB-CG 4.13Å; L159-L164 HydrophobicContact CD2-CD1 4.12Å
160	A	88.1	Confident	89.4	Confident	57 Å²	57	57.3 Å²	57.3	47%	0.471	33%	0.328	S	S	.	.	T	Hydrogen-bonded Turn	trans	44.1	47.2	-171.6	0	0	0	0	0	113.9	I104 R162	I104-A160 HydrophobicContact CD1-CB 3.81Å; I104-A160 HydrophobicContact CG1-CB 4.05Å; A160-R162 VanDerWaalsContact C-N 3.27Å; A160-R162 PolarHBondContact O-N 3.34Å
161	G	88.2	Confident	87.9	Confident	70 Å²	70	64.4 Å²	64.4	72%	0.722	37%	0.366	S	S	*	.	T	Hydrogen-bonded Turn	trans	74	7.5	177.8	0	0	0	0	0	115.8	L159	L159-G161 VanDerWaalsContact C-N 3.26Å; L159-G161 PolarHBondContact O-N 2.9Å
162	R	90.3	Very high	86.5	Confident	96 Å²	96	63.6 Å²	63.6	36%	0.362	36%	0.364	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	137.9	177.8	-69	170.6	59.8	121.1	-3.6	110.9	S99 T158 L159 A160 L164	S99-R162 PolarHBondContact O-NE 3.21Å; S99-R162 PolarHBondContact O-NH2 3.42Å; T158-R162 CarbonylContact C-O 3.52Å; T158-R162 WeakPolarHBondContact CA-O 3.44Å; L159-R162 PolarHBondContact N-O 3.18Å; L159-R162 PolarHBondContact O-N 3.5Å; L159-R162 VanDerWaalsContact O-O 3.09Å; A160-R162 VanDerWaalsContact C-N 3.27Å; A160-R162 PolarHBondContact O-N 3.34Å; R162-L164 PolarHBondContact O-N 3.48Å
163	N	93.3	Very high	85.1	Confident	93 Å²	93	63.9 Å²	63.9	50%	0.497	37%	0.372	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.3	122	177.4	-66.8	19.7	0	0	0	109.5	S99 G156 Y157 T158	S99-N163 WeakPolarHBondContact CB-O 3.48Å; G156-N163 WeakPolarHBondContact O-CB 3.41Å; G156-N163 PolarHBondContact O-ND2 3.02Å; Y157-N163 CarbonylContact O-C 3.57Å; Y157-N163 WeakPolarHBondContact O-CA 3.47Å; T158-N163 PolarHBondContact OG1-OD1 3.17Å
164	L	94	Very high	83.9	Confident	2 Å²	2	68.8 Å²	68.8	1%	0.01	40%	0.395	C	S	.	.			trans	-66.6	144.3	175.7	-62.2	-179.9	0	0	0	110.5	V97 I100 F113 M154 G156 Y157 L159 R162 V166	V97-L164 HydrophobicContact CG1-CD1 4.41Å; V97-L164 HydrophobicContact CG1-CD2 4.29Å; I100-L164 HydrophobicContact CB-CD2 4.47Å; I100-L164 HydrophobicContact CG1-CD2 3.97Å; F113-L164 HydrophobicContact CE2-CD1 4.49Å; M154-L164 HydrophobicContact CE-CD1 4.01Å; G156-L164 WeakPolarHBondContact CA-O 3.31Å; G156-L164 PolarHBondContact N-O 3.49Å; Y157-L164 HydrophobicContact CD1-CD1 4.37Å; Y157-L164 PolarHBondContact O-N 2.89Å; L159-L164 HydrophobicContact CB-CD1 4.12Å; L159-L164 HydrophobicContact CB-CD2 4.32Å; L159-L164 HydrophobicContact CB-CG 4.13Å; L159-L164 HydrophobicContact CD2-CD1 4.12Å; R162-L164 PolarHBondContact O-N 3.48Å; L164-V166 HydrophobicContact CB-CG2 4.33Å
165	K	93.4	Very high	82.8	Confident	133 Å²	133	68.6 Å²	68.6	58%	0.578	39%	0.394	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-109.3	110	169.1	-67.5	-173.5	179.7	-173.6	0	108.2	G98	G98-K165 PolarHBondContact N-O 3.4Å; G98-K165 PolarHBondContact O-N 3.25Å
166	V	93.2	Very high	81.7	Confident	9 Å²	9	67.5 Å²	67.5	6%	0.055	40%	0.398	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	137.8	-178.5	-171.9	0	0	0	0	109.4	I95 Y96 V97 F113 L151 M154 N155 L164	I95-V166 HydrophobicContact CB-CG1 4.35Å; I95-V166 HydrophobicContact CD1-CG1 3.89Å; Y96-V166 WeakPolarHBondContact O-CA 3.21Å; V97-V166 HydrophobicContact CG1-CG2 4.38Å; V97-V166 HydrophobicContact CG2-CG2 4.45Å; F113-V166 HydrophobicContact CZ-CG2 4.12Å; L151-V166 HydrophobicContact CB-CG1 4.39Å; M154-V166 HydrophobicContact CB-CG2 3.85Å; N155-V166 HydrophobicContact CB-CB 4.17Å; N155-V166 PolarHBondContact OD1-N 3.33Å; L164-V166 HydrophobicContact CB-CG2 4.33Å
167	G	90.6	Very high	80.9	Confident	19 Å²	19	69.2 Å²	69.2	20%	0.196	41%	0.409	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-167.9	178.3	-177.6	0	0	0	0	0	113.3	Y96	Y96-G167 PolarHBondContact N-O 3.36Å; Y96-G167 PolarHBondContact O-N 3.1Å; Y96-G167 VanDerWaalsContact O-N 3.1Å
168	R	87.7	Confident	79.9	Confident	62 Å²	62	65.7 Å²	65.7	23%	0.234	40%	0.398	C	S	.	.			trans	-71.3	144.7	171.4	-63.5	-58.6	-172.6	-166.7	1.4	110.4	L92 L151 E179	L92-R168 PolarHBondContact O-NH1 2.77Å; L151-R168 HydrophobicContact CD1-CG 3.98Å; R168-E179 IonicContact CZ-OE2 2.79Å; R168-E179 IonicContact NE-OE2 3Å; R168-E179 PolarHBondContact NE-OE2 3.49Å; R168-E179 IonicContact NH2-OE1 3.37Å; R168-E179 IonicContact NH2-OE2 3.74Å; R168-E179 PolarHBondContact NH2-OE2 3.22Å
169	P	80.5	Confident	79	Confident	17 Å²	17	63.3 Å²	63.3	11%	0.11	38%	0.381	C	S	.	.			trans	-64.8	141.4	174.5	27.8	-34.7	0	0	0	111	R94 F138 N171	R94-P169 HydrophobicContact CG-CG 4.44Å; R94-P169 VanDerWaalsContact O-CD 3.28Å; R94-P169 WeakPolarHBondContact O-CD 3.29Å; F138-P169 HydrophobicContact CD1-CB 4.44Å; F138-P169 HydrophobicContact CE1-CB 4.13Å; P169-N171 PolarHBondContact O-N 3.38Å; P169-N171 VanDerWaalsContact O-N 3.16Å
170	S	65	Low	78.4	Confident	101 Å²	101	65 Å²	65	71%	0.706	40%	0.399	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.6	-25.6	-174.3	43.6	0	0	0	0	115.2	A172	S170-A172 PolarHBondContact O-N 2.95Å; S170-A172 VanDerWaalsContact O-N 3.12Å
171	N	61.3	Low	77.8	Confident	150 Å²	150	68.9 Å²	68.9	80%	0.802	41%	0.407	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.6	5	-163.9	-61.6	22	0	0	0	114	P169	P169-N171 PolarHBondContact O-N 3.38Å; P169-N171 VanDerWaalsContact O-N 3.16Å
172	A	61.9	Low	77.2	Confident	18 Å²	18	66.2 Å²	66.2	15%	0.149	38%	0.376	C	S	.	.			trans	-143.2	75.2	-178.1	0	0	0	0	0	112	L91 S170 Q174 T175	L91-A172 HydrophobicContact CD1-CB 4.37Å; L91-A172 HydrophobicContact CD2-CB 4.27Å; S170-A172 PolarHBondContact O-N 2.95Å; S170-A172 VanDerWaalsContact O-N 3.12Å; A172-Q174 PolarHBondContact O-N 3.48Å; A172-T175 WeakPolarHBondContact CB-OG1 3.45Å; A172-T175 WeakPolarHBondContact O-CB 3.45Å; A172-T175 PolarHBondContact O-N 2.89Å; A172-T175 PolarHBondContact O-OG1 2.94Å
173	P	59.7	Low	76.5	Confident	118 Å²	118	65.3 Å²	65.3	77%	0.766	37%	0.373	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.8	-24.2	176.7	25	-34.5	0	0	0	113.2	T175	P173-T175 PolarHBondContact O-N 3.29Å
174	Q	65.5	Low	75.4	Confident	148 Å²	148	63.9 Å²	63.9	69%	0.692	37%	0.374	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.9	-18.9	174.7	-63.1	178.3	2	0	0	113.5	A172 A176 A177 L178	A172-Q174 PolarHBondContact O-N 3.48Å; Q174-A176 VanDerWaalsContact C-N 3.25Å; Q174-A176 PolarHBondContact O-N 3.24Å; Q174-A176 VanDerWaalsContact O-N 3.17Å; Q174-A177 PolarHBondContact O-N 3.02Å; Q174-A177 VanDerWaalsContact O-N 3.09Å; Q174-L178 HydrophobicContact CB-CD1 4.23Å; Q174-L178 WeakPolarHBondContact O-CG 3.41Å; Q174-L178 PolarHBondContact O-N 2.9Å; Q174-L178 VanDerWaalsContact O-N 3.14Å
175	T	67.7	Low	74.4	Confident	4 Å²	4	67.1 Å²	67.1	3%	0.025	39%	0.389	C	S	.	.	H	α-helix	trans	-52.5	-41.1	-176.4	-55.7	0	0	0	0	112.5	L92 A172 P173 A177 L178 E179	L92-T175 HydrophobicContact CD2-CG2 3.36Å; L92-T175 HydrophobicContact CG-CG2 4.01Å; A172-T175 WeakPolarHBondContact CB-OG1 3.45Å; A172-T175 WeakPolarHBondContact O-CB 3.45Å; A172-T175 PolarHBondContact O-N 2.89Å; A172-T175 PolarHBondContact O-OG1 2.94Å; P173-T175 PolarHBondContact O-N 3.29Å; T175-A177 PolarHBondContact O-N 3.41Å; T175-L178 PolarHBondContact O-N 3.41Å; T175-E179 WeakPolarHBondContact O-CB 3.35Å; T175-E179 PolarHBondContact O-N 3.38Å
176	A	69.8	Low	72.9	Confident	72 Å²	72	66.3 Å²	66.3	60%	0.595	40%	0.395	S	S	*	.	H	α-helix	trans	-68	-35.5	-177.8	0	0	0	0	0	113.3	Q174 A180	Q174-A176 VanDerWaalsContact C-N 3.25Å; Q174-A176 PolarHBondContact O-N 3.24Å; Q174-A176 VanDerWaalsContact O-N 3.17Å; A176-A180 PolarHBondContact O-N 2.95Å; A176-A180 VanDerWaalsContact O-N 3.12Å
177	A	74.4	Confident	71.7	Confident	70 Å²	70	68.9 Å²	68.9	58%	0.579	41%	0.413	S	S	*	.	H	α-helix	trans	-70.8	-43.6	176.4	0	0	0	0	0	111	Q174 T175 E179 A180 E181	Q174-A177 PolarHBondContact O-N 3.02Å; Q174-A177 VanDerWaalsContact O-N 3.09Å; T175-A177 PolarHBondContact O-N 3.41Å; A177-E179 VanDerWaalsContact C-N 3.34Å; A177-E179 PolarHBondContact O-N 3.48Å; A177-A180 WeakPolarHBondContact O-CB 3.44Å; A177-A180 PolarHBondContact O-N 3.05Å; A177-E181 PolarHBondContact O-N 3.29Å
178	L	72.4	Confident	70.7	Confident	40 Å²	40	68 Å²	68	21%	0.209	40%	0.404	C	S	.	.	H	α-helix	trans	-63.4	-39	175.3	-64.1	164.7	0	0	0	111.6	A88 Q174 T175 A180 E181 L182	A88-L178 HydrophobicContact CB-CB 3.94Å; A88-L178 HydrophobicContact CB-CD1 3.98Å; A88-L178 HydrophobicContact CB-CD2 4.3Å; A88-L178 HydrophobicContact CB-CG 4.29Å; Q174-L178 HydrophobicContact CB-CD1 4.23Å; Q174-L178 WeakPolarHBondContact O-CG 3.41Å; Q174-L178 PolarHBondContact O-N 2.9Å; Q174-L178 VanDerWaalsContact O-N 3.14Å; T175-L178 PolarHBondContact O-N 3.41Å; L178-A180 VanDerWaalsContact C-N 3.33Å; L178-A180 PolarHBondContact O-N 3.39Å; L178-E181 PolarHBondContact O-N 3.1Å; L178-L182 WeakPolarHBondContact O-CB 3.49Å; L178-L182 WeakPolarHBondContact O-CG 3.23Å; L178-L182 PolarHBondContact O-N 2.98Å
179	E	73.1	Confident	70.2	Confident	28 Å²	28	68.3 Å²	68.3	13%	0.131	41%	0.407	C	S	.	.	H	α-helix	trans	-63.1	-38.7	174.2	-154.1	-175.3	119.4	0	0	112.2	L92 R168 T175 A177 R183 L268	L92-E179 HydrophobicContact CD1-CB 4.28Å; L92-E179 HydrophobicContact CD1-CG 4.16Å; L92-E179 HydrophobicContact CD2-CB 3.79Å; L92-E179 HydrophobicContact CD2-CG 3.58Å; L92-E179 VanDerWaalsContact CD2-OE2 3.23Å; L92-E179 WeakPolarHBondContact CD2-OE2 3.42Å; R168-E179 IonicContact CZ-OE2 2.79Å; R168-E179 IonicContact NE-OE2 3Å; R168-E179 PolarHBondContact NE-OE2 3.49Å; R168-E179 IonicContact NH2-OE1 3.37Å; R168-E179 IonicContact NH2-OE2 3.74Å; R168-E179 PolarHBondContact NH2-OE2 3.22Å; T175-E179 WeakPolarHBondContact O-CB 3.35Å; T175-E179 PolarHBondContact O-N 3.38Å; A177-E179 VanDerWaalsContact C-N 3.34Å; A177-E179 PolarHBondContact O-N 3.48Å; E179-R183 WeakPolarHBondContact O-CB 3.49Å; E179-R183 PolarHBondContact O-N 3.1Å; E179-R183 IonicContact OE1-CZ 2.78Å; E179-R183 IonicContact OE1-NH1 4Å; E179-R183 PolarHBondContact OE1-NH1 3.15Å; E179-R183 IonicContact OE1-NH2 3.82Å; E179-R183 PolarHBondContact OE1-NH2 3.43Å; E179-L268 HydrophobicContact CG-CD1 4.44Å
180	A	75.6	Confident	70.5	Confident	59 Å²	59	69 Å²	69	49%	0.488	41%	0.411	S	S	.	.	H	α-helix	trans	-68.2	-42	176.5	0	0	0	0	0	111.8	A176 A177 L178 R183 A184	A176-A180 PolarHBondContact O-N 2.95Å; A176-A180 VanDerWaalsContact O-N 3.12Å; A177-A180 WeakPolarHBondContact O-CB 3.44Å; A177-A180 PolarHBondContact O-N 3.05Å; L178-A180 VanDerWaalsContact C-N 3.33Å; L178-A180 PolarHBondContact O-N 3.39Å; A180-R183 PolarHBondContact O-N 3.34Å; A180-A184 VanDerWaalsContact O-CB 3.27Å; A180-A184 WeakPolarHBondContact O-CB 3.28Å; A180-A184 PolarHBondContact O-N 3.05Å
181	E	77.2	Confident	71.6	Confident	138 Å²	138	65.3 Å²	65.3	65%	0.645	38%	0.382	S	S	*	.	H	α-helix	trans	-62.9	-49.6	176.3	-173.6	173.1	-166.4	0	0	111.7	A177 L178 R183 A184 E185	A177-E181 PolarHBondContact O-N 3.29Å; L178-E181 PolarHBondContact O-N 3.1Å; E181-R183 VanDerWaalsContact C-N 3.29Å; E181-R183 PolarHBondContact O-N 3.12Å; E181-A184 PolarHBondContact O-N 2.77Å; E181-A184 VanDerWaalsContact O-N 3.15Å; E181-E185 PolarHBondContact O-N 2.82Å
182	L	75.2	Confident	73.1	Confident	14 Å²	14	58.2 Å²	58.2	7%	0.073	34%	0.344	C	S	.	.	H	α-helix	trans	-65.9	-29.1	178.9	-65.4	172.6	0	0	0	113.4	R85 A88 L89 L92 L178 T188	R85-L182 HydrophobicContact CG-CD2 3.77Å; A88-L182 HydrophobicContact CB-CD1 3.91Å; L89-L182 HydrophobicContact CD2-CD1 4.11Å; L89-L182 HydrophobicContact CG-CD1 4.4Å; L92-L182 HydrophobicContact CD1-CD1 3.8Å; L178-L182 WeakPolarHBondContact O-CB 3.49Å; L178-L182 WeakPolarHBondContact O-CG 3.23Å; L178-L182 PolarHBondContact O-N 2.98Å; L182-T188 PolarHBondContact O-OG1 2.82Å
183	R	74.6	Confident	74.5	Confident	77 Å²	77	57.3 Å²	57.3	29%	0.291	34%	0.337	S	S	.	.	H	α-helix	trans	-82.6	-20.9	174.7	-171.8	176.3	-73.1	123.4	-9.1	113.3	E179 A180 E181 L268	E179-R183 WeakPolarHBondContact O-CB 3.49Å; E179-R183 PolarHBondContact O-N 3.1Å; E179-R183 IonicContact OE1-CZ 2.78Å; E179-R183 IonicContact OE1-NH1 4Å; E179-R183 PolarHBondContact OE1-NH1 3.15Å; E179-R183 IonicContact OE1-NH2 3.82Å; E179-R183 PolarHBondContact OE1-NH2 3.43Å; A180-R183 PolarHBondContact O-N 3.34Å; E181-R183 VanDerWaalsContact C-N 3.29Å; E181-R183 PolarHBondContact O-N 3.12Å; R183-L268 HydrophobicContact CB-CD2 3.74Å; R183-L268 HydrophobicContact CG-CD2 4.26Å
184	A	71.1	Confident	76.1	Confident	63 Å²	63	51.7 Å²	51.7	52%	0.521	30%	0.301	S	S	.	.	H	α-helix	trans	-79.4	-22	177	0	0	0	0	0	113	A180 E181 V186	A180-A184 VanDerWaalsContact O-CB 3.27Å; A180-A184 WeakPolarHBondContact O-CB 3.28Å; A180-A184 PolarHBondContact O-N 3.05Å; E181-A184 PolarHBondContact O-N 2.77Å; E181-A184 VanDerWaalsContact O-N 3.15Å; A184-V186 PolarHBondContact O-N 2.95Å
185	E	72.9	Confident	77.4	Confident	70 Å²	70	44.7 Å²	44.7	33%	0.327	27%	0.268	S	S	.	.			trans	-60.4	127.4	-177.1	-173.9	-179.5	-117.4	0	0	113.1	R85 E181 S187 T188	R85-E185 IonicContact CZ-OE1 2.71Å; R85-E185 IonicContact CZ-OE2 3.37Å; R85-E185 VanDerWaalsContact CZ-OE2 3.24Å; R85-E185 IonicContact NH1-OE1 3.62Å; R85-E185 PolarHBondContact NH1-OE1 3.41Å; R85-E185 IonicContact NH1-OE2 2.69Å; R85-E185 PolarHBondContact NH1-OE2 2.84Å; R85-E185 IonicContact NH2-OE1 3.51Å; R85-E185 IonicContact NH2-OE2 3.42Å; R85-E185 PolarHBondContact NH2-OE2 2.79Å; E181-E185 PolarHBondContact O-N 2.82Å; E185-S187 PolarHBondContact O-N 2.78Å; E185-S187 VanDerWaalsContact O-N 3.1Å; E185-T188 PolarHBondContact O-N 2.86Å; E185-T188 PolarHBondContact O-OG1 2.76Å
186	V	61.7	Low	78.5	Confident	115 Å²	115	45.5 Å²	45.5	70%	0.697	27%	0.273	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65	-23	-170.9	-173.4	0	0	0	0	114.2	A184	A184-V186 PolarHBondContact O-N 2.95Å
187	S	67.4	Low	79.5	Confident	63 Å²	63	42.1 Å²	42.1	44%	0.441	25%	0.246	S	C	.	.	T	Hydrogen-bonded Turn	trans	-71.4	-30.4	-179.9	-164	0	0	0	0	113.8	E185	E185-S187 PolarHBondContact O-N 2.78Å; E185-S187 VanDerWaalsContact O-N 3.1Å
188	T	70	Confident	80.3	Confident	2 Å²	2	40.6 Å²	40.6	1%	0.012	23%	0.226	C	C	.	.	T	Hydrogen-bonded Turn	trans	-91.9	-23.6	-176.9	52.9	0	0	0	0	113	L182 E185 R191 P270	L182-T188 PolarHBondContact O-OG1 2.82Å; E185-T188 PolarHBondContact O-N 2.86Å; E185-T188 PolarHBondContact O-OG1 2.76Å; T188-R191 WeakPolarHBondContact O-CA 3.41Å; T188-R191 WeakPolarHBondContact O-CB 3.33Å; T188-R191 PolarHBondContact O-N 3.48Å; T188-P270 HydrophobicContact CG2-CB 4.35Å
189	K	77.8	Confident	80.9	Confident	68 Å²	68	40.8 Å²	40.8	30%	0.296	23%	0.23	S	C	.	.	T	Hydrogen-bonded Turn	trans	-49.4	-48.5	-178.8	-74	177.6	158.9	-118.3	0	116.6	R191 E242	K189-R191 PolarHBondContact O-N 2.98Å; K189-E242 HydrophobicContact CB-CG 4.14Å; K189-E242 WeakPolarHBondContact CD-OE1 3.36Å; K189-E242 WeakPolarHBondContact CD-OE2 3.37Å; K189-E242 VanDerWaalsContact NZ-CD 3.28Å; K189-E242 IonicContact NZ-OE1 2.96Å; K189-E242 PolarHBondContact NZ-OE1 2.75Å; K189-E242 IonicContact NZ-OE2 3.84Å; K189-E242 PolarHBondContact NZ-OE2 3.15Å
190	P	85.4	Confident	81.5	Confident	30 Å²	30	46.4 Å²	46.4	20%	0.195	26%	0.256	C	S	.	.	T	Hydrogen-bonded Turn	trans	-82	2.7	178	34.9	-37.1	0	0	0	113.1	F239	P190-F239 PolarHBondContact O-N 3.3Å
191	R	89	Confident	82.1	Confident	24 Å²	24	44.8 Å²	44.8	9%	0.091	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.3	127.8	-178.7	-171.8	179.2	-160.4	-156.4	4.1	110.3	T188 K189 Y236 I237 D238 A267 T269 P270	T188-R191 WeakPolarHBondContact O-CA 3.41Å; T188-R191 WeakPolarHBondContact O-CB 3.33Å; T188-R191 PolarHBondContact O-N 3.48Å; K189-R191 PolarHBondContact O-N 2.98Å; R191-Y236 HydrophobicContact CG-CD1 4.13Å; R191-I237 CarbonylContact C-O 3.54Å; R191-I237 WeakPolarHBondContact CA-O 3.48Å; R191-D238 WeakPolarHBondContact CB-OD1 3.41Å; R191-D238 WeakPolarHBondContact CG-OD1 3.47Å; R191-D238 IonicContact NE-OD1 2.68Å; R191-A267 HydrophobicContact CB-CB 3.75Å; R191-A267 HydrophobicContact CG-CB 3.62Å; R191-A267 VanDerWaalsContact O-CB 3.22Å; R191-A267 WeakPolarHBondContact O-CB 3.37Å; R191-A267 PolarHBondContact O-N 2.69Å; R191-T269 PolarHBondContact NH1-O 3.3Å; R191-P270 PolarHBondContact NH1-O 2.91Å; R191-P270 VanDerWaalsContact NH1-O 3.15Å
192	V	92.1	Very high	82.7	Confident	1 Å²	1	41.5 Å²	41.5	1%	0.006	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	135.1	179.4	174	0	0	0	0	108.5	Y236 I237 F239 A245 V249 V264 G265	V192-Y236 CarbonylContact O-C 3.6Å; V192-Y236 VanDerWaalsContact O-CA 3.31Å; V192-Y236 WeakPolarHBondContact O-CA 3.45Å; V192-I237 HydrophobicContact CB-CB 4.44Å; V192-I237 PolarHBondContact N-O 3.05Å; V192-I237 PolarHBondContact O-N 2.89Å; V192-F239 HydrophobicContact CB-CE2 4.29Å; V192-F239 HydrophobicContact CG2-CD2 3.94Å; V192-F239 HydrophobicContact CG2-CE2 3.74Å; V192-A245 HydrophobicContact CG2-CB 3.62Å; V192-V249 HydrophobicContact CG1-CG2 3.91Å; V192-V249 HydrophobicContact CG2-CG2 3.93Å; V192-V264 HydrophobicContact CG1-CG1 3.39Å; V192-G265 CarbonylContact C-O 3.6Å; V192-G265 WeakPolarHBondContact CA-O 3.42Å; V192-G265 WeakPolarHBondContact CG1-O 3.43Å
193	Y	93	Very high	83.4	Confident	0 Å²	0	45.8 Å²	45.8	0%	0	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90	136	168	177.5	-109	0	0	0	109.5	F116 G117 V143 E145 A146 L149 A195 F234 G235 Y236 V264 G265	F116-Y193 PolarHBondContact O-OH 3.29Å; G117-Y193 WeakPolarHBondContact CA-OH 3.31Å; V143-Y193 HydrophobicContact CG1-CD2 4.25Å; V143-Y193 HydrophobicContact CG1-CE2 3.8Å; E145-Y193 HydrophobicContact CB-CD1 3.57Å; E145-Y193 HydrophobicContact CB-CD2 4.2Å; E145-Y193 HydrophobicContact CB-CE1 4.16Å; E145-Y193 HydrophobicContact CB-CG 3.58Å; E145-Y193 HydrophobicContact CG-CG 4.14Å; A146-Y193 HydrophobicContact CB-CE1 4.15Å; L149-Y193 HydrophobicContact CD1-CD1 3.81Å; L149-Y193 HydrophobicContact CD1-CE1 4.2Å; Y193-A195 HydrophobicContact CE1-CB 3.74Å; Y193-F234 HydrophobicContact CE2-CB 4.21Å; Y193-F234 AromaticContact CE2-CD2 3.87Å; Y193-F234 HydrophobicContact CE2-CD2 3.87Å; Y193-F234 HydrophobicContact CE2-CG 4.43Å; Y193-G235 VanDerWaalsContact CD2-O 3.31Å; Y193-G235 WeakPolarHBondContact CD2-O 3.48Å; Y193-Y236 HydrophobicContact CD2-CD1 4.05Å; Y193-Y236 AromaticContact CD2-CE1 3.66Å; Y193-Y236 HydrophobicContact CD2-CE1 3.66Å; Y193-Y236 HydrophobicContact CG-CE1 4.35Å; Y193-V264 WeakPolarHBondContact O-CA 3.33Å; Y193-G265 PolarHBondContact N-O 3.37Å; Y193-G265 PolarHBondContact O-N 2.93Å
194	I	92.8	Very high	84.2	Confident	0 Å²	0	45.4 Å²	45.4	0%	0	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	136	175.7	-171.1	174.8	0	0	0	109.9	V197 I206 F210 L221 F234 G235 I237 L262 R263 V264	I194-V197 HydrophobicContact CD1-CG2 3.74Å; I194-V197 HydrophobicContact CG1-CG2 3.71Å; I194-V197 HydrophobicContact CG2-CG2 4.38Å; I194-I206 HydrophobicContact CD1-CD1 4.38Å; I194-I206 HydrophobicContact CD1-CG2 3.86Å; I194-F210 HydrophobicContact CD1-CE2 3.61Å; I194-F210 HydrophobicContact CD1-CZ 3.79Å; I194-L221 HydrophobicContact CG2-CD2 4.03Å; I194-F234 CarbonylContact O-C 3.57Å; I194-F234 WeakPolarHBondContact O-CA 3.48Å; I194-F234 WeakPolarHBondContact O-CB 3.2Å; I194-G235 PolarHBondContact N-O 2.89Å; I194-G235 PolarHBondContact O-N 2.59Å; I194-I237 HydrophobicContact CB-CD1 4.49Å; I194-I237 HydrophobicContact CD1-CD1 4.24Å; I194-I237 HydrophobicContact CG2-CD1 4.3Å; I194-I237 HydrophobicContact CG2-CG1 4.25Å; I194-L262 HydrophobicContact CD1-CD1 4.41Å; I194-L262 HydrophobicContact CD1-CD2 4.29Å; I194-R263 CarbonylContact C-O 3.56Å; I194-R263 WeakPolarHBondContact CA-O 3.44Å; I194-V264 HydrophobicContact CG1-CG2 4.46Å
195	A	91.8	Very high	85.2	Confident	1 Å²	1	45.9 Å²	45.9	1%	0.008	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141	171.5	175.7	0	0	0	0	0	111.6	F116 Y193 V197 G233 F234 R263	F116-A195 VanDerWaalsContact O-CB 3.28Å; F116-A195 WeakPolarHBondContact O-CB 3.33Å; Y193-A195 HydrophobicContact CE1-CB 3.74Å; A195-V197 VanDerWaalsContact C-N 3.27Å; A195-V197 PolarHBondContact O-N 3.37Å; A195-G233 CarbonylContact C-O 3.32Å; A195-G233 VanDerWaalsContact CA-O 3.28Å; A195-G233 WeakPolarHBondContact CA-O 3.42Å; A195-F234 HydrophobicContact CB-CB 4.1Å; A195-R263 HydrophobicContact CB-CB 4.17Å; A195-R263 PolarHBondContact N-O 2.85Å; A195-R263 PolarHBondContact O-N 2.98Å
196	S	91.1	Very high	86.1	Confident	20 Å²	20	42.6 Å²	42.6	14%	0.14	24%	0.236	C	C	.	.			trans	55.7	35.2	-169.4	-165.5	0	0	0	0	114.4	P115 G233 Q260 Q261	P115-S196 WeakPolarHBondContact O-CB 3.41Å; P115-S196 PolarHBondContact O-N 2.94Å; S196-G233 PolarHBondContact N-O 3.09Å; S196-Q260 PolarHBondContact O-OE1 2.99Å; S196-Q261 VanDerWaalsContact CB-O 3.27Å; S196-Q261 WeakPolarHBondContact CB-O 3.35Å; S196-Q261 PolarHBondContact OG-O 2.85Å
197	V	91.2	Very high	87.6	Confident	2 Å²	2	40.7 Å²	40.7	1%	0.012	22%	0.22	C	C	.	.			trans	-74.1	127.9	172.8	-172.4	0	0	0	0	109.8	I194 A195 L201 I206 L221 G233 L262	I194-V197 HydrophobicContact CD1-CG2 3.74Å; I194-V197 HydrophobicContact CG1-CG2 3.71Å; I194-V197 HydrophobicContact CG2-CG2 4.38Å; A195-V197 VanDerWaalsContact C-N 3.27Å; A195-V197 PolarHBondContact O-N 3.37Å; V197-L201 HydrophobicContact CG1-CB 4.04Å; V197-L201 HydrophobicContact CG1-CD1 4.06Å; V197-I206 HydrophobicContact CG1-CD1 3.88Å; V197-I206 HydrophobicContact CG1-CG1 4Å; V197-L221 HydrophobicContact CG1-CD1 4.3Å; V197-L221 HydrophobicContact CG2-CD2 4.34Å; V197-G233 PolarHBondContact N-O 2.89Å; V197-G233 WeakPolarHBondContact O-CA 3.17Å; V197-L262 HydrophobicContact CG2-CD2 4.17Å
198	H	90.3	Very high	88.8	Confident	37 Å²	37	42 Å²	42	17%	0.171	23%	0.225	C	C	.	.			trans	-61.8	133.5	179.9	-173.8	-99.7	0	0	0	111.5	E200 L201 H231 A258 Q260	H198-E200 IonicContact CE1-OE2 3.94Å; H198-E200 PolarHBondContact CE1-OE2 3.49Å; H198-E200 IonicContact ND1-OE2 2.77Å; H198-E200 PolarHBondContact O-N 2.85Å; H198-L201 HydrophobicContact CB-CD1 3.81Å; H198-L201 HydrophobicContact CB-CG 4.14Å; H198-L201 WeakPolarHBondContact O-CB 3.26Å; H198-L201 PolarHBondContact O-N 3.37Å; H198-H231 PolarHBondContact O-NE2 2.87Å; H198-A258 HydrophobicContact CB-CB 3.88Å; H198-Q260 HydrophobicContact CB-CG 4.48Å
199	P	86.4	Confident	89.8	Confident	44 Å²	44	44 Å²	44	29%	0.286	24%	0.237	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66.8	1.9	-169.9	27.2	-37.8	0	0	0	116.3	H231	P199-H231 WeakPolarHBondContact CA-NE2 3.15Å
200	E	85.4	Confident	90.5	Very high	147 Å²	147	40.8 Å²	40.8	69%	0.687	22%	0.223	S	C	*	.	T	Hydrogen-bonded Turn	trans	-104.5	-8.9	173.7	-59.2	-177	155.7	0	0	113.2	H198	H198-E200 IonicContact CE1-OE2 3.94Å; H198-E200 PolarHBondContact CE1-OE2 3.49Å; H198-E200 IonicContact ND1-OE2 2.77Å; H198-E200 PolarHBondContact O-N 2.85Å
201	L	88.6	Confident	90.9	Very high	25 Å²	25	44.9 Å²	44.9	13%	0.131	24%	0.24	C	C	.	.			trans	-83.3	134.6	175.9	-62.8	168.2	0	0	0	110.3	V197 H198 D205 I206 H231 L257 A258	V197-L201 HydrophobicContact CG1-CB 4.04Å; V197-L201 HydrophobicContact CG1-CD1 4.06Å; H198-L201 HydrophobicContact CB-CD1 3.81Å; H198-L201 HydrophobicContact CB-CG 4.14Å; H198-L201 WeakPolarHBondContact O-CB 3.26Å; H198-L201 PolarHBondContact O-N 3.37Å; L201-D205 HydrophobicContact CD2-CB 4.34Å; L201-I206 HydrophobicContact CD1-CD1 4.21Å; L201-H231 VanDerWaalsContact C-NE2 3.32Å; L201-H231 PolarHBondContact N-NE2 2.9Å; L201-H231 VanDerWaalsContact N-NE2 3.19Å; L201-H231 PolarHBondContact O-CE1 2.92Å; L201-H231 PolarHBondContact O-ND1 2.82Å; L201-H231 PolarHBondContact O-NE2 3.44Å; L201-L257 HydrophobicContact CD1-CD2 3.67Å; L201-L257 HydrophobicContact CD1-CG 3.79Å; L201-A258 HydrophobicContact CD1-CB 4.43Å
202	T	89.3	Confident	91	Very high	69 Å²	69	48 Å²	48	42%	0.423	27%	0.271	S	S	.	.			trans	-91.2	166.4	175	72.1	0	0	0	0	111.6	S204 D205 I206	T202-S204 PolarHBondContact O-N 2.68Å; T202-S204 PolarHBondContact OG1-N 2.74Å; T202-D205 WeakPolarHBondContact CA-OD2 3.16Å; T202-D205 VanDerWaalsContact CB-OD2 3.31Å; T202-D205 WeakPolarHBondContact CB-OD2 3.23Å; T202-D205 PolarHBondContact N-OD2 2.81Å; T202-D205 PolarHBondContact O-N 2.8Å; T202-D205 VanDerWaalsContact O-N 3.12Å; T202-D205 PolarHBondContact OG1-N 3.48Å; T202-D205 PolarHBondContact OG1-OD2 2.87Å; T202-I206 PolarHBondContact O-N 3.09Å; T202-I206 VanDerWaalsContact O-N 3.13Å
203	E	90.1	Very high	91	Very high	103 Å²	103	50.8 Å²	50.8	48%	0.481	28%	0.283	S	S	.	.	H	α-helix	trans	-60	-26.8	171.1	63.5	-170.7	-178.6	0	0	112.9	Q207 L221	E203-Q207 VanDerWaalsContact O-CB 3.27Å; E203-Q207 WeakPolarHBondContact O-CB 3.4Å; E203-Q207 PolarHBondContact O-N 2.9Å; E203-L221 HydrophobicContact CB-CD1 4.22Å; E203-L221 HydrophobicContact CB-CG 4.11Å
204	S	91.2	Very high	90.9	Very high	70 Å²	70	51.9 Å²	51.9	49%	0.49	29%	0.294	S	S	.	.	H	α-helix	trans	-70.5	-37.5	173.8	-172.3	0	0	0	0	112.4	T202 T208	T202-S204 PolarHBondContact O-N 2.68Å; T202-S204 PolarHBondContact OG1-N 2.74Å; S204-T208 WeakPolarHBondContact O-CB 3.46Å; S204-T208 PolarHBondContact O-N 3.47Å; S204-T208 PolarHBondContact O-OG1 3.31Å
205	D	91.7	Very high	90.9	Very high	73 Å²	73	57.1 Å²	57.1	39%	0.39	32%	0.317	S	S	.	.	H	α-helix	trans	-68	-44	176.9	-56.7	-64.5	0	0	0	110.1	L201 T202 T208 V209	L201-D205 HydrophobicContact CD2-CB 4.34Å; T202-D205 WeakPolarHBondContact CA-OD2 3.16Å; T202-D205 VanDerWaalsContact CB-OD2 3.31Å; T202-D205 WeakPolarHBondContact CB-OD2 3.23Å; T202-D205 PolarHBondContact N-OD2 2.81Å; T202-D205 PolarHBondContact O-N 2.8Å; T202-D205 VanDerWaalsContact O-N 3.12Å; T202-D205 PolarHBondContact OG1-N 3.48Å; T202-D205 PolarHBondContact OG1-OD2 2.87Å; D205-T208 PolarHBondContact O-N 3.15Å; D205-V209 WeakPolarHBondContact O-CG2 3.35Å; D205-V209 PolarHBondContact O-N 2.83Å
206	I	92.2	Very high	91	Very high	0 Å²	0	57.8 Å²	57.8	0%	0	32%	0.321	C	S	.	.	H	α-helix	trans	-64.1	-44.1	175.1	-63.1	-54.1	0	0	0	111.3	I194 V197 L201 T202 T208 V209 F210 L221 I237 L257	I194-I206 HydrophobicContact CD1-CD1 4.38Å; I194-I206 HydrophobicContact CD1-CG2 3.86Å; V197-I206 HydrophobicContact CG1-CD1 3.88Å; V197-I206 HydrophobicContact CG1-CG1 4Å; L201-I206 HydrophobicContact CD1-CD1 4.21Å; T202-I206 PolarHBondContact O-N 3.09Å; T202-I206 VanDerWaalsContact O-N 3.13Å; I206-T208 VanDerWaalsContact C-N 3.31Å; I206-T208 PolarHBondContact O-N 2.99Å; I206-V209 PolarHBondContact O-N 3.41Å; I206-F210 HydrophobicContact CG2-CD2 3.86Å; I206-F210 HydrophobicContact CG2-CE2 4.08Å; I206-F210 WeakPolarHBondContact O-CD2 3.4Å; I206-F210 PolarHBondContact O-N 3.13Å; I206-L221 HydrophobicContact CG1-CD1 4.1Å; I206-I237 HydrophobicContact CG2-CD1 3.62Å; I206-I237 HydrophobicContact CG2-CG1 4.38Å; I206-L257 HydrophobicContact CD1-CD2 3.9Å
207	Q	92.8	Very high	91	Very high	76 Å²	76	61.2 Å²	61.2	36%	0.355	34%	0.337	S	S	.	.	H	α-helix	trans	-56.8	-45.3	174.2	-178.4	172.5	1.4	0	0	111.6	E203 V209 F210 E211 V216 C219	E203-Q207 VanDerWaalsContact O-CB 3.27Å; E203-Q207 WeakPolarHBondContact O-CB 3.4Å; E203-Q207 PolarHBondContact O-N 2.9Å; Q207-V209 PolarHBondContact O-N 3.23Å; Q207-F210 PolarHBondContact O-N 3.38Å; Q207-E211 WeakPolarHBondContact O-CB 3.1Å; Q207-E211 PolarHBondContact O-N 3.42Å; Q207-V216 HydrophobicContact CG-CB 4.18Å; Q207-V216 HydrophobicContact CG-CG1 4.17Å; Q207-C219 HydrophobicContact CB-CB 4.21Å
208	T	92.9	Very high	90.8	Very high	91 Å²	91	63.6 Å²	63.6	56%	0.558	35%	0.354	S	S	*	.	H	α-helix	trans	-63.3	-39	179.5	-53.6	0	0	0	0	112.3	S204 D205 I206	S204-T208 WeakPolarHBondContact O-CB 3.46Å; S204-T208 PolarHBondContact O-N 3.47Å; S204-T208 PolarHBondContact O-OG1 3.31Å; D205-T208 PolarHBondContact O-N 3.15Å; I206-T208 VanDerWaalsContact C-N 3.31Å; I206-T208 PolarHBondContact O-N 2.99Å
209	V	91.9	Very high	90.8	Very high	44 Å²	44	62.7 Å²	62.7	27%	0.267	35%	0.352	S	S	.	.	H	α-helix	trans	-68.2	-40.9	176.5	169.6	0	0	0	0	111.7	D205 I206 Q207 M252 L257	D205-V209 WeakPolarHBondContact O-CG2 3.35Å; D205-V209 PolarHBondContact O-N 2.83Å; I206-V209 PolarHBondContact O-N 3.41Å; Q207-V209 PolarHBondContact O-N 3.23Å; V209-M252 HydrophobicContact CG1-CE 3.47Å; V209-M252 VanDerWaalsContact CG1-CE 3.47Å; V209-M252 HydrophobicContact CG1-SD 4.43Å; V209-L257 HydrophobicContact CG2-CD2 4.32Å
210	F	92.5	Very high	90.8	Very high	0 Å²	0	63.4 Å²	63.4	0%	0	36%	0.358	C	S	.	.	H	α-helix	trans	-84	-20.4	-176	-80.8	-98.4	0	0	0	114	I194 I206 Q207 A212 F213 V216 I237 F239 A248 M252 L262 V264	I194-F210 HydrophobicContact CD1-CE2 3.61Å; I194-F210 HydrophobicContact CD1-CZ 3.79Å; I206-F210 HydrophobicContact CG2-CD2 3.86Å; I206-F210 HydrophobicContact CG2-CE2 4.08Å; I206-F210 WeakPolarHBondContact O-CD2 3.4Å; I206-F210 PolarHBondContact O-N 3.13Å; Q207-F210 PolarHBondContact O-N 3.38Å; F210-A212 PolarHBondContact O-N 3.13Å; F210-A212 VanDerWaalsContact O-N 3.15Å; F210-F213 PolarHBondContact O-N 2.97Å; F210-V216 HydrophobicContact CB-CG2 4.33Å; F210-I237 HydrophobicContact CB-CD1 4.13Å; F210-I237 HydrophobicContact CD1-CD1 3.76Å; F210-I237 HydrophobicContact CD2-CD1 3.62Å; F210-I237 HydrophobicContact CE1-CD1 4Å; F210-I237 HydrophobicContact CE2-CD1 3.88Å; F210-I237 HydrophobicContact CG-CD1 3.55Å; F210-I237 HydrophobicContact CZ-CD1 4.06Å; F210-F239 HydrophobicContact CB-CZ 4.08Å; F210-F239 HydrophobicContact CD1-CZ 4.04Å; F210-A248 HydrophobicContact CD1-CB 3.94Å; F210-A248 HydrophobicContact CE1-CB 4.12Å; F210-M252 HydrophobicContact CD1-CG 4.32Å; F210-M252 HydrophobicContact CE1-CB 3.8Å; F210-M252 HydrophobicContact CE1-CG 3.75Å; F210-M252 HydrophobicContact CE2-CE 4.22Å; F210-M252 HydrophobicContact CZ-CB 3.74Å; F210-M252 HydrophobicContact CZ-CE 4.28Å; F210-M252 HydrophobicContact CZ-CG 3.9Å; F210-L262 HydrophobicContact CE2-CD1 4.29Å; F210-V264 HydrophobicContact CE1-CG1 4.07Å; F210-V264 HydrophobicContact CZ-CG1 4.36Å; F210-V264 HydrophobicContact CZ-CG2 4.05Å
211	E	93	Very high	91	Very high	116 Å²	116	57.1 Å²	57.1	54%	0.542	33%	0.329	S	S	.	.	G	3₁₀ helix	trans	-57.1	-26.5	172.9	-175.1	169.4	-156.7	0	0	112.7	Q207 F213 G214	Q207-E211 WeakPolarHBondContact O-CB 3.1Å; Q207-E211 PolarHBondContact O-N 3.42Å; E211-F213 PolarHBondContact O-N 3.1Å; E211-G214 WeakPolarHBondContact CA-O 3.38Å; E211-G214 CarbonylContact O-C 3.55Å; E211-G214 PolarHBondContact O-N 3.26Å
212	A	91.9	Very high	90.8	Very high	89 Å²	89	57.3 Å²	57.3	74%	0.736	33%	0.328	S	S	*	.	G	3₁₀ helix	trans	-61	-21.3	175.2	0	0	0	0	0	114.6	F210	F210-A212 PolarHBondContact O-N 3.13Å; F210-A212 VanDerWaalsContact O-N 3.15Å
213	F	91.1	Very high	90.5	Very high	59 Å²	59	58.1 Å²	58.1	26%	0.259	34%	0.335	S	S	.	.	G	3₁₀ helix	trans	-94	-14.6	176	-60.8	-81.6	0	0	0	113.1	F210 E211 F239 A244 A247 A248 S251 M252	F210-F213 PolarHBondContact O-N 2.97Å; E211-F213 PolarHBondContact O-N 3.1Å; F213-F239 HydrophobicContact CB-CE1 4.49Å; F213-A244 VanDerWaalsContact O-CB 3.29Å; F213-A244 WeakPolarHBondContact O-CB 3.21Å; F213-A247 HydrophobicContact CD1-CB 4.29Å; F213-A248 HydrophobicContact CB-CB 4.09Å; F213-A248 HydrophobicContact CD2-CB 4.17Å; F213-A248 HydrophobicContact CG-CB 4Å; F213-S251 VanDerWaalsContact CE1-CB 3.41Å; F213-M252 HydrophobicContact CD2-CG 4.21Å; F213-M252 HydrophobicContact CE2-CG 3.35Å; F213-M252 HydrophobicContact CE2-SD 3.49Å; F213-M252 WeakPolarHBondContact CE2-SD 3.38Å; F213-M252 HydrophobicContact CZ-CG 3.6Å; F213-M252 HydrophobicContact CZ-SD 3.6Å
214	G	91.3	Very high	89.9	Confident	23 Å²	23	55.2 Å²	55.2	24%	0.237	32%	0.323	C	S	.	.	S	Bend	trans	149.2	163.7	-176	0	0	0	0	0	111.7	E211 V216 F239	E211-G214 WeakPolarHBondContact CA-O 3.38Å; E211-G214 CarbonylContact O-C 3.55Å; E211-G214 PolarHBondContact O-N 3.26Å; G214-V216 PolarHBondContact O-N 2.8Å; G214-F239 WeakPolarHBondContact O-CE1 3.27Å
215	K	93.5	Very high	88.9	Confident	111 Å²	111	57.2 Å²	57.2	48%	0.483	33%	0.334	S	S	.	.			trans	-60.4	123.7	-176.2	-172.8	-161.2	-172.7	-176.6	0	111.9	E240	K215-E240 HydrophobicContact CB-CB 4.33Å; K215-E240 HydrophobicContact CD-CB 4.14Å; K215-E240 HydrophobicContact CD-CG 4.45Å; K215-E240 WeakPolarHBondContact CD-OE2 3.31Å; K215-E240 IonicContact NZ-OE1 3.25Å; K215-E240 PolarHBondContact NZ-OE1 3.5Å; K215-E240 IonicContact NZ-OE2 2.84Å; K215-E240 PolarHBondContact NZ-OE2 2.87Å; K215-E240 PolarHBondContact O-N 3.11Å
216	V	93.1	Very high	87.9	Confident	15 Å²	15	62.4 Å²	62.4	9%	0.091	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.5	125.3	173.3	177.1	0	0	0	0	109.2	Q207 F210 G214 C219 I237 D238 F239	Q207-V216 HydrophobicContact CG-CB 4.18Å; Q207-V216 HydrophobicContact CG-CG1 4.17Å; F210-V216 HydrophobicContact CB-CG2 4.33Å; G214-V216 PolarHBondContact O-N 2.8Å; V216-C219 HydrophobicContact CG1-CB 4.3Å; V216-I237 HydrophobicContact CG1-CG2 3.82Å; V216-I237 HydrophobicContact CG2-CG2 3.96Å; V216-D238 CarbonylContact C-O 3.56Å; V216-D238 WeakPolarHBondContact CA-O 3.36Å; V216-F239 HydrophobicContact CG2-CD1 4.26Å; V216-F239 HydrophobicContact CG2-CE1 3.86Å; V216-F239 HydrophobicContact CG2-CZ 4.31Å
217	N	90.5	Very high	86.7	Confident	91 Å²	91	65.1 Å²	65.1	49%	0.487	37%	0.371	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.2	-40.4	174.1	-80.7	-39.3	0	0	0	111.9	D238 F239 E240	N217-D238 HydrophobicContact CB-CB 4.3Å; N217-D238 PolarHBondContact N-O 2.7Å; N217-F239 PolarHBondContact ND2-O 3.47Å; N217-E240 WeakPolarHBondContact ND2-CA 3.46Å; N217-E240 PolarHBondContact ND2-N 2.83Å
218	S	87.8	Confident	85.4	Confident	53 Å²	53	67.9 Å²	67.9	37%	0.371	40%	0.399	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-157.2	131.5	177.9	31	0	0	0	0	110.7	D238	S218-D238 PolarHBondContact N-O 3.21Å; S218-D238 PolarHBondContact O-N 3.44Å; S218-D238 WeakPolarHBondContact OG-CB 3.4Å; S218-D238 PolarHBondContact OG-OD2 3.16Å
219	C	89.4	Confident	84.2	Confident	18 Å²	18	67.1 Å²	67.1	12%	0.122	41%	0.409	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	139.7	165.2	179.9	0	0	0	0	107.6	Q207 V216	Q207-C219 HydrophobicContact CB-CB 4.21Å; V216-C219 HydrophobicContact CG1-CB 4.3Å
220	S	87.9	Confident	83.5	Confident	59 Å²	59	71.1 Å²	71.1	41%	0.413	42%	0.419	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.2	117	175.8	-175.6	0	0	0	0	109.9	G235 Y236	S220-G235 CarbonylContact O-C 3.56Å; S220-G235 WeakPolarHBondContact O-CA 3.33Å; S220-Y236 PolarHBondContact N-O 3.34Å; S220-Y236 PolarHBondContact O-N 3.25Å
221	L	88.4	Confident	83	Confident	15 Å²	15	72.3 Å²	72.3	8%	0.079	43%	0.425	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	136.8	173.7	-60.3	-179.2	0	0	0	109.5	I194 V197 E203 I206 H231	I194-L221 HydrophobicContact CG2-CD2 4.03Å; V197-L221 HydrophobicContact CG1-CD1 4.3Å; V197-L221 HydrophobicContact CG2-CD2 4.34Å; E203-L221 HydrophobicContact CB-CD1 4.22Å; E203-L221 HydrophobicContact CB-CG 4.11Å; I206-L221 HydrophobicContact CG1-CD1 4.1Å; L221-H231 HydrophobicContact CB-CB 4.15Å
222	Y	84.8	Confident	82.5	Confident	28 Å²	28	70.5 Å²	70.5	11%	0.11	41%	0.413	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.2	123.2	-173.5	-78.2	-67.1	0	0	0	112.6	H231 R232 F234 Y236 L275 F277 E278	Y222-H231 CarbonylContact O-C 3.45Å; Y222-H231 WeakPolarHBondContact O-CA 3.43Å; Y222-H231 VanDerWaalsContact O-CB 3.27Å; Y222-H231 WeakPolarHBondContact O-CB 3.39Å; Y222-R232 PolarHBondContact O-N 3.29Å; Y222-F234 AromaticContact CD2-CD2 3.83Å; Y222-F234 HydrophobicContact CD2-CD2 3.83Å; Y222-F234 AromaticContact CD2-CE2 3.37Å; Y222-F234 HydrophobicContact CD2-CE2 3.37Å; Y222-F234 HydrophobicContact CD2-CZ 4.12Å; Y222-F234 HydrophobicContact CE2-CE2 4.04Å; Y222-F234 HydrophobicContact CG-CE2 4.11Å; Y222-F234 HydrophobicContact CG-CZ 4.44Å; Y222-F234 PolarHBondContact N-O 3.47Å; Y222-Y236 AromaticContact CE2-CD2 3.83Å; Y222-Y236 HydrophobicContact CE2-CD2 3.83Å; Y222-Y236 AromaticContact CE2-CE2 3.81Å; Y222-Y236 HydrophobicContact CE2-CE2 3.81Å; Y222-L275 HydrophobicContact CD2-CD1 4.5Å; Y222-L275 HydrophobicContact CE2-CD1 3.74Å; Y222-F277 AromaticContact CD1-CE2 3.74Å; Y222-F277 HydrophobicContact CD1-CE2 3.74Å; Y222-F277 AromaticContact CD1-CZ 3.39Å; Y222-F277 HydrophobicContact CD1-CZ 3.39Å; Y222-F277 HydrophobicContact CD2-CZ 4.06Å; Y222-F277 HydrophobicContact CE1-CE2 4.13Å; Y222-F277 AromaticContact CE1-CZ 3.63Å; Y222-F277 HydrophobicContact CE1-CZ 3.63Å; Y222-F277 HydrophobicContact CE2-CZ 4.27Å; Y222-F277 HydrophobicContact CG-CE2 4.2Å; Y222-F277 AromaticContact CG-CZ 3.58Å; Y222-F277 HydrophobicContact CG-CZ 3.58Å; Y222-E278 HydrophobicContact CE1-CG 4.34Å; Y222-E278 WeakPolarHBondContact CE1-OE1 3.27Å; Y222-E278 VanDerWaalsContact CZ-OE1 3.31Å; Y222-E278 PolarHBondContact OH-OE1 2.86Å
223	P	81.7	Confident	82.3	Confident	87 Å²	87	66.9 Å²	66.9	57%	0.565	39%	0.385	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-64.5	146.9	-179.4	26.8	-34.4	0	0	0	112.2	P225 R230	P223-P225 WeakPolarHBondContact O-CD 3.48Å; P223-R230 CarbonylContact C-O 3.6Å; P223-R230 WeakPolarHBondContact CA-O 3.28Å
224	D	78.4	Confident	82.2	Confident	42 Å²	42	64.1 Å²	64.1	23%	0.225	37%	0.373	C	S	.	.	P	Polyproline II helix	trans	-81.8	116.4	170.2	179	10	0	0	0	109.9	K226 C227 R230 R232	D224-K226 PolarHBondContact O-N 3.32Å; D224-K226 WeakPolarHBondContact OD1-CB 3.31Å; D224-K226 PolarHBondContact OD1-N 3.04Å; D224-C227 HydrophobicContact CB-CB 4.5Å; D224-C227 CarbonylContact O-C 3.45Å; D224-C227 PolarHBondContact O-N 3.47Å; D224-R230 PolarHBondContact N-O 2.86Å; D224-R232 HydrophobicContact CB-CG 3.9Å
225	P	69.9	Low	82.2	Confident	111 Å²	111	63 Å²	63	72%	0.721	36%	0.362	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.8	-15.7	177.1	26.1	-35.6	0	0	0	113.6	P223	P223-P225 WeakPolarHBondContact O-CD 3.48Å
226	K	70.4	Confident	82.2	Confident	183 Å²	183	58 Å²	58	80%	0.796	34%	0.339	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.6	-16.9	175.7	-59.5	177.5	-179.9	177.8	0	114	D224	D224-K226 PolarHBondContact O-N 3.32Å; D224-K226 WeakPolarHBondContact OD1-CB 3.31Å; D224-K226 PolarHBondContact OD1-N 3.04Å
227	C	66.8	Low	82.1	Confident	56 Å²	56	57.2 Å²	57.2	38%	0.378	34%	0.335	S	S	.	.	S	Bend	trans	-146	86.1	-171.7	-85.7	0	0	0	0	111	D224 G229 R230	D224-C227 HydrophobicContact CB-CB 4.5Å; D224-C227 CarbonylContact O-C 3.45Å; D224-C227 PolarHBondContact O-N 3.47Å; C227-G229 PolarHBondContact O-N 2.85Å; C227-R230 HydrophobicContact CB-CB 4.11Å; C227-R230 PolarHBondContact O-N 3.37Å
228	S	65.7	Low	82.1	Confident	135 Å²	135	53.5 Å²	53.5	94%	0.944	32%	0.315	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.9	124.5	174.3	-172.6	0	0	0	0	111.3
229	G	68.8	Low	82.3	Confident	75 Å²	75	51.1 Å²	51.1	77%	0.773	30%	0.298	S	S	*	.	T	Hydrogen-bonded Turn	trans	91.7	2.1	-174	0	0	0	0	0	115.5	C227	C227-G229 PolarHBondContact O-N 2.85Å
230	R	76.2	Confident	82.4	Confident	127 Å²	127	55.9 Å²	55.9	48%	0.479	32%	0.319	S	S	.	.			trans	-119.2	153.6	168.1	-70.4	-177.1	168.5	-178.9	-5.5	111	P223 D224 C227	P223-R230 CarbonylContact C-O 3.6Å; P223-R230 WeakPolarHBondContact CA-O 3.28Å; D224-R230 PolarHBondContact N-O 2.86Å; C227-R230 HydrophobicContact CB-CB 4.11Å; C227-R230 PolarHBondContact O-N 3.37Å
231	H	83.5	Confident	82.6	Confident	26 Å²	26	55.1 Å²	55.1	12%	0.12	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103	156.9	174.2	55.7	-77.5	0	0	0	110.8	H198 P199 L201 L221 Y222 G233	H198-H231 PolarHBondContact O-NE2 2.87Å; P199-H231 WeakPolarHBondContact CA-NE2 3.15Å; L201-H231 VanDerWaalsContact C-NE2 3.32Å; L201-H231 PolarHBondContact N-NE2 2.9Å; L201-H231 VanDerWaalsContact N-NE2 3.19Å; L201-H231 PolarHBondContact O-CE1 2.92Å; L201-H231 PolarHBondContact O-ND1 2.82Å; L201-H231 PolarHBondContact O-NE2 3.44Å; L221-H231 HydrophobicContact CB-CB 4.15Å; Y222-H231 CarbonylContact O-C 3.45Å; Y222-H231 WeakPolarHBondContact O-CA 3.43Å; Y222-H231 VanDerWaalsContact O-CB 3.27Å; Y222-H231 WeakPolarHBondContact O-CB 3.39Å; H231-G233 PolarHBondContact CD2-N 3.07Å; H231-G233 PolarHBondContact O-N 2.91Å
232	R	82.1	Confident	82.7	Confident	77 Å²	77	57.6 Å²	57.6	29%	0.291	32%	0.324	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.6	16.6	178.5	-60.8	-179.7	74.6	-161.4	1.7	113.4	E142 Y222 D224 F234 F277	E142-R232 IonicContact OE1-CZ 3.24Å; E142-R232 IonicContact OE1-NH1 2.9Å; E142-R232 PolarHBondContact OE1-NH1 3.49Å; E142-R232 IonicContact OE1-NH2 2.71Å; E142-R232 PolarHBondContact OE1-NH2 3.22Å; E142-R232 IonicContact OE2-CZ 3.2Å; E142-R232 IonicContact OE2-NH1 2.66Å; E142-R232 PolarHBondContact OE2-NH1 3.33Å; E142-R232 IonicContact OE2-NH2 2.69Å; Y222-R232 PolarHBondContact O-N 3.29Å; D224-R232 HydrophobicContact CB-CG 3.9Å; R232-F234 VanDerWaalsContact C-N 3.3Å; R232-F234 HydrophobicContact CB-CD1 3.67Å; R232-F234 HydrophobicContact CB-CE1 3.45Å; R232-F234 VanDerWaalsContact CB-CE1 3.45Å; R232-F234 HydrophobicContact CG-CE1 4.26Å; R232-F234 WeakPolarHBondContact O-CD1 3.44Å; R232-F234 PolarHBondContact O-N 3.09Å; R232-F277 VanDerWaalsContact NH1-CD1 3.31Å
233	G	86.5	Confident	83.1	Confident	14 Å²	14	63.6 Å²	63.6	14%	0.144	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	74.4	6.8	-176	0	0	0	0	0	115.7	A195 S196 V197 H231	A195-G233 CarbonylContact C-O 3.32Å; A195-G233 VanDerWaalsContact CA-O 3.28Å; A195-G233 WeakPolarHBondContact CA-O 3.42Å; S196-G233 PolarHBondContact N-O 3.09Å; V197-G233 PolarHBondContact N-O 2.89Å; V197-G233 WeakPolarHBondContact O-CA 3.17Å; H231-G233 PolarHBondContact CD2-N 3.07Å; H231-G233 PolarHBondContact O-N 2.91Å
234	F	90.5	Very high	83.6	Confident	1 Å²	1	59.9 Å²	59.9	0%	0.004	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.6	163.2	-178.5	77	-88.7	0	0	0	114.3	P118 V143 Y193 I194 A195 Y222 R232 L275 F277	P118-F234 HydrophobicContact CB-CE1 3.95Å; P118-F234 HydrophobicContact CB-CZ 4.46Å; P118-F234 HydrophobicContact CG-CD1 4.05Å; P118-F234 HydrophobicContact CG-CE1 3.49Å; P118-F234 VanDerWaalsContact CG-CE1 3.49Å; P118-F234 HydrophobicContact CG-CE2 4.32Å; P118-F234 HydrophobicContact CG-CZ 3.65Å; V143-F234 HydrophobicContact CG2-CE2 4.3Å; Y193-F234 HydrophobicContact CE2-CB 4.21Å; Y193-F234 AromaticContact CE2-CD2 3.87Å; Y193-F234 HydrophobicContact CE2-CD2 3.87Å; Y193-F234 HydrophobicContact CE2-CG 4.43Å; I194-F234 CarbonylContact O-C 3.57Å; I194-F234 WeakPolarHBondContact O-CA 3.48Å; I194-F234 WeakPolarHBondContact O-CB 3.2Å; A195-F234 HydrophobicContact CB-CB 4.1Å; Y222-F234 AromaticContact CD2-CD2 3.83Å; Y222-F234 HydrophobicContact CD2-CD2 3.83Å; Y222-F234 AromaticContact CD2-CE2 3.37Å; Y222-F234 HydrophobicContact CD2-CE2 3.37Å; Y222-F234 HydrophobicContact CD2-CZ 4.12Å; Y222-F234 HydrophobicContact CE2-CE2 4.04Å; Y222-F234 HydrophobicContact CG-CE2 4.11Å; Y222-F234 HydrophobicContact CG-CZ 4.44Å; Y222-F234 PolarHBondContact N-O 3.47Å; R232-F234 VanDerWaalsContact C-N 3.3Å; R232-F234 HydrophobicContact CB-CD1 3.67Å; R232-F234 HydrophobicContact CB-CE1 3.45Å; R232-F234 VanDerWaalsContact CB-CE1 3.45Å; R232-F234 HydrophobicContact CG-CE1 4.26Å; R232-F234 WeakPolarHBondContact O-CD1 3.44Å; R232-F234 PolarHBondContact O-N 3.09Å; F234-L275 HydrophobicContact CE2-CD1 4.2Å; F234-F277 HydrophobicContact CE2-CE1 4.35Å; F234-F277 AromaticContact CZ-CE1 3.87Å; F234-F277 HydrophobicContact CZ-CE1 3.87Å; F234-F277 HydrophobicContact CZ-CZ 4.3Å
235	G	90.9	Very high	84.2	Confident	0 Å²	0	58.1 Å²	58.1	0%	0	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-178.6	-164.3	179.7	0	0	0	0	0	113.9	Y193 I194 S220	Y193-G235 VanDerWaalsContact CD2-O 3.31Å; Y193-G235 WeakPolarHBondContact CD2-O 3.48Å; I194-G235 PolarHBondContact N-O 2.89Å; I194-G235 PolarHBondContact O-N 2.59Å; S220-G235 CarbonylContact O-C 3.56Å; S220-G235 WeakPolarHBondContact O-CA 3.33Å
236	Y	92	Very high	85.3	Confident	4 Å²	4	55.4 Å²	55.4	2%	0.016	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.5	145.8	176.6	-64.6	-79.8	0	0	0	111.9	R191 V192 Y193 S220 Y222 A267 T269 L275	R191-Y236 HydrophobicContact CG-CD1 4.13Å; V192-Y236 CarbonylContact O-C 3.6Å; V192-Y236 VanDerWaalsContact O-CA 3.31Å; V192-Y236 WeakPolarHBondContact O-CA 3.45Å; Y193-Y236 HydrophobicContact CD2-CD1 4.05Å; Y193-Y236 AromaticContact CD2-CE1 3.66Å; Y193-Y236 HydrophobicContact CD2-CE1 3.66Å; Y193-Y236 HydrophobicContact CG-CE1 4.35Å; S220-Y236 PolarHBondContact N-O 3.34Å; S220-Y236 PolarHBondContact O-N 3.25Å; Y222-Y236 AromaticContact CE2-CD2 3.83Å; Y222-Y236 HydrophobicContact CE2-CD2 3.83Å; Y222-Y236 AromaticContact CE2-CE2 3.81Å; Y222-Y236 HydrophobicContact CE2-CE2 3.81Å; Y236-A267 HydrophobicContact CD1-CB 4.31Å; Y236-A267 HydrophobicContact CE1-CB 4.23Å; Y236-T269 WeakPolarHBondContact OH-CB 3.38Å; Y236-T269 PolarHBondContact OH-OG1 2.84Å; Y236-L275 HydrophobicContact CE2-CD1 4.17Å
237	I	92	Very high	86.4	Confident	0 Å²	0	48.6 Å²	48.6	0%	0	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124	126.3	175.3	-52.2	176.4	0	0	0	108	R191 V192 I194 I206 F210 V216 F239	R191-I237 CarbonylContact C-O 3.54Å; R191-I237 WeakPolarHBondContact CA-O 3.48Å; V192-I237 HydrophobicContact CB-CB 4.44Å; V192-I237 PolarHBondContact N-O 3.05Å; V192-I237 PolarHBondContact O-N 2.89Å; I194-I237 HydrophobicContact CB-CD1 4.49Å; I194-I237 HydrophobicContact CD1-CD1 4.24Å; I194-I237 HydrophobicContact CG2-CD1 4.3Å; I194-I237 HydrophobicContact CG2-CG1 4.25Å; I206-I237 HydrophobicContact CG2-CD1 3.62Å; I206-I237 HydrophobicContact CG2-CG1 4.38Å; F210-I237 HydrophobicContact CB-CD1 4.13Å; F210-I237 HydrophobicContact CD1-CD1 3.76Å; F210-I237 HydrophobicContact CD2-CD1 3.62Å; F210-I237 HydrophobicContact CE1-CD1 4Å; F210-I237 HydrophobicContact CE2-CD1 3.88Å; F210-I237 HydrophobicContact CG-CD1 3.55Å; F210-I237 HydrophobicContact CZ-CD1 4.06Å; V216-I237 HydrophobicContact CG1-CG2 3.82Å; V216-I237 HydrophobicContact CG2-CG2 3.96Å; I237-F239 HydrophobicContact CB-CE2 4.43Å; I237-F239 HydrophobicContact CG2-CD2 4.36Å; I237-F239 HydrophobicContact CG2-CE2 3.82Å; I237-F239 HydrophobicContact CG2-CZ 4.1Å
238	D	91	Very high	87.7	Confident	13 Å²	13	45.9 Å²	45.9	7%	0.07	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	124.4	176.6	-67.6	-54.1	0	0	0	110.5	R191 V216 N217 S218 K271	R191-D238 WeakPolarHBondContact CB-OD1 3.41Å; R191-D238 WeakPolarHBondContact CG-OD1 3.47Å; R191-D238 IonicContact NE-OD1 2.68Å; V216-D238 CarbonylContact C-O 3.56Å; V216-D238 WeakPolarHBondContact CA-O 3.36Å; N217-D238 HydrophobicContact CB-CB 4.3Å; N217-D238 PolarHBondContact N-O 2.7Å; S218-D238 PolarHBondContact N-O 3.21Å; S218-D238 PolarHBondContact O-N 3.44Å; S218-D238 WeakPolarHBondContact OG-CB 3.4Å; S218-D238 PolarHBondContact OG-OD2 3.16Å; D238-K271 VanDerWaalsContact CG-CE 3.49Å; D238-K271 WeakPolarHBondContact OD1-CE 3.36Å; D238-K271 IonicContact OD1-NZ 3.03Å; D238-K271 PolarHBondContact OD1-NZ 2.68Å; D238-K271 WeakPolarHBondContact OD2-CE 3.47Å; D238-K271 IonicContact OD2-NZ 2.76Å; D238-K271 PolarHBondContact OD2-NZ 2.68Å
239	F	92.5	Very high	89	Confident	3 Å²	3	40.7 Å²	40.7	1%	0.013	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94	167.4	174.3	-72.7	-86	0	0	0	112.7	P190 V192 F210 F213 G214 V216 N217 I237 S241 A244 A245 A248	P190-F239 PolarHBondContact O-N 3.3Å; V192-F239 HydrophobicContact CB-CE2 4.29Å; V192-F239 HydrophobicContact CG2-CD2 3.94Å; V192-F239 HydrophobicContact CG2-CE2 3.74Å; F210-F239 HydrophobicContact CB-CZ 4.08Å; F210-F239 HydrophobicContact CD1-CZ 4.04Å; F213-F239 HydrophobicContact CB-CE1 4.49Å; G214-F239 WeakPolarHBondContact O-CE1 3.27Å; V216-F239 HydrophobicContact CG2-CD1 4.26Å; V216-F239 HydrophobicContact CG2-CE1 3.86Å; V216-F239 HydrophobicContact CG2-CZ 4.31Å; N217-F239 PolarHBondContact ND2-O 3.47Å; I237-F239 HydrophobicContact CB-CE2 4.43Å; I237-F239 HydrophobicContact CG2-CD2 4.36Å; I237-F239 HydrophobicContact CG2-CE2 3.82Å; I237-F239 HydrophobicContact CG2-CZ 4.1Å; F239-S241 WeakPolarHBondContact CB-O 3.47Å; F239-A244 HydrophobicContact CB-CB 4.24Å; F239-A244 HydrophobicContact CD1-CB 3.65Å; F239-A244 HydrophobicContact CE1-CB 4.25Å; F239-A244 HydrophobicContact CG-CB 4.05Å; F239-A245 HydrophobicContact CB-CB 4.49Å; F239-A245 HydrophobicContact CD2-CB 3.87Å; F239-A245 HydrophobicContact CG-CB 4.42Å; F239-A248 HydrophobicContact CE2-CB 4.09Å; F239-A248 HydrophobicContact CZ-CB 3.86Å
240	E	91.2	Very high	90.1	Very high	118 Å²	118	41.6 Å²	41.6	55%	0.551	22%	0.216	S	C	*	.	S	Bend	trans	-80.6	-22.4	165.9	-172.9	163.9	-109.1	0	0	112.9	K215 N217	K215-E240 HydrophobicContact CB-CB 4.33Å; K215-E240 HydrophobicContact CD-CB 4.14Å; K215-E240 HydrophobicContact CD-CG 4.45Å; K215-E240 WeakPolarHBondContact CD-OE2 3.31Å; K215-E240 IonicContact NZ-OE1 3.25Å; K215-E240 PolarHBondContact NZ-OE1 3.5Å; K215-E240 IonicContact NZ-OE2 2.84Å; K215-E240 PolarHBondContact NZ-OE2 2.87Å; K215-E240 PolarHBondContact O-N 3.11Å; N217-E240 WeakPolarHBondContact ND2-CA 3.46Å; N217-E240 PolarHBondContact ND2-N 2.83Å
241	S	91.4	Very high	90.9	Very high	42 Å²	42	38.7 Å²	38.7	29%	0.294	22%	0.215	S	C	.	.			trans	-128.1	141.6	178	179.7	0	0	0	0	112.6	F239 E243 A244 A245	F239-S241 WeakPolarHBondContact CB-O 3.47Å; S241-E243 PolarHBondContact O-N 2.9Å; S241-E243 WeakPolarHBondContact OG-CB 3.45Å; S241-E243 PolarHBondContact OG-N 2.84Å; S241-E243 VanDerWaalsContact OG-N 3.09Å; S241-E243 PolarHBondContact OG-OE2 2.88Å; S241-A244 PolarHBondContact O-N 3.4Å; S241-A245 PolarHBondContact O-N 2.79Å
242	E	90.3	Very high	91.3	Very high	67 Å²	67	37.8 Å²	37.8	31%	0.313	21%	0.211	S	C	.	.	H	α-helix	trans	-59.5	-32.8	167.8	176.8	174.9	-167.6	0	0	111.3	K189 A245 I246	K189-E242 HydrophobicContact CB-CG 4.14Å; K189-E242 WeakPolarHBondContact CD-OE1 3.36Å; K189-E242 WeakPolarHBondContact CD-OE2 3.37Å; K189-E242 VanDerWaalsContact NZ-CD 3.28Å; K189-E242 IonicContact NZ-OE1 2.96Å; K189-E242 PolarHBondContact NZ-OE1 2.75Å; K189-E242 IonicContact NZ-OE2 3.84Å; K189-E242 PolarHBondContact NZ-OE2 3.15Å; E242-A245 PolarHBondContact O-N 3.05Å; E242-I246 HydrophobicContact CG-CD1 3.81Å; E242-I246 HydrophobicContact CG-CG1 4.39Å; E242-I246 VanDerWaalsContact O-CG1 3.3Å; E242-I246 WeakPolarHBondContact O-CG1 3.31Å; E242-I246 PolarHBondContact O-N 2.92Å
243	E	92.7	Very high	91.7	Very high	155 Å²	155	36.5 Å²	36.5	72%	0.724	21%	0.21	S	C	*	.	H	α-helix	trans	-65.8	-42.1	179.9	-57.6	168.7	145.2	0	0	111.4	S241 I246 A247	S241-E243 PolarHBondContact O-N 2.9Å; S241-E243 WeakPolarHBondContact OG-CB 3.45Å; S241-E243 PolarHBondContact OG-N 2.84Å; S241-E243 VanDerWaalsContact OG-N 3.09Å; S241-E243 PolarHBondContact OG-OE2 2.88Å; E243-I246 PolarHBondContact O-N 3.5Å; E243-A247 WeakPolarHBondContact O-CB 3.47Å; E243-A247 PolarHBondContact O-N 3.1Å
244	A	92.9	Very high	91.9	Very high	9 Å²	9	38.7 Å²	38.7	7%	0.074	22%	0.223	C	C	.	.	H	α-helix	trans	-64.5	-42.1	175.5	0	0	0	0	0	111.3	F213 F239 S241 A247 A248	F213-A244 VanDerWaalsContact O-CB 3.29Å; F213-A244 WeakPolarHBondContact O-CB 3.21Å; F239-A244 HydrophobicContact CB-CB 4.24Å; F239-A244 HydrophobicContact CD1-CB 3.65Å; F239-A244 HydrophobicContact CE1-CB 4.25Å; F239-A244 HydrophobicContact CG-CB 4.05Å; S241-A244 PolarHBondContact O-N 3.4Å; A244-A247 PolarHBondContact O-N 3.02Å; A244-A248 VanDerWaalsContact O-CB 3.25Å; A244-A248 WeakPolarHBondContact O-CB 3.35Å; A244-A248 PolarHBondContact O-N 3.45Å
245	A	92	Very high	92	Very high	4 Å²	4	43.1 Å²	43.1	3%	0.033	24%	0.242	C	C	.	.	H	α-helix	trans	-61.4	-43.4	174.6	0	0	0	0	0	112.2	V192 F239 S241 E242 V249	V192-A245 HydrophobicContact CG2-CB 3.62Å; F239-A245 HydrophobicContact CB-CB 4.49Å; F239-A245 HydrophobicContact CD2-CB 3.87Å; F239-A245 HydrophobicContact CG-CB 4.42Å; S241-A245 PolarHBondContact O-N 2.79Å; E242-A245 PolarHBondContact O-N 3.05Å; A245-V249 WeakPolarHBondContact O-CB 3.36Å; A245-V249 VanDerWaalsContact O-CG2 3.28Å; A245-V249 WeakPolarHBondContact O-CG2 3.09Å; A245-V249 PolarHBondContact O-N 2.85Å
246	I	92.4	Very high	92.1	Very high	55 Å²	55	47.7 Å²	47.7	28%	0.282	27%	0.267	S	S	.	.	H	α-helix	trans	-66.6	-42.7	177	-68.4	170.2	0	0	0	111.3	E242 E243 S250	E242-I246 HydrophobicContact CG-CD1 3.81Å; E242-I246 HydrophobicContact CG-CG1 4.39Å; E242-I246 VanDerWaalsContact O-CG1 3.3Å; E242-I246 WeakPolarHBondContact O-CG1 3.31Å; E242-I246 PolarHBondContact O-N 2.92Å; E243-I246 PolarHBondContact O-N 3.5Å; I246-S250 WeakPolarHBondContact O-CB 3.35Å; I246-S250 PolarHBondContact O-N 3.37Å; I246-S250 PolarHBondContact O-OG 3.01Å
247	A	94	Very high	92	Very high	39 Å²	39	49.1 Å²	49.1	32%	0.322	27%	0.274	S	S	.	.	H	α-helix	trans	-63	-43.8	176.6	0	0	0	0	0	111.9	F213 E243 A244 S250 S251	F213-A247 HydrophobicContact CD1-CB 4.29Å; E243-A247 WeakPolarHBondContact O-CB 3.47Å; E243-A247 PolarHBondContact O-N 3.1Å; A244-A247 PolarHBondContact O-N 3.02Å; A247-S250 PolarHBondContact O-N 3.25Å; A247-S251 VanDerWaalsContact O-CB 3.29Å; A247-S251 WeakPolarHBondContact O-CB 3.42Å; A247-S251 PolarHBondContact O-N 2.71Å; A247-S251 PolarHBondContact O-OG 3.31Å
248	A	93.4	Very high	91.7	Very high	0 Å²	0	52 Å²	52	0%	0	30%	0.298	C	S	.	.	H	α-helix	trans	-62.5	-49.3	176.3	0	0	0	0	0	111.9	F210 F213 F239 A244 S250 S251 M252	F210-A248 HydrophobicContact CD1-CB 3.94Å; F210-A248 HydrophobicContact CE1-CB 4.12Å; F213-A248 HydrophobicContact CB-CB 4.09Å; F213-A248 HydrophobicContact CD2-CB 4.17Å; F213-A248 HydrophobicContact CG-CB 4Å; F239-A248 HydrophobicContact CE2-CB 4.09Å; F239-A248 HydrophobicContact CZ-CB 3.86Å; A244-A248 VanDerWaalsContact O-CB 3.25Å; A244-A248 WeakPolarHBondContact O-CB 3.35Å; A244-A248 PolarHBondContact O-N 3.45Å; A248-S250 VanDerWaalsContact C-N 3.26Å; A248-S250 PolarHBondContact O-N 2.73Å; A248-S251 PolarHBondContact O-N 2.96Å; A248-M252 VanDerWaalsContact O-CB 3.29Å; A248-M252 WeakPolarHBondContact O-CB 3.25Å; A248-M252 PolarHBondContact O-N 2.85Å
249	V	92.7	Very high	91.6	Very high	25 Å²	25	54.2 Å²	54.2	15%	0.152	32%	0.324	C	S	.	.	H	α-helix	trans	-57.6	-40.2	175.7	169.3	0	0	0	0	111.7	V192 A245 N253 V264 R266	V192-V249 HydrophobicContact CG1-CG2 3.91Å; V192-V249 HydrophobicContact CG2-CG2 3.93Å; A245-V249 WeakPolarHBondContact O-CB 3.36Å; A245-V249 VanDerWaalsContact O-CG2 3.28Å; A245-V249 WeakPolarHBondContact O-CG2 3.09Å; A245-V249 PolarHBondContact O-N 2.85Å; V249-N253 VanDerWaalsContact O-CB 3.32Å; V249-N253 WeakPolarHBondContact O-CB 3.28Å; V249-V264 HydrophobicContact CG2-CG1 4.12Å; V249-R266 HydrophobicContact CG2-CG 4.37Å
250	S	92	Very high	91.4	Very high	94 Å²	94	57.2 Å²	57.2	66%	0.657	34%	0.338	S	S	*	.	H	α-helix	trans	-74.7	-23.9	-178	-52.2	0	0	0	0	113.8	I246 A247 A248	I246-S250 WeakPolarHBondContact O-CB 3.35Å; I246-S250 PolarHBondContact O-N 3.37Å; I246-S250 PolarHBondContact O-OG 3.01Å; A247-S250 PolarHBondContact O-N 3.25Å; A248-S250 VanDerWaalsContact C-N 3.26Å; A248-S250 PolarHBondContact O-N 2.73Å
251	S	92.6	Very high	91.5	Very high	66 Å²	66	56 Å²	56	46%	0.462	33%	0.332	S	S	.	.	H	α-helix	trans	-109.8	-30.1	-171.4	-47.9	0	0	0	0	114	F213 A247 A248	F213-S251 VanDerWaalsContact CE1-CB 3.41Å; A247-S251 VanDerWaalsContact O-CB 3.29Å; A247-S251 WeakPolarHBondContact O-CB 3.42Å; A247-S251 PolarHBondContact O-N 2.71Å; A247-S251 PolarHBondContact O-OG 3.31Å; A248-S251 PolarHBondContact O-N 2.96Å
252	M	92.1	Very high	91.5	Very high	7 Å²	7	54 Å²	54	3%	0.034	32%	0.318	C	S	.	.	H	α-helix	trans	-98.4	-13.2	-176.1	-64.8	-59.5	-60.9	0	0	113.5	V209 F210 F213 A248 C254 F255 L262 V264	V209-M252 HydrophobicContact CG1-CE 3.47Å; V209-M252 VanDerWaalsContact CG1-CE 3.47Å; V209-M252 HydrophobicContact CG1-SD 4.43Å; F210-M252 HydrophobicContact CD1-CG 4.32Å; F210-M252 HydrophobicContact CE1-CB 3.8Å; F210-M252 HydrophobicContact CE1-CG 3.75Å; F210-M252 HydrophobicContact CE2-CE 4.22Å; F210-M252 HydrophobicContact CZ-CB 3.74Å; F210-M252 HydrophobicContact CZ-CE 4.28Å; F210-M252 HydrophobicContact CZ-CG 3.9Å; F213-M252 HydrophobicContact CD2-CG 4.21Å; F213-M252 HydrophobicContact CE2-CG 3.35Å; F213-M252 HydrophobicContact CE2-SD 3.49Å; F213-M252 WeakPolarHBondContact CE2-SD 3.38Å; F213-M252 HydrophobicContact CZ-CG 3.6Å; F213-M252 HydrophobicContact CZ-SD 3.6Å; A248-M252 VanDerWaalsContact O-CB 3.29Å; A248-M252 WeakPolarHBondContact O-CB 3.25Å; A248-M252 PolarHBondContact O-N 2.85Å; M252-C254 PolarHBondContact O-N 2.79Å; M252-F255 HydrophobicContact CE-CB 3.94Å; M252-F255 HydrophobicContact CE-CD1 3.56Å; M252-F255 HydrophobicContact CE-CD2 4.26Å; M252-F255 HydrophobicContact CE-CE1 4.12Å; M252-F255 HydrophobicContact CE-CG 3.65Å; M252-F255 WeakPolarHBondContact O-CB 3.42Å; M252-F255 PolarHBondContact O-N 3.08Å; M252-F255 VanDerWaalsContact O-N 3.1Å; M252-F255 HydrophobicContact SD-CB 4.35Å; M252-F255 HydrophobicContact SD-CD2 4.19Å; M252-F255 HydrophobicContact SD-CG 4.1Å; M252-L262 HydrophobicContact CE-CD1 3.86Å; M252-V264 HydrophobicContact CB-CG2 3.88Å; M252-V264 WeakPolarHBondContact O-CG2 3.5Å
253	N	91.2	Very high	91.7	Very high	51 Å²	51	52.3 Å²	52.3	27%	0.273	31%	0.309	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.9	130.5	172.7	-171.9	41.5	0	0	0	110	Q153 V249 F255 V264	Q153-N253 PolarHBondContact NE2-ND2 3.17Å; Q153-N253 PolarHBondContact NE2-OD1 3.16Å; V249-N253 VanDerWaalsContact O-CB 3.32Å; V249-N253 WeakPolarHBondContact O-CB 3.28Å; N253-F255 PolarHBondContact O-N 3.3Å; N253-V264 HydrophobicContact CB-CB 4.12Å; N253-V264 PolarHBondContact OD1-N 2.84Å; N253-V264 VanDerWaalsContact OD1-N 3.11Å
254	C	89.9	Confident	91.7	Very high	59 Å²	59	44.9 Å²	44.9	40%	0.399	27%	0.274	S	S	.	.	T	Hydrogen-bonded Turn	trans	67	9.9	-169.8	-50.9	0	0	0	0	115.7	Q153 M252 L262 R263	Q153-C254 PolarHBondContact OE1-SG 2.87Å; M252-C254 PolarHBondContact O-N 2.79Å; C254-L262 WeakPolarHBondContact CA-O 3.26Å; C254-L262 PolarHBondContact N-O 3.35Å; C254-R263 PolarHBondContact SG-NH1 3.48Å
255	F	92.5	Very high	91.6	Very high	94 Å²	94	44.8 Å²	44.8	41%	0.412	27%	0.274	S	S	.	.			trans	-70.5	128.5	175.9	-176.2	-86.1	0	0	0	111.1	M252 N253 L257 Q261 L262	M252-F255 HydrophobicContact CE-CB 3.94Å; M252-F255 HydrophobicContact CE-CD1 3.56Å; M252-F255 HydrophobicContact CE-CD2 4.26Å; M252-F255 HydrophobicContact CE-CE1 4.12Å; M252-F255 HydrophobicContact CE-CG 3.65Å; M252-F255 WeakPolarHBondContact O-CB 3.42Å; M252-F255 PolarHBondContact O-N 3.08Å; M252-F255 VanDerWaalsContact O-N 3.1Å; M252-F255 HydrophobicContact SD-CB 4.35Å; M252-F255 HydrophobicContact SD-CD2 4.19Å; M252-F255 HydrophobicContact SD-CG 4.1Å; N253-F255 PolarHBondContact O-N 3.3Å; F255-L257 HydrophobicContact CD1-CB 4.2Å; F255-L257 HydrophobicContact CE1-CB 4.26Å; F255-L257 HydrophobicContact CE1-CD1 4.34Å; F255-L257 PolarHBondContact O-N 3.4Å; F255-Q261 CarbonylContact O-C 3.57Å; F255-Q261 WeakPolarHBondContact O-CA 3.41Å; F255-L262 HydrophobicContact CD1-CD1 4.45Å; F255-L262 PolarHBondContact O-N 3.12Å
256	D	92.9	Very high	91.4	Very high	97 Å²	97	50.2 Å²	50.2	52%	0.519	29%	0.293	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.8	116.8	179.6	-172.3	53	0	0	0	111.5	G259 Q260	D256-G259 VanDerWaalsContact OD1-CA 3.26Å; D256-G259 WeakPolarHBondContact OD1-CA 3.32Å; D256-Q260 PolarHBondContact OD1-N 3Å; D256-Q260 VanDerWaalsContact OD1-N 3.11Å
257	L	89.6	Confident	91.1	Very high	34 Å²	34	47.7 Å²	47.7	18%	0.178	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	122	177.9	-171.9	63.4	0	0	0	109.2	L201 I206 V209 F255 G259 Q260 L262	L201-L257 HydrophobicContact CD1-CD2 3.67Å; L201-L257 HydrophobicContact CD1-CG 3.79Å; I206-L257 HydrophobicContact CD1-CD2 3.9Å; V209-L257 HydrophobicContact CG2-CD2 4.32Å; F255-L257 HydrophobicContact CD1-CB 4.2Å; F255-L257 HydrophobicContact CE1-CB 4.26Å; F255-L257 HydrophobicContact CE1-CD1 4.34Å; F255-L257 PolarHBondContact O-N 3.4Å; L257-G259 PolarHBondContact O-N 2.84Å; L257-Q260 PolarHBondContact N-O 3.19Å; L257-Q260 PolarHBondContact O-N 2.9Å; L257-Q260 VanDerWaalsContact O-N 3.14Å; L257-L262 HydrophobicContact CB-CD1 4.11Å; L257-L262 HydrophobicContact CB-CG 4.15Å; L257-L262 HydrophobicContact CD2-CD1 3.97Å
258	A	87.3	Confident	90.5	Very high	61 Å²	61	45.9 Å²	45.9	50%	0.504	27%	0.266	S	S	.	.	T	Hydrogen-bonded Turn	trans	53.3	30.8	-171.8	0	0	0	0	0	114.5	H198 L201	H198-A258 HydrophobicContact CB-CB 3.88Å; L201-A258 HydrophobicContact CD1-CB 4.43Å
259	G	88.3	Confident	89.6	Confident	58 Å²	58	46.1 Å²	46.1	60%	0.598	27%	0.267	S	S	*	.	T	Hydrogen-bonded Turn	trans	78	16.1	-179.5	0	0	0	0	0	114.6	D256 L257	D256-G259 VanDerWaalsContact OD1-CA 3.26Å; D256-G259 WeakPolarHBondContact OD1-CA 3.32Å; L257-G259 PolarHBondContact O-N 2.84Å
260	Q	88.4	Confident	88.5	Confident	67 Å²	67	45.8 Å²	45.8	31%	0.313	27%	0.265	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	133.9	167.6	-66.2	-172.7	2.2	0	0	110.8	S196 H198 D256 L257 L262	S196-Q260 PolarHBondContact O-OE1 2.99Å; H198-Q260 HydrophobicContact CB-CG 4.48Å; D256-Q260 PolarHBondContact OD1-N 3Å; D256-Q260 VanDerWaalsContact OD1-N 3.11Å; L257-Q260 PolarHBondContact N-O 3.19Å; L257-Q260 PolarHBondContact O-N 2.9Å; L257-Q260 VanDerWaalsContact O-N 3.14Å; Q260-L262 PolarHBondContact O-N 2.86Å
261	Q	92	Very high	87.2	Confident	91 Å²	91	46.2 Å²	46.2	43%	0.425	26%	0.255	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.1	111.3	174.3	-70.9	-178.9	-0.1	0	0	110.6	S196 F255 R263	S196-Q261 VanDerWaalsContact CB-O 3.27Å; S196-Q261 WeakPolarHBondContact CB-O 3.35Å; S196-Q261 PolarHBondContact OG-O 2.85Å; F255-Q261 CarbonylContact O-C 3.57Å; F255-Q261 WeakPolarHBondContact O-CA 3.41Å; Q261-R263 PolarHBondContact O-N 3.48Å
262	L	93.1	Very high	85.7	Confident	0 Å²	0	46.8 Å²	46.8	0%	0	27%	0.272	C	S	.	.			trans	-58.6	136.9	172.8	-61.5	179.3	0	0	0	110.7	I194 V197 F210 M252 C254 F255 L257 Q260 V264	I194-L262 HydrophobicContact CD1-CD1 4.41Å; I194-L262 HydrophobicContact CD1-CD2 4.29Å; V197-L262 HydrophobicContact CG2-CD2 4.17Å; F210-L262 HydrophobicContact CE2-CD1 4.29Å; M252-L262 HydrophobicContact CE-CD1 3.86Å; C254-L262 WeakPolarHBondContact CA-O 3.26Å; C254-L262 PolarHBondContact N-O 3.35Å; F255-L262 HydrophobicContact CD1-CD1 4.45Å; F255-L262 PolarHBondContact O-N 3.12Å; L257-L262 HydrophobicContact CB-CD1 4.11Å; L257-L262 HydrophobicContact CB-CG 4.15Å; L257-L262 HydrophobicContact CD2-CD1 3.97Å; Q260-L262 PolarHBondContact O-N 2.86Å; L262-V264 HydrophobicContact CB-CG2 4.09Å
263	R	92.8	Very high	84.2	Confident	32 Å²	32	48.8 Å²	48.8	12%	0.121	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	119.2	171.9	-59.4	-61.8	178.2	-135.4	-15.1	107.5	F116 L149 I194 A195 C254 Q261	F116-R263 HydrophobicContact CD1-CG 4.02Å; F116-R263 HydrophobicContact CE1-CG 4.19Å; L149-R263 HydrophobicContact CD1-CB 4.27Å; I194-R263 CarbonylContact C-O 3.56Å; I194-R263 WeakPolarHBondContact CA-O 3.44Å; A195-R263 HydrophobicContact CB-CB 4.17Å; A195-R263 PolarHBondContact N-O 2.85Å; A195-R263 PolarHBondContact O-N 2.98Å; C254-R263 PolarHBondContact SG-NH1 3.48Å; Q261-R263 PolarHBondContact O-N 3.48Å
264	V	93.2	Very high	82.5	Confident	0 Å²	0	50.1 Å²	50.1	0%	0	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.7	126.6	-168.8	-169.8	0	0	0	0	109.7	L149 V192 Y193 I194 F210 V249 M252 N253 L262	L149-V264 WeakPolarHBondContact CD2-O 3.37Å; V192-V264 HydrophobicContact CG1-CG1 3.39Å; Y193-V264 WeakPolarHBondContact O-CA 3.33Å; I194-V264 HydrophobicContact CG1-CG2 4.46Å; F210-V264 HydrophobicContact CE1-CG1 4.07Å; F210-V264 HydrophobicContact CZ-CG1 4.36Å; F210-V264 HydrophobicContact CZ-CG2 4.05Å; V249-V264 HydrophobicContact CG2-CG1 4.12Å; M252-V264 HydrophobicContact CB-CG2 3.88Å; M252-V264 WeakPolarHBondContact O-CG2 3.5Å; N253-V264 HydrophobicContact CB-CB 4.12Å; N253-V264 PolarHBondContact OD1-N 2.84Å; N253-V264 VanDerWaalsContact OD1-N 3.11Å; L262-V264 HydrophobicContact CB-CG2 4.09Å
265	G	91	Very high	81.1	Confident	6 Å²	6	47.6 Å²	47.6	6%	0.062	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.3	168.3	-173.4	0	0	0	0	0	113.5	V192 Y193	V192-G265 CarbonylContact C-O 3.6Å; V192-G265 WeakPolarHBondContact CA-O 3.42Å; V192-G265 WeakPolarHBondContact CG1-O 3.43Å; Y193-G265 PolarHBondContact N-O 3.37Å; Y193-G265 PolarHBondContact O-N 2.93Å
266	R	88.2	Confident	79.3	Confident	118 Å²	118	47 Å²	47	45%	0.445	28%	0.284	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.1	139.5	174.2	-59.1	-175.3	-174	-158.3	1.8	110.1	E145 V249	E145-R266 WeakPolarHBondContact CG-O 3.36Å; V249-R266 HydrophobicContact CG2-CG 4.37Å
267	A	86.5	Confident	77.5	Confident	3 Å²	3	44.2 Å²	44.2	3%	0.025	27%	0.268	C	S	.	.			trans	-73	152	174.2	0	0	0	0	0	112.9	E145 R191 Y236	E145-A267 WeakPolarHBondContact OE1-CA 3.43Å; R191-A267 HydrophobicContact CB-CB 3.75Å; R191-A267 HydrophobicContact CG-CB 3.62Å; R191-A267 VanDerWaalsContact O-CB 3.22Å; R191-A267 WeakPolarHBondContact O-CB 3.37Å; R191-A267 PolarHBondContact O-N 2.69Å; Y236-A267 HydrophobicContact CD1-CB 4.31Å; Y236-A267 HydrophobicContact CE1-CB 4.23Å
268	L	81.2	Confident	75.7	Confident	1 Å²	1	44.8 Å²	44.8	1%	0.005	27%	0.269	C	S	.	.			trans	-126.8	-28.6	173.1	-59.9	176.3	0	0	0	110.5	R85 E145 E179 R183	R85-L268 PolarHBondContact NH2-O 2.87Å; E145-L268 HydrophobicContact CG-CG 4.48Å; E145-L268 PolarHBondContact OE1-N 3.38Å; E179-L268 HydrophobicContact CG-CD1 4.44Å; R183-L268 HydrophobicContact CB-CD2 3.74Å; R183-L268 HydrophobicContact CG-CD2 4.26Å
269	T	74.8	Confident	73.7	Confident	4 Å²	4	48.9 Å²	48.9	3%	0.025	28%	0.282	C	S	.	.	S	Bend	trans	-71.7	119.6	173.5	-55.3	0	0	0	0	109.4	E145 R191 Y236 V273 L275	E145-T269 WeakPolarHBondContact OE1-CB 3.43Å; E145-T269 PolarHBondContact OE1-N 3.18Å; E145-T269 PolarHBondContact OE1-OG1 3.03Å; E145-T269 VanDerWaalsContact OE1-OG1 3.1Å; E145-T269 PolarHBondContact OE2-OG1 2.96Å; E145-T269 VanDerWaalsContact OE2-OG1 3.05Å; R191-T269 PolarHBondContact NH1-O 3.3Å; Y236-T269 WeakPolarHBondContact OH-CB 3.38Å; Y236-T269 PolarHBondContact OH-OG1 2.84Å; T269-V273 HydrophobicContact CG2-CB 4.36Å; T269-L275 HydrophobicContact CG2-CD2 4.27Å
270	P	69.1	Low	71.3	Confident	18 Å²	18	53.3 Å²	53.3	12%	0.117	29%	0.292	C	S	.	.	P	Polyproline II helix	trans	-73.7	165.9	178	33.1	-35.1	0	0	0	110.9	T188 R191 G272 V273	T188-P270 HydrophobicContact CG2-CB 4.35Å; R191-P270 PolarHBondContact NH1-O 2.91Å; R191-P270 VanDerWaalsContact NH1-O 3.15Å; P270-G272 PolarHBondContact O-N 2.83Å; P270-V273 HydrophobicContact CG-CG2 3.71Å
271	K	65.2	Low	69.3	Low	103 Å²	103	52.9 Å²	52.9	45%	0.448	30%	0.3	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.7	125	177.3	-51.1	-170.1	-167	-162.3	0	109.5	D238	D238-K271 VanDerWaalsContact CG-CE 3.49Å; D238-K271 WeakPolarHBondContact OD1-CE 3.36Å; D238-K271 IonicContact OD1-NZ 3.03Å; D238-K271 PolarHBondContact OD1-NZ 2.68Å; D238-K271 WeakPolarHBondContact OD2-CE 3.47Å; D238-K271 IonicContact OD2-NZ 2.76Å; D238-K271 PolarHBondContact OD2-NZ 2.68Å
272	G	59.6	Low	66.8	Low	79 Å²	79	54.8 Å²	54.8	81%	0.814	31%	0.313	S	S	*	.	T	Hydrogen-bonded Turn	trans	100.2	3	178	0	0	0	0	0	116.2	P270 P274	P270-G272 PolarHBondContact O-N 2.83Å; G272-P274 WeakPolarHBondContact O-CD 3.2Å
273	V	60.4	Low	64.4	Low	49 Å²	49	64.7 Å²	64.7	30%	0.297	36%	0.356	S	S	.	.	P	Polyproline II helix	trans	-80.6	117.8	159.2	168.9	0	0	0	0	107.8	T269 P270 L275	T269-V273 HydrophobicContact CG2-CB 4.36Å; P270-V273 HydrophobicContact CG-CG2 3.71Å; V273-L275 PolarHBondContact O-N 3.48Å
274	P	57.4	Low	61.5	Low	78 Å²	78	67.4 Å²	67.4	51%	0.506	38%	0.38	S	S	.	.	P	Polyproline II helix	trans	-66.5	124.4	172.8	-14.8	29.6	0	0	0	108.9	G272 E278	G272-P274 WeakPolarHBondContact O-CD 3.2Å; P274-E278 HydrophobicContact CB-CB 4.2Å
275	L	58.9	Low	58.6	Low	7 Å²	7	75.1 Å²	75.1	4%	0.037	42%	0.42	C	S	.	.	P	Polyproline II helix	trans	-66.1	152.6	168.8	-70.6	178.6	0	0	0	109.7	V143 Y222 F234 Y236 T269 V273 F277 E278	V143-L275 HydrophobicContact CG2-CD1 3.86Å; V143-L275 HydrophobicContact CG2-CD2 4.16Å; Y222-L275 HydrophobicContact CD2-CD1 4.5Å; Y222-L275 HydrophobicContact CE2-CD1 3.74Å; F234-L275 HydrophobicContact CE2-CD1 4.2Å; Y236-L275 HydrophobicContact CE2-CD1 4.17Å; T269-L275 HydrophobicContact CG2-CD2 4.27Å; V273-L275 PolarHBondContact O-N 3.48Å; L275-F277 HydrophobicContact CB-CD1 3.93Å; L275-F277 HydrophobicContact CB-CE1 3.45Å; L275-F277 VanDerWaalsContact CB-CE1 3.45Å; L275-F277 HydrophobicContact CB-CZ 4.14Å; L275-F277 HydrophobicContact CD1-CE1 3.82Å; L275-F277 HydrophobicContact CD1-CZ 4.34Å; L275-F277 HydrophobicContact CG-CE1 4.3Å; L275-F277 PolarHBondContact O-N 2.83Å; L275-E278 PolarHBondContact O-N 3.44Å
276	P	55	Low	55.9	Low	82 Å²	82	82.6 Å²	82.6	53%	0.532	46%	0.459	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.6	-22.4	-167	-30.2	36.6	0	0	0	116.5
277	F	56.3	Low	53	Low	38 Å²	38	83.5 Å²	83.5	17%	0.167	48%	0.478	C	S	.	.	T	Hydrogen-bonded Turn	trans	-82.6	-21.5	176.7	68.9	-90.3	0	0	0	114.4	E142 Y222 R232 F234 L275 L279 N280	E142-F277 WeakPolarHBondContact OE2-CD1 3.32Å; Y222-F277 AromaticContact CD1-CE2 3.74Å; Y222-F277 HydrophobicContact CD1-CE2 3.74Å; Y222-F277 AromaticContact CD1-CZ 3.39Å; Y222-F277 HydrophobicContact CD1-CZ 3.39Å; Y222-F277 HydrophobicContact CD2-CZ 4.06Å; Y222-F277 HydrophobicContact CE1-CE2 4.13Å; Y222-F277 AromaticContact CE1-CZ 3.63Å; Y222-F277 HydrophobicContact CE1-CZ 3.63Å; Y222-F277 HydrophobicContact CE2-CZ 4.27Å; Y222-F277 HydrophobicContact CG-CE2 4.2Å; Y222-F277 AromaticContact CG-CZ 3.58Å; Y222-F277 HydrophobicContact CG-CZ 3.58Å; R232-F277 VanDerWaalsContact NH1-CD1 3.31Å; F234-F277 HydrophobicContact CE2-CE1 4.35Å; F234-F277 AromaticContact CZ-CE1 3.87Å; F234-F277 HydrophobicContact CZ-CE1 3.87Å; F234-F277 HydrophobicContact CZ-CZ 4.3Å; L275-F277 HydrophobicContact CB-CD1 3.93Å; L275-F277 HydrophobicContact CB-CE1 3.45Å; L275-F277 VanDerWaalsContact CB-CE1 3.45Å; L275-F277 HydrophobicContact CB-CZ 4.14Å; L275-F277 HydrophobicContact CD1-CE1 3.82Å; L275-F277 HydrophobicContact CD1-CZ 4.34Å; L275-F277 HydrophobicContact CG-CE1 4.3Å; L275-F277 PolarHBondContact O-N 2.83Å; F277-L279 VanDerWaalsContact C-N 3.26Å; F277-L279 PolarHBondContact O-N 2.93Å; F277-N280 PolarHBondContact O-N 2.88Å
278	E	50.4	Low	50.5	Low	46 Å²	46	91.1 Å²	91.1	22%	0.215	52%	0.516	C	S	.	.	H	α-helix	trans	-65.4	-30	-174.5	-71.7	-170	-146.5	0	0	112.5	Y222 P274 L275 N280 A281	Y222-E278 HydrophobicContact CE1-CG 4.34Å; Y222-E278 WeakPolarHBondContact CE1-OE1 3.27Å; Y222-E278 VanDerWaalsContact CZ-OE1 3.31Å; Y222-E278 PolarHBondContact OH-OE1 2.86Å; P274-E278 HydrophobicContact CB-CB 4.2Å; L275-E278 PolarHBondContact O-N 3.44Å; E278-N280 PolarHBondContact O-N 2.77Å; E278-N280 VanDerWaalsContact O-N 3.08Å; E278-A281 PolarHBondContact O-N 3.14Å; E278-A281 VanDerWaalsContact O-N 3.1Å
279	L	44.6	Very low	48.1	Very low	146 Å²	146	96.7 Å²	96.7	76%	0.764	56%	0.555	S	S	*	*	H	α-helix	trans	-55.9	-23.7	176.8	-80.2	155.4	0	0	0	113.9	F277	F277-L279 VanDerWaalsContact C-N 3.26Å; F277-L279 PolarHBondContact O-N 2.93Å
280	N	39.3	Very low	46.1	Very low	151 Å²	151	102.9 Å²	102.9	81%	0.807	59%	0.593	S	S	*	*	H	α-helix	trans	-101.8	-11.6	179	-81.3	-32.7	0	0	0	114.6	F277 E278	F277-N280 PolarHBondContact O-N 2.88Å; E278-N280 PolarHBondContact O-N 2.77Å; E278-N280 VanDerWaalsContact O-N 3.08Å
281	A	45.9	Very low	44.5	Very low	58 Å²	58	109.1 Å²	109.1	48%	0.479	63%	0.626	S	S	.	*	H	α-helix	trans	-86.5	-39	-174	0	0	0	0	0	113.3	E278 K283	E278-A281 PolarHBondContact O-N 3.14Å; E278-A281 VanDerWaalsContact O-N 3.1Å; A281-K283 VanDerWaalsContact C-N 3.28Å; A281-K283 PolarHBondContact O-N 2.82Å
282	N	39.9	Very low	42.9	Very low	132 Å²	132	109.6 Å²	109.6	71%	0.706	64%	0.639	S	S	*	*			trans	-86.8	25.8	-161.4	-64.4	-22.4	0	0	0	115.1
283	K	41.7	Very low	41.5	Very low	207 Å²	207	113.6 Å²	113.6	90%	0.9	64%	0.64	S	S	*	*	S	Bend	trans	-91.3	7.4	-176.1	-152.8	169.2	-176.7	174.1	0	114.5	A281	A281-K283 VanDerWaalsContact C-N 3.28Å; A281-K283 PolarHBondContact O-N 2.82Å
284	S	32.5	Very low	40.3	Very low	90 Å²	90	114.6 Å²	114.6	63%	0.629	65%	0.65	S	S	*	*	S	Bend	trans	-144.7	131.4	180	53.2	0	0	0	0	112.3
285	L	32.3	Very low	39.3	Very low	162 Å²	162	118.4 Å²	118.4	85%	0.848	67%	0.671	S	S	*	*	S	Bend	trans	62	84.3	179.7	-73.8	75.3	0	0	0	115.9
286	N	33.5	Very low	38.3	Very low	163 Å²	163	120.9 Å²	120.9	87%	0.872	69%	0.689	S	S	*	*				-167.6	147.8	91.9	-109.3	-28.4	0	0	0	113.9
287	T	28.8	Very low	37.6	Very low	136 Å²	136	119.5 Å²	119.5	83%	0.834	69%	0.685	S	S	*	*			trans	-95.5	105.1	176.9	-58.4	0	0	0	0	110.4
288	I	34.4	Very low	37	Very low	163 Å²	163	122.9 Å²	122.9	84%	0.836	71%	0.709	S	S	*	*	S	Bend	trans	-161	143.8	149.8	-100.3	147	0	0	0	108.1	T290	I288-T290 PolarHBondContact O-N 3.05Å
289	S	30.7	Very low	36.6	Very low	118 Å²	118	123.8 Å²	123.8	83%	0.825	72%	0.724	S	S	*	*	S	Bend	trans	-63.6	111.1	-164.6	-49.1	0	0	0	0	115.4
290	T	32.5	Very low	36.4	Very low	135 Å²	135	124.4 Å²	124.4	83%	0.828	72%	0.72	S	S	*	*			trans	-153.5	149.1	137.1	16.3	0	0	0	0	109.1	I288	I288-T290 PolarHBondContact O-N 3.05Å
291	N	34.8	Very low	36.7	Very low	148 Å²	148	119.6 Å²	119.6	79%	0.791	70%	0.702	S	S	*	*			trans	-75.5	151.7	-169.6	-68.5	-14.4	0	0	0	112.3	I293	N291-I293 PolarHBondContact O-N 2.86Å
292	P	31.9	Very low	36.5	Very low	113 Å²	113	119.3 Å²	119.3	73%	0.734	70%	0.7	S	S	*	*			trans	-61.1	134.6	176	26.6	-35.1	0	0	0	110.8	S294	P292-S294 PolarHBondContact O-N 3.43Å
293	I	31	Very low	36.8	Very low	164 Å²	164	115.6 Å²	115.6	84%	0.841	69%	0.687	S	S	*	*			trans	-80.8	73.9	177.2	-52	179	0	0	0	108.7	N291	N291-I293 PolarHBondContact O-N 2.86Å
294	S	34.4	Very low	37.2	Very low	70 Å²	70	109.2 Å²	109.2	49%	0.49	67%	0.668	S	S	.	*			trans	-83.6	164	156.9	55.4	0	0	0	0	110	P292 S296 A297	P292-S294 PolarHBondContact O-N 3.43Å; S294-S296 PolarHBondContact O-N 3.13Å; S294-A297 PolarHBondContact O-N 2.87Å
295	T	36.2	Very low	38	Very low	157 Å²	157	109.2 Å²	109.2	96%	0.963	66%	0.66	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.5	18.9	-167.7	39.8	0	0	0	0	116
296	S	39.2	Very low	38.8	Very low	59 Å²	59	104.6 Å²	104.6	41%	0.413	64%	0.642	S	S	.	*	T	Hydrogen-bonded Turn	trans	-107.5	-0.3	173.5	64.9	0	0	0	0	114.4	S294 V298 A299 F300	S294-S296 PolarHBondContact O-N 3.13Å; S296-V298 PolarHBondContact O-N 3.44Å; S296-A299 WeakPolarHBondContact O-CB 3.28Å; S296-A299 PolarHBondContact O-N 2.74Å; S296-F300 PolarHBondContact O-N 2.89Å
297	A	38.9	Very low	39.5	Very low	53 Å²	53	99.6 Å²	99.6	44%	0.438	62%	0.623	S	S	.	*	H	α-helix	trans	-56.8	-33.3	-178.4	0	0	0	0	0	113.7	S294 F300 A301	S294-A297 PolarHBondContact O-N 2.87Å; A297-F300 PolarHBondContact O-N 2.88Å; A297-A301 WeakPolarHBondContact O-CB 3.26Å; A297-A301 PolarHBondContact O-N 3.3Å
298	V	44.4	Very low	40.4	Very low	110 Å²	110	100.3 Å²	100.3	67%	0.667	62%	0.615	S	S	*	*	H	α-helix	trans	-63.9	-39.9	176.5	-167.3	0	0	0	0	111.4	S296 A302	S296-V298 PolarHBondContact O-N 3.44Å; V298-A302 PolarHBondContact O-N 3.08Å; V298-A302 VanDerWaalsContact O-N 3.07Å
299	A	42.3	Very low	41	Very low	64 Å²	64	96.6 Å²	96.6	53%	0.529	60%	0.6	S	S	.	*	H	α-helix	trans	-69.4	-40.9	177.8	0	0	0	0	0	112.1	S296 A302 A303	S296-A299 WeakPolarHBondContact O-CB 3.28Å; S296-A299 PolarHBondContact O-N 2.74Å; A299-A302 PolarHBondContact O-N 3.14Å; A299-A303 WeakPolarHBondContact O-CB 3.29Å; A299-A303 PolarHBondContact O-N 2.97Å
300	F	39.3	Very low	41.9	Very low	159 Å²	159	98 Å²	98	70%	0.697	60%	0.595	S	S	*	*	H	α-helix	trans	-70.1	-34.4	175.9	-96	-87.4	0	0	0	113.1	S296 A297 A303 S304	S296-F300 PolarHBondContact O-N 2.89Å; A297-F300 PolarHBondContact O-N 2.88Å; F300-A303 PolarHBondContact O-N 3.42Å; F300-S304 WeakPolarHBondContact O-CB 3.43Å; F300-S304 PolarHBondContact O-N 3.11Å
301	A	46.7	Very low	42.6	Very low	51 Å²	51	95.7 Å²	95.7	42%	0.421	58%	0.581	S	S	.	*	H	α-helix	trans	-60.9	-49.8	171.2	0	0	0	0	0	111	A297 A303 S304 I305	A297-A301 WeakPolarHBondContact O-CB 3.26Å; A297-A301 PolarHBondContact O-N 3.3Å; A301-A303 PolarHBondContact O-N 2.92Å; A301-S304 PolarHBondContact O-N 3.1Å; A301-S304 PolarHBondContact O-OG 3.3Å; A301-I305 PolarHBondContact O-N 2.9Å
302	A	41.1	Very low	43.1	Very low	52 Å²	52	95.1 Å²	95.1	43%	0.43	58%	0.577	S	S	.	*	H	α-helix	trans	-59.4	-46.4	175.8	0	0	0	0	0	112.5	V298 A299 S304 I305 S306	V298-A302 PolarHBondContact O-N 3.08Å; V298-A302 VanDerWaalsContact O-N 3.07Å; A299-A302 PolarHBondContact O-N 3.14Å; A302-S304 VanDerWaalsContact C-N 3.31Å; A302-S304 PolarHBondContact O-N 3.15Å; A302-I305 PolarHBondContact O-N 3.21Å; A302-S306 PolarHBondContact O-N 3.31Å; A302-S306 PolarHBondContact O-OG 3.32Å
303	A	45.3	Very low	43.6	Very low	53 Å²	53	94.3 Å²	94.3	44%	0.438	57%	0.574	S	S	.	*	H	α-helix	trans	-59.8	-39.4	177	0	0	0	0	0	112.5	A299 F300 A301 I305 S306 A307	A299-A303 WeakPolarHBondContact O-CB 3.29Å; A299-A303 PolarHBondContact O-N 2.97Å; F300-A303 PolarHBondContact O-N 3.42Å; A301-A303 PolarHBondContact O-N 2.92Å; A303-I305 VanDerWaalsContact C-N 3.29Å; A303-I305 PolarHBondContact O-N 2.97Å; A303-S306 PolarHBondContact O-N 3.43Å; A303-A307 WeakPolarHBondContact O-CB 3.45Å; A303-A307 PolarHBondContact O-N 3.12Å
304	S	51.6	Low	44.2	Very low	73 Å²	73	90.3 Å²	90.3	51%	0.51	57%	0.565	S	S	.	*	H	α-helix	trans	-65.8	-30.1	178.2	79.7	0	0	0	0	113.5	F300 A301 A302	F300-S304 WeakPolarHBondContact O-CB 3.43Å; F300-S304 PolarHBondContact O-N 3.11Å; A301-S304 PolarHBondContact O-N 3.1Å; A301-S304 PolarHBondContact O-OG 3.3Å; A302-S304 VanDerWaalsContact C-N 3.31Å; A302-S304 PolarHBondContact O-N 3.15Å
305	I	48.7	Very low	44.6	Very low	90 Å²	90	95 Å²	95	46%	0.462	58%	0.58	S	S	.	*	H	α-helix	trans	-77	-48.6	175.6	-65.1	168.8	0	0	0	109.4	A301 A302 A303 A307 K308 V309	A301-I305 PolarHBondContact O-N 2.9Å; A302-I305 PolarHBondContact O-N 3.21Å; A303-I305 VanDerWaalsContact C-N 3.29Å; A303-I305 PolarHBondContact O-N 2.97Å; I305-A307 VanDerWaalsContact C-N 3.33Å; I305-A307 PolarHBondContact O-N 3.32Å; I305-K308 WeakPolarHBondContact O-CA 3.45Å; I305-K308 PolarHBondContact O-N 3.25Å; I305-V309 HydrophobicContact CG2-CG2 4.34Å; I305-V309 WeakPolarHBondContact O-CG2 3.42Å; I305-V309 PolarHBondContact O-N 3.48Å
306	S	49.6	Very low	44.7	Very low	65 Å²	65	96.7 Å²	96.7	46%	0.455	58%	0.576	S	S	.	*	H	α-helix	trans	-56.9	-43.3	177.5	-62.5	0	0	0	0	112.6	A302 A303 K308 V309 M310	A302-S306 PolarHBondContact O-N 3.31Å; A302-S306 PolarHBondContact O-OG 3.32Å; A303-S306 PolarHBondContact O-N 3.43Å; S306-K308 PolarHBondContact O-N 3.23Å; S306-V309 PolarHBondContact O-N 3.13Å; S306-M310 WeakPolarHBondContact O-CG 3.48Å; S306-M310 PolarHBondContact O-N 2.85Å
307	A	47	Very low	44.7	Very low	59 Å²	59	101.5 Å²	101.5	49%	0.488	60%	0.596	S	S	.	*	H	α-helix	trans	-62.1	-29.6	175.4	0	0	0	0	0	113.3	A303 I305 T311	A303-A307 WeakPolarHBondContact O-CB 3.45Å; A303-A307 PolarHBondContact O-N 3.12Å; I305-A307 VanDerWaalsContact C-N 3.33Å; I305-A307 PolarHBondContact O-N 3.32Å; A307-T311 WeakPolarHBondContact O-CG2 3.36Å; A307-T311 PolarHBondContact O-N 3Å; A307-T311 PolarHBondContact O-OG1 3.4Å
308	K	48.4	Very low	44.4	Very low	150 Å²	150	105 Å²	105	65%	0.652	62%	0.617	S	S	*	*	H	α-helix	trans	-85.5	-27.2	178.6	-128.3	165.9	-173.7	171.3	0	113.5	I305 S306 T311 L312	I305-K308 WeakPolarHBondContact O-CA 3.45Å; I305-K308 PolarHBondContact O-N 3.25Å; S306-K308 PolarHBondContact O-N 3.23Å; K308-T311 WeakPolarHBondContact CA-OG1 3.4Å; K308-T311 PolarHBondContact O-OG1 2.6Å; K308-L312 WeakPolarHBondContact O-CG 3.21Å
309	V	47.8	Very low	44	Very low	86 Å²	86	104.7 Å²	104.7	52%	0.521	62%	0.62	S	S	.	*	H	α-helix	trans	-76.2	-39.1	172.9	173.9	0	0	0	0	110.9	I305 S306 S313	I305-V309 HydrophobicContact CG2-CG2 4.34Å; I305-V309 WeakPolarHBondContact O-CG2 3.42Å; I305-V309 PolarHBondContact O-N 3.48Å; S306-V309 PolarHBondContact O-N 3.13Å; V309-S313 PolarHBondContact O-N 3.01Å; V309-S313 PolarHBondContact O-OG 3.21Å
310	M	49	Very low	43.5	Very low	146 Å²	146	109.4 Å²	109.4	72%	0.719	64%	0.636	S	S	*	*	H	α-helix	trans	-69.7	-33.5	177.3	-72	-177.3	171.6	0	0	113.3	S306	S306-M310 WeakPolarHBondContact O-CG 3.48Å; S306-M310 PolarHBondContact O-N 2.85Å
311	T	46.7	Very low	43.3	Very low	88 Å²	88	107 Å²	107	54%	0.54	64%	0.639	S	S	.	*	H	α-helix	trans	-76.3	-26	178.7	41.5	0	0	0	0	114	A307 K308	A307-T311 WeakPolarHBondContact O-CG2 3.36Å; A307-T311 PolarHBondContact O-N 3Å; A307-T311 PolarHBondContact O-OG1 3.4Å; K308-T311 WeakPolarHBondContact CA-OG1 3.4Å; K308-T311 PolarHBondContact O-OG1 2.6Å
312	L	45.4	Very low	42.8	Very low	135 Å²	135	111.2 Å²	111.2	71%	0.707	65%	0.654	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.2	-4	175.7	-68.9	172.3	0	0	0	114.2	K308	K308-L312 WeakPolarHBondContact O-CG 3.21Å
313	S	41.5	Very low	42.5	Very low	96 Å²	96	116.2 Å²	116.2	67%	0.671	67%	0.673	S	S	*	*	T	Hydrogen-bonded Turn	trans	-98.7	3.9	-178.4	-57.8	0	0	0	0	113.9	V309	V309-S313 PolarHBondContact O-N 3.01Å; V309-S313 PolarHBondContact O-OG 3.21Å
314	A	44	Very low	41.8	Very low	80 Å²	80	117.1 Å²	117.1	66%	0.661	69%	0.688	S	S	*	*	S	Bend	trans	-116.9	-9.9	-167.8	0	0	0	0	0	115.5
315	E	42.7	Very low	41	Very low	170 Å²	170	118 Å²	118	79%	0.794	70%	0.699	S	S	*	*	S	Bend	trans	-105.1	-4.3	-169.8	-62.4	-166.6	126.5	0	0	115.3
316	E	39.8	Very low	40.4	Very low	191 Å²	191	121.4 Å²	121.4	89%	0.893	72%	0.719	S	S	*	*	S	Bend	trans	-98	17.7	-177.3	-68.3	-156	120.8	0	0	115.6
317	I	37.8	Very low	39.6	Very low	160 Å²	160	129.7 Å²	129.7	82%	0.821	74%	0.74	S	S	*	*			trans	-128.5	64.8	176.3	-43.1	-178.9	0	0	0	112.3
318	S	33.9	Very low	39.2	Very low	126 Å²	126	131.7 Å²	131.7	88%	0.881	75%	0.748	S	S	*	*			trans	-158.4	74.5	163.6	-84	0	0	0	0	112
319	S	34.3	Very low	38.6	Very low	105 Å²	105	130.6 Å²	130.6	73%	0.734	75%	0.754	S	S	*	*			trans	-119.4	145.8	170.3	61.4	0	0	0	0	111.8
320	N	32.2	Very low	38.2	Very low	162 Å²	162	132.7 Å²	132.7	87%	0.866	77%	0.767	S	S	*	*			trans	66.1	87.3	174.4	-59.2	-26.6	0	0	0	118.5
321	S	36.3	Very low	37.9	Very low	108 Å²	108	130.1 Å²	130.1	76%	0.755	76%	0.764	S	S	*	*			trans	-154.9	109.5	141.3	-163.1	0	0	0	0	114
322	L	35.6	Very low	37.6	Very low	140 Å²	140	132.6 Å²	132.6	73%	0.733	78%	0.779	S	S	*	*			trans	40.4	129	153.6	-71.2	87.7	0	0	0	123.3
323	N	34.8	Very low	37.4	Very low	157 Å²	157	130 Å²	130	84%	0.84	79%	0.785	S	S	*	*			trans	66	147	139.7	-60.9	-12.7	0	0	0	120.9
324	G	31.5	Very low	37.1	Very low	73 Å²	73	135 Å²	135	75%	0.753	80%	0.795	S	S	*	*			trans	-177.8	-50.5	168.3	0	0	0	0	0	118.7
325	A	34.7	Very low	37	Very low	90 Å²	90	135.3 Å²	135.3	74%	0.744	79%	0.792	S	S	*	*			trans	65.5	155.3	-179.8	0	0	0	0	0	118.9
326	N	36.1	Very low	36.6	Very low	163 Å²	163	130.5 Å²	130.5	87%	0.872	79%	0.788	S	S	*	*			trans	67.1	142	176.2	-55.2	-42.8	0	0	0	115.8
327	R	32.2	Very low	36.9	Very low	239 Å²	239	127.7 Å²	127.7	90%	0.902	79%	0.786	S	S	*	*			cis	-148.3	148.3	17.3	-172.1	177.9	178.3	-168.6	-0.3	111
328	P	37.6	Very low	36.9	Very low	100 Å²	100	124.7 Å²	124.7	65%	0.649	79%	0.785	S	S	*	*			trans	-108.1	-174.5	-168	41.3	-37	0	0	0	116
329	T	37.3	Very low	37.1	Very low	127 Å²	127	123.5 Å²	123.5	78%	0.779	78%	0.783	S	S	*	*			trans	76.9	136.7	170.9	66.1	0	0	0	0	115.9
330	T	39.1	Very low	37.2	Very low	131 Å²	131	122.9 Å²	122.9	80%	0.804	78%	0.784	S	S	*	*			cis	-157.2	176	4.8	-2.5	0	0	0	0	108.9
331	S	42.4	Very low	37.6	Very low	92 Å²	92	119.4 Å²	119.4	64%	0.643	78%	0.778	S	S	*	*			cis	-163.4	176.5	4.9	40.4	0	0	0	0	111
332	T	40.5	Very low	37.8	Very low	139 Å²	139	123.5 Å²	123.5	85%	0.853	79%	0.786	S	S	*	*			trans	22.8	137.5	147.3	57	0	0	0	0	120.8
333	G	40.5	Very low	37.8	Very low	81 Å²	81	123.8 Å²	123.8	84%	0.835	79%	0.788	S	S	*	*			cis	162.5	164.7	12	0	0	0	0	0	106.9
334	F	35.4	Very low	38	Very low	201 Å²	201	123.6 Å²	123.6	88%	0.882	79%	0.786	S	S	*	*			cis	-160.6	172.2	28.5	165.3	-97.1	0	0	0	110.4
335	S	41.1	Very low	38.4	Very low	87 Å²	87	125.3 Å²	125.3	61%	0.608	78%	0.784	S	S	*	*			trans	-69	169.4	-177.6	44.9	0	0	0	0	116.3
336	G	35.9	Very low	39	Very low	68 Å²	68	126.6 Å²	126.6	70%	0.701	79%	0.785	S	S	*	*			cis	176.1	-174.2	1.9	0	0	0	0	0	113.5
337	P	46.2	Very low	39.3	Very low	132 Å²	132	125.3 Å²	125.3	86%	0.857	79%	0.785	S	S	*	*			trans	-117.6	167.4	-167.2	41.5	-32.9	0	0	0	116
338	A	36.7	Very low	39.6	Very low	97 Å²	97	117.3 Å²	117.3	80%	0.802	78%	0.777	S	S	*	*			trans	176.6	147.1	140.4	0	0	0	0	0	115.6
339	A	38.3	Very low	39.9	Very low	101 Å²	101	119 Å²	119	84%	0.835	79%	0.785	S	S	*	*			trans	64.3	158.3	147.6	0	0	0	0	0	121.9
340	A	37.4	Very low	40	Very low	92 Å²	92	121.4 Å²	121.4	76%	0.76	79%	0.785	S	S	*	*			cis	-170.1	143	-32.8	0	0	0	0	0	113.4
341	A	40	Very low	40.1	Very low	89 Å²	89	122.8 Å²	122.8	74%	0.736	79%	0.786	S	S	*	*			trans	74.5	155.2	144.6	0	0	0	0	0	123.4
342	Q	40.8	Very low	39.9	Very low	195 Å²	195	122.3 Å²	122.3	91%	0.911	78%	0.781	S	S	*	*			trans	73.1	130.5	165.8	-47.2	-171.8	9.8	0	0	117.3
343	N	35.7	Very low	39.8	Very low	146 Å²	146	121.8 Å²	121.8	78%	0.781	78%	0.778	S	S	*	*			cis	134.9	147.4	-11.2	-175.1	31.2	0	0	0	110.4
344	L	38.2	Very low	40	Very low	153 Å²	153	123.6 Å²	123.6	80%	0.801	78%	0.777	S	S	*	*			trans	103.4	156.2	172.4	-58	172.2	0	0	0	119.5
345	P	39.7	Very low	40	Very low	109 Å²	109	121.1 Å²	121.1	71%	0.708	78%	0.778	S	S	*	*			trans	-125.1	178	-154.6	41.1	-23.8	0	0	0	117.3
346	P	47.5	Very low	40	Very low	117 Å²	117	119.9 Å²	119.9	76%	0.76	78%	0.779	S	S	*	*			trans	-86.5	-173.1	-178.4	38.8	-40	0	0	0	113.8
347	P	43.1	Very low	40.2	Very low	136 Å²	136	124.9 Å²	124.9	88%	0.883	79%	0.79	S	S	*	*			cis	-145.2	-172.2	18	45.2	-24	0	0	0	119.4
348	G	38.4	Very low	39.4	Very low	70 Å²	70	124.9 Å²	124.9	72%	0.722	78%	0.783	S	S	*	*			trans	171.6	175.1	171	0	0	0	0	0	110.8
349	V	44.1	Very low	39.4	Very low	137 Å²	137	127 Å²	127	83%	0.83	79%	0.786	S	S	*	*			cis	-154.9	116.7	-4.4	175.4	0	0	0	0	107.1
350	F	39.2	Very low	38.9	Very low	176 Å²	176	127.8 Å²	127.8	77%	0.772	78%	0.78	S	S	*	*				56.9	131	103.7	-144.6	-93.7	0	0	0	119.4	P352	F350-P352 HydrophobicContact CE1-CG 4.15Å
351	I	40.5	Very low	38.8	Very low	160 Å²	160	128.5 Å²	128.5	82%	0.821	78%	0.779	S	S	*	*			trans	171.6	146.2	134.3	-87.9	156.7	0	0	0	110.7
352	P	38.7	Very low	38.4	Very low	83 Å²	83	130.5 Å²	130.5	54%	0.539	78%	0.783	S	S	.	*			trans	-137.5	-178.6	-154.3	42.6	-23.5	0	0	0	119.2	F350	F350-P352 HydrophobicContact CE1-CG 4.15Å
353	T	37.8	Very low	38.1	Very low	128 Å²	128	126.2 Å²	126.2	79%	0.785	77%	0.774	S	S	*	*			trans	69.4	131.8	151.6	43.3	0	0	0	0	123.2
354	S	45.7	Very low	38	Very low	119 Å²	119	128.1 Å²	128.1	83%	0.832	78%	0.779	S	S	*	*			trans	-144.4	154.1	139.9	60.6	0	0	0	0	109.8
355	V	34.6	Very low	37.9	Very low	148 Å²	148	128.4 Å²	128.4	90%	0.897	78%	0.776	S	S	*	*			trans	-147.9	144.7	-175.6	174.3	0	0	0	0	109.9
356	G	41.4	Very low	37.7	Very low	61 Å²	61	131 Å²	131	63%	0.629	78%	0.776	S	S	*	*			trans	142.6	148.1	172.9	0	0	0	0	0	111.7
357	D	39.4	Very low	36.8	Very low	174 Å²	174	132.6 Å²	132.6	93%	0.93	77%	0.773	S	S	*	*			cis	-156.6	171.4	-11.2	-132.8	-41.6	0	0	0	111.2
358	N	29.5	Very low	36.4	Very low	131 Å²	131	134.3 Å²	134.3	70%	0.701	77%	0.773	S	S	*	*			trans	-109.4	123.7	-165.5	172.1	44.6	0	0	0	115.1
359	V	37.5	Very low	36.2	Very low	143 Å²	143	138 Å²	138	87%	0.867	77%	0.772	S	S	*	*			trans	-144.6	144.3	166	-174.6	0	0	0	0	111.5
360	T	27.7	Very low	35.7	Very low	116 Å²	116	139.4 Å²	139.4	71%	0.712	77%	0.774	S	S	*	*			trans	-122.2	139.6	-176.2	-53.1	0	0	0	0	112.2
361	S	36	Very low	35.3	Very low	107 Å²	107	136.9 Å²	136.9	75%	0.748	77%	0.773	S	S	*	*			trans	-163	90.2	161.5	59.6	0	0	0	0	115.8
362	T	30	Very low	35.1	Very low	132 Å²	132	136.9 Å²	136.9	81%	0.81	77%	0.773	S	S	*	*			trans	21.7	119.5	135.7	55.3	0	0	0	0	123.1
363	S	35.8	Very low	34.8	Very low	105 Å²	105	137.3 Å²	137.3	73%	0.734	78%	0.778	S	S	*	*				177.9	116.9	129	53.4	0	0	0	0	108.4
364	E	34.2	Very low	34.5	Very low	186 Å²	186	137.3 Å²	137.3	87%	0.869	78%	0.778	S	S	*	*				57.8	122.5	85	-65.9	-175.6	156.3	0	0	113.2
365	E	35.2	Very low	33.9	Very low	158 Å²	158	137.1 Å²	137.1	74%	0.738	77%	0.771	S	S	*	*			cis	-117.2	-162.4	0.4	-56.2	-165.2	86	0	0	111.1
366	K	35.2	Very low	33.8	Very low	163 Å²	163	135.9 Å²	135.9	71%	0.709	77%	0.765	S	S	*	*			cis	-155.8	-169.6	2.2	-146.8	169.9	-173.6	75.2	0	109.9
367	Q	28.3	Very low	33.4	Very low	151 Å²	151	137.6 Å²	137.6	71%	0.706	77%	0.773	S	S	*	*			trans	-134.3	148.8	179.2	-59.5	166.4	-86.8	0	0	112.6
368	I	35.9	Very low	33.1	Very low	172 Å²	172	134.5 Å²	134.5	88%	0.882	77%	0.765	S	S	*	*			trans	-141.6	143.4	130.7	-61.1	-170.1	0	0	0	106.4
369	E	33.2	Very low	33.6	Very low	148 Å²	148	134.5 Å²	134.5	69%	0.692	77%	0.769	S	S	*	*			trans	-88.8	162.4	-176.8	-66.3	154.5	136.2	0	0	111
370	D	33.9	Very low	34.1	Very low	166 Å²	166	139.1 Å²	139.1	89%	0.888	77%	0.771	S	S	*	*				-152.7	162	81.1	-104	-40.3	0	0	0	113.9
371	V	31	Very low	34.5	Very low	123 Å²	123	140.3 Å²	140.3	75%	0.745	77%	0.773	S	S	*	*			trans	-141.6	139.4	-173.1	175.5	0	0	0	0	111.4
372	I	35.2	Very low	34.9	Very low	160 Å²	160	143 Å²	143	82%	0.821	78%	0.779	S	S	*	*			trans	-178	114.7	150.3	-95.6	147	0	0	0	106.6
373	S	33.9	Very low	35.5	Very low	92 Å²	92	144.6 Å²	144.6	64%	0.643	78%	0.783	S	S	*	*				73.7	90.1	67.6	-154.9	0	0	0	0	112.4
374	V	31.1	Very low	36	Very low	128 Å²	128	147.5 Å²	147.5	78%	0.776	79%	0.79	S	S	*	*				95.6	160	79.8	158.9	0	0	0	0	113.4
375	T	33	Very low	36.4	Very low	115 Å²	115	145.3 Å²	145.3	71%	0.706	78%	0.784	S	S	*	*			trans	82	99.7	166.9	25.4	0	0	0	0	121.5
376	T	33.2	Very low	36.8	Very low	123 Å²	123	143.4 Å²	143.4	76%	0.755	79%	0.789	S	S	*	*				48.8	112	123.2	59.3	0	0	0	0	122.4
377	A	31.9	Very low	37	Very low	96 Å²	96	139.9 Å²	139.9	79%	0.793	79%	0.79	S	S	*	*				40.3	120.7	124.1	0	0	0	0	0	121.4
378	S	34.1	Very low	37.3	Very low	110 Å²	110	140 Å²	140	77%	0.769	79%	0.794	S	S	*	*			trans	-153.8	149.4	140	-78.8	0	0	0	0	109.9
379	V	39.3	Very low	37.2	Very low	131 Å²	131	137.7 Å²	137.7	79%	0.794	79%	0.79	S	S	*	*			trans	-118.3	123.2	170.3	171	0	0	0	0	106.5
380	W	47.3	Very low	37.2	Very low	240 Å²	240	136.3 Å²	136.3	91%	0.909	79%	0.791	S	S	*	*			trans	-125.8	123.1	169.5	-66	-15.3	0	0	0	108.3
381	D	37.1	Very low	37.5	Very low	141 Å²	141	134.1 Å²	134.1	75%	0.754	79%	0.786	S	S	*	*			trans	-85.5	154	154.2	-60.8	-92	0	0	0	108.4
382	D	44.1	Very low	37.3	Very low	164 Å²	164	134.5 Å²	134.5	88%	0.877	79%	0.789	S	S	*	*			trans	168.8	143.6	137.9	-93	-42	0	0	0	109.5
383	D	42.7	Very low	37.3	Very low	164 Å²	164	131.4 Å²	131.4	88%	0.877	79%	0.787	S	S	*	*			trans	-81.3	152.9	-174.7	-52.1	-97.4	0	0	0	114.2
384	D	45.4	Very low	37.2	Very low	166 Å²	166	132 Å²	132	89%	0.888	79%	0.791	S	S	*	*			trans	-153	159.3	143.3	-148.5	-9.9	0	0	0	112.2
385	D	43.2	Very low	37.5	Very low	140 Å²	140	134.8 Å²	134.8	75%	0.749	80%	0.796	S	S	*	*			trans	-94.9	154.3	-170.4	-169.3	1.2	0	0	0	112.5
386	S	43.9	Very low	37.5	Very low	119 Å²	119	137.8 Å²	137.8	83%	0.832	80%	0.802	S	S	*	*			trans	165.1	131.5	150	-80.2	0	0	0	0	115.1
387	A	38.4	Very low	37.6	Very low	88 Å²	88	139 Å²	139	73%	0.727	80%	0.802	S	S	*	*			trans	-53	149.1	-178.1	0	0	0	0	0	120.4
388	I	35.2	Very low	37.7	Very low	155 Å²	155	140.3 Å²	140.3	80%	0.795	80%	0.802	S	S	*	*			trans	-11.5	146.7	142.9	10.2	170.9	0	0	0	117.5
389	P	34.8	Very low	37.5	Very low	122 Å²	122	143.6 Å²	143.6	79%	0.792	81%	0.806	S	S	*	*				-146.8	168.3	80.7	39.9	-23.4	0	0	0	117.6
390	V	31.9	Very low	37.4	Very low	119 Å²	119	145.5 Å²	145.5	72%	0.721	81%	0.81	S	S	*	*			trans	-94.1	141.4	173.2	177.1	0	0	0	0	111
391	P	40.9	Very low	36.6	Very low	121 Å²	121	138.6 Å²	138.6	79%	0.786	80%	0.798	S	S	*	*			trans	-98.9	136.3	166.5	35.2	-28.9	0	0	0	112.7
392	T	26.7	Very low	36.3	Very low	130 Å²	130	136.8 Å²	136.8	80%	0.798	79%	0.792	S	S	*	*			trans	-129	119.9	173.5	-52.2	0	0	0	0	110.5
393	A	36	Very low	36	Very low	96 Å²	96	137 Å²	137	79%	0.793	79%	0.788	S	S	*	*			trans	-156.6	137.8	162.4	0	0	0	0	0	107.9
394	S	30.4	Very low	35.5	Very low	104 Å²	104	135.2 Å²	135.2	73%	0.727	78%	0.778	S	S	*	*			cis	89.8	74.8	19.4	-49.9	0	0	0	0	115.9
395	E	38	Very low	35	Very low	187 Å²	187	135 Å²	135	87%	0.874	77%	0.772	S	S	*	*			trans	-175.2	145.4	157.2	-103.5	158.2	-172.4	0	0	105.9
396	E	34.1	Very low	34.6	Very low	178 Å²	178	134.8 Å²	134.8	83%	0.832	78%	0.776	S	S	*	*			cis	-155.4	160	0.8	-152.5	177.3	-175.2	0	0	109.3
397	I	33.7	Very low	34.1	Very low	149 Å²	149	132.1 Å²	132.1	76%	0.764	77%	0.767	S	S	*	*			trans	-138	140	-179.9	-61.4	169.8	0	0	0	110.6	E399	I397-E399 HydrophobicContact CG2-CG 4.43Å
398	P	35.3	Very low	33.9	Very low	122 Å²	122	136.3 Å²	136.3	79%	0.792	77%	0.771	S	S	*	*			trans	-133.2	114	137.8	33	-19.5	0	0	0	110.7
399	E	29.7	Very low	33.7	Very low	179 Å²	179	136.5 Å²	136.5	84%	0.836	77%	0.768	S	S	*	*				50.6	110.4	80	-72	-153.9	155.9	0	0	115.5	I397	I397-E399 HydrophobicContact CG2-CG 4.43Å
400	I	35.7	Very low	33.5	Very low	171 Å²	171	135.5 Å²	135.5	88%	0.877	76%	0.761	S	S	*	*			trans	-135.2	130.3	143.6	-98.9	176.9	0	0	0	109
401	S	30.6	Very low	33.3	Very low	96 Å²	96	138.2 Å²	138.2	67%	0.671	77%	0.765	S	S	*	*			trans	-69.3	167.1	174.7	51.8	0	0	0	0	113.2
402	T	32.7	Very low	32.8	Very low	102 Å²	102	137.8 Å²	137.8	63%	0.626	76%	0.76	S	S	*	*			cis	-169.1	177.4	1.3	17	0	0	0	0	109.4
403	E	35.9	Very low	32.9	Very low	169 Å²	169	137.7 Å²	137.7	79%	0.79	76%	0.76	S	S	*	*			trans	71.2	142.6	143.5	-78.2	147.9	159.6	0	0	118.3
404	D	32.9	Very low	32.6	Very low	126 Å²	126	137.2 Å²	137.2	67%	0.674	76%	0.755	S	S	*	*			cis	-165.9	170.9	-7.9	-164.5	14.2	0	0	0	110.9
405	Q	36	Very low	32.7	Very low	162 Å²	162	140.3 Å²	140.3	76%	0.757	76%	0.758	S	S	*	*			trans	66.7	160	163.5	-73.3	159.6	62.6	0	0	119.8
406	V	34.7	Very low	32.5	Very low	136 Å²	136	137.7 Å²	137.7	82%	0.824	75%	0.75	S	S	*	*			cis	179.3	148	-42.6	132.9	0	0	0	0	108.2
407	G	32.8	Very low	32.2	Very low	63 Å²	63	135.5 Å²	135.5	65%	0.649	74%	0.743	S	S	*	*			trans	111.9	104.9	172.2	0	0	0	0	0	112.8
408	E	33.4	Very low	32.1	Very low	175 Å²	175	135 Å²	135	82%	0.818	74%	0.743	S	S	*	*				79.5	110.5	71	-77.8	-166.7	78.6	0	0	115.6
409	H	32.8	Very low	32	Very low	159 Å²	159	135.4 Å²	135.4	74%	0.736	74%	0.742	S	S	*	*			trans	71.1	114.6	137.7	-77.4	-61.1	0	0	0	123.4
410	T	29.9	Very low	32.3	Very low	102 Å²	102	135.3 Å²	135.3	63%	0.626	74%	0.742	S	S	*	*				83.7	91.1	120.6	-54.4	0	0	0	0	119.3
411	E	26.9	Very low	32.5	Very low	176 Å²	176	134.2 Å²	134.2	82%	0.822	74%	0.738	S	S	*	*				83.7	159.1	120.7	-144.6	-179.9	-177.7	0	0	120.8
412	V	30.4	Very low	33	Very low	112 Å²	112	133.2 Å²	133.2	68%	0.679	73%	0.731	S	S	*	*			trans	71.5	116.7	166.6	-134.7	0	0	0	0	120.7
413	T	29.5	Very low	33.4	Very low	128 Å²	128	136.1 Å²	136.1	79%	0.785	74%	0.737	S	S	*	*			trans	66.7	97	152	35.8	0	0	0	0	121.7
414	A	28.3	Very low	33.8	Very low	85 Å²	85	134.1 Å²	134.1	70%	0.702	73%	0.732	S	S	*	*				36.9	124	121.1	0	0	0	0	0	121.2
415	H	33.9	Very low	34.6	Very low	169 Å²	169	132.9 Å²	132.9	78%	0.782	73%	0.728	S	S	*	*				-168.8	124.2	110.3	-102.1	-74	0	0	0	113.4
416	L	34.2	Very low	35	Very low	133 Å²	133	131.4 Å²	131.4	70%	0.696	72%	0.72	S	S	*	*			trans	63.9	109.7	143.5	-57.3	169.3	0	0	0	122.1
417	N	27.3	Very low	35.7	Very low	131 Å²	131	128.7 Å²	128.7	70%	0.701	70%	0.704	S	S	*	*				93.2	146.4	118.3	-71.2	20	0	0	0	123.4
418	D	30.4	Very low	37	Very low	140 Å²	140	129.6 Å²	129.6	75%	0.749	69%	0.693	S	S	*	*			trans	90.3	99.8	148.5	-65.2	-38.9	0	0	0	121.8
419	V	33.2	Very low	38.3	Very low	129 Å²	129	123.5 Å²	123.5	78%	0.782	67%	0.67	S	S	*	*			trans	76.7	90.9	140.8	-170.6	0	0	0	0	119.1
420	E	37.2	Very low	40.1	Very low	178 Å²	178	121.7 Å²	121.7	83%	0.832	66%	0.663	S	S	*	*	S	Bend	trans	-143.2	174.8	142.1	-74	-155.6	131	0	0	110.9	S422	E420-S422 PolarHBondContact O-N 2.86Å; E420-S422 VanDerWaalsContact O-N 3.16Å; E420-S422 PolarHBondContact O-OG 2.92Å
421	D	39.7	Very low	42.6	Very low	147 Å²	147	117 Å²	117	79%	0.786	63%	0.634	S	S	*	*			trans	-35	101.4	-160.9	-73.1	-42.9	0	0	0	118.2
422	S	40.5	Very low	45.5	Very low	75 Å²	75	112.5 Å²	112.5	52%	0.524	61%	0.61	S	S	.	*			trans	-105.3	36	-170.9	-57.2	0	0	0	0	114.3	E420 F426	E420-S422 PolarHBondContact O-N 2.86Å; E420-S422 VanDerWaalsContact O-N 3.16Å; E420-S422 PolarHBondContact O-OG 2.92Å; S422-F426 WeakPolarHBondContact O-CD2 3.12Å
423	Q	42.3	Very low	48.3	Very low	163 Å²	163	107.2 Å²	107.2	76%	0.762	58%	0.578	S	S	*	*	S	Bend	trans	-111.2	-57.9	174.8	-70.8	-167.2	-29.8	0	0	112.8	V425 F426 T427	Q423-V425 VanDerWaalsContact C-N 3.31Å; Q423-V425 PolarHBondContact O-N 3.09Å; Q423-F426 WeakPolarHBondContact O-CB 3.2Å; Q423-F426 PolarHBondContact O-N 2.89Å; Q423-T427 PolarHBondContact O-N 3.49Å
424	D	44.6	Very low	51.2	Low	127 Å²	127	101.1 Å²	101.1	68%	0.679	54%	0.54	S	S	*	.	H	α-helix	trans	-70.9	-27.7	-178.9	-53.6	-48.7	0	0	0	112.8	F426 T427	D424-F426 PolarHBondContact O-N 3.11Å; D424-T427 PolarHBondContact O-OG1 2.99Å; D424-T427 VanDerWaalsContact O-OG1 3.05Å
425	V	48.4	Very low	54.1	Low	100 Å²	100	97.3 Å²	97.3	61%	0.606	51%	0.508	S	S	*	.	H	α-helix	trans	-64.3	-31.1	170.5	-175.9	0	0	0	0	111.3	Q423 S429	Q423-V425 VanDerWaalsContact C-N 3.31Å; Q423-V425 PolarHBondContact O-N 3.09Å; V425-S429 VanDerWaalsContact O-CB 3.31Å; V425-S429 WeakPolarHBondContact O-CB 3.44Å; V425-S429 PolarHBondContact O-N 3.49Å; V425-S429 VanDerWaalsContact O-N 3.17Å
426	F	44.1	Very low	56.8	Low	132 Å²	132	89.4 Å²	89.4	58%	0.579	47%	0.471	S	S	*	.	H	α-helix	trans	-77.2	-36.3	-175.9	-97.3	-103.9	0	0	0	113.1	S422 Q423 D424 S429	S422-F426 WeakPolarHBondContact O-CD2 3.12Å; Q423-F426 WeakPolarHBondContact O-CB 3.2Å; Q423-F426 PolarHBondContact O-N 2.89Å; D424-F426 PolarHBondContact O-N 3.11Å; F426-S429 PolarHBondContact O-N 2.83Å; F426-S429 PolarHBondContact O-OG 3.14Å
427	T	50.7	Low	59.3	Low	79 Å²	79	84.2 Å²	84.2	49%	0.485	44%	0.444	S	S	.	.	H	α-helix	trans	-67.1	-49.7	175.5	41.5	0	0	0	0	111.5	Q423 D424 S429 M430	Q423-T427 PolarHBondContact O-N 3.49Å; D424-T427 PolarHBondContact O-OG1 2.99Å; D424-T427 VanDerWaalsContact O-OG1 3.05Å; T427-S429 PolarHBondContact O-N 2.85Å; T427-M430 PolarHBondContact O-N 3.22Å
428	I	59.5	Low	62	Low	82 Å²	82	80.6 Å²	80.6	42%	0.421	42%	0.424	S	S	.	.	H	α-helix	trans	-58.8	-36.9	177	-59.3	171.6	0	0	0	110.5	M430 S431 L509	I428-M430 PolarHBondContact O-N 2.94Å; I428-S431 PolarHBondContact O-N 3.2Å; I428-S431 PolarHBondContact O-OG 3.39Å; I428-L509 HydrophobicContact CG2-CB 4.32Å
429	S	60.6	Low	64.3	Low	47 Å²	47	74.7 Å²	74.7	33%	0.329	39%	0.392	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.4	-5.2	175.2	85.4	0	0	0	0	115.6	V425 F426 T427 K489	V425-S429 VanDerWaalsContact O-CB 3.31Å; V425-S429 WeakPolarHBondContact O-CB 3.44Å; V425-S429 PolarHBondContact O-N 3.49Å; V425-S429 VanDerWaalsContact O-N 3.17Å; F426-S429 PolarHBondContact O-N 2.83Å; F426-S429 PolarHBondContact O-OG 3.14Å; T427-S429 PolarHBondContact O-N 2.85Å; S429-K489 WeakPolarHBondContact O-CE 3.43Å; S429-K489 PolarHBondContact O-NZ 2.82Å
430	M	70.3	Confident	66.4	Low	120 Å²	120	68.8 Å²	68.8	59%	0.591	36%	0.357	S	S	*	.	T	Hydrogen-bonded Turn	trans	-119.1	3	179.3	-72.3	-66.7	-175.8	0	0	114.1	T427 I428 S485	T427-M430 PolarHBondContact O-N 3.22Å; I428-M430 PolarHBondContact O-N 2.94Å; M430-S485 WeakPolarHBondContact O-CB 3.4Å; M430-S485 PolarHBondContact O-OG 2.95Å
431	S	82.2	Confident	68.4	Low	4 Å²	4	60.7 Å²	60.7	3%	0.028	32%	0.321	C	S	.	.			trans	-61.8	143.5	-175.6	-67.2	0	0	0	0	114	I428 S485 Y510	I428-S431 PolarHBondContact O-N 3.2Å; I428-S431 PolarHBondContact O-OG 3.39Å; S431-S485 WeakPolarHBondContact O-CA 3.1Å; S431-S485 WeakPolarHBondContact O-CB 3.48Å; S431-Y510 WeakPolarHBondContact CB-O 3.38Å; S431-Y510 PolarHBondContact OG-O 3.25Å; S431-Y510 VanDerWaalsContact OG-O 3.12Å
432	R	87.6	Confident	70.2	Confident	82 Å²	82	56.2 Å²	56.2	31%	0.309	30%	0.299	S	S	.	.			trans	-95.7	1.3	172.4	-62.3	-169.4	-75.5	172.6	-0.2	114.2	F482 D483 E512	R432-F482 PolarHBondContact O-N 2.79Å; R432-D483 VanDerWaalsContact CD-O 3.28Å; R432-D483 WeakPolarHBondContact CD-O 3.27Å; R432-D483 PolarHBondContact NH1-O 2.78Å; R432-E512 WeakPolarHBondContact CB-OE2 3.17Å; R432-E512 WeakPolarHBondContact CG-OE2 3.02Å; R432-E512 IonicContact CZ-OE1 3.41Å; R432-E512 IonicContact CZ-OE2 3.2Å; R432-E512 IonicContact NE-OE1 2.72Å; R432-E512 PolarHBondContact NE-OE1 2.66Å; R432-E512 IonicContact NE-OE2 3.59Å; R432-E512 PolarHBondContact NE-OE2 3.04Å; R432-E512 IonicContact NH2-OE1 4Å; R432-E512 PolarHBondContact NH2-OE1 2.94Å; R432-E512 IonicContact NH2-OE2 2.68Å
433	V	89.8	Confident	71.9	Confident	0 Å²	0	60.1 Å²	60.1	0%	0	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	132.2	-175.9	-173.3	0	0	0	0	109.9	F479 I480 Q481 Y510 E512 F515	V433-F479 HydrophobicContact CG1-CB 4.47Å; V433-F479 HydrophobicContact CG1-CD1 4.35Å; V433-I480 WeakPolarHBondContact CA-O 3.44Å; V433-Q481 HydrophobicContact CG2-CG 4.35Å; V433-Y510 PolarHBondContact O-N 3.49Å; V433-E512 HydrophobicContact CG2-CB 4.3Å; V433-E512 HydrophobicContact CG2-CG 4.07Å; V433-F515 HydrophobicContact CB-CB 4.34Å; V433-F515 HydrophobicContact CB-CG 4.36Å; V433-F515 HydrophobicContact CG1-CB 3.99Å; V433-F515 HydrophobicContact CG1-CD1 4.21Å; V433-F515 HydrophobicContact CG1-CD2 3.84Å; V433-F515 HydrophobicContact CG1-CE2 4.38Å; V433-F515 HydrophobicContact CG1-CG 3.74Å; V433-F515 HydrophobicContact CG2-CB 3.83Å; V433-F515 HydrophobicContact CG2-CD1 3.55Å; V433-F515 HydrophobicContact CG2-CE1 4.27Å; V433-F515 HydrophobicContact CG2-CG 3.76Å
434	L	90.6	Very high	73.6	Confident	0 Å²	0	56.5 Å²	56.5	0%	0	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	128.2	173.5	-177.4	70.1	0	0	0	109	L436 F479 I480 F482 A491 C492 L495 A507	L434-L436 HydrophobicContact CD2-CD2 3.88Å; L434-L436 HydrophobicContact CD2-CG 4.33Å; L434-L436 HydrophobicContact CG-CD2 4.03Å; L434-L436 HydrophobicContact CG-CG 4.44Å; L434-F479 CarbonylContact O-C 3.59Å; L434-F479 WeakPolarHBondContact O-CA 3.24Å; L434-I480 HydrophobicContact CB-CB 4.42Å; L434-I480 HydrophobicContact CD2-CD1 4.44Å; L434-I480 PolarHBondContact N-O 3.05Å; L434-I480 PolarHBondContact O-N 3.33Å; L434-F482 HydrophobicContact CB-CE2 4.03Å; L434-F482 HydrophobicContact CD2-CE2 4.11Å; L434-A491 HydrophobicContact CD2-CB 3.77Å; L434-C492 HydrophobicContact CD1-CB 3.52Å; L434-L495 HydrophobicContact CD2-CD1 4.09Å; L434-A507 HydrophobicContact CD1-CB 4.31Å
435	L	89.8	Confident	75.2	Confident	5 Å²	5	52.3 Å²	52.3	3%	0.026	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.4	126.5	167.9	168.7	59.8	0	0	0	109	E437 R477 F479 A507 R508 Y510	L435-E437 HydrophobicContact CD1-CG 4.04Å; L435-E437 HydrophobicContact CD2-CG 4Å; L435-E437 HydrophobicContact CG-CG 3.81Å; L435-R477 HydrophobicContact CD1-CB 3.73Å; L435-R477 HydrophobicContact CD1-CG 3.9Å; L435-F479 HydrophobicContact CB-CD1 4.33Å; L435-F479 HydrophobicContact CB-CE1 4.33Å; L435-F479 HydrophobicContact CD1-CD1 4.15Å; L435-F479 HydrophobicContact CD1-CD2 4.33Å; L435-F479 HydrophobicContact CD1-CE1 3.87Å; L435-F479 HydrophobicContact CD1-CE2 4.05Å; L435-F479 HydrophobicContact CD1-CG 4.37Å; L435-F479 HydrophobicContact CD1-CZ 3.81Å; L435-F479 HydrophobicContact CD2-CE1 4.34Å; L435-F479 HydrophobicContact CG-CE1 4.41Å; L435-A507 WeakPolarHBondContact O-CA 3.42Å; L435-R508 PolarHBondContact N-O 2.7Å; L435-R508 PolarHBondContact O-N 3.39Å; L435-Y510 HydrophobicContact CB-CD2 4.21Å; L435-Y510 HydrophobicContact CB-CG 4.38Å; L435-Y510 HydrophobicContact CD2-CD2 3.74Å; L435-Y510 HydrophobicContact CD2-CE2 4.18Å
436	L	89.6	Confident	76.8	Confident	3 Å²	3	53.2 Å²	53.2	2%	0.016	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	123.7	167.8	-55.7	-178.6	0	0	0	109.4	L434 M439 V453 I478 I480 L495 V505 Q506 A507	L434-L436 HydrophobicContact CD2-CD2 3.88Å; L434-L436 HydrophobicContact CD2-CG 4.33Å; L434-L436 HydrophobicContact CG-CD2 4.03Å; L434-L436 HydrophobicContact CG-CG 4.44Å; L436-M439 HydrophobicContact CB-CG 4.12Å; L436-M439 HydrophobicContact CB-SD 3.79Å; L436-M439 HydrophobicContact CD1-SD 3.48Å; L436-M439 WeakPolarHBondContact CD1-SD 3.36Å; L436-M439 HydrophobicContact CG-SD 4.25Å; L436-V453 HydrophobicContact CD1-CG1 4.41Å; L436-I478 HydrophobicContact CB-CB 4.4Å; L436-I478 PolarHBondContact N-O 2.36Å; L436-I478 PolarHBondContact O-N 3.19Å; L436-I480 HydrophobicContact CD1-CD1 3.51Å; L436-I480 HydrophobicContact CG-CD1 3.75Å; L436-L495 HydrophobicContact CD1-CD1 4.14Å; L436-L495 HydrophobicContact CD2-CB 4.23Å; L436-L495 HydrophobicContact CD2-CD1 4.23Å; L436-V505 HydrophobicContact CB-CG1 4.41Å; L436-V505 HydrophobicContact CD2-CG1 4.17Å; L436-Q506 WeakPolarHBondContact CA-O 3.34Å; L436-A507 HydrophobicContact CD2-CB 3.4Å
437	E	86.8	Confident	78.5	Confident	25 Å²	25	54.7 Å²	54.7	12%	0.117	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	156.4	175.8	-46.9	-173	107.8	0	0	110.6	L435 M439 R477 Q506 R508	L435-E437 HydrophobicContact CD1-CG 4.04Å; L435-E437 HydrophobicContact CD2-CG 4Å; L435-E437 HydrophobicContact CG-CG 3.81Å; E437-M439 PolarHBondContact O-N 3.31Å; E437-R477 HydrophobicContact CG-CG 4.43Å; E437-R477 IonicContact OE1-CZ 2.78Å; E437-R477 VanDerWaalsContact OE1-CZ 3.25Å; E437-R477 IonicContact OE1-NE 3.66Å; E437-R477 PolarHBondContact OE1-NE 2.89Å; E437-R477 IonicContact OE1-NH2 3.61Å; E437-R477 PolarHBondContact OE1-NH2 2.78Å; E437-Q506 HydrophobicContact CB-CB 4.32Å; E437-Q506 PolarHBondContact N-O 3.12Å; E437-Q506 PolarHBondContact O-N 3.23Å; E437-R508 IonicContact OE2-CZ 2.72Å; E437-R508 IonicContact OE2-NE 3.36Å; E437-R508 IonicContact OE2-NH1 3.41Å; E437-R508 PolarHBondContact OE2-NH1 2.95Å; E437-R508 IonicContact OE2-NH2 2.72Å; E437-R508 PolarHBondContact OE2-NH2 3.37Å
438	N	83.9	Confident	80	Confident	54 Å²	54	58.1 Å²	58.1	29%	0.289	30%	0.301	S	S	.	.	E	Extended strand (participates in β ladder)	trans	58.8	25.5	175.6	-169.8	47.7	0	0	0	115.2	R503 V504	N438-R503 VanDerWaalsContact O-CB 3.29Å; N438-R503 WeakPolarHBondContact O-CB 2.87Å; N438-V504 PolarHBondContact ND2-O 3.31Å
439	M	78.3	Confident	81.2	Confident	16 Å²	16	54.6 Å²	54.6	8%	0.079	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.8	-48.3	172.2	-67.3	-163.1	66.5	0	0	112.3	L436 E437 V453 I478 F500 V505	L436-M439 HydrophobicContact CB-CG 4.12Å; L436-M439 HydrophobicContact CB-SD 3.79Å; L436-M439 HydrophobicContact CD1-SD 3.48Å; L436-M439 WeakPolarHBondContact CD1-SD 3.36Å; L436-M439 HydrophobicContact CG-SD 4.25Å; E437-M439 PolarHBondContact O-N 3.31Å; M439-V453 HydrophobicContact CE-CG2 4.12Å; M439-V453 HydrophobicContact SD-CG2 4.31Å; M439-I478 HydrophobicContact SD-CD1 4.07Å; M439-F500 HydrophobicContact CE-CB 4.46Å; M439-F500 HydrophobicContact CE-CD1 4.4Å; M439-F500 HydrophobicContact CE-CD2 4.03Å; M439-F500 HydrophobicContact CE-CE2 4.37Å; M439-F500 HydrophobicContact CE-CG 4.04Å; M439-F500 WeakPolarHBondContact O-CD1 3.36Å; M439-V505 HydrophobicContact CE-CG2 4.41Å; M439-V505 HydrophobicContact CG-CB 4.32Å; M439-V505 HydrophobicContact CG-CG1 3.7Å; M439-V505 HydrophobicContact CG-CG2 3.82Å; M439-V505 HydrophobicContact SD-CG1 4.32Å
440	V	79.1	Confident	82.3	Confident	6 Å²	6	57 Å²	57	4%	0.036	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.8	149.2	-163.7	-175.6	0	0	0	0	109.2	E444 V445 L449 V476 F500	V440-E444 VanDerWaalsContact CG1-C 3.49Å; V440-E444 HydrophobicContact CG1-CB 3.48Å; V440-E444 VanDerWaalsContact CG1-CB 3.48Å; V440-E444 WeakPolarHBondContact CG1-O 3.25Å; V440-V445 HydrophobicContact CG1-CG2 4.09Å; V440-L449 HydrophobicContact CB-CD2 4.16Å; V440-L449 HydrophobicContact CG1-CD2 4.13Å; V440-L449 HydrophobicContact CG2-CD1 3.78Å; V440-L449 HydrophobicContact CG2-CD2 3.85Å; V440-L449 HydrophobicContact CG2-CG 4.5Å; V440-V476 WeakPolarHBondContact O-CB 3.28Å; V440-V476 VanDerWaalsContact O-CG2 3.31Å; V440-V476 WeakPolarHBondContact O-CG2 3.3Å; V440-F500 HydrophobicContact CG2-CD1 4.07Å; V440-F500 HydrophobicContact CG2-CE1 3.73Å
441	G	78.2	Confident	83.1	Confident	7 Å²	7	57.8 Å²	57.8	7%	0.072	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.6	159.6	171.2	0	0	0	0	0	112.6	N443 E444 R503	G441-N443 PolarHBondContact O-N 3.46Å; G441-E444 PolarHBondContact N-OE2 3.33Å; G441-E444 WeakPolarHBondContact O-CA 3.34Å; G441-E444 WeakPolarHBondContact O-CB 3.47Å; G441-E444 PolarHBondContact O-N 2.93Å; G441-R503 VanDerWaalsContact CA-NH2 3.32Å
442	V	76.5	Confident	83.2	Confident	53 Å²	53	62.3 Å²	62.3	32%	0.321	31%	0.313	S	S	.	.	G	3₁₀ helix	trans	-51	-33	-178.8	-172.7	0	0	0	0	114.1	E444 I470 Q474	V442-E444 PolarHBondContact O-N 2.79Å; V442-I470 HydrophobicContact CG1-CG2 4.08Å; V442-I470 HydrophobicContact CG2-CG2 3.78Å; V442-Q474 HydrophobicContact CG2-CB 3.7Å; V442-Q474 HydrophobicContact CG2-CG 4.27Å; V442-Q474 WeakPolarHBondContact CG2-O 3.17Å
443	N	77.3	Confident	83.2	Confident	157 Å²	157	58.7 Å²	58.7	84%	0.84	30%	0.299	S	S	*	.	G	3₁₀ helix	trans	-80.6	0.3	-179.4	-54.5	-32.8	0	0	0	114.1	G441	G441-N443 PolarHBondContact O-N 3.46Å
444	E	78.7	Confident	83.1	Confident	87 Å²	87	63 Å²	63	41%	0.407	32%	0.321	S	S	.	.	G	3₁₀ helix	trans	-125.7	9.8	-173	-59.4	166	143.4	0	0	110.9	V440 G441 V442 D446 R503	V440-E444 VanDerWaalsContact CG1-C 3.49Å; V440-E444 HydrophobicContact CG1-CB 3.48Å; V440-E444 VanDerWaalsContact CG1-CB 3.48Å; V440-E444 WeakPolarHBondContact CG1-O 3.25Å; G441-E444 PolarHBondContact N-OE2 3.33Å; G441-E444 WeakPolarHBondContact O-CA 3.34Å; G441-E444 WeakPolarHBondContact O-CB 3.47Å; G441-E444 PolarHBondContact O-N 2.93Å; V442-E444 PolarHBondContact O-N 2.79Å; E444-D446 PolarHBondContact O-N 2.78Å; E444-R503 IonicContact OE2-CZ 3.17Å; E444-R503 IonicContact OE2-NE 3.4Å; E444-R503 IonicContact OE2-NH2 3.27Å; E444-R503 PolarHBondContact OE2-NH2 3.27Å
445	V	77.7	Confident	82.9	Confident	40 Å²	40	70.3 Å²	70.3	24%	0.242	36%	0.355	C	S	.	.			trans	-88.9	86	177.8	-176	0	0	0	0	109.6	V440 L449 I468 I470 V476	V440-V445 HydrophobicContact CG1-CG2 4.09Å; V445-L449 HydrophobicContact CG1-CD2 4.24Å; V445-L449 HydrophobicContact CG2-CD2 4.47Å; V445-I468 HydrophobicContact CG1-CG2 4.32Å; V445-I470 HydrophobicContact CB-CD1 4.47Å; V445-I470 HydrophobicContact CG1-CD1 4.3Å; V445-I470 HydrophobicContact CG2-CD1 4.35Å; V445-V476 HydrophobicContact CG2-CG1 4.24Å; V445-V476 HydrophobicContact CG2-CG2 3.73Å
446	D	81	Confident	82.7	Confident	118 Å²	118	73.5 Å²	73.5	63%	0.631	37%	0.37	S	S	*	.			trans	-92.5	160.4	171.9	-68.4	-55.5	0	0	0	111.7	E444 E448 L449	E444-D446 PolarHBondContact O-N 2.78Å; D446-E448 PolarHBondContact O-N 2.88Å; D446-E448 VanDerWaalsContact O-N 3.12Å; D446-L449 VanDerWaalsContact O-CB 3.31Å; D446-L449 WeakPolarHBondContact O-CB 3.29Å; D446-L449 PolarHBondContact O-N 3.43Å; D446-L449 VanDerWaalsContact O-N 3.08Å
447	D	80.5	Confident	82.6	Confident	164 Å²	164	73.4 Å²	73.4	88%	0.877	37%	0.369	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.3	-27.9	-179	-70.7	-44.2	0	0	0	113.1	L449	D447-L449 VanDerWaalsContact C-N 3.29Å; D447-L449 PolarHBondContact O-N 2.9Å
448	E	82.1	Confident	82.6	Confident	150 Å²	150	74.4 Å²	74.4	70%	0.701	39%	0.386	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.3	-24.3	179.8	-60.9	-177	173.9	0	0	112.8	D446 Q450 E451 E452	D446-E448 PolarHBondContact O-N 2.88Å; D446-E448 VanDerWaalsContact O-N 3.12Å; E448-Q450 PolarHBondContact O-N 3.4Å; E448-E451 PolarHBondContact O-N 2.78Å; E448-E452 PolarHBondContact O-N 2.89Å; E448-E452 VanDerWaalsContact O-N 3.09Å
449	L	84.2	Confident	82.8	Confident	9 Å²	9	77.6 Å²	77.6	5%	0.047	40%	0.403	C	S	.	.	H	α-helix	trans	-60	-32.5	-177.1	179.3	61.4	0	0	0	113.1	V440 V445 D446 D447 E451 V453 I468 I478 F500	V440-L449 HydrophobicContact CB-CD2 4.16Å; V440-L449 HydrophobicContact CG1-CD2 4.13Å; V440-L449 HydrophobicContact CG2-CD1 3.78Å; V440-L449 HydrophobicContact CG2-CD2 3.85Å; V440-L449 HydrophobicContact CG2-CG 4.5Å; V445-L449 HydrophobicContact CG1-CD2 4.24Å; V445-L449 HydrophobicContact CG2-CD2 4.47Å; D446-L449 VanDerWaalsContact O-CB 3.31Å; D446-L449 WeakPolarHBondContact O-CB 3.29Å; D446-L449 PolarHBondContact O-N 3.43Å; D446-L449 VanDerWaalsContact O-N 3.08Å; D447-L449 VanDerWaalsContact C-N 3.29Å; D447-L449 PolarHBondContact O-N 2.9Å; L449-E451 VanDerWaalsContact C-N 3.31Å; L449-V453 HydrophobicContact CD1-CG2 3.99Å; L449-V453 HydrophobicContact CG-CG2 4.47Å; L449-V453 WeakPolarHBondContact O-CG2 3.39Å; L449-V453 PolarHBondContact O-N 3.31Å; L449-V453 VanDerWaalsContact O-N 3.11Å; L449-I468 HydrophobicContact CD2-CD1 4.32Å; L449-I468 HydrophobicContact CG-CD1 4.34Å; L449-I478 HydrophobicContact CD2-CD1 4.19Å; L449-I478 HydrophobicContact CG-CD1 4.44Å; L449-F500 HydrophobicContact CD1-CZ 4.45Å
450	Q	84.8	Confident	83.2	Confident	97 Å²	97	80.3 Å²	80.3	45%	0.453	41%	0.413	S	S	.	.	H	α-helix	trans	-68.4	-33.6	177.6	-164.1	-170.6	-91.6	0	0	111.5	E448 M454 V466 I468	E448-Q450 PolarHBondContact O-N 3.4Å; Q450-M454 WeakPolarHBondContact O-CB 3.28Å; Q450-M454 PolarHBondContact O-N 3.19Å; Q450-V466 HydrophobicContact CG-CB 4.31Å; Q450-V466 HydrophobicContact CG-CG1 4.17Å; Q450-I468 HydrophobicContact CB-CD1 4.14Å
451	E	85.8	Confident	83.6	Confident	136 Å²	136	80.8 Å²	80.8	64%	0.636	42%	0.42	S	S	*	.	H	α-helix	trans	-76.4	-42.6	178.3	-59.3	-162.1	160.9	0	0	110.9	E448 L449 V453 M454 E455	E448-E451 PolarHBondContact O-N 2.78Å; L449-E451 VanDerWaalsContact C-N 3.31Å; E451-V453 PolarHBondContact O-N 3.3Å; E451-M454 PolarHBondContact O-N 3.22Å; E451-E455 PolarHBondContact O-N 3.23Å
452	E	85.9	Confident	84.1	Confident	100 Å²	100	84.1 Å²	84.1	47%	0.467	44%	0.441	S	S	.	.	H	α-helix	trans	-58.1	-49.2	174.9	-68.3	-164.5	148.6	0	0	112.6	E448 M454 E455 E456 F500	E448-E452 PolarHBondContact O-N 2.89Å; E448-E452 VanDerWaalsContact O-N 3.09Å; E452-M454 VanDerWaalsContact C-N 3.28Å; E452-M454 PolarHBondContact O-N 3.04Å; E452-E455 PolarHBondContact O-N 2.99Å; E452-E456 PolarHBondContact O-N 3.13Å; E452-F500 WeakPolarHBondContact OE2-CZ 3.43Å
453	V	86.4	Confident	84.7	Confident	5 Å²	5	83.4 Å²	83.4	3%	0.03	44%	0.437	C	S	.	.	H	α-helix	trans	-65.9	-33.9	179.2	174.4	0	0	0	0	111.2	L436 M439 L449 E451 C457 I478 I480	L436-V453 HydrophobicContact CD1-CG1 4.41Å; M439-V453 HydrophobicContact CE-CG2 4.12Å; M439-V453 HydrophobicContact SD-CG2 4.31Å; L449-V453 HydrophobicContact CD1-CG2 3.99Å; L449-V453 HydrophobicContact CG-CG2 4.47Å; L449-V453 WeakPolarHBondContact O-CG2 3.39Å; L449-V453 PolarHBondContact O-N 3.31Å; L449-V453 VanDerWaalsContact O-N 3.11Å; E451-V453 PolarHBondContact O-N 3.3Å; V453-C457 WeakPolarHBondContact O-CB 3.39Å; V453-C457 PolarHBondContact O-N 2.83Å; V453-C457 PolarHBondContact O-SG 3.38Å; V453-I478 HydrophobicContact CG1-CG2 4.12Å; V453-I478 HydrophobicContact CG2-CD1 4.08Å; V453-I480 HydrophobicContact CG1-CD1 3.95Å; V453-I480 HydrophobicContact CG1-CG1 4.11Å
454	M	87.2	Confident	85.1	Confident	92 Å²	92	80.6 Å²	80.6	45%	0.453	42%	0.422	S	S	.	.	H	α-helix	trans	-69.4	-39.9	176.1	-177.4	174.7	63	0	0	112.3	Q450 E451 E452 G458 V466	Q450-M454 WeakPolarHBondContact O-CB 3.28Å; Q450-M454 PolarHBondContact O-N 3.19Å; E451-M454 PolarHBondContact O-N 3.22Å; E452-M454 VanDerWaalsContact C-N 3.28Å; E452-M454 PolarHBondContact O-N 3.04Å; M454-G458 PolarHBondContact O-N 3.06Å; M454-V466 HydrophobicContact CB-CG2 4.47Å
455	E	87.9	Confident	85.4	Confident	153 Å²	153	81.4 Å²	81.4	72%	0.715	42%	0.421	S	S	*	.	H	α-helix	trans	-67.8	-46	176.2	-174.5	168.4	-157.9	0	0	111.5	E451 E452 G458 N459	E451-E455 PolarHBondContact O-N 3.23Å; E452-E455 PolarHBondContact O-N 2.99Å; E455-G458 PolarHBondContact O-N 2.94Å; E455-N459 PolarHBondContact O-ND2 3.39Å; E455-N459 VanDerWaalsContact O-ND2 3.17Å
456	E	85.7	Confident	85.9	Confident	72 Å²	72	80.5 Å²	80.5	34%	0.336	42%	0.416	S	S	.	.	H	α-helix	trans	-62.1	-43.9	175.9	-80.4	-76.1	-178.5	0	0	112.2	E452 N459 Y460 R498	E452-E456 PolarHBondContact O-N 3.13Å; E456-N459 PolarHBondContact O-N 3.23Å; E456-Y460 WeakPolarHBondContact O-CD2 3.31Å; E456-Y460 WeakPolarHBondContact O-CE2 3.27Å; E456-R498 IonicContact OE1-CZ 2.74Å; E456-R498 IonicContact OE1-NH1 2.83Å; E456-R498 IonicContact OE1-NH2 2.8Å; E456-R498 PolarHBondContact OE1-NH2 2.77Å; E456-R498 IonicContact OE2-CZ 3.88Å; E456-R498 IonicContact OE2-NH1 3.69Å; E456-R498 PolarHBondContact OE2-NH1 3.24Å; E456-R498 IonicContact OE2-NH2 3.2Å; E456-R498 PolarHBondContact OE2-NH2 3.02Å
457	C	86.3	Confident	86.1	Confident	1 Å²	1	76.6 Å²	76.6	1%	0.007	39%	0.394	C	S	.	.	H	α-helix	trans	-70	-31.4	176.5	-68.1	0	0	0	0	112.9	V453 N459 Y460 G461 V463 I480 F482	V453-C457 WeakPolarHBondContact O-CB 3.39Å; V453-C457 PolarHBondContact O-N 2.83Å; V453-C457 PolarHBondContact O-SG 3.38Å; C457-N459 PolarHBondContact O-N 2.67Å; C457-Y460 PolarHBondContact O-N 2.92Å; C457-G461 PolarHBondContact O-N 3.41Å; C457-V463 HydrophobicContact CB-CG2 3.82Å; C457-I480 HydrophobicContact CB-CG2 4.26Å; C457-F482 HydrophobicContact CB-CE1 4.5Å; C457-F482 HydrophobicContact CB-CZ 4.05Å
458	G	87.8	Confident	86.4	Confident	45 Å²	45	71 Å²	71	46%	0.464	36%	0.364	S	S	.	.	H	α-helix	trans	-61.6	-20.9	177.7	0	0	0	0	0	114.3	M454 E455 Y460	M454-G458 PolarHBondContact O-N 3.06Å; E455-G458 PolarHBondContact O-N 2.94Å; G458-Y460 PolarHBondContact O-N 3.34Å
459	N	88.3	Confident	86.3	Confident	122 Å²	122	65.9 Å²	65.9	65%	0.652	34%	0.34	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.2	-18.4	171.9	-69.3	-60.6	0	0	0	113.8	E455 E456 C457	E455-N459 PolarHBondContact O-ND2 3.39Å; E455-N459 VanDerWaalsContact O-ND2 3.17Å; E456-N459 PolarHBondContact O-N 3.23Å; C457-N459 PolarHBondContact O-N 2.67Å
460	Y	86.7	Confident	86.2	Confident	72 Å²	72	69.2 Å²	69.2	28%	0.282	36%	0.357	S	S	.	.	T	Hydrogen-bonded Turn	trans	-104.6	-24	-176.8	-59.5	-79.6	0	0	0	113.8	E456 C457 G458 A491 A494 L495	E456-Y460 WeakPolarHBondContact O-CD2 3.31Å; E456-Y460 WeakPolarHBondContact O-CE2 3.27Å; C457-Y460 PolarHBondContact O-N 2.92Å; G458-Y460 PolarHBondContact O-N 3.34Å; Y460-A491 HydrophobicContact CD2-CB 4.23Å; Y460-A491 HydrophobicContact CG-CB 4.01Å; Y460-A494 HydrophobicContact CD1-CB 4.21Å; Y460-A494 HydrophobicContact CE1-CB 3.31Å; Y460-A494 WeakPolarHBondContact OH-CB 3.27Å; Y460-L495 HydrophobicContact CE2-CD2 4.18Å; Y460-L495 HydrophobicContact CE2-CG 4.35Å
461	G	86.2	Confident	85.6	Confident	17 Å²	17	66 Å²	66	18%	0.175	34%	0.343	C	S	.	.	S	Bend	trans	170.4	-175.6	177.6	0	0	0	0	0	114.6	C457 V463 D487	C457-G461 PolarHBondContact O-N 3.41Å; G461-V463 PolarHBondContact O-N 2.84Å; G461-D487 WeakPolarHBondContact CA-OD2 3.44Å
462	S	88.5	Confident	84.7	Confident	76 Å²	76	66.9 Å²	66.9	53%	0.531	36%	0.357	S	S	.	.			trans	-77.7	107.5	-177.5	-65	0	0	0	0	111.3	F482 D483 D487	S462-F482 CarbonylContact O-C 3.56Å; S462-F482 WeakPolarHBondContact O-CA 3.31Å; S462-D483 PolarHBondContact O-N 3.02Å; S462-D487 PolarHBondContact N-OD2 3.16Å
463	V	89.6	Confident	83.9	Confident	39 Å²	39	65.2 Å²	65.2	24%	0.236	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.4	126.3	174	178.9	0	0	0	0	110.5	C457 G461 V466 I480 F482	C457-V463 HydrophobicContact CB-CG2 3.82Å; G461-V463 PolarHBondContact O-N 2.84Å; V463-V466 HydrophobicContact CG1-CG2 3.77Å; V463-I480 HydrophobicContact CB-CG2 4.4Å; V463-I480 HydrophobicContact CG1-CG2 3.76Å; V463-I480 HydrophobicContact CG2-CG2 3.79Å; V463-F482 HydrophobicContact CG2-CD1 4.28Å; V463-F482 HydrophobicContact CG2-CE1 3.94Å; V463-F482 HydrophobicContact CG2-CZ 4.35Å
464	L	86.3	Confident	83.1	Confident	98 Å²	98	71.7 Å²	71.7	51%	0.513	39%	0.387	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.2	-35.8	175.8	-67.2	179.1	0	0	0	112.8	Q481 D483	L464-Q481 HydrophobicContact CB-CG 4.36Å; L464-Q481 HydrophobicContact CD1-CG 4.45Å; L464-Q481 PolarHBondContact N-O 3.46Å; L464-D483 HydrophobicContact CD1-CB 4.37Å; L464-D483 HydrophobicContact CD2-CB 4.42Å; L464-D483 HydrophobicContact CG-CB 4.26Å
465	R	85.4	Confident	82.7	Confident	104 Å²	104	71.3 Å²	71.3	39%	0.392	39%	0.386	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.4	137	-177.6	-169.4	174.8	-176.1	-166.6	0.9	110.1	Q481 H518	R465-Q481 HydrophobicContact CB-CB 4.18Å; R465-Q481 PolarHBondContact N-O 2.87Å; R465-Q481 PolarHBondContact O-N 2.72Å; R465-H518 PolarHBondContact NH1-NE2 3.37Å; R465-H518 PolarHBondContact NH2-CE1 2.69Å; R465-H518 VanDerWaalsContact NH2-CE1 3.26Å; R465-H518 PolarHBondContact NH2-NE2 2.98Å; R465-H518 VanDerWaalsContact NH2-NE2 3.17Å
466	V	87.6	Confident	82.5	Confident	21 Å²	21	64.1 Å²	64.1	13%	0.127	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110	143.8	162.6	-176.8	0	0	0	0	107.5	Q450 M454 V463 I478 F479 I480	Q450-V466 HydrophobicContact CG-CB 4.31Å; Q450-V466 HydrophobicContact CG-CG1 4.17Å; M454-V466 HydrophobicContact CB-CG2 4.47Å; V463-V466 HydrophobicContact CG1-CG2 3.77Å; V466-I478 HydrophobicContact CG1-CG2 3.89Å; V466-F479 CarbonylContact C-O 3.54Å; V466-F479 WeakPolarHBondContact CA-O 3.48Å; V466-I480 HydrophobicContact CG1-CG1 4.44Å; V466-I480 HydrophobicContact CG2-CG1 4.35Å
467	L	84.2	Confident	82.5	Confident	35 Å²	35	61.2 Å²	61.2	18%	0.183	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.8	113.3	177.5	-178.9	69.3	0	0	0	109.2	F479 F515 L520	L467-F479 HydrophobicContact CB-CB 4.34Å; L467-F479 PolarHBondContact N-O 2.94Å; L467-F479 PolarHBondContact O-N 2.86Å; L467-F515 HydrophobicContact CB-CE2 4.26Å; L467-F515 HydrophobicContact CD2-CE2 3.98Å; L467-L520 HydrophobicContact CD2-CD1 3.67Å; L467-L520 HydrophobicContact CD2-CD2 3.89Å; L467-L520 HydrophobicContact CD2-CG 4.46Å
468	I	86.8	Confident	82.6	Confident	47 Å²	47	61.2 Å²	61.2	24%	0.241	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.1	120.6	174.5	-58.3	171.9	0	0	0	107.7	V445 L449 Q450 V476 I478	V445-I468 HydrophobicContact CG1-CG2 4.32Å; L449-I468 HydrophobicContact CD2-CD1 4.32Å; L449-I468 HydrophobicContact CG-CD1 4.34Å; Q450-I468 HydrophobicContact CB-CD1 4.14Å; I468-V476 HydrophobicContact CG2-CG1 3.84Å; I468-I478 HydrophobicContact CG1-CD1 4.46Å; I468-I478 HydrophobicContact CG1-CG1 4.27Å; I468-I478 HydrophobicContact CG1-CG2 4.06Å; I468-I478 HydrophobicContact CG2-CG1 4.48Å
469	H	81.5	Confident	82.7	Confident	43 Å²	43	59 Å²	59	20%	0.199	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	122	177.5	-179.9	61.1	0	0	0	108.8	R477 F479 L520 D521	H469-R477 HydrophobicContact CB-CB 4.39Å; H469-R477 PolarHBondContact N-O 3.41Å; H469-R477 PolarHBondContact O-N 3.14Å; H469-F479 HydrophobicContact CB-CD2 4.41Å; H469-F479 HydrophobicContact CB-CE2 4.04Å; H469-L520 HydrophobicContact CB-CB 4.43Å; H469-L520 HydrophobicContact CB-CD1 4.12Å; H469-D521 IonicContact CD2-OD1 3Å; H469-D521 IonicContact CE1-OD1 2.64Å; H469-D521 IonicContact NE2-OD1 3.11Å; H469-D521 PolarHBondContact NE2-OD1 2.99Å; H469-D521 IonicContact NE2-OD2 3.55Å
470	I	82	Confident	82.8	Confident	79 Å²	79	53.2 Å²	53.2	41%	0.405	29%	0.285	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.2	110.2	178.2	-55.9	-180	0	0	0	107.5	V442 V445	V442-I470 HydrophobicContact CG1-CG2 4.08Å; V442-I470 HydrophobicContact CG2-CG2 3.78Å; V445-I470 HydrophobicContact CB-CD1 4.47Å; V445-I470 HydrophobicContact CG1-CD1 4.3Å; V445-I470 HydrophobicContact CG2-CD1 4.35Å
471	M	71.9	Confident	83	Confident	30 Å²	30	51.2 Å²	51.2	15%	0.148	28%	0.279	C	S	.	.			trans	-71.6	153.5	-179.9	-62.9	-175.4	77.6	0	0	111.3	S473 Q474 D475 R477	M471-S473 WeakPolarHBondContact CB-OG 3.27Å; M471-S473 PolarHBondContact O-N 3.06Å; M471-S473 VanDerWaalsContact O-N 3.13Å; M471-Q474 PolarHBondContact O-N 3.47Å; M471-Q474 VanDerWaalsContact O-N 3.09Å; M471-D475 HydrophobicContact CB-CB 4.39Å; M471-D475 WeakPolarHBondContact CB-O 3.48Å; M471-D475 PolarHBondContact N-O 2.81Å; M471-D475 HydrophobicContact SD-CB 4.23Å; M471-R477 HydrophobicContact CG-CG 4.23Å; M471-R477 VanDerWaalsContact SD-CD 3.55Å; M471-R477 HydrophobicContact SD-CG 3.81Å; M471-R477 VanDerWaalsContact SD-CZ 3.55Å; M471-R477 PolarHBondContact SD-NE 3.25Å
472	T	67.3	Low	83.2	Confident	154 Å²	154	50.4 Å²	50.4	95%	0.945	27%	0.27	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.9	-17.9	175.7	56.2	0	0	0	0	113.5	Q474	T472-Q474 VanDerWaalsContact C-N 3.26Å; T472-Q474 PolarHBondContact O-N 3.41Å
473	S	69.1	Low	83.2	Confident	64 Å²	64	50.7 Å²	50.7	45%	0.448	27%	0.266	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.3	-7.1	174.2	58	0	0	0	0	115	M471 D475	M471-S473 WeakPolarHBondContact CB-OG 3.27Å; M471-S473 PolarHBondContact O-N 3.06Å; M471-S473 VanDerWaalsContact O-N 3.13Å; S473-D475 VanDerWaalsContact C-N 3.34Å; S473-D475 VanDerWaalsContact CB-OD2 3.23Å; S473-D475 WeakPolarHBondContact CB-OD2 3.43Å; S473-D475 PolarHBondContact OG-N 2.96Å; S473-D475 PolarHBondContact OG-OD2 2.83Å
474	Q	69.2	Low	83.1	Confident	142 Å²	142	54.9 Å²	54.9	66%	0.664	28%	0.277	S	S	*	.	S	Bend	trans	74.5	14.3	-166	-51.3	-173.1	-7.8	0	0	115.4	V442 M471 T472	V442-Q474 HydrophobicContact CG2-CB 3.7Å; V442-Q474 HydrophobicContact CG2-CG 4.27Å; V442-Q474 WeakPolarHBondContact CG2-O 3.17Å; M471-Q474 PolarHBondContact O-N 3.47Å; M471-Q474 VanDerWaalsContact O-N 3.09Å; T472-Q474 VanDerWaalsContact C-N 3.26Å; T472-Q474 PolarHBondContact O-N 3.41Å
475	D	78.1	Confident	83.2	Confident	84 Å²	84	51.3 Å²	51.3	45%	0.449	26%	0.261	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.1	142.7	168.4	-60	-67	0	0	0	111.2	M471 S473	M471-D475 HydrophobicContact CB-CB 4.39Å; M471-D475 WeakPolarHBondContact CB-O 3.48Å; M471-D475 PolarHBondContact N-O 2.81Å; M471-D475 HydrophobicContact SD-CB 4.23Å; S473-D475 VanDerWaalsContact C-N 3.34Å; S473-D475 VanDerWaalsContact CB-OD2 3.23Å; S473-D475 WeakPolarHBondContact CB-OD2 3.43Å; S473-D475 PolarHBondContact OG-N 2.96Å; S473-D475 PolarHBondContact OG-OD2 2.83Å
476	V	83.7	Confident	83.4	Confident	1 Å²	1	50.3 Å²	50.3	1%	0.006	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	120.5	174.7	-175.2	0	0	0	0	108.8	V440 V445 I468 I478	V440-V476 WeakPolarHBondContact O-CB 3.28Å; V440-V476 VanDerWaalsContact O-CG2 3.31Å; V440-V476 WeakPolarHBondContact O-CG2 3.3Å; V445-V476 HydrophobicContact CG2-CG1 4.24Å; V445-V476 HydrophobicContact CG2-CG2 3.73Å; I468-V476 HydrophobicContact CG2-CG1 3.84Å; V476-I478 HydrophobicContact CG1-CG1 4.14Å
477	R	86.8	Confident	83.5	Confident	12 Å²	12	50.5 Å²	50.5	5%	0.045	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105	127.7	173.9	-74.6	-168.5	160.5	153.3	3.2	109.6	L435 E437 H469 M471 F479 L520 D522	L435-R477 HydrophobicContact CD1-CB 3.73Å; L435-R477 HydrophobicContact CD1-CG 3.9Å; E437-R477 HydrophobicContact CG-CG 4.43Å; E437-R477 IonicContact OE1-CZ 2.78Å; E437-R477 VanDerWaalsContact OE1-CZ 3.25Å; E437-R477 IonicContact OE1-NE 3.66Å; E437-R477 PolarHBondContact OE1-NE 2.89Å; E437-R477 IonicContact OE1-NH2 3.61Å; E437-R477 PolarHBondContact OE1-NH2 2.78Å; H469-R477 HydrophobicContact CB-CB 4.39Å; H469-R477 PolarHBondContact N-O 3.41Å; H469-R477 PolarHBondContact O-N 3.14Å; M471-R477 HydrophobicContact CG-CG 4.23Å; M471-R477 VanDerWaalsContact SD-CD 3.55Å; M471-R477 HydrophobicContact SD-CG 3.81Å; M471-R477 VanDerWaalsContact SD-CZ 3.55Å; M471-R477 PolarHBondContact SD-NE 3.25Å; R477-F479 HydrophobicContact CB-CD2 4.36Å; R477-F479 HydrophobicContact CB-CE2 3.67Å; R477-F479 HydrophobicContact CB-CZ 4.28Å; R477-L520 PolarHBondContact NH1-O 2.52Å; R477-L520 VanDerWaalsContact NH1-O 3.15Å; R477-D522 IonicContact CZ-OD1 3.58Å; R477-D522 IonicContact CZ-OD2 3.55Å; R477-D522 IonicContact NH1-OD1 2.71Å; R477-D522 IonicContact NH1-OD2 3.6Å; R477-D522 PolarHBondContact NH1-OD2 3.5Å; R477-D522 VanDerWaalsContact NH2-CG 3.28Å; R477-D522 IonicContact NH2-OD1 3.53Å; R477-D522 PolarHBondContact NH2-OD1 3.15Å; R477-D522 IonicContact NH2-OD2 2.74Å; R477-D522 PolarHBondContact NH2-OD2 3.39Å
478	I	88.1	Confident	83.8	Confident	0 Å²	0	48.9 Å²	48.9	0%	0	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	115.5	177.6	-48.1	-178.2	0	0	0	108.7	L436 M439 L449 V453 V466 I468 V476 I480	L436-I478 HydrophobicContact CB-CB 4.4Å; L436-I478 PolarHBondContact N-O 2.36Å; L436-I478 PolarHBondContact O-N 3.19Å; M439-I478 HydrophobicContact SD-CD1 4.07Å; L449-I478 HydrophobicContact CD2-CD1 4.19Å; L449-I478 HydrophobicContact CG-CD1 4.44Å; V453-I478 HydrophobicContact CG1-CG2 4.12Å; V453-I478 HydrophobicContact CG2-CD1 4.08Å; V466-I478 HydrophobicContact CG1-CG2 3.89Å; I468-I478 HydrophobicContact CG1-CD1 4.46Å; I468-I478 HydrophobicContact CG1-CG1 4.27Å; I468-I478 HydrophobicContact CG1-CG2 4.06Å; I468-I478 HydrophobicContact CG2-CG1 4.48Å; V476-I478 HydrophobicContact CG1-CG1 4.14Å; I478-I480 HydrophobicContact CG2-CD1 4.18Å; I478-I480 HydrophobicContact CG2-CG1 4.5Å
479	F	90.5	Very high	84	Confident	0 Å²	0	49.4 Å²	49.4	0%	0	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.9	125.7	179.8	-61.5	-99.8	0	0	0	109.7	V433 L434 L435 V466 L467 H469 R477 Y510 F515 L520	V433-F479 HydrophobicContact CG1-CB 4.47Å; V433-F479 HydrophobicContact CG1-CD1 4.35Å; L434-F479 CarbonylContact O-C 3.59Å; L434-F479 WeakPolarHBondContact O-CA 3.24Å; L435-F479 HydrophobicContact CB-CD1 4.33Å; L435-F479 HydrophobicContact CB-CE1 4.33Å; L435-F479 HydrophobicContact CD1-CD1 4.15Å; L435-F479 HydrophobicContact CD1-CD2 4.33Å; L435-F479 HydrophobicContact CD1-CE1 3.87Å; L435-F479 HydrophobicContact CD1-CE2 4.05Å; L435-F479 HydrophobicContact CD1-CG 4.37Å; L435-F479 HydrophobicContact CD1-CZ 3.81Å; L435-F479 HydrophobicContact CD2-CE1 4.34Å; L435-F479 HydrophobicContact CG-CE1 4.41Å; V466-F479 CarbonylContact C-O 3.54Å; V466-F479 WeakPolarHBondContact CA-O 3.48Å; L467-F479 HydrophobicContact CB-CB 4.34Å; L467-F479 PolarHBondContact N-O 2.94Å; L467-F479 PolarHBondContact O-N 2.86Å; H469-F479 HydrophobicContact CB-CD2 4.41Å; H469-F479 HydrophobicContact CB-CE2 4.04Å; R477-F479 HydrophobicContact CB-CD2 4.36Å; R477-F479 HydrophobicContact CB-CE2 3.67Å; R477-F479 HydrophobicContact CB-CZ 4.28Å; F479-Y510 HydrophobicContact CD1-CD1 4.13Å; F479-Y510 HydrophobicContact CD1-CG 4.23Å; F479-Y510 AromaticContact CE1-CD1 3.78Å; F479-Y510 HydrophobicContact CE1-CD1 3.78Å; F479-Y510 AromaticContact CE1-CD2 3.95Å; F479-Y510 HydrophobicContact CE1-CD2 3.95Å; F479-Y510 AromaticContact CE1-CE1 3.83Å; F479-Y510 HydrophobicContact CE1-CE1 3.83Å; F479-Y510 HydrophobicContact CE1-CE2 4.01Å; F479-Y510 AromaticContact CE1-CG 3.84Å; F479-Y510 HydrophobicContact CE1-CG 3.84Å; F479-Y510 AromaticContact CE1-CZ 3.97Å; F479-F515 HydrophobicContact CB-CD2 3.82Å; F479-F515 HydrophobicContact CB-CE2 3.5Å; F479-F515 VanDerWaalsContact CB-CE2 3.5Å; F479-F515 HydrophobicContact CD1-CD2 4.01Å; F479-F515 HydrophobicContact CG-CD2 4.12Å; F479-F515 HydrophobicContact CG-CE2 4.22Å; F479-L520 HydrophobicContact CD1-CD2 4.26Å; F479-L520 HydrophobicContact CD2-CD2 3.96Å; F479-L520 HydrophobicContact CE1-CD2 4.06Å; F479-L520 HydrophobicContact CE2-CB 3.81Å; F479-L520 HydrophobicContact CE2-CD2 3.76Å; F479-L520 HydrophobicContact CE2-CG 4.26Å; F479-L520 HydrophobicContact CG-CD2 4.21Å; F479-L520 HydrophobicContact CZ-CB 3.82Å; F479-L520 HydrophobicContact CZ-CD2 3.81Å; F479-L520 HydrophobicContact CZ-CG 4.41Å; F479-L520 WeakPolarHBondContact CZ-O 3.47Å
480	I	89.3	Confident	84.4	Confident	0 Å²	0	49.7 Å²	49.7	0%	0	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	118	178.4	-58.3	107.9	0	0	0	109	V433 L434 L436 V453 C457 V463 V466 I478 F482	V433-I480 WeakPolarHBondContact CA-O 3.44Å; L434-I480 HydrophobicContact CB-CB 4.42Å; L434-I480 HydrophobicContact CD2-CD1 4.44Å; L434-I480 PolarHBondContact N-O 3.05Å; L434-I480 PolarHBondContact O-N 3.33Å; L436-I480 HydrophobicContact CD1-CD1 3.51Å; L436-I480 HydrophobicContact CG-CD1 3.75Å; V453-I480 HydrophobicContact CG1-CD1 3.95Å; V453-I480 HydrophobicContact CG1-CG1 4.11Å; C457-I480 HydrophobicContact CB-CG2 4.26Å; V463-I480 HydrophobicContact CB-CG2 4.4Å; V463-I480 HydrophobicContact CG1-CG2 3.76Å; V463-I480 HydrophobicContact CG2-CG2 3.79Å; V466-I480 HydrophobicContact CG1-CG1 4.44Å; V466-I480 HydrophobicContact CG2-CG1 4.35Å; I478-I480 HydrophobicContact CG2-CD1 4.18Å; I478-I480 HydrophobicContact CG2-CG1 4.5Å; I480-F482 HydrophobicContact CB-CE2 4.2Å; I480-F482 HydrophobicContact CG2-CD2 4.07Å; I480-F482 HydrophobicContact CG2-CE2 3.58Å; I480-F482 HydrophobicContact CG2-CZ 3.92Å
481	Q	90.3	Very high	84.8	Confident	30 Å²	30	45.9 Å²	45.9	14%	0.14	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.5	120.6	173.1	-172.9	177.8	28.4	0	0	109.6	V433 L464 R465 F515	V433-Q481 HydrophobicContact CG2-CG 4.35Å; L464-Q481 HydrophobicContact CB-CG 4.36Å; L464-Q481 HydrophobicContact CD1-CG 4.45Å; L464-Q481 PolarHBondContact N-O 3.46Å; R465-Q481 HydrophobicContact CB-CB 4.18Å; R465-Q481 PolarHBondContact N-O 2.87Å; R465-Q481 PolarHBondContact O-N 2.72Å; Q481-F515 HydrophobicContact CB-CE1 3.77Å; Q481-F515 HydrophobicContact CB-CZ 4.15Å; Q481-F515 HydrophobicContact CG-CE1 4.16Å
482	F	90.3	Very high	85.6	Confident	0 Å²	0	45.4 Å²	45.4	0%	0	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.6	157.6	171.4	-69.4	-94.2	0	0	0	111	R432 L434 C457 S462 V463 I480 R484 D487 A488 A491	R432-F482 PolarHBondContact O-N 2.79Å; L434-F482 HydrophobicContact CB-CE2 4.03Å; L434-F482 HydrophobicContact CD2-CE2 4.11Å; C457-F482 HydrophobicContact CB-CE1 4.5Å; C457-F482 HydrophobicContact CB-CZ 4.05Å; S462-F482 CarbonylContact O-C 3.56Å; S462-F482 WeakPolarHBondContact O-CA 3.31Å; V463-F482 HydrophobicContact CG2-CD1 4.28Å; V463-F482 HydrophobicContact CG2-CE1 3.94Å; V463-F482 HydrophobicContact CG2-CZ 4.35Å; I480-F482 HydrophobicContact CB-CE2 4.2Å; I480-F482 HydrophobicContact CG2-CD2 4.07Å; I480-F482 HydrophobicContact CG2-CE2 3.58Å; I480-F482 HydrophobicContact CG2-CZ 3.92Å; F482-R484 WeakPolarHBondContact CB-O 3.46Å; F482-R484 PolarHBondContact O-N 2.92Å; F482-D487 HydrophobicContact CB-CB 4.17Å; F482-D487 HydrophobicContact CD1-CB 3.76Å; F482-D487 HydrophobicContact CE1-CB 4.49Å; F482-D487 HydrophobicContact CG-CB 4.15Å; F482-A488 HydrophobicContact CB-CB 4.3Å; F482-A488 HydrophobicContact CD2-CB 3.76Å; F482-A488 HydrophobicContact CE2-CB 4.48Å; F482-A488 HydrophobicContact CG-CB 4.25Å; F482-A491 HydrophobicContact CE1-CB 4.36Å; F482-A491 HydrophobicContact CE2-CB 3.95Å; F482-A491 HydrophobicContact CZ-CB 3.55Å
483	D	89.1	Confident	86.7	Confident	82 Å²	82	43.4 Å²	43.4	44%	0.439	24%	0.236	S	C	.	.	S	Bend	trans	-62.6	-34.2	171	-174.5	53.1	0	0	0	111.8	R432 S462 L464	R432-D483 VanDerWaalsContact CD-O 3.28Å; R432-D483 WeakPolarHBondContact CD-O 3.27Å; R432-D483 PolarHBondContact NH1-O 2.78Å; S462-D483 PolarHBondContact O-N 3.02Å; L464-D483 HydrophobicContact CD1-CB 4.37Å; L464-D483 HydrophobicContact CD2-CB 4.42Å; L464-D483 HydrophobicContact CG-CB 4.26Å
484	R	87.8	Confident	87.6	Confident	127 Å²	127	42.4 Å²	42.4	48%	0.479	23%	0.231	S	C	.	.			trans	-125.3	147.8	-176.5	-60.2	179	63.2	176.7	-3.8	112.6	F482 D486 D487 A488	F482-R484 WeakPolarHBondContact CB-O 3.46Å; F482-R484 PolarHBondContact O-N 2.92Å; R484-D486 VanDerWaalsContact C-N 3.34Å; R484-D486 IonicContact CZ-OD2 3.44Å; R484-D486 IonicContact NE-OD2 3.42Å; R484-D486 PolarHBondContact NE-OD2 2.87Å; R484-D486 IonicContact NH2-OD2 2.69Å; R484-D486 PolarHBondContact NH2-OD2 3.2Å; R484-D487 HydrophobicContact CB-CB 4.34Å; R484-D487 IonicContact NE-OD1 3.95Å; R484-D487 PolarHBondContact O-N 2.85Å; R484-A488 PolarHBondContact O-N 3.43Å
485	S	89.2	Confident	88.5	Confident	23 Å²	23	36.2 Å²	36.2	16%	0.161	20%	0.203	C	C	.	.	H	α-helix	trans	-78.7	-19.2	175.6	50.2	0	0	0	0	113.3	M430 S431 K489	M430-S485 WeakPolarHBondContact O-CB 3.4Å; M430-S485 PolarHBondContact O-OG 2.95Å; S431-S485 WeakPolarHBondContact O-CA 3.1Å; S431-S485 WeakPolarHBondContact O-CB 3.48Å; S485-K489 WeakPolarHBondContact O-CD 3.43Å; S485-K489 WeakPolarHBondContact O-CG 3.31Å; S485-K489 PolarHBondContact O-N 3.46Å; S485-K489 VanDerWaalsContact O-N 3.12Å
486	D	88.3	Confident	88.9	Confident	82 Å²	82	35.8 Å²	35.8	44%	0.439	20%	0.2	S	C	.	.	H	α-helix	trans	-64.1	-46.2	169.4	-55.2	-51.9	0	0	0	110.9	R484 K489 A490	R484-D486 VanDerWaalsContact C-N 3.34Å; R484-D486 IonicContact CZ-OD2 3.44Å; R484-D486 IonicContact NE-OD2 3.42Å; R484-D486 PolarHBondContact NE-OD2 2.87Å; R484-D486 IonicContact NH2-OD2 2.69Å; R484-D486 PolarHBondContact NH2-OD2 3.2Å; D486-K489 WeakPolarHBondContact O-CB 3.48Å; D486-K489 PolarHBondContact O-N 3Å; D486-A490 PolarHBondContact O-N 3.41Å
487	D	91	Very high	89.1	Confident	26 Å²	26	42.8 Å²	42.8	14%	0.139	23%	0.233	C	C	.	.	H	α-helix	trans	-63.6	-45.4	178.3	-56.1	16.8	0	0	0	110.7	G461 S462 F482 R484 K489 A490 A491	G461-D487 WeakPolarHBondContact CA-OD2 3.44Å; S462-D487 PolarHBondContact N-OD2 3.16Å; F482-D487 HydrophobicContact CB-CB 4.17Å; F482-D487 HydrophobicContact CD1-CB 3.76Å; F482-D487 HydrophobicContact CE1-CB 4.49Å; F482-D487 HydrophobicContact CG-CB 4.15Å; R484-D487 HydrophobicContact CB-CB 4.34Å; R484-D487 IonicContact NE-OD1 3.95Å; R484-D487 PolarHBondContact O-N 2.85Å; D487-K489 VanDerWaalsContact C-N 3.32Å; D487-K489 PolarHBondContact O-N 3.33Å; D487-A490 PolarHBondContact O-N 2.91Å; D487-A490 VanDerWaalsContact O-N 3.15Å; D487-A491 PolarHBondContact O-N 3.32Å
488	A	89.7	Confident	89.1	Confident	0 Å²	0	46.8 Å²	46.8	0%	0	25%	0.248	C	C	.	.	H	α-helix	trans	-59.1	-39.3	175.3	0	0	0	0	0	112.7	F482 R484 C492 L509	F482-A488 HydrophobicContact CB-CB 4.3Å; F482-A488 HydrophobicContact CD2-CB 3.76Å; F482-A488 HydrophobicContact CE2-CB 4.48Å; F482-A488 HydrophobicContact CG-CB 4.25Å; R484-A488 PolarHBondContact O-N 3.43Å; A488-C492 VanDerWaalsContact O-CB 3.27Å; A488-C492 WeakPolarHBondContact O-CB 3.49Å; A488-C492 PolarHBondContact O-N 3.29Å; A488-L509 HydrophobicContact CB-CD2 4.04Å
489	K	90.1	Very high	88.9	Confident	59 Å²	59	54.9 Å²	54.9	26%	0.257	28%	0.28	S	S	.	.	H	α-helix	trans	-66	-43.4	173.6	-71.1	158.3	-169.5	175.6	0	112	S429 S485 D486 D487 C492 C493 L509	S429-K489 WeakPolarHBondContact O-CE 3.43Å; S429-K489 PolarHBondContact O-NZ 2.82Å; S485-K489 WeakPolarHBondContact O-CD 3.43Å; S485-K489 WeakPolarHBondContact O-CG 3.31Å; S485-K489 PolarHBondContact O-N 3.46Å; S485-K489 VanDerWaalsContact O-N 3.12Å; D486-K489 WeakPolarHBondContact O-CB 3.48Å; D486-K489 PolarHBondContact O-N 3Å; D487-K489 VanDerWaalsContact C-N 3.32Å; D487-K489 PolarHBondContact O-N 3.33Å; K489-C492 PolarHBondContact O-N 2.88Å; K489-C493 PolarHBondContact O-N 3.46Å; K489-C493 PolarHBondContact O-SG 3.47Å; K489-C493 VanDerWaalsContact O-SG 3.37Å; K489-L509 HydrophobicContact CG-CD1 3.99Å; K489-L509 HydrophobicContact CG-CD2 4.46Å
490	A	89.7	Confident	88.3	Confident	48 Å²	48	57.9 Å²	57.9	40%	0.397	29%	0.293	S	S	.	.	H	α-helix	trans	-61.9	-45.6	178.9	0	0	0	0	0	111.3	D486 D487 C493 A494	D486-A490 PolarHBondContact O-N 3.41Å; D487-A490 PolarHBondContact O-N 2.91Å; D487-A490 VanDerWaalsContact O-N 3.15Å; A490-C493 PolarHBondContact O-N 2.97Å; A490-A494 WeakPolarHBondContact O-CB 3.42Å; A490-A494 PolarHBondContact O-N 3.17Å
491	A	90.5	Very high	87.7	Confident	0 Å²	0	61.2 Å²	61.2	0%	0	32%	0.32	C	S	.	.	H	α-helix	trans	-62.7	-44.9	173.7	0	0	0	0	0	112	L434 Y460 F482 D487 C493 A494 L495	L434-A491 HydrophobicContact CD2-CB 3.77Å; Y460-A491 HydrophobicContact CD2-CB 4.23Å; Y460-A491 HydrophobicContact CG-CB 4.01Å; F482-A491 HydrophobicContact CE1-CB 4.36Å; F482-A491 HydrophobicContact CE2-CB 3.95Å; F482-A491 HydrophobicContact CZ-CB 3.55Å; D487-A491 PolarHBondContact O-N 3.32Å; A491-C493 PolarHBondContact O-N 3.19Å; A491-A494 PolarHBondContact O-N 3.44Å; A491-A494 VanDerWaalsContact O-N 3.16Å; A491-L495 HydrophobicContact CB-CD1 4.46Å; A491-L495 WeakPolarHBondContact O-CB 3.39Å; A491-L495 WeakPolarHBondContact O-CG 3.38Å; A491-L495 PolarHBondContact O-N 2.86Å
492	C	90.3	Very high	87.2	Confident	19 Å²	19	63.2 Å²	63.2	13%	0.128	35%	0.349	C	S	.	.	H	α-helix	trans	-56	-47.7	176.9	-166	0	0	0	0	112.4	L434 A488 K489 A494 N496 A507 L509	L434-C492 HydrophobicContact CD1-CB 3.52Å; A488-C492 VanDerWaalsContact O-CB 3.27Å; A488-C492 WeakPolarHBondContact O-CB 3.49Å; A488-C492 PolarHBondContact O-N 3.29Å; K489-C492 PolarHBondContact O-N 2.88Å; C492-A494 VanDerWaalsContact C-N 3.27Å; C492-A494 PolarHBondContact O-N 2.91Å; C492-N496 VanDerWaalsContact O-CB 3.3Å; C492-N496 WeakPolarHBondContact O-CB 3.35Å; C492-N496 PolarHBondContact O-N 3.02Å; C492-A507 PolarHBondContact SG-O 3.42Å; C492-L509 HydrophobicContact CB-CD2 4.27Å; C492-L509 HydrophobicContact CB-CG 4.47Å
493	C	88.8	Confident	86.9	Confident	112 Å²	112	67.1 Å²	67.1	76%	0.757	36%	0.364	S	S	*	.	H	α-helix	trans	-69.9	-21	-179.3	-70.3	0	0	0	0	113.9	K489 A490 A491	K489-C493 PolarHBondContact O-N 3.46Å; K489-C493 PolarHBondContact O-SG 3.47Å; K489-C493 VanDerWaalsContact O-SG 3.37Å; A490-C493 PolarHBondContact O-N 2.97Å; A491-C493 PolarHBondContact O-N 3.19Å
494	A	89.1	Confident	86.9	Confident	43 Å²	43	65.5 Å²	65.5	36%	0.355	36%	0.357	S	S	.	.	H	α-helix	trans	-101.6	-25.1	-176.4	0	0	0	0	0	114.2	Y460 A490 A491 C492	Y460-A494 HydrophobicContact CD1-CB 4.21Å; Y460-A494 HydrophobicContact CE1-CB 3.31Å; Y460-A494 WeakPolarHBondContact OH-CB 3.27Å; A490-A494 WeakPolarHBondContact O-CB 3.42Å; A490-A494 PolarHBondContact O-N 3.17Å; A491-A494 PolarHBondContact O-N 3.44Å; A491-A494 VanDerWaalsContact O-N 3.16Å; C492-A494 VanDerWaalsContact C-N 3.27Å; C492-A494 PolarHBondContact O-N 2.91Å
495	L	87	Confident	86.9	Confident	12 Å²	12	59.7 Å²	59.7	6%	0.063	34%	0.336	C	S	.	.	H	α-helix	trans	-94.3	-23	178.8	-63.3	176.9	0	0	0	113	L434 L436 Y460 A491 Q497 R498 A507	L434-L495 HydrophobicContact CD2-CD1 4.09Å; L436-L495 HydrophobicContact CD1-CD1 4.14Å; L436-L495 HydrophobicContact CD2-CB 4.23Å; L436-L495 HydrophobicContact CD2-CD1 4.23Å; Y460-L495 HydrophobicContact CE2-CD2 4.18Å; Y460-L495 HydrophobicContact CE2-CG 4.35Å; A491-L495 HydrophobicContact CB-CD1 4.46Å; A491-L495 WeakPolarHBondContact O-CB 3.39Å; A491-L495 WeakPolarHBondContact O-CG 3.38Å; A491-L495 PolarHBondContact O-N 2.86Å; L495-Q497 PolarHBondContact O-N 2.86Å; L495-R498 VanDerWaalsContact O-CB 3.27Å; L495-R498 WeakPolarHBondContact O-CB 3.27Å; L495-R498 PolarHBondContact O-N 3.16Å; L495-R498 VanDerWaalsContact O-N 3.16Å; L495-A507 HydrophobicContact CB-CB 4.13Å
496	N	88.1	Confident	86.9	Confident	75 Å²	75	62.5 Å²	62.5	40%	0.401	35%	0.346	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.7	132.6	177.3	-162.1	17.8	0	0	0	111.3	C492 R498 A507	C492-N496 VanDerWaalsContact O-CB 3.3Å; C492-N496 WeakPolarHBondContact O-CB 3.35Å; C492-N496 PolarHBondContact O-N 3.02Å; N496-R498 PolarHBondContact O-N 3.17Å; N496-A507 HydrophobicContact CB-CB 3.89Å; N496-A507 PolarHBondContact OD1-N 3.47Å
497	Q	86.8	Confident	87	Confident	149 Å²	149	58.8 Å²	58.8	70%	0.696	33%	0.327	S	S	*	.	T	Hydrogen-bonded Turn	trans	63	12.3	-173.9	-50.4	-171.6	15.4	0	0	115.9	L495 V504 V505	L495-Q497 PolarHBondContact O-N 2.86Å; Q497-V504 HydrophobicContact CB-CG1 4.35Å; Q497-V505 WeakPolarHBondContact CA-O 3.49Å; Q497-V505 PolarHBondContact N-O 3.35Å
498	R	87.1	Confident	86.9	Confident	95 Å²	95	63.3 Å²	63.3	36%	0.358	34%	0.342	S	S	.	.			trans	-68.5	149	167.6	-170.7	169.2	172.5	-178.8	-7.6	109.8	E456 L495 N496 V505	E456-R498 IonicContact OE1-CZ 2.74Å; E456-R498 IonicContact OE1-NH1 2.83Å; E456-R498 IonicContact OE1-NH2 2.8Å; E456-R498 PolarHBondContact OE1-NH2 2.77Å; E456-R498 IonicContact OE2-CZ 3.88Å; E456-R498 IonicContact OE2-NH1 3.69Å; E456-R498 PolarHBondContact OE2-NH1 3.24Å; E456-R498 IonicContact OE2-NH2 3.2Å; E456-R498 PolarHBondContact OE2-NH2 3.02Å; L495-R498 VanDerWaalsContact O-CB 3.27Å; L495-R498 WeakPolarHBondContact O-CB 3.27Å; L495-R498 PolarHBondContact O-N 3.16Å; L495-R498 VanDerWaalsContact O-N 3.16Å; N496-R498 PolarHBondContact O-N 3.17Å; R498-V505 WeakPolarHBondContact O-CB 3.13Å; R498-V505 WeakPolarHBondContact O-CG2 3.37Å; R498-V505 PolarHBondContact O-N 2.96Å
499	Y	83.3	Confident	86.9	Confident	171 Å²	171	65.4 Å²	65.4	67%	0.671	35%	0.353	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-91.9	134.6	174	-81.5	-100.7	0	0	0	111.1	R503 V504	Y499-R503 VanDerWaalsContact CA-O 3.31Å; Y499-R503 WeakPolarHBondContact CA-O 3.22Å; Y499-V504 HydrophobicContact CD1-CG2 4.05Å; Y499-V504 HydrophobicContact CD2-CG2 4.47Å; Y499-V504 HydrophobicContact CE1-CG2 3.55Å; Y499-V504 HydrophobicContact CE2-CG2 4.01Å; Y499-V504 HydrophobicContact CG-CG2 4.5Å
500	F	79.5	Confident	86.7	Confident	63 Å²	63	63.5 Å²	63.5	28%	0.276	34%	0.344	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.6	135.6	174.2	-168.9	-85.2	0	0	0	109	M439 V440 L449 E452 G502 R503 V505	M439-F500 HydrophobicContact CE-CB 4.46Å; M439-F500 HydrophobicContact CE-CD1 4.4Å; M439-F500 HydrophobicContact CE-CD2 4.03Å; M439-F500 HydrophobicContact CE-CE2 4.37Å; M439-F500 HydrophobicContact CE-CG 4.04Å; M439-F500 WeakPolarHBondContact O-CD1 3.36Å; V440-F500 HydrophobicContact CG2-CD1 4.07Å; V440-F500 HydrophobicContact CG2-CE1 3.73Å; L449-F500 HydrophobicContact CD1-CZ 4.45Å; E452-F500 WeakPolarHBondContact OE2-CZ 3.43Å; F500-G502 PolarHBondContact O-N 3.29Å; F500-R503 PolarHBondContact N-O 3.29Å; F500-R503 WeakPolarHBondContact O-CA 3.31Å; F500-R503 WeakPolarHBondContact O-CB 3.18Å; F500-R503 PolarHBondContact O-N 3.37Å; F500-V505 HydrophobicContact CB-CG2 3.76Å
501	A	75.8	Confident	86.4	Confident	69 Å²	69	63.3 Å²	63.3	57%	0.57	34%	0.337	S	S	*	.	T	Hydrogen-bonded Turn	trans	48	25.6	-177.8	0	0	0	0	0	116.1	R503	A501-R503 VanDerWaalsContact C-N 3.29Å; A501-R503 PolarHBondContact O-N 3.12Å
502	G	80.7	Confident	85.9	Confident	73 Å²	73	64.7 Å²	64.7	75%	0.753	34%	0.343	S	S	*	.	T	Hydrogen-bonded Turn	trans	81.1	-1	-174.1	0	0	0	0	0	115.4	F500	F500-G502 PolarHBondContact O-N 3.29Å
503	R	83.7	Confident	85.1	Confident	82 Å²	82	70.4 Å²	70.4	31%	0.309	37%	0.368	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.1	166.1	172.4	-50.6	-179.6	-170.1	-123.5	-0.7	110.7	N438 G441 E444 Y499 F500 A501	N438-R503 VanDerWaalsContact O-CB 3.29Å; N438-R503 WeakPolarHBondContact O-CB 2.87Å; G441-R503 VanDerWaalsContact CA-NH2 3.32Å; E444-R503 IonicContact OE2-CZ 3.17Å; E444-R503 IonicContact OE2-NE 3.4Å; E444-R503 IonicContact OE2-NH2 3.27Å; E444-R503 PolarHBondContact OE2-NH2 3.27Å; Y499-R503 VanDerWaalsContact CA-O 3.31Å; Y499-R503 WeakPolarHBondContact CA-O 3.22Å; F500-R503 PolarHBondContact N-O 3.29Å; F500-R503 WeakPolarHBondContact O-CA 3.31Å; F500-R503 WeakPolarHBondContact O-CB 3.18Å; F500-R503 PolarHBondContact O-N 3.37Å; A501-R503 VanDerWaalsContact C-N 3.29Å; A501-R503 PolarHBondContact O-N 3.12Å
504	V	88.2	Confident	84.6	Confident	48 Å²	48	69 Å²	69	29%	0.291	35%	0.347	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	117.6	174.3	-179.4	0	0	0	0	108.9	N438 Q497 Y499	N438-V504 PolarHBondContact ND2-O 3.31Å; Q497-V504 HydrophobicContact CB-CG1 4.35Å; Y499-V504 HydrophobicContact CD1-CG2 4.05Å; Y499-V504 HydrophobicContact CD2-CG2 4.47Å; Y499-V504 HydrophobicContact CE1-CG2 3.55Å; Y499-V504 HydrophobicContact CE2-CG2 4.01Å; Y499-V504 HydrophobicContact CG-CG2 4.5Å
505	V	88.2	Confident	84.1	Confident	5 Å²	5	67 Å²	67	3%	0.03	33%	0.33	C	S	.	.			trans	-70.2	129.4	180	-177	0	0	0	0	109.8	L436 M439 Q497 R498 F500	L436-V505 HydrophobicContact CB-CG1 4.41Å; L436-V505 HydrophobicContact CD2-CG1 4.17Å; M439-V505 HydrophobicContact CE-CG2 4.41Å; M439-V505 HydrophobicContact CG-CB 4.32Å; M439-V505 HydrophobicContact CG-CG1 3.7Å; M439-V505 HydrophobicContact CG-CG2 3.82Å; M439-V505 HydrophobicContact SD-CG1 4.32Å; Q497-V505 WeakPolarHBondContact CA-O 3.49Å; Q497-V505 PolarHBondContact N-O 3.35Å; R498-V505 WeakPolarHBondContact O-CB 3.13Å; R498-V505 WeakPolarHBondContact O-CG2 3.37Å; R498-V505 PolarHBondContact O-N 2.96Å; F500-V505 HydrophobicContact CB-CG2 3.76Å
506	Q	88.9	Confident	83.5	Confident	82 Å²	82	72.5 Å²	72.5	38%	0.383	36%	0.355	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	120	168.7	-58.3	-169.8	33.8	0	0	108.5	L436 E437	L436-Q506 WeakPolarHBondContact CA-O 3.34Å; E437-Q506 HydrophobicContact CB-CB 4.32Å; E437-Q506 PolarHBondContact N-O 3.12Å; E437-Q506 PolarHBondContact O-N 3.23Å
507	A	91	Very high	82.6	Confident	3 Å²	3	74.5 Å²	74.5	3%	0.025	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	128.3	178.5	0	0	0	0	0	110.1	L434 L435 L436 C492 L495 N496	L434-A507 HydrophobicContact CD1-CB 4.31Å; L435-A507 WeakPolarHBondContact O-CA 3.42Å; L436-A507 HydrophobicContact CD2-CB 3.4Å; C492-A507 PolarHBondContact SG-O 3.42Å; L495-A507 HydrophobicContact CB-CB 4.13Å; N496-A507 HydrophobicContact CB-CB 3.89Å; N496-A507 PolarHBondContact OD1-N 3.47Å
508	R	89.1	Confident	81.7	Confident	122 Å²	122	71.9 Å²	71.9	46%	0.46	35%	0.353	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.8	145.5	-178.6	-55	-175.3	-165.8	157.3	13.9	110.2	L435 E437 Y510	L435-R508 PolarHBondContact N-O 2.7Å; L435-R508 PolarHBondContact O-N 3.39Å; E437-R508 IonicContact OE2-CZ 2.72Å; E437-R508 IonicContact OE2-NE 3.36Å; E437-R508 IonicContact OE2-NH1 3.41Å; E437-R508 PolarHBondContact OE2-NH1 2.95Å; E437-R508 IonicContact OE2-NH2 2.72Å; E437-R508 PolarHBondContact OE2-NH2 3.37Å; R508-Y510 PolarHBondContact O-N 3.4Å
509	L	89.5	Confident	80.8	Confident	43 Å²	43	72 Å²	72	23%	0.225	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.7	131.5	165.1	-66	175.4	0	0	0	108.6	I428 A488 K489 C492	I428-L509 HydrophobicContact CG2-CB 4.32Å; A488-L509 HydrophobicContact CB-CD2 4.04Å; K489-L509 HydrophobicContact CG-CD1 3.99Å; K489-L509 HydrophobicContact CG-CD2 4.46Å; C492-L509 HydrophobicContact CB-CD2 4.27Å; C492-L509 HydrophobicContact CB-CG 4.47Å
510	Y	85.7	Confident	80.1	Confident	19 Å²	19	64.6 Å²	64.6	8%	0.075	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	147	177.1	-162.6	-97.9	0	0	0	109.4	S431 V433 L435 F479 R508 E512 R514 F515 E519 D521	S431-Y510 WeakPolarHBondContact CB-O 3.38Å; S431-Y510 PolarHBondContact OG-O 3.25Å; S431-Y510 VanDerWaalsContact OG-O 3.12Å; V433-Y510 PolarHBondContact O-N 3.49Å; L435-Y510 HydrophobicContact CB-CD2 4.21Å; L435-Y510 HydrophobicContact CB-CG 4.38Å; L435-Y510 HydrophobicContact CD2-CD2 3.74Å; L435-Y510 HydrophobicContact CD2-CE2 4.18Å; F479-Y510 HydrophobicContact CD1-CD1 4.13Å; F479-Y510 HydrophobicContact CD1-CG 4.23Å; F479-Y510 AromaticContact CE1-CD1 3.78Å; F479-Y510 HydrophobicContact CE1-CD1 3.78Å; F479-Y510 AromaticContact CE1-CD2 3.95Å; F479-Y510 HydrophobicContact CE1-CD2 3.95Å; F479-Y510 AromaticContact CE1-CE1 3.83Å; F479-Y510 HydrophobicContact CE1-CE1 3.83Å; F479-Y510 HydrophobicContact CE1-CE2 4.01Å; F479-Y510 AromaticContact CE1-CG 3.84Å; F479-Y510 HydrophobicContact CE1-CG 3.84Å; F479-Y510 AromaticContact CE1-CZ 3.97Å; R508-Y510 PolarHBondContact O-N 3.4Å; Y510-E512 PolarHBondContact O-N 2.69Å; Y510-R514 HydrophobicContact CD1-CB 4.31Å; Y510-R514 HydrophobicContact CE1-CB 3.46Å; Y510-R514 VanDerWaalsContact CE1-CB 3.46Å; Y510-F515 HydrophobicContact CD1-CB 4.24Å; Y510-E519 WeakPolarHBondContact CE1-O 3.45Å; Y510-E519 PolarHBondContact OH-O 3.24Å; Y510-E519 VanDerWaalsContact OH-O 3.09Å; Y510-D521 PolarHBondContact OH-O 2.92Å
511	D	83.4	Confident	79.4	Confident	45 Å²	45	65.6 Å²	65.6	24%	0.241	34%	0.338	C	S	.	.			trans	-61.2	130.7	-179.5	-171.4	-5	0	0	0	110.8	E513 R514 F515	D511-E513 VanDerWaalsContact C-N 3.29Å; D511-E513 PolarHBondContact O-N 2.69Å; D511-E513 PolarHBondContact OD1-N 3.2Å; D511-R514 HydrophobicContact CB-CB 4.13Å; D511-R514 HydrophobicContact CB-CG 4.03Å; D511-F515 PolarHBondContact O-N 3.41Å; D511-F515 VanDerWaalsContact O-N 3.1Å
512	E	80.5	Confident	78.5	Confident	28 Å²	28	68.9 Å²	68.9	13%	0.131	35%	0.346	C	S	.	.	H	α-helix	trans	-68	-31.8	178.1	-165.4	-178.8	149.6	0	0	111.3	R432 V433 Y510 Q516	R432-E512 WeakPolarHBondContact CB-OE2 3.17Å; R432-E512 WeakPolarHBondContact CG-OE2 3.02Å; R432-E512 IonicContact CZ-OE1 3.41Å; R432-E512 IonicContact CZ-OE2 3.2Å; R432-E512 IonicContact NE-OE1 2.72Å; R432-E512 PolarHBondContact NE-OE1 2.66Å; R432-E512 IonicContact NE-OE2 3.59Å; R432-E512 PolarHBondContact NE-OE2 3.04Å; R432-E512 IonicContact NH2-OE1 4Å; R432-E512 PolarHBondContact NH2-OE1 2.94Å; R432-E512 IonicContact NH2-OE2 2.68Å; V433-E512 HydrophobicContact CG2-CB 4.3Å; V433-E512 HydrophobicContact CG2-CG 4.07Å; Y510-E512 PolarHBondContact O-N 2.69Å; E512-Q516 HydrophobicContact CG-CG 4.45Å; E512-Q516 WeakPolarHBondContact O-CB 3.26Å; E512-Q516 VanDerWaalsContact O-CG 3.28Å; E512-Q516 WeakPolarHBondContact O-CG 3.18Å; E512-Q516 PolarHBondContact O-N 3.29Å; E512-Q516 PolarHBondContact OE1-NE2 2.68Å
513	E	73.7	Confident	78.4	Confident	140 Å²	140	68.7 Å²	68.7	65%	0.654	33%	0.325	S	S	*	.	H	α-helix	trans	-66.2	-47.7	177.7	-62.8	-165.3	-178.7	0	0	110.7	D511 F515 Q516 L517	D511-E513 VanDerWaalsContact C-N 3.29Å; D511-E513 PolarHBondContact O-N 2.69Å; D511-E513 PolarHBondContact OD1-N 3.2Å; E513-F515 PolarHBondContact O-N 3.24Å; E513-Q516 PolarHBondContact O-N 2.92Å; E513-L517 WeakPolarHBondContact O-CB 3.41Å; E513-L517 VanDerWaalsContact O-CG 3.27Å; E513-L517 WeakPolarHBondContact O-CG 3.4Å; E513-L517 PolarHBondContact O-N 3.01Å
514	R	76.5	Confident	78.1	Confident	82 Å²	82	68 Å²	68	31%	0.309	33%	0.326	S	S	.	.	H	α-helix	trans	-59.1	-45.8	174.9	-69.5	177.2	154.1	-136.5	-5.3	112.9	Y510 D511 Q516 L517 H518 E519 D522	Y510-R514 HydrophobicContact CD1-CB 4.31Å; Y510-R514 HydrophobicContact CE1-CB 3.46Å; Y510-R514 VanDerWaalsContact CE1-CB 3.46Å; D511-R514 HydrophobicContact CB-CB 4.13Å; D511-R514 HydrophobicContact CB-CG 4.03Å; R514-Q516 VanDerWaalsContact C-N 3.34Å; R514-Q516 PolarHBondContact O-N 3.2Å; R514-L517 CarbonylContact O-C 3.52Å; R514-L517 WeakPolarHBondContact O-CB 3.3Å; R514-L517 PolarHBondContact O-N 3.26Å; R514-L517 VanDerWaalsContact O-N 3.13Å; R514-H518 PolarHBondContact O-N 3.37Å; R514-H518 VanDerWaalsContact O-N 3.13Å; R514-E519 HydrophobicContact CB-CB 4.17Å; R514-E519 PolarHBondContact O-N 3.39Å; R514-D522 VanDerWaalsContact CZ-OXT 3.23Å; R514-D522 PolarHBondContact NH1-OXT 2.69Å; R514-D522 PolarHBondContact NH2-OXT 3.42Å
515	F	78.4	Confident	77.5	Confident	2 Å²	2	69.1 Å²	69.1	1%	0.009	33%	0.328	C	S	.	.	H	α-helix	trans	-63	-38.1	176.9	177.6	-103.8	0	0	0	112.7	V433 L467 F479 Q481 Y510 D511 E513 H518 L520	V433-F515 HydrophobicContact CB-CB 4.34Å; V433-F515 HydrophobicContact CB-CG 4.36Å; V433-F515 HydrophobicContact CG1-CB 3.99Å; V433-F515 HydrophobicContact CG1-CD1 4.21Å; V433-F515 HydrophobicContact CG1-CD2 3.84Å; V433-F515 HydrophobicContact CG1-CE2 4.38Å; V433-F515 HydrophobicContact CG1-CG 3.74Å; V433-F515 HydrophobicContact CG2-CB 3.83Å; V433-F515 HydrophobicContact CG2-CD1 3.55Å; V433-F515 HydrophobicContact CG2-CE1 4.27Å; V433-F515 HydrophobicContact CG2-CG 3.76Å; L467-F515 HydrophobicContact CB-CE2 4.26Å; L467-F515 HydrophobicContact CD2-CE2 3.98Å; F479-F515 HydrophobicContact CB-CD2 3.82Å; F479-F515 HydrophobicContact CB-CE2 3.5Å; F479-F515 VanDerWaalsContact CB-CE2 3.5Å; F479-F515 HydrophobicContact CD1-CD2 4.01Å; F479-F515 HydrophobicContact CG-CD2 4.12Å; F479-F515 HydrophobicContact CG-CE2 4.22Å; Q481-F515 HydrophobicContact CB-CE1 3.77Å; Q481-F515 HydrophobicContact CB-CZ 4.15Å; Q481-F515 HydrophobicContact CG-CE1 4.16Å; Y510-F515 HydrophobicContact CD1-CB 4.24Å; D511-F515 PolarHBondContact O-N 3.41Å; D511-F515 VanDerWaalsContact O-N 3.1Å; E513-F515 PolarHBondContact O-N 3.24Å; F515-H518 PolarHBondContact O-N 3.16Å; F515-L520 HydrophobicContact CD2-CD2 4.26Å
516	Q	75	Confident	76.9	Confident	126 Å²	126	72.9 Å²	72.9	59%	0.589	35%	0.346	S	S	*	.	H	α-helix	trans	-68.6	-33.2	173.5	-73.5	-175.6	35.9	0	0	112.5	E512 E513 R514 H518	E512-Q516 HydrophobicContact CG-CG 4.45Å; E512-Q516 WeakPolarHBondContact O-CB 3.26Å; E512-Q516 VanDerWaalsContact O-CG 3.28Å; E512-Q516 WeakPolarHBondContact O-CG 3.18Å; E512-Q516 PolarHBondContact O-N 3.29Å; E512-Q516 PolarHBondContact OE1-NE2 2.68Å; E513-Q516 PolarHBondContact O-N 2.92Å; R514-Q516 VanDerWaalsContact C-N 3.34Å; R514-Q516 PolarHBondContact O-N 3.2Å; Q516-H518 PolarHBondContact O-N 3.23Å
517	L	69.3	Low	76.2	Confident	117 Å²	117	72.3 Å²	72.3	61%	0.613	34%	0.343	S	S	*	.	H	α-helix	trans	-72.7	-8.9	174.2	-72.5	166	0	0	0	113.7	E513 R514 E519	E513-L517 WeakPolarHBondContact O-CB 3.41Å; E513-L517 VanDerWaalsContact O-CG 3.27Å; E513-L517 WeakPolarHBondContact O-CG 3.4Å; E513-L517 PolarHBondContact O-N 3.01Å; R514-L517 CarbonylContact O-C 3.52Å; R514-L517 WeakPolarHBondContact O-CB 3.3Å; R514-L517 PolarHBondContact O-N 3.26Å; R514-L517 VanDerWaalsContact O-N 3.13Å; L517-E519 HydrophobicContact CB-CG 4.11Å; L517-E519 PolarHBondContact O-N 3.49Å
518	H	68.1	Low	75.2	Confident	94 Å²	94	76.9 Å²	76.9	44%	0.435	37%	0.365	S	S	.	.	T	Hydrogen-bonded Turn	trans	59.3	28.3	-168.3	-85.9	-65.9	0	0	0	113.5	R465 R514 F515 Q516 L520	R465-H518 PolarHBondContact NH1-NE2 3.37Å; R465-H518 PolarHBondContact NH2-CE1 2.69Å; R465-H518 VanDerWaalsContact NH2-CE1 3.26Å; R465-H518 PolarHBondContact NH2-NE2 2.98Å; R465-H518 VanDerWaalsContact NH2-NE2 3.17Å; R514-H518 PolarHBondContact O-N 3.37Å; R514-H518 VanDerWaalsContact O-N 3.13Å; F515-H518 PolarHBondContact O-N 3.16Å; Q516-H518 PolarHBondContact O-N 3.23Å; H518-L520 PolarHBondContact O-N 2.9Å
519	E	68.6	Low	74.2	Confident	98 Å²	98	73.7 Å²	73.7	46%	0.458	36%	0.358	S	S	.	.			trans	-78.5	108.2	161.4	-67.3	177.9	170.1	0	0	107.4	Y510 R514 L517	Y510-E519 WeakPolarHBondContact CE1-O 3.45Å; Y510-E519 PolarHBondContact OH-O 3.24Å; Y510-E519 VanDerWaalsContact OH-O 3.09Å; R514-E519 HydrophobicContact CB-CB 4.17Å; R514-E519 PolarHBondContact O-N 3.39Å; L517-E519 HydrophobicContact CB-CG 4.11Å; L517-E519 PolarHBondContact O-N 3.49Å
520	L	68.8	Low	73	Confident	16 Å²	16	76.1 Å²	76.1	8%	0.084	37%	0.368	C	S	.	.			trans	-122.9	-16.1	-174.2	-53.2	174.6	0	0	0	112.6	L467 H469 R477 F479 F515 H518	L467-L520 HydrophobicContact CD2-CD1 3.67Å; L467-L520 HydrophobicContact CD2-CD2 3.89Å; L467-L520 HydrophobicContact CD2-CG 4.46Å; H469-L520 HydrophobicContact CB-CB 4.43Å; H469-L520 HydrophobicContact CB-CD1 4.12Å; R477-L520 PolarHBondContact NH1-O 2.52Å; R477-L520 VanDerWaalsContact NH1-O 3.15Å; F479-L520 HydrophobicContact CD1-CD2 4.26Å; F479-L520 HydrophobicContact CD2-CD2 3.96Å; F479-L520 HydrophobicContact CE1-CD2 4.06Å; F479-L520 HydrophobicContact CE2-CB 3.81Å; F479-L520 HydrophobicContact CE2-CD2 3.76Å; F479-L520 HydrophobicContact CE2-CG 4.26Å; F479-L520 HydrophobicContact CG-CD2 4.21Å; F479-L520 HydrophobicContact CZ-CB 3.82Å; F479-L520 HydrophobicContact CZ-CD2 3.81Å; F479-L520 HydrophobicContact CZ-CG 4.41Å; F479-L520 WeakPolarHBondContact CZ-O 3.47Å; F515-L520 HydrophobicContact CD2-CD2 4.26Å; H518-L520 PolarHBondContact O-N 2.9Å
521	D	63.8	Low	72	Confident	84 Å²	84	80.8 Å²	80.8	45%	0.449	39%	0.392	S	S	.	.			trans	-88.8	166	161.8	-53.5	-48.7	0	0	0	108.3	H469 Y510	H469-D521 IonicContact CD2-OD1 3Å; H469-D521 IonicContact CE1-OD1 2.64Å; H469-D521 IonicContact NE2-OD1 3.11Å; H469-D521 PolarHBondContact NE2-OD1 2.99Å; H469-D521 IonicContact NE2-OD2 3.55Å; Y510-D521 PolarHBondContact OH-O 2.92Å
522	D	57.5	Low	70.9	Confident	138 Å²	138	84.1 Å²	84.1	74%	0.738	41%	0.406	S	S	*	.			trans	-75.2	0	-165.7	-59	-98.2	0	0	0	116.6	R477 R514	R477-D522 IonicContact CZ-OD1 3.58Å; R477-D522 IonicContact CZ-OD2 3.55Å; R477-D522 IonicContact NH1-OD1 2.71Å; R477-D522 IonicContact NH1-OD2 3.6Å; R477-D522 PolarHBondContact NH1-OD2 3.5Å; R477-D522 VanDerWaalsContact NH2-CG 3.28Å; R477-D522 IonicContact NH2-OD1 3.53Å; R477-D522 PolarHBondContact NH2-OD1 3.15Å; R477-D522 IonicContact NH2-OD2 2.74Å; R477-D522 PolarHBondContact NH2-OD2 3.39Å; R514-D522 VanDerWaalsContact CZ-OXT 3.23Å; R514-D522 PolarHBondContact NH1-OXT 2.69Å; R514-D522 PolarHBondContact NH2-OXT 3.42Å

Retrieved 522 of 522 residues in 163.5 ms (Link to these results)

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