A0A077Z366_TRITR Loading...

F5 F8 type C domain containing protein

AlphaFold DB , UniProt , Accession A0A077Z366, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 559 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	36.3	Very low	34.4	Very low	258 Å²	258	156.1 Å²	156.1	100%	1.271	86%	0.859	S	S	*	*				0	148.1	0	-82.2	-176.2	-179.4	0	0	109
2	G	39.7	Very low	34.7	Very low	69 Å²	69	152.2 Å²	152.2	71%	0.711	86%	0.863	S	S	*	*			trans	127.2	87.6	179.4	0	0	0	0	0	109.4
3	C	30	Very low	34.8	Very low	143 Å²	143	152.2 Å²	152.2	97%	0.966	86%	0.856	S	S	*	*				47.1	119.7	52.1	-68.5	0	0	0	0	111.3
4	G	29.1	Very low	35.2	Very low	70 Å²	70	147.3 Å²	147.3	72%	0.722	85%	0.845	S	S	*	*			cis	159.5	147	1.7	0	0	0	0	0	109.3
5	R	33.4	Very low	35.9	Very low	250 Å²	250	145.5 Å²	145.5	94%	0.943	84%	0.84	S	S	*	*			trans	58.6	168.2	155.5	-67.7	-169.6	-176.8	-164	1.7	119.5
6	P	47.4	Very low	36.7	Very low	121 Å²	121	144.7 Å²	144.7	79%	0.786	83%	0.831	S	S	*	*			cis	-127.1	175.3	-9.4	20.9	4	0	0	0	115.3
7	F	30.5	Very low	37.6	Very low	199 Å²	199	146.6 Å²	146.6	87%	0.873	83%	0.831	S	S	*	*			trans	-70.7	145.3	171.9	-80.7	-109.2	0	0	0	113.1
8	D	36.9	Very low	38.4	Very low	167 Å²	167	150.8 Å²	150.8	89%	0.893	83%	0.832	S	S	*	*			trans	-123.1	141.9	156.9	-89.1	-34.6	0	0	0	110.5
9	E	29.9	Very low	39.1	Very low	182 Å²	182	147.3 Å²	147.3	85%	0.85	82%	0.818	S	S	*	*			trans	-75.9	165.1	-177.6	-67.8	173.8	126	0	0	113.7
10	V	32.9	Very low	40.1	Very low	119 Å²	119	146.6 Å²	146.6	72%	0.721	81%	0.808	S	S	*	*				140.8	101.7	126.9	177.8	0	0	0	0	113.9
11	I	32.4	Very low	41.4	Very low	139 Å²	139	143.8 Å²	143.8	71%	0.713	79%	0.794	S	S	*	*			trans	55.6	110.4	130.9	-51.8	174.7	0	0	0	119.6	I13	I11-I13 HydrophobicContact CG2-CD1 3.83Å; I11-I13 HydrophobicContact CG2-CG1 3.61Å
12	A	37.6	Very low	42.6	Very low	109 Å²	109	138 Å²	138	90%	0.901	77%	0.766	S	S	*	*			trans	-112.4	118.3	156	0	0	0	0	0	109.7
13	I	36.3	Very low	43.8	Very low	152 Å²	152	139.6 Å²	139.6	78%	0.779	76%	0.758	S	S	*	*			trans	-104.4	142	174.5	-64.5	168.1	0	0	0	109.1	I11	I11-I13 HydrophobicContact CG2-CD1 3.83Å; I11-I13 HydrophobicContact CG2-CG1 3.61Å
14	A	39.9	Very low	45.5	Very low	84 Å²	84	135.9 Å²	135.9	69%	0.694	73%	0.733	S	S	*	*			trans	94.6	102.3	160.2	0	0	0	0	0	119.3
15	P	46	Very low	47	Very low	120 Å²	120	141 Å²	141	78%	0.779	73%	0.731	S	S	*	*			trans	-127.9	65.9	136.6	37.7	-24.2	0	0	0	110.6
16	L	49.2	Very low	48.3	Very low	133 Å²	133	132.7 Å²	132.7	70%	0.696	71%	0.711	S	S	*	*			trans	-104.4	-14.8	170.1	-111.7	88.6	0	0	0	113.8	R18	L16-R18 PolarHBondContact O-N 3.44Å
17	Q	51.6	Low	48.9	Very low	177 Å²	177	135.7 Å²	135.7	83%	0.827	71%	0.707	S	S	*	*	H	α-helix	trans	-79.8	-16.1	-172.1	-159.6	162.6	-12.9	0	0	114.1
18	R	51.9	Low	50.2	Low	223 Å²	223	131.6 Å²	131.6	84%	0.842	69%	0.694	S	S	*	*	H	α-helix	trans	-82	-25.4	179.9	-75.3	-175.2	177.4	-175.4	-0.9	114.3	L16	L16-R18 PolarHBondContact O-N 3.44Å
19	C	51.6	Low	50.9	Low	84 Å²	84	129.5 Å²	129.5	57%	0.568	68%	0.682	S	S	*	*	H	α-helix	trans	-73.5	-34.8	-178.5	-80.6	0	0	0	0	113.2	V21 M22 L23	C19-V21 PolarHBondContact O-N 3.16Å; C19-M22 PolarHBondContact O-N 3.48Å; C19-L23 PolarHBondContact O-N 3.48Å; C19-L23 VanDerWaalsContact O-N 3.16Å
20	H	59.7	Low	52	Low	133 Å²	133	127.1 Å²	127.1	62%	0.616	67%	0.674	S	S	*	*	H	α-helix	trans	-69	-33.7	-178.1	-72.3	-73.7	0	0	0	113.4	S24	H20-S24 WeakPolarHBondContact O-CB 3.5Å; H20-S24 PolarHBondContact O-N 2.8Å
21	V	67.2	Low	52.9	Low	87 Å²	87	125.6 Å²	125.6	53%	0.527	67%	0.669	S	S	.	*	H	α-helix	trans	-69.4	-41.2	178.7	-175.9	0	0	0	0	111	C19 S24 W25	C19-V21 PolarHBondContact O-N 3.16Å; V21-S24 PolarHBondContact O-N 3.19Å; V21-W25 PolarHBondContact O-N 2.82Å
22	M	61.8	Low	53.5	Low	136 Å²	136	122.1 Å²	122.1	67%	0.67	66%	0.661	S	S	*	*	H	α-helix	trans	-65.1	-41.4	176.6	-73.6	-65.7	-148.1	0	0	112.3	C19 W25 C26	C19-M22 PolarHBondContact O-N 3.48Å; M22-W25 PolarHBondContact O-N 2.92Å; M22-C26 PolarHBondContact O-N 2.91Å
23	L	64.5	Low	54	Low	104 Å²	104	121.7 Å²	121.7	55%	0.545	65%	0.648	S	S	.	*	H	α-helix	trans	-66	-37.1	176.8	-82.9	154.5	0	0	0	112.3	C19 C26 Y27	C19-L23 PolarHBondContact O-N 3.48Å; C19-L23 VanDerWaalsContact O-N 3.16Å; L23-C26 PolarHBondContact O-N 2.78Å; L23-Y27 PolarHBondContact O-N 2.8Å
24	S	65	Low	54.6	Low	65 Å²	65	122 Å²	122	46%	0.455	65%	0.648	S	S	.	*	H	α-helix	trans	-67.5	-38.3	174.8	-173.1	0	0	0	0	112.2	H20 V21 Y27 L28	H20-S24 WeakPolarHBondContact O-CB 3.5Å; H20-S24 PolarHBondContact O-N 2.8Å; V21-S24 PolarHBondContact O-N 3.19Å; S24-Y27 PolarHBondContact O-N 2.86Å; S24-L28 PolarHBondContact O-N 3.48Å
25	W	61.6	Low	54.9	Low	176 Å²	176	123.4 Å²	123.4	67%	0.667	65%	0.648	S	S	*	*	H	α-helix	trans	-68.6	-40.3	175.2	-88.5	42	0	0	0	111.9	V21 M22 Y27 L28 L29	V21-W25 PolarHBondContact O-N 2.82Å; M22-W25 PolarHBondContact O-N 2.92Å; W25-Y27 VanDerWaalsContact C-N 3.33Å; W25-Y27 PolarHBondContact O-N 3.24Å; W25-L28 PolarHBondContact O-N 2.96Å; W25-L29 WeakPolarHBondContact O-CB 3.27Å; W25-L29 WeakPolarHBondContact O-CD1 3.35Å; W25-L29 WeakPolarHBondContact O-CG 3.31Å; W25-L29 PolarHBondContact O-N 3.06Å
26	C	59.9	Low	55.1	Low	77 Å²	77	123.6 Å²	123.6	52%	0.52	64%	0.641	S	S	.	*	H	α-helix	trans	-62.7	-38.1	171.8	-78.9	0	0	0	0	112.3	M22 L23 L29 L30	M22-C26 PolarHBondContact O-N 2.91Å; L23-C26 PolarHBondContact O-N 2.78Å; C26-L29 PolarHBondContact O-N 3.37Å; C26-L30 WeakPolarHBondContact O-CB 3.34Å; C26-L30 PolarHBondContact O-N 3.33Å
27	Y	60.1	Low	55.3	Low	183 Å²	183	122.5 Å²	122.5	72%	0.718	63%	0.632	S	S	*	*	H	α-helix	trans	-68.1	-39.7	175.7	-108.1	-88.5	0	0	0	112.8	L23 S24 W25 L30 S31	L23-Y27 PolarHBondContact O-N 2.8Å; S24-Y27 PolarHBondContact O-N 2.86Å; W25-Y27 VanDerWaalsContact C-N 3.33Å; W25-Y27 PolarHBondContact O-N 3.24Å; Y27-L30 PolarHBondContact O-N 2.9Å; Y27-S31 PolarHBondContact O-N 3.02Å; Y27-S31 PolarHBondContact O-OG 3.22Å
28	L	57.8	Low	55.7	Low	114 Å²	114	116.5 Å²	116.5	60%	0.597	61%	0.609	S	S	*	*	H	α-helix	trans	-65.6	-39.4	173.9	-97.8	148.1	0	0	0	112.1	S24 W25 S31 A32	S24-L28 PolarHBondContact O-N 3.48Å; W25-L28 PolarHBondContact O-N 2.96Å; L28-S31 WeakPolarHBondContact CA-OG 3.44Å; L28-S31 PolarHBondContact O-N 3.19Å; L28-S31 PolarHBondContact O-OG 3.49Å; L28-A32 PolarHBondContact O-N 3.48Å
29	L	52.9	Low	56.5	Low	122 Å²	122	107 Å²	107	64%	0.639	58%	0.575	S	S	*	*	H	α-helix	trans	-71.7	-33.6	174.7	-75.9	161.4	0	0	0	112.5	W25 C26 S31 A32	W25-L29 WeakPolarHBondContact O-CB 3.27Å; W25-L29 WeakPolarHBondContact O-CD1 3.35Å; W25-L29 WeakPolarHBondContact O-CG 3.31Å; W25-L29 PolarHBondContact O-N 3.06Å; C26-L29 PolarHBondContact O-N 3.37Å; L29-S31 VanDerWaalsContact C-N 3.33Å; L29-A32 PolarHBondContact O-N 2.75Å
30	L	52.7	Low	57.7	Low	132 Å²	132	106.7 Å²	106.7	69%	0.691	57%	0.568	S	S	*	*	H	α-helix	trans	-72.3	-26	174	-126.4	79.9	0	0	0	112.6	C26 Y27 A32 T33	C26-L30 WeakPolarHBondContact O-CB 3.34Å; C26-L30 PolarHBondContact O-N 3.33Å; Y27-L30 PolarHBondContact O-N 2.9Å; L30-A32 PolarHBondContact O-N 3.03Å; L30-T33 WeakPolarHBondContact O-CG2 3.46Å; L30-T33 PolarHBondContact O-N 3.36Å
31	S	51.4	Low	58.6	Low	88 Å²	88	101.8 Å²	101.8	62%	0.615	55%	0.546	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.1	-10.7	171.8	59.2	0	0	0	0	113.7	Y27 L28 L29 T33	Y27-S31 PolarHBondContact O-N 3.02Å; Y27-S31 PolarHBondContact O-OG 3.22Å; L28-S31 WeakPolarHBondContact CA-OG 3.44Å; L28-S31 PolarHBondContact O-N 3.19Å; L28-S31 PolarHBondContact O-OG 3.49Å; L29-S31 VanDerWaalsContact C-N 3.33Å; S31-T33 PolarHBondContact O-N 2.7Å
32	A	44.7	Very low	59	Low	65 Å²	65	101.3 Å²	101.3	54%	0.537	55%	0.546	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.2	29.4	170.7	0	0	0	0	0	112	L28 L29 L30 M34	L28-A32 PolarHBondContact O-N 3.48Å; L29-A32 PolarHBondContact O-N 2.75Å; L30-A32 PolarHBondContact O-N 3.03Å; A32-M34 VanDerWaalsContact C-N 3.35Å; A32-M34 PolarHBondContact O-N 2.9Å
33	T	48.9	Very low	60	Low	101 Å²	101	102.6 Å²	102.6	62%	0.62	55%	0.55	S	S	*	*			trans	-57.7	106.6	158.7	46.6	0	0	0	0	106.8	L30 S31 T35	L30-T33 WeakPolarHBondContact O-CG2 3.46Å; L30-T33 PolarHBondContact O-N 3.36Å; S31-T33 PolarHBondContact O-N 2.7Å; T33-T35 PolarHBondContact O-N 3.18Å
34	M	47.6	Very low	61.3	Low	159 Å²	159	97.7 Å²	97.7	78%	0.783	53%	0.525	S	S	*	.			trans	-42.3	106.5	164.8	-71.8	-73.4	149.9	0	0	107.4	A32 I36	A32-M34 VanDerWaalsContact C-N 3.35Å; A32-M34 PolarHBondContact O-N 2.9Å; M34-I36 PolarHBondContact O-N 3.48Å
35	T	46.2	Very low	62.7	Low	112 Å²	112	99.3 Å²	99.3	69%	0.687	53%	0.525	S	S	*	.			trans	-62	113.1	170.3	44.1	0	0	0	0	105.4	T33 E37	T33-T35 PolarHBondContact O-N 3.18Å; T35-E37 VanDerWaalsContact O-CG 3.3Å; T35-E37 WeakPolarHBondContact O-CG 3.42Å; T35-E37 PolarHBondContact O-N 3.43Å; T35-E37 VanDerWaalsContact O-N 3.1Å
36	I	50.7	Low	64.4	Low	124 Å²	124	93.8 Å²	93.8	64%	0.636	52%	0.518	S	S	*	.			trans	-62.5	112.5	177.5	-65.4	170.3	0	0	0	106.5	M34 C38 E370	M34-I36 PolarHBondContact O-N 3.48Å; I36-C38 PolarHBondContact O-N 3.02Å; I36-E370 HydrophobicContact CG2-CG 4.36Å
37	E	54.6	Low	66.2	Low	111 Å²	111	92.9 Å²	92.9	52%	0.519	52%	0.515	S	S	.	.			trans	-83.5	72.1	-174.5	-54.9	-172.2	133.4	0	0	109.4	T35 K203	T35-E37 VanDerWaalsContact O-CG 3.3Å; T35-E37 WeakPolarHBondContact O-CG 3.42Å; T35-E37 PolarHBondContact O-N 3.43Å; T35-E37 VanDerWaalsContact O-N 3.1Å; E37-K203 HydrophobicContact CB-CD 4.31Å; E37-K203 IonicContact OE1-NZ 3.66Å; E37-K203 PolarHBondContact OE1-NZ 3.31Å; E37-K203 WeakPolarHBondContact OE2-CD 3.33Å; E37-K203 WeakPolarHBondContact OE2-CE 3.45Å; E37-K203 IonicContact OE2-NZ 2.75Å; E37-K203 PolarHBondContact OE2-NZ 2.85Å
38	C	59.8	Low	68	Low	50 Å²	50	85.4 Å²	85.4	34%	0.338	49%	0.488	S	S	.	.			trans	-76	146.6	162.1	-177.5	0	0	0	0	108.6	I36 D40 R368	I36-C38 PolarHBondContact O-N 3.02Å; C38-D40 PolarHBondContact O-N 2.89Å; C38-R368 WeakPolarHBondContact SG-CD 3.18Å; C38-R368 PolarHBondContact SG-NE 2.98Å
39	L	68.7	Low	69.9	Low	24 Å²	24	80 Å²	80	13%	0.126	46%	0.459	C	S	.	.			trans	-63.1	100.9	170.4	-177.8	65.4	0	0	0	110.3	L41 C44 V110 E204	L39-L41 HydrophobicContact CD1-CD2 4.44Å; L39-L41 HydrophobicContact CD2-CD2 4.23Å; L39-L41 HydrophobicContact CG-CD2 4.31Å; L39-C44 HydrophobicContact CD1-CB 4.21Å; L39-V110 HydrophobicContact CD1-CB 4.15Å; L39-V110 HydrophobicContact CD1-CG1 4.16Å; L39-V110 HydrophobicContact CD1-CG2 3.9Å; L39-V110 HydrophobicContact CD2-CG1 4.14Å; L39-V110 HydrophobicContact CD2-CG2 4.07Å; L39-E204 WeakPolarHBondContact CB-OE1 3.44Å; L39-E204 PolarHBondContact N-OE1 2.86Å
40	D	75.4	Confident	72.1	Confident	78 Å²	78	74.2 Å²	74.2	42%	0.417	43%	0.429	S	S	.	.			trans	-96.6	108.2	161	-169.8	-20.3	0	0	0	108.7	C38 S42 E43 C44	C38-D40 PolarHBondContact O-N 2.89Å; D40-S42 PolarHBondContact O-N 3.5Å; D40-S42 VanDerWaalsContact O-N 3.14Å; D40-S42 VanDerWaalsContact OD1-CB 3.24Å; D40-S42 WeakPolarHBondContact OD1-CB 3.44Å; D40-S42 PolarHBondContact OD1-N 2.83Å; D40-S42 PolarHBondContact OD1-OG 3.34Å; D40-S42 PolarHBondContact OD2-OG 3.46Å; D40-E43 HydrophobicContact CB-CG 4.38Å; D40-E43 PolarHBondContact O-N 3.36Å; D40-E43 VanDerWaalsContact O-N 3.09Å; D40-C44 PolarHBondContact O-N 3.31Å; D40-C44 VanDerWaalsContact O-N 3.1Å
41	L	78.1	Confident	74.3	Confident	29 Å²	29	72.1 Å²	72.1	15%	0.152	42%	0.416	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60.6	-21.3	178.3	-72	178	0	0	0	113.6	L39 E43 V110 T112 P173 D246 R248	L39-L41 HydrophobicContact CD1-CD2 4.44Å; L39-L41 HydrophobicContact CD2-CD2 4.23Å; L39-L41 HydrophobicContact CG-CD2 4.31Å; L41-E43 VanDerWaalsContact C-N 3.34Å; L41-V110 HydrophobicContact CD2-CG1 4.2Å; L41-T112 HydrophobicContact CD2-CG2 3.69Å; L41-P173 HydrophobicContact CD1-CG 3.89Å; L41-P173 HydrophobicContact CD2-CB 4.18Å; L41-P173 HydrophobicContact CD2-CG 3.58Å; L41-P173 HydrophobicContact CG-CG 4.39Å; L41-D246 WeakPolarHBondContact CD1-O 3.31Å; L41-R248 HydrophobicContact CD1-CG 4.44Å
42	S	77.5	Confident	76.5	Confident	77 Å²	77	72.2 Å²	72.2	54%	0.538	42%	0.417	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.3	-32.9	176.7	73.9	0	0	0	0	111.9	D40	D40-S42 PolarHBondContact O-N 3.5Å; D40-S42 VanDerWaalsContact O-N 3.14Å; D40-S42 VanDerWaalsContact OD1-CB 3.24Å; D40-S42 WeakPolarHBondContact OD1-CB 3.44Å; D40-S42 PolarHBondContact OD1-N 2.83Å; D40-S42 PolarHBondContact OD1-OG 3.34Å; D40-S42 PolarHBondContact OD2-OG 3.46Å
43	E	82.2	Confident	79	Confident	163 Å²	163	71.1 Å²	71.1	76%	0.762	41%	0.411	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.7	-21	176.1	-59.2	-170.9	165.3	0	0	112.1	D40 L41 Q45	D40-E43 HydrophobicContact CB-CG 4.38Å; D40-E43 PolarHBondContact O-N 3.36Å; D40-E43 VanDerWaalsContact O-N 3.09Å; L41-E43 VanDerWaalsContact C-N 3.34Å; E43-Q45 VanDerWaalsContact C-N 3.27Å; E43-Q45 PolarHBondContact O-N 2.89Å
44	C	91.3	Very high	81.3	Confident	2 Å²	2	70.1 Å²	70.1	1%	0.014	41%	0.413	C	S	.	.			trans	-83.1	50.4	-179	-164.8	0	0	0	0	113.6	L39 D40 T112 G199 C200	L39-C44 HydrophobicContact CD1-CB 4.21Å; D40-C44 PolarHBondContact O-N 3.31Å; D40-C44 VanDerWaalsContact O-N 3.1Å; C44-T112 HydrophobicContact CB-CG2 4.22Å; C44-T112 WeakPolarHBondContact O-CB 3.44Å; C44-T112 WeakPolarHBondContact O-CG2 3.45Å; C44-T112 PolarHBondContact O-OG1 3.2Å; C44-G199 WeakPolarHBondContact O-CA 3.35Å; C44-G199 VanDerWaalsContact SG-C 3.57Å; C44-C200 HydrophobicContact CB-CB 3.94Å; C44-C200 WeakPolarHBondContact CB-SG 3.34Å; C44-C200 WeakPolarHBondContact SG-CB 3.49Å; C44-C200 PolarHBondContact SG-N 3.45Å; C44-C200 CovalentContact SG-SG 2.04Å; C44-C200 PolarHBondContact SG-SG 3.24Å
45	Q	94.4	Very high	83.7	Confident	98 Å²	98	63 Å²	63	46%	0.458	38%	0.379	S	S	.	.			trans	-126.1	14.5	-175.8	-59.1	-171	0.6	0	0	114.3	E43 Y198	E43-Q45 VanDerWaalsContact C-N 3.27Å; E43-Q45 PolarHBondContact O-N 2.89Å; Q45-Y198 VanDerWaalsContact O-CD1 3.3Å; Q45-Y198 WeakPolarHBondContact O-CD1 3.37Å
46	A	97.1	Very high	86.2	Confident	61 Å²	61	59 Å²	59	50%	0.504	36%	0.357	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.5	147.5	-178.7	0	0	0	0	0	111.9	Y198 G199	A46-Y198 CarbonylContact O-C 3.59Å; A46-Y198 WeakPolarHBondContact O-CA 3.49Å; A46-G199 PolarHBondContact N-O 2.99Å; A46-G199 PolarHBondContact O-N 3.4Å
47	A	98.2	Very high	88.4	Confident	57 Å²	57	55.5 Å²	55.5	47%	0.471	35%	0.346	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67	132.6	174	0	0	0	0	0	110.3	E196 Y198	A47-E196 HydrophobicContact CB-CG 4.2Å; A47-Y198 HydrophobicContact CB-CD1 4.09Å; A47-Y198 HydrophobicContact CB-CE1 3.82Å
48	L	98.3	Very high	90.5	Very high	27 Å²	27	56.9 Å²	56.9	14%	0.141	35%	0.352	C	S	.	.			trans	-81.6	-18.9	-176.4	-60.9	-172.8	0	0	0	112.8	I55 L105 H109 I111 L197	L48-I55 HydrophobicContact CB-CD1 4.18Å; L48-L105 HydrophobicContact CB-CD2 4.44Å; L48-L105 HydrophobicContact CD1-CD1 3.88Å; L48-L105 HydrophobicContact CD1-CD2 4.01Å; L48-H109 HydrophobicContact CD1-CB 4.42Å; L48-I111 HydrophobicContact CD1-CG1 4.38Å; L48-L197 HydrophobicContact CB-CB 4.21Å; L48-L197 HydrophobicContact CD1-CB 3.78Å; L48-L197 HydrophobicContact CG-CB 4.14Å; L48-L197 PolarHBondContact N-O 2.83Å
49	G	98.2	Very high	92.3	Very high	0 Å²	0	55.5 Å²	55.5	0%	0	34%	0.342	C	S	.	.	S	Bend	trans	118.5	37	160.5	0	0	0	0	0	115.6	S52 G53 A54 I55 E196	G49-S52 WeakPolarHBondContact CA-OG 3.36Å; G49-G53 CarbonylContact O-C 3.48Å; G49-G53 PolarHBondContact O-N 3.4Å; G49-A54 PolarHBondContact O-N 2.9Å; G49-I55 PolarHBondContact O-N 2.86Å; G49-E196 PolarHBondContact N-OE1 2.94Å
50	M	98.3	Very high	93.8	Very high	0 Å²	0	54.5 Å²	54.5	0%	0	34%	0.336	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64.3	-48.5	162.8	-64.3	-64.6	-67.6	0	0	110	I55 I60 R77 V103 V195 E196	M50-I55 HydrophobicContact CG-CD1 4.04Å; M50-I55 HydrophobicContact SD-CB 4.23Å; M50-I55 HydrophobicContact SD-CD1 3.81Å; M50-I55 HydrophobicContact SD-CG2 4.01Å; M50-I60 HydrophobicContact CE-CD1 3.56Å; M50-I60 HydrophobicContact CE-CG1 3.99Å; M50-I60 HydrophobicContact CE-CG2 4.16Å; M50-I60 HydrophobicContact SD-CD1 4.05Å; M50-I60 HydrophobicContact SD-CG1 4.21Å; M50-R77 HydrophobicContact CE-CG 4.39Å; M50-R77 WeakPolarHBondContact O-CB 3.39Å; M50-R77 WeakPolarHBondContact O-CD 3.41Å; M50-R77 WeakPolarHBondContact O-CG 3.2Å; M50-R77 PolarHBondContact O-NH1 2.81Å; M50-V103 HydrophobicContact CE-CG2 4.18Å; M50-V103 HydrophobicContact SD-CG1 4.02Å; M50-V103 HydrophobicContact SD-CG2 3.94Å; M50-V195 WeakPolarHBondContact CB-O 3.24Å; M50-V195 HydrophobicContact CE-CG2 3.75Å; M50-V195 HydrophobicContact CG-CG2 4.47Å; M50-V195 WeakPolarHBondContact CG-O 3.05Å; M50-E196 HydrophobicContact CB-CB 4.4Å; M50-E196 WeakPolarHBondContact CB-OE1 3.48Å; M50-E196 WeakPolarHBondContact CG-OE1 3.43Å; M50-E196 PolarHBondContact N-OE1 2.81Å; M50-E196 PolarHBondContact N-OE2 3.09Å; M50-E196 VanDerWaalsContact N-OE2 3.07Å
51	E	98	Very high	94.9	Very high	88 Å²	88	54.9 Å²	54.9	41%	0.411	34%	0.338	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.2	-47.3	179.1	-167.3	168.5	167.9	0	0	112.3	G53 I78 R79 E196	E51-G53 PolarHBondContact O-N 3.48Å; E51-I78 HydrophobicContact CB-CG2 3.65Å; E51-I78 HydrophobicContact CG-CG2 4.16Å; E51-I78 WeakPolarHBondContact OE2-CG2 3.39Å; E51-R79 WeakPolarHBondContact OE1-CD 3.47Å; E51-R79 WeakPolarHBondContact OE2-CD 3.41Å; E51-R79 IonicContact OE2-CZ 3.05Å; E51-R79 IonicContact OE2-NE 3.9Å; E51-R79 IonicContact OE2-NH1 3.72Å; E51-R79 PolarHBondContact OE2-NH1 2.8Å; E51-E196 PolarHBondContact N-OE2 2.78Å
52	S	97.8	Very high	95.8	Very high	91 Å²	91	54.8 Å²	54.8	64%	0.636	34%	0.341	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.1	-17.3	-174.7	66.6	0	0	0	0	113.7	G49 A54	G49-S52 WeakPolarHBondContact CA-OG 3.36Å; S52-A54 VanDerWaalsContact C-N 3.32Å; S52-A54 PolarHBondContact OG-N 3.38Å
53	G	97.5	Very high	96.8	Very high	41 Å²	41	53.2 Å²	53.2	42%	0.423	33%	0.331	S	S	.	.	S	Bend	trans	82.7	4.2	-174.2	0	0	0	0	0	114.4	G49 E51 I55	G49-G53 CarbonylContact O-C 3.48Å; G49-G53 PolarHBondContact O-N 3.4Å; E51-G53 PolarHBondContact O-N 3.48Å; G53-I55 PolarHBondContact O-N 2.89Å
54	A	98	Very high	97.6	Very high	80 Å²	80	46.7 Å²	46.7	66%	0.661	30%	0.303	S	S	*	.			trans	-61.9	-34	175.2	0	0	0	0	0	111.8	G49 S52 A56	G49-A54 PolarHBondContact O-N 2.9Å; S52-A54 VanDerWaalsContact C-N 3.32Å; S52-A54 PolarHBondContact OG-N 3.38Å; A54-A56 PolarHBondContact O-N 3.48Å
55	I	98.4	Very high	97.9	Very high	11 Å²	11	47.7 Å²	47.7	6%	0.056	31%	0.31	C	S	.	.	S	Bend	trans	-79.7	115.1	164.5	-62.7	172	0	0	0	107.5	L48 G49 M50 G53 D59 I60 R77 V103 L105	L48-I55 HydrophobicContact CB-CD1 4.18Å; G49-I55 PolarHBondContact O-N 2.86Å; M50-I55 HydrophobicContact CG-CD1 4.04Å; M50-I55 HydrophobicContact SD-CB 4.23Å; M50-I55 HydrophobicContact SD-CD1 3.81Å; M50-I55 HydrophobicContact SD-CG2 4.01Å; G53-I55 PolarHBondContact O-N 2.89Å; I55-D59 HydrophobicContact CG2-CB 4.15Å; I55-I60 HydrophobicContact CG2-CG1 4.05Å; I55-R77 VanDerWaalsContact O-CZ 3.26Å; I55-R77 PolarHBondContact O-NH1 3.41Å; I55-R77 PolarHBondContact O-NH2 2.88Å; I55-V103 HydrophobicContact CD1-CG1 3.89Å; I55-V103 HydrophobicContact CG2-CG1 4.03Å; I55-L105 HydrophobicContact CD1-CD2 3.71Å; I55-L105 HydrophobicContact CG1-CD2 4.33Å
56	A	98.2	Very high	97.9	Very high	28 Å²	28	50.4 Å²	50.4	23%	0.231	32%	0.321	C	S	.	.			trans	-72.9	157.3	-174.9	0	0	0	0	0	112.4	A54 Q58 D59	A54-A56 PolarHBondContact O-N 3.48Å; A56-Q58 VanDerWaalsContact C-N 3.29Å; A56-Q58 HydrophobicContact CB-CG 4.43Å; A56-Q58 VanDerWaalsContact CB-OE1 3.31Å; A56-Q58 PolarHBondContact O-N 3.45Å; A56-D59 WeakPolarHBondContact O-CB 3.36Å; A56-D59 PolarHBondContact O-N 2.9Å
57	A	97.4	Very high	97.9	Very high	49 Å²	49	50.9 Å²	50.9	41%	0.405	31%	0.314	S	S	.	.	G	3₁₀ helix	trans	-61.4	-35.9	-175.7	0	0	0	0	0	113	D59 I60 Q74	A57-D59 PolarHBondContact O-N 3.44Å; A57-I60 PolarHBondContact O-N 3.34Å; A57-I60 VanDerWaalsContact O-N 3.16Å; A57-Q74 HydrophobicContact CB-CB 4.08Å
58	Q	97.9	Very high	97.8	Very high	140 Å²	140	53.2 Å²	53.2	65%	0.654	32%	0.315	S	S	*	.	G	3₁₀ helix	trans	-65.3	-16.2	176.5	67	-86.8	15.2	0	0	114.1	A56	A56-Q58 VanDerWaalsContact C-N 3.29Å; A56-Q58 HydrophobicContact CB-CG 4.43Å; A56-Q58 VanDerWaalsContact CB-OE1 3.31Å; A56-Q58 PolarHBondContact O-N 3.45Å
59	D	98.5	Very high	97.6	Very high	21 Å²	21	55.2 Å²	55.2	11%	0.112	34%	0.336	C	S	.	.	G	3₁₀ helix	trans	-93.8	0.5	179.8	-65.6	-42	0	0	0	112.8	I55 A56 A57 N104 H106	I55-D59 HydrophobicContact CG2-CB 4.15Å; A56-D59 WeakPolarHBondContact O-CB 3.36Å; A56-D59 PolarHBondContact O-N 2.9Å; A57-D59 PolarHBondContact O-N 3.44Å; D59-N104 HydrophobicContact CB-CB 4.16Å; D59-N104 PolarHBondContact O-N 3.48Å; D59-H106 IonicContact OD1-CD2 3.65Å; D59-H106 IonicContact OD1-CE1 2.89Å; D59-H106 PolarHBondContact OD1-CE1 3.42Å; D59-H106 IonicContact OD1-NE2 3.42Å; D59-H106 PolarHBondContact OD1-NE2 3.33Å; D59-H106 IonicContact OD2-CD2 3.02Å; D59-H106 IonicContact OD2-CE1 3.6Å; D59-H106 IonicContact OD2-NE2 3.46Å; D59-H106 PolarHBondContact OD2-NE2 2.92Å
60	I	98.6	Very high	97.4	Very high	3 Å²	3	57.2 Å²	57.2	2%	0.015	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110	110.8	174.3	-46.2	168	0	0	0	107.6	M50 I55 A57 P73 R77 L101 Q102	M50-I60 HydrophobicContact CE-CD1 3.56Å; M50-I60 HydrophobicContact CE-CG1 3.99Å; M50-I60 HydrophobicContact CE-CG2 4.16Å; M50-I60 HydrophobicContact SD-CD1 4.05Å; M50-I60 HydrophobicContact SD-CG1 4.21Å; I55-I60 HydrophobicContact CG2-CG1 4.05Å; A57-I60 PolarHBondContact O-N 3.34Å; A57-I60 VanDerWaalsContact O-N 3.16Å; I60-P73 HydrophobicContact CG2-CB 4.06Å; I60-P73 VanDerWaalsContact CG2-O 3.25Å; I60-P73 WeakPolarHBondContact CG2-O 3.41Å; I60-R77 HydrophobicContact CD1-CG 4.28Å; I60-L101 HydrophobicContact CG2-CD1 3.82Å; I60-L101 HydrophobicContact CG2-CG 4.36Å; I60-Q102 WeakPolarHBondContact CA-O 3.4Å
61	L	98.4	Very high	97.3	Very high	86 Å²	86	57.7 Å²	57.7	45%	0.45	35%	0.353	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	166.3	-177.8	-57.6	177.7	0	0	0	110.1	L101 Q102	L61-L101 CarbonylContact O-C 3.42Å; L61-Q102 HydrophobicContact CB-CB 4.35Å; L61-Q102 PolarHBondContact N-O 3.41Å; L61-Q102 PolarHBondContact O-N 2.8Å
62	A	98.4	Very high	97.3	Very high	27 Å²	27	53.5 Å²	53.5	22%	0.223	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143	163.2	172.5	0	0	0	0	0	111.8	S64 P73 W87 Y100 L101	A62-S64 VanDerWaalsContact C-N 3.33Å; A62-P73 HydrophobicContact CB-CB 3.98Å; A62-P73 HydrophobicContact CB-CG 4.3Å; A62-W87 HydrophobicContact CB-CZ2 4Å; A62-Y100 CarbonylContact C-O 3.57Å; A62-Y100 WeakPolarHBondContact CA-O 3.38Å; A62-Y100 WeakPolarHBondContact CB-O 3.5Å; A62-L101 HydrophobicContact CB-CD1 4.45Å
63	S	97.9	Very high	97.4	Very high	45 Å²	45	49.5 Å²	49.5	32%	0.315	31%	0.305	S	S	.	.	S	Bend	trans	-62.5	-41	169.4	47.2	0	0	0	0	112.3	E99 Y100	S63-E99 WeakPolarHBondContact CB-OE2 2.87Å; S63-E99 VanDerWaalsContact OG-CA 3.29Å; S63-E99 WeakPolarHBondContact OG-CA 3.4Å; S63-E99 PolarHBondContact OG-OE2 3.39Å; S63-Y100 PolarHBondContact N-O 2.84Å; S63-Y100 PolarHBondContact OG-N 3.25Å; S63-Y100 PolarHBondContact OG-O 2.84Å
64	S	98.1	Very high	97.3	Very high	26 Å²	26	49.9 Å²	49.9	18%	0.182	30%	0.296	C	S	.	.			trans	-159.2	167.1	179.4	74.7	0	0	0	0	110.6	A62 W87 S90 E99	A62-S64 VanDerWaalsContact C-N 3.33Å; S64-W87 PolarHBondContact O-NE1 3.46Å; S64-S90 VanDerWaalsContact CB-OG 3.27Å; S64-S90 WeakPolarHBondContact CB-OG 3.48Å; S64-S90 WeakPolarHBondContact OG-CB 3.25Å; S64-S90 PolarHBondContact OG-N 3.04Å; S64-S90 PolarHBondContact OG-OG 2.85Å; S64-E99 WeakPolarHBondContact CB-OE2 3.1Å; S64-E99 PolarHBondContact OG-OE1 3.47Å; S64-E99 VanDerWaalsContact OG-OE1 3.14Å; S64-E99 PolarHBondContact OG-OE2 3.49Å
65	S	97.8	Very high	97.3	Very high	22 Å²	22	48.4 Å²	48.4	15%	0.154	27%	0.274	C	S	.	.			trans	-138.8	142.3	170.5	-178.7	0	0	0	0	109.2	D67 E68 V71 G72 C88	S65-D67 VanDerWaalsContact C-N 3.32Å; S65-D67 PolarHBondContact OG-N 3.29Å; S65-D67 PolarHBondContact OG-O 2.85Å; S65-E68 WeakPolarHBondContact CB-OE2 3.35Å; S65-V71 PolarHBondContact OG-O 2.83Å; S65-V71 VanDerWaalsContact OG-O 3.06Å; S65-G72 PolarHBondContact OG-N 2.88Å; S65-C88 CarbonylContact C-O 3.6Å; S65-C88 WeakPolarHBondContact CA-O 3.32Å
66	F	96	Very high	97.3	Very high	156 Å²	156	47.9 Å²	47.9	68%	0.684	27%	0.271	S	S	*	.	S	Bend	trans	-64.1	-40	173.8	179.8	-95.7	0	0	0	111.9	V71 C88	F66-V71 HydrophobicContact CB-CG2 3.96Å; F66-C88 PolarHBondContact N-O 2.86Å
67	D	96.2	Very high	97.3	Very high	70 Å²	70	48.1 Å²	48.1	37%	0.374	27%	0.266	S	S	.	.			trans	-151.5	116.6	171.3	170.1	31.3	0	0	0	108.6	S65 A69 S70 V71 G72	S65-D67 VanDerWaalsContact C-N 3.32Å; S65-D67 PolarHBondContact OG-N 3.29Å; S65-D67 PolarHBondContact OG-O 2.85Å; D67-A69 PolarHBondContact O-N 3.35Å; D67-A69 PolarHBondContact OD1-N 3.33Å; D67-S70 PolarHBondContact O-N 2.92Å; D67-S70 WeakPolarHBondContact OD2-CB 3.47Å; D67-S70 PolarHBondContact OD2-N 2.85Å; D67-V71 HydrophobicContact CB-CG2 4.29Å; D67-V71 CarbonylContact O-C 3.6Å; D67-V71 WeakPolarHBondContact O-CA 3.17Å; D67-V71 WeakPolarHBondContact O-CG2 3.4Å; D67-V71 PolarHBondContact O-N 3.44Å; D67-G72 PolarHBondContact O-N 2.83Å
68	E	95.2	Very high	97.3	Very high	106 Å²	106	45.8 Å²	45.8	50%	0.495	25%	0.247	S	C	.	.	H	α-helix	trans	-63.2	-31.3	-175.7	-163.2	63.5	-166.7	0	0	112.6	S65 P73 Q74	S65-E68 WeakPolarHBondContact CB-OE2 3.35Å; E68-P73 WeakPolarHBondContact OE1-CD 3.27Å; E68-Q74 PolarHBondContact O-NE2 2.89Å
69	A	94.9	Very high	97.3	Very high	69 Å²	69	44.3 Å²	44.3	57%	0.57	24%	0.235	S	C	*	.	H	α-helix	trans	-74.6	-35.5	-178	0	0	0	0	0	112.6	D67 Y75	D67-A69 PolarHBondContact O-N 3.35Å; D67-A69 PolarHBondContact OD1-N 3.33Å; A69-Y75 WeakPolarHBondContact O-CE2 3.48Å; A69-Y75 PolarHBondContact O-OH 2.87Å
70	S	94.7	Very high	97.1	Very high	43 Å²	43	44.8 Å²	44.8	30%	0.301	24%	0.239	S	C	.	.	H	α-helix	trans	-100.1	-48.1	-176.4	-173	0	0	0	0	113.2	D67 Y75 G84	D67-S70 PolarHBondContact O-N 2.92Å; D67-S70 WeakPolarHBondContact OD2-CB 3.47Å; D67-S70 PolarHBondContact OD2-N 2.85Å; S70-Y75 WeakPolarHBondContact O-CD2 3.47Å; S70-Y75 WeakPolarHBondContact O-CE2 3.43Å; S70-G84 WeakPolarHBondContact O-CA 3.36Å; S70-G84 PolarHBondContact O-N 3.32Å; S70-G84 WeakPolarHBondContact OG-CA 3.46Å
71	V	96.4	Very high	96.8	Very high	10 Å²	10	48 Å²	48	6%	0.061	26%	0.256	C	S	.	.	H	α-helix	trans	-126.7	30.9	-169.9	-64.9	0	0	0	0	112.9	S65 F66 D67 A86 W87 C88	S65-V71 PolarHBondContact OG-O 2.83Å; S65-V71 VanDerWaalsContact OG-O 3.06Å; F66-V71 HydrophobicContact CB-CG2 3.96Å; D67-V71 HydrophobicContact CB-CG2 4.29Å; D67-V71 CarbonylContact O-C 3.6Å; D67-V71 WeakPolarHBondContact O-CA 3.17Å; D67-V71 WeakPolarHBondContact O-CG2 3.4Å; D67-V71 PolarHBondContact O-N 3.44Å; V71-A86 CarbonylContact C-O 3.49Å; V71-A86 WeakPolarHBondContact CA-O 3.27Å; V71-A86 WeakPolarHBondContact CB-O 3.32Å; V71-W87 VanDerWaalsContact O-CA 3.31Å; V71-W87 WeakPolarHBondContact O-CA 3.3Å; V71-C88 HydrophobicContact CB-CB 3.87Å; V71-C88 HydrophobicContact CG1-CB 4.42Å; V71-C88 HydrophobicContact CG2-CB 3.83Å; V71-C88 PolarHBondContact O-N 3.33Å
72	G	97.8	Very high	96.6	Very high	0 Å²	0	48 Å²	48	0%	0	26%	0.259	C	S	.	.			trans	-64.8	164.8	172.2	0	0	0	0	0	114.3	S65 D67 Q74 Y75	S65-G72 PolarHBondContact OG-N 2.88Å; D67-G72 PolarHBondContact O-N 2.83Å; G72-Q74 VanDerWaalsContact C-OE1 3.22Å; G72-Q74 PolarHBondContact O-N 3.45Å; G72-Y75 PolarHBondContact O-N 3.5Å; G72-Y75 VanDerWaalsContact O-N 3.15Å
73	P	98.2	Very high	96.3	Very high	7 Å²	7	49.8 Å²	49.8	5%	0.045	27%	0.274	C	S	.	.	G	3₁₀ helix	trans	-56.1	-33.3	-178.1	22.9	-33.5	0	0	0	113.9	I60 A62 E68 Y75 A76 L101	I60-P73 HydrophobicContact CG2-CB 4.06Å; I60-P73 VanDerWaalsContact CG2-O 3.25Å; I60-P73 WeakPolarHBondContact CG2-O 3.41Å; A62-P73 HydrophobicContact CB-CB 3.98Å; A62-P73 HydrophobicContact CB-CG 4.3Å; E68-P73 WeakPolarHBondContact OE1-CD 3.27Å; P73-Y75 PolarHBondContact O-N 3.5Å; P73-Y75 VanDerWaalsContact O-N 3.1Å; P73-A76 WeakPolarHBondContact O-CB 3.32Å; P73-A76 PolarHBondContact O-N 3.25Å; P73-L101 HydrophobicContact CB-CD1 3.77Å
74	Q	97.4	Very high	96.1	Very high	49 Å²	49	47.9 Å²	47.9	23%	0.229	26%	0.262	C	S	.	.	G	3₁₀ helix	trans	-60.3	-21.1	179.6	69.1	-80.7	16.2	0	0	114.3	A57 E68 G72	A57-Q74 HydrophobicContact CB-CB 4.08Å; E68-Q74 PolarHBondContact O-NE2 2.89Å; G72-Q74 VanDerWaalsContact C-OE1 3.22Å; G72-Q74 PolarHBondContact O-N 3.45Å
75	Y	97.6	Very high	95.9	Very high	48 Å²	48	46.7 Å²	46.7	19%	0.188	25%	0.253	C	S	.	.	G	3₁₀ helix	trans	-94.6	4.4	178	-50	-60.5	0	0	0	113.1	A69 S70 G72 P73 R77 V82 A83 A86	A69-Y75 WeakPolarHBondContact O-CE2 3.48Å; A69-Y75 PolarHBondContact O-OH 2.87Å; S70-Y75 WeakPolarHBondContact O-CD2 3.47Å; S70-Y75 WeakPolarHBondContact O-CE2 3.43Å; G72-Y75 PolarHBondContact O-N 3.5Å; G72-Y75 VanDerWaalsContact O-N 3.15Å; P73-Y75 PolarHBondContact O-N 3.5Å; P73-Y75 VanDerWaalsContact O-N 3.1Å; Y75-R77 PolarHBondContact O-N 2.84Å; Y75-V82 HydrophobicContact CD1-CB 4.05Å; Y75-V82 HydrophobicContact CD1-CG1 3.96Å; Y75-V82 HydrophobicContact CE1-CB 4.44Å; Y75-V82 HydrophobicContact CE1-CG1 3.84Å; Y75-A83 HydrophobicContact CD1-CB 4.05Å; Y75-A83 HydrophobicContact CD2-CB 4.17Å; Y75-A83 HydrophobicContact CE1-CB 3.63Å; Y75-A83 HydrophobicContact CE2-CB 3.74Å; Y75-A83 HydrophobicContact CG-CB 4.3Å; Y75-A83 VanDerWaalsContact CZ-CB 3.43Å; Y75-A86 WeakPolarHBondContact O-CA 3.28Å
76	A	98	Very high	95.9	Very high	0 Å²	0	45.6 Å²	45.6	0%	0	25%	0.246	C	C	.	.			trans	-77.3	22.6	179	0	0	0	0	0	114.2	P73 W87 L101 R194 V195	P73-A76 WeakPolarHBondContact O-CB 3.32Å; P73-A76 PolarHBondContact O-N 3.25Å; A76-W87 HydrophobicContact CB-CB 3.64Å; A76-L101 HydrophobicContact CB-CD1 3.78Å; A76-L101 HydrophobicContact CB-CD2 3.45Å; A76-L101 VanDerWaalsContact CB-CD2 3.45Å; A76-L101 HydrophobicContact CB-CG 4.27Å; A76-R194 CarbonylContact O-C 3.52Å; A76-R194 WeakPolarHBondContact O-CA 2.82Å; A76-V195 PolarHBondContact O-N 3.28Å
77	R	98.1	Very high	96	Very high	33 Å²	33	38.2 Å²	38.2	13%	0.125	21%	0.213	C	C	.	.	B	Isolated β-bridge	trans	-86.1	130.5	-175.2	-61.8	173.2	-179.7	-81.2	0.4	110.4	M50 I55 I60 Y75 T80 R194	M50-R77 HydrophobicContact CE-CG 4.39Å; M50-R77 WeakPolarHBondContact O-CB 3.39Å; M50-R77 WeakPolarHBondContact O-CD 3.41Å; M50-R77 WeakPolarHBondContact O-CG 3.2Å; M50-R77 PolarHBondContact O-NH1 2.81Å; I55-R77 VanDerWaalsContact O-CZ 3.26Å; I55-R77 PolarHBondContact O-NH1 3.41Å; I55-R77 PolarHBondContact O-NH2 2.88Å; I60-R77 HydrophobicContact CD1-CG 4.28Å; Y75-R77 PolarHBondContact O-N 2.84Å; R77-T80 HydrophobicContact CB-CG2 3.72Å; R77-T80 WeakPolarHBondContact CB-OG1 3.18Å; R77-T80 PolarHBondContact O-N 2.83Å; R77-T80 PolarHBondContact O-OG1 3.47Å; R77-R194 VanDerWaalsContact O-CD 3.31Å; R77-R194 WeakPolarHBondContact O-CD 3.25Å; R77-R194 WeakPolarHBondContact O-CG 3.25Å
78	I	98	Very high	96.1	Very high	0 Å²	0	35.2 Å²	35.2	0%	0	20%	0.198	C	C	.	.	T	Hydrogen-bonded Turn	trans	-53.2	145.3	178.3	-156	78.9	0	0	0	111.5	E51 T80 E115 Q117 A165 R194 V195 E196	E51-I78 HydrophobicContact CB-CG2 3.65Å; E51-I78 HydrophobicContact CG-CG2 4.16Å; E51-I78 WeakPolarHBondContact OE2-CG2 3.39Å; I78-T80 WeakPolarHBondContact O-CG2 3.45Å; I78-T80 PolarHBondContact O-N 3.29Å; I78-E115 HydrophobicContact CD1-CG 3.86Å; I78-E115 HydrophobicContact CG1-CG 4.21Å; I78-Q117 HydrophobicContact CD1-CB 3.45Å; I78-Q117 VanDerWaalsContact CD1-CB 3.45Å; I78-Q117 HydrophobicContact CG1-CB 4.5Å; I78-A165 HydrophobicContact CD1-CB 4.35Å; I78-R194 HydrophobicContact CD1-CB 4.48Å; I78-V195 PolarHBondContact N-O 3.34Å; I78-V195 VanDerWaalsContact N-O 3.16Å; I78-E196 HydrophobicContact CB-CB 3.91Å; I78-E196 HydrophobicContact CG1-CB 4.47Å; I78-E196 HydrophobicContact CG2-CB 3.56Å; I78-E196 HydrophobicContact CG2-CG 4.15Å
79	R	96.5	Very high	96.2	Very high	110 Å²	110	30.4 Å²	30.4	42%	0.415	18%	0.176	S	C	.	.	T	Hydrogen-bonded Turn	trans	56.4	11.3	177.4	-54.6	-179.7	-169.3	69.4	8.9	115.8	E51 E115	E51-R79 WeakPolarHBondContact OE1-CD 3.47Å; E51-R79 WeakPolarHBondContact OE2-CD 3.41Å; E51-R79 IonicContact OE2-CZ 3.05Å; E51-R79 IonicContact OE2-NE 3.9Å; E51-R79 IonicContact OE2-NH1 3.72Å; E51-R79 PolarHBondContact OE2-NH1 2.8Å; R79-E115 IonicContact CZ-OE1 2.73Å; R79-E115 IonicContact CZ-OE2 3.95Å; R79-E115 VanDerWaalsContact CZ-OE2 3.25Å; R79-E115 IonicContact NH1-OE2 2.69Å; R79-E115 PolarHBondContact NH1-OE2 2.66Å; R79-E115 IonicContact NH2-OE1 3.2Å; R79-E115 PolarHBondContact NH2-OE1 3.35Å; R79-E115 IonicContact NH2-OE2 3.44Å; R79-E115 PolarHBondContact NH2-OE2 2.79Å
80	T	94.7	Very high	96.3	Very high	31 Å²	31	29.7 Å²	29.7	19%	0.19	17%	0.167	C	C	.	.			trans	-100.4	154	172.7	71.9	0	0	0	0	111.4	R77 I78 R194	R77-T80 HydrophobicContact CB-CG2 3.72Å; R77-T80 WeakPolarHBondContact CB-OG1 3.18Å; R77-T80 PolarHBondContact O-N 2.83Å; R77-T80 PolarHBondContact O-OG1 3.47Å; I78-T80 WeakPolarHBondContact O-CG2 3.45Å; I78-T80 PolarHBondContact O-N 3.29Å; T80-R194 VanDerWaalsContact O-CD 3.31Å; T80-R194 WeakPolarHBondContact O-CD 3.41Å; T80-R194 PolarHBondContact O-NH1 3.07Å
81	D	92.5	Very high	96.4	Very high	69 Å²	69	30 Å²	30	37%	0.369	17%	0.167	S	C	.	.			trans	-140	64.7	175.1	-164.9	35.9	0	0	0	109.7	G85 H120 G121 G122	D81-G85 WeakPolarHBondContact OD1-CA 3.27Å; D81-H120 IonicContact OD2-CD2 2.91Å; D81-H120 PolarHBondContact OD2-CD2 2.99Å; D81-G121 VanDerWaalsContact OD1-CA 3.23Å; D81-G121 WeakPolarHBondContact OD1-CA 3.49Å; D81-G121 PolarHBondContact OD1-N 2.87Å; D81-G122 WeakPolarHBondContact OD2-CA 3.44Å; D81-G122 PolarHBondContact OD2-N 3.06Å
82	V	93.4	Very high	96.4	Very high	86 Å²	86	33.4 Å²	33.4	52%	0.521	18%	0.182	S	C	.	.			trans	-102.9	138.2	179.5	-178	0	0	0	0	109.4	Y75 G84 G85	Y75-V82 HydrophobicContact CD1-CB 4.05Å; Y75-V82 HydrophobicContact CD1-CG1 3.96Å; Y75-V82 HydrophobicContact CE1-CB 4.44Å; Y75-V82 HydrophobicContact CE1-CG1 3.84Å; V82-G84 PolarHBondContact O-N 3.23Å; V82-G85 WeakPolarHBondContact O-CA 3.28Å; V82-G85 PolarHBondContact O-N 3.49Å
83	A	93.1	Very high	96.4	Very high	65 Å²	65	33.4 Å²	33.4	54%	0.537	18%	0.182	S	C	.	.	T	Hydrogen-bonded Turn	trans	54.4	-117.6	-175	0	0	0	0	0	112	Y75 G85	Y75-A83 HydrophobicContact CD1-CB 4.05Å; Y75-A83 HydrophobicContact CD2-CB 4.17Å; Y75-A83 HydrophobicContact CE1-CB 3.63Å; Y75-A83 HydrophobicContact CE2-CB 3.74Å; Y75-A83 HydrophobicContact CG-CB 4.3Å; Y75-A83 VanDerWaalsContact CZ-CB 3.43Å; A83-G85 VanDerWaalsContact C-N 3.27Å; A83-G85 PolarHBondContact O-N 3.4Å
84	G	92.6	Very high	96.3	Very high	6 Å²	6	34.5 Å²	34.5	6%	0.062	19%	0.188	C	C	.	.	T	Hydrogen-bonded Turn	trans	-77.2	-10.4	175.6	0	0	0	0	0	114.2	S70 V82 R119	S70-G84 WeakPolarHBondContact O-CA 3.36Å; S70-G84 PolarHBondContact O-N 3.32Å; S70-G84 WeakPolarHBondContact OG-CA 3.46Å; V82-G84 PolarHBondContact O-N 3.23Å; G84-R119 VanDerWaalsContact O-CD 3.27Å; G84-R119 WeakPolarHBondContact O-CD 3.22Å; G84-R119 WeakPolarHBondContact O-CG 3.43Å; G84-R119 PolarHBondContact O-NH1 2.78Å; G84-R119 VanDerWaalsContact O-NH1 3.11Å
85	G	94.1	Very high	96.3	Very high	0 Å²	0	38.1 Å²	38.1	0%	0	21%	0.205	C	C	.	.	S	Bend	trans	85.6	6.1	167.9	0	0	0	0	0	116.3	D81 V82 A83 R194	D81-G85 WeakPolarHBondContact OD1-CA 3.27Å; V82-G85 WeakPolarHBondContact O-CA 3.28Å; V82-G85 PolarHBondContact O-N 3.49Å; A83-G85 VanDerWaalsContact C-N 3.27Å; A83-G85 PolarHBondContact O-N 3.4Å; G85-R194 VanDerWaalsContact O-CD 3.26Å; G85-R194 WeakPolarHBondContact O-CD 3.43Å
86	A	97.7	Very high	96.2	Very high	0 Å²	0	41.7 Å²	41.7	0%	0	23%	0.232	C	C	.	.	S	Bend	trans	-169.1	170.4	174.6	0	0	0	0	0	110.3	V71 Y75 R119 C192 R194	V71-A86 CarbonylContact C-O 3.49Å; V71-A86 WeakPolarHBondContact CA-O 3.27Å; V71-A86 WeakPolarHBondContact CB-O 3.32Å; Y75-A86 WeakPolarHBondContact O-CA 3.28Å; A86-R119 HydrophobicContact CB-CB 3.6Å; A86-R119 HydrophobicContact CB-CG 3.59Å; A86-C192 HydrophobicContact CB-CB 3.95Å; A86-R194 HydrophobicContact CB-CG 3.99Å
87	W	98.2	Very high	96.1	Very high	0 Å²	0	46.6 Å²	46.6	0%	0	25%	0.25	C	S	.	.	B	Isolated β-bridge	trans	-81.2	135.7	160.4	165.8	68.4	0	0	0	110.9	A62 S64 V71 A76 P89 E99 Y100 L101 P183 C192 M193	A62-W87 HydrophobicContact CB-CZ2 4Å; S64-W87 PolarHBondContact O-NE1 3.46Å; V71-W87 VanDerWaalsContact O-CA 3.31Å; V71-W87 WeakPolarHBondContact O-CA 3.3Å; A76-W87 HydrophobicContact CB-CB 3.64Å; W87-P89 HydrophobicContact CH2-CB 4.26Å; W87-P89 HydrophobicContact CH2-CG 4.23Å; W87-P89 HydrophobicContact CZ2-CB 3.8Å; W87-P89 HydrophobicContact CZ2-CG 4.19Å; W87-E99 HydrophobicContact CH2-CB 4.38Å; W87-Y100 VanDerWaalsContact CH2-C 3.4Å; W87-Y100 WeakPolarHBondContact CZ2-O 3.46Å; W87-L101 HydrophobicContact CB-CD1 4.07Å; W87-L101 HydrophobicContact CD2-CB 4.12Å; W87-L101 HydrophobicContact CD2-CD1 3.96Å; W87-L101 HydrophobicContact CE3-CB 3.68Å; W87-L101 HydrophobicContact CE3-CD1 4.23Å; W87-L101 HydrophobicContact CE3-CG 4.37Å; W87-L101 HydrophobicContact CG-CD1 3.89Å; W87-L101 HydrophobicContact CH2-CB 4.16Å; W87-L101 HydrophobicContact CZ3-CB 3.71Å; W87-P183 HydrophobicContact CH2-CG 4.15Å; W87-P183 HydrophobicContact CZ3-CG 4.22Å; W87-C192 CarbonylContact O-C 3.54Å; W87-C192 WeakPolarHBondContact O-CA 3.42Å; W87-C192 WeakPolarHBondContact O-CB 3.27Å; W87-M193 HydrophobicContact CE3-CB 4.2Å; W87-M193 HydrophobicContact CZ3-CG 4.48Å; W87-M193 HydrophobicContact CZ3-SD 4.18Å; W87-M193 PolarHBondContact N-O 3.15Å; W87-M193 VanDerWaalsContact N-O 3.09Å; W87-M193 PolarHBondContact O-N 3.12Å
88	C	98.1	Very high	96	Very high	7 Å²	7	50.1 Å²	50.1	5%	0.047	26%	0.264	C	S	.	.			trans	-129.1	121.8	170.8	-52.7	0	0	0	0	109.4	S65 F66 V71 C192	S65-C88 CarbonylContact C-O 3.6Å; S65-C88 WeakPolarHBondContact CA-O 3.32Å; F66-C88 PolarHBondContact N-O 2.86Å; V71-C88 HydrophobicContact CB-CB 3.87Å; V71-C88 HydrophobicContact CG1-CB 4.42Å; V71-C88 HydrophobicContact CG2-CB 3.83Å; V71-C88 PolarHBondContact O-N 3.33Å; C88-C192 HydrophobicContact CB-CB 4.1Å; C88-C192 WeakPolarHBondContact CB-SG 3.28Å; C88-C192 WeakPolarHBondContact SG-CB 3.49Å; C88-C192 CovalentContact SG-SG 2.03Å; C88-C192 PolarHBondContact SG-SG 2.69Å
89	P	98.2	Very high	96	Very high	6 Å²	6	51 Å²	51	4%	0.039	27%	0.268	C	S	.	.			trans	-59.9	155.4	173.3	23.5	-28.9	0	0	0	111.4	W87 T91 I93 E99 T191	W87-P89 HydrophobicContact CH2-CB 4.26Å; W87-P89 HydrophobicContact CH2-CG 4.23Å; W87-P89 HydrophobicContact CZ2-CB 3.8Å; W87-P89 HydrophobicContact CZ2-CG 4.19Å; P89-T91 PolarHBondContact O-N 3.36Å; P89-I93 HydrophobicContact CB-CD1 4.48Å; P89-I93 HydrophobicContact CG-CD1 3.86Å; P89-I93 HydrophobicContact CG-CG1 4.14Å; P89-E99 HydrophobicContact CB-CB 3.81Å; P89-E99 HydrophobicContact CB-CG 3.64Å; P89-E99 HydrophobicContact CG-CB 4.32Å; P89-E99 HydrophobicContact CG-CG 4.34Å; P89-T191 VanDerWaalsContact CD-O 3.23Å; P89-T191 WeakPolarHBondContact CD-O 3.39Å
90	S	97.4	Very high	96.1	Very high	54 Å²	54	48.1 Å²	48.1	38%	0.378	26%	0.258	S	S	.	.	S	Bend	trans	-61.8	-27	-177.7	64.9	0	0	0	0	113.4	S64	S64-S90 VanDerWaalsContact CB-OG 3.27Å; S64-S90 WeakPolarHBondContact CB-OG 3.48Å; S64-S90 WeakPolarHBondContact OG-CB 3.25Å; S64-S90 PolarHBondContact OG-N 3.04Å; S64-S90 PolarHBondContact OG-OG 2.85Å
91	T	96	Very high	96.3	Very high	48 Å²	48	46.7 Å²	46.7	29%	0.294	25%	0.249	S	C	.	.	S	Bend	trans	-117.8	152.4	-179.9	74.6	0	0	0	0	112.6	P89 R97 E99	P89-T91 PolarHBondContact O-N 3.36Å; T91-R97 PolarHBondContact OG1-NH1 2.91Å; T91-E99 PolarHBondContact OG1-OE1 3.5Å
92	Q	97.5	Very high	96.6	Very high	83 Å²	83	44.4 Å²	44.4	39%	0.388	24%	0.236	S	C	.	.			trans	-63.2	146.9	171	-66	-174.5	-50.7	0	0	110.1	R97 L188 R189 T190	Q92-R97 WeakPolarHBondContact O-CD 3.48Å; Q92-R97 PolarHBondContact O-NE 3.08Å; Q92-L188 HydrophobicContact CB-CD1 3.62Å; Q92-L188 HydrophobicContact CB-CG 3.95Å; Q92-R189 CarbonylContact C-O 3.57Å; Q92-R189 WeakPolarHBondContact CA-O 3.4Å; Q92-R189 WeakPolarHBondContact CB-O 3.49Å; Q92-T190 PolarHBondContact NE2-OG1 2.87Å
93	I	98	Very high	96.9	Very high	0 Å²	0	40.3 Å²	40.3	0%	0	21%	0.211	C	C	.	.	B	Isolated β-bridge	trans	-95.2	136.1	-175.9	-57.1	-58.1	0	0	0	110.4	P89 E99 P183 L188 R189	P89-I93 HydrophobicContact CB-CD1 4.48Å; P89-I93 HydrophobicContact CG-CD1 3.86Å; P89-I93 HydrophobicContact CG-CG1 4.14Å; I93-E99 HydrophobicContact CD1-CB 3.85Å; I93-E99 HydrophobicContact CD1-CG 3.65Å; I93-P183 HydrophobicContact CD1-CG 4.05Å; I93-P183 HydrophobicContact CG1-CB 4.21Å; I93-P183 HydrophobicContact CG1-CG 4.08Å; I93-P183 HydrophobicContact CG2-CB 4.37Å; I93-L188 WeakPolarHBondContact O-CA 3.37Å; I93-R189 PolarHBondContact N-O 3.36Å; I93-R189 PolarHBondContact O-N 2.77Å
94	D	96	Very high	97.1	Very high	30 Å²	30	38.6 Å²	38.6	16%	0.16	19%	0.193	C	C	.	.			trans	-137.2	-167.7	169.4	62.7	37.7	0	0	0	109.2	T96 R97 S185 L188	D94-T96 PolarHBondContact O-N 3.45Å; D94-T96 WeakPolarHBondContact OD1-CA 3.31Å; D94-T96 WeakPolarHBondContact OD1-CB 3.31Å; D94-T96 PolarHBondContact OD1-N 2.76Å; D94-T96 PolarHBondContact OD1-OG1 3.34Å; D94-R97 WeakPolarHBondContact OD1-CG 2.98Å; D94-R97 PolarHBondContact OD1-N 3.44Å; D94-R97 VanDerWaalsContact OD1-N 3.08Å; D94-R97 IonicContact OD2-NE 3.55Å; D94-R97 PolarHBondContact OD2-NE 3Å; D94-R97 VanDerWaalsContact OD2-NE 3.12Å; D94-S185 CarbonylContact C-O 3.59Å; D94-S185 WeakPolarHBondContact CA-O 3.28Å; D94-L188 HydrophobicContact CB-CB 4.47Å; D94-L188 HydrophobicContact CB-CD1 4Å
95	Q	95.8	Very high	97.4	Very high	125 Å²	125	39 Å²	39	58%	0.584	19%	0.194	S	C	*	.	S	Bend	trans	-70	-15.2	-177.3	-58.3	-177.8	10.5	0	0	114.3	F184 S185 E186	Q95-F184 HydrophobicContact CB-CE2 4.07Å; Q95-F184 HydrophobicContact CB-CZ 4.22Å; Q95-F184 HydrophobicContact CG-CE2 4.23Å; Q95-F184 HydrophobicContact CG-CZ 3.9Å; Q95-S185 WeakPolarHBondContact CG-O 3.32Å; Q95-S185 PolarHBondContact N-O 2.9Å; Q95-S185 VanDerWaalsContact N-O 3.15Å; Q95-E186 PolarHBondContact NE2-O 3.29Å; Q95-E186 VanDerWaalsContact NE2-O 3.15Å
96	T	95.3	Very high	97.5	Very high	123 Å²	123	44.9 Å²	44.9	76%	0.755	22%	0.221	S	C	*	.	S	Bend	trans	-108.5	-22.6	-170.4	67.3	0	0	0	0	113.4	D94	D94-T96 PolarHBondContact O-N 3.45Å; D94-T96 WeakPolarHBondContact OD1-CA 3.31Å; D94-T96 WeakPolarHBondContact OD1-CB 3.31Å; D94-T96 PolarHBondContact OD1-N 2.76Å; D94-T96 PolarHBondContact OD1-OG1 3.34Å
97	R	96	Very high	97.5	Very high	103 Å²	103	52.3 Å²	52.3	39%	0.389	25%	0.249	S	C	.	.			trans	-83.6	133.9	-175.3	-68.5	171.5	-172	-113.9	5.7	111.3	T91 Q92 D94	T91-R97 PolarHBondContact OG1-NH1 2.91Å; Q92-R97 WeakPolarHBondContact O-CD 3.48Å; Q92-R97 PolarHBondContact O-NE 3.08Å; D94-R97 WeakPolarHBondContact OD1-CG 2.98Å; D94-R97 PolarHBondContact OD1-N 3.44Å; D94-R97 VanDerWaalsContact OD1-N 3.08Å; D94-R97 IonicContact OD2-NE 3.55Å; D94-R97 PolarHBondContact OD2-NE 3Å; D94-R97 VanDerWaalsContact OD2-NE 3.12Å
98	Y	97.5	Very high	97.4	Very high	106 Å²	106	53 Å²	53	42%	0.416	25%	0.253	S	S	.	.			trans	-109.6	109.2	177.1	179.3	-98.7	0	0	0	109.6	Y100 E135 R180 V182	Y98-Y100 HydrophobicContact CD1-CD1 4.27Å; Y98-Y100 AromaticContact CE1-CD1 3.46Å; Y98-Y100 HydrophobicContact CE1-CD1 3.46Å; Y98-Y100 VanDerWaalsContact CE1-CD1 3.46Å; Y98-Y100 AromaticContact CE1-CE1 3.83Å; Y98-Y100 HydrophobicContact CE1-CE1 3.83Å; Y98-Y100 AromaticContact CZ-CD1 3.8Å; Y98-E135 PolarHBondContact OH-OE2 2.81Å; Y98-R180 PolarHBondContact OH-NH1 2.92Å; Y98-V182 HydrophobicContact CD2-CG1 3.82Å; Y98-V182 HydrophobicContact CE2-CG1 3.88Å; Y98-V182 HydrophobicContact CE2-CG2 4.04Å
99	E	98.4	Very high	97.4	Very high	18 Å²	18	54.1 Å²	54.1	8%	0.084	26%	0.258	C	S	.	.			trans	-127.9	154.2	171.3	-64.7	-78	-176.3	0	0	107.4	S63 S64 W87 P89 T91 I93 V182 P183	S63-E99 WeakPolarHBondContact CB-OE2 2.87Å; S63-E99 VanDerWaalsContact OG-CA 3.29Å; S63-E99 WeakPolarHBondContact OG-CA 3.4Å; S63-E99 PolarHBondContact OG-OE2 3.39Å; S64-E99 WeakPolarHBondContact CB-OE2 3.1Å; S64-E99 PolarHBondContact OG-OE1 3.47Å; S64-E99 VanDerWaalsContact OG-OE1 3.14Å; S64-E99 PolarHBondContact OG-OE2 3.49Å; W87-E99 HydrophobicContact CH2-CB 4.38Å; P89-E99 HydrophobicContact CB-CB 3.81Å; P89-E99 HydrophobicContact CB-CG 3.64Å; P89-E99 HydrophobicContact CG-CB 4.32Å; P89-E99 HydrophobicContact CG-CG 4.34Å; T91-E99 PolarHBondContact OG1-OE1 3.5Å; I93-E99 HydrophobicContact CD1-CB 3.85Å; I93-E99 HydrophobicContact CD1-CG 3.65Å; E99-V182 WeakPolarHBondContact O-CA 3.25Å; E99-V182 WeakPolarHBondContact O-CG1 3.21Å; E99-P183 HydrophobicContact CB-CG 4.48Å; E99-P183 WeakPolarHBondContact O-CD 3.45Å
100	Y	98.7	Very high	97.3	Very high	51 Å²	51	53.8 Å²	53.8	20%	0.2	26%	0.256	C	S	.	.			trans	-148.3	148.2	178.4	62.7	-97.6	0	0	0	112.6	A62 S63 W87 Y98 Q102 R180 F181	A62-Y100 CarbonylContact C-O 3.57Å; A62-Y100 WeakPolarHBondContact CA-O 3.38Å; A62-Y100 WeakPolarHBondContact CB-O 3.5Å; S63-Y100 PolarHBondContact N-O 2.84Å; S63-Y100 PolarHBondContact OG-N 3.25Å; S63-Y100 PolarHBondContact OG-O 2.84Å; W87-Y100 VanDerWaalsContact CH2-C 3.4Å; W87-Y100 WeakPolarHBondContact CZ2-O 3.46Å; Y98-Y100 HydrophobicContact CD1-CD1 4.27Å; Y98-Y100 AromaticContact CE1-CD1 3.46Å; Y98-Y100 HydrophobicContact CE1-CD1 3.46Å; Y98-Y100 VanDerWaalsContact CE1-CD1 3.46Å; Y98-Y100 AromaticContact CE1-CE1 3.83Å; Y98-Y100 HydrophobicContact CE1-CE1 3.83Å; Y98-Y100 AromaticContact CZ-CD1 3.8Å; Y100-Q102 HydrophobicContact CD2-CB 3.99Å; Y100-Q102 HydrophobicContact CE2-CB 4.1Å; Y100-R180 HydrophobicContact CD2-CG 3.99Å; Y100-R180 HydrophobicContact CG-CG 4.29Å; Y100-F181 VanDerWaalsContact CA-O 3.29Å; Y100-F181 WeakPolarHBondContact CA-O 3.44Å
101	L	98.8	Very high	97.4	Very high	0 Å²	0	51.2 Å²	51.2	0%	0	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	125.9	160.5	-178.5	77.3	0	0	0	107.9	I60 L61 A62 P73 A76 W87 R180 F181 V195	I60-L101 HydrophobicContact CG2-CD1 3.82Å; I60-L101 HydrophobicContact CG2-CG 4.36Å; L61-L101 CarbonylContact O-C 3.42Å; A62-L101 HydrophobicContact CB-CD1 4.45Å; P73-L101 HydrophobicContact CB-CD1 3.77Å; A76-L101 HydrophobicContact CB-CD1 3.78Å; A76-L101 HydrophobicContact CB-CD2 3.45Å; A76-L101 VanDerWaalsContact CB-CD2 3.45Å; A76-L101 HydrophobicContact CB-CG 4.27Å; W87-L101 HydrophobicContact CB-CD1 4.07Å; W87-L101 HydrophobicContact CD2-CB 4.12Å; W87-L101 HydrophobicContact CD2-CD1 3.96Å; W87-L101 HydrophobicContact CE3-CB 3.68Å; W87-L101 HydrophobicContact CE3-CD1 4.23Å; W87-L101 HydrophobicContact CE3-CG 4.37Å; W87-L101 HydrophobicContact CG-CD1 3.89Å; W87-L101 HydrophobicContact CH2-CB 4.16Å; W87-L101 HydrophobicContact CZ3-CB 3.71Å; L101-R180 CarbonylContact O-C 3.18Å; L101-R180 WeakPolarHBondContact O-CA 3.46Å; L101-F181 HydrophobicContact CB-CB 4.43Å; L101-F181 PolarHBondContact N-O 2.86Å; L101-F181 PolarHBondContact O-N 2.8Å; L101-V195 HydrophobicContact CD2-CB 4.46Å; L101-V195 HydrophobicContact CD2-CG1 3.92Å; L101-V195 HydrophobicContact CD2-CG2 3.62Å
102	Q	98.8	Very high	97.4	Very high	22 Å²	22	49.4 Å²	49.4	10%	0.103	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	131.7	-177.6	-173.9	-178.8	-74.7	0	0	110.8	I60 L61 Y100 W144 V179 R180	I60-Q102 WeakPolarHBondContact CA-O 3.4Å; L61-Q102 HydrophobicContact CB-CB 4.35Å; L61-Q102 PolarHBondContact N-O 3.41Å; L61-Q102 PolarHBondContact O-N 2.8Å; Y100-Q102 HydrophobicContact CD2-CB 3.99Å; Y100-Q102 HydrophobicContact CE2-CB 4.1Å; Q102-W144 HydrophobicContact CG-CH2 4.03Å; Q102-W144 VanDerWaalsContact OE1-CZ2 3.32Å; Q102-V179 CarbonylContact C-O 3.56Å; Q102-V179 WeakPolarHBondContact CA-O 3.34Å; Q102-R180 HydrophobicContact CB-CG 3.91Å; Q102-R180 HydrophobicContact CG-CG 3.91Å
103	V	98.8	Very high	97.4	Very high	0 Å²	0	45.5 Å²	45.5	0%	0	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113	125.9	173.4	-177.5	0	0	0	0	108.8	M50 I55 L105 K178 V179 L197	M50-V103 HydrophobicContact CE-CG2 4.18Å; M50-V103 HydrophobicContact SD-CG1 4.02Å; M50-V103 HydrophobicContact SD-CG2 3.94Å; I55-V103 HydrophobicContact CD1-CG1 3.89Å; I55-V103 HydrophobicContact CG2-CG1 4.03Å; V103-L105 HydrophobicContact CG1-CD2 4.08Å; V103-K178 VanDerWaalsContact O-CA 3.3Å; V103-K178 WeakPolarHBondContact O-CA 3.11Å; V103-V179 PolarHBondContact N-O 2.95Å; V103-V179 PolarHBondContact O-N 3.46Å; V103-L197 HydrophobicContact CB-CD1 4Å; V103-L197 HydrophobicContact CG1-CD1 3.79Å; V103-L197 HydrophobicContact CG2-CD1 4.36Å
104	N	98.5	Very high	97.4	Very high	28 Å²	28	45.5 Å²	45.5	15%	0.15	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.5	114.1	174.7	-176.8	24.7	0	0	0	110	D59 H106	D59-N104 HydrophobicContact CB-CB 4.16Å; D59-N104 PolarHBondContact O-N 3.48Å; N104-H106 PolarHBondContact ND2-CE1 3.31Å; N104-H106 PolarHBondContact ND2-ND1 3.43Å; N104-H106 VanDerWaalsContact ND2-ND1 3.18Å; N104-H106 PolarHBondContact OD1-N 3.09Å
105	L	98.4	Very high	97.6	Very high	16 Å²	16	44.5 Å²	44.5	8%	0.084	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.3	-7.7	178.5	-58.6	173.4	0	0	0	112.3	L48 I55 V103 R107 H109 I111 S177 L197	L48-L105 HydrophobicContact CB-CD2 4.44Å; L48-L105 HydrophobicContact CD1-CD1 3.88Å; L48-L105 HydrophobicContact CD1-CD2 4.01Å; I55-L105 HydrophobicContact CD1-CD2 3.71Å; I55-L105 HydrophobicContact CG1-CD2 4.33Å; V103-L105 HydrophobicContact CG1-CD2 4.08Å; L105-R107 PolarHBondContact O-N 2.8Å; L105-H109 HydrophobicContact CD1-CB 3.86Å; L105-I111 HydrophobicContact CD1-CD1 4.24Å; L105-I111 HydrophobicContact CD1-CG1 4.42Å; L105-S177 WeakPolarHBondContact CB-O 3.35Å; L105-S177 PolarHBondContact N-O 2.85Å; L105-L197 HydrophobicContact CD1-CD1 4.44Å; L105-L197 HydrophobicContact CD2-CD1 4.09Å
106	H	96.3	Very high	97.7	Very high	122 Å²	122	38.6 Å²	38.6	57%	0.565	18%	0.175	S	C	*	.	E	Extended strand (participates in β ladder)	trans	61.1	-51.5	-172.7	-59	-75	0	0	0	115.1	D59 N104	D59-H106 IonicContact OD1-CD2 3.65Å; D59-H106 IonicContact OD1-CE1 2.89Å; D59-H106 PolarHBondContact OD1-CE1 3.42Å; D59-H106 IonicContact OD1-NE2 3.42Å; D59-H106 PolarHBondContact OD1-NE2 3.33Å; D59-H106 IonicContact OD2-CD2 3.02Å; D59-H106 IonicContact OD2-CE1 3.6Å; D59-H106 IonicContact OD2-NE2 3.46Å; D59-H106 PolarHBondContact OD2-NE2 2.92Å; N104-H106 PolarHBondContact ND2-CE1 3.31Å; N104-H106 PolarHBondContact ND2-ND1 3.43Å; N104-H106 VanDerWaalsContact ND2-ND1 3.18Å; N104-H106 PolarHBondContact OD1-N 3.09Å
107	R	96	Very high	97.8	Very high	156 Å²	156	33.5 Å²	33.5	59%	0.589	14%	0.143	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-92.2	156	174.2	-56.8	-167.2	-178.8	-166.8	-3.2	110.8	L105 H109 S177 E201	L105-R107 PolarHBondContact O-N 2.8Å; R107-H109 PolarHBondContact O-N 2.82Å; R107-H109 PolarHBondContact O-ND1 3.48Å; R107-S177 WeakPolarHBondContact O-CA 3.44Å; R107-E201 WeakPolarHBondContact CD-OE1 3.08Å; R107-E201 IonicContact CZ-OE1 3.45Å; R107-E201 IonicContact NE-OE1 3.86Å; R107-E201 IonicContact NH1-OE1 3.14Å; R107-E201 PolarHBondContact NH1-OE1 3.07Å; R107-E201 IonicContact NH1-OE2 2.97Å
108	V	97.2	Very high	97.9	Very high	16 Å²	16	28.6 Å²	28.6	10%	0.097	12%	0.124	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.8	128.9	174.4	-174	0	0	0	0	108.5	P139 V175 H202 L207	V108-P139 HydrophobicContact CG2-CG 4.08Å; V108-V175 HydrophobicContact CG1-CG1 3.43Å; V108-V175 VanDerWaalsContact CG1-CG1 3.43Å; V108-H202 HydrophobicContact CB-CB 4.15Å; V108-H202 HydrophobicContact CG1-CB 3.78Å; V108-H202 WeakPolarHBondContact O-CB 3.06Å; V108-H202 PolarHBondContact O-N 3.49Å; V108-L207 HydrophobicContact CG2-CD2 4.23Å
109	H	97.7	Very high	97.9	Very high	29 Å²	29	25.3 Å²	25.3	13%	0.134	11%	0.111	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	153.6	176.8	-71.2	72.1	0	0	0	109.6	L48 L105 R107 V175 A176 C200	L48-H109 HydrophobicContact CD1-CB 4.42Å; L105-H109 HydrophobicContact CD1-CB 3.86Å; R107-H109 PolarHBondContact O-N 2.82Å; R107-H109 PolarHBondContact O-ND1 3.48Å; H109-V175 WeakPolarHBondContact O-CA 3.35Å; H109-A176 PolarHBondContact N-O 2.84Å; H109-A176 PolarHBondContact O-N 2.84Å; H109-C200 CarbonylContact C-O 2.91Å; H109-C200 VanDerWaalsContact CA-O 3.23Å; H109-C200 WeakPolarHBondContact CA-O 3.18Å; H109-C200 VanDerWaalsContact CB-O 3.3Å; H109-C200 WeakPolarHBondContact CB-O 3.27Å; H109-C200 PolarHBondContact CD2-O 3.33Å
110	V	97.2	Very high	97.5	Very high	0 Å²	0	27.3 Å²	27.3	0%	0	12%	0.12	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.8	114.1	163.5	-176.6	0	0	0	0	107.3	L39 L41 T112 P173 V175 G199 C200 H202	L39-V110 HydrophobicContact CD1-CB 4.15Å; L39-V110 HydrophobicContact CD1-CG1 4.16Å; L39-V110 HydrophobicContact CD1-CG2 3.9Å; L39-V110 HydrophobicContact CD2-CG1 4.14Å; L39-V110 HydrophobicContact CD2-CG2 4.07Å; L41-V110 HydrophobicContact CD2-CG1 4.2Å; V110-T112 HydrophobicContact CG1-CG2 4.22Å; V110-P173 HydrophobicContact CG1-CB 3.69Å; V110-V175 HydrophobicContact CG2-CG2 4.37Å; V110-G199 CarbonylContact O-C 3.44Å; V110-G199 WeakPolarHBondContact O-CA 2.98Å; V110-C200 PolarHBondContact N-O 2.89Å; V110-C200 PolarHBondContact O-N 3.42Å; V110-C200 VanDerWaalsContact O-N 3.08Å; V110-H202 HydrophobicContact CG2-CB 3.96Å
111	I	98	Very high	97	Very high	0 Å²	0	25.4 Å²	25.4	0%	0	12%	0.116	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.5	120.8	179.6	-60	142.5	0	0	0	108.2	L48 L105 V114 L170 P173 I174 A176 V179 L197 Y198	L48-I111 HydrophobicContact CD1-CG1 4.38Å; L105-I111 HydrophobicContact CD1-CD1 4.24Å; L105-I111 HydrophobicContact CD1-CG1 4.42Å; I111-V114 HydrophobicContact CG2-CG1 4.28Å; I111-L170 HydrophobicContact CG2-CD1 4.15Å; I111-P173 WeakPolarHBondContact O-CA 3.47Å; I111-I174 HydrophobicContact CB-CB 4.22Å; I111-I174 HydrophobicContact CD1-CB 4.35Å; I111-I174 HydrophobicContact CD1-CG2 4.07Å; I111-I174 PolarHBondContact N-O 3.18Å; I111-I174 PolarHBondContact O-N 2.77Å; I111-A176 HydrophobicContact CD1-CB 4.07Å; I111-V179 HydrophobicContact CD1-CG2 3.26Å; I111-V179 HydrophobicContact CG1-CG2 4.48Å; I111-L197 HydrophobicContact CG2-CD2 4.18Å; I111-Y198 CarbonylContact C-O 3.52Å; I111-Y198 WeakPolarHBondContact CA-O 3.38Å
112	T	96.9	Very high	96.3	Very high	9 Å²	9	27.9 Å²	27.9	6%	0.055	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	-27.4	-173.7	57.2	0	0	0	0	112.4	L41 C44 V110 L170 Y198	L41-T112 HydrophobicContact CD2-CG2 3.69Å; C44-T112 HydrophobicContact CB-CG2 4.22Å; C44-T112 WeakPolarHBondContact O-CB 3.44Å; C44-T112 WeakPolarHBondContact O-CG2 3.45Å; C44-T112 PolarHBondContact O-OG1 3.2Å; V110-T112 HydrophobicContact CG1-CG2 4.22Å; T112-L170 PolarHBondContact O-N 2.59Å; T112-Y198 PolarHBondContact N-O 2.9Å; T112-Y198 PolarHBondContact OG1-O 2.97Å
113	C	97.6	Very high	95.6	Very high	1 Å²	1	28.4 Å²	28.4	1%	0.007	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.4	157	173.5	-40.3	0	0	0	0	111.4	K167 I168 Y198	C113-K167 HydrophobicContact CB-CG 4.25Å; C113-I168 WeakPolarHBondContact CA-O 3.35Å; C113-I168 VanDerWaalsContact CB-O 3.3Å; C113-I168 WeakPolarHBondContact CB-O 3.22Å; C113-Y198 HydrophobicContact CB-CD2 3.99Å; C113-Y198 HydrophobicContact CB-CG 4.17Å; C113-Y198 PolarHBondContact N-O 2.85Å; C113-Y198 PolarHBondContact O-N 2.98Å
114	V	98.4	Very high	95.1	Very high	0 Å²	0	36 Å²	36	0%	0	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	147	170.3	-63.6	0	0	0	0	108.9	I111 Y132 L134 K167 I168 L170 F181 L197	I111-V114 HydrophobicContact CG2-CG1 4.28Å; V114-Y132 HydrophobicContact CG2-CE2 4.21Å; V114-Y132 WeakPolarHBondContact CG2-OH 3.27Å; V114-L134 HydrophobicContact CG1-CD1 3.76Å; V114-L134 HydrophobicContact CG1-CD2 4.29Å; V114-L134 HydrophobicContact CG2-CD1 4.11Å; V114-K167 CarbonylContact O-C 3.59Å; V114-K167 WeakPolarHBondContact O-CA 2.82Å; V114-I168 HydrophobicContact CG2-CB 4.19Å; V114-I168 PolarHBondContact N-O 2.8Å; V114-I168 PolarHBondContact O-N 2.88Å; V114-L170 HydrophobicContact CG1-CD1 4.48Å; V114-L170 HydrophobicContact CG2-CD2 4.24Å; V114-F181 HydrophobicContact CB-CE1 4.03Å; V114-F181 HydrophobicContact CB-CZ 4.18Å; V114-F181 HydrophobicContact CG1-CE1 4.31Å; V114-F181 HydrophobicContact CG1-CZ 4.15Å; V114-L197 HydrophobicContact CG1-CD2 3.91Å
115	E	98.5	Very high	94.5	Very high	10 Å²	10	34.7 Å²	34.7	5%	0.047	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	140.2	174.9	-177.6	176.1	-131.2	0	0	110.2	I78 R79 A165 V166 K167 V195 E196 Y198	I78-E115 HydrophobicContact CD1-CG 3.86Å; I78-E115 HydrophobicContact CG1-CG 4.21Å; R79-E115 IonicContact CZ-OE1 2.73Å; R79-E115 IonicContact CZ-OE2 3.95Å; R79-E115 VanDerWaalsContact CZ-OE2 3.25Å; R79-E115 IonicContact NH1-OE2 2.69Å; R79-E115 PolarHBondContact NH1-OE2 2.66Å; R79-E115 IonicContact NH2-OE1 3.2Å; R79-E115 PolarHBondContact NH2-OE1 3.35Å; R79-E115 IonicContact NH2-OE2 3.44Å; R79-E115 PolarHBondContact NH2-OE2 2.79Å; E115-A165 HydrophobicContact CG-CB 4.05Å; E115-A165 WeakPolarHBondContact OE1-CB 3.35Å; E115-V166 WeakPolarHBondContact CA-O 3.48Å; E115-K167 HydrophobicContact CB-CB 4.11Å; E115-K167 HydrophobicContact CB-CG 4.31Å; E115-K167 HydrophobicContact CG-CB 4.07Å; E115-V195 CarbonylContact O-C 3.52Å; E115-V195 WeakPolarHBondContact O-CA 3.14Å; E115-E196 HydrophobicContact CB-CB 4.3Å; E115-E196 PolarHBondContact N-O 3.25Å; E115-E196 PolarHBondContact O-N 2.9Å; E115-Y198 HydrophobicContact CB-CE2 3.7Å; E115-Y198 PolarHBondContact OE2-OH 3.46Å
116	T	98.6	Very high	94.3	Very high	0 Å²	0	40.8 Å²	40.8	0%	0	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.3	149.9	-179.2	56.4	0	0	0	0	111.2	Y132 N159 A165 V166 F181 M193 R194 V195	T116-Y132 HydrophobicContact CG2-CD1 4.03Å; T116-Y132 HydrophobicContact CG2-CE1 3.45Å; T116-Y132 VanDerWaalsContact CG2-CE1 3.45Å; T116-Y132 HydrophobicContact CG2-CE2 4.39Å; T116-N159 PolarHBondContact O-ND2 3.16Å; T116-N159 PolarHBondContact OG1-OD1 3.48Å; T116-A165 WeakPolarHBondContact O-CA 3.39Å; T116-V166 PolarHBondContact N-O 2.8Å; T116-V166 PolarHBondContact O-N 2.83Å; T116-F181 HydrophobicContact CG2-CD1 4.06Å; T116-F181 HydrophobicContact CG2-CE1 3.94Å; T116-M193 HydrophobicContact CG2-CE 3.95Å; T116-R194 CarbonylContact C-O 3.5Å; T116-R194 VanDerWaalsContact CA-O 3.29Å; T116-R194 WeakPolarHBondContact CA-O 3.25Å; T116-V195 HydrophobicContact CG2-CG1 4.21Å
117	Q	98	Very high	94.3	Very high	17 Å²	17	36.8 Å²	36.8	8%	0.079	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.7	145	177.9	-163.5	-177	25.7	0	0	109.4	I78 N159 N163 A165 R194	I78-Q117 HydrophobicContact CD1-CB 3.45Å; I78-Q117 VanDerWaalsContact CD1-CB 3.45Å; I78-Q117 HydrophobicContact CG1-CB 4.5Å; Q117-N159 WeakPolarHBondContact CA-ND2 3.46Å; Q117-N159 PolarHBondContact N-OD1 2.76Å; Q117-N163 PolarHBondContact NE2-O 2.81Å; Q117-A165 HydrophobicContact CB-CB 4.39Å; Q117-A165 HydrophobicContact CG-CB 4.32Å; Q117-R194 HydrophobicContact CB-CB 4.26Å; Q117-R194 VanDerWaalsContact CG-NH2 3.26Å; Q117-R194 PolarHBondContact N-O 3.45Å; Q117-R194 PolarHBondContact O-N 3.34Å
118	G	97.7	Very high	94.4	Very high	0 Å²	0	32 Å²	32	0%	0	17%	0.171	C	C	.	.			trans	-70.6	-177.1	174.1	0	0	0	0	0	113.1	T162 R194	G118-T162 CarbonylContact C-O 3.58Å; G118-R194 PolarHBondContact O-NE 2.86Å; G118-R194 PolarHBondContact O-NH2 3.45Å
119	R	96.9	Very high	94.4	Very high	37 Å²	37	31.2 Å²	31.2	14%	0.14	17%	0.167	C	C	.	.			trans	-88.8	119.5	178.8	-173.5	179.7	81.2	88.5	-7	111.5	G84 A86 G125 E127 T162 C192	G84-R119 VanDerWaalsContact O-CD 3.27Å; G84-R119 WeakPolarHBondContact O-CD 3.22Å; G84-R119 WeakPolarHBondContact O-CG 3.43Å; G84-R119 PolarHBondContact O-NH1 2.78Å; G84-R119 VanDerWaalsContact O-NH1 3.11Å; A86-R119 HydrophobicContact CB-CB 3.6Å; A86-R119 HydrophobicContact CB-CG 3.59Å; R119-G125 CarbonylContact O-C 3.55Å; R119-G125 WeakPolarHBondContact O-CA 3.48Å; R119-E127 IonicContact CZ-OE1 3.88Å; R119-E127 IonicContact CZ-OE2 3.89Å; R119-E127 PolarHBondContact N-O 3.13Å; R119-E127 IonicContact NE-OE1 3.69Å; R119-E127 IonicContact NE-OE2 3.09Å; R119-E127 PolarHBondContact NE-OE2 3.47Å; R119-E127 IonicContact NH2-OE1 3.86Å; R119-E127 PolarHBondContact NH2-OE1 2.91Å; R119-E127 VanDerWaalsContact NH2-OE1 3.09Å; R119-E127 IonicContact NH2-OE2 3.12Å; R119-E127 PolarHBondContact NH2-OE2 3.24Å; R119-T162 WeakPolarHBondContact O-CB 3.3Å; R119-T162 VanDerWaalsContact O-CG2 3.22Å; R119-T162 WeakPolarHBondContact O-CG2 3.46Å; R119-C192 HydrophobicContact CB-CB 3.67Å; R119-C192 HydrophobicContact CG-CB 4.4Å
120	H	91.3	Very high	94.3	Very high	59 Å²	59	31.2 Å²	31.2	27%	0.273	17%	0.169	S	C	.	.			trans	-79.9	-54.8	172.6	-174.2	72.5	0	0	0	111.7	D81 G122 G123 G125 N163	D81-H120 IonicContact OD2-CD2 2.91Å; D81-H120 PolarHBondContact OD2-CD2 2.99Å; H120-G122 PolarHBondContact O-N 2.92Å; H120-G123 PolarHBondContact CD2-N 2.98Å; H120-G123 PolarHBondContact NE2-N 3.4Å; H120-G123 WeakPolarHBondContact O-CA 3.37Å; H120-G123 PolarHBondContact O-N 2.92Å; H120-G125 VanDerWaalsContact O-CA 3.26Å; H120-G125 WeakPolarHBondContact O-CA 3.26Å; H120-G125 PolarHBondContact O-N 2.85Å; H120-N163 PolarHBondContact ND1-OD1 2.92Å
121	G	86.6	Confident	94.4	Very high	12 Å²	12	33.9 Å²	33.9	12%	0.124	18%	0.181	C	C	.	.	G	3₁₀ helix	trans	56.1	49.9	175.2	0	0	0	0	0	113	D81 G123 H124	D81-G121 VanDerWaalsContact OD1-CA 3.23Å; D81-G121 WeakPolarHBondContact OD1-CA 3.49Å; D81-G121 PolarHBondContact OD1-N 2.87Å; G121-G123 PolarHBondContact O-N 2.75Å; G121-G123 VanDerWaalsContact O-N 3.16Å; G121-H124 WeakPolarHBondContact O-CB 3.41Å; G121-H124 PolarHBondContact O-N 2.91Å
122	G	84.9	Confident	94.4	Very high	52 Å²	52	33.9 Å²	33.9	54%	0.536	18%	0.181	S	C	.	.	G	3₁₀ helix	trans	60.1	21.4	-174.9	0	0	0	0	0	115.1	D81 H120	D81-G122 WeakPolarHBondContact OD2-CA 3.44Å; D81-G122 PolarHBondContact OD2-N 3.06Å; H120-G122 PolarHBondContact O-N 2.92Å
123	G	85	Confident	94.4	Very high	33 Å²	33	35 Å²	35	34%	0.34	19%	0.185	S	C	.	.	G	3₁₀ helix	trans	92.3	-8.7	-176.8	0	0	0	0	0	114.8	H120 G121 K126	H120-G123 PolarHBondContact CD2-N 2.98Å; H120-G123 PolarHBondContact NE2-N 3.4Å; H120-G123 WeakPolarHBondContact O-CA 3.37Å; H120-G123 PolarHBondContact O-N 2.92Å; G121-G123 PolarHBondContact O-N 2.75Å; G121-G123 VanDerWaalsContact O-N 3.16Å; G123-K126 PolarHBondContact O-NZ 3.43Å
124	H	87.2	Confident	94.5	Very high	158 Å²	158	34.9 Å²	34.9	73%	0.731	19%	0.185	S	C	*	.	T	Hydrogen-bonded Turn	trans	-79.6	-20.3	174.5	-61.4	-71.5	0	0	0	112.8	G121	G121-H124 WeakPolarHBondContact O-CB 3.41Å; G121-H124 PolarHBondContact O-N 2.91Å
125	G	86.5	Confident	94.5	Very high	1 Å²	1	35.3 Å²	35.3	1%	0.01	19%	0.187	C	C	.	.			trans	-63.7	138.3	174.3	0	0	0	0	0	113.2	R119 H120 E127	R119-G125 CarbonylContact O-C 3.55Å; R119-G125 WeakPolarHBondContact O-CA 3.48Å; H120-G125 VanDerWaalsContact O-CA 3.26Å; H120-G125 WeakPolarHBondContact O-CA 3.26Å; H120-G125 PolarHBondContact O-N 2.85Å; G125-E127 WeakPolarHBondContact CA-OE2 3.5Å
126	K	93.5	Very high	94.5	Very high	144 Å²	144	35.6 Å²	35.6	63%	0.626	19%	0.188	S	C	*	.			trans	-133.3	-0.2	175.2	-59	-64	167.8	-132.8	0	112.4	G123	G123-K126 PolarHBondContact O-NZ 3.43Å
127	E	97.1	Very high	94.4	Very high	39 Å²	39	38.4 Å²	38.4	18%	0.182	20%	0.198	C	C	.	.			trans	-99.2	135.3	-170.4	-51	82.8	175.5	0	0	110.9	R119 G125 T190 C192	R119-E127 IonicContact CZ-OE1 3.88Å; R119-E127 IonicContact CZ-OE2 3.89Å; R119-E127 PolarHBondContact N-O 3.13Å; R119-E127 IonicContact NE-OE1 3.69Å; R119-E127 IonicContact NE-OE2 3.09Å; R119-E127 PolarHBondContact NE-OE2 3.47Å; R119-E127 IonicContact NH2-OE1 3.86Å; R119-E127 PolarHBondContact NH2-OE1 2.91Å; R119-E127 VanDerWaalsContact NH2-OE1 3.09Å; R119-E127 IonicContact NH2-OE2 3.12Å; R119-E127 PolarHBondContact NH2-OE2 3.24Å; G125-E127 WeakPolarHBondContact CA-OE2 3.5Å; E127-T190 HydrophobicContact CG-CG2 3.78Å; E127-C192 HydrophobicContact CB-CB 3.86Å; E127-C192 VanDerWaalsContact CB-SG 3.55Å
128	Y	97.4	Very high	94.4	Very high	54 Å²	54	37.7 Å²	37.7	21%	0.212	20%	0.195	C	C	.	.			trans	-157	152.2	178.7	56.7	-93.3	0	0	0	109.9	T130 N159 D161 T162	Y128-T130 HydrophobicContact CD2-CG2 4.46Å; Y128-T130 HydrophobicContact CE2-CG2 4.05Å; Y128-N159 HydrophobicContact CD2-CB 4.27Å; Y128-D161 VanDerWaalsContact CB-O 3.23Å; Y128-D161 WeakPolarHBondContact CB-O 3.38Å; Y128-T162 HydrophobicContact CD1-CG2 4.15Å
129	P	97.1	Very high	94.2	Very high	0 Å²	0	40 Å²	40	0%	0	21%	0.21	C	C	.	.			trans	-75.4	136.4	174.2	33.7	-35.5	0	0	0	109.4	A158 N159 T191 C192 M193	P129-A158 HydrophobicContact CB-CB 4.03Å; P129-A158 HydrophobicContact CG-CB 3.92Å; P129-A158 WeakPolarHBondContact O-CB 3.33Å; P129-N159 VanDerWaalsContact CG-OD1 3.3Å; P129-N159 WeakPolarHBondContact CG-OD1 3.41Å; P129-N159 PolarHBondContact O-N 3.34Å; P129-T191 HydrophobicContact CB-CG2 3.83Å; P129-C192 WeakPolarHBondContact CD-O 3.31Å; P129-M193 HydrophobicContact CB-CE 4.1Å; P129-M193 HydrophobicContact CB-CG 3.91Å; P129-M193 HydrophobicContact CB-SD 3.94Å; P129-M193 HydrophobicContact CG-CE 3.96Å; P129-M193 HydrophobicContact CG-CG 3.77Å; P129-M193 HydrophobicContact CG-SD 4.21Å
130	T	96.9	Very high	93.6	Very high	30 Å²	30	41.7 Å²	41.7	18%	0.184	24%	0.239	C	C	.	.	S	Bend	trans	-88.6	-38.4	172	53.5	0	0	0	0	111.1	Y128 A158 F184 S185	Y128-T130 HydrophobicContact CD2-CG2 4.46Å; Y128-T130 HydrophobicContact CE2-CG2 4.05Å; T130-A158 WeakPolarHBondContact O-CB 3.21Å; T130-A158 PolarHBondContact O-N 3.01Å; T130-F184 PolarHBondContact OG1-O 2.86Å; T130-S185 PolarHBondContact OG1-OG 2.78Å
131	F	98	Very high	93.5	Very high	56 Å²	56	40.6 Å²	40.6	25%	0.246	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.3	162.6	171.7	-61.3	-91.4	0	0	0	109.9	L155 L156 K157 F184	F131-L155 HydrophobicContact CB-CD2 4.13Å; F131-L156 CarbonylContact C-O 3.12Å; F131-L156 WeakPolarHBondContact CA-O 3.11Å; F131-K157 HydrophobicContact CD1-CB 4.24Å; F131-K157 HydrophobicContact CE1-CB 4.04Å; F131-K157 HydrophobicContact CE1-CG 4.19Å; F131-F184 HydrophobicContact CB-CB 4.2Å; F131-F184 HydrophobicContact CB-CD1 4.04Å; F131-F184 PolarHBondContact N-O 2.82Å; F131-F184 PolarHBondContact O-N 3.05Å
132	Y	98.2	Very high	93.5	Very high	0 Å²	0	46 Å²	46	0%	0	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.4	164.2	164.8	60.1	-86.7	0	0	0	110.2	V114 T116 L134 L156 A158 I168 F181 V182 M193	V114-Y132 HydrophobicContact CG2-CE2 4.21Å; V114-Y132 WeakPolarHBondContact CG2-OH 3.27Å; T116-Y132 HydrophobicContact CG2-CD1 4.03Å; T116-Y132 HydrophobicContact CG2-CE1 3.45Å; T116-Y132 VanDerWaalsContact CG2-CE1 3.45Å; T116-Y132 HydrophobicContact CG2-CE2 4.39Å; Y132-L134 HydrophobicContact CD2-CD2 4.03Å; Y132-L134 HydrophobicContact CD2-CG 4.21Å; Y132-L134 HydrophobicContact CE2-CD1 4.48Å; Y132-L134 HydrophobicContact CE2-CD2 3.8Å; Y132-L134 HydrophobicContact CE2-CG 3.93Å; Y132-L156 HydrophobicContact CD2-CB 4.36Å; Y132-L156 HydrophobicContact CD2-CD1 4.26Å; Y132-L156 HydrophobicContact CE1-CB 4.3Å; Y132-L156 HydrophobicContact CE2-CB 4Å; Y132-L156 HydrophobicContact CE2-CD1 3.56Å; Y132-L156 HydrophobicContact CE2-CG 4.4Å; Y132-L156 PolarHBondContact N-O 2.59Å; Y132-L156 PolarHBondContact O-N 3.41Å; Y132-A158 HydrophobicContact CD1-CB 3.48Å; Y132-A158 VanDerWaalsContact CD1-CB 3.48Å; Y132-A158 HydrophobicContact CE1-CB 3.62Å; Y132-I168 HydrophobicContact CE1-CD1 4.44Å; Y132-I168 WeakPolarHBondContact OH-CD1 3.37Å; Y132-F181 AromaticContact CD2-CD1 3.93Å; Y132-F181 HydrophobicContact CD2-CD1 3.93Å; Y132-F181 AromaticContact CE2-CD1 3.89Å; Y132-F181 HydrophobicContact CE2-CD1 3.89Å; Y132-F181 HydrophobicContact CE2-CE1 4.09Å; Y132-V182 CarbonylContact C-O 3.57Å; Y132-V182 WeakPolarHBondContact CA-O 3.39Å; Y132-V182 WeakPolarHBondContact CB-O 3.18Å; Y132-M193 HydrophobicContact CD1-CE 4.2Å; Y132-M193 HydrophobicContact CG-CE 4.26Å
133	M	98.1	Very high	93.9	Very high	31 Å²	31	49.9 Å²	49.9	15%	0.153	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	153.5	166.4	-57.9	172.2	-78	0	0	108.4	V154 L155 V182 F184	M133-V154 HydrophobicContact CB-CG1 4.41Å; M133-V154 HydrophobicContact CG-CG1 3.85Å; M133-V154 HydrophobicContact SD-CG1 3.8Å; M133-L155 HydrophobicContact CG-CD2 3.83Å; M133-L155 HydrophobicContact SD-CD2 4.46Å; M133-V182 HydrophobicContact CB-CB 4.29Å; M133-V182 HydrophobicContact CE-CB 4.39Å; M133-V182 HydrophobicContact CE-CG1 3.81Å; M133-V182 PolarHBondContact N-O 2.84Å; M133-V182 PolarHBondContact O-N 2.93Å; M133-F184 HydrophobicContact CE-CD2 4.48Å
134	L	98.6	Very high	94.4	Very high	0 Å²	0	51.6 Å²	51.6	0%	0	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	136.2	169.6	-66.5	172.2	0	0	0	109.5	V114 Y132 Y147 L156 L170 I174 V179 R180 F181	V114-L134 HydrophobicContact CG1-CD1 3.76Å; V114-L134 HydrophobicContact CG1-CD2 4.29Å; V114-L134 HydrophobicContact CG2-CD1 4.11Å; Y132-L134 HydrophobicContact CD2-CD2 4.03Å; Y132-L134 HydrophobicContact CD2-CG 4.21Å; Y132-L134 HydrophobicContact CE2-CD1 4.48Å; Y132-L134 HydrophobicContact CE2-CD2 3.8Å; Y132-L134 HydrophobicContact CE2-CG 3.93Å; L134-Y147 HydrophobicContact CB-CG 4.5Å; L134-Y147 PolarHBondContact O-N 3.12Å; L134-L156 HydrophobicContact CD1-CD1 3.63Å; L134-L156 HydrophobicContact CG-CD1 3.84Å; L134-L170 HydrophobicContact CD1-CD1 4.41Å; L134-L170 HydrophobicContact CD1-CD2 3.88Å; L134-I174 HydrophobicContact CB-CD1 4.48Å; L134-I174 HydrophobicContact CD1-CD1 4.06Å; L134-V179 HydrophobicContact CD2-CG1 4.27Å; L134-R180 WeakPolarHBondContact CA-O 3.32Å; L134-F181 HydrophobicContact CD2-CD1 3.67Å; L134-F181 HydrophobicContact CD2-CE1 3.71Å; L134-F181 HydrophobicContact CD2-CG 4.09Å; L134-F181 HydrophobicContact CD2-CZ 4.14Å
135	E	98.5	Very high	94.9	Very high	9 Å²	9	46.1 Å²	46.1	4%	0.042	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120	149.5	163.2	-51	176.8	157	0	0	110.2	Y98 W144 Q145 R146 V179 R180 V182	Y98-E135 PolarHBondContact OH-OE2 2.81Å; E135-W144 HydrophobicContact CB-CE3 4.16Å; E135-Q145 CarbonylContact C-O 3.47Å; E135-Q145 WeakPolarHBondContact CA-O 3.25Å; E135-Q145 WeakPolarHBondContact CB-O 3.4Å; E135-R146 IonicContact OE1-CZ 3.97Å; E135-R146 IonicContact OE1-NE 3.84Å; E135-R146 PolarHBondContact OE1-NE 3.41Å; E135-R146 IonicContact OE1-NH2 3.85Å; E135-R146 PolarHBondContact OE1-NH2 2.73Å; E135-V179 CarbonylContact O-C 3.54Å; E135-V179 WeakPolarHBondContact O-CA 3.36Å; E135-R180 HydrophobicContact CB-CB 4.1Å; E135-R180 PolarHBondContact N-O 3.19Å; E135-R180 PolarHBondContact O-N 2.73Å; E135-R180 IonicContact OE2-NH1 2.91Å; E135-V182 HydrophobicContact CG-CG2 3.95Å
136	Y	98.4	Very high	95.3	Very high	16 Å²	16	51.2 Å²	51.2	6%	0.063	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.1	157.9	-177.5	61.9	-91.1	0	0	0	112	W144 Q145 I174 A176 K178 D228	Y136-W144 VanDerWaalsContact C-CE3 3.49Å; Y136-Q145 HydrophobicContact CD1-CB 4.24Å; Y136-Q145 HydrophobicContact CD2-CB 4.03Å; Y136-Q145 HydrophobicContact CE1-CB 3.82Å; Y136-Q145 HydrophobicContact CE2-CB 3.57Å; Y136-Q145 HydrophobicContact CE2-CG 3.97Å; Y136-Q145 HydrophobicContact CG-CB 4.34Å; Y136-Q145 VanDerWaalsContact CZ-CB 3.45Å; Y136-Q145 PolarHBondContact N-O 3.34Å; Y136-Q145 PolarHBondContact O-N 2.78Å; Y136-I174 HydrophobicContact CD1-CD1 3.94Å; Y136-I174 HydrophobicContact CD1-CG1 4.1Å; Y136-I174 HydrophobicContact CD1-CG2 3.66Å; Y136-I174 HydrophobicContact CD2-CG2 3.61Å; Y136-I174 HydrophobicContact CE1-CD1 4.37Å; Y136-I174 HydrophobicContact CE1-CG1 4.19Å; Y136-I174 HydrophobicContact CE1-CG2 4.21Å; Y136-I174 HydrophobicContact CE2-CG2 4.18Å; Y136-I174 HydrophobicContact CG-CG2 3.32Å; Y136-A176 HydrophobicContact CD2-CB 4.19Å; Y136-A176 HydrophobicContact CG-CB 4.35Å; Y136-K178 VanDerWaalsContact CA-O 3.31Å; Y136-K178 WeakPolarHBondContact CA-O 3.47Å; Y136-D228 VanDerWaalsContact OH-CB 3.26Å; Y136-D228 WeakPolarHBondContact OH-CB 3.29Å; Y136-D228 PolarHBondContact OH-OD2 3.21Å; Y136-D228 VanDerWaalsContact OH-OD2 3.09Å
137	W	97.7	Very high	95.5	Very high	59 Å²	59	44.5 Å²	44.5	22%	0.223	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.8	140	-179.9	-178	91.2	0	0	0	110.8	P139 R141 W144 S177 K178	W137-P139 HydrophobicContact CH2-CB 4.42Å; W137-P139 HydrophobicContact CH2-CG 4.28Å; W137-P139 HydrophobicContact CZ3-CG 4.22Å; W137-R141 PolarHBondContact NE1-O 3.03Å; W137-W144 HydrophobicContact CB-CD2 3.91Å; W137-W144 HydrophobicContact CB-CE3 3.73Å; W137-W144 HydrophobicContact CB-CH2 4.09Å; W137-W144 HydrophobicContact CB-CZ2 4.23Å; W137-W144 HydrophobicContact CB-CZ3 3.82Å; W137-S177 VanDerWaalsContact CE3-OG 3.23Å; W137-S177 VanDerWaalsContact CZ3-OG 3.26Å; W137-S177 WeakPolarHBondContact CZ3-OG 3.49Å; W137-S177 PolarHBondContact O-N 3.43Å; W137-S177 PolarHBondContact O-OG 2.87Å; W137-K178 HydrophobicContact CB-CB 4.47Å; W137-K178 HydrophobicContact CE3-CD 4.05Å; W137-K178 HydrophobicContact CE3-CG 4.26Å; W137-K178 PolarHBondContact N-O 3.32Å; W137-K178 PolarHBondContact O-N 2.9Å; W137-K178 VanDerWaalsContact O-N 3.14Å
138	R	96.2	Very high	95.3	Very high	1 Å²	1	48 Å²	48	0%	0.004	24%	0.243	C	C	.	.			trans	-131.4	155.2	173.6	62.4	178.6	173	-81.2	-2.5	110.9	R141 V175 L207 D228	R138-R141 HydrophobicContact CG-CG 4.17Å; R138-R141 PolarHBondContact O-N 2.93Å; R138-V175 WeakPolarHBondContact CD-O 3.16Å; R138-V175 PolarHBondContact NH1-O 2.86Å; R138-L207 PolarHBondContact NE-O 3.33Å; R138-D228 IonicContact CZ-OD1 2.8Å; R138-D228 IonicContact CZ-OD2 2.76Å; R138-D228 IonicContact NH1-OD2 3.81Å; R138-D228 PolarHBondContact NH1-OD2 2.97Å; R138-D228 IonicContact NH2-OD1 3.44Å; R138-D228 PolarHBondContact NH2-OD1 3.17Å; R138-D228 IonicContact NH2-OD2 2.89Å; R138-D228 PolarHBondContact NH2-OD2 3.05Å
139	P	93.3	Very high	94.6	Very high	48 Å²	48	45.4 Å²	45.4	31%	0.312	23%	0.233	S	C	.	.	T	Hydrogen-bonded Turn	trans	-52	146.8	173.1	-25.7	35.7	0	0	0	112.2	V108 W137 R141 L207	V108-P139 HydrophobicContact CG2-CG 4.08Å; W137-P139 HydrophobicContact CH2-CB 4.42Å; W137-P139 HydrophobicContact CH2-CG 4.28Å; W137-P139 HydrophobicContact CZ3-CG 4.22Å; P139-R141 VanDerWaalsContact C-N 3.34Å; P139-L207 HydrophobicContact CB-CD1 4.31Å
140	G	86.1	Confident	93.7	Very high	74 Å²	74	47.2 Å²	47.2	76%	0.763	24%	0.241	S	C	*	.	T	Hydrogen-bonded Turn	trans	87.3	-4.6	-177	0	0	0	0	0	114.9
141	R	88.2	Confident	92.9	Very high	36 Å²	36	52 Å²	52	14%	0.136	26%	0.261	C	S	.	.			trans	-114.5	148	173.2	-51.5	-162.7	98.5	-174.2	-6.4	112	W137 R138 P139 D228 G229 G239	W137-R141 PolarHBondContact NE1-O 3.03Å; R138-R141 HydrophobicContact CG-CG 4.17Å; R138-R141 PolarHBondContact O-N 2.93Å; P139-R141 VanDerWaalsContact C-N 3.34Å; R141-D228 VanDerWaalsContact CZ-O 3.22Å; R141-D228 IonicContact CZ-OD1 2.73Å; R141-D228 PolarHBondContact NH1-O 3.45Å; R141-D228 IonicContact NH1-OD1 3.64Å; R141-D228 PolarHBondContact NH1-OD1 3.44Å; R141-D228 IonicContact NH1-OD2 3.25Å; R141-D228 PolarHBondContact NH1-OD2 3.44Å; R141-D228 PolarHBondContact NH2-O 3.19Å; R141-G229 VanDerWaalsContact NH2-CA 3.33Å; R141-G239 VanDerWaalsContact CZ-O 3.24Å; R141-G239 PolarHBondContact NE-O 3.42Å; R141-G239 VanDerWaalsContact NE-O 3.12Å; R141-G239 PolarHBondContact NH2-O 3Å
142	T	87.1	Confident	92.2	Very high	126 Å²	126	54 Å²	54	77%	0.773	27%	0.271	S	S	*	.	S	Bend	trans	-91.2	-33.9	177.5	54.7	0	0	0	0	112.5
143	E	92.7	Very high	91.8	Very high	132 Å²	132	58.9 Å²	58.9	62%	0.617	30%	0.297	S	S	*	.	S	Bend	trans	-106.5	149.7	-173.4	-57	-62.8	131.5	0	0	112	Q145	E143-Q145 PolarHBondContact O-NE2 2.94Å
144	W	96.8	Very high	91.6	Very high	70 Å²	70	59.5 Å²	59.5	27%	0.265	30%	0.302	S	S	.	.	P	Polyproline II helix	trans	-67.6	141.4	165.2	-72.2	84.4	0	0	0	110.3	Q102 E135 Y136 W137 K178 R180	Q102-W144 HydrophobicContact CG-CH2 4.03Å; Q102-W144 VanDerWaalsContact OE1-CZ2 3.32Å; E135-W144 HydrophobicContact CB-CE3 4.16Å; Y136-W144 VanDerWaalsContact C-CE3 3.49Å; W137-W144 HydrophobicContact CB-CD2 3.91Å; W137-W144 HydrophobicContact CB-CE3 3.73Å; W137-W144 HydrophobicContact CB-CH2 4.09Å; W137-W144 HydrophobicContact CB-CZ2 4.23Å; W137-W144 HydrophobicContact CB-CZ3 3.82Å; W144-K178 HydrophobicContact CH2-CB 3.53Å; W144-K178 HydrophobicContact CH2-CD 4.31Å; W144-K178 HydrophobicContact CZ2-CB 4.43Å; W144-K178 HydrophobicContact CZ2-CD 4.45Å; W144-K178 HydrophobicContact CZ3-CB 4.04Å; W144-R180 HydrophobicContact CE3-CG 4.18Å; W144-R180 HydrophobicContact CH2-CG 3.84Å; W144-R180 VanDerWaalsContact CZ2-CZ 3.46Å; W144-R180 VanDerWaalsContact CZ2-NE 3.31Å; W144-R180 HydrophobicContact CZ3-CB 4.4Å; W144-R180 HydrophobicContact CZ3-CG 3.67Å
145	Q	95.8	Very high	91.4	Very high	43 Å²	43	63.1 Å²	63.1	20%	0.201	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	140.7	177	-61.7	-54.8	-47.2	0	0	110.5	E135 Y136 E143	E135-Q145 CarbonylContact C-O 3.47Å; E135-Q145 WeakPolarHBondContact CA-O 3.25Å; E135-Q145 WeakPolarHBondContact CB-O 3.4Å; Y136-Q145 HydrophobicContact CD1-CB 4.24Å; Y136-Q145 HydrophobicContact CD2-CB 4.03Å; Y136-Q145 HydrophobicContact CE1-CB 3.82Å; Y136-Q145 HydrophobicContact CE2-CB 3.57Å; Y136-Q145 HydrophobicContact CE2-CG 3.97Å; Y136-Q145 HydrophobicContact CG-CB 4.34Å; Y136-Q145 VanDerWaalsContact CZ-CB 3.45Å; Y136-Q145 PolarHBondContact N-O 3.34Å; Y136-Q145 PolarHBondContact O-N 2.78Å; E143-Q145 PolarHBondContact O-NE2 2.94Å
146	R	96.6	Very high	91.3	Very high	107 Å²	107	63.5 Å²	63.5	40%	0.404	32%	0.324	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.7	129	170	-168.5	153.8	-58.5	128.9	2.7	109.8	E135 K148 V154	E135-R146 IonicContact OE1-CZ 3.97Å; E135-R146 IonicContact OE1-NE 3.84Å; E135-R146 PolarHBondContact OE1-NE 3.41Å; E135-R146 IonicContact OE1-NH2 3.85Å; E135-R146 PolarHBondContact OE1-NH2 2.73Å; R146-K148 PolarHBondContact O-N 3.21Å; R146-V154 HydrophobicContact CG-CG1 3.71Å
147	Y	96.9	Very high	91.2	Very high	4 Å²	4	70.1 Å²	70.1	2%	0.016	35%	0.353	C	S	.	.	P	Polyproline II helix	trans	-59.5	134.5	173	-178.2	-106.3	0	0	0	110.9	L134 L156 L170 D171 T172 I174	L134-Y147 HydrophobicContact CB-CG 4.5Å; L134-Y147 PolarHBondContact O-N 3.12Å; Y147-L156 HydrophobicContact CD1-CD1 4.5Å; Y147-L156 HydrophobicContact CE1-CD2 4.42Å; Y147-L170 HydrophobicContact CD1-CD2 4.49Å; Y147-L170 HydrophobicContact CE1-CD2 3.95Å; Y147-L170 HydrophobicContact CE2-CB 4.44Å; Y147-L170 HydrophobicContact CE2-CD2 4.47Å; Y147-D171 PolarHBondContact OH-N 2.8Å; Y147-D171 VanDerWaalsContact OH-N 3.14Å; Y147-D171 PolarHBondContact OH-OD1 2.83Å; Y147-T172 VanDerWaalsContact CE2-O 3.25Å; Y147-T172 WeakPolarHBondContact CE2-O 3.47Å; Y147-T172 PolarHBondContact OH-N 2.88Å; Y147-T172 PolarHBondContact OH-O 3.43Å; Y147-I174 HydrophobicContact CD2-CD1 3.52Å; Y147-I174 HydrophobicContact CD2-CG1 3.54Å; Y147-I174 HydrophobicContact CE2-CD1 4.15Å; Y147-I174 HydrophobicContact CE2-CG1 3.9Å; Y147-I174 HydrophobicContact CG-CD1 4.01Å; Y147-I174 HydrophobicContact CG-CG1 4.5Å
148	K	92.1	Very high	91.2	Very high	111 Å²	111	67.4 Å²	67.4	48%	0.483	34%	0.343	S	S	.	.			trans	-132.8	121.5	173.4	-63.2	175.1	-171.8	175.6	0	105.9	R146 V154	R146-K148 PolarHBondContact O-N 3.21Å; K148-V154 HydrophobicContact CG-CG2 3.95Å
149	G	83.6	Confident	91.3	Very high	0 Å²	0	67.8 Å²	67.8	0%	0	35%	0.345	C	S	.	.			trans	-62.1	174.9	171	0	0	0	0	0	112	H151 Q152 N153 D171	G149-H151 PolarHBondContact O-N 3.38Å; G149-Q152 WeakPolarHBondContact O-CA 3.28Å; G149-Q152 PolarHBondContact O-N 2.91Å; G149-N153 PolarHBondContact N-O 3.19Å; G149-D171 VanDerWaalsContact C-OD2 3.27Å; G149-D171 VanDerWaalsContact CA-CG 3.45Å; G149-D171 WeakPolarHBondContact CA-OD1 3.35Å; G149-D171 WeakPolarHBondContact CA-OD2 3.47Å
150	H	77.2	Confident	91.4	Very high	38 Å²	38	71.7 Å²	71.7	18%	0.176	36%	0.357	C	S	.	.	T	Hydrogen-bonded Turn	trans	-52.3	-39.5	175.1	-176.6	68.2	0	0	0	111.6	Q152 D171 E267	H150-Q152 VanDerWaalsContact C-N 3.26Å; H150-Q152 PolarHBondContact O-N 3.25Å; H150-D171 PolarHBondContact N-OD2 2.88Å; H150-E267 IonicContact CD2-OE2 3.81Å; H150-E267 IonicContact CE1-OE2 3.34Å; H150-E267 IonicContact NE2-OE2 3.98Å; H150-E267 PolarHBondContact NE2-OE2 3.34Å
151	H	80.9	Confident	91.9	Very high	131 Å²	131	70.2 Å²	70.2	61%	0.606	33%	0.332	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.6	17	176.3	-56.7	-56.7	0	0	0	114.3	G149 N153	G149-H151 PolarHBondContact O-N 3.38Å; H151-N153 PolarHBondContact O-N 2.62Å
152	Q	83.7	Confident	92.2	Very high	99 Å²	99	69.4 Å²	69.4	46%	0.463	33%	0.331	S	S	.	.			trans	61.8	19	-177.8	-53.5	-65.5	-61	0	0	114.5	G149 H150 V154 R225	G149-Q152 WeakPolarHBondContact O-CA 3.28Å; G149-Q152 PolarHBondContact O-N 2.91Å; H150-Q152 VanDerWaalsContact C-N 3.26Å; H150-Q152 PolarHBondContact O-N 3.25Å; Q152-V154 PolarHBondContact O-N 3Å; Q152-R225 PolarHBondContact NE2-O 2.87Å
153	N	88.5	Confident	92.5	Very high	102 Å²	102	67.5 Å²	67.5	55%	0.545	32%	0.316	S	S	.	.			trans	-72.1	125.4	174.2	-70.1	-26.8	0	0	0	110	G149 H151	G149-N153 PolarHBondContact N-O 3.19Å; H151-N153 PolarHBondContact O-N 2.62Å
154	V	94.3	Very high	92.7	Very high	43 Å²	43	63.9 Å²	63.9	26%	0.261	30%	0.303	S	S	.	.			trans	-101.7	-31.4	-178.4	172.9	0	0	0	0	112.3	M133 R146 K148 Q152	M133-V154 HydrophobicContact CB-CG1 4.41Å; M133-V154 HydrophobicContact CG-CG1 3.85Å; M133-V154 HydrophobicContact SD-CG1 3.8Å; R146-V154 HydrophobicContact CG-CG1 3.71Å; K148-V154 HydrophobicContact CG-CG2 3.95Å; Q152-V154 PolarHBondContact O-N 3Å
155	L	95.7	Very high	92.7	Very high	77 Å²	77	62 Å²	62	40%	0.403	30%	0.302	S	S	.	.	P	Polyproline II helix	trans	-89.5	123.9	-179.2	-77.4	166.8	0	0	0	110.7	F131 M133 F184	F131-L155 HydrophobicContact CB-CD2 4.13Å; M133-L155 HydrophobicContact CG-CD2 3.83Å; M133-L155 HydrophobicContact SD-CD2 4.46Å; L155-F184 HydrophobicContact CD1-CD1 4.1Å; L155-F184 HydrophobicContact CD1-CE1 3.88Å; L155-F184 HydrophobicContact CD1-CZ 4.3Å; L155-F184 HydrophobicContact CD2-CB 3.67Å; L155-F184 HydrophobicContact CD2-CD1 3.45Å; L155-F184 VanDerWaalsContact CD2-CD1 3.45Å; L155-F184 HydrophobicContact CD2-CD2 4.13Å; L155-F184 HydrophobicContact CD2-CE1 4.08Å; L155-F184 HydrophobicContact CD2-CG 3.47Å; L155-F184 VanDerWaalsContact CD2-CG 3.47Å; L155-F184 HydrophobicContact CG-CD1 4.45Å
156	L	96.6	Very high	92.8	Very high	17 Å²	17	61.3 Å²	61.3	9%	0.089	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.8	128.3	174.7	-61.5	176.1	0	0	0	109.3	F131 Y132 L134 Y147 A158 I168 L170	F131-L156 CarbonylContact C-O 3.12Å; F131-L156 WeakPolarHBondContact CA-O 3.11Å; Y132-L156 HydrophobicContact CD2-CB 4.36Å; Y132-L156 HydrophobicContact CD2-CD1 4.26Å; Y132-L156 HydrophobicContact CE1-CB 4.3Å; Y132-L156 HydrophobicContact CE2-CB 4Å; Y132-L156 HydrophobicContact CE2-CD1 3.56Å; Y132-L156 HydrophobicContact CE2-CG 4.4Å; Y132-L156 PolarHBondContact N-O 2.59Å; Y132-L156 PolarHBondContact O-N 3.41Å; L134-L156 HydrophobicContact CD1-CD1 3.63Å; L134-L156 HydrophobicContact CG-CD1 3.84Å; Y147-L156 HydrophobicContact CD1-CD1 4.5Å; Y147-L156 HydrophobicContact CE1-CD2 4.42Å; L156-A158 PolarHBondContact O-N 2.87Å; L156-I168 HydrophobicContact CB-CD1 3.94Å; L156-L170 HydrophobicContact CD1-CD2 4.35Å
157	K	96.4	Very high	92.9	Very high	154 Å²	154	60.5 Å²	60.5	67%	0.67	30%	0.301	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-72.2	122.6	176.5	-175.8	179	179.9	-179.8	0	109.5	F131 I168	F131-K157 HydrophobicContact CD1-CB 4.24Å; F131-K157 HydrophobicContact CE1-CB 4.04Å; F131-K157 HydrophobicContact CE1-CG 4.19Å; K157-I168 WeakPolarHBondContact O-CD1 3.31Å
158	A	96.7	Very high	92.9	Very high	3 Å²	3	61.9 Å²	61.9	3%	0.025	31%	0.308	C	S	.	.			trans	-100.4	-127.6	-172.4	0	0	0	0	0	110.9	P129 T130 Y132 L156	P129-A158 HydrophobicContact CB-CB 4.03Å; P129-A158 HydrophobicContact CG-CB 3.92Å; P129-A158 WeakPolarHBondContact O-CB 3.33Å; T130-A158 WeakPolarHBondContact O-CB 3.21Å; T130-A158 PolarHBondContact O-N 3.01Å; Y132-A158 HydrophobicContact CD1-CB 3.48Å; Y132-A158 VanDerWaalsContact CD1-CB 3.48Å; Y132-A158 HydrophobicContact CE1-CB 3.62Å; L156-A158 PolarHBondContact O-N 2.87Å
159	N	97.8	Very high	93	Very high	8 Å²	8	61.3 Å²	61.3	4%	0.043	31%	0.314	C	S	.	.			trans	-90.8	164.6	-172.1	-57.3	100.8	0	0	0	112.9	T116 Q117 Y128 P129 T164 V166	T116-N159 PolarHBondContact O-ND2 3.16Å; T116-N159 PolarHBondContact OG1-OD1 3.48Å; Q117-N159 WeakPolarHBondContact CA-ND2 3.46Å; Q117-N159 PolarHBondContact N-OD1 2.76Å; Y128-N159 HydrophobicContact CD2-CB 4.27Å; P129-N159 VanDerWaalsContact CG-OD1 3.3Å; P129-N159 WeakPolarHBondContact CG-OD1 3.41Å; P129-N159 PolarHBondContact O-N 3.34Å; N159-T164 PolarHBondContact ND2-O 3.1Å; N159-V166 WeakPolarHBondContact ND2-CG2 3.41Å
160	F	96	Very high	93.5	Very high	130 Å²	130	61.5 Å²	61.5	57%	0.57	32%	0.315	S	S	*	.	S	Bend	trans	-124.7	-5.3	175.9	53.5	-95.1	0	0	0	112.7	T164 V166	F160-T164 HydrophobicContact CE1-CG2 4.08Å; F160-T164 HydrophobicContact CE2-CG2 4.38Å; F160-T164 HydrophobicContact CZ-CG2 3.57Å; F160-V166 HydrophobicContact CD1-CG2 4.46Å; F160-V166 HydrophobicContact CE1-CG2 4.17Å
161	D	95.8	Very high	94.1	Very high	44 Å²	44	62 Å²	62	24%	0.235	32%	0.319	C	S	.	.	S	Bend	trans	-152.4	-173.7	176.1	67.8	27.4	0	0	0	109.8	Y128 N163 T164	Y128-D161 VanDerWaalsContact CB-O 3.23Å; Y128-D161 WeakPolarHBondContact CB-O 3.38Å; D161-N163 PolarHBondContact OD1-N 2.92Å; D161-T164 WeakPolarHBondContact OD1-CB 3.49Å; D161-T164 PolarHBondContact OD1-N 2.81Å; D161-T164 PolarHBondContact OD1-OG1 2.96Å; D161-T164 PolarHBondContact OD2-OG1 2.81Å
162	T	95	Very high	94.6	Very high	18 Å²	18	56.5 Å²	56.5	11%	0.11	30%	0.295	C	S	.	.	S	Bend	trans	-90.2	-9.3	-179.6	52.3	0	0	0	0	115.2	G118 R119 Y128 R194	G118-T162 CarbonylContact C-O 3.58Å; R119-T162 WeakPolarHBondContact O-CB 3.3Å; R119-T162 VanDerWaalsContact O-CG2 3.22Å; R119-T162 WeakPolarHBondContact O-CG2 3.46Å; Y128-T162 HydrophobicContact CD1-CG2 4.15Å; T162-R194 PolarHBondContact O-NH2 2.77Å
163	N	93	Very high	95.2	Very high	86 Å²	86	52.7 Å²	52.7	46%	0.46	28%	0.278	S	S	.	.	S	Bend	trans	-118.8	-33.5	-165.1	-65	-34	0	0	0	113.5	Q117 H120 D161 A165	Q117-N163 PolarHBondContact NE2-O 2.81Å; H120-N163 PolarHBondContact ND1-OD1 2.92Å; D161-N163 PolarHBondContact OD1-N 2.92Å; N163-A165 PolarHBondContact O-N 2.78Å
164	T	96.4	Very high	95.5	Very high	56 Å²	56	47.9 Å²	47.9	34%	0.344	25%	0.253	S	S	.	.			trans	-80.1	117	-176.5	-55	0	0	0	0	109.5	N159 F160 D161	N159-T164 PolarHBondContact ND2-O 3.1Å; F160-T164 HydrophobicContact CE1-CG2 4.08Å; F160-T164 HydrophobicContact CE2-CG2 4.38Å; F160-T164 HydrophobicContact CZ-CG2 3.57Å; D161-T164 WeakPolarHBondContact OD1-CB 3.49Å; D161-T164 PolarHBondContact OD1-N 2.81Å; D161-T164 PolarHBondContact OD1-OG1 2.96Å; D161-T164 PolarHBondContact OD2-OG1 2.81Å
165	A	97.8	Very high	95.6	Very high	30 Å²	30	46.6 Å²	46.6	25%	0.248	25%	0.245	C	C	.	.			trans	-73.7	132.5	171.1	0	0	0	0	0	109.5	I78 E115 T116 Q117 N163	I78-A165 HydrophobicContact CD1-CB 4.35Å; E115-A165 HydrophobicContact CG-CB 4.05Å; E115-A165 WeakPolarHBondContact OE1-CB 3.35Å; T116-A165 WeakPolarHBondContact O-CA 3.39Å; Q117-A165 HydrophobicContact CB-CB 4.39Å; Q117-A165 HydrophobicContact CG-CB 4.32Å; N163-A165 PolarHBondContact O-N 2.78Å
166	V	98.4	Very high	95.8	Very high	29 Å²	29	43 Å²	43	18%	0.176	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	107.7	179.6	175.6	0	0	0	0	107.8	E115 T116 N159 F160 I168	E115-V166 WeakPolarHBondContact CA-O 3.48Å; T116-V166 PolarHBondContact N-O 2.8Å; T116-V166 PolarHBondContact O-N 2.83Å; N159-V166 WeakPolarHBondContact ND2-CG2 3.41Å; F160-V166 HydrophobicContact CD1-CG2 4.46Å; F160-V166 HydrophobicContact CE1-CG2 4.17Å; V166-I168 HydrophobicContact CG1-CG1 4.27Å
167	K	98.1	Very high	95.8	Very high	90 Å²	90	42.3 Å²	42.3	39%	0.391	22%	0.223	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.3	131.6	174.3	-175.1	172.7	178.6	172.6	0	110	C113 V114 E115 Y198	C113-K167 HydrophobicContact CB-CG 4.25Å; V114-K167 CarbonylContact O-C 3.59Å; V114-K167 WeakPolarHBondContact O-CA 2.82Å; E115-K167 HydrophobicContact CB-CB 4.11Å; E115-K167 HydrophobicContact CB-CG 4.31Å; E115-K167 HydrophobicContact CG-CB 4.07Å; K167-Y198 HydrophobicContact CD-CD2 4.31Å; K167-Y198 HydrophobicContact CD-CE2 3.95Å; K167-Y198 HydrophobicContact CG-CE2 4.35Å; K167-Y198 VanDerWaalsContact NZ-CD1 3.34Å
168	I	96.2	Very high	95.9	Very high	33 Å²	33	38 Å²	38	17%	0.169	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	122.3	178.9	-55.3	178.5	0	0	0	108.2	C113 V114 Y132 L156 K157 V166	C113-I168 WeakPolarHBondContact CA-O 3.35Å; C113-I168 VanDerWaalsContact CB-O 3.3Å; C113-I168 WeakPolarHBondContact CB-O 3.22Å; V114-I168 HydrophobicContact CG2-CB 4.19Å; V114-I168 PolarHBondContact N-O 2.8Å; V114-I168 PolarHBondContact O-N 2.88Å; Y132-I168 HydrophobicContact CE1-CD1 4.44Å; Y132-I168 WeakPolarHBondContact OH-CD1 3.37Å; L156-I168 HydrophobicContact CB-CD1 3.94Å; K157-I168 WeakPolarHBondContact O-CD1 3.31Å; V166-I168 HydrophobicContact CG1-CG1 4.27Å
169	T	95	Very high	96	Very high	99 Å²	99	38 Å²	38	61%	0.607	20%	0.203	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-77.6	125.6	166.8	-56	0	0	0	0	108.6
170	L	94.6	Very high	96.1	Very high	5 Å²	5	39 Å²	39	3%	0.026	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.4	131.3	177.7	-59.9	179.9	0	0	0	109.1	I111 T112 V114 L134 Y147 L156 T172 I174	I111-L170 HydrophobicContact CG2-CD1 4.15Å; T112-L170 PolarHBondContact O-N 2.59Å; V114-L170 HydrophobicContact CG1-CD1 4.48Å; V114-L170 HydrophobicContact CG2-CD2 4.24Å; L134-L170 HydrophobicContact CD1-CD1 4.41Å; L134-L170 HydrophobicContact CD1-CD2 3.88Å; Y147-L170 HydrophobicContact CD1-CD2 4.49Å; Y147-L170 HydrophobicContact CE1-CD2 3.95Å; Y147-L170 HydrophobicContact CE2-CB 4.44Å; Y147-L170 HydrophobicContact CE2-CD2 4.47Å; L156-L170 HydrophobicContact CD1-CD2 4.35Å; L170-T172 VanDerWaalsContact C-N 3.26Å; L170-T172 WeakPolarHBondContact CB-O 3.44Å; L170-T172 PolarHBondContact O-N 2.93Å; L170-I174 HydrophobicContact CD1-CD1 3.64Å; L170-I174 HydrophobicContact CD1-CG1 3.91Å
171	D	89.6	Confident	96.2	Very high	49 Å²	49	32.8 Å²	32.8	26%	0.262	18%	0.18	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.6	-24.1	176.3	46.7	-31.1	0	0	0	112.7	Y147 G149 H150 R248	Y147-D171 PolarHBondContact OH-N 2.8Å; Y147-D171 VanDerWaalsContact OH-N 3.14Å; Y147-D171 PolarHBondContact OH-OD1 2.83Å; G149-D171 VanDerWaalsContact C-OD2 3.27Å; G149-D171 VanDerWaalsContact CA-CG 3.45Å; G149-D171 WeakPolarHBondContact CA-OD1 3.35Å; G149-D171 WeakPolarHBondContact CA-OD2 3.47Å; H150-D171 PolarHBondContact N-OD2 2.88Å; D171-R248 PolarHBondContact O-NH1 2.85Å; D171-R248 PolarHBondContact O-NH2 3.06Å
172	T	91.9	Very high	96.3	Very high	15 Å²	15	30.8 Å²	30.8	9%	0.092	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	128.7	164.8	-53.6	0	0	0	0	108.5	Y147 L170	Y147-T172 VanDerWaalsContact CE2-O 3.25Å; Y147-T172 WeakPolarHBondContact CE2-O 3.47Å; Y147-T172 PolarHBondContact OH-N 2.88Å; Y147-T172 PolarHBondContact OH-O 3.43Å; L170-T172 VanDerWaalsContact C-N 3.26Å; L170-T172 WeakPolarHBondContact CB-O 3.44Å; L170-T172 PolarHBondContact O-N 2.93Å
173	P	94.8	Very high	96.5	Very high	18 Å²	18	30 Å²	30	12%	0.117	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-60.7	145.3	175.3	-19.8	31.2	0	0	0	112	L41 V110 I111	L41-P173 HydrophobicContact CD1-CG 3.89Å; L41-P173 HydrophobicContact CD2-CB 4.18Å; L41-P173 HydrophobicContact CD2-CG 3.58Å; L41-P173 HydrophobicContact CG-CG 4.39Å; V110-P173 HydrophobicContact CG1-CB 3.69Å; I111-P173 WeakPolarHBondContact O-CA 3.47Å
174	I	96.2	Very high	96.7	Very high	2 Å²	2	27.6 Å²	27.6	1%	0.01	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.7	122	174.4	-65.8	169.7	0	0	0	108.8	I111 L134 Y136 Y147 L170 A176	I111-I174 HydrophobicContact CB-CB 4.22Å; I111-I174 HydrophobicContact CD1-CB 4.35Å; I111-I174 HydrophobicContact CD1-CG2 4.07Å; I111-I174 PolarHBondContact N-O 3.18Å; I111-I174 PolarHBondContact O-N 2.77Å; L134-I174 HydrophobicContact CB-CD1 4.48Å; L134-I174 HydrophobicContact CD1-CD1 4.06Å; Y136-I174 HydrophobicContact CD1-CD1 3.94Å; Y136-I174 HydrophobicContact CD1-CG1 4.1Å; Y136-I174 HydrophobicContact CD1-CG2 3.66Å; Y136-I174 HydrophobicContact CD2-CG2 3.61Å; Y136-I174 HydrophobicContact CE1-CD1 4.37Å; Y136-I174 HydrophobicContact CE1-CG1 4.19Å; Y136-I174 HydrophobicContact CE1-CG2 4.21Å; Y136-I174 HydrophobicContact CE2-CG2 4.18Å; Y136-I174 HydrophobicContact CG-CG2 3.32Å; Y147-I174 HydrophobicContact CD2-CD1 3.52Å; Y147-I174 HydrophobicContact CD2-CG1 3.54Å; Y147-I174 HydrophobicContact CE2-CD1 4.15Å; Y147-I174 HydrophobicContact CE2-CG1 3.9Å; Y147-I174 HydrophobicContact CG-CD1 4.01Å; Y147-I174 HydrophobicContact CG-CG1 4.5Å; L170-I174 HydrophobicContact CD1-CD1 3.64Å; L170-I174 HydrophobicContact CD1-CG1 3.91Å; I174-A176 HydrophobicContact CG2-CB 3.68Å
175	V	96.6	Very high	96.8	Very high	16 Å²	16	25 Å²	25	10%	0.097	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.1	107.4	169.4	-176.5	0	0	0	0	109	V108 H109 V110 R138 L241	V108-V175 HydrophobicContact CG1-CG1 3.43Å; V108-V175 VanDerWaalsContact CG1-CG1 3.43Å; H109-V175 WeakPolarHBondContact O-CA 3.35Å; V110-V175 HydrophobicContact CG2-CG2 4.37Å; R138-V175 WeakPolarHBondContact CD-O 3.16Å; R138-V175 PolarHBondContact NH1-O 2.86Å; V175-L241 HydrophobicContact CB-CD1 3.74Å; V175-L241 HydrophobicContact CG1-CD1 3.97Å; V175-L241 HydrophobicContact CG2-CD1 3.87Å
176	A	97.9	Very high	96.6	Very high	0 Å²	0	28.9 Å²	28.9	0%	0	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.8	155.2	-172.9	0	0	0	0	0	114.6	H109 I111 Y136 I174	H109-A176 PolarHBondContact N-O 2.84Å; H109-A176 PolarHBondContact O-N 2.84Å; I111-A176 HydrophobicContact CD1-CB 4.07Å; Y136-A176 HydrophobicContact CD2-CB 4.19Å; Y136-A176 HydrophobicContact CG-CB 4.35Å; I174-A176 HydrophobicContact CG2-CB 3.68Å
177	S	97.8	Very high	96.5	Very high	4 Å²	4	34.2 Å²	34.2	3%	0.028	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.1	-16.6	169.6	62	0	0	0	0	112.8	L105 R107 W137	L105-S177 WeakPolarHBondContact CB-O 3.35Å; L105-S177 PolarHBondContact N-O 2.85Å; R107-S177 WeakPolarHBondContact O-CA 3.44Å; W137-S177 VanDerWaalsContact CE3-OG 3.23Å; W137-S177 VanDerWaalsContact CZ3-OG 3.26Å; W137-S177 WeakPolarHBondContact CZ3-OG 3.49Å; W137-S177 PolarHBondContact O-N 3.43Å; W137-S177 PolarHBondContact O-OG 2.87Å
178	K	98.5	Very high	96.4	Very high	64 Å²	64	34.2 Å²	34.2	28%	0.278	17%	0.173	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.7	141.5	177.1	-55.1	177.7	-177.1	173.3	0	109.7	V103 Y136 W137 W144	V103-K178 VanDerWaalsContact O-CA 3.3Å; V103-K178 WeakPolarHBondContact O-CA 3.11Å; Y136-K178 VanDerWaalsContact CA-O 3.31Å; Y136-K178 WeakPolarHBondContact CA-O 3.47Å; W137-K178 HydrophobicContact CB-CB 4.47Å; W137-K178 HydrophobicContact CE3-CD 4.05Å; W137-K178 HydrophobicContact CE3-CG 4.26Å; W137-K178 PolarHBondContact N-O 3.32Å; W137-K178 PolarHBondContact O-N 2.9Å; W137-K178 VanDerWaalsContact O-N 3.14Å; W144-K178 HydrophobicContact CH2-CB 3.53Å; W144-K178 HydrophobicContact CH2-CD 4.31Å; W144-K178 HydrophobicContact CZ2-CB 4.43Å; W144-K178 HydrophobicContact CZ2-CD 4.45Å; W144-K178 HydrophobicContact CZ3-CB 4.04Å
179	V	98.8	Very high	96.4	Very high	1 Å²	1	36.2 Å²	36.2	1%	0.006	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.8	140.9	-178.6	-172.4	0	0	0	0	109.4	Q102 V103 I111 L134 E135 F181 L197	Q102-V179 CarbonylContact C-O 3.56Å; Q102-V179 WeakPolarHBondContact CA-O 3.34Å; V103-V179 PolarHBondContact N-O 2.95Å; V103-V179 PolarHBondContact O-N 3.46Å; I111-V179 HydrophobicContact CD1-CG2 3.26Å; I111-V179 HydrophobicContact CG1-CG2 4.48Å; L134-V179 HydrophobicContact CD2-CG1 4.27Å; E135-V179 CarbonylContact O-C 3.54Å; E135-V179 WeakPolarHBondContact O-CA 3.36Å; V179-F181 HydrophobicContact CG1-CE2 4.35Å; V179-L197 HydrophobicContact CB-CD1 4.36Å; V179-L197 HydrophobicContact CB-CD2 4.42Å; V179-L197 HydrophobicContact CG1-CD2 4.12Å; V179-L197 HydrophobicContact CG2-CD1 4.23Å; V179-L197 HydrophobicContact CG2-CD2 4.38Å
180	R	98.8	Very high	96.5	Very high	30 Å²	30	34.6 Å²	34.6	11%	0.113	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119	133.5	172.7	-72.4	173.8	177.3	178.2	-1.7	110.6	Y98 Y100 L101 Q102 L134 E135 W144 V182	Y98-R180 PolarHBondContact OH-NH1 2.92Å; Y100-R180 HydrophobicContact CD2-CG 3.99Å; Y100-R180 HydrophobicContact CG-CG 4.29Å; L101-R180 CarbonylContact O-C 3.18Å; L101-R180 WeakPolarHBondContact O-CA 3.46Å; Q102-R180 HydrophobicContact CB-CG 3.91Å; Q102-R180 HydrophobicContact CG-CG 3.91Å; L134-R180 WeakPolarHBondContact CA-O 3.32Å; E135-R180 HydrophobicContact CB-CB 4.1Å; E135-R180 PolarHBondContact N-O 3.19Å; E135-R180 PolarHBondContact O-N 2.73Å; E135-R180 IonicContact OE2-NH1 2.91Å; W144-R180 HydrophobicContact CE3-CG 4.18Å; W144-R180 HydrophobicContact CH2-CG 3.84Å; W144-R180 VanDerWaalsContact CZ2-CZ 3.46Å; W144-R180 VanDerWaalsContact CZ2-NE 3.31Å; W144-R180 HydrophobicContact CZ3-CB 4.4Å; W144-R180 HydrophobicContact CZ3-CG 3.67Å; R180-V182 HydrophobicContact CB-CG2 4.4Å
181	F	98.8	Very high	96.7	Very high	0 Å²	0	34.4 Å²	34.4	0%	0	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.2	116.2	165.4	-67.5	-100.8	0	0	0	108.2	Y100 L101 V114 T116 Y132 L134 V179 P183 M193 V195 L197	Y100-F181 VanDerWaalsContact CA-O 3.29Å; Y100-F181 WeakPolarHBondContact CA-O 3.44Å; L101-F181 HydrophobicContact CB-CB 4.43Å; L101-F181 PolarHBondContact N-O 2.86Å; L101-F181 PolarHBondContact O-N 2.8Å; V114-F181 HydrophobicContact CB-CE1 4.03Å; V114-F181 HydrophobicContact CB-CZ 4.18Å; V114-F181 HydrophobicContact CG1-CE1 4.31Å; V114-F181 HydrophobicContact CG1-CZ 4.15Å; T116-F181 HydrophobicContact CG2-CD1 4.06Å; T116-F181 HydrophobicContact CG2-CE1 3.94Å; Y132-F181 AromaticContact CD2-CD1 3.93Å; Y132-F181 HydrophobicContact CD2-CD1 3.93Å; Y132-F181 AromaticContact CE2-CD1 3.89Å; Y132-F181 HydrophobicContact CE2-CD1 3.89Å; Y132-F181 HydrophobicContact CE2-CE1 4.09Å; L134-F181 HydrophobicContact CD2-CD1 3.67Å; L134-F181 HydrophobicContact CD2-CE1 3.71Å; L134-F181 HydrophobicContact CD2-CG 4.09Å; L134-F181 HydrophobicContact CD2-CZ 4.14Å; V179-F181 HydrophobicContact CG1-CE2 4.35Å; F181-P183 WeakPolarHBondContact O-CD 3.35Å; F181-M193 HydrophobicContact CB-CE 4.11Å; F181-M193 HydrophobicContact CD1-CE 4.27Å; F181-V195 HydrophobicContact CD1-CB 4.45Å; F181-V195 HydrophobicContact CD1-CG1 3.88Å; F181-V195 HydrophobicContact CD2-CB 4.27Å; F181-V195 HydrophobicContact CD2-CG1 4.05Å; F181-V195 HydrophobicContact CD2-CG2 4.12Å; F181-V195 HydrophobicContact CE1-CB 4.1Å; F181-V195 HydrophobicContact CE1-CG1 4Å; F181-V195 HydrophobicContact CE2-CB 3.92Å; F181-V195 HydrophobicContact CE2-CG1 4.19Å; F181-V195 HydrophobicContact CE2-CG2 3.82Å; F181-V195 HydrophobicContact CG-CG1 3.9Å; F181-V195 HydrophobicContact CZ-CB 3.83Å; F181-V195 HydrophobicContact CZ-CG1 4.16Å; F181-V195 HydrophobicContact CZ-CG2 4.22Å; F181-L197 HydrophobicContact CE2-CD2 3.86Å; F181-L197 HydrophobicContact CE2-CG 4.37Å; F181-L197 HydrophobicContact CZ-CD2 3.71Å; F181-L197 HydrophobicContact CZ-CG 4.41Å
182	V	98.6	Very high	97.1	Very high	1 Å²	1	32.1 Å²	32.1	1%	0.006	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	97.5	-178	-176.1	0	0	0	0	108	Y98 E99 Y132 M133 E135 R180	Y98-V182 HydrophobicContact CD2-CG1 3.82Å; Y98-V182 HydrophobicContact CE2-CG1 3.88Å; Y98-V182 HydrophobicContact CE2-CG2 4.04Å; E99-V182 WeakPolarHBondContact O-CA 3.25Å; E99-V182 WeakPolarHBondContact O-CG1 3.21Å; Y132-V182 CarbonylContact C-O 3.57Å; Y132-V182 WeakPolarHBondContact CA-O 3.39Å; Y132-V182 WeakPolarHBondContact CB-O 3.18Å; M133-V182 HydrophobicContact CB-CB 4.29Å; M133-V182 HydrophobicContact CE-CB 4.39Å; M133-V182 HydrophobicContact CE-CG1 3.81Å; M133-V182 PolarHBondContact N-O 2.84Å; M133-V182 PolarHBondContact O-N 2.93Å; E135-V182 HydrophobicContact CG-CG2 3.95Å; R180-V182 HydrophobicContact CB-CG2 4.4Å
183	P	98.3	Very high	97.3	Very high	2 Å²	2	31.4 Å²	31.4	1%	0.013	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-58.2	142	179.2	22.7	-34	0	0	0	111.7	W87 I93 E99 F181 T191 M193	W87-P183 HydrophobicContact CH2-CG 4.15Å; W87-P183 HydrophobicContact CZ3-CG 4.22Å; I93-P183 HydrophobicContact CD1-CG 4.05Å; I93-P183 HydrophobicContact CG1-CB 4.21Å; I93-P183 HydrophobicContact CG1-CG 4.08Å; I93-P183 HydrophobicContact CG2-CB 4.37Å; E99-P183 HydrophobicContact CB-CG 4.48Å; E99-P183 WeakPolarHBondContact O-CD 3.45Å; F181-P183 WeakPolarHBondContact O-CD 3.35Å; P183-T191 HydrophobicContact CB-CG2 3.92Å; P183-M193 HydrophobicContact CB-SD 3.8Å; P183-M193 HydrophobicContact CG-SD 4.21Å
184	F	97.9	Very high	97.5	Very high	36 Å²	36	31 Å²	31	16%	0.158	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.7	143.6	176	179.8	-92.7	0	0	0	109.9	Q95 T130 F131 M133 L155 E186	Q95-F184 HydrophobicContact CB-CE2 4.07Å; Q95-F184 HydrophobicContact CB-CZ 4.22Å; Q95-F184 HydrophobicContact CG-CE2 4.23Å; Q95-F184 HydrophobicContact CG-CZ 3.9Å; T130-F184 PolarHBondContact OG1-O 2.86Å; F131-F184 HydrophobicContact CB-CB 4.2Å; F131-F184 HydrophobicContact CB-CD1 4.04Å; F131-F184 PolarHBondContact N-O 2.82Å; F131-F184 PolarHBondContact O-N 3.05Å; M133-F184 HydrophobicContact CE-CD2 4.48Å; L155-F184 HydrophobicContact CD1-CD1 4.1Å; L155-F184 HydrophobicContact CD1-CE1 3.88Å; L155-F184 HydrophobicContact CD1-CZ 4.3Å; L155-F184 HydrophobicContact CD2-CB 3.67Å; L155-F184 HydrophobicContact CD2-CD1 3.45Å; L155-F184 VanDerWaalsContact CD2-CD1 3.45Å; L155-F184 HydrophobicContact CD2-CD2 4.13Å; L155-F184 HydrophobicContact CD2-CE1 4.08Å; L155-F184 HydrophobicContact CD2-CG 3.47Å; L155-F184 VanDerWaalsContact CD2-CG 3.47Å; L155-F184 HydrophobicContact CG-CD1 4.45Å; F184-E186 HydrophobicContact CE1-CG 4.33Å
185	S	97.3	Very high	97.6	Very high	0 Å²	0	30.9 Å²	30.9	0%	0	15%	0.147	C	C	.	.			trans	-149.7	136.5	175.8	-72.5	0	0	0	0	111.1	D94 Q95 T130 H187 R189	D94-S185 CarbonylContact C-O 3.59Å; D94-S185 WeakPolarHBondContact CA-O 3.28Å; Q95-S185 WeakPolarHBondContact CG-O 3.32Å; Q95-S185 PolarHBondContact N-O 2.9Å; Q95-S185 VanDerWaalsContact N-O 3.15Å; T130-S185 PolarHBondContact OG1-OG 2.78Å; S185-H187 WeakPolarHBondContact CB-O 3.44Å; S185-H187 PolarHBondContact O-N 3.32Å; S185-R189 VanDerWaalsContact OG-CD 3.29Å; S185-R189 WeakPolarHBondContact OG-CD 3.35Å
186	E	95.4	Very high	97.7	Very high	113 Å²	113	30.2 Å²	30.2	53%	0.528	14%	0.142	S	C	.	.	S	Bend	trans	-67.7	-26.2	179.3	-64.3	-178.3	170.6	0	0	112.8	Q95 F184	Q95-E186 PolarHBondContact NE2-O 3.29Å; Q95-E186 VanDerWaalsContact NE2-O 3.15Å; F184-E186 HydrophobicContact CE1-CG 4.33Å
187	H	95.3	Very high	97.8	Very high	140 Å²	140	30.2 Å²	30.2	65%	0.648	14%	0.142	S	C	*	.	S	Bend	trans	-128.6	148.7	179.3	-57	-39.2	0	0	0	110.4	S185 R189	S185-H187 WeakPolarHBondContact CB-O 3.44Å; S185-H187 PolarHBondContact O-N 3.32Å; H187-R189 PolarHBondContact O-N 3.13Å
188	L	97	Very high	97.8	Very high	90 Å²	90	31.1 Å²	31.1	47%	0.471	15%	0.145	S	C	.	.			trans	-57.4	119	179.4	-170.9	69.1	0	0	0	110.8	Q92 I93 D94	Q92-L188 HydrophobicContact CB-CD1 3.62Å; Q92-L188 HydrophobicContact CB-CG 3.95Å; I93-L188 WeakPolarHBondContact O-CA 3.37Å; D94-L188 HydrophobicContact CB-CB 4.47Å; D94-L188 HydrophobicContact CB-CD1 4Å
189	R	96.2	Very high	97.8	Very high	76 Å²	76	28.1 Å²	28.1	29%	0.287	13%	0.132	S	C	.	.	B	Isolated β-bridge	trans	-152.1	150.4	179.2	69.5	-172.5	-54.9	112.1	-1.5	112.7	Q92 I93 S185 H187 T191	Q92-R189 CarbonylContact C-O 3.57Å; Q92-R189 WeakPolarHBondContact CA-O 3.4Å; Q92-R189 WeakPolarHBondContact CB-O 3.49Å; I93-R189 PolarHBondContact N-O 3.36Å; I93-R189 PolarHBondContact O-N 2.77Å; S185-R189 VanDerWaalsContact OG-CD 3.29Å; S185-R189 WeakPolarHBondContact OG-CD 3.35Å; H187-R189 PolarHBondContact O-N 3.13Å; R189-T191 PolarHBondContact O-N 3.09Å
190	T	96.6	Very high	97.7	Very high	64 Å²	64	29.9 Å²	29.9	39%	0.393	14%	0.144	S	C	.	.			trans	-70	123.1	166.6	-46.1	0	0	0	0	108.5	Q92 E127	Q92-T190 PolarHBondContact NE2-OG1 2.87Å; E127-T190 HydrophobicContact CG-CG2 3.78Å
191	T	97.3	Very high	97.5	Very high	2 Å²	2	32.1 Å²	32.1	1%	0.012	16%	0.156	C	C	.	.			trans	-120.3	136.9	-178.2	-63.4	0	0	0	0	108	P89 P129 P183 R189 M193	P89-T191 VanDerWaalsContact CD-O 3.23Å; P89-T191 WeakPolarHBondContact CD-O 3.39Å; P129-T191 HydrophobicContact CB-CG2 3.83Å; P183-T191 HydrophobicContact CB-CG2 3.92Å; R189-T191 PolarHBondContact O-N 3.09Å; T191-M193 HydrophobicContact CG2-CG 4.23Å
192	C	98	Very high	97.3	Very high	1 Å²	1	32.8 Å²	32.8	1%	0.007	16%	0.159	C	C	.	.			trans	-137.4	145.1	173.6	-58.8	0	0	0	0	108.5	A86 W87 C88 R119 E127 P129	A86-C192 HydrophobicContact CB-CB 3.95Å; W87-C192 CarbonylContact O-C 3.54Å; W87-C192 WeakPolarHBondContact O-CA 3.42Å; W87-C192 WeakPolarHBondContact O-CB 3.27Å; C88-C192 HydrophobicContact CB-CB 4.1Å; C88-C192 WeakPolarHBondContact CB-SG 3.28Å; C88-C192 WeakPolarHBondContact SG-CB 3.49Å; C88-C192 CovalentContact SG-SG 2.03Å; C88-C192 PolarHBondContact SG-SG 2.69Å; R119-C192 HydrophobicContact CB-CB 3.67Å; R119-C192 HydrophobicContact CG-CB 4.4Å; E127-C192 HydrophobicContact CB-CB 3.86Å; E127-C192 VanDerWaalsContact CB-SG 3.55Å; P129-C192 WeakPolarHBondContact CD-O 3.31Å
193	M	97.7	Very high	96.9	Very high	0 Å²	0	37.2 Å²	37.2	0%	0	18%	0.178	C	C	.	.	B	Isolated β-bridge	trans	-133.4	142	-171.2	-56.4	-176.4	61.5	0	0	112.2	W87 T116 P129 Y132 F181 P183 T191 V195	W87-M193 HydrophobicContact CE3-CB 4.2Å; W87-M193 HydrophobicContact CZ3-CG 4.48Å; W87-M193 HydrophobicContact CZ3-SD 4.18Å; W87-M193 PolarHBondContact N-O 3.15Å; W87-M193 VanDerWaalsContact N-O 3.09Å; W87-M193 PolarHBondContact O-N 3.12Å; T116-M193 HydrophobicContact CG2-CE 3.95Å; P129-M193 HydrophobicContact CB-CE 4.1Å; P129-M193 HydrophobicContact CB-CG 3.91Å; P129-M193 HydrophobicContact CB-SD 3.94Å; P129-M193 HydrophobicContact CG-CE 3.96Å; P129-M193 HydrophobicContact CG-CG 3.77Å; P129-M193 HydrophobicContact CG-SD 4.21Å; Y132-M193 HydrophobicContact CD1-CE 4.2Å; Y132-M193 HydrophobicContact CG-CE 4.26Å; F181-M193 HydrophobicContact CB-CE 4.11Å; F181-M193 HydrophobicContact CD1-CE 4.27Å; P183-M193 HydrophobicContact CB-SD 3.8Å; P183-M193 HydrophobicContact CG-SD 4.21Å; T191-M193 HydrophobicContact CG2-CG 4.23Å; M193-V195 HydrophobicContact CB-CG1 4.43Å; M193-V195 HydrophobicContact CE-CG1 4.25Å
194	R	98.4	Very high	96.5	Very high	9 Å²	9	38 Å²	38	3%	0.034	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117	144.2	157.5	-65.3	174.5	-75.2	-179.4	0.6	108.5	A76 R77 I78 T80 G85 A86 T116 Q117 G118 T162	A76-R194 CarbonylContact O-C 3.52Å; A76-R194 WeakPolarHBondContact O-CA 2.82Å; R77-R194 VanDerWaalsContact O-CD 3.31Å; R77-R194 WeakPolarHBondContact O-CD 3.25Å; R77-R194 WeakPolarHBondContact O-CG 3.25Å; I78-R194 HydrophobicContact CD1-CB 4.48Å; T80-R194 VanDerWaalsContact O-CD 3.31Å; T80-R194 WeakPolarHBondContact O-CD 3.41Å; T80-R194 PolarHBondContact O-NH1 3.07Å; G85-R194 VanDerWaalsContact O-CD 3.26Å; G85-R194 WeakPolarHBondContact O-CD 3.43Å; A86-R194 HydrophobicContact CB-CG 3.99Å; T116-R194 CarbonylContact C-O 3.5Å; T116-R194 VanDerWaalsContact CA-O 3.29Å; T116-R194 WeakPolarHBondContact CA-O 3.25Å; Q117-R194 HydrophobicContact CB-CB 4.26Å; Q117-R194 VanDerWaalsContact CG-NH2 3.26Å; Q117-R194 PolarHBondContact N-O 3.45Å; Q117-R194 PolarHBondContact O-N 3.34Å; G118-R194 PolarHBondContact O-NE 2.86Å; G118-R194 PolarHBondContact O-NH2 3.45Å; T162-R194 PolarHBondContact O-NH2 2.77Å
195	V	98.7	Very high	96.2	Very high	0 Å²	0	36.3 Å²	36.3	0%	0	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138	157.1	-172.7	-50.4	0	0	0	0	112.5	M50 A76 I78 L101 E115 T116 F181 M193	M50-V195 WeakPolarHBondContact CB-O 3.24Å; M50-V195 HydrophobicContact CE-CG2 3.75Å; M50-V195 HydrophobicContact CG-CG2 4.47Å; M50-V195 WeakPolarHBondContact CG-O 3.05Å; A76-V195 PolarHBondContact O-N 3.28Å; I78-V195 PolarHBondContact N-O 3.34Å; I78-V195 VanDerWaalsContact N-O 3.16Å; L101-V195 HydrophobicContact CD2-CB 4.46Å; L101-V195 HydrophobicContact CD2-CG1 3.92Å; L101-V195 HydrophobicContact CD2-CG2 3.62Å; E115-V195 CarbonylContact O-C 3.52Å; E115-V195 WeakPolarHBondContact O-CA 3.14Å; T116-V195 HydrophobicContact CG2-CG1 4.21Å; F181-V195 HydrophobicContact CD1-CB 4.45Å; F181-V195 HydrophobicContact CD1-CG1 3.88Å; F181-V195 HydrophobicContact CD2-CB 4.27Å; F181-V195 HydrophobicContact CD2-CG1 4.05Å; F181-V195 HydrophobicContact CD2-CG2 4.12Å; F181-V195 HydrophobicContact CE1-CB 4.1Å; F181-V195 HydrophobicContact CE1-CG1 4Å; F181-V195 HydrophobicContact CE2-CB 3.92Å; F181-V195 HydrophobicContact CE2-CG1 4.19Å; F181-V195 HydrophobicContact CE2-CG2 3.82Å; F181-V195 HydrophobicContact CG-CG1 3.9Å; F181-V195 HydrophobicContact CZ-CB 3.83Å; F181-V195 HydrophobicContact CZ-CG1 4.16Å; F181-V195 HydrophobicContact CZ-CG2 4.22Å; M193-V195 HydrophobicContact CB-CG1 4.43Å; M193-V195 HydrophobicContact CE-CG1 4.25Å
196	E	98.7	Very high	96.2	Very high	1 Å²	1	36.4 Å²	36.4	1%	0.005	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.6	149.5	165.4	-178.3	61.9	-82.5	0	0	109.9	A47 G49 M50 E51 I78 E115 Y198	A47-E196 HydrophobicContact CB-CG 4.2Å; G49-E196 PolarHBondContact N-OE1 2.94Å; M50-E196 HydrophobicContact CB-CB 4.4Å; M50-E196 WeakPolarHBondContact CB-OE1 3.48Å; M50-E196 WeakPolarHBondContact CG-OE1 3.43Å; M50-E196 PolarHBondContact N-OE1 2.81Å; M50-E196 PolarHBondContact N-OE2 3.09Å; M50-E196 VanDerWaalsContact N-OE2 3.07Å; E51-E196 PolarHBondContact N-OE2 2.78Å; I78-E196 HydrophobicContact CB-CB 3.91Å; I78-E196 HydrophobicContact CG1-CB 4.47Å; I78-E196 HydrophobicContact CG2-CB 3.56Å; I78-E196 HydrophobicContact CG2-CG 4.15Å; E115-E196 HydrophobicContact CB-CB 4.3Å; E115-E196 PolarHBondContact N-O 3.25Å; E115-E196 PolarHBondContact O-N 2.9Å; E196-Y198 HydrophobicContact CB-CE2 4.14Å; E196-Y198 HydrophobicContact CG-CD2 4.36Å; E196-Y198 HydrophobicContact CG-CE1 4.5Å; E196-Y198 HydrophobicContact CG-CE2 3.74Å
197	L	98.7	Very high	96.2	Very high	0 Å²	0	31.4 Å²	31.4	0%	0	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113	140.3	175.9	-65.2	166.6	0	0	0	108.6	L48 V103 L105 I111 V114 V179 F181	L48-L197 HydrophobicContact CB-CB 4.21Å; L48-L197 HydrophobicContact CD1-CB 3.78Å; L48-L197 HydrophobicContact CG-CB 4.14Å; L48-L197 PolarHBondContact N-O 2.83Å; V103-L197 HydrophobicContact CB-CD1 4Å; V103-L197 HydrophobicContact CG1-CD1 3.79Å; V103-L197 HydrophobicContact CG2-CD1 4.36Å; L105-L197 HydrophobicContact CD1-CD1 4.44Å; L105-L197 HydrophobicContact CD2-CD1 4.09Å; I111-L197 HydrophobicContact CG2-CD2 4.18Å; V114-L197 HydrophobicContact CG1-CD2 3.91Å; V179-L197 HydrophobicContact CB-CD1 4.36Å; V179-L197 HydrophobicContact CB-CD2 4.42Å; V179-L197 HydrophobicContact CG1-CD2 4.12Å; V179-L197 HydrophobicContact CG2-CD1 4.23Å; V179-L197 HydrophobicContact CG2-CD2 4.38Å; F181-L197 HydrophobicContact CE2-CD2 3.86Å; F181-L197 HydrophobicContact CE2-CG 4.37Å; F181-L197 HydrophobicContact CZ-CD2 3.71Å; F181-L197 HydrophobicContact CZ-CG 4.41Å
198	Y	98.6	Very high	96.2	Very high	23 Å²	23	25.1 Å²	25.1	9%	0.09	12%	0.124	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	139.7	175	-61.5	-96.3	0	0	0	110.5	Q45 A46 A47 I111 T112 C113 E115 K167 E196	Q45-Y198 VanDerWaalsContact O-CD1 3.3Å; Q45-Y198 WeakPolarHBondContact O-CD1 3.37Å; A46-Y198 CarbonylContact O-C 3.59Å; A46-Y198 WeakPolarHBondContact O-CA 3.49Å; A47-Y198 HydrophobicContact CB-CD1 4.09Å; A47-Y198 HydrophobicContact CB-CE1 3.82Å; I111-Y198 CarbonylContact C-O 3.52Å; I111-Y198 WeakPolarHBondContact CA-O 3.38Å; T112-Y198 PolarHBondContact N-O 2.9Å; T112-Y198 PolarHBondContact OG1-O 2.97Å; C113-Y198 HydrophobicContact CB-CD2 3.99Å; C113-Y198 HydrophobicContact CB-CG 4.17Å; C113-Y198 PolarHBondContact N-O 2.85Å; C113-Y198 PolarHBondContact O-N 2.98Å; E115-Y198 HydrophobicContact CB-CE2 3.7Å; E115-Y198 PolarHBondContact OE2-OH 3.46Å; K167-Y198 HydrophobicContact CD-CD2 4.31Å; K167-Y198 HydrophobicContact CD-CE2 3.95Å; K167-Y198 HydrophobicContact CG-CE2 4.35Å; K167-Y198 VanDerWaalsContact NZ-CD1 3.34Å; E196-Y198 HydrophobicContact CB-CE2 4.14Å; E196-Y198 HydrophobicContact CG-CD2 4.36Å; E196-Y198 HydrophobicContact CG-CE1 4.5Å; E196-Y198 HydrophobicContact CG-CE2 3.74Å
199	G	98	Very high	96.3	Very high	1 Å²	1	20.9 Å²	20.9	1%	0.01	10%	0.102	C	C	.	.	E	Extended strand (participates in β ladder)	trans	167	-154.3	-174.4	0	0	0	0	0	113.4	C44 A46 V110	C44-G199 WeakPolarHBondContact O-CA 3.35Å; C44-G199 VanDerWaalsContact SG-C 3.57Å; A46-G199 PolarHBondContact N-O 2.99Å; A46-G199 PolarHBondContact O-N 3.4Å; V110-G199 CarbonylContact O-C 3.44Å; V110-G199 WeakPolarHBondContact O-CA 2.98Å
200	C	96.4	Very high	96.3	Very high	38 Å²	38	17.9 Å²	17.9	26%	0.257	9%	0.093	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-153	164	177.2	60.8	0	0	0	0	109.9	C44 H109 V110	C44-C200 HydrophobicContact CB-CB 3.94Å; C44-C200 WeakPolarHBondContact CB-SG 3.34Å; C44-C200 WeakPolarHBondContact SG-CB 3.49Å; C44-C200 PolarHBondContact SG-N 3.45Å; C44-C200 CovalentContact SG-SG 2.04Å; C44-C200 PolarHBondContact SG-SG 3.24Å; H109-C200 CarbonylContact C-O 2.91Å; H109-C200 VanDerWaalsContact CA-O 3.23Å; H109-C200 WeakPolarHBondContact CA-O 3.18Å; H109-C200 VanDerWaalsContact CB-O 3.3Å; H109-C200 WeakPolarHBondContact CB-O 3.27Å; H109-C200 PolarHBondContact CD2-O 3.33Å; V110-C200 PolarHBondContact N-O 2.89Å; V110-C200 PolarHBondContact O-N 3.42Å; V110-C200 VanDerWaalsContact O-N 3.08Å
201	E	95.2	Very high	96.4	Very high	77 Å²	77	14.8 Å²	14.8	36%	0.36	7%	0.074	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-65.1	137.7	173.5	-172.3	171.4	-178.3	0	0	110.4	R107 K203	R107-E201 WeakPolarHBondContact CD-OE1 3.08Å; R107-E201 IonicContact CZ-OE1 3.45Å; R107-E201 IonicContact NE-OE1 3.86Å; R107-E201 IonicContact NH1-OE1 3.14Å; R107-E201 PolarHBondContact NH1-OE1 3.07Å; R107-E201 IonicContact NH1-OE2 2.97Å; E201-K203 HydrophobicContact CB-CG 4.47Å; E201-K203 PolarHBondContact O-N 2.8Å; E201-K203 VanDerWaalsContact O-N 3.09Å
202	H	94	Very high	96.4	Very high	14 Å²	14	15.6 Å²	15.6	7%	0.065	8%	0.079	C	C	.	.			trans	-82.8	85.6	-178.9	-176.3	47.6	0	0	0	111	V108 V110 G205 L206	V108-H202 HydrophobicContact CB-CB 4.15Å; V108-H202 HydrophobicContact CG1-CB 3.78Å; V108-H202 WeakPolarHBondContact O-CB 3.06Å; V108-H202 PolarHBondContact O-N 3.49Å; V110-H202 HydrophobicContact CG2-CB 3.96Å; H202-G205 PolarHBondContact O-N 3.26Å; H202-L206 PolarHBondContact NE2-N 2.95Å; H202-L206 PolarHBondContact NE2-O 2.82Å
203	K	90.6	Very high	96.3	Very high	94 Å²	94	16.8 Å²	16.8	41%	0.409	9%	0.088	S	C	.	.	T	Hydrogen-bonded Turn	trans	-78.3	-23.2	-171.4	-58.8	-165.5	177.9	-171.5	0	114.8	E37 E201 G205 R287	E37-K203 HydrophobicContact CB-CD 4.31Å; E37-K203 IonicContact OE1-NZ 3.66Å; E37-K203 PolarHBondContact OE1-NZ 3.31Å; E37-K203 WeakPolarHBondContact OE2-CD 3.33Å; E37-K203 WeakPolarHBondContact OE2-CE 3.45Å; E37-K203 IonicContact OE2-NZ 2.75Å; E37-K203 PolarHBondContact OE2-NZ 2.85Å; E201-K203 HydrophobicContact CB-CG 4.47Å; E201-K203 PolarHBondContact O-N 2.8Å; E201-K203 VanDerWaalsContact O-N 3.09Å; K203-G205 PolarHBondContact O-N 2.95Å; K203-R287 VanDerWaalsContact O-CZ 3.25Å; K203-R287 PolarHBondContact O-NH1 2.93Å; K203-R287 PolarHBondContact O-NH2 3.12Å
204	E	89.6	Confident	96.3	Very high	20 Å²	20	17.1 Å²	17.1	9%	0.093	9%	0.091	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68.2	-21.5	176.1	-63.3	-179.1	-171.3	0	0	112.2	L39 L206 M245 F283 R287	L39-E204 WeakPolarHBondContact CB-OE1 3.44Å; L39-E204 PolarHBondContact N-OE1 2.86Å; E204-L206 PolarHBondContact O-N 2.89Å; E204-L206 VanDerWaalsContact O-N 3.07Å; E204-M245 WeakPolarHBondContact OE2-CE 3.23Å; E204-F283 WeakPolarHBondContact O-CD1 3.21Å; E204-F283 WeakPolarHBondContact O-CE1 3.13Å; E204-R287 PolarHBondContact O-NH1 3.43Å
205	G	93.2	Very high	96.1	Very high	0 Å²	0	18.3 Å²	18.3	0%	0	10%	0.097	C	C	.	.			trans	70	1.4	172.2	0	0	0	0	0	116	H202 K203 L207 F283 D284 R287	H202-G205 PolarHBondContact O-N 3.26Å; K203-G205 PolarHBondContact O-N 2.95Å; G205-L207 PolarHBondContact O-N 3.45Å; G205-F283 CarbonylContact O-C 3.59Å; G205-F283 WeakPolarHBondContact O-CA 3.3Å; G205-D284 VanDerWaalsContact CA-CG 3.43Å; G205-D284 WeakPolarHBondContact CA-OD1 3.37Å; G205-D284 WeakPolarHBondContact CA-OD2 3.3Å; G205-D284 WeakPolarHBondContact O-CB 3.23Å; G205-D284 PolarHBondContact O-N 2.95Å; G205-R287 VanDerWaalsContact CA-NH2 3.31Å
206	L	95.5	Very high	95.8	Very high	1 Å²	1	25 Å²	25	1%	0.005	13%	0.126	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-65.2	125.1	176.8	-173.4	75	0	0	0	110.7	H202 E204 Y209 L241 M245 F281 L282 F283	H202-L206 PolarHBondContact NE2-N 2.95Å; H202-L206 PolarHBondContact NE2-O 2.82Å; E204-L206 PolarHBondContact O-N 2.89Å; E204-L206 VanDerWaalsContact O-N 3.07Å; L206-Y209 HydrophobicContact CD2-CD1 4.31Å; L206-L241 HydrophobicContact CD2-CD2 3.68Å; L206-L241 HydrophobicContact CG-CD2 3.96Å; L206-M245 HydrophobicContact CB-CE 4.31Å; L206-M245 HydrophobicContact CD2-CB 4.31Å; L206-M245 HydrophobicContact CD2-CE 3.5Å; L206-M245 HydrophobicContact CD2-CG 3.38Å; L206-M245 HydrophobicContact CD2-SD 3.44Å; L206-M245 WeakPolarHBondContact CD2-SD 3.4Å; L206-F281 HydrophobicContact CD1-CB 3.74Å; L206-F281 HydrophobicContact CD1-CD1 3.83Å; L206-F281 HydrophobicContact CD1-CG 4.28Å; L206-F281 HydrophobicContact CD2-CD1 4.11Å; L206-L282 WeakPolarHBondContact CD1-O 3.47Å; L206-F283 HydrophobicContact CB-CD1 4.26Å; L206-F283 HydrophobicContact CB-CE1 4.01Å; L206-F283 HydrophobicContact CD1-CD1 4.35Å; L206-F283 HydrophobicContact CD1-CD2 4.24Å; L206-F283 HydrophobicContact CD1-CE1 4.02Å; L206-F283 HydrophobicContact CD1-CE2 3.88Å; L206-F283 HydrophobicContact CD1-CG 4.47Å; L206-F283 HydrophobicContact CD1-CZ 3.76Å
207	L	95.8	Very high	95.5	Very high	8 Å²	8	29.5 Å²	29.5	4%	0.042	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.6	-32.2	-179.9	-66.1	-178.1	0	0	0	113.3	V108 R138 P139 G205 L282 D284	V108-L207 HydrophobicContact CG2-CD2 4.23Å; R138-L207 PolarHBondContact NE-O 3.33Å; P139-L207 HydrophobicContact CB-CD1 4.31Å; G205-L207 PolarHBondContact O-N 3.45Å; L207-L282 HydrophobicContact CB-CG 4.43Å; L207-L282 PolarHBondContact N-O 3.18Å; L207-D284 HydrophobicContact CD1-CB 4.05Å; L207-D284 HydrophobicContact CD2-CB 4.26Å; L207-D284 HydrophobicContact CG-CB 4.05Å
208	A	96.8	Very high	95	Very high	9 Å²	9	30.6 Å²	30.6	7%	0.074	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-162.2	152.8	178.5	0	0	0	0	0	111.6	G240 L282	A208-G240 CarbonylContact C-O 3.3Å; A208-G240 VanDerWaalsContact CA-O 3.23Å; A208-G240 WeakPolarHBondContact CA-O 3.41Å; A208-L282 PolarHBondContact N-O 3.36Å; A208-L282 PolarHBondContact O-N 2.88Å
209	Y	97.6	Very high	94.4	Very high	0 Å²	0	32.4 Å²	32.4	0%	0	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	169.5	159.2	59.4	-101.8	0	0	0	111.6	L206 M211 D224 Y227 G239 G240 L241 G242 Q243 L244 M245 Y280 F281	L206-Y209 HydrophobicContact CD2-CD1 4.31Å; Y209-M211 HydrophobicContact CD2-CG 4.34Å; Y209-M211 HydrophobicContact CD2-SD 4.12Å; Y209-M211 HydrophobicContact CE2-CE 3.71Å; Y209-M211 HydrophobicContact CE2-CG 4.37Å; Y209-M211 HydrophobicContact CE2-SD 3.81Å; Y209-D224 PolarHBondContact OH-OD2 2.86Å; Y209-Y227 AromaticContact CD2-CE2 3.84Å; Y209-Y227 HydrophobicContact CD2-CE2 3.84Å; Y209-Y227 AromaticContact CE2-CD2 3.69Å; Y209-Y227 HydrophobicContact CE2-CD2 3.69Å; Y209-Y227 AromaticContact CE2-CE2 3.41Å; Y209-Y227 HydrophobicContact CE2-CE2 3.41Å; Y209-Y227 VanDerWaalsContact CE2-CE2 3.41Å; Y209-Y227 AromaticContact CZ-CD2 3.93Å; Y209-Y227 AromaticContact CZ-CE2 3.94Å; Y209-Y227 PolarHBondContact O-OH 3.02Å; Y209-G239 PolarHBondContact O-N 3.08Å; Y209-G240 PolarHBondContact N-O 3.3Å; Y209-L241 HydrophobicContact CD1-CD2 3.84Å; Y209-L241 HydrophobicContact CE1-CD2 4.14Å; Y209-G242 WeakPolarHBondContact OH-CA 3.49Å; Y209-G242 PolarHBondContact OH-N 3.29Å; Y209-Q243 PolarHBondContact OH-N 3.5Å; Y209-L244 HydrophobicContact CE1-CB 4.1Å; Y209-L244 HydrophobicContact CE2-CD1 4.37Å; Y209-L244 PolarHBondContact OH-N 3.17Å; Y209-M245 HydrophobicContact CD1-CG 3.93Å; Y209-M245 HydrophobicContact CE1-CB 4.33Å; Y209-M245 HydrophobicContact CE1-CG 3.81Å; Y209-Y280 CarbonylContact C-O 3.59Å; Y209-Y280 VanDerWaalsContact C-O 3.3Å; Y209-Y280 WeakPolarHBondContact CA-O 3.07Å; Y209-Y280 WeakPolarHBondContact CB-O 3.13Å; Y209-F281 HydrophobicContact CD1-CE1 4.4Å; Y209-F281 HydrophobicContact CG-CD1 4.48Å; Y209-F281 HydrophobicContact CG-CE1 4.25Å
210	S	97.8	Very high	94.1	Very high	13 Å²	13	33.3 Å²	33.3	9%	0.091	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.4	139.5	172.9	-56.7	0	0	0	0	109.1	L237 T238 F279 Y280	S210-L237 CarbonylContact C-O 3.6Å; S210-L237 WeakPolarHBondContact CA-O 2.99Å; S210-L237 VanDerWaalsContact CB-O 3.25Å; S210-L237 WeakPolarHBondContact CB-O 3.4Å; S210-T238 WeakPolarHBondContact OG-CA 3.37Å; S210-T238 PolarHBondContact OG-OG1 2.94Å; S210-T238 VanDerWaalsContact OG-OG1 3.07Å; S210-F279 WeakPolarHBondContact O-CA 3.44Å; S210-Y280 PolarHBondContact N-O 3.01Å; S210-Y280 PolarHBondContact O-N 3.47Å
211	M	97.9	Very high	93.9	Very high	0 Å²	0	35 Å²	35	0%	0	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-160.3	162.2	-175.3	63.9	-175.5	-173.2	0	0	111.7	Y209 D224 L237 L244 V270 W272 F279	Y209-M211 HydrophobicContact CD2-CG 4.34Å; Y209-M211 HydrophobicContact CD2-SD 4.12Å; Y209-M211 HydrophobicContact CE2-CE 3.71Å; Y209-M211 HydrophobicContact CE2-CG 4.37Å; Y209-M211 HydrophobicContact CE2-SD 3.81Å; M211-D224 HydrophobicContact CE-CB 3.49Å; M211-D224 VanDerWaalsContact CE-CB 3.49Å; M211-D224 WeakPolarHBondContact CE-OD2 3.37Å; M211-L237 HydrophobicContact CE-CD1 3.72Å; M211-L237 HydrophobicContact CG-CB 4.24Å; M211-L237 HydrophobicContact CG-CD1 4.27Å; M211-L237 PolarHBondContact N-O 3.34Å; M211-L237 WeakPolarHBondContact O-CB 3.43Å; M211-L237 PolarHBondContact O-N 3.11Å; M211-L244 HydrophobicContact CE-CD1 4.03Å; M211-L244 HydrophobicContact CE-CG 4.37Å; M211-L244 HydrophobicContact SD-CD1 3.37Å; M211-L244 WeakPolarHBondContact SD-CD1 3.03Å; M211-L244 HydrophobicContact SD-CG 4.31Å; M211-V270 HydrophobicContact CE-CG1 4.01Å; M211-W272 HydrophobicContact CE-CZ2 4.24Å; M211-W272 HydrophobicContact CG-CZ2 4.47Å; M211-W272 HydrophobicContact SD-CH2 4.06Å; M211-W272 HydrophobicContact SD-CZ2 3.7Å; M211-F279 HydrophobicContact CB-CD1 3.73Å; M211-F279 HydrophobicContact CB-CE1 4.07Å; M211-F279 HydrophobicContact SD-CD1 4.08Å; M211-F279 HydrophobicContact SD-CE1 3.88Å
212	P	97.5	Very high	93.9	Very high	19 Å²	19	31.3 Å²	31.3	12%	0.123	17%	0.171	C	C	.	.	P	Polyproline II helix	trans	-58.9	146.2	165.9	-20.2	31.7	0	0	0	111.3	G214 F236 W272 V277 E278	P212-G214 PolarHBondContact O-N 2.94Å; P212-F236 HydrophobicContact CG-CD2 4.47Å; P212-F236 HydrophobicContact CG-CE2 4.36Å; P212-W272 PolarHBondContact O-NE1 3.45Å; P212-V277 HydrophobicContact CG-CG1 4.33Å; P212-E278 VanDerWaalsContact CD-O 3.28Å; P212-E278 WeakPolarHBondContact CD-O 3.32Å
213	S	96.6	Very high	93.9	Very high	26 Å²	26	31.8 Å²	31.8	18%	0.182	17%	0.174	C	C	.	.	P	Polyproline II helix	trans	-48.9	143.7	168	-170.3	0	0	0	0	111.2	D223 R231 G235 W272	S213-D223 PolarHBondContact OG-OD1 2.93Å; S213-R231 PolarHBondContact OG-NH1 2.85Å; S213-G235 VanDerWaalsContact CB-O 3.28Å; S213-G235 WeakPolarHBondContact CB-O 3.47Å; S213-G235 PolarHBondContact N-O 2.95Å; S213-W272 VanDerWaalsContact O-CD1 3.24Å; S213-W272 PolarHBondContact O-NE1 3.42Å
214	G	96.1	Very high	94.1	Very high	6 Å²	6	27.5 Å²	27.5	6%	0.062	16%	0.155	C	C	.	.	P	Polyproline II helix	trans	-64.1	160	165.2	0	0	0	0	0	112	P212 F222 D223 G271	P212-G214 PolarHBondContact O-N 2.94Å; G214-F222 WeakPolarHBondContact CA-O 3.21Å; G214-D223 PolarHBondContact N-OD1 3.09Å; G214-G271 CarbonylContact C-O 3.58Å; G214-G271 WeakPolarHBondContact CA-O 3.26Å
215	E	94.8	Very high	94.2	Very high	35 Å²	35	30.3 Å²	30.3	16%	0.164	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	152.7	-166.6	-67.5	177.1	-176.6	0	0	112.6	F222 G271 T273 K274	E215-F222 PolarHBondContact O-N 3.04Å; E215-G271 PolarHBondContact N-O 2.84Å; E215-T273 PolarHBondContact OE2-N 2.96Å; E215-T273 PolarHBondContact OE2-OG1 2.85Å; E215-K274 WeakPolarHBondContact OE1-CD 3.49Å; E215-K274 WeakPolarHBondContact OE1-CE 3.35Å; E215-K274 VanDerWaalsContact OE1-CG 3.27Å; E215-K274 WeakPolarHBondContact OE1-CG 3.36Å; E215-K274 IonicContact OE1-NZ 2.69Å; E215-K274 PolarHBondContact OE1-NZ 2.67Å
216	F	92.8	Very high	94.2	Very high	141 Å²	141	31 Å²	31	62%	0.618	17%	0.17	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-80.5	124.2	170.3	-170	-94.5	0	0	0	109.6	G219 H220 L221	F216-G219 WeakPolarHBondContact CZ-O 3.35Å; F216-H220 CarbonylContact C-O 3.52Å; F216-H220 WeakPolarHBondContact CA-O 3.25Å; F216-H220 WeakPolarHBondContact CD2-O 3.41Å; F216-L221 HydrophobicContact CB-CD1 4.34Å; F216-L221 HydrophobicContact CD2-CB 4.09Å
217	Y	91.4	Very high	94.2	Very high	95 Å²	95	32.4 Å²	32.4	37%	0.373	18%	0.175	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.5	136.2	179.9	-173.3	-89.5	0	0	0	110.1	G219 H220 L255 T273 L361	Y217-G219 VanDerWaalsContact C-N 3.27Å; Y217-G219 PolarHBondContact O-N 3.1Å; Y217-G219 VanDerWaalsContact O-N 3.17Å; Y217-H220 PolarHBondContact N-O 3.14Å; Y217-H220 PolarHBondContact O-N 2.95Å; Y217-H220 VanDerWaalsContact O-O 3.06Å; Y217-L255 HydrophobicContact CE1-CD1 4.12Å; Y217-T273 HydrophobicContact CD2-CG2 3.58Å; Y217-T273 HydrophobicContact CE2-CG2 3.92Å; Y217-L361 HydrophobicContact CD1-CB 4.46Å; Y217-L361 HydrophobicContact CD1-CD1 4.24Å; Y217-L361 HydrophobicContact CD1-CD2 3.54Å; Y217-L361 HydrophobicContact CD1-CG 4.29Å; Y217-L361 HydrophobicContact CD2-CD1 4.16Å; Y217-L361 HydrophobicContact CE1-CB 4.28Å; Y217-L361 HydrophobicContact CE1-CD2 3.93Å; Y217-L361 HydrophobicContact CG-CD1 3.85Å; Y217-L361 HydrophobicContact CG-CD2 4.03Å; Y217-L361 HydrophobicContact CG-CG 4.39Å
218	A	88	Confident	94.1	Very high	23 Å²	23	33.1 Å²	33.1	19%	0.19	18%	0.179	C	C	.	.	T	Hydrogen-bonded Turn	trans	50.1	43.2	175.3	0	0	0	0	0	114.3	H220 L255 G258	A218-H220 VanDerWaalsContact C-N 3.28Å; A218-H220 PolarHBondContact O-N 2.85Å; A218-L255 HydrophobicContact CB-CD2 3.89Å; A218-G258 CarbonylContact C-O 3.54Å; A218-G258 VanDerWaalsContact CA-O 3.25Å; A218-G258 WeakPolarHBondContact CA-O 3.41Å; A218-G258 WeakPolarHBondContact CB-O 3.48Å; A218-G258 VanDerWaalsContact O-O 3.05Å
219	G	87.7	Confident	94	Very high	60 Å²	60	33.7 Å²	33.7	62%	0.619	19%	0.186	S	C	*	.	T	Hydrogen-bonded Turn	trans	80.8	-0.5	178.1	0	0	0	0	0	115.3	F216 Y217	F216-G219 WeakPolarHBondContact CZ-O 3.35Å; Y217-G219 VanDerWaalsContact C-N 3.27Å; Y217-G219 PolarHBondContact O-N 3.1Å; Y217-G219 VanDerWaalsContact O-N 3.17Å
220	H	91.1	Very high	93.8	Very high	21 Å²	21	37.4 Å²	37.4	10%	0.097	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	144.6	-176.6	-167	-88	0	0	0	111.9	F216 Y217 A218 F222 V260	F216-H220 CarbonylContact C-O 3.52Å; F216-H220 WeakPolarHBondContact CA-O 3.25Å; F216-H220 WeakPolarHBondContact CD2-O 3.41Å; Y217-H220 PolarHBondContact N-O 3.14Å; Y217-H220 PolarHBondContact O-N 2.95Å; Y217-H220 VanDerWaalsContact O-O 3.06Å; A218-H220 VanDerWaalsContact C-N 3.28Å; A218-H220 PolarHBondContact O-N 2.85Å; H220-F222 HydrophobicContact CB-CE2 4.03Å; H220-F222 HydrophobicContact CB-CZ 4.11Å; H220-F222 AromaticContact ND1-CD1 3.8Å; H220-F222 AromaticContact ND1-CE1 3.68Å; H220-F222 AromaticContact ND1-CZ 3.84Å; H220-V260 HydrophobicContact CB-CB 4.49Å; H220-V260 HydrophobicContact CB-CG2 3.61Å
221	L	92.8	Very high	93.7	Very high	72 Å²	72	41.9 Å²	41.9	38%	0.377	23%	0.227	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.4	111.4	174.7	179.8	62.4	0	0	0	109.8	F216 D223	F216-L221 HydrophobicContact CB-CD1 4.34Å; F216-L221 HydrophobicContact CD2-CB 4.09Å; L221-D223 VanDerWaalsContact C-N 3.31Å; L221-D223 HydrophobicContact CD1-CB 3.94Å; L221-D223 HydrophobicContact CD2-CB 4.01Å; L221-D223 HydrophobicContact CG-CB 3.68Å; L221-D223 PolarHBondContact O-N 2.93Å
222	F	95	Very high	93.5	Very high	1 Å²	1	45.3 Å²	45.3	0%	0.004	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.4	59.3	177.3	-63.9	-78.9	0	0	0	110.8	G214 E215 H220 F253 V260 A266 W269 V270 G271 L361 L363	G214-F222 WeakPolarHBondContact CA-O 3.21Å; E215-F222 PolarHBondContact O-N 3.04Å; H220-F222 HydrophobicContact CB-CE2 4.03Å; H220-F222 HydrophobicContact CB-CZ 4.11Å; H220-F222 AromaticContact ND1-CD1 3.8Å; H220-F222 AromaticContact ND1-CE1 3.68Å; H220-F222 AromaticContact ND1-CZ 3.84Å; F222-F253 HydrophobicContact CE1-CE1 4.1Å; F222-F253 HydrophobicContact CE1-CE2 4.26Å; F222-F253 AromaticContact CE1-CZ 3.48Å; F222-F253 HydrophobicContact CE1-CZ 3.48Å; F222-F253 VanDerWaalsContact CE1-CZ 3.48Å; F222-F253 HydrophobicContact CZ-CE2 4.05Å; F222-F253 AromaticContact CZ-CZ 3.67Å; F222-F253 HydrophobicContact CZ-CZ 3.67Å; F222-V260 HydrophobicContact CZ-CG2 4.02Å; F222-A266 HydrophobicContact CE1-CB 3.91Å; F222-A266 HydrophobicContact CZ-CB 4.44Å; F222-W269 HydrophobicContact CD1-CB 4.1Å; F222-W269 HydrophobicContact CE1-CB 4.48Å; F222-V270 WeakPolarHBondContact O-CA 3.44Å; F222-G271 PolarHBondContact O-N 2.99Å; F222-L361 HydrophobicContact CD2-CD2 4.44Å; F222-L361 HydrophobicContact CE2-CD2 4.06Å; F222-L361 HydrophobicContact CZ-CD2 4.41Å; F222-L363 HydrophobicContact CB-CD2 4.25Å; F222-L363 HydrophobicContact CD1-CD2 3.58Å; F222-L363 HydrophobicContact CD2-CD2 4.3Å; F222-L363 HydrophobicContact CE1-CD1 4.48Å; F222-L363 HydrophobicContact CE1-CD2 3.92Å; F222-L363 HydrophobicContact CG-CD2 3.79Å; F222-L363 HydrophobicContact CZ-CD2 4.41Å
223	D	94.3	Very high	93.4	Very high	24 Å²	24	50.9 Å²	50.9	13%	0.128	29%	0.285	C	S	.	.			trans	-105.1	156.2	-178	-170.3	33.8	0	0	0	111.3	S213 G214 L221 R225 R231 Q243	S213-D223 PolarHBondContact OG-OD1 2.93Å; G214-D223 PolarHBondContact N-OD1 3.09Å; L221-D223 VanDerWaalsContact C-N 3.31Å; L221-D223 HydrophobicContact CD1-CB 3.94Å; L221-D223 HydrophobicContact CD2-CB 4.01Å; L221-D223 HydrophobicContact CG-CB 3.68Å; L221-D223 PolarHBondContact O-N 2.93Å; D223-R225 PolarHBondContact O-N 3.42Å; D223-R225 VanDerWaalsContact O-N 3.08Å; D223-R231 IonicContact OD1-CZ 3.66Å; D223-R231 IonicContact OD1-NH1 2.78Å; D223-R231 IonicContact OD1-NH2 2.88Å; D223-R231 PolarHBondContact OD1-NH2 3.28Å; D223-R231 IonicContact OD2-CZ 3.76Å; D223-R231 IonicContact OD2-NH2 2.76Å; D223-R231 PolarHBondContact OD2-NH2 2.75Å; D223-Q243 PolarHBondContact O-OE1 2.99Å; D223-Q243 VanDerWaalsContact O-OE1 3.06Å
224	D	95.1	Very high	93.3	Very high	4 Å²	4	54.3 Å²	54.3	2%	0.021	31%	0.309	C	S	.	.			trans	-78.4	92.1	178.5	-172.2	-13.9	0	0	0	110.2	Y209 M211 Y227 L237 G242 Q243 V270	Y209-D224 PolarHBondContact OH-OD2 2.86Å; M211-D224 HydrophobicContact CE-CB 3.49Å; M211-D224 VanDerWaalsContact CE-CB 3.49Å; M211-D224 WeakPolarHBondContact CE-OD2 3.37Å; D224-Y227 WeakPolarHBondContact O-CB 3.19Å; D224-Y227 PolarHBondContact O-N 2.69Å; D224-Y227 PolarHBondContact OD1-N 2.91Å; D224-Y227 WeakPolarHBondContact OD2-CD2 3.09Å; D224-L237 HydrophobicContact CB-CD1 4.07Å; D224-G242 WeakPolarHBondContact OD1-CA 3.06Å; D224-Q243 WeakPolarHBondContact OD1-CG 3.44Å; D224-Q243 PolarHBondContact OD1-N 3.08Å; D224-V270 HydrophobicContact CB-CG1 4.3Å; D224-V270 HydrophobicContact CB-CG2 4.02Å
225	R	91.7	Very high	93.2	Very high	79 Å²	79	54.8 Å²	54.8	30%	0.298	31%	0.314	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.4	-25.7	-171.1	-62	-172.7	179.8	-173.8	6.8	113.4	Q152 D223 E267	Q152-R225 PolarHBondContact NE2-O 2.87Å; D223-R225 PolarHBondContact O-N 3.42Å; D223-R225 VanDerWaalsContact O-N 3.08Å; R225-E267 IonicContact CZ-OE1 3.38Å; R225-E267 IonicContact NH1-OE1 3.84Å; R225-E267 PolarHBondContact NH1-OE1 3.07Å; R225-E267 IonicContact NH1-OE2 2.74Å; R225-E267 IonicContact NH2-OE1 3.87Å
226	S	92.7	Very high	93.3	Very high	15 Å²	15	56.5 Å²	56.5	11%	0.105	32%	0.321	C	S	.	.	T	Hydrogen-bonded Turn	trans	-93.3	1.5	179.6	69.1	0	0	0	0	112.8	D228 G242 Q243	S226-D228 PolarHBondContact O-N 2.75Å; S226-D228 VanDerWaalsContact O-N 3.13Å; S226-G242 WeakPolarHBondContact OG-CA 3.17Å; S226-Q243 WeakPolarHBondContact OG-CG 3.28Å; S226-Q243 PolarHBondContact OG-N 3.31Å; S226-Q243 VanDerWaalsContact OG-N 3.07Å
227	Y	94.7	Very high	93.5	Very high	29 Å²	29	49.9 Å²	49.9	11%	0.114	29%	0.292	C	S	.	.			trans	-57.4	115.7	-178.7	-165.2	-108.8	0	0	0	112.8	Y209 D224 G229 L237 T238 G239 G240 L241	Y209-Y227 AromaticContact CD2-CE2 3.84Å; Y209-Y227 HydrophobicContact CD2-CE2 3.84Å; Y209-Y227 AromaticContact CE2-CD2 3.69Å; Y209-Y227 HydrophobicContact CE2-CD2 3.69Å; Y209-Y227 AromaticContact CE2-CE2 3.41Å; Y209-Y227 HydrophobicContact CE2-CE2 3.41Å; Y209-Y227 VanDerWaalsContact CE2-CE2 3.41Å; Y209-Y227 AromaticContact CZ-CD2 3.93Å; Y209-Y227 AromaticContact CZ-CE2 3.94Å; Y209-Y227 PolarHBondContact O-OH 3.02Å; D224-Y227 WeakPolarHBondContact O-CB 3.19Å; D224-Y227 PolarHBondContact O-N 2.69Å; D224-Y227 PolarHBondContact OD1-N 2.91Å; D224-Y227 WeakPolarHBondContact OD2-CD2 3.09Å; Y227-G229 VanDerWaalsContact C-N 3.31Å; Y227-L237 HydrophobicContact CD1-CB 4.05Å; Y227-L237 HydrophobicContact CD1-CD1 4.05Å; Y227-L237 HydrophobicContact CD1-CD2 3.61Å; Y227-L237 HydrophobicContact CD1-CG 4.11Å; Y227-L237 HydrophobicContact CD2-CD1 4.36Å; Y227-L237 HydrophobicContact CE1-CB 3.52Å; Y227-L237 HydrophobicContact CE1-CD1 4.36Å; Y227-L237 HydrophobicContact CE1-CD2 3.79Å; Y227-L237 HydrophobicContact CE1-CG 4.09Å; Y227-L237 HydrophobicContact CE2-CB 4.34Å; Y227-L237 HydrophobicContact CG-CD1 4.02Å; Y227-L237 HydrophobicContact CG-CD2 4.37Å; Y227-T238 WeakPolarHBondContact OH-CA 3.44Å; Y227-T238 PolarHBondContact OH-N 3.02Å; Y227-T238 PolarHBondContact OH-O 3.15Å; Y227-G239 PolarHBondContact OH-N 2.04Å; Y227-G240 VanDerWaalsContact CE2-C 3.5Å; Y227-G240 PolarHBondContact OH-N 3.42Å; Y227-G240 VanDerWaalsContact OH-N 3.07Å; Y227-L241 CarbonylContact C-O 3.52Å; Y227-L241 WeakPolarHBondContact CA-O 3.21Å
228	D	94	Very high	93.7	Very high	23 Å²	23	48.2 Å²	48.2	12%	0.123	29%	0.292	C	S	.	.			trans	-90.8	5.9	-178.1	78.1	-0.6	0	0	0	113.4	Y136 R138 R141 S226 G240 L241	Y136-D228 VanDerWaalsContact OH-CB 3.26Å; Y136-D228 WeakPolarHBondContact OH-CB 3.29Å; Y136-D228 PolarHBondContact OH-OD2 3.21Å; Y136-D228 VanDerWaalsContact OH-OD2 3.09Å; R138-D228 IonicContact CZ-OD1 2.8Å; R138-D228 IonicContact CZ-OD2 2.76Å; R138-D228 IonicContact NH1-OD2 3.81Å; R138-D228 PolarHBondContact NH1-OD2 2.97Å; R138-D228 IonicContact NH2-OD1 3.44Å; R138-D228 PolarHBondContact NH2-OD1 3.17Å; R138-D228 IonicContact NH2-OD2 2.89Å; R138-D228 PolarHBondContact NH2-OD2 3.05Å; R141-D228 VanDerWaalsContact CZ-O 3.22Å; R141-D228 IonicContact CZ-OD1 2.73Å; R141-D228 PolarHBondContact NH1-O 3.45Å; R141-D228 IonicContact NH1-OD1 3.64Å; R141-D228 PolarHBondContact NH1-OD1 3.44Å; R141-D228 IonicContact NH1-OD2 3.25Å; R141-D228 PolarHBondContact NH1-OD2 3.44Å; R141-D228 PolarHBondContact NH2-O 3.19Å; S226-D228 PolarHBondContact O-N 2.75Å; S226-D228 VanDerWaalsContact O-N 3.13Å; D228-G240 WeakPolarHBondContact OD1-CA 3.17Å; D228-L241 PolarHBondContact N-O 3.1Å; D228-L241 PolarHBondContact OD1-N 2.96Å
229	G	94.1	Very high	94	Very high	22 Å²	22	48.6 Å²	48.6	23%	0.227	30%	0.297	C	S	.	.	S	Bend	trans	-82.2	-167.6	-179.2	0	0	0	0	0	114.8	R141 Y227 G240	R141-G229 VanDerWaalsContact NH2-CA 3.33Å; Y227-G229 VanDerWaalsContact C-N 3.31Å; G229-G240 VanDerWaalsContact CA-CA 3.49Å
230	S	94.1	Very high	94.3	Very high	78 Å²	78	45.7 Å²	45.7	55%	0.545	27%	0.268	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.2	142	170.1	-66.4	0	0	0	0	110.7	T238	S230-T238 PolarHBondContact N-O 3.04Å; S230-T238 PolarHBondContact O-N 2.87Å
231	R	95	Very high	94.6	Very high	107 Å²	107	45.4 Å²	45.4	40%	0.404	27%	0.267	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108	121.3	170.7	-176.8	178	-65.9	-91.6	13.3	108.7	S213 D223 G235 F236 L237	S213-R231 PolarHBondContact OG-NH1 2.85Å; D223-R231 IonicContact OD1-CZ 3.66Å; D223-R231 IonicContact OD1-NH1 2.78Å; D223-R231 IonicContact OD1-NH2 2.88Å; D223-R231 PolarHBondContact OD1-NH2 3.28Å; D223-R231 IonicContact OD2-CZ 3.76Å; D223-R231 IonicContact OD2-NH2 2.76Å; D223-R231 PolarHBondContact OD2-NH2 2.75Å; R231-G235 PolarHBondContact NH1-O 2.9Å; R231-F236 WeakPolarHBondContact CA-O 3.49Å; R231-L237 HydrophobicContact CB-CD2 3.89Å; R231-L237 HydrophobicContact CG-CD2 4.01Å
232	N	94.6	Very high	94.6	Very high	71 Å²	71	42.2 Å²	42.2	38%	0.38	25%	0.252	S	S	.	.			trans	-80	178.6	177.7	78.4	-0.5	0	0	0	111.6	S234 G235 F236	N232-S234 PolarHBondContact ND2-OG 2.86Å; N232-S234 PolarHBondContact O-N 3.01Å; N232-S234 WeakPolarHBondContact OD1-CA 3.19Å; N232-S234 PolarHBondContact OD1-N 2.76Å; N232-S234 PolarHBondContact OD1-OG 2.83Å; N232-G235 PolarHBondContact O-N 3.3Å; N232-G235 PolarHBondContact OD1-N 3.37Å; N232-G235 VanDerWaalsContact OD1-N 3.08Å; N232-F236 PolarHBondContact N-O 3.07Å; N232-F236 WeakPolarHBondContact OD1-CA 3.3Å; N232-F236 WeakPolarHBondContact OD1-CB 3.22Å; N232-F236 PolarHBondContact OD1-N 2.83Å; N232-F236 PolarHBondContact OD1-O 3.42Å
233	S	95.7	Very high	94.6	Very high	137 Å²	137	42.4 Å²	42.4	96%	0.958	25%	0.253	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.4	-23.7	179.9	53.6	0	0	0	0	114.6	G235	S233-G235 VanDerWaalsContact C-N 3.27Å
234	S	93.9	Very high	94.7	Very high	98 Å²	98	41.3 Å²	41.3	69%	0.685	25%	0.247	S	C	*	.	T	Hydrogen-bonded Turn	trans	-86	1.7	173.7	68.7	0	0	0	0	113.1	N232 F236	N232-S234 PolarHBondContact ND2-OG 2.86Å; N232-S234 PolarHBondContact O-N 3.01Å; N232-S234 WeakPolarHBondContact OD1-CA 3.19Å; N232-S234 PolarHBondContact OD1-N 2.76Å; N232-S234 PolarHBondContact OD1-OG 2.83Å; S234-F236 VanDerWaalsContact C-N 3.27Å; S234-F236 PolarHBondContact O-N 3.49Å
235	G	93.8	Very high	94.7	Very high	15 Å²	15	42 Å²	42	16%	0.155	25%	0.25	C	S	.	.			trans	81.7	-2.8	-175.2	0	0	0	0	0	114.3	S213 R231 N232 S233 L237	S213-G235 VanDerWaalsContact CB-O 3.28Å; S213-G235 WeakPolarHBondContact CB-O 3.47Å; S213-G235 PolarHBondContact N-O 2.95Å; R231-G235 PolarHBondContact NH1-O 2.9Å; N232-G235 PolarHBondContact O-N 3.3Å; N232-G235 PolarHBondContact OD1-N 3.37Å; N232-G235 VanDerWaalsContact OD1-N 3.08Å; S233-G235 VanDerWaalsContact C-N 3.27Å; G235-L237 PolarHBondContact O-N 3.47Å
236	F	96.8	Very high	94.7	Very high	72 Å²	72	39 Å²	39	32%	0.316	24%	0.24	S	C	.	.			trans	-63.2	133.1	177.7	-168.3	-91.6	0	0	0	110.7	P212 R231 N232 S234	P212-F236 HydrophobicContact CG-CD2 4.47Å; P212-F236 HydrophobicContact CG-CE2 4.36Å; R231-F236 WeakPolarHBondContact CA-O 3.49Å; N232-F236 PolarHBondContact N-O 3.07Å; N232-F236 WeakPolarHBondContact OD1-CA 3.3Å; N232-F236 WeakPolarHBondContact OD1-CB 3.22Å; N232-F236 PolarHBondContact OD1-N 2.83Å; N232-F236 PolarHBondContact OD1-O 3.42Å; S234-F236 VanDerWaalsContact C-N 3.27Å; S234-F236 PolarHBondContact O-N 3.49Å
237	L	97.6	Very high	94.6	Very high	1 Å²	1	39.2 Å²	39.2	1%	0.005	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.3	131.3	-176.7	-66.2	-176.3	0	0	0	109.6	S210 M211 D224 Y227 R231 G235	S210-L237 CarbonylContact C-O 3.6Å; S210-L237 WeakPolarHBondContact CA-O 2.99Å; S210-L237 VanDerWaalsContact CB-O 3.25Å; S210-L237 WeakPolarHBondContact CB-O 3.4Å; M211-L237 HydrophobicContact CE-CD1 3.72Å; M211-L237 HydrophobicContact CG-CB 4.24Å; M211-L237 HydrophobicContact CG-CD1 4.27Å; M211-L237 PolarHBondContact N-O 3.34Å; M211-L237 WeakPolarHBondContact O-CB 3.43Å; M211-L237 PolarHBondContact O-N 3.11Å; D224-L237 HydrophobicContact CB-CD1 4.07Å; Y227-L237 HydrophobicContact CD1-CB 4.05Å; Y227-L237 HydrophobicContact CD1-CD1 4.05Å; Y227-L237 HydrophobicContact CD1-CD2 3.61Å; Y227-L237 HydrophobicContact CD1-CG 4.11Å; Y227-L237 HydrophobicContact CD2-CD1 4.36Å; Y227-L237 HydrophobicContact CE1-CB 3.52Å; Y227-L237 HydrophobicContact CE1-CD1 4.36Å; Y227-L237 HydrophobicContact CE1-CD2 3.79Å; Y227-L237 HydrophobicContact CE1-CG 4.09Å; Y227-L237 HydrophobicContact CE2-CB 4.34Å; Y227-L237 HydrophobicContact CG-CD1 4.02Å; Y227-L237 HydrophobicContact CG-CD2 4.37Å; R231-L237 HydrophobicContact CB-CD2 3.89Å; R231-L237 HydrophobicContact CG-CD2 4.01Å; G235-L237 PolarHBondContact O-N 3.47Å
238	T	96	Very high	94.4	Very high	61 Å²	61	42.8 Å²	42.8	37%	0.374	26%	0.258	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.5	147.2	-179.9	-170.7	0	0	0	0	114.5	S210 Y227 S230 G240	S210-T238 WeakPolarHBondContact OG-CA 3.37Å; S210-T238 PolarHBondContact OG-OG1 2.94Å; S210-T238 VanDerWaalsContact OG-OG1 3.07Å; Y227-T238 WeakPolarHBondContact OH-CA 3.44Å; Y227-T238 PolarHBondContact OH-N 3.02Å; Y227-T238 PolarHBondContact OH-O 3.15Å; S230-T238 PolarHBondContact N-O 3.04Å; S230-T238 PolarHBondContact O-N 2.87Å; T238-G240 PolarHBondContact O-N 3.24Å
239	G	93.7	Very high	94.3	Very high	30 Å²	30	44.8 Å²	44.8	31%	0.309	27%	0.271	S	S	.	.	E	Extended strand (participates in β ladder)	trans	67.2	32.4	171	0	0	0	0	0	114.8	R141 Y209 Y227	R141-G239 VanDerWaalsContact CZ-O 3.24Å; R141-G239 PolarHBondContact NE-O 3.42Å; R141-G239 VanDerWaalsContact NE-O 3.12Å; R141-G239 PolarHBondContact NH2-O 3Å; Y209-G239 PolarHBondContact O-N 3.08Å; Y227-G239 PolarHBondContact OH-N 2.04Å
240	G	94.8	Very high	94.2	Very high	0 Å²	0	44 Å²	44	0%	0	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.7	177.1	-178.9	0	0	0	0	0	114	A208 Y209 Y227 D228 G229 T238	A208-G240 CarbonylContact C-O 3.3Å; A208-G240 VanDerWaalsContact CA-O 3.23Å; A208-G240 WeakPolarHBondContact CA-O 3.41Å; Y209-G240 PolarHBondContact N-O 3.3Å; Y227-G240 VanDerWaalsContact CE2-C 3.5Å; Y227-G240 PolarHBondContact OH-N 3.42Å; Y227-G240 VanDerWaalsContact OH-N 3.07Å; D228-G240 WeakPolarHBondContact OD1-CA 3.17Å; G229-G240 VanDerWaalsContact CA-CA 3.49Å; T238-G240 PolarHBondContact O-N 3.24Å
241	L	95.5	Very high	94.1	Very high	14 Å²	14	41.3 Å²	41.3	7%	0.073	25%	0.248	C	C	.	.			trans	-125.3	158.9	169.9	-63.4	173.3	0	0	0	108	V175 L206 Y209 Y227 D228	V175-L241 HydrophobicContact CB-CD1 3.74Å; V175-L241 HydrophobicContact CG1-CD1 3.97Å; V175-L241 HydrophobicContact CG2-CD1 3.87Å; L206-L241 HydrophobicContact CD2-CD2 3.68Å; L206-L241 HydrophobicContact CG-CD2 3.96Å; Y209-L241 HydrophobicContact CD1-CD2 3.84Å; Y209-L241 HydrophobicContact CE1-CD2 4.14Å; Y227-L241 CarbonylContact C-O 3.52Å; Y227-L241 WeakPolarHBondContact CA-O 3.21Å; D228-L241 PolarHBondContact N-O 3.1Å; D228-L241 PolarHBondContact OD1-N 2.96Å
242	G	94.8	Very high	93.8	Very high	6 Å²	6	42.1 Å²	42.1	6%	0.062	26%	0.256	C	S	.	.			trans	-171.2	-146.9	-175	0	0	0	0	0	110.3	Y209 D224 S226 L244 M245 D246	Y209-G242 WeakPolarHBondContact OH-CA 3.49Å; Y209-G242 PolarHBondContact OH-N 3.29Å; D224-G242 WeakPolarHBondContact OD1-CA 3.06Å; S226-G242 WeakPolarHBondContact OG-CA 3.17Å; G242-L244 VanDerWaalsContact C-N 3.25Å; G242-L244 PolarHBondContact O-N 3.26Å; G242-L244 VanDerWaalsContact O-N 3.17Å; G242-M245 PolarHBondContact O-N 3.28Å; G242-D246 PolarHBondContact O-N 2.83Å
243	Q	94.3	Very high	93.5	Very high	5 Å²	5	39.5 Å²	39.5	2%	0.023	24%	0.241	C	C	.	.	G	3₁₀ helix	trans	-60.3	-31.4	-168.4	-65.7	-173.1	-102.9	0	0	113.9	Y209 D223 D224 S226 M245 D246 E267 V270	Y209-Q243 PolarHBondContact OH-N 3.5Å; D223-Q243 PolarHBondContact O-OE1 2.99Å; D223-Q243 VanDerWaalsContact O-OE1 3.06Å; D224-Q243 WeakPolarHBondContact OD1-CG 3.44Å; D224-Q243 PolarHBondContact OD1-N 3.08Å; S226-Q243 WeakPolarHBondContact OG-CG 3.28Å; S226-Q243 PolarHBondContact OG-N 3.31Å; S226-Q243 VanDerWaalsContact OG-N 3.07Å; Q243-M245 PolarHBondContact O-N 3.46Å; Q243-D246 PolarHBondContact O-N 3.36Å; Q243-E267 PolarHBondContact NE2-O 2.8Å; Q243-V270 HydrophobicContact CB-CG2 4.06Å
244	L	96.4	Very high	92.8	Very high	0 Å²	0	35.6 Å²	35.6	0%	0	22%	0.217	C	C	.	.	G	3₁₀ helix	trans	-68.9	-4.8	-177.5	-63.3	-171.1	0	0	0	114.6	Y209 M211 G242 V270 W272 F279 I364 V367	Y209-L244 HydrophobicContact CE1-CB 4.1Å; Y209-L244 HydrophobicContact CE2-CD1 4.37Å; Y209-L244 PolarHBondContact OH-N 3.17Å; M211-L244 HydrophobicContact CE-CD1 4.03Å; M211-L244 HydrophobicContact CE-CG 4.37Å; M211-L244 HydrophobicContact SD-CD1 3.37Å; M211-L244 WeakPolarHBondContact SD-CD1 3.03Å; M211-L244 HydrophobicContact SD-CG 4.31Å; G242-L244 VanDerWaalsContact C-N 3.25Å; G242-L244 PolarHBondContact O-N 3.26Å; G242-L244 VanDerWaalsContact O-N 3.17Å; L244-V270 HydrophobicContact CD2-CB 4.08Å; L244-V270 HydrophobicContact CD2-CG2 3.94Å; L244-V270 HydrophobicContact CG-CG2 4.41Å; L244-W272 HydrophobicContact CD1-CH2 4.37Å; L244-F279 HydrophobicContact CD1-CD1 4.17Å; L244-F279 HydrophobicContact CD1-CE1 3.85Å; L244-I364 HydrophobicContact CD2-CB 4.19Å; L244-I364 HydrophobicContact CD2-CG2 3.91Å; L244-V367 HydrophobicContact CB-CG2 4.15Å; L244-V367 HydrophobicContact CD1-CG2 4.36Å; L244-V367 PolarHBondContact O-N 2.8Å
245	M	93.8	Very high	92.1	Very high	19 Å²	19	34.5 Å²	34.5	9%	0.094	20%	0.203	C	C	.	.	G	3₁₀ helix	trans	-143.4	21.6	-176.7	-60.8	-71.9	-43.4	0	0	111.3	E204 L206 Y209 G242 Q243 G247 E366 V367	E204-M245 WeakPolarHBondContact OE2-CE 3.23Å; L206-M245 HydrophobicContact CB-CE 4.31Å; L206-M245 HydrophobicContact CD2-CB 4.31Å; L206-M245 HydrophobicContact CD2-CE 3.5Å; L206-M245 HydrophobicContact CD2-CG 3.38Å; L206-M245 HydrophobicContact CD2-SD 3.44Å; L206-M245 WeakPolarHBondContact CD2-SD 3.4Å; Y209-M245 HydrophobicContact CD1-CG 3.93Å; Y209-M245 HydrophobicContact CE1-CB 4.33Å; Y209-M245 HydrophobicContact CE1-CG 3.81Å; G242-M245 PolarHBondContact O-N 3.28Å; Q243-M245 PolarHBondContact O-N 3.46Å; M245-G247 VanDerWaalsContact C-N 3.34Å; M245-E366 WeakPolarHBondContact CA-OE1 3.29Å; M245-E366 PolarHBondContact N-OE1 2.76Å; M245-V367 HydrophobicContact SD-CB 4.04Å; M245-V367 HydrophobicContact SD-CG1 4.49Å
246	D	92	Very high	90.9	Very high	15 Å²	15	35.7 Å²	35.7	8%	0.08	22%	0.216	C	C	.	.	S	Bend	trans	-89.4	-0.8	-175.5	76.9	7.5	0	0	0	113.3	L41 G242 Q243 R248	L41-D246 WeakPolarHBondContact CD1-O 3.31Å; G242-D246 PolarHBondContact O-N 2.83Å; Q243-D246 PolarHBondContact O-N 3.36Å; D246-R248 WeakPolarHBondContact OD1-CB 3.14Å; D246-R248 PolarHBondContact OD1-N 3.03Å
247	G	90.4	Very high	89.6	Confident	20 Å²	20	40.7 Å²	40.7	21%	0.206	25%	0.245	C	C	.	.	S	Bend	trans	83.2	7.8	179.1	0	0	0	0	0	114	M245 E366	M245-G247 VanDerWaalsContact C-N 3.34Å; G247-E366 WeakPolarHBondContact CA-OE2 3.18Å; G247-E366 PolarHBondContact N-OE2 2.89Å
248	R	90.4	Very high	88.2	Confident	104 Å²	104	42.9 Å²	42.9	39%	0.392	27%	0.269	S	S	.	.			trans	-110.6	126.2	-178.5	-59	-177.7	170.6	159.6	7.4	111.8	L41 D171 D246 E366	L41-R248 HydrophobicContact CD1-CG 4.44Å; D171-R248 PolarHBondContact O-NH1 2.85Å; D171-R248 PolarHBondContact O-NH2 3.06Å; D246-R248 WeakPolarHBondContact OD1-CB 3.14Å; D246-R248 PolarHBondContact OD1-N 3.03Å; R248-E366 PolarHBondContact N-OE2 2.73Å
249	T	92.9	Very high	87.2	Confident	65 Å²	65	45.5 Å²	45.5	40%	0.399	28%	0.279	S	S	.	.	P	Polyproline II helix	trans	-86.9	138.8	171.4	47.5	0	0	0	0	110.8	H295 W338	T249-H295 HydrophobicContact CG2-CB 4.42Å; T249-W338 HydrophobicContact CG2-CH2 4.18Å; T249-W338 HydrophobicContact CG2-CZ2 3.37Å
250	G	92.4	Very high	86.6	Confident	5 Å²	5	45 Å²	45	5%	0.052	27%	0.27	C	S	.	.	P	Polyproline II helix	trans	-73.7	137.4	177.6	0	0	0	0	0	112.1	W269 H295 S365	G250-W269 VanDerWaalsContact O-CZ2 3.25Å; G250-W269 WeakPolarHBondContact O-CZ2 3.25Å; G250-H295 PolarHBondContact O-CE1 3.08Å; G250-S365 VanDerWaalsContact N-CB 3.3Å; G250-S365 PolarHBondContact N-OG 2.82Å
251	G	91.2	Very high	86	Confident	23 Å²	23	49 Å²	49	24%	0.237	30%	0.298	C	S	.	.	P	Polyproline II helix	trans	-75.2	160.8	172.6	0	0	0	0	0	112.6	W269	G251-W269 PolarHBondContact O-NE1 2.86Å
252	E	89.7	Confident	85.5	Confident	123 Å²	123	51.4 Å²	51.4	58%	0.575	31%	0.311	S	S	*	.	P	Polyproline II helix	trans	-65	138.6	172.8	-171.5	-179.7	165.2	0	0	110.5	N265 P336	E252-N265 PolarHBondContact O-ND2 3.42Å; E252-P336 HydrophobicContact CB-CG 3.93Å
253	F	87.4	Confident	85	Confident	17 Å²	17	53.8 Å²	53.8	8%	0.075	33%	0.33	C	S	.	.			trans	-143.9	152.7	168.3	70.5	-95.5	0	0	0	110.2	F222 L255 V260 D262 N265 A266 W269 M297 L363	F222-F253 HydrophobicContact CE1-CE1 4.1Å; F222-F253 HydrophobicContact CE1-CE2 4.26Å; F222-F253 AromaticContact CE1-CZ 3.48Å; F222-F253 HydrophobicContact CE1-CZ 3.48Å; F222-F253 VanDerWaalsContact CE1-CZ 3.48Å; F222-F253 HydrophobicContact CZ-CE2 4.05Å; F222-F253 AromaticContact CZ-CZ 3.67Å; F222-F253 HydrophobicContact CZ-CZ 3.67Å; F253-L255 HydrophobicContact CD2-CG 4.42Å; F253-L255 HydrophobicContact CE2-CD1 4.4Å; F253-L255 HydrophobicContact CE2-CD2 3.76Å; F253-L255 HydrophobicContact CE2-CG 3.78Å; F253-V260 HydrophobicContact CD2-CG1 3.99Å; F253-V260 HydrophobicContact CD2-CG2 4.46Å; F253-V260 HydrophobicContact CE2-CG1 4.35Å; F253-V260 HydrophobicContact CE2-CG2 4.09Å; F253-D262 HydrophobicContact CB-CB 4.21Å; F253-N265 HydrophobicContact CB-CB 4.09Å; F253-N265 HydrophobicContact CD1-CB 4.44Å; F253-A266 HydrophobicContact CD1-CB 4.11Å; F253-A266 HydrophobicContact CD2-CB 4.38Å; F253-A266 HydrophobicContact CE1-CB 4.01Å; F253-A266 HydrophobicContact CE2-CB 4.28Å; F253-A266 HydrophobicContact CG-CB 4.3Å; F253-A266 HydrophobicContact CZ-CB 4.12Å; F253-W269 AromaticContact CD1-CD1 3.82Å; F253-W269 AromaticContact CD1-NE1 3.83Å; F253-W269 AromaticContact CE1-CD1 3.39Å; F253-W269 AromaticContact CE1-CG 3.98Å; F253-W269 HydrophobicContact CE1-CG 3.98Å; F253-W269 AromaticContact CE1-NE1 3.73Å; F253-M297 HydrophobicContact CD1-CE 3.13Å; F253-M297 HydrophobicContact CE1-CE 3.07Å; F253-M297 HydrophobicContact CG-CE 3.99Å; F253-M297 HydrophobicContact CZ-CE 3.89Å; F253-L363 HydrophobicContact CE1-CD1 3.92Å; F253-L363 HydrophobicContact CZ-CD1 3.5Å
254	A	82.1	Confident	84.7	Confident	54 Å²	54	56.5 Å²	56.5	45%	0.446	35%	0.354	S	S	.	.			trans	-93.8	137.6	178.9	0	0	0	0	0	111.4	S261	A254-S261 PolarHBondContact N-OG 2.68Å; A254-S261 VanDerWaalsContact N-OG 3.08Å; A254-S261 PolarHBondContact O-N 2.94Å; A254-S261 PolarHBondContact O-OG 2.49Å
255	L	77.4	Confident	84.3	Confident	76 Å²	76	58.6 Å²	58.6	40%	0.398	37%	0.365	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96	87.7	165.4	-71.3	168.6	0	0	0	108.5	Y217 A218 F253 V260 L361	Y217-L255 HydrophobicContact CE1-CD1 4.12Å; A218-L255 HydrophobicContact CB-CD2 3.89Å; F253-L255 HydrophobicContact CD2-CG 4.42Å; F253-L255 HydrophobicContact CE2-CD1 4.4Å; F253-L255 HydrophobicContact CE2-CD2 3.76Å; F253-L255 HydrophobicContact CE2-CG 3.78Å; L255-V260 HydrophobicContact CD2-CG2 3.8Å; L255-L361 HydrophobicContact CD1-CD2 3.94Å
256	G	68.5	Low	84.1	Confident	40 Å²	40	57.7 Å²	57.7	41%	0.412	36%	0.36	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	131.1	-179	0	0	0	0	0	111.7	G258 I259	G256-G258 PolarHBondContact O-N 3.07Å; G256-I259 PolarHBondContact N-O 3.39Å; G256-I259 PolarHBondContact O-N 2.89Å
257	N	70.8	Confident	84	Confident	176 Å²	176	59.3 Å²	59.3	94%	0.941	37%	0.367	S	S	*	.	T	Hydrogen-bonded Turn	trans	50.5	31.8	178.6	-67.5	-16.6	0	0	0	114.6	I259	N257-I259 VanDerWaalsContact C-N 3.29Å; N257-I259 PolarHBondContact O-N 3.37Å
258	G	67.3	Low	84.1	Confident	48 Å²	48	61.6 Å²	61.6	50%	0.495	37%	0.373	S	S	.	.	T	Hydrogen-bonded Turn	trans	71.6	20.3	-177.1	0	0	0	0	0	114.5	A218 G256	A218-G258 CarbonylContact C-O 3.54Å; A218-G258 VanDerWaalsContact CA-O 3.25Å; A218-G258 WeakPolarHBondContact CA-O 3.41Å; A218-G258 WeakPolarHBondContact CB-O 3.48Å; A218-G258 VanDerWaalsContact O-O 3.05Å; G256-G258 PolarHBondContact O-N 3.07Å
259	I	75.1	Confident	84.4	Confident	116 Å²	116	56.7 Å²	56.7	60%	0.595	35%	0.354	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-128.2	140.1	176.3	-58	175.5	0	0	0	109	G256 N257	G256-I259 PolarHBondContact N-O 3.39Å; G256-I259 PolarHBondContact O-N 2.89Å; N257-I259 VanDerWaalsContact C-N 3.29Å; N257-I259 PolarHBondContact O-N 3.37Å
260	V	81.2	Confident	84.6	Confident	19 Å²	19	53.6 Å²	53.6	12%	0.115	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.7	125.7	170.7	169.7	0	0	0	0	110	H220 F222 F253 L255 D262 A266	H220-V260 HydrophobicContact CB-CB 4.49Å; H220-V260 HydrophobicContact CB-CG2 3.61Å; F222-V260 HydrophobicContact CZ-CG2 4.02Å; F253-V260 HydrophobicContact CD2-CG1 3.99Å; F253-V260 HydrophobicContact CD2-CG2 4.46Å; F253-V260 HydrophobicContact CE2-CG1 4.35Å; F253-V260 HydrophobicContact CE2-CG2 4.09Å; L255-V260 HydrophobicContact CD2-CG2 3.8Å; V260-D262 VanDerWaalsContact CG1-C 3.48Å; V260-D262 WeakPolarHBondContact CG1-O 3.37Å; V260-A266 HydrophobicContact CB-CB 4.49Å; V260-A266 HydrophobicContact CG1-CB 3.45Å; V260-A266 VanDerWaalsContact CG1-CB 3.45Å; V260-A266 HydrophobicContact CG2-CB 4.28Å
261	S	81.6	Confident	84.8	Confident	85 Å²	85	53.3 Å²	53.3	59%	0.594	33%	0.333	S	S	*	.	S	Bend	trans	-72	-31.1	178.6	65.4	0	0	0	0	113.8	A254	A254-S261 PolarHBondContact N-OG 2.68Å; A254-S261 VanDerWaalsContact N-OG 3.08Å; A254-S261 PolarHBondContact O-N 2.94Å; A254-S261 PolarHBondContact O-OG 2.49Å
262	D	85.5	Confident	85	Confident	63 Å²	63	52.2 Å²	52.2	34%	0.337	32%	0.321	S	S	.	.			trans	-135.7	100.3	-176.4	-171.1	-21.9	0	0	0	109.9	F253 V260 A264 N265 A266	F253-D262 HydrophobicContact CB-CB 4.21Å; V260-D262 VanDerWaalsContact CG1-C 3.48Å; V260-D262 WeakPolarHBondContact CG1-O 3.37Å; D262-A264 VanDerWaalsContact C-N 3.3Å; D262-A264 PolarHBondContact O-N 3.21Å; D262-A264 WeakPolarHBondContact OD1-CB 3.48Å; D262-A264 PolarHBondContact OD1-N 3.5Å; D262-N265 HydrophobicContact CB-CB 4.31Å; D262-N265 PolarHBondContact OD1-N 3.22Å; D262-N265 PolarHBondContact OD2-ND2 2.94Å; D262-A266 WeakPolarHBondContact O-CB 3.45Å; D262-A266 PolarHBondContact O-N 2.85Å; D262-A266 VanDerWaalsContact O-N 3.08Å
263	A	85	Confident	85.2	Confident	56 Å²	56	49.1 Å²	49.1	46%	0.463	31%	0.311	S	S	.	.	H	α-helix	trans	-65.7	-33.2	-179.1	0	0	0	0	0	112.1	A266 E267	A263-A266 PolarHBondContact O-N 2.77Å; A263-E267 VanDerWaalsContact O-CG 3.32Å; A263-E267 WeakPolarHBondContact O-CG 3.13Å; A263-E267 PolarHBondContact O-N 3.47Å
264	A	87.1	Confident	85.5	Confident	63 Å²	63	52 Å²	52	52%	0.521	32%	0.323	S	S	.	.	H	α-helix	trans	-67.6	-42.9	-177.5	0	0	0	0	0	111.1	D262 E267	D262-A264 VanDerWaalsContact C-N 3.3Å; D262-A264 PolarHBondContact O-N 3.21Å; D262-A264 WeakPolarHBondContact OD1-CB 3.48Å; D262-A264 PolarHBondContact OD1-N 3.5Å; A264-E267 PolarHBondContact O-N 2.84Å
265	N	88.8	Confident	86.2	Confident	44 Å²	44	54.1 Å²	54.1	24%	0.235	33%	0.332	C	S	.	.	H	α-helix	trans	-67.9	-40.3	173.5	-74	-3.3	0	0	0	111.3	E252 F253 D262 E267 Q268	E252-N265 PolarHBondContact O-ND2 3.42Å; F253-N265 HydrophobicContact CB-CB 4.09Å; F253-N265 HydrophobicContact CD1-CB 4.44Å; D262-N265 HydrophobicContact CB-CB 4.31Å; D262-N265 PolarHBondContact OD1-N 3.22Å; D262-N265 PolarHBondContact OD2-ND2 2.94Å; N265-E267 VanDerWaalsContact C-N 3.25Å; N265-E267 PolarHBondContact O-N 3.08Å; N265-Q268 WeakPolarHBondContact O-CB 3.43Å; N265-Q268 PolarHBondContact O-N 2.79Å; N265-Q268 VanDerWaalsContact O-N 3.1Å
266	A	89.3	Confident	87.1	Confident	0 Å²	0	54.3 Å²	54.3	0%	0	33%	0.333	C	S	.	.	H	α-helix	trans	-63.5	-27.9	178.7	0	0	0	0	0	114.1	F222 F253 V260 D262 A263 Q268 W269	F222-A266 HydrophobicContact CE1-CB 3.91Å; F222-A266 HydrophobicContact CZ-CB 4.44Å; F253-A266 HydrophobicContact CD1-CB 4.11Å; F253-A266 HydrophobicContact CD2-CB 4.38Å; F253-A266 HydrophobicContact CE1-CB 4.01Å; F253-A266 HydrophobicContact CE2-CB 4.28Å; F253-A266 HydrophobicContact CG-CB 4.3Å; F253-A266 HydrophobicContact CZ-CB 4.12Å; V260-A266 HydrophobicContact CB-CB 4.49Å; V260-A266 HydrophobicContact CG1-CB 3.45Å; V260-A266 VanDerWaalsContact CG1-CB 3.45Å; V260-A266 HydrophobicContact CG2-CB 4.28Å; D262-A266 WeakPolarHBondContact O-CB 3.45Å; D262-A266 PolarHBondContact O-N 2.85Å; D262-A266 VanDerWaalsContact O-N 3.08Å; A263-A266 PolarHBondContact O-N 2.77Å; A266-Q268 PolarHBondContact O-N 3.23Å; A266-W269 PolarHBondContact O-N 2.93Å
267	E	90.2	Very high	88.5	Confident	49 Å²	49	52.4 Å²	52.4	23%	0.229	31%	0.314	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66.1	-15.8	174.6	-76.9	-172.5	172.4	0	0	114	H150 R225 Q243 A263 A264 N265 W269	H150-E267 IonicContact CD2-OE2 3.81Å; H150-E267 IonicContact CE1-OE2 3.34Å; H150-E267 IonicContact NE2-OE2 3.98Å; H150-E267 PolarHBondContact NE2-OE2 3.34Å; R225-E267 IonicContact CZ-OE1 3.38Å; R225-E267 IonicContact NH1-OE1 3.84Å; R225-E267 PolarHBondContact NH1-OE1 3.07Å; R225-E267 IonicContact NH1-OE2 2.74Å; R225-E267 IonicContact NH2-OE1 3.87Å; Q243-E267 PolarHBondContact NE2-O 2.8Å; A263-E267 VanDerWaalsContact O-CG 3.32Å; A263-E267 WeakPolarHBondContact O-CG 3.13Å; A263-E267 PolarHBondContact O-N 3.47Å; A264-E267 PolarHBondContact O-N 2.84Å; N265-E267 VanDerWaalsContact C-N 3.25Å; N265-E267 PolarHBondContact O-N 3.08Å; E267-W269 VanDerWaalsContact C-N 3.29Å
268	Q	92.7	Very high	89.7	Confident	67 Å²	67	48.7 Å²	48.7	31%	0.313	29%	0.291	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.2	-4.4	178.7	-58.5	170.3	-30.4	0	0	112.9	N265 A266 S365	N265-Q268 WeakPolarHBondContact O-CB 3.43Å; N265-Q268 PolarHBondContact O-N 2.79Å; N265-Q268 VanDerWaalsContact O-N 3.1Å; A266-Q268 PolarHBondContact O-N 3.23Å; Q268-S365 VanDerWaalsContact O-CB 3.25Å; Q268-S365 WeakPolarHBondContact O-CB 3.41Å
269	W	95.6	Very high	91.2	Very high	1 Å²	1	46.6 Å²	46.6	0%	0.004	27%	0.268	C	S	.	.			trans	-114.2	136	-173.4	-63.7	91.1	0	0	0	112.1	F222 G250 G251 F253 A266 E267 H295 M297 P336 L363	F222-W269 HydrophobicContact CD1-CB 4.1Å; F222-W269 HydrophobicContact CE1-CB 4.48Å; G250-W269 VanDerWaalsContact O-CZ2 3.25Å; G250-W269 WeakPolarHBondContact O-CZ2 3.25Å; G251-W269 PolarHBondContact O-NE1 2.86Å; F253-W269 AromaticContact CD1-CD1 3.82Å; F253-W269 AromaticContact CD1-NE1 3.83Å; F253-W269 AromaticContact CE1-CD1 3.39Å; F253-W269 AromaticContact CE1-CG 3.98Å; F253-W269 HydrophobicContact CE1-CG 3.98Å; F253-W269 AromaticContact CE1-NE1 3.73Å; A266-W269 PolarHBondContact O-N 2.93Å; E267-W269 VanDerWaalsContact C-N 3.29Å; W269-H295 AromaticContact CH2-CE1 3.65Å; W269-H295 AromaticContact CH2-ND1 3.54Å; W269-M297 HydrophobicContact CD2-CE 4.05Å; W269-M297 HydrophobicContact CE3-CB 4.22Å; W269-M297 HydrophobicContact CG-CE 4.4Å; W269-M297 VanDerWaalsContact CH2-CA 3.45Å; W269-M297 HydrophobicContact CH2-CB 3.82Å; W269-M297 HydrophobicContact CH2-CE 4.44Å; W269-M297 VanDerWaalsContact CH2-N 3.27Å; W269-M297 HydrophobicContact CH2-SD 4.44Å; W269-M297 HydrophobicContact CZ2-CB 4.11Å; W269-M297 HydrophobicContact CZ2-CE 3.56Å; W269-M297 HydrophobicContact CZ2-SD 3.91Å; W269-M297 HydrophobicContact CZ3-CB 3.88Å; W269-M297 VanDerWaalsContact NE1-CE 3.31Å; W269-P336 HydrophobicContact CH2-CB 3.98Å; W269-P336 HydrophobicContact CH2-CG 4.35Å; W269-P336 HydrophobicContact CZ2-CB 3.99Å; W269-P336 HydrophobicContact CZ2-CG 3.91Å; W269-L363 HydrophobicContact CB-CB 4.29Å; W269-L363 HydrophobicContact CB-CD2 4.07Å; W269-L363 HydrophobicContact CD2-CB 4.14Å; W269-L363 HydrophobicContact CE3-CB 3.66Å; W269-L363 HydrophobicContact CG-CB 4.44Å; W269-L363 HydrophobicContact CZ3-CB 4.34Å; W269-L363 WeakPolarHBondContact CZ3-O 3.21Å
270	V	97.2	Very high	92.3	Very high	0 Å²	0	44.2 Å²	44.2	0%	0	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.5	135.7	167.9	-167.4	0	0	0	0	108.7	M211 F222 D224 Q243 L244 W272 L363 I364	M211-V270 HydrophobicContact CE-CG1 4.01Å; F222-V270 WeakPolarHBondContact O-CA 3.44Å; D224-V270 HydrophobicContact CB-CG1 4.3Å; D224-V270 HydrophobicContact CB-CG2 4.02Å; Q243-V270 HydrophobicContact CB-CG2 4.06Å; L244-V270 HydrophobicContact CD2-CB 4.08Å; L244-V270 HydrophobicContact CD2-CG2 3.94Å; L244-V270 HydrophobicContact CG-CG2 4.41Å; V270-W272 HydrophobicContact CB-CH2 3.8Å; V270-W272 HydrophobicContact CB-CZ2 4.31Å; V270-W272 HydrophobicContact CB-CZ3 4.34Å; V270-W272 HydrophobicContact CG1-CH2 3.4Å; V270-W272 HydrophobicContact CG1-CZ2 3.4Å; V270-W272 HydrophobicContact CG1-CZ3 4.22Å; V270-W272 WeakPolarHBondContact O-CZ3 3.42Å; V270-L363 WeakPolarHBondContact O-CA 3.45Å; V270-I364 PolarHBondContact N-O 3.35Å; V270-I364 PolarHBondContact O-N 2.52Å
271	G	96.4	Very high	93.1	Very high	0 Å²	0	43.4 Å²	43.4	0%	0	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.3	145.9	-162	0	0	0	0	0	116.7	G214 E215 F222 L362	G214-G271 CarbonylContact C-O 3.58Å; G214-G271 WeakPolarHBondContact CA-O 3.26Å; E215-G271 PolarHBondContact N-O 2.84Å; F222-G271 PolarHBondContact O-N 2.99Å; G271-L362 CarbonylContact C-O 3.55Å; G271-L362 WeakPolarHBondContact CA-O 3.26Å
272	W	96.7	Very high	93.8	Very high	0 Å²	0	41.1 Å²	41.1	0%	0	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.3	146.3	-179.9	-52	-89.3	0	0	0	112.2	M211 P212 S213 L244 V270 V277 F279 N357 L362 I364	M211-W272 HydrophobicContact CE-CZ2 4.24Å; M211-W272 HydrophobicContact CG-CZ2 4.47Å; M211-W272 HydrophobicContact SD-CH2 4.06Å; M211-W272 HydrophobicContact SD-CZ2 3.7Å; P212-W272 PolarHBondContact O-NE1 3.45Å; S213-W272 VanDerWaalsContact O-CD1 3.24Å; S213-W272 PolarHBondContact O-NE1 3.42Å; L244-W272 HydrophobicContact CD1-CH2 4.37Å; V270-W272 HydrophobicContact CB-CH2 3.8Å; V270-W272 HydrophobicContact CB-CZ2 4.31Å; V270-W272 HydrophobicContact CB-CZ3 4.34Å; V270-W272 HydrophobicContact CG1-CH2 3.4Å; V270-W272 HydrophobicContact CG1-CZ2 3.4Å; V270-W272 HydrophobicContact CG1-CZ3 4.22Å; V270-W272 WeakPolarHBondContact O-CZ3 3.42Å; W272-V277 HydrophobicContact CB-CG2 3.69Å; W272-V277 HydrophobicContact CD2-CG1 3.86Å; W272-V277 HydrophobicContact CD2-CG2 4.28Å; W272-V277 HydrophobicContact CE3-CG1 4.24Å; W272-V277 HydrophobicContact CG-CG1 4.1Å; W272-V277 HydrophobicContact CG-CG2 3.91Å; W272-F279 HydrophobicContact CE3-CZ 4.32Å; W272-F279 AromaticContact CH2-CE1 3.57Å; W272-F279 HydrophobicContact CH2-CE1 3.57Å; W272-F279 AromaticContact CH2-CZ 3.72Å; W272-F279 HydrophobicContact CH2-CZ 3.72Å; W272-F279 AromaticContact CZ2-CE1 3.96Å; W272-F279 HydrophobicContact CZ2-CE1 3.96Å; W272-F279 HydrophobicContact CZ2-CZ 4.24Å; W272-F279 HydrophobicContact CZ3-CE1 4.11Å; W272-F279 AromaticContact CZ3-CZ 3.77Å; W272-F279 HydrophobicContact CZ3-CZ 3.77Å; W272-N357 PolarHBondContact O-ND2 2.96Å; W272-L362 HydrophobicContact CE3-CD2 4.27Å; W272-L362 HydrophobicContact CE3-CG 4.42Å; W272-L362 PolarHBondContact N-O 2.8Å; W272-L362 PolarHBondContact O-N 3.38Å; W272-I364 HydrophobicContact CZ3-CB 4.36Å; W272-I364 HydrophobicContact CZ3-CD1 4.33Å; W272-I364 HydrophobicContact CZ3-CG1 4.35Å
273	T	93.8	Very high	94.3	Very high	58 Å²	58	38.1 Å²	38.1	36%	0.356	21%	0.212	S	C	.	.			trans	-106.1	-2.9	170.2	61.4	0	0	0	0	112.7	E215 Y217 L361	E215-T273 PolarHBondContact OE2-N 2.96Å; E215-T273 PolarHBondContact OE2-OG1 2.85Å; Y217-T273 HydrophobicContact CD2-CG2 3.58Å; Y217-T273 HydrophobicContact CE2-CG2 3.92Å; T273-L361 HydrophobicContact CG2-CD1 3.87Å
274	K	94.5	Very high	94.7	Very high	78 Å²	78	38.3 Å²	38.3	34%	0.339	21%	0.205	S	C	.	.			trans	-56.8	142.5	176.4	-79.1	162.8	-177	143.9	0	111.4	E215 L276 V277 N357	E215-K274 WeakPolarHBondContact OE1-CD 3.49Å; E215-K274 WeakPolarHBondContact OE1-CE 3.35Å; E215-K274 VanDerWaalsContact OE1-CG 3.27Å; E215-K274 WeakPolarHBondContact OE1-CG 3.36Å; E215-K274 IonicContact OE1-NZ 2.69Å; E215-K274 PolarHBondContact OE1-NZ 2.67Å; K274-L276 PolarHBondContact O-N 2.79Å; K274-V277 HydrophobicContact CB-CG2 4.27Å; K274-N357 VanDerWaalsContact O-CB 3.25Å; K274-N357 WeakPolarHBondContact O-CB 3.29Å
275	P	95.7	Very high	95	Very high	97 Å²	97	40 Å²	40	63%	0.63	21%	0.205	S	C	*	.	S	Bend	trans	-67.4	-21.9	178.2	28.2	-35.6	0	0	0	113	R356 N357	P275-R356 WeakPolarHBondContact O-CA 3.29Å; P275-R356 WeakPolarHBondContact O-CG 3.46Å; P275-N357 PolarHBondContact O-N 3.41Å
276	L	96.7	Very high	95.3	Very high	80 Å²	80	41 Å²	41	42%	0.419	21%	0.21	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.5	129	176.3	-179.8	66	0	0	0	108.5	K274 E278 N354 I355	K274-L276 PolarHBondContact O-N 2.79Å; L276-E278 HydrophobicContact CD2-CG 4.15Å; L276-E278 HydrophobicContact CG-CG 4.06Å; L276-N354 HydrophobicContact CD1-CB 4.17Å; L276-I355 WeakPolarHBondContact CA-O 3.43Å
277	V	97.4	Very high	95.6	Very high	0 Å²	0	41.7 Å²	41.7	0%	0	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	121.4	173.7	-170.2	0	0	0	0	107.9	P212 W272 K274 F279 I355 L362	P212-V277 HydrophobicContact CG-CG1 4.33Å; W272-V277 HydrophobicContact CB-CG2 3.69Å; W272-V277 HydrophobicContact CD2-CG1 3.86Å; W272-V277 HydrophobicContact CD2-CG2 4.28Å; W272-V277 HydrophobicContact CE3-CG1 4.24Å; W272-V277 HydrophobicContact CG-CG1 4.1Å; W272-V277 HydrophobicContact CG-CG2 3.91Å; K274-V277 HydrophobicContact CB-CG2 4.27Å; V277-F279 HydrophobicContact CB-CE2 3.95Å; V277-F279 HydrophobicContact CB-CZ 4.27Å; V277-F279 HydrophobicContact CG1-CD2 4.28Å; V277-F279 HydrophobicContact CG1-CE1 4.16Å; V277-F279 HydrophobicContact CG1-CE2 3.48Å; V277-F279 VanDerWaalsContact CG1-CE2 3.48Å; V277-F279 HydrophobicContact CG1-CZ 3.41Å; V277-F279 VanDerWaalsContact CG1-CZ 3.41Å; V277-I355 PolarHBondContact N-O 3.14Å; V277-I355 PolarHBondContact O-N 2.85Å; V277-L362 HydrophobicContact CG2-CD2 4.11Å
278	E	96.8	Very high	95.8	Very high	99 Å²	99	41.2 Å²	41.2	46%	0.463	21%	0.211	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	125.9	-177.1	-55.1	-177	117.8	0	0	109.3	P212 L276 N354	P212-E278 VanDerWaalsContact CD-O 3.28Å; P212-E278 WeakPolarHBondContact CD-O 3.32Å; L276-E278 HydrophobicContact CD2-CG 4.15Å; L276-E278 HydrophobicContact CG-CG 4.06Å; E278-N354 WeakPolarHBondContact CB-OD1 3.33Å; E278-N354 VanDerWaalsContact CG-OD1 3.31Å; E278-N354 WeakPolarHBondContact CG-OD1 3.43Å
279	F	98.1	Very high	95.9	Very high	4 Å²	4	38 Å²	38	2%	0.018	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	133.2	177.3	-55.5	-94.7	0	0	0	109.4	S210 M211 L244 W272 V277 F281 L352 V353 I355 I364	S210-F279 WeakPolarHBondContact O-CA 3.44Å; M211-F279 HydrophobicContact CB-CD1 3.73Å; M211-F279 HydrophobicContact CB-CE1 4.07Å; M211-F279 HydrophobicContact SD-CD1 4.08Å; M211-F279 HydrophobicContact SD-CE1 3.88Å; L244-F279 HydrophobicContact CD1-CD1 4.17Å; L244-F279 HydrophobicContact CD1-CE1 3.85Å; W272-F279 HydrophobicContact CE3-CZ 4.32Å; W272-F279 AromaticContact CH2-CE1 3.57Å; W272-F279 HydrophobicContact CH2-CE1 3.57Å; W272-F279 AromaticContact CH2-CZ 3.72Å; W272-F279 HydrophobicContact CH2-CZ 3.72Å; W272-F279 AromaticContact CZ2-CE1 3.96Å; W272-F279 HydrophobicContact CZ2-CE1 3.96Å; W272-F279 HydrophobicContact CZ2-CZ 4.24Å; W272-F279 HydrophobicContact CZ3-CE1 4.11Å; W272-F279 AromaticContact CZ3-CZ 3.77Å; W272-F279 HydrophobicContact CZ3-CZ 3.77Å; V277-F279 HydrophobicContact CB-CE2 3.95Å; V277-F279 HydrophobicContact CB-CZ 4.27Å; V277-F279 HydrophobicContact CG1-CD2 4.28Å; V277-F279 HydrophobicContact CG1-CE1 4.16Å; V277-F279 HydrophobicContact CG1-CE2 3.48Å; V277-F279 VanDerWaalsContact CG1-CE2 3.48Å; V277-F279 HydrophobicContact CG1-CZ 3.41Å; V277-F279 VanDerWaalsContact CG1-CZ 3.41Å; F279-F281 HydrophobicContact CB-CD2 4.25Å; F279-F281 HydrophobicContact CB-CE2 3.39Å; F279-F281 HydrophobicContact CB-CZ 3.83Å; F279-F281 HydrophobicContact CG-CE2 4.34Å; F279-F281 HydrophobicContact CG-CZ 4.42Å; F279-L352 WeakPolarHBondContact O-CA 3.44Å; F279-V353 HydrophobicContact CB-CB 4.27Å; F279-V353 PolarHBondContact N-O 2.75Å; F279-V353 PolarHBondContact O-N 3.04Å; F279-I355 HydrophobicContact CD2-CD1 4.29Å; F279-I355 HydrophobicContact CD2-CG1 4.37Å; F279-I355 HydrophobicContact CE2-CB 4.49Å; F279-I355 HydrophobicContact CE2-CD1 3.66Å; F279-I355 HydrophobicContact CE2-CG1 4Å; F279-I355 HydrophobicContact CZ-CD1 4.5Å; F279-I364 HydrophobicContact CE2-CD1 4.39Å; F279-I364 HydrophobicContact CZ-CD1 4.01Å
280	Y	97.8	Very high	95.8	Very high	65 Å²	65	40.1 Å²	40.1	26%	0.255	21%	0.21	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	126.4	176.1	-178.7	-86.1	0	0	0	109.6	Y209 S210 F317 F350 V351	Y209-Y280 CarbonylContact C-O 3.59Å; Y209-Y280 VanDerWaalsContact C-O 3.3Å; Y209-Y280 WeakPolarHBondContact CA-O 3.07Å; Y209-Y280 WeakPolarHBondContact CB-O 3.13Å; S210-Y280 PolarHBondContact N-O 3.01Å; S210-Y280 PolarHBondContact O-N 3.47Å; Y280-F317 HydrophobicContact CD2-CZ 4.39Å; Y280-F317 AromaticContact CE2-CZ 3.88Å; Y280-F317 HydrophobicContact CE2-CZ 3.88Å; Y280-F350 AromaticContact CE1-CD1 3.86Å; Y280-F350 HydrophobicContact CE1-CD1 3.86Å; Y280-F350 HydrophobicContact CE2-CB 4.4Å; Y280-F350 AromaticContact CZ-CD1 3.51Å; Y280-F350 WeakPolarHBondContact OH-CD1 3.43Å; Y280-F350 VanDerWaalsContact OH-CE1 3.28Å; Y280-F350 WeakPolarHBondContact OH-CE1 3.36Å; Y280-V351 CarbonylContact C-O 3.58Å; Y280-V351 WeakPolarHBondContact CA-O 3.49Å
281	F	97.9	Very high	95.7	Very high	2 Å²	2	40.4 Å²	40.4	1%	0.009	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	136.7	-178	-61.4	-91.2	0	0	0	110.5	L206 Y209 F279 F283 F350 V351 V353 V367 F369	L206-F281 HydrophobicContact CD1-CB 3.74Å; L206-F281 HydrophobicContact CD1-CD1 3.83Å; L206-F281 HydrophobicContact CD1-CG 4.28Å; L206-F281 HydrophobicContact CD2-CD1 4.11Å; Y209-F281 HydrophobicContact CD1-CE1 4.4Å; Y209-F281 HydrophobicContact CG-CD1 4.48Å; Y209-F281 HydrophobicContact CG-CE1 4.25Å; F279-F281 HydrophobicContact CB-CD2 4.25Å; F279-F281 HydrophobicContact CB-CE2 3.39Å; F279-F281 HydrophobicContact CB-CZ 3.83Å; F279-F281 HydrophobicContact CG-CE2 4.34Å; F279-F281 HydrophobicContact CG-CZ 4.42Å; F281-F283 HydrophobicContact CB-CE2 3.82Å; F281-F283 HydrophobicContact CB-CZ 4.49Å; F281-F350 VanDerWaalsContact O-CA 3.31Å; F281-F350 WeakPolarHBondContact O-CA 3.42Å; F281-V351 HydrophobicContact CB-CB 4.26Å; F281-V351 PolarHBondContact N-O 2.77Å; F281-V351 PolarHBondContact O-N 2.95Å; F281-V353 HydrophobicContact CD2-CG2 4.14Å; F281-V353 HydrophobicContact CE2-CB 4.21Å; F281-V353 HydrophobicContact CE2-CG2 3.83Å; F281-V367 HydrophobicContact CE1-CG1 4.07Å; F281-V367 HydrophobicContact CZ-CB 4.48Å; F281-V367 HydrophobicContact CZ-CG1 3.85Å; F281-V367 HydrophobicContact CZ-CG2 4.44Å; F281-F369 HydrophobicContact CB-CE2 4.46Å; F281-F369 HydrophobicContact CB-CZ 4.37Å; F281-F369 AromaticContact CD1-CE2 3.69Å; F281-F369 HydrophobicContact CD1-CE2 3.69Å; F281-F369 HydrophobicContact CD1-CZ 4.1Å; F281-F369 HydrophobicContact CD2-CE2 4.09Å; F281-F369 AromaticContact CD2-CZ 3.62Å; F281-F369 HydrophobicContact CD2-CZ 3.62Å; F281-F369 AromaticContact CE1-CE2 3.87Å; F281-F369 HydrophobicContact CE1-CE2 3.87Å; F281-F369 HydrophobicContact CE1-CZ 4.3Å; F281-F369 HydrophobicContact CE2-CE2 4.23Å; F281-F369 AromaticContact CE2-CZ 3.82Å; F281-F369 HydrophobicContact CE2-CZ 3.82Å; F281-F369 AromaticContact CG-CE2 3.82Å; F281-F369 HydrophobicContact CG-CE2 3.82Å; F281-F369 AromaticContact CG-CZ 3.77Å; F281-F369 HydrophobicContact CG-CZ 3.77Å; F281-F369 HydrophobicContact CZ-CE2 4.14Å; F281-F369 HydrophobicContact CZ-CZ 4.18Å
282	L	97	Very high	95.7	Very high	37 Å²	37	40.4 Å²	40.4	19%	0.194	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	124.7	177.4	165.9	63.1	0	0	0	109.9	L206 L207 A208 R349 F350	L206-L282 WeakPolarHBondContact CD1-O 3.47Å; L207-L282 HydrophobicContact CB-CG 4.43Å; L207-L282 PolarHBondContact N-O 3.18Å; A208-L282 PolarHBondContact N-O 3.36Å; A208-L282 PolarHBondContact O-N 2.88Å; L282-R349 HydrophobicContact CD1-CG 4.42Å; L282-F350 HydrophobicContact CB-CD1 4.48Å; L282-F350 HydrophobicContact CD1-CD1 3.76Å; L282-F350 HydrophobicContact CD1-CE1 3.43Å; L282-F350 VanDerWaalsContact CD1-CE1 3.43Å; L282-F350 HydrophobicContact CD1-CZ 4.06Å
283	F	96.3	Very high	95.6	Very high	1 Å²	1	41 Å²	41	0%	0.004	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	158.1	175.7	-65	-97.7	0	0	0	112.3	E204 G205 L206 F281 F289 R349 V351 F369	E204-F283 WeakPolarHBondContact O-CD1 3.21Å; E204-F283 WeakPolarHBondContact O-CE1 3.13Å; G205-F283 CarbonylContact O-C 3.59Å; G205-F283 WeakPolarHBondContact O-CA 3.3Å; L206-F283 HydrophobicContact CB-CD1 4.26Å; L206-F283 HydrophobicContact CB-CE1 4.01Å; L206-F283 HydrophobicContact CD1-CD1 4.35Å; L206-F283 HydrophobicContact CD1-CD2 4.24Å; L206-F283 HydrophobicContact CD1-CE1 4.02Å; L206-F283 HydrophobicContact CD1-CE2 3.88Å; L206-F283 HydrophobicContact CD1-CG 4.47Å; L206-F283 HydrophobicContact CD1-CZ 3.76Å; F281-F283 HydrophobicContact CB-CE2 3.82Å; F281-F283 HydrophobicContact CB-CZ 4.49Å; F283-F289 HydrophobicContact CD1-CE1 4.33Å; F283-F289 HydrophobicContact CD1-CZ 4.13Å; F283-F289 HydrophobicContact CD2-CE1 4.34Å; F283-F289 AromaticContact CD2-CZ 3.67Å; F283-F289 HydrophobicContact CD2-CZ 3.67Å; F283-F289 AromaticContact CE1-CE1 3.81Å; F283-F289 HydrophobicContact CE1-CE1 3.81Å; F283-F289 HydrophobicContact CE1-CZ 4.01Å; F283-F289 AromaticContact CE2-CE1 3.82Å; F283-F289 HydrophobicContact CE2-CE1 3.82Å; F283-F289 AromaticContact CE2-CZ 3.55Å; F283-F289 HydrophobicContact CE2-CZ 3.55Å; F283-F289 AromaticContact CG-CZ 3.97Å; F283-F289 HydrophobicContact CG-CZ 3.97Å; F283-F289 AromaticContact CZ-CE1 3.53Å; F283-F289 HydrophobicContact CZ-CE1 3.53Å; F283-F289 AromaticContact CZ-CZ 3.73Å; F283-F289 HydrophobicContact CZ-CZ 3.73Å; F283-R349 WeakPolarHBondContact CD2-O 3.45Å; F283-R349 PolarHBondContact N-O 3.2Å; F283-R349 PolarHBondContact O-NE 2.87Å; F283-V351 HydrophobicContact CD2-CG2 4.2Å; F283-V351 HydrophobicContact CE2-CB 4.32Å; F283-V351 HydrophobicContact CE2-CG2 3.67Å; F283-F369 HydrophobicContact CE1-CB 4.36Å; F283-F369 HydrophobicContact CE1-CD2 4.43Å; F283-F369 HydrophobicContact CE1-CG 4.44Å; F283-F369 HydrophobicContact CZ-CB 4.11Å; F283-F369 HydrophobicContact CZ-CD1 4.2Å; F283-F369 AromaticContact CZ-CD2 3.68Å; F283-F369 HydrophobicContact CZ-CD2 3.68Å; F283-F369 HydrophobicContact CZ-CE2 4.09Å; F283-F369 AromaticContact CZ-CG 3.73Å; F283-F369 HydrophobicContact CZ-CG 3.73Å
284	D	93.5	Very high	95.7	Very high	59 Å²	59	38.5 Å²	38.5	32%	0.316	20%	0.2	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-58.4	-44.5	178	56.9	-10.2	0	0	0	113	G205 L207 R287	G205-D284 VanDerWaalsContact CA-CG 3.43Å; G205-D284 WeakPolarHBondContact CA-OD1 3.37Å; G205-D284 WeakPolarHBondContact CA-OD2 3.3Å; G205-D284 WeakPolarHBondContact O-CB 3.23Å; G205-D284 PolarHBondContact O-N 2.95Å; L207-D284 HydrophobicContact CD1-CB 4.05Å; L207-D284 HydrophobicContact CD2-CB 4.26Å; L207-D284 HydrophobicContact CG-CB 4.05Å; D284-R287 IonicContact OD1-CZ 3.83Å; D284-R287 IonicContact OD1-NE 3.69Å; D284-R287 PolarHBondContact OD1-NE 3.49Å; D284-R287 IonicContact OD1-NH2 3.82Å; D284-R287 PolarHBondContact OD1-NH2 2.88Å; D284-R287 IonicContact OD2-NH2 2.8Å; D284-R287 PolarHBondContact OD2-NH2 2.87Å
285	D	93	Very high	95.8	Very high	98 Å²	98	35.3 Å²	35.3	52%	0.524	19%	0.187	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.7	179.3	179	-150.1	-17.1	0	0	0	112	R287	D285-R287 PolarHBondContact O-N 2.87Å
286	I	95.5	Very high	95.8	Very high	65 Å²	65	30.7 Å²	30.7	33%	0.333	16%	0.157	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.8	119.8	169.1	-60.6	167.7	0	0	0	108.4	L312 C347 R349 A374	I286-L312 HydrophobicContact CD1-CD2 4.11Å; I286-L312 HydrophobicContact CG1-CD2 4.09Å; I286-L312 HydrophobicContact CG2-CD2 3.69Å; I286-C347 HydrophobicContact CG2-CB 4.29Å; I286-R349 HydrophobicContact CG1-CB 4.18Å; I286-A374 HydrophobicContact CG2-CB 4.28Å; I286-A374 WeakPolarHBondContact O-CB 3.32Å
287	R	94.4	Very high	95.6	Very high	16 Å²	16	27.9 Å²	27.9	6%	0.06	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	153.8	-176.6	-71.1	174.9	164.8	-94.4	-5.2	111.2	K203 E204 G205 D284 D285 F289 C347 G348 S371	K203-R287 VanDerWaalsContact O-CZ 3.25Å; K203-R287 PolarHBondContact O-NH1 2.93Å; K203-R287 PolarHBondContact O-NH2 3.12Å; E204-R287 PolarHBondContact O-NH1 3.43Å; G205-R287 VanDerWaalsContact CA-NH2 3.31Å; D284-R287 IonicContact OD1-CZ 3.83Å; D284-R287 IonicContact OD1-NE 3.69Å; D284-R287 PolarHBondContact OD1-NE 3.49Å; D284-R287 IonicContact OD1-NH2 3.82Å; D284-R287 PolarHBondContact OD1-NH2 2.88Å; D284-R287 IonicContact OD2-NH2 2.8Å; D284-R287 PolarHBondContact OD2-NH2 2.87Å; D285-R287 PolarHBondContact O-N 2.87Å; R287-F289 HydrophobicContact CB-CE1 4.5Å; R287-F289 HydrophobicContact CB-CE2 3.97Å; R287-F289 HydrophobicContact CB-CZ 3.92Å; R287-C347 CarbonylContact O-C 3.48Å; R287-C347 VanDerWaalsContact O-CA 3.26Å; R287-C347 WeakPolarHBondContact O-CA 3.25Å; R287-G348 PolarHBondContact N-O 2.83Å; R287-G348 PolarHBondContact O-N 3.46Å; R287-S371 PolarHBondContact NH1-OG 2.97Å
288	N	94.3	Very high	95.1	Very high	38 Å²	38	29.4 Å²	29.4	20%	0.203	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	101.6	176.7	-172.6	7.2	0	0	0	110.2	K345 S371 G372	N288-K345 VanDerWaalsContact OD1-CA 3.27Å; N288-K345 WeakPolarHBondContact OD1-CA 3.18Å; N288-K345 WeakPolarHBondContact OD1-CB 3.4Å; N288-K345 PolarHBondContact OD1-O 2.8Å; N288-S371 VanDerWaalsContact O-CA 3.25Å; N288-S371 WeakPolarHBondContact O-CA 3.39Å; N288-G372 PolarHBondContact N-O 3.48Å; N288-G372 PolarHBondContact O-N 2.93Å
289	F	95.2	Very high	94.4	Very high	0 Å²	0	25.7 Å²	25.7	0%	0	14%	0.135	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.6	134.5	-172.8	-64.6	-84.2	0	0	0	112.9	F283 R287 F310 I343 K345 Q346 G348 V351 F369 E370	F283-F289 HydrophobicContact CD1-CE1 4.33Å; F283-F289 HydrophobicContact CD1-CZ 4.13Å; F283-F289 HydrophobicContact CD2-CE1 4.34Å; F283-F289 AromaticContact CD2-CZ 3.67Å; F283-F289 HydrophobicContact CD2-CZ 3.67Å; F283-F289 AromaticContact CE1-CE1 3.81Å; F283-F289 HydrophobicContact CE1-CE1 3.81Å; F283-F289 HydrophobicContact CE1-CZ 4.01Å; F283-F289 AromaticContact CE2-CE1 3.82Å; F283-F289 HydrophobicContact CE2-CE1 3.82Å; F283-F289 AromaticContact CE2-CZ 3.55Å; F283-F289 HydrophobicContact CE2-CZ 3.55Å; F283-F289 AromaticContact CG-CZ 3.97Å; F283-F289 HydrophobicContact CG-CZ 3.97Å; F283-F289 AromaticContact CZ-CE1 3.53Å; F283-F289 HydrophobicContact CZ-CE1 3.53Å; F283-F289 AromaticContact CZ-CZ 3.73Å; F283-F289 HydrophobicContact CZ-CZ 3.73Å; R287-F289 HydrophobicContact CB-CE1 4.5Å; R287-F289 HydrophobicContact CB-CE2 3.97Å; R287-F289 HydrophobicContact CB-CZ 3.92Å; F289-F310 HydrophobicContact CB-CE1 3.74Å; F289-F310 HydrophobicContact CB-CZ 4.28Å; F289-F310 AromaticContact CD2-CD1 3.6Å; F289-F310 HydrophobicContact CD2-CD1 3.6Å; F289-F310 AromaticContact CD2-CE1 3.5Å; F289-F310 HydrophobicContact CD2-CE1 3.5Å; F289-F310 HydrophobicContact CE2-CD1 4.1Å; F289-F310 HydrophobicContact CE2-CE1 4.24Å; F289-F310 HydrophobicContact CG-CD1 4.25Å; F289-F310 AromaticContact CG-CE1 3.66Å; F289-F310 HydrophobicContact CG-CE1 3.66Å; F289-I343 HydrophobicContact CB-CD1 4.03Å; F289-I343 HydrophobicContact CB-CG2 4.17Å; F289-I343 VanDerWaalsContact O-CG2 3.22Å; F289-I343 WeakPolarHBondContact O-CG2 3.32Å; F289-K345 WeakPolarHBondContact O-CA 3.4Å; F289-K345 PolarHBondContact O-N 3.21Å; F289-Q346 WeakPolarHBondContact CD2-O 3.05Å; F289-Q346 PolarHBondContact N-O 2.74Å; F289-Q346 PolarHBondContact O-N 2.84Å; F289-Q346 VanDerWaalsContact O-N 3.09Å; F289-G348 WeakPolarHBondContact CE2-O 3.34Å; F289-V351 HydrophobicContact CD2-CG2 4.33Å; F289-V351 HydrophobicContact CE1-CG2 4.2Å; F289-V351 HydrophobicContact CE2-CG2 3.73Å; F289-V351 HydrophobicContact CZ-CG2 3.67Å; F289-F369 HydrophobicContact CD1-CB 4.14Å; F289-F369 HydrophobicContact CD1-CD1 4.01Å; F289-F369 HydrophobicContact CD1-CG 4.46Å; F289-F369 HydrophobicContact CE1-CB 4.02Å; F289-F369 HydrophobicContact CE1-CD1 4.02Å; F289-F369 HydrophobicContact CE1-CG 4.23Å; F289-E370 WeakPolarHBondContact CA-O 3.36Å
290	T	94.4	Very high	93.5	Very high	46 Å²	46	27.5 Å²	27.5	28%	0.282	15%	0.148	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	-25.3	-179.4	51.2	0	0	0	0	113.9	I343 K345 E370	T290-I343 CarbonylContact C-O 3.59Å; T290-I343 WeakPolarHBondContact CA-O 3.47Å; T290-I343 PolarHBondContact O-N 3Å; T290-I343 VanDerWaalsContact O-O 3.08Å; T290-K345 HydrophobicContact CG2-CG 4.05Å; T290-E370 PolarHBondContact N-O 3.45Å; T290-E370 WeakPolarHBondContact OG1-CB 3.41Å; T290-E370 PolarHBondContact OG1-O 2.9Å
291	A	94.7	Very high	92.8	Very high	5 Å²	5	25.4 Å²	25.4	4%	0.041	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-155.3	151.3	175.8	0	0	0	0	0	112.4	I341 E370	A291-I341 WeakPolarHBondContact CA-O 3.37Å; A291-E370 HydrophobicContact CB-CB 3.96Å; A291-E370 HydrophobicContact CB-CG 4.07Å; A291-E370 PolarHBondContact N-O 3.16Å; A291-E370 PolarHBondContact O-N 2.99Å
292	L	95.8	Very high	92.3	Very high	0 Å²	0	25.4 Å²	25.4	0%	0	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	125	165.8	163.3	62.4	0	0	0	107.3	L294 V308 S340 I341 I343 V353 V367 R368 F369	L292-L294 HydrophobicContact CD1-CD2 3.94Å; L292-L294 HydrophobicContact CD1-CG 4.44Å; L292-L294 HydrophobicContact CG-CD2 4.45Å; L292-L294 HydrophobicContact CG-CG 4.48Å; L292-V308 HydrophobicContact CD2-CG2 3.58Å; L292-S340 CarbonylContact O-C 3.52Å; L292-S340 WeakPolarHBondContact O-CA 3.18Å; L292-I341 HydrophobicContact CB-CB 4.46Å; L292-I341 HydrophobicContact CD2-CD1 4.3Å; L292-I341 PolarHBondContact N-O 2.96Å; L292-I341 PolarHBondContact O-N 3.08Å; L292-I343 HydrophobicContact CB-CD1 4.02Å; L292-V353 HydrophobicContact CD2-CG1 3.92Å; L292-V353 HydrophobicContact CD2-CG2 3.73Å; L292-V367 HydrophobicContact CD1-CG1 3.82Å; L292-R368 CarbonylContact C-O 3.53Å; L292-R368 WeakPolarHBondContact CA-O 3.42Å; L292-F369 HydrophobicContact CB-CE1 4.44Å; L292-F369 HydrophobicContact CD1-CD1 4.1Å; L292-F369 HydrophobicContact CD1-CE1 3.65Å; L292-F369 HydrophobicContact CD1-CE2 4.3Å; L292-F369 HydrophobicContact CD1-CZ 3.76Å; L292-F369 HydrophobicContact CG-CE1 4.45Å
293	S	95.3	Very high	92.1	Very high	14 Å²	14	23.7 Å²	23.7	10%	0.098	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	135.1	176.3	-60.7	0	0	0	0	110.5	L339 S340 V367 R368	S293-L339 CarbonylContact C-O 3.56Å; S293-L339 WeakPolarHBondContact CA-O 3.2Å; S293-S340 PolarHBondContact OG-OG 2.74Å; S293-V367 CarbonylContact O-C 3.45Å; S293-V367 WeakPolarHBondContact O-CA 3.4Å; S293-R368 PolarHBondContact N-O 2.91Å; S293-R368 PolarHBondContact O-N 3.19Å
294	L	96.1	Very high	92	Very high	4 Å²	4	29 Å²	29	2%	0.021	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	127.6	179.7	-57.4	175.2	0	0	0	108.4	L292 V296 L339 I355 V367	L292-L294 HydrophobicContact CD1-CD2 3.94Å; L292-L294 HydrophobicContact CD1-CG 4.44Å; L292-L294 HydrophobicContact CG-CD2 4.45Å; L292-L294 HydrophobicContact CG-CG 4.48Å; L294-V296 HydrophobicContact CB-CG2 3.77Å; L294-L339 HydrophobicContact CB-CB 4.44Å; L294-L339 HydrophobicContact CD1-CD2 4.35Å; L294-L339 PolarHBondContact N-O 3.34Å; L294-L339 PolarHBondContact O-N 2.67Å; L294-I355 HydrophobicContact CD1-CD1 3.65Å; L294-V367 HydrophobicContact CD2-CB 4.2Å; L294-V367 HydrophobicContact CD2-CG1 3.83Å; L294-V367 HydrophobicContact CD2-CG2 3.71Å
295	H	96.1	Very high	92	Very high	12 Å²	12	27.8 Å²	27.8	6%	0.056	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89	112	170.1	-170.1	-105.8	0	0	0	109.3	T249 G250 W269 W338 I364 S365 E366	T249-H295 HydrophobicContact CG2-CB 4.42Å; G250-H295 PolarHBondContact O-CE1 3.08Å; W269-H295 AromaticContact CH2-CE1 3.65Å; W269-H295 AromaticContact CH2-ND1 3.54Å; H295-W338 HydrophobicContact CB-CD2 4.07Å; H295-W338 HydrophobicContact CB-CE3 3.88Å; H295-W338 HydrophobicContact CB-CH2 3.78Å; H295-W338 HydrophobicContact CB-CZ2 3.98Å; H295-W338 HydrophobicContact CB-CZ3 3.73Å; H295-W338 AromaticContact CD2-CD1 3.8Å; H295-W338 AromaticContact CD2-CD2 3.86Å; H295-W338 AromaticContact CD2-CE2 3.58Å; H295-W338 AromaticContact CD2-NE1 3.52Å; H295-I364 WeakPolarHBondContact O-CA 3.16Å; H295-S365 PolarHBondContact ND1-OG 3.37Å; H295-S365 PolarHBondContact O-N 3.21Å; H295-S365 VanDerWaalsContact O-N 3.07Å; H295-E366 HydrophobicContact CB-CB 3.83Å; H295-E366 PolarHBondContact N-O 3.19Å
296	V	95.1	Very high	92.1	Very high	0 Å²	0	23.1 Å²	23.1	0%	0	12%	0.123	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	136.9	-168.2	-169.5	0	0	0	0	109.4	L294 D298 I303 P336 D337 L339 L362 L363 I364	L294-V296 HydrophobicContact CB-CG2 3.77Å; V296-D298 VanDerWaalsContact C-N 3.26Å; V296-D298 PolarHBondContact O-N 2.88Å; V296-I303 HydrophobicContact CG1-CD1 4.19Å; V296-I303 HydrophobicContact CG2-CD1 4.04Å; V296-P336 WeakPolarHBondContact O-CA 3.21Å; V296-D337 PolarHBondContact N-O 2.78Å; V296-D337 PolarHBondContact O-N 3.09Å; V296-L339 HydrophobicContact CG2-CB 4.44Å; V296-L362 HydrophobicContact CG1-CD1 4.03Å; V296-L363 WeakPolarHBondContact CA-O 3.37Å; V296-L363 WeakPolarHBondContact CG1-O 3.35Å; V296-I364 HydrophobicContact CG2-CG1 4.44Å
297	M	92.2	Very high	92.2	Very high	21 Å²	21	20.5 Å²	20.5	10%	0.103	11%	0.111	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.2	-36.4	-179.6	178.8	65.2	83.6	0	0	112.5	F253 W269 G335 P336 L363	F253-M297 HydrophobicContact CD1-CE 3.13Å; F253-M297 HydrophobicContact CE1-CE 3.07Å; F253-M297 HydrophobicContact CG-CE 3.99Å; F253-M297 HydrophobicContact CZ-CE 3.89Å; W269-M297 HydrophobicContact CD2-CE 4.05Å; W269-M297 HydrophobicContact CE3-CB 4.22Å; W269-M297 HydrophobicContact CG-CE 4.4Å; W269-M297 VanDerWaalsContact CH2-CA 3.45Å; W269-M297 HydrophobicContact CH2-CB 3.82Å; W269-M297 HydrophobicContact CH2-CE 4.44Å; W269-M297 VanDerWaalsContact CH2-N 3.27Å; W269-M297 HydrophobicContact CH2-SD 4.44Å; W269-M297 HydrophobicContact CZ2-CB 4.11Å; W269-M297 HydrophobicContact CZ2-CE 3.56Å; W269-M297 HydrophobicContact CZ2-SD 3.91Å; W269-M297 HydrophobicContact CZ3-CB 3.88Å; W269-M297 VanDerWaalsContact NE1-CE 3.31Å; M297-G335 CarbonylContact O-C 3.42Å; M297-P336 HydrophobicContact SD-CG 3.72Å; M297-L363 HydrophobicContact CB-CB 3.72Å; M297-L363 HydrophobicContact CB-CD1 3.93Å; M297-L363 HydrophobicContact CB-CG 4.4Å; M297-L363 HydrophobicContact CE-CD1 4.23Å; M297-L363 HydrophobicContact CG-CD1 4.02Å; M297-L363 PolarHBondContact N-O 2.73Å; M297-L363 VanDerWaalsContact N-O 3.13Å
298	D	87.5	Confident	92.3	Very high	31 Å²	31	19.8 Å²	19.8	17%	0.166	11%	0.109	C	C	.	.	T	Hydrogen-bonded Turn	trans	-155.9	75.2	-178.6	-175.7	-4.5	0	0	0	109.1	V296 S300 N301 S302 P334	V296-D298 VanDerWaalsContact C-N 3.26Å; V296-D298 PolarHBondContact O-N 2.88Å; D298-S300 VanDerWaalsContact C-N 3.3Å; D298-S300 PolarHBondContact O-N 2.78Å; D298-S300 PolarHBondContact OD1-OG 3.05Å; D298-N301 VanDerWaalsContact CG-CB 3.48Å; D298-N301 VanDerWaalsContact CG-ND2 3.31Å; D298-N301 PolarHBondContact O-N 3.1Å; D298-N301 WeakPolarHBondContact OD1-CB 3.26Å; D298-N301 VanDerWaalsContact OD1-CG 3.28Å; D298-N301 PolarHBondContact OD1-N 3.18Å; D298-N301 PolarHBondContact OD1-ND2 3.02Å; D298-N301 VanDerWaalsContact OD1-ND2 3.12Å; D298-N301 WeakPolarHBondContact OD2-CB 3.09Å; D298-N301 PolarHBondContact OD2-ND2 3.02Å; D298-S302 VanDerWaalsContact O-CB 3.29Å; D298-S302 WeakPolarHBondContact O-CB 3.37Å; D298-S302 PolarHBondContact O-N 3.45Å; D298-S302 PolarHBondContact O-OG 3.15Å; D298-P334 HydrophobicContact CB-CB 4.1Å; D298-P334 WeakPolarHBondContact OD2-CB 3.15Å
299	S	81.3	Confident	92.4	Very high	21 Å²	21	18.3 Å²	18.3	15%	0.147	10%	0.101	C	C	.	.	H	α-helix	trans	-57.8	-43.6	-178	57.1	0	0	0	0	111.8	N301 I303	S299-N301 PolarHBondContact O-N 3.17Å; S299-I303 PolarHBondContact O-N 2.88Å
300	S	79.7	Confident	92.5	Very high	43 Å²	43	18.4 Å²	18.4	30%	0.301	10%	0.102	S	C	.	.	H	α-helix	trans	-58.6	-31	-176.8	72.6	0	0	0	0	113.9	D298	D298-S300 VanDerWaalsContact C-N 3.3Å; D298-S300 PolarHBondContact O-N 2.78Å; D298-S300 PolarHBondContact OD1-OG 3.05Å
301	N	83	Confident	92.6	Very high	21 Å²	21	16.3 Å²	16.3	11%	0.112	9%	0.089	C	C	.	.	H	α-helix	trans	-110.5	-23	-174.4	-61.5	-33.1	0	0	0	114.1	D298 S299 Y327 T358 K360	D298-N301 VanDerWaalsContact CG-CB 3.48Å; D298-N301 VanDerWaalsContact CG-ND2 3.31Å; D298-N301 PolarHBondContact O-N 3.1Å; D298-N301 WeakPolarHBondContact OD1-CB 3.26Å; D298-N301 VanDerWaalsContact OD1-CG 3.28Å; D298-N301 PolarHBondContact OD1-N 3.18Å; D298-N301 PolarHBondContact OD1-ND2 3.02Å; D298-N301 VanDerWaalsContact OD1-ND2 3.12Å; D298-N301 WeakPolarHBondContact OD2-CB 3.09Å; D298-N301 PolarHBondContact OD2-ND2 3.02Å; S299-N301 PolarHBondContact O-N 3.17Å; N301-Y327 WeakPolarHBondContact OD1-CD2 3.34Å; N301-Y327 WeakPolarHBondContact OD1-CE2 3.1Å; N301-T358 WeakPolarHBondContact O-CB 3.31Å; N301-T358 VanDerWaalsContact O-CG2 3.25Å; N301-T358 WeakPolarHBondContact O-CG2 3.31Å; N301-T358 PolarHBondContact O-OG1 3.38Å; N301-K360 HydrophobicContact CB-CD 4.18Å
302	S	88.4	Confident	92.7	Very high	2 Å²	2	20.9 Å²	20.9	1%	0.014	11%	0.112	C	C	.	.	H	α-helix	trans	-94.8	-26.6	-175.6	63.3	0	0	0	0	113.2	D298 N357 T358	D298-S302 VanDerWaalsContact O-CB 3.29Å; D298-S302 WeakPolarHBondContact O-CB 3.37Å; D298-S302 PolarHBondContact O-N 3.45Å; D298-S302 PolarHBondContact O-OG 3.15Å; S302-N357 VanDerWaalsContact O-CA 3.28Å; S302-N357 WeakPolarHBondContact O-CA 3.49Å; S302-N357 PolarHBondContact O-OD1 2.77Å; S302-T358 PolarHBondContact O-N 2.9Å
303	I	92.7	Very high	92.6	Very high	1 Å²	1	24.5 Å²	24.5	1%	0.005	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	132.1	-175	-57.3	176.6	0	0	0	110.4	V296 S299 F325 L339 I355 L362	V296-I303 HydrophobicContact CG1-CD1 4.19Å; V296-I303 HydrophobicContact CG2-CD1 4.04Å; S299-I303 PolarHBondContact O-N 2.88Å; I303-F325 HydrophobicContact CB-CD2 4.3Å; I303-F325 HydrophobicContact CG2-CD2 3.44Å; I303-F325 VanDerWaalsContact CG2-CD2 3.44Å; I303-F325 HydrophobicContact CG2-CE2 3.89Å; I303-F325 HydrophobicContact CG2-CG 4.17Å; I303-F325 WeakPolarHBondContact O-CB 3.31Å; I303-L339 HydrophobicContact CD1-CD2 3.73Å; I303-I355 HydrophobicContact CD1-CG2 4.25Å; I303-I355 HydrophobicContact CG1-CG2 3.96Å; I303-I355 HydrophobicContact CG2-CG2 3.95Å; I303-L362 HydrophobicContact CD1-CD1 3.99Å; I303-L362 HydrophobicContact CG1-CD1 3.69Å
304	K	93	Very high	92.5	Very high	113 Å²	113	24.8 Å²	24.8	49%	0.491	14%	0.136	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.2	-41	172.6	179.8	176.8	175.5	-179.7	0	111.9	F325 R356 T358	K304-F325 PolarHBondContact O-N 2.92Å; K304-R356 WeakPolarHBondContact CB-O 3.44Å; K304-R356 PolarHBondContact N-O 3.19Å; K304-T358 HydrophobicContact CB-CG2 4.19Å
305	E	94.1	Very high	92.4	Very high	32 Å²	32	34.4 Å²	34.4	15%	0.15	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.9	134.7	-172.2	-178.7	-176	173.5	0	0	108.5	V322 E323 Y324 R356	E305-V322 HydrophobicContact CG-CG1 3.59Å; E305-V322 WeakPolarHBondContact OE1-CG1 3.39Å; E305-E323 CarbonylContact C-O 3.59Å; E305-E323 WeakPolarHBondContact CA-O 3.3Å; E305-Y324 HydrophobicContact CB-CD1 4.21Å; E305-Y324 HydrophobicContact CB-CE1 4.37Å; E305-Y324 HydrophobicContact CG-CD1 3.98Å; E305-Y324 HydrophobicContact CG-CE1 3.76Å; E305-R356 HydrophobicContact CB-CB 3.86Å; E305-R356 PolarHBondContact N-O 3.2Å; E305-R356 PolarHBondContact O-N 2.87Å; E305-R356 IonicContact OE2-NH1 3.63Å; E305-R356 PolarHBondContact OE2-NH1 3Å
306	A	95.9	Very high	92.3	Very high	0 Å²	0	40.6 Å²	40.6	0%	0	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	126.9	169.3	0	0	0	0	0	108.9	E323 F325 I341 N354	A306-E323 PolarHBondContact N-O 2.97Å; A306-E323 PolarHBondContact O-N 2.69Å; A306-F325 HydrophobicContact CB-CE2 3.71Å; A306-F325 HydrophobicContact CB-CZ 4.46Å; A306-I341 HydrophobicContact CB-CD1 3.52Å; A306-N354 WeakPolarHBondContact CA-O 3.25Å
307	A	96.3	Very high	92.2	Very high	10 Å²	10	44 Å²	44	8%	0.083	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	127.8	-176.4	0	0	0	0	0	109.9	T320 L321 V322 V353 N354	A307-T320 HydrophobicContact CB-CG2 3.59Å; A307-L321 CarbonylContact C-O 3.6Å; A307-L321 VanDerWaalsContact CA-O 3.27Å; A307-L321 WeakPolarHBondContact CA-O 3.41Å; A307-V322 HydrophobicContact CB-CG2 4.19Å; A307-V353 CarbonylContact O-C 3.49Å; A307-V353 WeakPolarHBondContact O-CA 3.2Å; A307-N354 HydrophobicContact CB-CB 4.16Å; A307-N354 PolarHBondContact N-O 2.91Å; A307-N354 PolarHBondContact O-N 2.84Å
308	V	97.3	Very high	92	Very high	1 Å²	1	45.1 Å²	45.1	1%	0.006	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	128.5	-176.2	-169.1	0	0	0	0	110.1	L292 F310 T320 L321 V351 L352 V353	L292-V308 HydrophobicContact CD2-CG2 3.58Å; V308-F310 HydrophobicContact CB-CE2 4.48Å; V308-F310 HydrophobicContact CG1-CE1 4.26Å; V308-F310 HydrophobicContact CG1-CE2 3.76Å; V308-F310 HydrophobicContact CG1-CZ 3.49Å; V308-F310 VanDerWaalsContact CG1-CZ 3.49Å; V308-T320 WeakPolarHBondContact O-CA 3.46Å; V308-L321 PolarHBondContact N-O 3.2Å; V308-L321 PolarHBondContact O-N 3.48Å; V308-V351 HydrophobicContact CG1-CG1 3.71Å; V308-L352 CarbonylContact C-O 3.53Å; V308-L352 WeakPolarHBondContact CA-O 3.41Å; V308-V353 HydrophobicContact CG1-CG2 4.33Å; V308-V353 HydrophobicContact CG2-CG2 4.48Å
309	S	97	Very high	91.9	Very high	7 Å²	7	51.4 Å²	51.4	5%	0.049	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131	145.7	178.9	-81.4	0	0	0	0	110.7	T320 V351 L352	S309-T320 WeakPolarHBondContact OG-CA 2.99Å; S309-T320 WeakPolarHBondContact OG-CB 3.32Å; S309-T320 PolarHBondContact OG-OG1 3.13Å; S309-V351 WeakPolarHBondContact O-CA 3.4Å; S309-L352 PolarHBondContact N-O 3.3Å; S309-L352 PolarHBondContact O-N 2.77Å
310	F	96.9	Very high	92.3	Very high	2 Å²	2	53 Å²	53	1%	0.009	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	145.3	-175.8	-57.9	-91.5	0	0	0	110.6	F289 V308 F317 S318 L321 I343 Q346 F350 V351	F289-F310 HydrophobicContact CB-CE1 3.74Å; F289-F310 HydrophobicContact CB-CZ 4.28Å; F289-F310 AromaticContact CD2-CD1 3.6Å; F289-F310 HydrophobicContact CD2-CD1 3.6Å; F289-F310 AromaticContact CD2-CE1 3.5Å; F289-F310 HydrophobicContact CD2-CE1 3.5Å; F289-F310 HydrophobicContact CE2-CD1 4.1Å; F289-F310 HydrophobicContact CE2-CE1 4.24Å; F289-F310 HydrophobicContact CG-CD1 4.25Å; F289-F310 AromaticContact CG-CE1 3.66Å; F289-F310 HydrophobicContact CG-CE1 3.66Å; V308-F310 HydrophobicContact CB-CE2 4.48Å; V308-F310 HydrophobicContact CG1-CE1 4.26Å; V308-F310 HydrophobicContact CG1-CE2 3.76Å; V308-F310 HydrophobicContact CG1-CZ 3.49Å; V308-F310 VanDerWaalsContact CG1-CZ 3.49Å; F310-F317 CarbonylContact O-C 3.59Å; F310-F317 WeakPolarHBondContact O-CA 3.31Å; F310-S318 PolarHBondContact N-OG 2.75Å; F310-S318 WeakPolarHBondContact O-CB 3.41Å; F310-S318 PolarHBondContact O-N 3.3Å; F310-S318 PolarHBondContact O-OG 2.92Å; F310-L321 HydrophobicContact CE2-CD1 3.91Å; F310-I343 HydrophobicContact CE1-CD1 4.35Å; F310-I343 HydrophobicContact CE2-CG2 4.02Å; F310-I343 HydrophobicContact CZ-CD1 3.71Å; F310-I343 HydrophobicContact CZ-CG1 4.14Å; F310-I343 HydrophobicContact CZ-CG2 3.73Å; F310-Q346 HydrophobicContact CD1-CB 4.26Å; F310-Q346 HydrophobicContact CD2-CB 3.58Å; F310-Q346 HydrophobicContact CD2-CG 3.98Å; F310-Q346 HydrophobicContact CE1-CB 4.38Å; F310-Q346 HydrophobicContact CE2-CB 3.72Å; F310-Q346 HydrophobicContact CE2-CG 3.97Å; F310-Q346 HydrophobicContact CG-CB 3.9Å; F310-Q346 HydrophobicContact CZ-CB 4.13Å; F310-F350 CarbonylContact C-O 3.59Å; F310-F350 WeakPolarHBondContact CA-O 3.25Å; F310-V351 HydrophobicContact CD1-CG1 4.28Å; F310-V351 HydrophobicContact CD1-CG2 3.8Å; F310-V351 HydrophobicContact CE1-CG1 3.94Å; F310-V351 HydrophobicContact CE1-CG2 3.88Å; F310-V351 HydrophobicContact CZ-CG1 4.45Å
311	S	97.2	Very high	92.9	Very high	3 Å²	3	52.8 Å²	52.8	2%	0.021	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.6	145.7	174.5	-179.7	0	0	0	0	110.7	D313 G314 R315 H316 R349 F350	S311-D313 PolarHBondContact OG-N 3.14Å; S311-D313 PolarHBondContact OG-OD1 3.48Å; S311-G314 WeakPolarHBondContact OG-CA 3.1Å; S311-G314 PolarHBondContact OG-N 2.85Å; S311-R315 PolarHBondContact OG-N 2.74Å; S311-H316 WeakPolarHBondContact CB-O 3.28Å; S311-H316 PolarHBondContact OG-O 3.05Å; S311-R349 PolarHBondContact O-N 3.38Å; S311-F350 PolarHBondContact N-O 2.96Å; S311-F350 PolarHBondContact O-N 2.77Å
312	L	96.1	Very high	93.3	Very high	100 Å²	100	54.6 Å²	54.6	52%	0.524	27%	0.27	S	S	.	.	S	Bend	trans	-89.6	-27.5	173.9	-60.8	176.8	0	0	0	111.9	I286 F350	I286-L312 HydrophobicContact CD1-CD2 4.11Å; I286-L312 HydrophobicContact CG1-CD2 4.09Å; I286-L312 HydrophobicContact CG2-CD2 3.69Å; L312-F350 WeakPolarHBondContact O-CE2 3.48Å
313	D	94.2	Very high	93.4	Very high	77 Å²	77	57.8 Å²	57.8	41%	0.412	28%	0.284	S	S	.	.	S	Bend	trans	-116.6	-5.3	-172.8	70.6	-11.7	0	0	0	113.9	S311 R315 H316 F350	S311-D313 PolarHBondContact OG-N 3.14Å; S311-D313 PolarHBondContact OG-OD1 3.48Å; D313-R315 VanDerWaalsContact C-N 3.25Å; D313-R315 PolarHBondContact O-N 2.88Å; D313-R315 PolarHBondContact OD1-N 3.32Å; D313-H316 PolarHBondContact OD1-N 2.88Å; D313-H316 IonicContact OD1-ND1 2.8Å; D313-H316 IonicContact OD2-CE1 3.88Å; D313-H316 IonicContact OD2-CG 2.59Å; D313-H316 IonicContact OD2-ND1 3.43Å; D313-H316 PolarHBondContact OD2-ND1 2.88Å; D313-F350 VanDerWaalsContact C-CE2 3.43Å
314	G	93.4	Very high	93.2	Very high	19 Å²	19	65.2 Å²	65.2	20%	0.196	31%	0.314	C	S	.	.	S	Bend	trans	77.9	7.3	-178.6	0	0	0	0	0	113.7	S311 F350	S311-G314 WeakPolarHBondContact OG-CA 3.1Å; S311-G314 PolarHBondContact OG-N 2.85Å; G314-F350 VanDerWaalsContact CA-CD2 3.5Å; G314-F350 VanDerWaalsContact N-CE2 3.31Å
315	R	92.7	Very high	92.8	Very high	207 Å²	207	61.9 Å²	61.9	78%	0.781	30%	0.299	S	S	*	.	S	Bend	trans	-122.4	-45.1	-177	-61.9	-177.9	179.4	-168.9	-0.3	112.1	S311 D313	S311-R315 PolarHBondContact OG-N 2.74Å; D313-R315 VanDerWaalsContact C-N 3.25Å; D313-R315 PolarHBondContact O-N 2.88Å; D313-R315 PolarHBondContact OD1-N 3.32Å
316	H	93.6	Very high	92	Very high	141 Å²	141	71.1 Å²	71.1	65%	0.653	33%	0.333	S	S	*	.	S	Bend	trans	-103.7	112.4	-179.1	-58.3	93.9	0	0	0	108.9	S311 D313	S311-H316 WeakPolarHBondContact CB-O 3.28Å; S311-H316 PolarHBondContact OG-O 3.05Å; D313-H316 PolarHBondContact OD1-N 2.88Å; D313-H316 IonicContact OD1-ND1 2.8Å; D313-H316 IonicContact OD2-CE1 3.88Å; D313-H316 IonicContact OD2-CG 2.59Å; D313-H316 IonicContact OD2-ND1 3.43Å; D313-H316 PolarHBondContact OD2-ND1 2.88Å
317	F	93	Very high	90.9	Very high	73 Å²	73	77.7 Å²	77.7	32%	0.32	36%	0.358	S	S	.	.	B	Isolated β-bridge	trans	-96	140.3	179.8	-76.1	-91.7	0	0	0	111	Y280 F310 L352	Y280-F317 HydrophobicContact CD2-CZ 4.39Å; Y280-F317 AromaticContact CE2-CZ 3.88Å; Y280-F317 HydrophobicContact CE2-CZ 3.88Å; F310-F317 CarbonylContact O-C 3.59Å; F310-F317 WeakPolarHBondContact O-CA 3.31Å; F317-L352 HydrophobicContact CD1-CB 4.07Å; F317-L352 HydrophobicContact CE1-CB 3.61Å; F317-L352 HydrophobicContact CZ-CB 4.18Å
318	S	87.9	Confident	89.6	Confident	43 Å²	43	84.1 Å²	84.1	30%	0.301	39%	0.387	S	S	.	.			trans	-62.8	174.6	173.6	70.4	0	0	0	0	111.5	F310 T320	F310-S318 PolarHBondContact N-OG 2.75Å; F310-S318 WeakPolarHBondContact O-CB 3.41Å; F310-S318 PolarHBondContact O-N 3.3Å; F310-S318 PolarHBondContact O-OG 2.92Å; S318-T320 PolarHBondContact O-N 3.33Å
319	H	86.2	Confident	88.1	Confident	163 Å²	163	90.7 Å²	90.7	76%	0.755	42%	0.422	S	S	*	.	P	Polyproline II helix	trans	-50.4	133.7	166.8	-176	-79.7	0	0	0	110.7
320	T	90.1	Very high	86.4	Confident	54 Å²	54	93.6 Å²	93.6	33%	0.331	44%	0.442	S	S	.	.	P	Polyproline II helix	trans	-76.4	122.8	180	-51.8	0	0	0	0	110.5	A307 V308 S309 S318 V322	A307-T320 HydrophobicContact CB-CG2 3.59Å; V308-T320 WeakPolarHBondContact O-CA 3.46Å; S309-T320 WeakPolarHBondContact OG-CA 2.99Å; S309-T320 WeakPolarHBondContact OG-CB 3.32Å; S309-T320 PolarHBondContact OG-OG1 3.13Å; S318-T320 PolarHBondContact O-N 3.33Å; T320-V322 HydrophobicContact CG2-CG2 3.84Å
321	L	91.6	Very high	84.7	Confident	40 Å²	40	99.6 Å²	99.6	21%	0.209	48%	0.484	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.6	125.7	166.7	-59.9	174.1	0	0	0	107.8	A307 V308 F310 I343 P344 Q346	A307-L321 CarbonylContact C-O 3.6Å; A307-L321 VanDerWaalsContact CA-O 3.27Å; A307-L321 WeakPolarHBondContact CA-O 3.41Å; V308-L321 PolarHBondContact N-O 3.2Å; V308-L321 PolarHBondContact O-N 3.48Å; F310-L321 HydrophobicContact CE2-CD1 3.91Å; L321-I343 HydrophobicContact CD1-CB 4.29Å; L321-I343 HydrophobicContact CD1-CG1 4.23Å; L321-I343 HydrophobicContact CD1-CG2 3.8Å; L321-P344 HydrophobicContact CD1-CG 4.35Å; L321-P344 HydrophobicContact CD2-CG 4.04Å; L321-Q346 HydrophobicContact CD1-CG 4.2Å
322	V	92.1	Very high	83.1	Confident	58 Å²	58	104.6 Å²	104.6	35%	0.352	51%	0.514	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	126.1	-177.7	-174.8	0	0	0	0	109	E305 A307 T320 Y324	E305-V322 HydrophobicContact CG-CG1 3.59Å; E305-V322 WeakPolarHBondContact OE1-CG1 3.39Å; A307-V322 HydrophobicContact CB-CG2 4.19Å; T320-V322 HydrophobicContact CG2-CG2 3.84Å; V322-Y324 HydrophobicContact CB-CE2 4.37Å; V322-Y324 HydrophobicContact CG1-CD2 4.23Å; V322-Y324 HydrophobicContact CG1-CE1 4.01Å; V322-Y324 HydrophobicContact CG1-CE2 3.67Å
323	E	90	Very high	81.6	Confident	70 Å²	70	103.4 Å²	103.4	33%	0.327	52%	0.519	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	135.2	168.4	-120.4	-164.3	-165.3	0	0	110.6	E305 A306 F325 I341	E305-E323 CarbonylContact C-O 3.59Å; E305-E323 WeakPolarHBondContact CA-O 3.3Å; A306-E323 PolarHBondContact N-O 2.97Å; A306-E323 PolarHBondContact O-N 2.69Å; E323-F325 HydrophobicContact CB-CE2 4.1Å; E323-F325 HydrophobicContact CB-CZ 3.98Å; E323-F325 WeakPolarHBondContact OE2-CE1 3.35Å; E323-F325 WeakPolarHBondContact OE2-CZ 3.41Å; E323-I341 HydrophobicContact CB-CG2 4.39Å; E323-I341 HydrophobicContact CG-CG2 4.44Å
324	Y	88.6	Confident	80.6	Confident	157 Å²	157	103.3 Å²	103.3	62%	0.616	52%	0.523	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-109.4	128.1	-179.1	-67.8	-78	0	0	0	110.2	E305 V322	E305-Y324 HydrophobicContact CB-CD1 4.21Å; E305-Y324 HydrophobicContact CB-CE1 4.37Å; E305-Y324 HydrophobicContact CG-CD1 3.98Å; E305-Y324 HydrophobicContact CG-CE1 3.76Å; V322-Y324 HydrophobicContact CB-CE2 4.37Å; V322-Y324 HydrophobicContact CG1-CD2 4.23Å; V322-Y324 HydrophobicContact CG1-CE1 4.01Å; V322-Y324 HydrophobicContact CG1-CE2 3.67Å
325	F	84.7	Confident	80.2	Confident	42 Å²	42	103.6 Å²	103.6	18%	0.184	53%	0.525	C	S	.	.	P	Polyproline II helix	trans	-102.3	120.5	179.8	-61	-78.2	0	0	0	109.1	I303 K304 A306 E323 L339 I341	I303-F325 HydrophobicContact CB-CD2 4.3Å; I303-F325 HydrophobicContact CG2-CD2 3.44Å; I303-F325 VanDerWaalsContact CG2-CD2 3.44Å; I303-F325 HydrophobicContact CG2-CE2 3.89Å; I303-F325 HydrophobicContact CG2-CG 4.17Å; I303-F325 WeakPolarHBondContact O-CB 3.31Å; K304-F325 PolarHBondContact O-N 2.92Å; A306-F325 HydrophobicContact CB-CE2 3.71Å; A306-F325 HydrophobicContact CB-CZ 4.46Å; E323-F325 HydrophobicContact CB-CE2 4.1Å; E323-F325 HydrophobicContact CB-CZ 3.98Å; E323-F325 WeakPolarHBondContact OE2-CE1 3.35Å; E323-F325 WeakPolarHBondContact OE2-CZ 3.41Å; F325-L339 HydrophobicContact CD1-CD1 4.1Å; F325-L339 HydrophobicContact CE1-CD1 3.12Å; F325-L339 HydrophobicContact CE1-CD2 3.89Å; F325-L339 HydrophobicContact CE1-CG 4.11Å; F325-L339 HydrophobicContact CE2-CD2 4.07Å; F325-L339 HydrophobicContact CZ-CD1 3.44Å; F325-L339 VanDerWaalsContact CZ-CD1 3.44Å; F325-L339 HydrophobicContact CZ-CD2 3.56Å; F325-L339 HydrophobicContact CZ-CG 4.03Å; F325-I341 HydrophobicContact CZ-CG1 4.49Å
326	R	77	Confident	80.2	Confident	227 Å²	227	95.6 Å²	95.6	86%	0.857	50%	0.5	S	S	*	.	P	Polyproline II helix	trans	-89.3	131.6	172.8	-67.8	-174.9	-173.8	174	3.7	108	E328	R326-E328 PolarHBondContact O-N 2.74Å; R326-E328 VanDerWaalsContact O-N 3.13Å
327	Y	72.8	Confident	80	Confident	137 Å²	137	93.2 Å²	93.2	54%	0.537	49%	0.492	S	S	.	.	P	Polyproline II helix	trans	-57.5	117.5	168.3	175.3	-106.9	0	0	0	109	N301 N329	N301-Y327 WeakPolarHBondContact OD1-CD2 3.34Å; N301-Y327 WeakPolarHBondContact OD1-CE2 3.1Å; Y327-N329 WeakPolarHBondContact CE1-OD1 3.48Å; Y327-N329 PolarHBondContact OH-OD1 3.24Å
328	E	68.6	Low	80	Confident	146 Å²	146	93.9 Å²	93.9	68%	0.682	49%	0.493	S	S	*	.	P	Polyproline II helix	trans	-98.5	120.3	178.3	-148.5	150	-139.3	0	0	107.4	R326 S330	R326-E328 PolarHBondContact O-N 2.74Å; R326-E328 VanDerWaalsContact O-N 3.13Å; E328-S330 PolarHBondContact O-N 2.85Å
329	N	65.5	Low	80.2	Confident	139 Å²	139	92.6 Å²	92.6	74%	0.743	48%	0.482	S	S	*	.			trans	-71.2	63.9	171	-85.3	-33.5	0	0	0	108.9	Y327	Y327-N329 WeakPolarHBondContact CE1-OD1 3.48Å; Y327-N329 PolarHBondContact OH-OD1 3.24Å
330	S	62.8	Low	80.5	Confident	68 Å²	68	87.9 Å²	87.9	48%	0.476	47%	0.468	S	S	.	.			trans	-76.5	136.2	173.2	-172.5	0	0	0	0	108.9	E328 V332	E328-S330 PolarHBondContact O-N 2.85Å; S330-V332 PolarHBondContact O-N 3.07Å; S330-V332 VanDerWaalsContact OG-CB 3.31Å; S330-V332 WeakPolarHBondContact OG-CB 3.44Å; S330-V332 VanDerWaalsContact OG-CG2 3.31Å; S330-V332 WeakPolarHBondContact OG-CG2 3.44Å; S330-V332 PolarHBondContact OG-N 2.97Å; S330-V332 VanDerWaalsContact OG-N 3.16Å
331	S	61.5	Low	80.6	Confident	128 Å²	128	85.7 Å²	85.7	90%	0.895	45%	0.454	S	S	*	.	S	Bend	trans	-75.9	-7.1	167.6	59.1	0	0	0	0	112.5
332	V	62.9	Low	80.7	Confident	108 Å²	108	94.2 Å²	94.2	66%	0.655	48%	0.483	S	S	*	.	S	Bend	trans	-71.7	132.1	176.1	-175	0	0	0	0	108	S330	S330-V332 PolarHBondContact O-N 3.07Å; S330-V332 VanDerWaalsContact OG-CB 3.31Å; S330-V332 WeakPolarHBondContact OG-CB 3.44Å; S330-V332 VanDerWaalsContact OG-CG2 3.31Å; S330-V332 WeakPolarHBondContact OG-CG2 3.44Å; S330-V332 PolarHBondContact OG-N 2.97Å; S330-V332 VanDerWaalsContact OG-N 3.16Å
333	A	65.3	Low	80.7	Confident	75 Å²	75	91.6 Å²	91.6	62%	0.62	47%	0.468	S	S	*	.	P	Polyproline II helix	trans	-57.4	137.3	176.5	0	0	0	0	0	109.7	G335	A333-G335 PolarHBondContact O-N 3.27Å
334	P	72.3	Confident	80.8	Confident	75 Å²	75	92.2 Å²	92.2	49%	0.487	48%	0.477	S	S	.	.	P	Polyproline II helix	trans	-62.2	129	175.5	26.2	-32.6	0	0	0	109.3	D298	D298-P334 HydrophobicContact CB-CB 4.1Å; D298-P334 WeakPolarHBondContact OD2-CB 3.15Å
335	G	84.5	Confident	80.8	Confident	24 Å²	24	92 Å²	92	25%	0.247	48%	0.479	C	S	.	.			trans	-151.5	166.1	179	0	0	0	0	0	111.5	M297 A333 D337	M297-G335 CarbonylContact O-C 3.42Å; A333-G335 PolarHBondContact O-N 3.27Å; G335-D337 PolarHBondContact O-N 3.45Å
336	P	92.2	Very high	81.2	Confident	39 Å²	39	93 Å²	93	25%	0.253	49%	0.485	S	S	.	.			trans	-55.3	131.7	-176.1	-22.1	30.1	0	0	0	112.3	E252 W269 V296 M297	E252-P336 HydrophobicContact CB-CG 3.93Å; W269-P336 HydrophobicContact CH2-CB 3.98Å; W269-P336 HydrophobicContact CH2-CG 4.35Å; W269-P336 HydrophobicContact CZ2-CB 3.99Å; W269-P336 HydrophobicContact CZ2-CG 3.91Å; V296-P336 WeakPolarHBondContact O-CA 3.21Å; M297-P336 HydrophobicContact SD-CG 3.72Å
337	D	91.2	Very high	82	Confident	92 Å²	92	85.1 Å²	85.1	49%	0.492	46%	0.464	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.7	160.1	178.2	-160.8	10.8	0	0	0	112.4	V296 G335	V296-D337 PolarHBondContact N-O 2.78Å; V296-D337 PolarHBondContact O-N 3.09Å; G335-D337 PolarHBondContact O-N 3.45Å
338	W	92.6	Very high	83.1	Confident	86 Å²	86	78.6 Å²	78.6	33%	0.326	44%	0.438	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.9	114.2	174.8	-75.6	98.6	0	0	0	111	T249 H295 E366 R368	T249-W338 HydrophobicContact CG2-CH2 4.18Å; T249-W338 HydrophobicContact CG2-CZ2 3.37Å; H295-W338 HydrophobicContact CB-CD2 4.07Å; H295-W338 HydrophobicContact CB-CE3 3.88Å; H295-W338 HydrophobicContact CB-CH2 3.78Å; H295-W338 HydrophobicContact CB-CZ2 3.98Å; H295-W338 HydrophobicContact CB-CZ3 3.73Å; H295-W338 AromaticContact CD2-CD1 3.8Å; H295-W338 AromaticContact CD2-CD2 3.86Å; H295-W338 AromaticContact CD2-CE2 3.58Å; H295-W338 AromaticContact CD2-NE1 3.52Å; W338-E366 HydrophobicContact CH2-CB 3.87Å; W338-E366 HydrophobicContact CH2-CG 3.62Å; W338-E366 HydrophobicContact CZ3-CB 4.46Å; W338-E366 HydrophobicContact CZ3-CG 4.37Å; W338-R368 VanDerWaalsContact CH2-CD 3.4Å; W338-R368 HydrophobicContact CH2-CG 4.02Å; W338-R368 VanDerWaalsContact CZ2-CZ 3.43Å; W338-R368 HydrophobicContact CZ3-CG 4.05Å
339	L	91.5	Very high	84.4	Confident	16 Å²	16	76.1 Å²	76.1	8%	0.084	42%	0.423	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.1	118.5	167.6	168.4	58.9	0	0	0	109.7	S293 L294 V296 I303 F325	S293-L339 CarbonylContact C-O 3.56Å; S293-L339 WeakPolarHBondContact CA-O 3.2Å; L294-L339 HydrophobicContact CB-CB 4.44Å; L294-L339 HydrophobicContact CD1-CD2 4.35Å; L294-L339 PolarHBondContact N-O 3.34Å; L294-L339 PolarHBondContact O-N 2.67Å; V296-L339 HydrophobicContact CG2-CB 4.44Å; I303-L339 HydrophobicContact CD1-CD2 3.73Å; F325-L339 HydrophobicContact CD1-CD1 4.1Å; F325-L339 HydrophobicContact CE1-CD1 3.12Å; F325-L339 HydrophobicContact CE1-CD2 3.89Å; F325-L339 HydrophobicContact CE1-CG 4.11Å; F325-L339 HydrophobicContact CE2-CD2 4.07Å; F325-L339 HydrophobicContact CZ-CD1 3.44Å; F325-L339 VanDerWaalsContact CZ-CD1 3.44Å; F325-L339 HydrophobicContact CZ-CD2 3.56Å; F325-L339 HydrophobicContact CZ-CG 4.03Å
340	S	91.7	Very high	85.9	Confident	65 Å²	65	70.9 Å²	70.9	46%	0.455	39%	0.394	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	124.1	178.2	-165.8	0	0	0	0	112.4	L292 S293	L292-S340 CarbonylContact O-C 3.52Å; L292-S340 WeakPolarHBondContact O-CA 3.18Å; S293-S340 PolarHBondContact OG-OG 2.74Å
341	I	92.9	Very high	87.6	Confident	7 Å²	7	67.7 Å²	67.7	4%	0.036	37%	0.371	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	114.9	177.9	-53.4	178.5	0	0	0	108	A291 L292 A306 E323 F325	A291-I341 WeakPolarHBondContact CA-O 3.37Å; L292-I341 HydrophobicContact CB-CB 4.46Å; L292-I341 HydrophobicContact CD2-CD1 4.3Å; L292-I341 PolarHBondContact N-O 2.96Å; L292-I341 PolarHBondContact O-N 3.08Å; A306-I341 HydrophobicContact CB-CD1 3.52Å; E323-I341 HydrophobicContact CB-CG2 4.39Å; E323-I341 HydrophobicContact CG-CG2 4.44Å; F325-I341 HydrophobicContact CZ-CG1 4.49Å
342	R	93.4	Very high	89.3	Confident	219 Å²	219	63.3 Å²	63.3	83%	0.826	34%	0.338	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-75.4	128.6	177.3	-178.3	173.9	-104.3	175.7	-5	110.9
343	I	93	Very high	91	Very high	4 Å²	4	58.3 Å²	58.3	2%	0.021	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	126.7	178.8	-61.6	160.3	0	0	0	108.6	F289 T290 L292 F310 L321 K345 Q346	F289-I343 HydrophobicContact CB-CD1 4.03Å; F289-I343 HydrophobicContact CB-CG2 4.17Å; F289-I343 VanDerWaalsContact O-CG2 3.22Å; F289-I343 WeakPolarHBondContact O-CG2 3.32Å; T290-I343 CarbonylContact C-O 3.59Å; T290-I343 WeakPolarHBondContact CA-O 3.47Å; T290-I343 PolarHBondContact O-N 3Å; T290-I343 VanDerWaalsContact O-O 3.08Å; L292-I343 HydrophobicContact CB-CD1 4.02Å; F310-I343 HydrophobicContact CE1-CD1 4.35Å; F310-I343 HydrophobicContact CE2-CG2 4.02Å; F310-I343 HydrophobicContact CZ-CD1 3.71Å; F310-I343 HydrophobicContact CZ-CG1 4.14Å; F310-I343 HydrophobicContact CZ-CG2 3.73Å; L321-I343 HydrophobicContact CD1-CB 4.29Å; L321-I343 HydrophobicContact CD1-CG1 4.23Å; L321-I343 HydrophobicContact CD1-CG2 3.8Å; I343-K345 PolarHBondContact O-N 3.25Å; I343-Q346 HydrophobicContact CG2-CB 3.74Å; I343-Q346 HydrophobicContact CG2-CG 3.73Å
344	P	91.4	Very high	92.5	Very high	82 Å²	82	56.3 Å²	56.3	53%	0.532	29%	0.286	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.9	69.6	178.9	33.7	-34.5	0	0	0	110.8	L321 Q346	L321-P344 HydrophobicContact CD1-CG 4.35Å; L321-P344 HydrophobicContact CD2-CG 4.04Å; P344-Q346 PolarHBondContact O-N 3.04Å; P344-Q346 PolarHBondContact O-NE2 3.3Å
345	K	89	Confident	93.6	Very high	152 Å²	152	52.8 Å²	52.8	66%	0.661	26%	0.263	S	S	*	.	E	Extended strand (participates in β ladder)	trans	44.7	68	174.3	-68.9	-172.3	177.1	-167.8	0	113	N288 F289 T290 I343	N288-K345 VanDerWaalsContact OD1-CA 3.27Å; N288-K345 WeakPolarHBondContact OD1-CA 3.18Å; N288-K345 WeakPolarHBondContact OD1-CB 3.4Å; N288-K345 PolarHBondContact OD1-O 2.8Å; F289-K345 WeakPolarHBondContact O-CA 3.4Å; F289-K345 PolarHBondContact O-N 3.21Å; T290-K345 HydrophobicContact CG2-CG 4.05Å; I343-K345 PolarHBondContact O-N 3.25Å
346	Q	92.2	Very high	94.2	Very high	64 Å²	64	57.6 Å²	57.6	30%	0.299	27%	0.274	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98	128.5	-179.5	-68.4	-62.1	-42.8	0	0	110.7	F289 F310 L321 I343 P344	F289-Q346 WeakPolarHBondContact CD2-O 3.05Å; F289-Q346 PolarHBondContact N-O 2.74Å; F289-Q346 PolarHBondContact O-N 2.84Å; F289-Q346 VanDerWaalsContact O-N 3.09Å; F310-Q346 HydrophobicContact CD1-CB 4.26Å; F310-Q346 HydrophobicContact CD2-CB 3.58Å; F310-Q346 HydrophobicContact CD2-CG 3.98Å; F310-Q346 HydrophobicContact CE1-CB 4.38Å; F310-Q346 HydrophobicContact CE2-CB 3.72Å; F310-Q346 HydrophobicContact CE2-CG 3.97Å; F310-Q346 HydrophobicContact CG-CB 3.9Å; F310-Q346 HydrophobicContact CZ-CB 4.13Å; L321-Q346 HydrophobicContact CD1-CG 4.2Å; I343-Q346 HydrophobicContact CG2-CB 3.74Å; I343-Q346 HydrophobicContact CG2-CG 3.73Å; P344-Q346 PolarHBondContact O-N 3.04Å; P344-Q346 PolarHBondContact O-NE2 3.3Å
347	C	94.2	Very high	94.2	Very high	62 Å²	62	56.2 Å²	56.2	42%	0.419	26%	0.264	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.8	133.3	174.7	-63.1	0	0	0	0	110.8	I286 R287	I286-C347 HydrophobicContact CG2-CB 4.29Å; R287-C347 CarbonylContact O-C 3.48Å; R287-C347 VanDerWaalsContact O-CA 3.26Å; R287-C347 WeakPolarHBondContact O-CA 3.25Å
348	G	95.4	Very high	94.2	Very high	0 Å²	0	55 Å²	55	0%	0	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-161.7	155.4	177.4	0	0	0	0	0	111.7	R287 F289	R287-G348 PolarHBondContact N-O 2.83Å; R287-G348 PolarHBondContact O-N 3.46Å; F289-G348 WeakPolarHBondContact CE2-O 3.34Å
349	R	96	Very high	93.9	Very high	94 Å²	94	53.6 Å²	53.6	36%	0.355	27%	0.272	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.4	-26.2	163.6	-179.3	175.5	179.4	-169.5	4.1	111.4	L282 F283 I286 S311	L282-R349 HydrophobicContact CD1-CG 4.42Å; F283-R349 WeakPolarHBondContact CD2-O 3.45Å; F283-R349 PolarHBondContact N-O 3.2Å; F283-R349 PolarHBondContact O-NE 2.87Å; I286-R349 HydrophobicContact CG1-CB 4.18Å; S311-R349 PolarHBondContact O-N 3.38Å
350	F	97.7	Very high	93.7	Very high	29 Å²	29	57.8 Å²	57.8	13%	0.127	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	133.1	178.4	-53.6	-91.1	0	0	0	108.7	Y280 F281 L282 F310 S311 L312 D313 G314	Y280-F350 AromaticContact CE1-CD1 3.86Å; Y280-F350 HydrophobicContact CE1-CD1 3.86Å; Y280-F350 HydrophobicContact CE2-CB 4.4Å; Y280-F350 AromaticContact CZ-CD1 3.51Å; Y280-F350 WeakPolarHBondContact OH-CD1 3.43Å; Y280-F350 VanDerWaalsContact OH-CE1 3.28Å; Y280-F350 WeakPolarHBondContact OH-CE1 3.36Å; F281-F350 VanDerWaalsContact O-CA 3.31Å; F281-F350 WeakPolarHBondContact O-CA 3.42Å; L282-F350 HydrophobicContact CB-CD1 4.48Å; L282-F350 HydrophobicContact CD1-CD1 3.76Å; L282-F350 HydrophobicContact CD1-CE1 3.43Å; L282-F350 VanDerWaalsContact CD1-CE1 3.43Å; L282-F350 HydrophobicContact CD1-CZ 4.06Å; F310-F350 CarbonylContact C-O 3.59Å; F310-F350 WeakPolarHBondContact CA-O 3.25Å; S311-F350 PolarHBondContact N-O 2.96Å; S311-F350 PolarHBondContact O-N 2.77Å; L312-F350 WeakPolarHBondContact O-CE2 3.48Å; D313-F350 VanDerWaalsContact C-CE2 3.43Å; G314-F350 VanDerWaalsContact CA-CD2 3.5Å; G314-F350 VanDerWaalsContact N-CE2 3.31Å
351	V	97.7	Very high	93.7	Very high	0 Å²	0	55.6 Å²	55.6	0%	0	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123	127.5	179.5	-172.1	0	0	0	0	108.9	Y280 F281 F283 F289 V308 S309 F310 V353 F369	Y280-V351 CarbonylContact C-O 3.58Å; Y280-V351 WeakPolarHBondContact CA-O 3.49Å; F281-V351 HydrophobicContact CB-CB 4.26Å; F281-V351 PolarHBondContact N-O 2.77Å; F281-V351 PolarHBondContact O-N 2.95Å; F283-V351 HydrophobicContact CD2-CG2 4.2Å; F283-V351 HydrophobicContact CE2-CB 4.32Å; F283-V351 HydrophobicContact CE2-CG2 3.67Å; F289-V351 HydrophobicContact CD2-CG2 4.33Å; F289-V351 HydrophobicContact CE1-CG2 4.2Å; F289-V351 HydrophobicContact CE2-CG2 3.73Å; F289-V351 HydrophobicContact CZ-CG2 3.67Å; V308-V351 HydrophobicContact CG1-CG1 3.71Å; S309-V351 WeakPolarHBondContact O-CA 3.4Å; F310-V351 HydrophobicContact CD1-CG1 4.28Å; F310-V351 HydrophobicContact CD1-CG2 3.8Å; F310-V351 HydrophobicContact CE1-CG1 3.94Å; F310-V351 HydrophobicContact CE1-CG2 3.88Å; F310-V351 HydrophobicContact CZ-CG1 4.45Å; V351-V353 HydrophobicContact CG1-CG2 4.11Å; V351-F369 HydrophobicContact CB-CE1 4.32Å; V351-F369 HydrophobicContact CG1-CE1 3.88Å; V351-F369 HydrophobicContact CG1-CZ 4.4Å
352	L	97.9	Very high	93.8	Very high	37 Å²	37	55.3 Å²	55.3	19%	0.194	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.1	123.7	173	-179.9	68.8	0	0	0	108.2	F279 V308 S309 F317	F279-L352 WeakPolarHBondContact O-CA 3.44Å; V308-L352 CarbonylContact C-O 3.53Å; V308-L352 WeakPolarHBondContact CA-O 3.41Å; S309-L352 PolarHBondContact N-O 3.3Å; S309-L352 PolarHBondContact O-N 2.77Å; F317-L352 HydrophobicContact CD1-CB 4.07Å; F317-L352 HydrophobicContact CE1-CB 3.61Å; F317-L352 HydrophobicContact CZ-CB 4.18Å
353	V	97.9	Very high	94	Very high	2 Å²	2	45.1 Å²	45.1	1%	0.012	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	120.4	176.5	-177.7	0	0	0	0	108.7	F279 F281 L292 A307 V308 V351 I355 F369	F279-V353 HydrophobicContact CB-CB 4.27Å; F279-V353 PolarHBondContact N-O 2.75Å; F279-V353 PolarHBondContact O-N 3.04Å; F281-V353 HydrophobicContact CD2-CG2 4.14Å; F281-V353 HydrophobicContact CE2-CB 4.21Å; F281-V353 HydrophobicContact CE2-CG2 3.83Å; L292-V353 HydrophobicContact CD2-CG1 3.92Å; L292-V353 HydrophobicContact CD2-CG2 3.73Å; A307-V353 CarbonylContact O-C 3.49Å; A307-V353 WeakPolarHBondContact O-CA 3.2Å; V308-V353 HydrophobicContact CG1-CG2 4.33Å; V308-V353 HydrophobicContact CG2-CG2 4.48Å; V351-V353 HydrophobicContact CG1-CG2 4.11Å; V353-I355 HydrophobicContact CG1-CG1 4.12Å; V353-F369 HydrophobicContact CG2-CZ 4.39Å
354	N	97.3	Very high	94.2	Very high	34 Å²	34	45 Å²	45	18%	0.182	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	116.5	180	-69.7	-22.1	0	0	0	108.9	L276 E278 A306 A307	L276-N354 HydrophobicContact CD1-CB 4.17Å; E278-N354 WeakPolarHBondContact CB-OD1 3.33Å; E278-N354 VanDerWaalsContact CG-OD1 3.31Å; E278-N354 WeakPolarHBondContact CG-OD1 3.43Å; A306-N354 WeakPolarHBondContact CA-O 3.25Å; A307-N354 HydrophobicContact CB-CB 4.16Å; A307-N354 PolarHBondContact N-O 2.91Å; A307-N354 PolarHBondContact O-N 2.84Å
355	I	96.9	Very high	94.4	Very high	0 Å²	0	41.1 Å²	41.1	0%	0	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	115.7	179.6	-56.2	-174.8	0	0	0	109	L276 V277 F279 L294 I303 V353 L362 I364	L276-I355 WeakPolarHBondContact CA-O 3.43Å; V277-I355 PolarHBondContact N-O 3.14Å; V277-I355 PolarHBondContact O-N 2.85Å; F279-I355 HydrophobicContact CD2-CD1 4.29Å; F279-I355 HydrophobicContact CD2-CG1 4.37Å; F279-I355 HydrophobicContact CE2-CB 4.49Å; F279-I355 HydrophobicContact CE2-CD1 3.66Å; F279-I355 HydrophobicContact CE2-CG1 4Å; F279-I355 HydrophobicContact CZ-CD1 4.5Å; L294-I355 HydrophobicContact CD1-CD1 3.65Å; I303-I355 HydrophobicContact CD1-CG2 4.25Å; I303-I355 HydrophobicContact CG1-CG2 3.96Å; I303-I355 HydrophobicContact CG2-CG2 3.95Å; V353-I355 HydrophobicContact CG1-CG1 4.12Å; I355-L362 HydrophobicContact CB-CD2 4.3Å; I355-L362 HydrophobicContact CD1-CD2 4.44Å; I355-L362 HydrophobicContact CG2-CD2 3.76Å; I355-I364 HydrophobicContact CD1-CD1 3.67Å
356	R	95.8	Very high	94.8	Very high	126 Å²	126	34 Å²	34	48%	0.475	18%	0.177	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.6	119.4	171.7	-158.6	177.9	-153.6	137.3	10.1	109.6	P275 K304 E305	P275-R356 WeakPolarHBondContact O-CA 3.29Å; P275-R356 WeakPolarHBondContact O-CG 3.46Å; K304-R356 WeakPolarHBondContact CB-O 3.44Å; K304-R356 PolarHBondContact N-O 3.19Å; E305-R356 HydrophobicContact CB-CB 3.86Å; E305-R356 PolarHBondContact N-O 3.2Å; E305-R356 PolarHBondContact O-N 2.87Å; E305-R356 IonicContact OE2-NH1 3.63Å; E305-R356 PolarHBondContact OE2-NH1 3Å
357	N	92.7	Very high	95	Very high	9 Å²	9	31.1 Å²	31.1	5%	0.048	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.6	151.1	-179	-169.7	-25	0	0	0	110.9	W272 K274 P275 S302 G359 K360	W272-N357 PolarHBondContact O-ND2 2.96Å; K274-N357 VanDerWaalsContact O-CB 3.25Å; K274-N357 WeakPolarHBondContact O-CB 3.29Å; P275-N357 PolarHBondContact O-N 3.41Å; S302-N357 VanDerWaalsContact O-CA 3.28Å; S302-N357 WeakPolarHBondContact O-CA 3.49Å; S302-N357 PolarHBondContact O-OD1 2.77Å; N357-G359 PolarHBondContact O-N 2.99Å; N357-G359 PolarHBondContact OD1-N 3Å; N357-K360 VanDerWaalsContact CG-O 3.29Å; N357-K360 PolarHBondContact ND2-O 3.06Å; N357-K360 PolarHBondContact OD1-N 3.25Å; N357-K360 VanDerWaalsContact OD1-N 3.12Å; N357-K360 PolarHBondContact OD1-O 3.16Å; N357-K360 VanDerWaalsContact OD1-O 3.09Å
358	T	90.6	Very high	95.1	Very high	66 Å²	66	31.4 Å²	31.4	41%	0.405	16%	0.156	S	C	.	.			trans	-70.7	-8.3	169.7	63.1	0	0	0	0	113.3	N301 S302 K304	N301-T358 WeakPolarHBondContact O-CB 3.31Å; N301-T358 VanDerWaalsContact O-CG2 3.25Å; N301-T358 WeakPolarHBondContact O-CG2 3.31Å; N301-T358 PolarHBondContact O-OG1 3.38Å; S302-T358 PolarHBondContact O-N 2.9Å; K304-T358 HydrophobicContact CB-CG2 4.19Å
359	G	86.2	Confident	95.1	Very high	57 Å²	57	32 Å²	32	59%	0.588	16%	0.158	S	C	*	.	S	Bend	trans	99	4.2	-172.9	0	0	0	0	0	113.5	N357	N357-G359 PolarHBondContact O-N 2.99Å; N357-G359 PolarHBondContact OD1-N 3Å
360	K	88.8	Confident	95	Very high	104 Å²	104	30.9 Å²	30.9	45%	0.452	16%	0.157	S	C	.	.	S	Bend	trans	-89	179.9	172	-66.2	-173.1	-177.4	174.9	0	110.5	N301 N357 L362	N301-K360 HydrophobicContact CB-CD 4.18Å; N357-K360 VanDerWaalsContact CG-O 3.29Å; N357-K360 PolarHBondContact ND2-O 3.06Å; N357-K360 PolarHBondContact OD1-N 3.25Å; N357-K360 VanDerWaalsContact OD1-N 3.12Å; N357-K360 PolarHBondContact OD1-O 3.16Å; N357-K360 VanDerWaalsContact OD1-O 3.09Å; K360-L362 PolarHBondContact O-N 3.42Å
361	L	91.8	Very high	94.7	Very high	20 Å²	20	31 Å²	31	11%	0.105	16%	0.161	C	C	.	.			trans	-72.7	119.3	170.9	-176.5	68.7	0	0	0	109.2	Y217 F222 L255 T273 L363	Y217-L361 HydrophobicContact CD1-CB 4.46Å; Y217-L361 HydrophobicContact CD1-CD1 4.24Å; Y217-L361 HydrophobicContact CD1-CD2 3.54Å; Y217-L361 HydrophobicContact CD1-CG 4.29Å; Y217-L361 HydrophobicContact CD2-CD1 4.16Å; Y217-L361 HydrophobicContact CE1-CB 4.28Å; Y217-L361 HydrophobicContact CE1-CD2 3.93Å; Y217-L361 HydrophobicContact CG-CD1 3.85Å; Y217-L361 HydrophobicContact CG-CD2 4.03Å; Y217-L361 HydrophobicContact CG-CG 4.39Å; F222-L361 HydrophobicContact CD2-CD2 4.44Å; F222-L361 HydrophobicContact CE2-CD2 4.06Å; F222-L361 HydrophobicContact CZ-CD2 4.41Å; L255-L361 HydrophobicContact CD1-CD2 3.94Å; T273-L361 HydrophobicContact CG2-CD1 3.87Å; L361-L363 HydrophobicContact CD1-CD2 4.34Å; L361-L363 HydrophobicContact CD2-CD1 3.86Å; L361-L363 HydrophobicContact CD2-CD2 3.73Å; L361-L363 HydrophobicContact CD2-CG 3.78Å; L361-L363 HydrophobicContact CG-CD1 4.45Å; L361-L363 HydrophobicContact CG-CD2 3.89Å; L361-L363 HydrophobicContact CG-CG 3.88Å
362	L	95	Very high	94.1	Very high	0 Å²	0	32.5 Å²	32.5	0%	0	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.7	125.7	167.3	173.3	65.1	0	0	0	107.8	G271 W272 V277 V296 I303 I355 K360 I364	G271-L362 CarbonylContact C-O 3.55Å; G271-L362 WeakPolarHBondContact CA-O 3.26Å; W272-L362 HydrophobicContact CE3-CD2 4.27Å; W272-L362 HydrophobicContact CE3-CG 4.42Å; W272-L362 PolarHBondContact N-O 2.8Å; W272-L362 PolarHBondContact O-N 3.38Å; V277-L362 HydrophobicContact CG2-CD2 4.11Å; V296-L362 HydrophobicContact CG1-CD1 4.03Å; I303-L362 HydrophobicContact CD1-CD1 3.99Å; I303-L362 HydrophobicContact CG1-CD1 3.69Å; I355-L362 HydrophobicContact CB-CD2 4.3Å; I355-L362 HydrophobicContact CD1-CD2 4.44Å; I355-L362 HydrophobicContact CG2-CD2 3.76Å; K360-L362 PolarHBondContact O-N 3.42Å; L362-I364 HydrophobicContact CD1-CD1 4.3Å; L362-I364 HydrophobicContact CD1-CG1 4.09Å; L362-I364 HydrophobicContact CD2-CD1 4.21Å; L362-I364 HydrophobicContact CG-CD1 4.31Å; L362-I364 HydrophobicContact CG-CG1 4.18Å
363	L	95.9	Very high	93.1	Very high	6 Å²	6	35.4 Å²	35.4	3%	0.031	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125	123.5	175.6	-66.3	174.4	0	0	0	109	F222 F253 W269 V270 V296 M297 L361	F222-L363 HydrophobicContact CB-CD2 4.25Å; F222-L363 HydrophobicContact CD1-CD2 3.58Å; F222-L363 HydrophobicContact CD2-CD2 4.3Å; F222-L363 HydrophobicContact CE1-CD1 4.48Å; F222-L363 HydrophobicContact CE1-CD2 3.92Å; F222-L363 HydrophobicContact CG-CD2 3.79Å; F222-L363 HydrophobicContact CZ-CD2 4.41Å; F253-L363 HydrophobicContact CE1-CD1 3.92Å; F253-L363 HydrophobicContact CZ-CD1 3.5Å; W269-L363 HydrophobicContact CB-CB 4.29Å; W269-L363 HydrophobicContact CB-CD2 4.07Å; W269-L363 HydrophobicContact CD2-CB 4.14Å; W269-L363 HydrophobicContact CE3-CB 3.66Å; W269-L363 HydrophobicContact CG-CB 4.44Å; W269-L363 HydrophobicContact CZ3-CB 4.34Å; W269-L363 WeakPolarHBondContact CZ3-O 3.21Å; V270-L363 WeakPolarHBondContact O-CA 3.45Å; V296-L363 WeakPolarHBondContact CA-O 3.37Å; V296-L363 WeakPolarHBondContact CG1-O 3.35Å; M297-L363 HydrophobicContact CB-CB 3.72Å; M297-L363 HydrophobicContact CB-CD1 3.93Å; M297-L363 HydrophobicContact CB-CG 4.4Å; M297-L363 HydrophobicContact CE-CD1 4.23Å; M297-L363 HydrophobicContact CG-CD1 4.02Å; M297-L363 PolarHBondContact N-O 2.73Å; M297-L363 VanDerWaalsContact N-O 3.13Å; L361-L363 HydrophobicContact CD1-CD2 4.34Å; L361-L363 HydrophobicContact CD2-CD1 3.86Å; L361-L363 HydrophobicContact CD2-CD2 3.73Å; L361-L363 HydrophobicContact CD2-CG 3.78Å; L361-L363 HydrophobicContact CG-CD1 4.45Å; L361-L363 HydrophobicContact CG-CD2 3.89Å; L361-L363 HydrophobicContact CG-CG 3.88Å
364	I	97.7	Very high	91.6	Very high	0 Å²	0	37 Å²	37	0%	0	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	131.3	176.9	-55.8	-179.8	0	0	0	107.7	L244 V270 W272 F279 H295 V296 I355 L362 V367	L244-I364 HydrophobicContact CD2-CB 4.19Å; L244-I364 HydrophobicContact CD2-CG2 3.91Å; V270-I364 PolarHBondContact N-O 3.35Å; V270-I364 PolarHBondContact O-N 2.52Å; W272-I364 HydrophobicContact CZ3-CB 4.36Å; W272-I364 HydrophobicContact CZ3-CD1 4.33Å; W272-I364 HydrophobicContact CZ3-CG1 4.35Å; F279-I364 HydrophobicContact CE2-CD1 4.39Å; F279-I364 HydrophobicContact CZ-CD1 4.01Å; H295-I364 WeakPolarHBondContact O-CA 3.16Å; V296-I364 HydrophobicContact CG2-CG1 4.44Å; I355-I364 HydrophobicContact CD1-CD1 3.67Å; L362-I364 HydrophobicContact CD1-CD1 4.3Å; L362-I364 HydrophobicContact CD1-CG1 4.09Å; L362-I364 HydrophobicContact CD2-CD1 4.21Å; L362-I364 HydrophobicContact CG-CD1 4.31Å; L362-I364 HydrophobicContact CG-CG1 4.18Å; I364-V367 HydrophobicContact CG2-CG2 4.05Å
365	S	96.5	Very high	89.8	Confident	1 Å²	1	45.3 Å²	45.3	1%	0.007	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.2	-27.7	174.2	73.4	0	0	0	0	112.5	G250 Q268 H295	G250-S365 VanDerWaalsContact N-CB 3.3Å; G250-S365 PolarHBondContact N-OG 2.82Å; Q268-S365 VanDerWaalsContact O-CB 3.25Å; Q268-S365 WeakPolarHBondContact O-CB 3.41Å; H295-S365 PolarHBondContact ND1-OG 3.37Å; H295-S365 PolarHBondContact O-N 3.21Å; H295-S365 VanDerWaalsContact O-N 3.07Å
366	E	96.7	Very high	87.5	Confident	4 Å²	4	51.3 Å²	51.3	2%	0.019	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.8	144.2	-171.2	-170.1	64.5	-105.2	0	0	110.8	M245 G247 R248 H295 W338 R368	M245-E366 WeakPolarHBondContact CA-OE1 3.29Å; M245-E366 PolarHBondContact N-OE1 2.76Å; G247-E366 WeakPolarHBondContact CA-OE2 3.18Å; G247-E366 PolarHBondContact N-OE2 2.89Å; R248-E366 PolarHBondContact N-OE2 2.73Å; H295-E366 HydrophobicContact CB-CB 3.83Å; H295-E366 PolarHBondContact N-O 3.19Å; W338-E366 HydrophobicContact CH2-CB 3.87Å; W338-E366 HydrophobicContact CH2-CG 3.62Å; W338-E366 HydrophobicContact CZ3-CB 4.46Å; W338-E366 HydrophobicContact CZ3-CG 4.37Å; E366-R368 HydrophobicContact CG-CG 4.23Å
367	V	97.2	Very high	85.1	Confident	2 Å²	2	51 Å²	51	1%	0.012	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	134.2	176.2	179.8	0	0	0	0	107.9	L244 M245 F281 L292 S293 L294 I364 F369	L244-V367 HydrophobicContact CB-CG2 4.15Å; L244-V367 HydrophobicContact CD1-CG2 4.36Å; L244-V367 PolarHBondContact O-N 2.8Å; M245-V367 HydrophobicContact SD-CB 4.04Å; M245-V367 HydrophobicContact SD-CG1 4.49Å; F281-V367 HydrophobicContact CE1-CG1 4.07Å; F281-V367 HydrophobicContact CZ-CB 4.48Å; F281-V367 HydrophobicContact CZ-CG1 3.85Å; F281-V367 HydrophobicContact CZ-CG2 4.44Å; L292-V367 HydrophobicContact CD1-CG1 3.82Å; S293-V367 CarbonylContact O-C 3.45Å; S293-V367 WeakPolarHBondContact O-CA 3.4Å; L294-V367 HydrophobicContact CD2-CB 4.2Å; L294-V367 HydrophobicContact CD2-CG1 3.83Å; L294-V367 HydrophobicContact CD2-CG2 3.71Å; I364-V367 HydrophobicContact CG2-CG2 4.05Å; V367-F369 HydrophobicContact CG1-CD2 4.24Å; V367-F369 HydrophobicContact CG1-CE2 3.59Å; V367-F369 HydrophobicContact CG1-CZ 4.11Å
368	R	95.1	Very high	82.7	Confident	69 Å²	69	58.1 Å²	58.1	26%	0.26	31%	0.313	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.5	138.4	-178.9	-67.2	178.5	176.3	176.9	0.5	110.6	C38 L292 S293 W338 E366	C38-R368 WeakPolarHBondContact SG-CD 3.18Å; C38-R368 PolarHBondContact SG-NE 2.98Å; L292-R368 CarbonylContact C-O 3.53Å; L292-R368 WeakPolarHBondContact CA-O 3.42Å; S293-R368 PolarHBondContact N-O 2.91Å; S293-R368 PolarHBondContact O-N 3.19Å; W338-R368 VanDerWaalsContact CH2-CD 3.4Å; W338-R368 HydrophobicContact CH2-CG 4.02Å; W338-R368 VanDerWaalsContact CZ2-CZ 3.43Å; W338-R368 HydrophobicContact CZ3-CG 4.05Å; E366-R368 HydrophobicContact CG-CG 4.23Å
369	F	95.4	Very high	80.4	Confident	11 Å²	11	62 Å²	62	5%	0.048	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	124.1	174.3	-68.1	-88.9	0	0	0	109.4	F281 F283 F289 L292 V351 V353 V367	F281-F369 HydrophobicContact CB-CE2 4.46Å; F281-F369 HydrophobicContact CB-CZ 4.37Å; F281-F369 AromaticContact CD1-CE2 3.69Å; F281-F369 HydrophobicContact CD1-CE2 3.69Å; F281-F369 HydrophobicContact CD1-CZ 4.1Å; F281-F369 HydrophobicContact CD2-CE2 4.09Å; F281-F369 AromaticContact CD2-CZ 3.62Å; F281-F369 HydrophobicContact CD2-CZ 3.62Å; F281-F369 AromaticContact CE1-CE2 3.87Å; F281-F369 HydrophobicContact CE1-CE2 3.87Å; F281-F369 HydrophobicContact CE1-CZ 4.3Å; F281-F369 HydrophobicContact CE2-CE2 4.23Å; F281-F369 AromaticContact CE2-CZ 3.82Å; F281-F369 HydrophobicContact CE2-CZ 3.82Å; F281-F369 AromaticContact CG-CE2 3.82Å; F281-F369 HydrophobicContact CG-CE2 3.82Å; F281-F369 AromaticContact CG-CZ 3.77Å; F281-F369 HydrophobicContact CG-CZ 3.77Å; F281-F369 HydrophobicContact CZ-CE2 4.14Å; F281-F369 HydrophobicContact CZ-CZ 4.18Å; F283-F369 HydrophobicContact CE1-CB 4.36Å; F283-F369 HydrophobicContact CE1-CD2 4.43Å; F283-F369 HydrophobicContact CE1-CG 4.44Å; F283-F369 HydrophobicContact CZ-CB 4.11Å; F283-F369 HydrophobicContact CZ-CD1 4.2Å; F283-F369 AromaticContact CZ-CD2 3.68Å; F283-F369 HydrophobicContact CZ-CD2 3.68Å; F283-F369 HydrophobicContact CZ-CE2 4.09Å; F283-F369 AromaticContact CZ-CG 3.73Å; F283-F369 HydrophobicContact CZ-CG 3.73Å; F289-F369 HydrophobicContact CD1-CB 4.14Å; F289-F369 HydrophobicContact CD1-CD1 4.01Å; F289-F369 HydrophobicContact CD1-CG 4.46Å; F289-F369 HydrophobicContact CE1-CB 4.02Å; F289-F369 HydrophobicContact CE1-CD1 4.02Å; F289-F369 HydrophobicContact CE1-CG 4.23Å; L292-F369 HydrophobicContact CB-CE1 4.44Å; L292-F369 HydrophobicContact CD1-CD1 4.1Å; L292-F369 HydrophobicContact CD1-CE1 3.65Å; L292-F369 HydrophobicContact CD1-CE2 4.3Å; L292-F369 HydrophobicContact CD1-CZ 3.76Å; L292-F369 HydrophobicContact CG-CE1 4.45Å; V351-F369 HydrophobicContact CB-CE1 4.32Å; V351-F369 HydrophobicContact CG1-CE1 3.88Å; V351-F369 HydrophobicContact CG1-CZ 4.4Å; V353-F369 HydrophobicContact CG2-CZ 4.39Å; V367-F369 HydrophobicContact CG1-CD2 4.24Å; V367-F369 HydrophobicContact CG1-CE2 3.59Å; V367-F369 HydrophobicContact CG1-CZ 4.11Å
370	E	93.5	Very high	78.5	Confident	72 Å²	72	64.6 Å²	64.6	34%	0.336	33%	0.334	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89	119	166.4	-65	177.2	-162.2	0	0	108	I36 F289 T290 A291	I36-E370 HydrophobicContact CG2-CG 4.36Å; F289-E370 WeakPolarHBondContact CA-O 3.36Å; T290-E370 PolarHBondContact N-O 3.45Å; T290-E370 WeakPolarHBondContact OG1-CB 3.41Å; T290-E370 PolarHBondContact OG1-O 2.9Å; A291-E370 HydrophobicContact CB-CB 3.96Å; A291-E370 HydrophobicContact CB-CG 4.07Å; A291-E370 PolarHBondContact N-O 3.16Å; A291-E370 PolarHBondContact O-N 2.99Å
371	S	92.8	Very high	76.2	Confident	30 Å²	30	65.3 Å²	65.3	21%	0.21	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148	145.7	177.6	67.6	0	0	0	0	111.4	R287 N288	R287-S371 PolarHBondContact NH1-OG 2.97Å; N288-S371 VanDerWaalsContact O-CA 3.25Å; N288-S371 WeakPolarHBondContact O-CA 3.39Å
372	G	85	Confident	73.8	Confident	32 Å²	32	71.6 Å²	71.6	33%	0.33	38%	0.381	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	171	168.3	0	0	0	0	0	111.5	N288	N288-G372 PolarHBondContact N-O 3.48Å; N288-G372 PolarHBondContact O-N 2.93Å
373	D	76.8	Confident	71.1	Confident	99 Å²	99	74.6 Å²	74.6	53%	0.529	41%	0.412	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.6	136.9	171.1	-70.1	-28.5	0	0	0	109.6	Y375 D376	D373-Y375 PolarHBondContact O-N 2.89Å; D373-D376 PolarHBondContact O-N 2.79Å
374	A	67.2	Low	68.7	Low	34 Å²	34	81 Å²	81	28%	0.281	45%	0.454	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62	-17.2	-178.6	0	0	0	0	0	113.4	I286	I286-A374 HydrophobicContact CG2-CB 4.28Å; I286-A374 WeakPolarHBondContact O-CB 3.32Å
375	Y	59.2	Low	65.7	Low	209 Å²	209	88.3 Å²	88.3	82%	0.82	49%	0.486	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.3	2.3	-178.2	-65	-76.1	0	0	0	114.9	D373 V377	D373-Y375 PolarHBondContact O-N 2.89Å; Y375-V377 PolarHBondContact O-N 2.71Å
376	D	47.6	Very low	62.9	Low	127 Å²	127	94.6 Å²	94.6	68%	0.679	52%	0.524	S	S	*	.			trans	-75.1	66.5	170	-79.7	-21.7	0	0	0	110.9	D373	D373-D376 PolarHBondContact O-N 2.79Å
377	V	46.6	Very low	60.1	Low	118 Å²	118	97 Å²	97	72%	0.715	55%	0.55	S	S	*	.			trans	-89.4	97.2	153.7	-178.4	0	0	0	0	105.5	Y375 I379	Y375-V377 PolarHBondContact O-N 2.71Å; V377-I379 PolarHBondContact O-N 2.93Å
378	E	42.1	Very low	57	Low	160 Å²	160	107.1 Å²	107.1	75%	0.748	59%	0.588	S	S	*	*			trans	-52.7	107.4	167.1	-76	-176.6	158.7	0	0	108.6	V380	E378-V380 HydrophobicContact CB-CG2 4.36Å; E378-V380 PolarHBondContact O-N 2.86Å
379	I	42.4	Very low	54.5	Low	146 Å²	146	110.5 Å²	110.5	75%	0.749	61%	0.609	S	S	*	*			trans	-71.4	89.2	165.3	-55.7	177.4	0	0	0	105.2	V377 T381	V377-I379 PolarHBondContact O-N 2.93Å; I379-T381 VanDerWaalsContact C-N 3.31Å; I379-T381 HydrophobicContact CG2-CG2 3.92Å; I379-T381 PolarHBondContact O-N 2.88Å
380	V	44.6	Very low	52	Low	112 Å²	112	115.2 Å²	115.2	68%	0.679	64%	0.644	S	S	*	*			trans	-64	94.9	171.5	180	0	0	0	0	107.7	E378 D382	E378-V380 HydrophobicContact CB-CG2 4.36Å; E378-V380 PolarHBondContact O-N 2.86Å; V380-D382 VanDerWaalsContact C-N 3.33Å; V380-D382 PolarHBondContact O-N 3.43Å
381	T	42.1	Very low	49.7	Very low	119 Å²	119	116.6 Å²	116.6	73%	0.73	66%	0.662	S	S	*	*			trans	-83.9	77.6	172.3	53.9	0	0	0	0	109.2	I379	I379-T381 VanDerWaalsContact C-N 3.31Å; I379-T381 HydrophobicContact CG2-CG2 3.92Å; I379-T381 PolarHBondContact O-N 2.88Å
382	D	40.6	Very low	47.6	Very low	152 Å²	152	118.3 Å²	118.3	81%	0.813	67%	0.672	S	S	*	*			trans	-137.4	110.4	163	-97.7	-24.9	0	0	0	110.5	V380	V380-D382 VanDerWaalsContact C-N 3.33Å; V380-D382 PolarHBondContact O-N 3.43Å
383	G	39	Very low	46.6	Very low	63 Å²	63	120.1 Å²	120.1	65%	0.649	68%	0.68	S	S	*	*	S	Bend	trans	97.3	147.1	167.5	0	0	0	0	0	115.4	F385	G383-F385 PolarHBondContact O-N 2.84Å
384	P	45.5	Very low	46.4	Very low	141 Å²	141	123.5 Å²	123.5	92%	0.916	69%	0.69	S	S	*	*			trans	-77.8	69.4	174	34.7	-32	0	0	0	108.5
385	F	34.5	Very low	46.9	Very low	154 Å²	154	129.5 Å²	129.5	68%	0.675	71%	0.712	S	S	*	*			trans	-91	109.7	163.4	-163.9	-103	0	0	0	106.5	G383 G387 R388	G383-F385 PolarHBondContact O-N 2.84Å; F385-G387 VanDerWaalsContact C-N 3.31Å; F385-G387 PolarHBondContact O-N 3.16Å; F385-R388 HydrophobicContact CE1-CB 4.48Å
386	V	37.6	Very low	47.9	Very low	133 Å²	133	126.3 Å²	126.3	81%	0.806	70%	0.699	S	S	*	*			trans	-50.6	103.8	166.2	176.5	0	0	0	0	106.1	R388	V386-R388 PolarHBondContact O-N 3.45Å
387	G	37.6	Very low	49.5	Very low	54 Å²	54	123.2 Å²	123.2	56%	0.557	69%	0.685	S	S	*	*			trans	-50.9	112.4	-178.2	0	0	0	0	0	107.5	F385 I389	F385-G387 VanDerWaalsContact C-N 3.31Å; F385-G387 PolarHBondContact O-N 3.16Å; G387-I389 PolarHBondContact O-N 3.45Å
388	R	31.7	Very low	51.3	Low	215 Å²	215	126.1 Å²	126.1	81%	0.811	68%	0.683	S	S	*	*			trans	-69	86	167.8	-160.5	-174.5	-68.1	-174.4	-0.1	104	F385 V386 S390	F385-R388 HydrophobicContact CE1-CB 4.48Å; V386-R388 PolarHBondContact O-N 3.45Å; R388-S390 PolarHBondContact O-N 3.27Å
389	I	42.4	Very low	53.6	Low	139 Å²	139	123.4 Å²	123.4	71%	0.713	67%	0.673	S	S	*	*			trans	-46.5	113.3	167.9	-64.4	171.1	0	0	0	103.8	G387 S391	G387-I389 PolarHBondContact O-N 3.45Å; I389-S391 VanDerWaalsContact C-N 3.31Å; I389-S391 PolarHBondContact O-N 3.41Å
390	S	42.9	Very low	55.7	Low	111 Å²	111	120.3 Å²	120.3	78%	0.776	66%	0.658	S	S	*	*			trans	-46.7	107.9	168.8	-62.6	0	0	0	0	105.1	R388 P392	R388-S390 PolarHBondContact O-N 3.27Å; S390-P392 VanDerWaalsContact O-CD 3.31Å; S390-P392 WeakPolarHBondContact O-CD 3.45Å
391	S	44.9	Very low	57.7	Low	101 Å²	101	118.4 Å²	118.4	71%	0.706	65%	0.646	S	S	*	*			trans	-49.5	118.2	-172.5	46.8	0	0	0	0	106.3	I389 S393	I389-S391 VanDerWaalsContact C-N 3.31Å; I389-S391 PolarHBondContact O-N 3.41Å; S391-S393 PolarHBondContact O-N 3.16Å
392	P	48.7	Very low	60.1	Low	65 Å²	65	114.5 Å²	114.5	42%	0.422	63%	0.629	S	S	.	*			trans	-46.7	135	167.6	16.6	-29.5	0	0	0	106.6	S390 F394 V397	S390-P392 VanDerWaalsContact O-CD 3.31Å; S390-P392 WeakPolarHBondContact O-CD 3.45Å; P392-F394 PolarHBondContact O-N 3.09Å; P392-V397 HydrophobicContact CB-CG2 3.87Å; P392-V397 HydrophobicContact CG-CG2 3.4Å
393	S	64.5	Low	62.6	Low	71 Å²	71	112 Å²	112	50%	0.497	62%	0.616	S	S	.	*			trans	-43.5	133.7	176.9	53.9	0	0	0	0	107.6	S391 E395 Y396 V397	S391-S393 PolarHBondContact O-N 3.16Å; S393-E395 CarbonylContact O-C 3.55Å; S393-E395 PolarHBondContact O-N 2.99Å; S393-Y396 PolarHBondContact O-N 3.36Å; S393-V397 PolarHBondContact O-N 3.4Å
394	F	73.9	Confident	65.1	Low	169 Å²	169	114.5 Å²	114.5	74%	0.741	61%	0.613	S	S	*	*	H	α-helix	trans	-47.2	-33.2	-173.5	-118	-90.2	0	0	0	111.3	P392 V397 W398	P392-F394 PolarHBondContact O-N 3.09Å; F394-V397 PolarHBondContact O-N 3.42Å; F394-W398 AromaticContact CD1-NE1 3.84Å; F394-W398 PolarHBondContact O-N 3.47Å
395	E	76	Confident	67.4	Low	160 Å²	160	109.2 Å²	109.2	75%	0.748	58%	0.584	S	S	*	*	H	α-helix	trans	-57.6	-43.2	172.8	-60.8	-177.8	171.3	0	0	114.9	S393 W398 L399	S393-E395 CarbonylContact O-C 3.55Å; S393-E395 PolarHBondContact O-N 2.99Å; E395-W398 PolarHBondContact O-N 2.95Å; E395-L399 PolarHBondContact O-N 3.22Å
396	Y	80.1	Confident	70.3	Confident	142 Å²	142	105.5 Å²	105.5	56%	0.557	58%	0.576	S	S	*	*	H	α-helix	trans	-71.4	-33.2	-178.1	-144.1	-95.8	0	0	0	112.2	S393 L399 I400	S393-Y396 PolarHBondContact O-N 3.36Å; Y396-L399 PolarHBondContact O-N 3.48Å; Y396-I400 HydrophobicContact CD1-CD1 3.69Å; Y396-I400 HydrophobicContact CD1-CG1 4.21Å; Y396-I400 HydrophobicContact CE1-CD1 3.85Å; Y396-I400 HydrophobicContact CE1-CG1 4.33Å; Y396-I400 WeakPolarHBondContact O-CG1 3.39Å; Y396-I400 PolarHBondContact O-N 3.14Å
397	V	81.4	Confident	72.9	Confident	62 Å²	62	103 Å²	103	38%	0.376	56%	0.564	S	S	.	*	H	α-helix	trans	-66.5	-42.4	173.6	-176.7	0	0	0	0	110.6	P392 S393 F394 L399 I400 T401	P392-V397 HydrophobicContact CB-CG2 3.87Å; P392-V397 HydrophobicContact CG-CG2 3.4Å; S393-V397 PolarHBondContact O-N 3.4Å; F394-V397 PolarHBondContact O-N 3.42Å; V397-L399 VanDerWaalsContact C-N 3.29Å; V397-L399 PolarHBondContact O-N 2.88Å; V397-I400 PolarHBondContact O-N 3.17Å; V397-T401 HydrophobicContact CG1-CG2 4.19Å; V397-T401 WeakPolarHBondContact O-CB 3.49Å; V397-T401 VanDerWaalsContact O-CG2 3.27Å; V397-T401 WeakPolarHBondContact O-CG2 3.49Å; V397-T401 PolarHBondContact O-N 3.18Å; V397-T401 PolarHBondContact O-OG1 2.87Å
398	W	85.6	Confident	75.6	Confident	180 Å²	180	107.1 Å²	107.1	68%	0.682	57%	0.567	S	S	*	*	H	α-helix	trans	-62.4	-36.3	174.1	-77.3	114.3	0	0	0	112.2	F394 E395 T401 G402	F394-W398 AromaticContact CD1-NE1 3.84Å; F394-W398 PolarHBondContact O-N 3.47Å; E395-W398 PolarHBondContact O-N 2.95Å; W398-T401 WeakPolarHBondContact CA-OG1 3.3Å; W398-T401 PolarHBondContact O-OG1 2.96Å; W398-G402 WeakPolarHBondContact O-CA 3.34Å; W398-G402 PolarHBondContact O-N 2.84Å
399	L	89.1	Confident	78.6	Confident	102 Å²	102	102.1 Å²	102.1	53%	0.534	56%	0.556	S	S	.	*	H	α-helix	trans	-68.7	-46.3	178.3	-161	119	0	0	0	112.2	E395 Y396 V397 G402 L403	E395-L399 PolarHBondContact O-N 3.22Å; Y396-L399 PolarHBondContact O-N 3.48Å; V397-L399 VanDerWaalsContact C-N 3.29Å; V397-L399 PolarHBondContact O-N 2.88Å; L399-G402 PolarHBondContact O-N 2.97Å; L399-L403 HydrophobicContact CD2-CD1 3.84Å; L399-L403 HydrophobicContact CG-CD1 4.39Å; L399-L403 WeakPolarHBondContact O-CB 3.22Å; L399-L403 WeakPolarHBondContact O-CG 3.33Å; L399-L403 PolarHBondContact O-N 2.77Å
400	I	87.8	Confident	81	Confident	82 Å²	82	99.3 Å²	99.3	42%	0.421	55%	0.547	S	S	.	.	H	α-helix	trans	-66.8	-45.7	177.5	-65.7	171.8	0	0	0	111	Y396 V397 G402 L403 L404	Y396-I400 HydrophobicContact CD1-CD1 3.69Å; Y396-I400 HydrophobicContact CD1-CG1 4.21Å; Y396-I400 HydrophobicContact CE1-CD1 3.85Å; Y396-I400 HydrophobicContact CE1-CG1 4.33Å; Y396-I400 WeakPolarHBondContact O-CG1 3.39Å; Y396-I400 PolarHBondContact O-N 3.14Å; V397-I400 PolarHBondContact O-N 3.17Å; I400-G402 VanDerWaalsContact C-N 3.31Å; I400-G402 PolarHBondContact O-N 3.31Å; I400-L403 PolarHBondContact O-N 3.4Å; I400-L404 HydrophobicContact CG2-CD1 3.85Å; I400-L404 HydrophobicContact CG2-CG 4.33Å; I400-L404 WeakPolarHBondContact O-CB 3.48Å; I400-L404 WeakPolarHBondContact O-CG 3.23Å; I400-L404 PolarHBondContact O-N 2.84Å
401	T	86.9	Confident	83.3	Confident	72 Å²	72	96.6 Å²	96.6	44%	0.442	53%	0.532	S	S	.	.	H	α-helix	trans	-64.8	-36.9	177.3	53.5	0	0	0	0	111.7	V397 W398 G405	V397-T401 HydrophobicContact CG1-CG2 4.19Å; V397-T401 WeakPolarHBondContact O-CB 3.49Å; V397-T401 VanDerWaalsContact O-CG2 3.27Å; V397-T401 WeakPolarHBondContact O-CG2 3.49Å; V397-T401 PolarHBondContact O-N 3.18Å; V397-T401 PolarHBondContact O-OG1 2.87Å; W398-T401 WeakPolarHBondContact CA-OG1 3.3Å; W398-T401 PolarHBondContact O-OG1 2.96Å; T401-G405 PolarHBondContact O-N 2.74Å
402	G	92.2	Very high	85.7	Confident	36 Å²	36	95.2 Å²	95.2	37%	0.371	52%	0.516	S	S	.	.	H	α-helix	trans	-62.8	-47.1	172.2	0	0	0	0	0	112.7	W398 L399 I400 G405 C406	W398-G402 WeakPolarHBondContact O-CA 3.34Å; W398-G402 PolarHBondContact O-N 2.84Å; L399-G402 PolarHBondContact O-N 2.97Å; I400-G402 VanDerWaalsContact C-N 3.31Å; I400-G402 PolarHBondContact O-N 3.31Å; G402-G405 PolarHBondContact O-N 3.38Å; G402-C406 WeakPolarHBondContact O-CB 3.36Å; G402-C406 PolarHBondContact O-N 2.88Å; G402-C406 PolarHBondContact O-SG 3.29Å
403	L	92.6	Very high	87.9	Confident	101 Å²	101	97.1 Å²	97.1	53%	0.529	52%	0.522	S	S	.	.	H	α-helix	trans	-62.6	-47.7	176.9	-86.6	160.3	0	0	0	112.1	L399 I400 G405 C406 C407	L399-L403 HydrophobicContact CD2-CD1 3.84Å; L399-L403 HydrophobicContact CG-CD1 4.39Å; L399-L403 WeakPolarHBondContact O-CB 3.22Å; L399-L403 WeakPolarHBondContact O-CG 3.33Å; L399-L403 PolarHBondContact O-N 2.77Å; I400-L403 PolarHBondContact O-N 3.4Å; L403-G405 VanDerWaalsContact C-N 3.31Å; L403-G405 PolarHBondContact O-N 2.83Å; L403-C406 PolarHBondContact O-N 2.81Å; L403-C407 PolarHBondContact O-N 2.77Å; L403-C407 PolarHBondContact O-SG 2.84Å; L403-C407 VanDerWaalsContact O-SG 3.34Å
404	L	92	Very high	89.2	Confident	115 Å²	115	98.3 Å²	98.3	60%	0.602	53%	0.526	S	S	*	.	H	α-helix	trans	-63.3	-39.1	176.7	-70.2	173.4	0	0	0	111.4	I400 C407 F408	I400-L404 HydrophobicContact CG2-CD1 3.85Å; I400-L404 HydrophobicContact CG2-CG 4.33Å; I400-L404 WeakPolarHBondContact O-CB 3.48Å; I400-L404 WeakPolarHBondContact O-CG 3.23Å; I400-L404 PolarHBondContact O-N 2.84Å; L404-C407 PolarHBondContact O-N 2.83Å; L404-F408 WeakPolarHBondContact O-CB 3.2Å; L404-F408 PolarHBondContact O-N 3.06Å
405	G	94	Very high	90.1	Very high	30 Å²	30	93.6 Å²	93.6	31%	0.309	51%	0.511	S	S	.	.	H	α-helix	trans	-61.3	-45.1	172.8	0	0	0	0	0	112.5	T401 G402 L403 F408 L409	T401-G405 PolarHBondContact O-N 2.74Å; G402-G405 PolarHBondContact O-N 3.38Å; L403-G405 VanDerWaalsContact C-N 3.31Å; L403-G405 PolarHBondContact O-N 2.83Å; G405-F408 PolarHBondContact O-N 2.88Å; G405-L409 WeakPolarHBondContact O-CB 3.49Å; G405-L409 VanDerWaalsContact O-CG 3.31Å; G405-L409 WeakPolarHBondContact O-CG 3.35Å; G405-L409 PolarHBondContact O-N 3.44Å
406	C	94.2	Very high	90.9	Very high	75 Å²	75	89.5 Å²	89.5	51%	0.507	49%	0.494	S	S	.	.	H	α-helix	trans	-63.1	-44.8	174.6	-80.1	0	0	0	0	112.1	G402 L403 F408 L409 C410	G402-C406 WeakPolarHBondContact O-CB 3.36Å; G402-C406 PolarHBondContact O-N 2.88Å; G402-C406 PolarHBondContact O-SG 3.29Å; L403-C406 PolarHBondContact O-N 2.81Å; C406-F408 VanDerWaalsContact C-N 3.32Å; C406-F408 PolarHBondContact O-N 2.99Å; C406-L409 PolarHBondContact O-N 3.34Å; C406-C410 WeakPolarHBondContact O-CB 3.33Å; C406-C410 PolarHBondContact O-N 2.79Å; C406-C410 PolarHBondContact O-SG 2.73Å
407	C	92.6	Very high	91.4	Very high	80 Å²	80	86.5 Å²	86.5	54%	0.541	49%	0.487	S	S	.	.	H	α-helix	trans	-60.4	-42.4	175.6	-71.9	0	0	0	0	111.7	L403 L404 C410 A411	L403-C407 PolarHBondContact O-N 2.77Å; L403-C407 PolarHBondContact O-SG 2.84Å; L403-C407 VanDerWaalsContact O-SG 3.34Å; L404-C407 PolarHBondContact O-N 2.83Å; C407-C410 PolarHBondContact O-N 2.87Å; C407-A411 WeakPolarHBondContact O-CB 3.37Å; C407-A411 PolarHBondContact O-N 2.65Å
408	F	94.1	Very high	91.5	Very high	141 Å²	141	86 Å²	86	62%	0.618	49%	0.489	S	S	*	.	H	α-helix	trans	-66	-44.2	177.4	-169.8	-96.6	0	0	0	111.8	L404 G405 C406 A411 L412	L404-F408 WeakPolarHBondContact O-CB 3.2Å; L404-F408 PolarHBondContact O-N 3.06Å; G405-F408 PolarHBondContact O-N 2.88Å; C406-F408 VanDerWaalsContact C-N 3.32Å; C406-F408 PolarHBondContact O-N 2.99Å; F408-A411 PolarHBondContact O-N 3.43Å; F408-L412 HydrophobicContact CD1-CD1 3.94Å; F408-L412 HydrophobicContact CE1-CD1 3.44Å; F408-L412 VanDerWaalsContact CE1-CD1 3.44Å; F408-L412 HydrophobicContact CE1-CG 4.36Å; F408-L412 HydrophobicContact CZ-CD1 4.21Å; F408-L412 WeakPolarHBondContact O-CB 3.2Å; F408-L412 PolarHBondContact O-N 3.09Å
409	L	94.2	Very high	91.6	Very high	111 Å²	111	82 Å²	82	58%	0.581	48%	0.48	S	S	*	.	H	α-helix	trans	-63.2	-41	175.4	-73.2	173.4	0	0	0	112	G405 C406 L412 L413	G405-L409 WeakPolarHBondContact O-CB 3.49Å; G405-L409 VanDerWaalsContact O-CG 3.31Å; G405-L409 WeakPolarHBondContact O-CG 3.35Å; G405-L409 PolarHBondContact O-N 3.44Å; C406-L409 PolarHBondContact O-N 3.34Å; L409-L412 PolarHBondContact O-N 2.96Å; L409-L413 WeakPolarHBondContact O-CB 3.38Å; L409-L413 PolarHBondContact O-N 2.82Å
410	C	93.6	Very high	91.2	Very high	79 Å²	79	85 Å²	85	53%	0.534	48%	0.484	S	S	.	.	H	α-helix	trans	-63	-45	174.4	-75.2	0	0	0	0	111.7	C406 C407 L412 L413 V414	C406-C410 WeakPolarHBondContact O-CB 3.33Å; C406-C410 PolarHBondContact O-N 2.79Å; C406-C410 PolarHBondContact O-SG 2.73Å; C407-C410 PolarHBondContact O-N 2.87Å; C410-L412 VanDerWaalsContact C-N 3.33Å; C410-L412 PolarHBondContact O-N 2.65Å; C410-L413 PolarHBondContact O-N 3.15Å; C410-V414 WeakPolarHBondContact O-CB 3.39Å; C410-V414 VanDerWaalsContact O-CG2 3.28Å; C410-V414 WeakPolarHBondContact O-CG2 3.27Å; C410-V414 PolarHBondContact O-N 3.21Å
411	A	92	Very high	90.8	Very high	54 Å²	54	86.6 Å²	86.6	45%	0.446	49%	0.49	S	S	.	.	H	α-helix	trans	-62.8	-39.7	175.2	0	0	0	0	0	111.8	C407 F408 V414 T415	C407-A411 WeakPolarHBondContact O-CB 3.37Å; C407-A411 PolarHBondContact O-N 2.65Å; F408-A411 PolarHBondContact O-N 3.43Å; A411-V414 PolarHBondContact O-N 2.73Å; A411-T415 WeakPolarHBondContact O-CB 3.23Å; A411-T415 VanDerWaalsContact O-CG2 3.25Å; A411-T415 WeakPolarHBondContact O-CG2 3.39Å; A411-T415 PolarHBondContact O-N 3.36Å; A411-T415 PolarHBondContact O-OG1 3.36Å
412	L	94.7	Very high	90.4	Very high	72 Å²	72	92.2 Å²	92.2	38%	0.377	50%	0.503	S	S	.	.	H	α-helix	trans	-63.8	-42.1	173.3	-112.8	167.1	0	0	0	112	F408 L409 C410 T415 I416	F408-L412 HydrophobicContact CD1-CD1 3.94Å; F408-L412 HydrophobicContact CE1-CD1 3.44Å; F408-L412 VanDerWaalsContact CE1-CD1 3.44Å; F408-L412 HydrophobicContact CE1-CG 4.36Å; F408-L412 HydrophobicContact CZ-CD1 4.21Å; F408-L412 WeakPolarHBondContact O-CB 3.2Å; F408-L412 PolarHBondContact O-N 3.09Å; L409-L412 PolarHBondContact O-N 2.96Å; C410-L412 VanDerWaalsContact C-N 3.33Å; C410-L412 PolarHBondContact O-N 2.65Å; L412-T415 VanDerWaalsContact CA-OG1 3.27Å; L412-T415 WeakPolarHBondContact CA-OG1 3.5Å; L412-T415 PolarHBondContact O-N 2.92Å; L412-T415 PolarHBondContact O-OG1 2.82Å; L412-I416 HydrophobicContact CD2-CD1 4.03Å; L412-I416 HydrophobicContact CD2-CG1 4.37Å; L412-I416 WeakPolarHBondContact O-CB 3.31Å; L412-I416 WeakPolarHBondContact O-CD1 3.21Å; L412-I416 WeakPolarHBondContact O-CG1 3.45Å; L412-I416 PolarHBondContact O-N 3.1Å
413	L	93.8	Very high	89.5	Confident	105 Å²	105	96.2 Å²	96.2	55%	0.55	51%	0.512	S	S	.	.	H	α-helix	trans	-65.8	-45.2	177.5	-121.8	158.5	0	0	0	111.4	L409 C410 T415 I416 I417	L409-L413 WeakPolarHBondContact O-CB 3.38Å; L409-L413 PolarHBondContact O-N 2.82Å; C410-L413 PolarHBondContact O-N 3.15Å; L413-T415 PolarHBondContact O-N 3.29Å; L413-I416 PolarHBondContact O-N 2.83Å; L413-I417 HydrophobicContact CD2-CD1 3.8Å; L413-I417 HydrophobicContact CD2-CG1 4.25Å; L413-I417 WeakPolarHBondContact O-CB 3.1Å; L413-I417 WeakPolarHBondContact O-CG1 3.2Å; L413-I417 PolarHBondContact O-N 2.88Å
414	V	92.4	Very high	88.3	Confident	97 Å²	97	100.8 Å²	100.8	59%	0.588	52%	0.522	S	S	*	.	H	α-helix	trans	-62.7	-42.3	176.4	171.6	0	0	0	0	110.9	C410 A411 I417 A418	C410-V414 WeakPolarHBondContact O-CB 3.39Å; C410-V414 VanDerWaalsContact O-CG2 3.28Å; C410-V414 WeakPolarHBondContact O-CG2 3.27Å; C410-V414 PolarHBondContact O-N 3.21Å; A411-V414 PolarHBondContact O-N 2.73Å; V414-I417 PolarHBondContact O-N 3.28Å; V414-A418 VanDerWaalsContact O-CB 3.28Å; V414-A418 WeakPolarHBondContact O-CB 3.49Å; V414-A418 PolarHBondContact O-N 3.45Å
415	T	92.4	Very high	86.8	Confident	69 Å²	69	101.8 Å²	101.8	42%	0.423	52%	0.521	S	S	.	.	H	α-helix	trans	-67.8	-40.6	176.2	51	0	0	0	0	112.1	A411 L412 L413 A418 I419	A411-T415 WeakPolarHBondContact O-CB 3.23Å; A411-T415 VanDerWaalsContact O-CG2 3.25Å; A411-T415 WeakPolarHBondContact O-CG2 3.39Å; A411-T415 PolarHBondContact O-N 3.36Å; A411-T415 PolarHBondContact O-OG1 3.36Å; L412-T415 VanDerWaalsContact CA-OG1 3.27Å; L412-T415 WeakPolarHBondContact CA-OG1 3.5Å; L412-T415 PolarHBondContact O-N 2.92Å; L412-T415 PolarHBondContact O-OG1 2.82Å; L413-T415 PolarHBondContact O-N 3.29Å; T415-A418 PolarHBondContact O-N 2.91Å; T415-I419 WeakPolarHBondContact O-CB 3.35Å; T415-I419 WeakPolarHBondContact O-CD1 3.29Å; T415-I419 WeakPolarHBondContact O-CG1 3.41Å; T415-I419 PolarHBondContact O-N 3.04Å
416	I	93	Very high	85.1	Confident	74 Å²	74	105.8 Å²	105.8	38%	0.379	54%	0.54	S	S	.	.	H	α-helix	trans	-63	-42.4	173.4	-71.1	166.1	0	0	0	111	L412 L413 I419 R420	L412-I416 HydrophobicContact CD2-CD1 4.03Å; L412-I416 HydrophobicContact CD2-CG1 4.37Å; L412-I416 WeakPolarHBondContact O-CB 3.31Å; L412-I416 WeakPolarHBondContact O-CD1 3.21Å; L412-I416 WeakPolarHBondContact O-CG1 3.45Å; L412-I416 PolarHBondContact O-N 3.1Å; L413-I416 PolarHBondContact O-N 2.83Å; I416-I419 PolarHBondContact O-N 2.87Å; I416-R420 VanDerWaalsContact O-CB 3.32Å; I416-R420 WeakPolarHBondContact O-CB 3.13Å; I416-R420 WeakPolarHBondContact O-CG 3.37Å; I416-R420 PolarHBondContact O-N 2.94Å
417	I	90.3	Very high	83.2	Confident	80 Å²	80	107.7 Å²	107.7	41%	0.41	55%	0.549	S	S	.	.	H	α-helix	trans	-63.4	-44.7	175.3	-69.7	165	0	0	0	109.9	L413 V414 I419 R420 Q421	L413-I417 HydrophobicContact CD2-CD1 3.8Å; L413-I417 HydrophobicContact CD2-CG1 4.25Å; L413-I417 WeakPolarHBondContact O-CB 3.1Å; L413-I417 WeakPolarHBondContact O-CG1 3.2Å; L413-I417 PolarHBondContact O-N 2.88Å; V414-I417 PolarHBondContact O-N 3.28Å; I417-I419 PolarHBondContact O-N 2.91Å; I417-R420 PolarHBondContact O-N 3.47Å; I417-Q421 HydrophobicContact CG2-CG 4.28Å; I417-Q421 WeakPolarHBondContact O-CB 3.46Å; I417-Q421 VanDerWaalsContact O-CG 3.3Å; I417-Q421 WeakPolarHBondContact O-CG 3.46Å; I417-Q421 PolarHBondContact O-N 3.07Å
418	A	84.5	Confident	81	Confident	52 Å²	52	106.5 Å²	106.5	43%	0.43	54%	0.542	S	S	.	.	H	α-helix	trans	-63	-41.4	177.2	0	0	0	0	0	112	V414 T415 Q421 R422	V414-A418 VanDerWaalsContact O-CB 3.28Å; V414-A418 WeakPolarHBondContact O-CB 3.49Å; V414-A418 PolarHBondContact O-N 3.45Å; T415-A418 PolarHBondContact O-N 2.91Å; A418-Q421 PolarHBondContact O-N 3.08Å; A418-R422 VanDerWaalsContact O-CB 3.27Å; A418-R422 WeakPolarHBondContact O-CB 3.33Å; A418-R422 PolarHBondContact O-N 2.76Å
419	I	86.7	Confident	78.8	Confident	94 Å²	94	106.1 Å²	106.1	48%	0.482	55%	0.553	S	S	.	*	H	α-helix	trans	-65.5	-45.1	175.1	-69	163.9	0	0	0	110.4	T415 I416 I417 R422 Q423	T415-I419 WeakPolarHBondContact O-CB 3.35Å; T415-I419 WeakPolarHBondContact O-CD1 3.29Å; T415-I419 WeakPolarHBondContact O-CG1 3.41Å; T415-I419 PolarHBondContact O-N 3.04Å; I416-I419 PolarHBondContact O-N 2.87Å; I417-I419 PolarHBondContact O-N 2.91Å; I419-R422 CarbonylContact O-C 3.59Å; I419-R422 PolarHBondContact O-N 3.4Å; I419-Q423 HydrophobicContact CG2-CG 4.46Å; I419-Q423 WeakPolarHBondContact O-CB 3.37Å; I419-Q423 WeakPolarHBondContact O-CG 3.46Å; I419-Q423 PolarHBondContact O-N 3.09Å
420	R	82.2	Confident	76.4	Confident	167 Å²	167	106 Å²	106	63%	0.63	56%	0.562	S	S	*	*	H	α-helix	trans	-64.2	-40.9	176.4	-82.8	-176.6	161.5	164.7	-2.6	112.3	I416 I417 R422 Q423 R424	I416-R420 VanDerWaalsContact O-CB 3.32Å; I416-R420 WeakPolarHBondContact O-CB 3.13Å; I416-R420 WeakPolarHBondContact O-CG 3.37Å; I416-R420 PolarHBondContact O-N 2.94Å; I417-R420 PolarHBondContact O-N 3.47Å; R420-R422 VanDerWaalsContact C-N 3.33Å; R420-Q423 PolarHBondContact O-N 2.7Å; R420-R424 WeakPolarHBondContact O-CB 3.13Å; R420-R424 WeakPolarHBondContact O-CG 2.89Å; R420-R424 PolarHBondContact O-N 2.89Å
421	Q	77.8	Confident	73.5	Confident	114 Å²	114	111 Å²	111	53%	0.533	57%	0.571	S	S	.	*	H	α-helix	trans	-63.5	-41.2	173.6	-77.6	-175.8	-2.4	0	0	110.8	I417 A418 R424 K425	I417-Q421 HydrophobicContact CG2-CG 4.28Å; I417-Q421 WeakPolarHBondContact O-CB 3.46Å; I417-Q421 VanDerWaalsContact O-CG 3.3Å; I417-Q421 WeakPolarHBondContact O-CG 3.46Å; I417-Q421 PolarHBondContact O-N 3.07Å; A418-Q421 PolarHBondContact O-N 3.08Å; Q421-R424 PolarHBondContact O-N 3.41Å; Q421-K425 WeakPolarHBondContact O-CB 3.44Å; Q421-K425 WeakPolarHBondContact O-CG 3.3Å; Q421-K425 PolarHBondContact O-N 3.39Å
422	R	78.8	Confident	70.9	Confident	190 Å²	190	115.2 Å²	115.2	72%	0.717	59%	0.592	S	S	*	*	H	α-helix	trans	-64.4	-46	175.2	-171.1	177.6	-178	-172.9	0.5	111.6	A418 I419 R420 K425 V426	A418-R422 VanDerWaalsContact O-CB 3.27Å; A418-R422 WeakPolarHBondContact O-CB 3.33Å; A418-R422 PolarHBondContact O-N 2.76Å; I419-R422 CarbonylContact O-C 3.59Å; I419-R422 PolarHBondContact O-N 3.4Å; R420-R422 VanDerWaalsContact C-N 3.33Å; R422-K425 PolarHBondContact O-N 3.03Å; R422-V426 VanDerWaalsContact O-CG2 3.27Å; R422-V426 WeakPolarHBondContact O-CG2 3.5Å; R422-V426 PolarHBondContact O-N 3.34Å
423	Q	73.7	Confident	68.1	Low	120 Å²	120	114.6 Å²	114.6	56%	0.561	60%	0.603	S	S	*	*	H	α-helix	trans	-61.8	-44	175.8	-76.9	-179.7	-23.3	0	0	111.5	I419 R420 K425 V426 T427	I419-Q423 HydrophobicContact CG2-CG 4.46Å; I419-Q423 WeakPolarHBondContact O-CB 3.37Å; I419-Q423 WeakPolarHBondContact O-CG 3.46Å; I419-Q423 PolarHBondContact O-N 3.09Å; R420-Q423 PolarHBondContact O-N 2.7Å; Q423-K425 VanDerWaalsContact C-N 3.29Å; Q423-K425 PolarHBondContact O-N 2.9Å; Q423-V426 PolarHBondContact O-N 2.74Å; Q423-T427 PolarHBondContact O-N 3.01Å; Q423-T427 PolarHBondContact O-OG1 2.94Å; Q423-T427 VanDerWaalsContact O-OG1 3.08Å
424	R	67.6	Low	65.3	Low	198 Å²	198	117.7 Å²	117.7	75%	0.747	62%	0.619	S	S	*	*	H	α-helix	trans	-58.8	-39.4	173.7	-79.8	-173.5	-176.3	-173.9	1.8	112.4	R420 Q421 V426 S428	R420-R424 WeakPolarHBondContact O-CB 3.13Å; R420-R424 WeakPolarHBondContact O-CG 2.89Å; R420-R424 PolarHBondContact O-N 2.89Å; Q421-R424 PolarHBondContact O-N 3.41Å; R424-V426 VanDerWaalsContact C-N 3.31Å; R424-S428 PolarHBondContact O-N 3.46Å; R424-S428 PolarHBondContact O-OG 3.21Å
425	K	60.3	Low	62.6	Low	135 Å²	135	122.3 Å²	122.3	59%	0.587	63%	0.631	S	S	*	*	H	α-helix	trans	-69.4	-25.8	175.2	-74.5	179.4	-179.6	-174.6	0	113.2	Q421 R422 Q423 S428	Q421-K425 WeakPolarHBondContact O-CB 3.44Å; Q421-K425 WeakPolarHBondContact O-CG 3.3Å; Q421-K425 PolarHBondContact O-N 3.39Å; R422-K425 PolarHBondContact O-N 3.03Å; Q423-K425 VanDerWaalsContact C-N 3.29Å; Q423-K425 PolarHBondContact O-N 2.9Å; K425-S428 WeakPolarHBondContact CA-OG 3.37Å; K425-S428 PolarHBondContact O-OG 2.84Å
426	V	59.4	Low	60	Low	114 Å²	114	124.5 Å²	124.5	69%	0.691	65%	0.649	S	S	*	*	H	α-helix	trans	-86.7	-30.4	178.4	174.5	0	0	0	0	112.1	R422 Q423 R424	R422-V426 VanDerWaalsContact O-CG2 3.27Å; R422-V426 WeakPolarHBondContact O-CG2 3.5Å; R422-V426 PolarHBondContact O-N 3.34Å; Q423-V426 PolarHBondContact O-N 2.74Å; R424-V426 VanDerWaalsContact C-N 3.31Å
427	T	53.9	Low	57.5	Low	115 Å²	115	126.8 Å²	126.8	71%	0.706	67%	0.667	S	S	*	*	S	Bend	trans	-92	1.5	177.2	56.5	0	0	0	0	114.2	Q423	Q423-T427 PolarHBondContact O-N 3.01Å; Q423-T427 PolarHBondContact O-OG1 2.94Å; Q423-T427 VanDerWaalsContact O-OG1 3.08Å
428	S	45	Very low	55.4	Low	55 Å²	55	128.2 Å²	128.2	39%	0.385	68%	0.681	S	S	.	*	S	Bend	trans	-86.6	121.6	170.2	22.7	0	0	0	0	109	R424 K425 S430	R424-S428 PolarHBondContact O-N 3.46Å; R424-S428 PolarHBondContact O-OG 3.21Å; K425-S428 WeakPolarHBondContact CA-OG 3.37Å; K425-S428 PolarHBondContact O-OG 2.84Å; S428-S430 PolarHBondContact O-N 3.44Å
429	P	48.8	Very low	53.6	Low	133 Å²	133	132 Å²	132	86%	0.864	69%	0.69	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69.6	23.5	-175.5	-15.6	29.6	0	0	0	115.4
430	S	44	Very low	52	Low	109 Å²	109	129 Å²	129	76%	0.762	68%	0.679	S	S	*	*	T	Hydrogen-bonded Turn	trans	-136.3	20.6	-172.5	-52.2	0	0	0	0	114	S428	S428-S430 PolarHBondContact O-N 3.44Å
431	Y	33.3	Very low	51	Low	183 Å²	183	125.2 Å²	125.2	72%	0.718	67%	0.669	S	S	*	*			trans	-125.2	54.9	173.5	-146.2	-98.4	0	0	0	112.5
432	T	36	Very low	50.7	Low	144 Å²	144	121.5 Å²	121.5	88%	0.883	65%	0.651	S	S	*	*			trans	-117.3	89.7	156.1	54.6	0	0	0	0	107.7
433	G	36	Very low	50.5	Low	59 Å²	59	115.6 Å²	115.6	61%	0.608	63%	0.633	S	S	*	*			trans	-158.9	108.2	174.4	0	0	0	0	0	107.7
434	L	36.1	Very low	50.5	Low	170 Å²	170	110 Å²	110	89%	0.89	61%	0.608	S	S	*	*			trans	-58.7	154.6	-164.4	-72	94.9	0	0	0	113.8	S436	L434-S436 PolarHBondContact O-N 3.41Å
435	K	35.4	Very low	50.9	Low	194 Å²	194	102 Å²	102	84%	0.843	58%	0.581	S	S	*	*			trans	-25.8	123	157.8	-70.2	174.2	173.6	-179.6	0	110.7	T437	K435-T437 PolarHBondContact O-N 2.7Å
436	S	37.4	Very low	51.5	Low	115 Å²	115	95.7 Å²	95.7	80%	0.804	55%	0.553	S	S	*	*			trans	-54.3	108.3	163.7	51.4	0	0	0	0	107.8	L434	L434-S436 PolarHBondContact O-N 3.41Å
437	T	40.6	Very low	52.1	Low	122 Å²	122	95.1 Å²	95.1	75%	0.748	55%	0.546	S	S	*	.			trans	-54.8	134	168	-33.8	0	0	0	0	107.5	K435 Q439	K435-T437 PolarHBondContact O-N 2.7Å; T437-Q439 PolarHBondContact O-N 2.82Å; T437-Q439 VanDerWaalsContact O-N 3.11Å
438	P	46.1	Very low	52.7	Low	110 Å²	110	97.1 Å²	97.1	71%	0.714	55%	0.545	S	S	*	.			trans	-55.8	120.8	178.2	21.8	-31.5	0	0	0	108.9	A440	P438-A440 PolarHBondContact O-N 2.93Å
439	Q	46.6	Very low	53.9	Low	130 Å²	130	98.3 Å²	98.3	61%	0.607	55%	0.55	S	S	*	.			trans	-82.6	110.3	179.8	-165.1	172.5	3.2	0	0	106.5	T437 E441 R456	T437-Q439 PolarHBondContact O-N 2.82Å; T437-Q439 VanDerWaalsContact O-N 3.11Å; Q439-E441 PolarHBondContact O-N 2.9Å; Q439-E441 VanDerWaalsContact O-N 3.15Å; Q439-R456 WeakPolarHBondContact CG-O 3.44Å; Q439-R456 PolarHBondContact NE2-O 2.63Å
440	A	52.3	Low	54.9	Low	32 Å²	32	94.9 Å²	94.9	26%	0.264	54%	0.538	S	S	.	.	P	Polyproline II helix	trans	-53.3	118.4	-177.9	0	0	0	0	0	110.5	P438 D480	P438-A440 PolarHBondContact O-N 2.93Å; A440-D480 VanDerWaalsContact CB-OD2 3.29Å; A440-D480 WeakPolarHBondContact CB-OD2 3.39Å
441	E	61.9	Low	56.1	Low	88 Å²	88	95 Å²	95	41%	0.411	53%	0.527	S	S	.	.	P	Polyproline II helix	trans	-93	116.1	174.8	-61.3	-164.4	149	0	0	108.7	Q439 R456 S479	Q439-E441 PolarHBondContact O-N 2.9Å; Q439-E441 VanDerWaalsContact O-N 3.15Å; E441-R456 HydrophobicContact CG-CG 4.37Å; E441-R456 IonicContact OE1-NH1 2.78Å; E441-S479 PolarHBondContact O-OG 3.25Å
442	H	71	Confident	58	Low	35 Å²	35	91.5 Å²	91.5	16%	0.162	52%	0.518	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	132.4	172.5	-60.9	-66.5	0	0	0	109.7	I455 W461 M476 F477 D478	H442-I455 PolarHBondContact N-O 3.49Å; H442-I455 PolarHBondContact O-N 2.9Å; H442-W461 HydrophobicContact CB-CZ2 3.98Å; H442-W461 AromaticContact CD2-CZ2 3.73Å; H442-W461 AromaticContact CG-CZ2 3.88Å; H442-M476 HydrophobicContact CB-CG 4.37Å; H442-M476 HydrophobicContact CB-SD 4.45Å; H442-F477 WeakPolarHBondContact CA-O 3.34Å; H442-D478 IonicContact CE1-OD1 2.67Å; H442-D478 IonicContact CE1-OD2 2.65Å; H442-D478 PolarHBondContact CE1-OD2 2.94Å; H442-D478 IonicContact ND1-OD2 3.43Å
443	I	76.2	Confident	59.7	Low	67 Å²	67	89.1 Å²	89.1	34%	0.344	50%	0.496	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	119.1	174.6	-52.6	178.5	0	0	0	108.5	V445 V454 M476 F477	I443-V445 HydrophobicContact CG2-CG2 3.98Å; I443-V454 HydrophobicContact CG1-CG2 4.36Å; I443-M476 CarbonylContact O-C 3.42Å; I443-M476 WeakPolarHBondContact O-CA 3.27Å; I443-F477 HydrophobicContact CB-CB 4.32Å; I443-F477 PolarHBondContact N-O 3.18Å; I443-F477 PolarHBondContact O-N 2.85Å
444	A	73.8	Confident	61.5	Low	3 Å²	3	89.6 Å²	89.6	3%	0.025	49%	0.487	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.4	129.2	171.8	0	0	0	0	0	110	M452 K453 I455 F464 V474 Y475	A444-M452 CarbonylContact O-C 3.51Å; A444-M452 VanDerWaalsContact O-CA 3.32Å; A444-M452 WeakPolarHBondContact O-CA 3.49Å; A444-K453 PolarHBondContact N-O 3.11Å; A444-K453 PolarHBondContact O-N 2.84Å; A444-I455 HydrophobicContact CB-CD1 3.68Å; A444-F464 HydrophobicContact CB-CD1 4.3Å; A444-F464 HydrophobicContact CB-CE1 3.66Å; A444-F464 HydrophobicContact CB-CZ 4.3Å; A444-V474 HydrophobicContact CB-CG1 4.48Å; A444-Y475 WeakPolarHBondContact CA-O 3.39Å
445	V	74.8	Confident	63	Low	29 Å²	29	81.9 Å²	81.9	18%	0.176	45%	0.446	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	126.2	-179	-174	0	0	0	0	109.4	I443 L447 Q451 M452 V474 Y475 F477	I443-V445 HydrophobicContact CG2-CG2 3.98Å; V445-L447 HydrophobicContact CG1-CD2 4.15Å; V445-Q451 WeakPolarHBondContact CA-O 3.42Å; V445-M452 HydrophobicContact CG2-CB 4.15Å; V445-V474 WeakPolarHBondContact O-CA 3.39Å; V445-Y475 PolarHBondContact N-O 3.35Å; V445-Y475 PolarHBondContact O-N 2.93Å; V445-F477 HydrophobicContact CB-CE2 4.25Å; V445-F477 HydrophobicContact CG2-CD2 4.08Å; V445-F477 HydrophobicContact CG2-CE2 3.83Å
446	D	72.4	Confident	64.4	Low	2 Å²	2	80.1 Å²	80.1	1%	0.011	43%	0.434	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.1	110.4	168.5	-179.3	-9.5	0	0	0	109.4	K448 T449 G450 Q451 K468 V474	D446-K448 PolarHBondContact O-N 2.73Å; D446-K448 WeakPolarHBondContact OD1-CA 3.22Å; D446-K448 VanDerWaalsContact OD1-CB 3.3Å; D446-K448 WeakPolarHBondContact OD1-CB 3.19Å; D446-K448 PolarHBondContact OD1-N 3.5Å; D446-T449 PolarHBondContact O-N 3.28Å; D446-T449 PolarHBondContact OD1-N 3.06Å; D446-T449 PolarHBondContact OD2-OG1 3.03Å; D446-G450 WeakPolarHBondContact O-CA 3.26Å; D446-G450 PolarHBondContact O-N 2.82Å; D446-Q451 PolarHBondContact N-O 3.25Å; D446-K468 HydrophobicContact CB-CD 4.23Å; D446-K468 WeakPolarHBondContact OD2-CD 3.5Å; D446-K468 WeakPolarHBondContact OD2-CE 3.44Å; D446-K468 IonicContact OD2-NZ 3.95Å; D446-K468 PolarHBondContact OD2-NZ 2.8Å; D446-V474 HydrophobicContact CB-CG2 4.36Å
447	L	72	Confident	65.6	Low	102 Å²	102	78 Å²	78	53%	0.534	41%	0.414	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.7	-17.2	-178.6	-62.6	-177	0	0	0	113.3	V445 N473 Y475	V445-L447 HydrophobicContact CG1-CD2 4.15Å; L447-N473 PolarHBondContact N-O 2.9Å; L447-Y475 HydrophobicContact CD1-CD2 3.45Å; L447-Y475 VanDerWaalsContact CD1-CD2 3.45Å; L447-Y475 HydrophobicContact CD1-CE2 3.29Å; L447-Y475 HydrophobicContact CD1-CG 4.36Å; L447-Y475 HydrophobicContact CG-CD2 3.74Å; L447-Y475 HydrophobicContact CG-CE2 4Å
448	K	66.9	Low	66.5	Low	158 Å²	158	77.2 Å²	77.2	69%	0.687	41%	0.409	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80	-38.6	178.3	-167.5	178.8	179	-179	0	111.9	D446 N473	D446-K448 PolarHBondContact O-N 2.73Å; D446-K448 WeakPolarHBondContact OD1-CA 3.22Å; D446-K448 VanDerWaalsContact OD1-CB 3.3Å; D446-K448 WeakPolarHBondContact OD1-CB 3.19Å; D446-K448 PolarHBondContact OD1-N 3.5Å; K448-N473 HydrophobicContact CB-CB 4.19Å
449	T	71.6	Confident	67	Low	80 Å²	80	79.7 Å²	79.7	49%	0.491	41%	0.411	S	S	.	.	T	Hydrogen-bonded Turn	trans	-102.7	-12	-178.2	70.2	0	0	0	0	113.7	D446 Q451 K468	D446-T449 PolarHBondContact O-N 3.28Å; D446-T449 PolarHBondContact OD1-N 3.06Å; D446-T449 PolarHBondContact OD2-OG1 3.03Å; T449-Q451 PolarHBondContact O-N 2.85Å; T449-Q451 WeakPolarHBondContact OG1-CB 3.33Å; T449-Q451 PolarHBondContact OG1-N 2.53Å; T449-K468 PolarHBondContact OG1-NZ 2.97Å
450	G	69.1	Low	67.5	Low	60 Å²	60	78.5 Å²	78.5	62%	0.619	41%	0.408	S	S	*	.			trans	71	7.1	-172.8	0	0	0	0	0	114	D446	D446-G450 WeakPolarHBondContact O-CA 3.26Å; D446-G450 PolarHBondContact O-N 2.82Å
451	Q	68.9	Low	67.9	Low	112 Å²	112	80 Å²	80	52%	0.523	41%	0.407	S	S	.	.			trans	-77.5	132.9	179.8	-75.9	179.9	-27.8	0	0	111.4	V445 D446 T449	V445-Q451 WeakPolarHBondContact CA-O 3.42Å; D446-Q451 PolarHBondContact N-O 3.25Å; T449-Q451 PolarHBondContact O-N 2.85Å; T449-Q451 WeakPolarHBondContact OG1-CB 3.33Å; T449-Q451 PolarHBondContact OG1-N 2.53Å
452	M	73.7	Confident	67.9	Low	110 Å²	110	80.7 Å²	80.7	54%	0.542	41%	0.413	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	145.7	173	64.2	172.9	-169.5	0	0	111.3	A444 V445 L542	A444-M452 CarbonylContact O-C 3.51Å; A444-M452 VanDerWaalsContact O-CA 3.32Å; A444-M452 WeakPolarHBondContact O-CA 3.49Å; V445-M452 HydrophobicContact CG2-CB 4.15Å; M452-L542 HydrophobicContact CE-CD1 4.01Å; M452-L542 HydrophobicContact CE-CD2 3.69Å; M452-L542 HydrophobicContact CE-CG 4.11Å
453	K	70.2	Confident	67.5	Low	94 Å²	94	83.1 Å²	83.1	41%	0.409	43%	0.432	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.6	125.1	172.5	-164.1	167.1	-175	179.5	0	110.6	A444 F464	A444-K453 PolarHBondContact N-O 3.11Å; A444-K453 PolarHBondContact O-N 2.84Å; K453-F464 HydrophobicContact CB-CD2 4.21Å; K453-F464 HydrophobicContact CB-CE2 3.92Å; K453-F464 HydrophobicContact CB-CZ 4.3Å; K453-F464 HydrophobicContact CD-CD2 3.69Å; K453-F464 HydrophobicContact CD-CE2 4.2Å; K453-F464 HydrophobicContact CD-CG 4.26Å
454	V	73.8	Confident	67.1	Low	69 Å²	69	81 Å²	81	42%	0.418	42%	0.421	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.6	125.5	172.7	-175.4	0	0	0	0	108.3	I443 R456	I443-V454 HydrophobicContact CG1-CG2 4.36Å; V454-R456 HydrophobicContact CG1-CG 4.43Å
455	I	67.6	Low	66.5	Low	8 Å²	8	82 Å²	82	4%	0.041	43%	0.425	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	119.8	-179.9	-51.5	127.2	0	0	0	108.6	H442 A444 D457 L460 W461	H442-I455 PolarHBondContact N-O 3.49Å; H442-I455 PolarHBondContact O-N 2.9Å; A444-I455 HydrophobicContact CB-CD1 3.68Å; I455-D457 WeakPolarHBondContact CG2-O 3.29Å; I455-L460 HydrophobicContact CG2-CB 4.47Å; I455-W461 VanDerWaalsContact CB-NE1 3.26Å; I455-W461 VanDerWaalsContact CG1-CD1 3.44Å; I455-W461 HydrophobicContact CG2-CG 4.16Å
456	R	66.6	Low	66	Low	156 Å²	156	85.5 Å²	85.5	59%	0.589	44%	0.443	S	S	*	.	S	Bend	trans	-104.2	-12.2	177.9	-63.2	-172.9	-103.1	-133.6	1.6	113.4	Q439 E441 V454	Q439-R456 WeakPolarHBondContact CG-O 3.44Å; Q439-R456 PolarHBondContact NE2-O 2.63Å; E441-R456 HydrophobicContact CG-CG 4.37Å; E441-R456 IonicContact OE1-NH1 2.78Å; V454-R456 HydrophobicContact CG1-CG 4.43Å
457	D	62.1	Low	65.4	Low	70 Å²	70	89.5 Å²	89.5	37%	0.374	48%	0.477	S	S	.	.	S	Bend	trans	-141.4	127.7	-176.3	-165.6	-19.4	0	0	0	109.9	I455 E459 L460	I455-D457 WeakPolarHBondContact CG2-O 3.29Å; D457-E459 PolarHBondContact O-N 3.18Å; D457-E459 VanDerWaalsContact O-N 3.16Å; D457-E459 PolarHBondContact OD1-N 3.28Å; D457-L460 HydrophobicContact CB-CD1 4.21Å; D457-L460 PolarHBondContact O-N 3.34Å
458	T	58.6	Low	65	Low	106 Å²	106	86 Å²	86	65%	0.65	46%	0.457	S	S	*	.	G	3₁₀ helix	trans	-54.3	-27.3	176.9	14.9	0	0	0	0	113.2	L460 W461	T458-L460 VanDerWaalsContact C-N 3.29Å; T458-L460 PolarHBondContact O-N 3.23Å; T458-W461 WeakPolarHBondContact O-CB 3.45Å; T458-W461 PolarHBondContact O-N 3.18Å
459	E	56.2	Low	64.5	Low	163 Å²	163	80.9 Å²	80.9	76%	0.762	44%	0.444	S	S	*	.	G	3₁₀ helix	trans	-72.4	-22.1	178.7	-64.9	-165.3	172.3	0	0	113.4	D457 W461	D457-E459 PolarHBondContact O-N 3.18Å; D457-E459 VanDerWaalsContact O-N 3.16Å; D457-E459 PolarHBondContact OD1-N 3.28Å; E459-W461 VanDerWaalsContact C-N 3.33Å
460	L	58.4	Low	63.8	Low	104 Å²	104	84.9 Å²	84.9	55%	0.545	46%	0.463	S	S	.	.	G	3₁₀ helix	trans	-84	-3.6	177.6	-79.1	157.3	0	0	0	113.5	I455 D457 T458	I455-L460 HydrophobicContact CG2-CB 4.47Å; D457-L460 HydrophobicContact CB-CD1 4.21Å; D457-L460 PolarHBondContact O-N 3.34Å; T458-L460 VanDerWaalsContact C-N 3.29Å; T458-L460 PolarHBondContact O-N 3.23Å
461	W	60.4	Low	63.3	Low	65 Å²	65	83.9 Å²	83.9	25%	0.246	45%	0.446	C	S	.	.	H	α-helix	trans	-73.6	-44.9	-179.8	-91.5	8.4	0	0	0	114.4	H442 I455 T458 E459 F464 L465 M476	H442-W461 HydrophobicContact CB-CZ2 3.98Å; H442-W461 AromaticContact CD2-CZ2 3.73Å; H442-W461 AromaticContact CG-CZ2 3.88Å; I455-W461 VanDerWaalsContact CB-NE1 3.26Å; I455-W461 VanDerWaalsContact CG1-CD1 3.44Å; I455-W461 HydrophobicContact CG2-CG 4.16Å; T458-W461 WeakPolarHBondContact O-CB 3.45Å; T458-W461 PolarHBondContact O-N 3.18Å; E459-W461 VanDerWaalsContact C-N 3.33Å; W461-F464 PolarHBondContact O-N 3.43Å; W461-L465 PolarHBondContact O-N 3.2Å; W461-L465 VanDerWaalsContact O-N 3.14Å; W461-M476 HydrophobicContact CH2-CE 3.98Å; W461-M476 HydrophobicContact CH2-SD 3.31Å; W461-M476 WeakPolarHBondContact CH2-SD 3.08Å; W461-M476 HydrophobicContact CZ2-CE 4.4Å; W461-M476 HydrophobicContact CZ2-SD 3.28Å; W461-M476 WeakPolarHBondContact CZ2-SD 3.04Å; W461-M476 HydrophobicContact CZ3-SD 4.35Å
462	L	62.1	Low	62.9	Low	101 Å²	101	82.7 Å²	82.7	53%	0.529	45%	0.446	S	S	.	.	H	α-helix	trans	-57.7	-44.6	-169.5	-80.1	152.5	0	0	0	113.4	F464 N466	L462-F464 VanDerWaalsContact C-N 3.34Å; L462-F464 PolarHBondContact O-N 2.83Å; L462-N466 WeakPolarHBondContact O-CB 3.23Å; L462-N466 PolarHBondContact O-N 3.31Å; L462-N466 PolarHBondContact O-ND2 3.28Å
463	P	62.7	Low	62.8	Low	86 Å²	86	80 Å²	80	56%	0.558	44%	0.435	S	S	*	.	H	α-helix	trans	-65.5	-35.7	179.6	-20.4	32.6	0	0	0	113.1	A467	P463-A467 WeakPolarHBondContact O-CB 3.02Å; P463-A467 PolarHBondContact O-N 3.09Å; P463-A467 VanDerWaalsContact O-N 3.09Å
464	F	66.9	Low	62.9	Low	24 Å²	24	75.7 Å²	75.7	11%	0.105	42%	0.416	C	S	.	.	H	α-helix	trans	-70.4	-43.6	-178.8	179.1	-97.7	0	0	0	111.6	A444 K453 W461 L462 K468 V474	A444-F464 HydrophobicContact CB-CD1 4.3Å; A444-F464 HydrophobicContact CB-CE1 3.66Å; A444-F464 HydrophobicContact CB-CZ 4.3Å; K453-F464 HydrophobicContact CB-CD2 4.21Å; K453-F464 HydrophobicContact CB-CE2 3.92Å; K453-F464 HydrophobicContact CB-CZ 4.3Å; K453-F464 HydrophobicContact CD-CD2 3.69Å; K453-F464 HydrophobicContact CD-CE2 4.2Å; K453-F464 HydrophobicContact CD-CG 4.26Å; W461-F464 PolarHBondContact O-N 3.43Å; L462-F464 VanDerWaalsContact C-N 3.34Å; L462-F464 PolarHBondContact O-N 2.83Å; F464-K468 HydrophobicContact CZ-CD 4.4Å; F464-K468 PolarHBondContact O-N 3.45Å; F464-V474 HydrophobicContact CE1-CG1 4.35Å
465	L	62.2	Low	63	Low	22 Å²	22	75.3 Å²	75.3	12%	0.115	41%	0.407	C	S	.	.	H	α-helix	trans	-72.6	-39	177.3	-64.8	177.3	0	0	0	112	W461 A467 K468 A469 I487	W461-L465 PolarHBondContact O-N 3.2Å; W461-L465 VanDerWaalsContact O-N 3.14Å; L465-A467 VanDerWaalsContact C-N 3.34Å; L465-A467 PolarHBondContact O-N 3.29Å; L465-K468 CarbonylContact O-C 3.14Å; L465-K468 WeakPolarHBondContact O-CA 3.39Å; L465-K468 PolarHBondContact O-N 3.36Å; L465-A469 WeakPolarHBondContact O-CA 3.35Å; L465-A469 PolarHBondContact O-N 3.13Å; L465-I487 HydrophobicContact CD1-CD1 4.39Å; L465-I487 HydrophobicContact CD2-CD1 3.55Å
466	N	62.8	Low	63.3	Low	103 Å²	103	76 Å²	76	55%	0.551	41%	0.411	S	S	*	.	H	α-helix	trans	-63	-39.7	176.6	-77.3	-11.4	0	0	0	112.1	L462 K468 A469	L462-N466 WeakPolarHBondContact O-CB 3.23Å; L462-N466 PolarHBondContact O-N 3.31Å; L462-N466 PolarHBondContact O-ND2 3.28Å; N466-K468 PolarHBondContact O-N 3.39Å; N466-A469 PolarHBondContact O-N 2.69Å
467	A	61.1	Low	63.6	Low	87 Å²	87	72.8 Å²	72.8	72%	0.719	40%	0.401	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.8	-20.3	173.1	0	0	0	0	0	112.8	P463 L465	P463-A467 WeakPolarHBondContact O-CB 3.02Å; P463-A467 PolarHBondContact O-N 3.09Å; P463-A467 VanDerWaalsContact O-N 3.09Å; L465-A467 VanDerWaalsContact C-N 3.34Å; L465-A467 PolarHBondContact O-N 3.29Å
468	K	62.3	Low	64	Low	27 Å²	27	70.3 Å²	70.3	12%	0.117	39%	0.388	C	S	.	.	T	Hydrogen-bonded Turn	trans	-119.3	21	-178.1	-62.8	-156.3	177.6	-166.3	0	113.5	D446 T449 F464 L465 N466 N470 S471 V474	D446-K468 HydrophobicContact CB-CD 4.23Å; D446-K468 WeakPolarHBondContact OD2-CD 3.5Å; D446-K468 WeakPolarHBondContact OD2-CE 3.44Å; D446-K468 IonicContact OD2-NZ 3.95Å; D446-K468 PolarHBondContact OD2-NZ 2.8Å; T449-K468 PolarHBondContact OG1-NZ 2.97Å; F464-K468 HydrophobicContact CZ-CD 4.4Å; F464-K468 PolarHBondContact O-N 3.45Å; L465-K468 CarbonylContact O-C 3.14Å; L465-K468 WeakPolarHBondContact O-CA 3.39Å; L465-K468 PolarHBondContact O-N 3.36Å; N466-K468 PolarHBondContact O-N 3.39Å; K468-N470 PolarHBondContact O-N 3.33Å; K468-S471 PolarHBondContact O-N 3.5Å; K468-V474 HydrophobicContact CB-CG2 4.48Å; K468-V474 HydrophobicContact CD-CG2 4.29Å
469	A	56.6	Low	64.3	Low	51 Å²	51	68.3 Å²	68.3	42%	0.421	38%	0.378	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.3	-24.3	-171.9	0	0	0	0	0	114	L465 N466 A490	L465-A469 WeakPolarHBondContact O-CA 3.35Å; L465-A469 PolarHBondContact O-N 3.13Å; N466-A469 PolarHBondContact O-N 2.69Å; A469-A490 HydrophobicContact CB-CB 3.96Å
470	N	58	Low	64.7	Low	165 Å²	165	65.7 Å²	65.7	88%	0.882	37%	0.369	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.3	3.3	177.8	-69.2	-10	0	0	0	114.7	K468	K468-N470 PolarHBondContact O-N 3.33Å
471	S	57.1	Low	65	Low	39 Å²	39	68.1 Å²	68.1	27%	0.273	38%	0.376	S	S	.	.			trans	-99.2	109.3	-178.7	-75.7	0	0	0	0	111.8	K468 N473	K468-S471 PolarHBondContact O-N 3.5Å; S471-N473 PolarHBondContact O-N 2.83Å; S471-N473 VanDerWaalsContact O-N 3.13Å
472	T	62.1	Low	65.3	Low	86 Å²	86	70.8 Å²	70.8	53%	0.528	40%	0.403	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78	16.9	174.8	51.4	0	0	0	0	114.1	K486	T472-K486 WeakPolarHBondContact O-CE 2.8Å; T472-K486 PolarHBondContact O-NZ 3.09Å
473	N	70.6	Confident	65.6	Low	55 Å²	55	67.8 Å²	67.8	29%	0.294	39%	0.393	S	S	.	.	T	Hydrogen-bonded Turn	trans	-117.9	18.8	-172.2	-67.9	-30.1	0	0	0	113.8	L447 K448 S471	L447-N473 PolarHBondContact N-O 2.9Å; K448-N473 HydrophobicContact CB-CB 4.19Å; S471-N473 PolarHBondContact O-N 2.83Å; S471-N473 VanDerWaalsContact O-N 3.13Å
474	V	73.4	Confident	66	Low	3 Å²	3	67.4 Å²	67.4	2%	0.018	39%	0.389	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95	124.1	178.6	-173	0	0	0	0	110.4	A444 V445 D446 F464 K468 I487	A444-V474 HydrophobicContact CB-CG1 4.48Å; V445-V474 WeakPolarHBondContact O-CA 3.39Å; D446-V474 HydrophobicContact CB-CG2 4.36Å; F464-V474 HydrophobicContact CE1-CG1 4.35Å; K468-V474 HydrophobicContact CB-CG2 4.48Å; K468-V474 HydrophobicContact CD-CG2 4.29Å; V474-I487 HydrophobicContact CB-CB 4.46Å; V474-I487 HydrophobicContact CG1-CD1 3.98Å; V474-I487 PolarHBondContact O-N 3.21Å
475	Y	74.8	Confident	66	Low	61 Å²	61	67.5 Å²	67.5	24%	0.239	39%	0.392	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	141.9	176.9	-69.1	-101.9	0	0	0	109.8	A444 V445 L447 V484 K486	A444-Y475 WeakPolarHBondContact CA-O 3.39Å; V445-Y475 PolarHBondContact N-O 3.35Å; V445-Y475 PolarHBondContact O-N 2.93Å; L447-Y475 HydrophobicContact CD1-CD2 3.45Å; L447-Y475 VanDerWaalsContact CD1-CD2 3.45Å; L447-Y475 HydrophobicContact CD1-CE2 3.29Å; L447-Y475 HydrophobicContact CD1-CG 4.36Å; L447-Y475 HydrophobicContact CG-CD2 3.74Å; L447-Y475 HydrophobicContact CG-CE2 4Å; Y475-V484 HydrophobicContact CD1-CG1 4.17Å; Y475-K486 HydrophobicContact CD1-CB 3.98Å; Y475-K486 HydrophobicContact CD1-CG 4.24Å; Y475-K486 HydrophobicContact CE1-CB 3.75Å; Y475-K486 HydrophobicContact CE1-CD 4Å; Y475-K486 HydrophobicContact CE1-CG 3.81Å; Y475-K486 HydrophobicContact CE2-CD 4.49Å; Y475-K486 HydrophobicContact CE2-CG 4.32Å
476	M	73.7	Confident	66.4	Low	22 Å²	22	70.3 Å²	70.3	11%	0.108	40%	0.403	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117	129.6	-178.8	-172.5	178.7	75.9	0	0	110.1	H442 I443 W461 V484 S485	H442-M476 HydrophobicContact CB-CG 4.37Å; H442-M476 HydrophobicContact CB-SD 4.45Å; I443-M476 CarbonylContact O-C 3.42Å; I443-M476 WeakPolarHBondContact O-CA 3.27Å; W461-M476 HydrophobicContact CH2-CE 3.98Å; W461-M476 HydrophobicContact CH2-SD 3.31Å; W461-M476 WeakPolarHBondContact CH2-SD 3.08Å; W461-M476 HydrophobicContact CZ2-CE 4.4Å; W461-M476 HydrophobicContact CZ2-SD 3.28Å; W461-M476 WeakPolarHBondContact CZ2-SD 3.04Å; W461-M476 HydrophobicContact CZ3-SD 4.35Å; M476-V484 CarbonylContact O-C 3.59Å; M476-V484 WeakPolarHBondContact O-CA 3.43Å; M476-S485 PolarHBondContact N-O 3.27Å; M476-S485 PolarHBondContact O-N 2.91Å
477	F	74.5	Confident	66.4	Low	88 Å²	88	67.1 Å²	67.1	39%	0.386	39%	0.386	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.4	117.6	175.9	-62.2	-99.9	0	0	0	108.3	H442 I443 V445 V484	H442-F477 WeakPolarHBondContact CA-O 3.34Å; I443-F477 HydrophobicContact CB-CB 4.32Å; I443-F477 PolarHBondContact N-O 3.18Å; I443-F477 PolarHBondContact O-N 2.85Å; V445-F477 HydrophobicContact CB-CE2 4.25Å; V445-F477 HydrophobicContact CG2-CD2 4.08Å; V445-F477 HydrophobicContact CG2-CE2 3.83Å; F477-V484 HydrophobicContact CD1-CB 4.39Å; F477-V484 HydrophobicContact CD1-CG1 4.24Å; F477-V484 HydrophobicContact CD1-CG2 3.46Å; F477-V484 VanDerWaalsContact CD1-CG2 3.46Å; F477-V484 HydrophobicContact CE1-CB 4.29Å; F477-V484 HydrophobicContact CE1-CG1 3.88Å; F477-V484 HydrophobicContact CE1-CG2 3.4Å; F477-V484 VanDerWaalsContact CE1-CG2 3.4Å; F477-V484 HydrophobicContact CE2-CG1 4.42Å; F477-V484 HydrophobicContact CG-CG2 4.41Å; F477-V484 HydrophobicContact CZ-CG1 3.97Å; F477-V484 HydrophobicContact CZ-CG2 4.32Å
478	D	68.6	Low	66	Low	18 Å²	18	68.4 Å²	68.4	10%	0.096	38%	0.38	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.1	114.5	174.5	-174.1	-31.5	0	0	0	108.4	H442 D480 K481 C482 A483	H442-D478 IonicContact CE1-OD1 2.67Å; H442-D478 IonicContact CE1-OD2 2.65Å; H442-D478 PolarHBondContact CE1-OD2 2.94Å; H442-D478 IonicContact ND1-OD2 3.43Å; D478-D480 PolarHBondContact OD1-N 3.4Å; D478-K481 HydrophobicContact CB-CB 4.18Å; D478-K481 PolarHBondContact OD1-N 3.07Å; D478-K481 WeakPolarHBondContact OD2-CD 3.5Å; D478-C482 VanDerWaalsContact O-CA 3.25Å; D478-C482 WeakPolarHBondContact O-CA 3.5Å; D478-C482 PolarHBondContact O-N 3.03Å; D478-A483 PolarHBondContact N-O 2.73Å; D478-A483 PolarHBondContact O-N 2.84Å
479	S	66.5	Low	65.5	Low	65 Å²	65	75.1 Å²	75.1	46%	0.455	41%	0.412	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.9	-39	-179.2	51.8	0	0	0	0	112.2	E441 C482	E441-S479 PolarHBondContact O-OG 3.25Å; S479-C482 PolarHBondContact O-N 3.44Å
480	D	63.3	Low	65.1	Low	107 Å²	107	74.3 Å²	74.3	57%	0.572	41%	0.405	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.5	-36.4	-179.1	-75.2	-19.4	0	0	0	111.6	A440 D478	A440-D480 VanDerWaalsContact CB-OD2 3.29Å; A440-D480 WeakPolarHBondContact CB-OD2 3.39Å; D478-D480 PolarHBondContact OD1-N 3.4Å
481	K	65.6	Low	64.4	Low	156 Å²	156	70 Å²	70	68%	0.678	39%	0.387	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.1	-8.3	178.8	-63.1	-177.7	-173.5	165	0	114	D478 A483	D478-K481 HydrophobicContact CB-CB 4.18Å; D478-K481 PolarHBondContact OD1-N 3.07Å; D478-K481 WeakPolarHBondContact OD2-CD 3.5Å; K481-A483 HydrophobicContact CB-CB 3.9Å; K481-A483 PolarHBondContact O-N 3.16Å; K481-A483 VanDerWaalsContact O-N 3.17Å
482	C	65.7	Low	63.6	Low	121 Å²	121	73 Å²	73	82%	0.818	41%	0.414	S	S	*	.	T	Hydrogen-bonded Turn	trans	44.4	43.6	-167.7	-77.1	0	0	0	0	112	D478 S479	D478-C482 VanDerWaalsContact O-CA 3.25Å; D478-C482 WeakPolarHBondContact O-CA 3.5Å; D478-C482 PolarHBondContact O-N 3.03Å; S479-C482 PolarHBondContact O-N 3.44Å
483	A	68.6	Low	62.3	Low	38 Å²	38	76.2 Å²	76.2	31%	0.314	43%	0.427	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	140.7	-172.8	0	0	0	0	0	111.2	D478 K481	D478-A483 PolarHBondContact N-O 2.73Å; D478-A483 PolarHBondContact O-N 2.84Å; K481-A483 HydrophobicContact CB-CB 3.9Å; K481-A483 PolarHBondContact O-N 3.16Å; K481-A483 VanDerWaalsContact O-N 3.17Å
484	V	70.7	Confident	60.4	Low	78 Å²	78	80.1 Å²	80.1	47%	0.473	45%	0.453	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107	119.4	174.6	-170.8	0	0	0	0	108.8	Y475 M476 F477	Y475-V484 HydrophobicContact CD1-CG1 4.17Å; M476-V484 CarbonylContact O-C 3.59Å; M476-V484 WeakPolarHBondContact O-CA 3.43Å; F477-V484 HydrophobicContact CD1-CB 4.39Å; F477-V484 HydrophobicContact CD1-CG1 4.24Å; F477-V484 HydrophobicContact CD1-CG2 3.46Å; F477-V484 VanDerWaalsContact CD1-CG2 3.46Å; F477-V484 HydrophobicContact CE1-CB 4.29Å; F477-V484 HydrophobicContact CE1-CG1 3.88Å; F477-V484 HydrophobicContact CE1-CG2 3.4Å; F477-V484 VanDerWaalsContact CE1-CG2 3.4Å; F477-V484 HydrophobicContact CE2-CG1 4.42Å; F477-V484 HydrophobicContact CG-CG2 4.41Å; F477-V484 HydrophobicContact CZ-CG1 3.97Å; F477-V484 HydrophobicContact CZ-CG2 4.32Å
485	S	68.8	Low	58.3	Low	25 Å²	25	84.9 Å²	84.9	18%	0.175	49%	0.487	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.3	134.6	178.8	-61.5	0	0	0	0	110.6	M476	M476-S485 PolarHBondContact N-O 3.27Å; M476-S485 PolarHBondContact O-N 2.91Å
486	K	69.7	Low	56.1	Low	81 Å²	81	87.3 Å²	87.3	35%	0.352	51%	0.513	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.3	128.2	174.6	-172	179	-177.2	179.3	0	109.6	T472 Y475 L488	T472-K486 WeakPolarHBondContact O-CE 2.8Å; T472-K486 PolarHBondContact O-NZ 3.09Å; Y475-K486 HydrophobicContact CD1-CB 3.98Å; Y475-K486 HydrophobicContact CD1-CG 4.24Å; Y475-K486 HydrophobicContact CE1-CB 3.75Å; Y475-K486 HydrophobicContact CE1-CD 4Å; Y475-K486 HydrophobicContact CE1-CG 3.81Å; Y475-K486 HydrophobicContact CE2-CD 4.49Å; Y475-K486 HydrophobicContact CE2-CG 4.32Å; K486-L488 HydrophobicContact CD-CD2 4.03Å; K486-L488 HydrophobicContact CG-CD2 4.37Å; K486-L488 PolarHBondContact O-N 2.03Å
487	I	63.3	Low	54.2	Low	37 Å²	37	91.6 Å²	91.6	19%	0.19	54%	0.54	C	S	.	.			trans	-81.3	107.2	173.6	-56.6	-179.7	0	0	0	107.2	L465 V474	L465-I487 HydrophobicContact CD1-CD1 4.39Å; L465-I487 HydrophobicContact CD2-CD1 3.55Å; V474-I487 HydrophobicContact CB-CB 4.46Å; V474-I487 HydrophobicContact CG1-CD1 3.98Å; V474-I487 PolarHBondContact O-N 3.21Å
488	L	53.1	Low	52.1	Low	113 Å²	113	94.8 Å²	94.8	59%	0.592	56%	0.556	S	S	*	*			trans	-81.9	-33.2	-176.9	-69.2	167	0	0	0	112	K486	K486-L488 HydrophobicContact CD-CD2 4.03Å; K486-L488 HydrophobicContact CG-CD2 4.37Å; K486-L488 PolarHBondContact O-N 2.03Å
489	E	51	Low	50.1	Low	169 Å²	169	99.2 Å²	99.2	79%	0.79	59%	0.586	S	S	*	*	S	Bend	trans	-148.6	146	-179.2	-66.3	-178.4	165.6	0	0	110.9	P491	E489-P491 WeakPolarHBondContact O-CD 3.45Å
490	A	48.7	Very low	48.4	Very low	34 Å²	34	99.9 Å²	99.9	28%	0.281	60%	0.595	S	S	.	*			trans	-74.1	120.8	172.4	0	0	0	0	0	109.3	A469 A492	A469-A490 HydrophobicContact CB-CB 3.96Å; A490-A492 PolarHBondContact O-N 3.08Å; A490-A492 VanDerWaalsContact O-N 3.07Å
491	P	43.1	Very low	46.6	Very low	75 Å²	75	104 Å²	104	49%	0.487	61%	0.61	S	S	.	*			trans	-73.2	107.8	-171.4	26	-31.6	0	0	0	111.2	E489 N493	E489-P491 WeakPolarHBondContact O-CD 3.45Å; P491-N493 VanDerWaalsContact C-N 3.3Å; P491-N493 PolarHBondContact O-N 3.36Å; P491-N493 VanDerWaalsContact O-N 3.08Å
492	A	40.5	Very low	44.7	Very low	102 Å²	102	102.1 Å²	102.1	84%	0.843	62%	0.617	S	S	*	*	S	Bend	trans	-71.1	93.1	153.9	0	0	0	0	0	107.3	A490	A490-A492 PolarHBondContact O-N 3.08Å; A490-A492 VanDerWaalsContact O-N 3.07Å
493	N	34.1	Very low	42.9	Very low	152 Å²	152	100.6 Å²	100.6	81%	0.813	61%	0.614	S	S	*	*	S	Bend	trans	67.3	121.6	-175.2	-71.5	-16.2	0	0	0	116	P491 S495	P491-N493 VanDerWaalsContact C-N 3.3Å; P491-N493 PolarHBondContact O-N 3.36Å; P491-N493 VanDerWaalsContact O-N 3.08Å; N493-S495 PolarHBondContact O-N 2.92Å
494	V	30.9	Very low	40.9	Very low	137 Å²	137	103.9 Å²	103.9	83%	0.83	63%	0.634	S	S	*	*	S	Bend	trans	-36.4	113.7	175.1	-178.3	0	0	0	0	114
495	S	28.4	Very low	38.8	Very low	104 Å²	104	106.5 Å²	106.5	73%	0.727	65%	0.65	S	S	*	*			trans	169.9	82.6	138	44	0	0	0	0	112.2	N493	N493-S495 PolarHBondContact O-N 2.92Å
496	S	30.1	Very low	36.7	Very low	112 Å²	112	111 Å²	111	78%	0.783	68%	0.677	S	S	*	*			trans	159.5	107.1	142.1	49.9	0	0	0	0	111.1
497	V	33.8	Very low	34.8	Very low	112 Å²	112	112.7 Å²	112.7	68%	0.679	70%	0.696	S	S	*	*			trans	-93.9	108	158.2	175.7	0	0	0	0	104.8	P499	V497-P499 WeakPolarHBondContact O-CD 3.5Å
498	Q	29.6	Very low	33	Very low	154 Å²	154	118.8 Å²	118.8	72%	0.72	73%	0.728	S	S	*	*	P	Polyproline II helix	trans	-77.9	122.9	172.4	-78.6	-172.9	-25.5	0	0	109	A500	Q498-A500 PolarHBondContact O-N 3.2Å
499	P	27	Very low	31.7	Very low	112 Å²	112	120.9 Å²	120.9	73%	0.727	74%	0.739	S	S	*	*	P	Polyproline II helix	trans	-65.5	128.4	172.2	25.2	-29.6	0	0	0	109	V497 E501	V497-P499 WeakPolarHBondContact O-CD 3.5Å; P499-E501 PolarHBondContact O-N 2.94Å
500	A	30.3	Very low	30.5	Very low	78 Å²	78	118.7 Å²	118.7	65%	0.645	74%	0.739	S	S	*	*	P	Polyproline II helix	trans	-61.4	135.5	171.4	0	0	0	0	0	109.3	Q498 S502	Q498-A500 PolarHBondContact O-N 3.2Å; A500-S502 PolarHBondContact O-N 3.14Å
501	E	26.1	Very low	29.4	Very low	193 Å²	193	125.5 Å²	125.5	90%	0.902	77%	0.77	S	S	*	*	P	Polyproline II helix	trans	-49.5	124.5	179.1	-82.1	177	144.8	0	0	110.9	P499 A503	P499-E501 PolarHBondContact O-N 2.94Å; E501-A503 PolarHBondContact O-N 3.23Å
502	S	25.1	Very low	28.5	Very low	117 Å²	117	132.1 Å²	132.1	82%	0.818	79%	0.791	S	S	*	*			trans	-60	96.7	179.8	50.1	0	0	0	0	111	A500 S504	A500-S502 PolarHBondContact O-N 3.14Å; S502-S504 PolarHBondContact O-N 2.85Å; S502-S504 VanDerWaalsContact O-N 3.16Å
503	A	27.7	Very low	27.7	Very low	90 Å²	90	132.1 Å²	132.1	74%	0.744	79%	0.785	S	S	*	*			trans	-69.5	105	156.4	0	0	0	0	0	107.4	E501 T505	E501-A503 PolarHBondContact O-N 3.23Å; A503-T505 PolarHBondContact O-N 3.49Å; A503-T505 VanDerWaalsContact O-N 3.09Å
504	S	27.3	Very low	27.2	Very low	106 Å²	106	129.9 Å²	129.9	74%	0.741	78%	0.781	S	S	*	*			trans	-36.2	109.2	176.5	171.9	0	0	0	0	113	S502 T506	S502-S504 PolarHBondContact O-N 2.85Å; S502-S504 VanDerWaalsContact O-N 3.16Å; S504-T506 PolarHBondContact O-N 3.37Å
505	T	25.5	Very low	26.9	Very low	134 Å²	134	128.7 Å²	128.7	82%	0.822	78%	0.778	S	S	*	*			trans	-87.3	93.7	171.6	39.8	0	0	0	0	109.6	A503	A503-T505 PolarHBondContact O-N 3.49Å; A503-T505 VanDerWaalsContact O-N 3.09Å
506	T	25.4	Very low	26.8	Very low	118 Å²	118	128.5 Å²	128.5	72%	0.724	78%	0.777	S	S	*	*	P	Polyproline II helix	trans	-75.7	131.1	166.9	-39.7	0	0	0	0	108.7	S504	S504-T506 PolarHBondContact O-N 3.37Å
507	P	28.9	Very low	26.7	Very low	117 Å²	117	131.7 Å²	131.7	76%	0.76	78%	0.78	S	S	*	*	P	Polyproline II helix	trans	-66.3	144.5	-170.3	24.3	-34.1	0	0	0	113.5
508	L	25.9	Very low	26.5	Very low	165 Å²	165	135 Å²	135	86%	0.864	79%	0.788	S	S	*	*	S	Bend	trans	-59.2	145.3	172.2	-73.2	153.7	0	0	0	111
509	I	26.2	Very low	26.3	Very low	158 Å²	158	136 Å²	136	81%	0.81	80%	0.798	S	S	*	*			trans	96.4	87.3	175.2	-47	161.5	0	0	0	114.1
510	P	26.5	Very low	26.5	Very low	123 Å²	123	135.9 Å²	135.9	80%	0.799	80%	0.8	S	S	*	*			trans	-83.8	130.4	168.7	-2.1	21.1	0	0	0	111.9
511	L	24.5	Very low	26.3	Very low	177 Å²	177	140.6 Å²	140.6	93%	0.927	81%	0.808	S	S	*	*			trans	-64.2	122.9	162.9	-80.9	130.6	0	0	0	109.8
512	K	24.6	Very low	26.3	Very low	213 Å²	213	137.7 Å²	137.7	93%	0.926	81%	0.808	S	S	*	*			trans	-93.1	113	-177.7	-161.3	177.4	-174.4	-178.5	0	110.1
513	S	23.2	Very low	26.5	Very low	103 Å²	103	139.8 Å²	139.8	72%	0.72	81%	0.809	S	S	*	*			trans	-131.6	128.1	163	58.3	0	0	0	0	110.7
514	S	24.7	Very low	26.6	Very low	104 Å²	104	140.5 Å²	140.5	73%	0.727	81%	0.809	S	S	*	*			trans	59.7	124.9	154.5	61.5	0	0	0	0	121.1
515	S	25	Very low	26.5	Very low	112 Å²	112	146 Å²	146	78%	0.783	81%	0.813	S	S	*	*			trans	57.2	126.5	148.9	62.2	0	0	0	0	117.6
516	S	26.1	Very low	26.5	Very low	100 Å²	100	148.8 Å²	148.8	70%	0.699	81%	0.814	S	S	*	*			cis	-168.6	150.1	35.3	43	0	0	0	0	109.9
517	E	27.4	Very low	26.7	Very low	179 Å²	179	150.4 Å²	150.4	84%	0.836	81%	0.813	S	S	*	*			trans	76.6	127.8	146.2	-72.2	174.6	172.7	0	0	122.4
518	E	29.1	Very low	26.5	Very low	183 Å²	183	151.5 Å²	151.5	86%	0.855	81%	0.812	S	S	*	*			trans	80.5	78	157	-63.2	-173.4	170.5	0	0	119.6	S520	E518-S520 PolarHBondContact O-N 3.04Å
519	D	25.9	Very low	26.4	Very low	173 Å²	173	152.3 Å²	152.3	93%	0.925	81%	0.809	S	S	*	*			trans	-59.6	103.7	158.8	-73.6	-46.5	0	0	0	111.4
520	S	30.3	Very low	26.5	Very low	111 Å²	111	153.9 Å²	153.9	78%	0.776	81%	0.81	S	S	*	*			trans	-100.8	107.1	158.5	53.9	0	0	0	0	109.4	E518 C522	E518-S520 PolarHBondContact O-N 3.04Å; S520-C522 PolarHBondContact O-N 3.44Å
521	H	27.3	Very low	26.5	Very low	176 Å²	176	156.5 Å²	156.5	82%	0.815	81%	0.812	S	S	*	*			trans	2.2	102	165.3	-83.5	-86	0	0	0	117.6	L523	H521-L523 PolarHBondContact O-N 3.11Å
522	C	24.7	Very low	26.5	Very low	133 Å²	133	155 Å²	155	90%	0.899	81%	0.805	S	S	*	*			trans	-67.3	97.2	151.7	-81.3	0	0	0	0	109.3	S520 S524	S520-C522 PolarHBondContact O-N 3.44Å; C522-S524 PolarHBondContact O-N 3.01Å
523	L	29.4	Very low	26.7	Very low	161 Å²	161	154.2 Å²	154.2	84%	0.843	81%	0.807	S	S	*	*			trans	-63	130.4	165.8	-83.5	160.3	0	0	0	110.1	H521 R525	H521-L523 PolarHBondContact O-N 3.11Å; L523-R525 PolarHBondContact O-N 3.24Å
524	S	29.7	Very low	26.7	Very low	105 Å²	105	160.5 Å²	160.5	73%	0.734	82%	0.815	S	S	*	*			trans	-57.5	127.2	-175.2	62.4	0	0	0	0	113.1	C522 K526	C522-S524 PolarHBondContact O-N 3.01Å; S524-K526 PolarHBondContact O-N 3.35Å; S524-K526 VanDerWaalsContact O-N 3.11Å
525	R	27	Very low	27	Very low	221 Å²	221	160.3 Å²	160.3	83%	0.834	81%	0.813	S	S	*	*			trans	-11.7	98.5	149.1	-175	-179.9	-92.2	-179.3	-7.9	113.8	L523 E527	L523-R525 PolarHBondContact O-N 3.24Å; R525-E527 HydrophobicContact CG-CG 4.31Å
526	K	25.8	Very low	27.1	Very low	193 Å²	193	162.8 Å²	162.8	84%	0.839	81%	0.813	S	S	*	*			trans	-81.2	110.6	152.1	-93.1	-176.8	175.5	178.2	0	107.2	S524 L528	S524-K526 PolarHBondContact O-N 3.35Å; S524-K526 VanDerWaalsContact O-N 3.11Å; K526-L528 PolarHBondContact O-N 3.24Å
527	E	27.9	Very low	27.5	Very low	151 Å²	151	169.5 Å²	169.5	71%	0.706	82%	0.824	S	S	*	*			trans	-60.6	101.4	166.5	-66.8	-175.7	156.7	0	0	108.5	R525 F529	R525-E527 HydrophobicContact CG-CG 4.31Å; E527-F529 PolarHBondContact O-N 2.76Å
528	L	25.8	Very low	27.5	Very low	141 Å²	141	169.1 Å²	169.1	74%	0.738	83%	0.828	S	S	*	*			trans	-78	100.1	166.4	-102.5	127.8	0	0	0	107.5	K526 F530	K526-L528 PolarHBondContact O-N 3.24Å; L528-F530 PolarHBondContact O-N 2.86Å
529	F	23.6	Very low	27.7	Very low	181 Å²	181	165.2 Å²	165.2	79%	0.794	81%	0.813	S	S	*	*			trans	-52.9	116.4	161	-86.9	-98.6	0	0	0	109.2	E527	E527-F529 PolarHBondContact O-N 2.76Å
530	F	28.9	Very low	28.3	Very low	192 Å²	192	161.9 Å²	161.9	84%	0.842	80%	0.801	S	S	*	*			trans	-93.7	104.3	161.9	-87.2	-85.8	0	0	0	108.2	L528	L528-F530 PolarHBondContact O-N 2.86Å
531	E	25.2	Very low	28.4	Very low	177 Å²	177	161.4 Å²	161.4	83%	0.827	80%	0.797	S	S	*	*			trans	-63.8	128.4	164.7	-79.6	-175.4	138.8	0	0	110.4
532	N	25.9	Very low	28.5	Very low	146 Å²	146	157.3 Å²	157.3	78%	0.781	78%	0.781	S	S	*	*			trans	29	92.3	145.8	-80.7	-24.2	0	0	0	117.8
533	M	27.1	Very low	28.9	Very low	196 Å²	196	158.6 Å²	158.6	97%	0.966	77%	0.773	S	S	*	*			trans	-101.7	102	141.6	-78.9	-153.6	-72.9	0	0	109.5
534	R	24	Very low	29.1	Very low	236 Å²	236	161.6 Å²	161.6	89%	0.891	78%	0.775	S	S	*	*			trans	-79.2	124.5	155.6	-82.5	178.3	172.2	173	-2.6	107.8
535	S	29.9	Very low	29.4	Very low	99 Å²	99	159.9 Å²	159.9	69%	0.692	77%	0.767	S	S	*	*			trans	177.2	115.1	135	176.1	0	0	0	0	111.3
536	E	28.3	Very low	29.7	Very low	165 Å²	165	152.8 Å²	152.8	77%	0.771	76%	0.756	S	S	*	*			trans	40	87.9	137.3	-65.5	172.4	142.7	0	0	119.4
537	Y	33.5	Very low	30.1	Very low	240 Å²	240	148 Å²	148	94%	0.941	75%	0.747	S	S	*	*			trans	-152.3	84	133.1	-89.7	-72	0	0	0	108.6	N539	Y537-N539 PolarHBondContact O-N 2.83Å; Y537-N539 VanDerWaalsContact O-N 3.09Å
538	D	28.5	Very low	30.2	Very low	172 Å²	172	148.1 Å²	148.1	92%	0.92	75%	0.752	S	S	*	*			trans	-71.2	93.8	169.5	-82.7	-36.8	0	0	0	109.8
539	N	33.4	Very low	30.4	Very low	100 Å²	100	146.7 Å²	146.7	54%	0.535	75%	0.749	S	S	.	*			trans	-141.5	107.8	153.3	-164.1	-24.4	0	0	0	110.3	Y537 S541 L542	Y537-N539 PolarHBondContact O-N 2.83Å; Y537-N539 VanDerWaalsContact O-N 3.09Å; N539-S541 PolarHBondContact O-N 3.35Å; N539-S541 PolarHBondContact OD1-N 3.15Å; N539-S541 PolarHBondContact OD1-OG 3.18Å; N539-L542 PolarHBondContact O-N 3Å
540	P	37.7	Very low	30.8	Very low	103 Å²	103	149.2 Å²	149.2	67%	0.669	75%	0.754	S	S	*	*	G	3₁₀ helix	trans	-67.9	-4.7	-170.6	24.3	-32.3	0	0	0	114.8	L542	P540-L542 VanDerWaalsContact C-N 3.27Å; P540-L542 PolarHBondContact O-N 3.19Å
541	S	32.2	Very low	31	Very low	101 Å²	101	147 Å²	147	71%	0.706	75%	0.749	S	S	*	*	G	3₁₀ helix	trans	-76.7	-11.5	178.1	-50.5	0	0	0	0	113.8	N539	N539-S541 PolarHBondContact O-N 3.35Å; N539-S541 PolarHBondContact OD1-N 3.15Å; N539-S541 PolarHBondContact OD1-OG 3.18Å
542	L	30.9	Very low	31.5	Very low	91 Å²	91	144 Å²	144	48%	0.476	74%	0.743	S	S	.	*	G	3₁₀ helix	trans	-95.5	-7.7	-175.9	-114.4	135.8	0	0	0	114.2	M452 N539 P540 Y544 A545	M452-L542 HydrophobicContact CE-CD1 4.01Å; M452-L542 HydrophobicContact CE-CD2 3.69Å; M452-L542 HydrophobicContact CE-CG 4.11Å; N539-L542 PolarHBondContact O-N 3Å; P540-L542 VanDerWaalsContact C-N 3.27Å; P540-L542 PolarHBondContact O-N 3.19Å; L542-Y544 PolarHBondContact O-N 3.15Å; L542-A545 PolarHBondContact O-N 3.05Å
543	H	32	Very low	31.7	Very low	159 Å²	159	142.4 Å²	142.4	74%	0.736	74%	0.74	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69	-16.8	179.9	-90.8	-68.8	0	0	0	114.6
544	Y	33.9	Very low	32	Very low	224 Å²	224	141.4 Å²	141.4	88%	0.878	74%	0.738	S	S	*	*	T	Hydrogen-bonded Turn	trans	-92.5	-7.9	-179.7	-84.3	-81.4	0	0	0	115	L542	L542-Y544 PolarHBondContact O-N 3.15Å
545	A	36	Very low	32.5	Very low	69 Å²	69	134.9 Å²	134.9	57%	0.57	73%	0.729	S	S	*	*	T	Hydrogen-bonded Turn	trans	-115.9	-16.9	-176.8	0	0	0	0	0	114.5	L542	L542-A545 PolarHBondContact O-N 3.05Å
546	A	33.3	Very low	32.7	Very low	73 Å²	73	140.3 Å²	140.3	60%	0.603	74%	0.74	S	S	*	*	S	Bend	trans	-82.8	-16.4	-177.2	0	0	0	0	0	114.2	D548	A546-D548 PolarHBondContact O-N 2.83Å
547	S	33.6	Very low	33.1	Very low	92 Å²	92	136.8 Å²	136.8	64%	0.643	74%	0.739	S	S	*	*	S	Bend	trans	-76.8	-16	-173.9	49.1	0	0	0	0	115.2
548	D	31.3	Very low	32.9	Very low	153 Å²	153	134.6 Å²	134.6	82%	0.818	74%	0.737	S	S	*	*	S	Bend	trans	-117.5	5.1	-174.1	-84.1	-27.1	0	0	0	115.8	A546	A546-D548 PolarHBondContact O-N 2.83Å
549	V	30.3	Very low	33.1	Very low	112 Å²	112	141.9 Å²	141.9	68%	0.679	75%	0.752	S	S	*	*			trans	-101.4	92.8	177.2	-172.3	0	0	0	0	110.7
550	R	30.8	Very low	33.1	Very low	233 Å²	233	144 Å²	144	88%	0.879	76%	0.763	S	S	*	*			trans	-84.9	115.2	166.8	-70.5	-169.3	-169.7	-160.1	4.1	110.2	V552	R550-V552 PolarHBondContact O-N 3.33Å
551	I	33.5	Very low	32.8	Very low	145 Å²	145	146.1 Å²	146.1	74%	0.744	77%	0.767	S	S	*	*			trans	-82.3	104.8	167.4	-57.6	174.6	0	0	0	107.4	P553	I551-P553 WeakPolarHBondContact O-CD 3.43Å
552	V	36.2	Very low	32.8	Very low	116 Å²	116	148.6 Å²	148.6	70%	0.703	77%	0.771	S	S	*	*			trans	-88.2	116.4	174.6	-174.5	0	0	0	0	108.1	R550 L554	R550-V552 PolarHBondContact O-N 3.33Å; V552-L554 PolarHBondContact O-N 3.12Å
553	P	28.6	Very low	33	Very low	112 Å²	112	152 Å²	152	73%	0.727	79%	0.788	S	S	*	*			trans	-66	122.3	170	-7.5	21.9	0	0	0	108.1	I551 S555	I551-P553 WeakPolarHBondContact O-CD 3.43Å; P553-S555 PolarHBondContact O-N 2.69Å
554	L	33.2	Very low	33	Very low	174 Å²	174	151.6 Å²	151.6	91%	0.911	79%	0.791	S	S	*	*			trans	-66.8	89.9	164.7	-83.7	157.1	0	0	0	107.5	V552 K556	V552-L554 PolarHBondContact O-N 3.12Å; L554-K556 PolarHBondContact O-N 2.78Å
555	S	35.1	Very low	33	Very low	100 Å²	100	146.7 Å²	146.7	70%	0.699	79%	0.786	S	S	*	*			trans	-57	122.4	160.1	54.2	0	0	0	0	106.7	P553 A557	P553-S555 PolarHBondContact O-N 2.69Å; S555-A557 VanDerWaalsContact C-N 3.3Å; S555-A557 PolarHBondContact O-N 3.26Å
556	K	34.4	Very low	32.7	Very low	213 Å²	213	152.3 Å²	152.3	93%	0.926	80%	0.801	S	S	*	*			trans	-49.8	96.8	171	-83.8	-179.8	171.3	-178.4	0	108.8	L554	L554-K556 PolarHBondContact O-N 2.78Å
557	A	36.5	Very low	32.7	Very low	91 Å²	91	158.4 Å²	158.4	75%	0.752	82%	0.816	S	S	*	*			trans	-78.2	119.4	161.4	0	0	0	0	0	106.2	S555 R559	S555-A557 VanDerWaalsContact C-N 3.3Å; S555-A557 PolarHBondContact O-N 3.26Å; A557-R559 PolarHBondContact O-N 3.25Å
558	E	30.2	Very low	32.6	Very low	194 Å²	194	163.9 Å²	163.9	91%	0.907	83%	0.831	S	S	*	*			trans	-23.1	112.2	172.9	-66.1	160.8	154.1	0	0	115.2
559	R	31.4	Very low	32.7	Very low	324 Å²	324	164.9 Å²	164.9	100%	1.223	83%	0.832	S	S	*	*				-138.4	0	129.8	-86.2	-166.3	-170	177.5	4.2	109.2	A557	A557-R559 PolarHBondContact O-N 3.25Å

Retrieved 559 of 559 residues in 289.8 ms (Link to these results)

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