A0A087XP82_POEFO Loading...

Interleukin-1

AlphaFold DB , UniProt , Accession A0A087XP82, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 247 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	33.2	Very low	48.3	Very low	244 Å²	244	129.8 Å²	129.8	100%	1.202	67%	0.669	S	S	*	*				0	84.1	0	-155.8	163.8	85.5	0	0	106.5	S3	M1-S3 PolarHBondContact O-N 3.36Å
2	E	33	Very low	49.3	Very low	195 Å²	195	130.1 Å²	130.1	91%	0.911	67%	0.668	S	S	*	*			trans	-76.3	115.3	-175.9	-78.8	176.7	146.3	0	0	109.6	K4	E2-K4 PolarHBondContact O-N 2.91Å; E2-K4 VanDerWaalsContact O-N 3.09Å
3	S	37.5	Very low	50	Low	102 Å²	102	131.5 Å²	131.5	71%	0.713	66%	0.659	S	S	*	*			trans	-73.3	96.6	174	176.8	0	0	0	0	108.9	M1 K5	M1-S3 PolarHBondContact O-N 3.36Å; S3-K5 PolarHBondContact O-N 3.09Å
4	K	45.2	Very low	50.8	Low	187 Å²	187	126.5 Å²	126.5	81%	0.813	65%	0.649	S	S	*	*			trans	-58.4	99.7	163.4	-87.8	-176.4	174	-179.3	0	108.5	E2 N6	E2-K4 PolarHBondContact O-N 2.91Å; E2-K4 VanDerWaalsContact O-N 3.09Å; K4-N6 PolarHBondContact O-N 3.08Å; K4-N6 VanDerWaalsContact O-N 3.08Å
5	K	48.8	Very low	51.5	Low	181 Å²	181	128.4 Å²	128.4	79%	0.787	66%	0.661	S	S	*	*			trans	-74.5	93.4	167.7	-74.6	-175.8	179.5	176.7	0	107.3	S3 C7	S3-K5 PolarHBondContact O-N 3.09Å; K5-C7 PolarHBondContact O-N 3.16Å; K5-C7 VanDerWaalsContact O-N 3.16Å
6	N	49.6	Very low	52.4	Low	125 Å²	125	131.3 Å²	131.3	67%	0.668	67%	0.667	S	S	*	*			trans	-65.7	113.6	170.2	-72.6	-10.6	0	0	0	108.2	K4 S8	K4-N6 PolarHBondContact O-N 3.08Å; K4-N6 VanDerWaalsContact O-N 3.08Å; N6-S8 PolarHBondContact O-N 2.99Å
7	C	53.5	Low	53.1	Low	44 Å²	44	127.4 Å²	127.4	30%	0.297	65%	0.647	S	S	.	*			trans	-70.3	122.2	175.5	-168	0	0	0	0	109.1	K5 I9 S10	K5-C7 PolarHBondContact O-N 3.16Å; K5-C7 VanDerWaalsContact O-N 3.16Å; C7-I9 PolarHBondContact O-N 3.39Å; C7-S10 PolarHBondContact O-N 3.44Å; C7-S10 VanDerWaalsContact O-N 3.15Å; C7-S10 PolarHBondContact O-OG 3.15Å
8	S	57	Low	54	Low	85 Å²	85	125.3 Å²	125.3	59%	0.594	64%	0.643	S	S	*	*	H	α-helix	trans	-56.4	-19.9	-179.6	-179.7	0	0	0	0	113.6	N6	N6-S8 PolarHBondContact O-N 2.99Å
9	I	57.6	Low	54.9	Low	97 Å²	97	130.2 Å²	130.2	50%	0.497	66%	0.659	S	S	.	*	H	α-helix	trans	-73.9	-38	-178.9	-62.7	172.9	0	0	0	111.3	C7 Q11 M12 W13	C7-I9 PolarHBondContact O-N 3.39Å; I9-Q11 VanDerWaalsContact C-N 3.27Å; I9-Q11 PolarHBondContact O-N 3.47Å; I9-M12 PolarHBondContact O-N 3.11Å; I9-M12 VanDerWaalsContact O-N 3.11Å; I9-W13 PolarHBondContact O-N 3.37Å
10	S	55.8	Low	55.5	Low	37 Å²	37	128.1 Å²	128.1	26%	0.259	67%	0.671	S	S	.	*	H	α-helix	trans	-60.3	-39.2	-179	-44.7	0	0	0	0	111.6	C7 M12 W13 A14 I25	C7-S10 PolarHBondContact O-N 3.44Å; C7-S10 VanDerWaalsContact O-N 3.15Å; C7-S10 PolarHBondContact O-OG 3.15Å; S10-M12 VanDerWaalsContact C-N 3.34Å; S10-M12 PolarHBondContact O-N 3.31Å; S10-W13 PolarHBondContact O-N 3.25Å; S10-A14 PolarHBondContact O-N 3.46Å; S10-I25 WeakPolarHBondContact OG-CD1 3.16Å
11	Q	60.2	Low	55.9	Low	131 Å²	131	126 Å²	126	61%	0.612	66%	0.664	S	S	*	*	H	α-helix	trans	-71.1	-26.8	179.1	-70.7	-179.5	-13.7	0	0	113.2	I9	I9-Q11 VanDerWaalsContact C-N 3.27Å; I9-Q11 PolarHBondContact O-N 3.47Å
12	M	60.9	Low	57.5	Low	133 Å²	133	121.8 Å²	121.8	66%	0.655	65%	0.646	S	S	*	*	H	α-helix	trans	-73.9	-26.8	178.4	-70.5	-178.7	71.5	0	0	113.1	I9 S10	I9-M12 PolarHBondContact O-N 3.11Å; I9-M12 VanDerWaalsContact O-N 3.11Å; S10-M12 VanDerWaalsContact C-N 3.34Å; S10-M12 PolarHBondContact O-N 3.31Å
13	W	58.1	Low	59.3	Low	148 Å²	148	115.9 Å²	115.9	56%	0.561	62%	0.62	S	S	*	*	H	α-helix	trans	-100.4	-20.7	-174.8	-72.4	66.7	0	0	0	113.5	I9 S10 N15 K16 M17 L23	I9-W13 PolarHBondContact O-N 3.37Å; S10-W13 PolarHBondContact O-N 3.25Å; W13-N15 PolarHBondContact O-N 3.48Å; W13-K16 PolarHBondContact O-N 3.25Å; W13-M17 PolarHBondContact O-N 2.89Å; W13-L23 HydrophobicContact CB-CD2 4.26Å
14	A	60.4	Low	60.7	Low	62 Å²	62	119.8 Å²	119.8	51%	0.512	63%	0.627	S	S	.	*	H	α-helix	trans	-53.5	-38.9	176.6	0	0	0	0	0	112.9	S10 K16 M17	S10-A14 PolarHBondContact O-N 3.46Å; A14-K16 PolarHBondContact O-N 3.07Å; A14-M17 PolarHBondContact O-N 3.13Å
15	N	61.3	Low	61.8	Low	155 Å²	155	114 Å²	114	83%	0.829	61%	0.605	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75	-7	179.3	-67.7	-18.4	0	0	0	114.3	W13	W13-N15 PolarHBondContact O-N 3.48Å
16	K	67.2	Low	62.5	Low	174 Å²	174	109.4 Å²	109.4	76%	0.757	60%	0.595	S	S	*	*	T	Hydrogen-bonded Turn	trans	-108.1	-5.5	177.9	-70.1	-171.7	177	-174.1	0	113.1	W13 A14	W13-K16 PolarHBondContact O-N 3.25Å; A14-K16 PolarHBondContact O-N 3.07Å
17	M	64	Low	63.1	Low	66 Å²	66	110.5 Å²	110.5	33%	0.325	60%	0.596	S	S	.	*	S	Bend	trans	-81.9	141.2	-178.3	-72.9	-58.9	-163.7	0	0	111.8	W13 A14 L23	W13-M17 PolarHBondContact O-N 2.89Å; A14-M17 PolarHBondContact O-N 3.13Å; M17-L23 HydrophobicContact CE-CB 4.18Å; M17-L23 HydrophobicContact CE-CD1 4.25Å; M17-L23 HydrophobicContact CE-CD2 4.35Å; M17-L23 HydrophobicContact CE-CG 4.5Å
18	P	69.5	Low	63.6	Low	90 Å²	90	115.9 Å²	115.9	58%	0.584	62%	0.617	S	S	*	*	P	Polyproline II helix	trans	-58.2	150.6	170.7	-21.1	32	0	0	0	111.9	G20 V21	P18-G20 PolarHBondContact O-N 3.34Å; P18-V21 HydrophobicContact CB-CG2 4.4Å; P18-V21 PolarHBondContact O-N 2.93Å
19	K	70.9	Confident	63.7	Low	218 Å²	218	117.7 Å²	117.7	95%	0.948	63%	0.626	S	S	*	*	T	Hydrogen-bonded Turn	trans	-58.2	124.7	175.7	-69.4	-175.7	-179.9	-179.3	0	110
20	G	65.6	Low	64.1	Low	87 Å²	87	116.9 Å²	116.9	90%	0.897	63%	0.628	S	S	*	*	T	Hydrogen-bonded Turn	trans	100.8	-0	178.4	0	0	0	0	0	115.4	P18	P18-G20 PolarHBondContact O-N 3.34Å
21	V	64	Low	65	Low	85 Å²	85	118.6 Å²	118.6	52%	0.515	64%	0.639	S	S	.	*			trans	-111.2	129.7	175.1	-171.9	0	0	0	0	109.5	P18	P18-V21 HydrophobicContact CB-CG2 4.4Å; P18-V21 PolarHBondContact O-N 2.93Å
22	D	68.1	Low	65.7	Low	156 Å²	156	119.8 Å²	119.8	83%	0.834	65%	0.647	S	S	*	*			trans	-115.2	150.1	174.9	-164	11.9	0	0	0	110.7
23	L	71.4	Confident	66.1	Low	70 Å²	70	121 Å²	121	37%	0.366	64%	0.644	S	S	.	*			trans	-114.8	108.4	-178.1	-179.1	70.7	0	0	0	109.9	W13 M17	W13-L23 HydrophobicContact CB-CD2 4.26Å; M17-L23 HydrophobicContact CE-CB 4.18Å; M17-L23 HydrophobicContact CE-CD1 4.25Å; M17-L23 HydrophobicContact CE-CD2 4.35Å; M17-L23 HydrophobicContact CE-CG 4.5Å
24	E	65.2	Low	66.5	Low	185 Å²	185	117.2 Å²	117.2	86%	0.864	64%	0.64	S	S	*	*			trans	-101.4	129.9	173	-166	173.8	-174.5	0	0	110.7
25	I	69.1	Low	67.2	Low	65 Å²	65	116.6 Å²	116.6	33%	0.333	63%	0.63	S	S	.	*			trans	-101.6	107.7	177.6	-56.7	-176.2	0	0	0	108.4	S10	S10-I25 WeakPolarHBondContact OG-CD1 3.16Å
26	S	64.1	Low	67.6	Low	85 Å²	85	111.3 Å²	111.3	59%	0.594	61%	0.607	S	S	*	*			trans	-77.1	134.2	171.8	-179.6	0	0	0	0	110.8	Q28	S26-Q28 PolarHBondContact OG-N 3.2Å
27	H	62.5	Low	67.6	Low	147 Å²	147	106.8 Å²	106.8	68%	0.681	59%	0.591	S	S	*	*			trans	-94.7	6.2	176.7	-70.6	-69	0	0	0	113.4
28	Q	62.5	Low	67.9	Low	158 Å²	158	108.8 Å²	108.8	74%	0.738	60%	0.603	S	S	*	*	S	Bend	trans	-73.4	126.8	175.4	-72.4	-179.5	-28	0	0	109.8	S26 P30	S26-Q28 PolarHBondContact OG-N 3.2Å; Q28-P30 WeakPolarHBondContact O-CD 3.34Å
29	P	59.1	Low	68.1	Low	122 Å²	122	109.4 Å²	109.4	79%	0.792	60%	0.6	S	S	*	*	P	Polyproline II helix	trans	-63.4	120	176.6	23.1	-29.5	0	0	0	108.9
30	P	66.3	Low	68.1	Low	81 Å²	81	102.6 Å²	102.6	53%	0.526	57%	0.573	S	S	.	*	P	Polyproline II helix	trans	-68.2	145.3	179.8	27.9	-33.3	0	0	0	109.7	Q28 C34 V35	Q28-P30 WeakPolarHBondContact O-CD 3.34Å; P30-C34 HydrophobicContact CB-CB 4.08Å; P30-V35 HydrophobicContact CB-CG2 3.97Å; P30-V35 HydrophobicContact CG-CG2 3.7Å
31	S	75	Confident	68.2	Low	72 Å²	72	99.6 Å²	99.6	50%	0.503	54%	0.54	S	S	.	.	P	Polyproline II helix	trans	-63.6	151	168	66.7	0	0	0	0	109.7	R33 C34 V35	S31-R33 PolarHBondContact O-N 3.43Å; S31-R33 VanDerWaalsContact O-N 3.07Å; S31-C34 WeakPolarHBondContact O-CA 3.48Å; S31-C34 WeakPolarHBondContact O-CB 3.34Å; S31-C34 PolarHBondContact O-N 3.28Å; S31-C34 PolarHBondContact OG-N 3.49Å; S31-V35 PolarHBondContact O-N 2.93Å; S31-V35 VanDerWaalsContact O-N 3.13Å
32	M	74.6	Confident	68.4	Low	157 Å²	157	101.1 Å²	101.1	77%	0.773	54%	0.543	S	S	*	.	H	α-helix	trans	-54.8	-29.4	174.2	-75.2	-59.9	-63.2	0	0	112.4	V35 A36	M32-V35 PolarHBondContact O-N 2.72Å; M32-A36 WeakPolarHBondContact O-CB 3.5Å; M32-A36 PolarHBondContact O-N 2.95Å
33	R	69.7	Low	68.5	Low	158 Å²	158	99 Å²	99	60%	0.596	53%	0.528	S	S	*	.	H	α-helix	trans	-61.5	-47.5	172.2	-176.8	-173.1	-75.1	163.4	-10.3	111.8	S31 V35 A36 N37 E74	S31-R33 PolarHBondContact O-N 3.43Å; S31-R33 VanDerWaalsContact O-N 3.07Å; R33-V35 VanDerWaalsContact C-N 3.33Å; R33-V35 PolarHBondContact O-N 2.92Å; R33-A36 PolarHBondContact O-N 3.05Å; R33-N37 WeakPolarHBondContact O-CB 3.25Å; R33-N37 PolarHBondContact O-N 3.02Å; R33-E74 IonicContact CZ-OE1 3.64Å; R33-E74 IonicContact NH2-OE1 2.76Å; R33-E74 PolarHBondContact NH2-OE1 3.39Å
34	C	66.9	Low	68.3	Low	69 Å²	69	102.5 Å²	102.5	47%	0.466	54%	0.536	S	S	.	.	H	α-helix	trans	-61.4	-43.3	177.6	-174.3	0	0	0	0	111.2	P30 S31 N37 L38	P30-C34 HydrophobicContact CB-CB 4.08Å; S31-C34 WeakPolarHBondContact O-CA 3.48Å; S31-C34 WeakPolarHBondContact O-CB 3.34Å; S31-C34 PolarHBondContact O-N 3.28Å; S31-C34 PolarHBondContact OG-N 3.49Å; C34-N37 PolarHBondContact O-N 2.76Å; C34-L38 WeakPolarHBondContact O-CB 3.49Å; C34-L38 PolarHBondContact O-N 3.48Å
35	V	74.3	Confident	68.4	Low	49 Å²	49	97.3 Å²	97.3	30%	0.297	51%	0.514	S	S	.	.	H	α-helix	trans	-63.7	-46.6	178.3	179.5	0	0	0	0	111.7	P30 S31 M32 R33 N37 L38 I39	P30-V35 HydrophobicContact CB-CG2 3.97Å; P30-V35 HydrophobicContact CG-CG2 3.7Å; S31-V35 PolarHBondContact O-N 2.93Å; S31-V35 VanDerWaalsContact O-N 3.13Å; M32-V35 PolarHBondContact O-N 2.72Å; R33-V35 VanDerWaalsContact C-N 3.33Å; R33-V35 PolarHBondContact O-N 2.92Å; V35-N37 PolarHBondContact O-N 3.06Å; V35-L38 PolarHBondContact O-N 3.44Å; V35-I39 HydrophobicContact CG1-CD1 3.86Å; V35-I39 HydrophobicContact CG1-CG1 4.47Å; V35-I39 WeakPolarHBondContact O-CG1 3.36Å; V35-I39 PolarHBondContact O-N 3.03Å
36	A	70.2	Confident	68.2	Low	43 Å²	43	101.1 Å²	101.1	36%	0.355	53%	0.528	S	S	.	.	H	α-helix	trans	-62	-44.4	179.3	0	0	0	0	0	112.1	M32 R33 L38 I39 I40	M32-A36 WeakPolarHBondContact O-CB 3.5Å; M32-A36 PolarHBondContact O-N 2.95Å; R33-A36 PolarHBondContact O-N 3.05Å; A36-L38 VanDerWaalsContact C-N 3.3Å; A36-L38 PolarHBondContact O-N 3.44Å; A36-I39 PolarHBondContact O-N 3.49Å; A36-I40 VanDerWaalsContact O-CG1 3.28Å; A36-I40 WeakPolarHBondContact O-CG1 3.29Å; A36-I40 PolarHBondContact O-N 3.25Å
37	N	67.3	Low	68	Low	80 Å²	80	101.4 Å²	101.4	43%	0.428	53%	0.53	S	S	.	.	H	α-helix	trans	-61.2	-40.7	176.4	-72.5	-5.8	0	0	0	111.6	R33 C34 V35 I40 A41	R33-N37 WeakPolarHBondContact O-CB 3.25Å; R33-N37 PolarHBondContact O-N 3.02Å; C34-N37 PolarHBondContact O-N 2.76Å; V35-N37 PolarHBondContact O-N 3.06Å; N37-I40 PolarHBondContact O-N 3.49Å; N37-A41 WeakPolarHBondContact O-CB 3.42Å; N37-A41 PolarHBondContact O-N 3.18Å
38	L	70.1	Confident	67.8	Low	108 Å²	108	96.8 Å²	96.8	57%	0.565	52%	0.522	S	S	*	.	H	α-helix	trans	-64.2	-44.2	177.3	-165.5	75.5	0	0	0	111.8	C34 V35 A36 A41 M42	C34-L38 WeakPolarHBondContact O-CB 3.49Å; C34-L38 PolarHBondContact O-N 3.48Å; V35-L38 PolarHBondContact O-N 3.44Å; A36-L38 VanDerWaalsContact C-N 3.3Å; A36-L38 PolarHBondContact O-N 3.44Å; L38-A41 PolarHBondContact O-N 3.06Å; L38-M42 HydrophobicContact CG-SD 4.37Å; L38-M42 WeakPolarHBondContact O-CB 3.43Å; L38-M42 VanDerWaalsContact O-CG 3.27Å; L38-M42 WeakPolarHBondContact O-CG 3.37Å; L38-M42 PolarHBondContact O-N 3.25Å
39	I	73.8	Confident	67.4	Low	102 Å²	102	95.6 Å²	95.6	52%	0.523	52%	0.519	S	S	.	.	H	α-helix	trans	-61.5	-46.2	177.7	-68.2	167.1	0	0	0	110.7	V35 A36 M42 E43	V35-I39 HydrophobicContact CG1-CD1 3.86Å; V35-I39 HydrophobicContact CG1-CG1 4.47Å; V35-I39 WeakPolarHBondContact O-CG1 3.36Å; V35-I39 PolarHBondContact O-N 3.03Å; A36-I39 PolarHBondContact O-N 3.49Å; I39-M42 PolarHBondContact O-N 2.97Å; I39-E43 PolarHBondContact O-N 3.3Å
40	I	71.1	Confident	66.9	Low	75 Å²	75	94 Å²	94	39%	0.385	52%	0.515	S	S	.	.	H	α-helix	trans	-63.1	-44.7	179.3	-66.7	165.2	0	0	0	110.6	A36 N37 M42 E43 R44	A36-I40 VanDerWaalsContact O-CG1 3.28Å; A36-I40 WeakPolarHBondContact O-CG1 3.29Å; A36-I40 PolarHBondContact O-N 3.25Å; N37-I40 PolarHBondContact O-N 3.49Å; I40-M42 VanDerWaalsContact C-N 3.33Å; I40-M42 PolarHBondContact O-N 3.24Å; I40-E43 PolarHBondContact O-N 3.21Å; I40-R44 WeakPolarHBondContact O-CB 3.33Å; I40-R44 WeakPolarHBondContact O-CG 3.45Å; I40-R44 PolarHBondContact O-N 2.93Å; I40-R44 VanDerWaalsContact O-N 3.11Å
41	A	67.2	Low	66.1	Low	24 Å²	24	99.2 Å²	99.2	20%	0.198	53%	0.533	C	S	.	.	H	α-helix	trans	-60.6	-42.7	176.5	0	0	0	0	0	111.7	N37 L38 R44 L45	N37-A41 WeakPolarHBondContact O-CB 3.42Å; N37-A41 PolarHBondContact O-N 3.18Å; L38-A41 PolarHBondContact O-N 3.06Å; A41-R44 PolarHBondContact O-N 2.96Å; A41-L45 WeakPolarHBondContact O-CB 3.04Å; A41-L45 WeakPolarHBondContact O-CG 3.4Å; A41-L45 PolarHBondContact O-N 3.22Å
42	M	67.9	Low	64.8	Low	118 Å²	118	99.1 Å²	99.1	58%	0.581	53%	0.532	S	S	*	.	H	α-helix	trans	-67.1	-43.8	178.6	-74.1	-177.6	72.4	0	0	113.3	L38 I39 I40 R44 L45 K46	L38-M42 HydrophobicContact CG-SD 4.37Å; L38-M42 WeakPolarHBondContact O-CB 3.43Å; L38-M42 VanDerWaalsContact O-CG 3.27Å; L38-M42 WeakPolarHBondContact O-CG 3.37Å; L38-M42 PolarHBondContact O-N 3.25Å; I39-M42 PolarHBondContact O-N 2.97Å; I40-M42 VanDerWaalsContact C-N 3.33Å; I40-M42 PolarHBondContact O-N 3.24Å; M42-R44 VanDerWaalsContact C-N 3.27Å; M42-R44 PolarHBondContact O-N 3.45Å; M42-L45 WeakPolarHBondContact O-CB 3.14Å; M42-L45 PolarHBondContact O-N 2.53Å; M42-K46 WeakPolarHBondContact O-CB 3.33Å; M42-K46 PolarHBondContact O-N 3.42Å
43	E	70.5	Confident	63.4	Low	112 Å²	112	99.1 Å²	99.1	52%	0.523	53%	0.534	S	S	.	.	H	α-helix	trans	-66.3	-33.9	179.5	-161.8	62.1	-143.6	0	0	111.2	I39 I40 K46 S47	I39-E43 PolarHBondContact O-N 3.3Å; I40-E43 PolarHBondContact O-N 3.21Å; E43-K46 PolarHBondContact O-N 3.39Å; E43-K46 IonicContact OE1-NZ 3.64Å; E43-S47 PolarHBondContact O-N 2.84Å
44	R	67.6	Low	62.4	Low	143 Å²	143	99.2 Å²	99.2	54%	0.54	55%	0.545	S	S	.	.	H	α-helix	trans	-73.4	-40.3	175.5	-73.9	-179.6	161.7	-171	-6	113.2	I40 A41 M42 K46 S47 G48 E69	I40-R44 WeakPolarHBondContact O-CB 3.33Å; I40-R44 WeakPolarHBondContact O-CG 3.45Å; I40-R44 PolarHBondContact O-N 2.93Å; I40-R44 VanDerWaalsContact O-N 3.11Å; A41-R44 PolarHBondContact O-N 2.96Å; M42-R44 VanDerWaalsContact C-N 3.27Å; M42-R44 PolarHBondContact O-N 3.45Å; R44-K46 PolarHBondContact O-N 2.94Å; R44-S47 CarbonylContact O-C 3.48Å; R44-S47 WeakPolarHBondContact O-CB 3.42Å; R44-S47 PolarHBondContact O-N 2.63Å; R44-S47 VanDerWaalsContact O-N 3.1Å; R44-G48 PolarHBondContact O-N 2.88Å; R44-E69 PolarHBondContact NH1-O 3.19Å
45	L	66.1	Low	61.4	Low	76 Å²	76	100.6 Å²	100.6	40%	0.398	56%	0.555	S	S	.	*	H	α-helix	trans	-54.3	-45.1	170	-92.7	162.6	0	0	0	111.2	A41 M42 S47 G48 M49 I66	A41-L45 WeakPolarHBondContact O-CB 3.04Å; A41-L45 WeakPolarHBondContact O-CG 3.4Å; A41-L45 PolarHBondContact O-N 3.22Å; M42-L45 WeakPolarHBondContact O-CB 3.14Å; M42-L45 PolarHBondContact O-N 2.53Å; L45-S47 VanDerWaalsContact C-N 3.32Å; L45-S47 PolarHBondContact O-N 3.03Å; L45-G48 PolarHBondContact O-N 2.83Å; L45-M49 PolarHBondContact O-N 2.7Å; L45-M49 VanDerWaalsContact O-N 3.08Å; L45-I66 HydrophobicContact CD2-CD1 3.47Å; L45-I66 VanDerWaalsContact CD2-CD1 3.47Å; L45-I66 HydrophobicContact CG-CD1 4.16Å
46	K	65.8	Low	60.4	Low	144 Å²	144	105.2 Å²	105.2	63%	0.626	59%	0.587	S	S	*	*	H	α-helix	trans	-64.4	-35.8	177.1	-172.8	-177	171.6	-161.9	0	112.5	M42 E43 R44	M42-K46 WeakPolarHBondContact O-CB 3.33Å; M42-K46 PolarHBondContact O-N 3.42Å; E43-K46 PolarHBondContact O-N 3.39Å; E43-K46 IonicContact OE1-NZ 3.64Å; R44-K46 PolarHBondContact O-N 2.94Å
47	S	60.2	Low	59.4	Low	91 Å²	91	105.8 Å²	105.8	64%	0.636	60%	0.596	S	S	*	*	H	α-helix	trans	-70.6	-39.5	174.3	173.9	0	0	0	0	113	E43 R44 L45 M49 A50	E43-S47 PolarHBondContact O-N 2.84Å; R44-S47 CarbonylContact O-C 3.48Å; R44-S47 WeakPolarHBondContact O-CB 3.42Å; R44-S47 PolarHBondContact O-N 2.63Å; R44-S47 VanDerWaalsContact O-N 3.1Å; L45-S47 VanDerWaalsContact C-N 3.32Å; L45-S47 PolarHBondContact O-N 3.03Å; S47-M49 VanDerWaalsContact C-N 3.32Å; S47-A50 PolarHBondContact O-N 3.39Å
48	G	58.1	Low	59	Low	50 Å²	50	108.1 Å²	108.1	52%	0.515	60%	0.603	S	S	.	*	H	α-helix	trans	-72.9	-23.9	179	0	0	0	0	0	113.5	R44 L45 A50 E51	R44-G48 PolarHBondContact O-N 2.88Å; L45-G48 PolarHBondContact O-N 2.83Å; G48-A50 PolarHBondContact O-N 3.38Å; G48-E51 PolarHBondContact O-N 2.79Å
49	M	52.8	Low	59	Low	134 Å²	134	105.6 Å²	105.6	66%	0.66	59%	0.594	S	S	*	*	G	3₁₀ helix	trans	-66.1	-14.9	176.2	-149.2	79.9	-169.5	0	0	113.4	L45 S47 E51	L45-M49 PolarHBondContact O-N 2.7Å; L45-M49 VanDerWaalsContact O-N 3.08Å; S47-M49 VanDerWaalsContact C-N 3.32Å; M49-E51 PolarHBondContact O-N 2.89Å
50	A	49.6	Very low	58.8	Low	87 Å²	87	106.4 Å²	106.4	72%	0.719	60%	0.6	S	S	*	*	G	3₁₀ helix	trans	-68.8	-18.8	178.7	0	0	0	0	0	113.3	S47 G48	S47-A50 PolarHBondContact O-N 3.39Å; G48-A50 PolarHBondContact O-N 3.38Å
51	E	49.9	Very low	58.7	Low	191 Å²	191	109.3 Å²	109.3	89%	0.893	61%	0.612	S	S	*	*	G	3₁₀ helix	trans	-108.8	2.1	-172.5	-121.6	172.8	-173.1	0	0	115.4	G48 M49	G48-E51 PolarHBondContact O-N 2.79Å; M49-E51 PolarHBondContact O-N 2.89Å
52	S	47.8	Very low	58.6	Low	70 Å²	70	110.5 Å²	110.5	49%	0.49	62%	0.618	S	S	.	*			trans	-139	86.5	176.6	77.8	0	0	0	0	113.5	L54	S52-L54 VanDerWaalsContact C-N 3.31Å
53	I	43.6	Very low	58.6	Low	158 Å²	158	108 Å²	108	81%	0.81	61%	0.607	S	S	*	*	S	Bend	trans	-85.9	0.7	165.3	-69.7	177.8	0	0	0	111.9
54	L	49.6	Very low	58.4	Low	160 Å²	160	106.8 Å²	106.8	84%	0.838	60%	0.604	S	S	*	*	S	Bend	trans	-126.2	34.4	-168.5	-61.4	178.2	0	0	0	117.3	S52	S52-L54 VanDerWaalsContact C-N 3.31Å
55	S	46.3	Very low	58.3	Low	97 Å²	97	102.6 Å²	102.6	68%	0.678	60%	0.596	S	S	*	*			trans	-148.3	135.2	160.4	-89	0	0	0	0	113.7	G57	S55-G57 VanDerWaalsContact C-N 3.27Å; S55-G57 PolarHBondContact O-N 2.85Å
56	P	52	Low	58.2	Low	147 Å²	147	101.2 Å²	101.2	96%	0.955	59%	0.589	S	S	*	*	S	Bend	trans	-85.5	15.1	-172.4	34.8	-34.7	0	0	0	114.2
57	G	50.6	Low	58.1	Low	54 Å²	54	100.3 Å²	100.3	56%	0.557	59%	0.588	S	S	*	*			trans	-133.4	112.7	-172.6	0	0	0	0	0	112.4	S55 S59	S55-G57 VanDerWaalsContact C-N 3.27Å; S55-G57 PolarHBondContact O-N 2.85Å; G57-S59 PolarHBondContact O-N 3.21Å
58	F	58.7	Low	58.2	Low	129 Å²	129	102 Å²	102	57%	0.566	59%	0.59	S	S	*	*			trans	-72.6	107.8	159.8	-175.4	-114	0	0	0	107.3	L63 I66	F58-L63 HydrophobicContact CD1-CD1 4.19Å; F58-L63 HydrophobicContact CD1-CG 4.06Å; F58-L63 HydrophobicContact CE1-CD1 3.59Å; F58-L63 HydrophobicContact CE1-CD2 3.29Å; F58-L63 HydrophobicContact CE1-CG 3.17Å; F58-L63 HydrophobicContact CE2-CG 4.44Å; F58-L63 HydrophobicContact CZ-CD1 4.31Å; F58-L63 HydrophobicContact CZ-CD2 3.28Å; F58-L63 HydrophobicContact CZ-CG 3.4Å; F58-I66 HydrophobicContact CE2-CD1 4.02Å; F58-I66 HydrophobicContact CZ-CD1 4.28Å
59	S	70.7	Confident	58.1	Low	56 Å²	56	106.3 Å²	106.3	39%	0.392	60%	0.596	S	S	.	*			trans	-89.7	157.7	-179.9	64.7	0	0	0	0	111.2	G57 E61 S62 L63	G57-S59 PolarHBondContact O-N 3.21Å; S59-E61 PolarHBondContact O-N 2.94Å; S59-S62 WeakPolarHBondContact O-CB 3.22Å; S59-S62 PolarHBondContact O-N 3.38Å; S59-S62 PolarHBondContact OG-OG 3.46Å; S59-L63 PolarHBondContact O-N 3Å
60	D	68.2	Low	58.1	Low	119 Å²	119	102.6 Å²	102.6	64%	0.636	58%	0.584	S	S	*	*	H	α-helix	trans	-57.7	-29	175.1	-68	-17.3	0	0	0	112.2	S62 L63 L64	D60-S62 VanDerWaalsContact C-N 3.35Å; D60-S62 PolarHBondContact O-N 3.21Å; D60-L63 WeakPolarHBondContact O-CB 3.39Å; D60-L63 PolarHBondContact O-N 2.92Å; D60-L64 VanDerWaalsContact O-CG 3.29Å; D60-L64 WeakPolarHBondContact O-CG 3.31Å; D60-L64 PolarHBondContact O-N 3.35Å
61	E	70	Confident	58.4	Low	136 Å²	136	103.7 Å²	103.7	64%	0.636	58%	0.581	S	S	*	*	H	α-helix	trans	-66.1	-36.5	175.1	-58.5	-57.8	161.2	0	0	112.5	S59 L63 L64 S65	S59-E61 PolarHBondContact O-N 2.94Å; E61-L63 VanDerWaalsContact C-N 3.32Å; E61-L64 PolarHBondContact O-N 3.42Å; E61-S65 PolarHBondContact O-N 2.93Å; E61-S65 PolarHBondContact O-OG 3.29Å
62	S	65.3	Low	58.5	Low	48 Å²	48	98.8 Å²	98.8	34%	0.336	56%	0.564	S	S	.	*	H	α-helix	trans	-68.6	-33	172.8	-59.6	0	0	0	0	111.6	S59 D60 S65 I66	S59-S62 WeakPolarHBondContact O-CB 3.22Å; S59-S62 PolarHBondContact O-N 3.38Å; S59-S62 PolarHBondContact OG-OG 3.46Å; D60-S62 VanDerWaalsContact C-N 3.35Å; D60-S62 PolarHBondContact O-N 3.21Å; S62-S65 PolarHBondContact O-OG 2.92Å; S62-I66 WeakPolarHBondContact O-CD1 3.28Å; S62-I66 WeakPolarHBondContact O-CG1 3.27Å; S62-I66 PolarHBondContact O-N 3.04Å
63	L	67.6	Low	58.7	Low	66 Å²	66	102.6 Å²	102.6	35%	0.346	57%	0.574	S	S	.	*	H	α-helix	trans	-66.3	-45.7	171.7	-84.4	167.6	0	0	0	111.8	F58 S59 D60 E61 I66 M67	F58-L63 HydrophobicContact CD1-CD1 4.19Å; F58-L63 HydrophobicContact CD1-CG 4.06Å; F58-L63 HydrophobicContact CE1-CD1 3.59Å; F58-L63 HydrophobicContact CE1-CD2 3.29Å; F58-L63 HydrophobicContact CE1-CG 3.17Å; F58-L63 HydrophobicContact CE2-CG 4.44Å; F58-L63 HydrophobicContact CZ-CD1 4.31Å; F58-L63 HydrophobicContact CZ-CD2 3.28Å; F58-L63 HydrophobicContact CZ-CG 3.4Å; S59-L63 PolarHBondContact O-N 3Å; D60-L63 WeakPolarHBondContact O-CB 3.39Å; D60-L63 PolarHBondContact O-N 2.92Å; E61-L63 VanDerWaalsContact C-N 3.32Å; L63-I66 PolarHBondContact O-N 3.39Å; L63-M67 WeakPolarHBondContact O-CB 3.33Å; L63-M67 WeakPolarHBondContact O-CG 3.27Å; L63-M67 PolarHBondContact O-N 3.41Å
64	L	66.3	Low	58.7	Low	87 Å²	87	100.1 Å²	100.1	46%	0.455	56%	0.559	S	S	.	*	H	α-helix	trans	-64	-41.1	-179.5	-71.5	171.5	0	0	0	111.5	D60 E61 M67 L68	D60-L64 VanDerWaalsContact O-CG 3.29Å; D60-L64 WeakPolarHBondContact O-CG 3.31Å; D60-L64 PolarHBondContact O-N 3.35Å; E61-L64 PolarHBondContact O-N 3.42Å; L64-M67 PolarHBondContact O-N 2.78Å; L64-L68 VanDerWaalsContact O-CB 3.29Å; L64-L68 WeakPolarHBondContact O-CB 3.43Å; L64-L68 WeakPolarHBondContact O-CD1 3.36Å; L64-L68 WeakPolarHBondContact O-CG 3.48Å; L64-L68 PolarHBondContact O-N 3.06Å
65	S	65.5	Low	58.5	Low	54 Å²	54	102.2 Å²	102.2	38%	0.378	56%	0.556	S	S	.	*	H	α-helix	trans	-62.3	-45.1	175.4	62.7	0	0	0	0	111.8	E61 S62 M67 L68 E69	E61-S65 PolarHBondContact O-N 2.93Å; E61-S65 PolarHBondContact O-OG 3.29Å; S62-S65 PolarHBondContact O-OG 2.92Å; S65-M67 PolarHBondContact O-N 2.83Å; S65-L68 PolarHBondContact O-N 3.08Å; S65-E69 WeakPolarHBondContact O-CB 3.47Å; S65-E69 WeakPolarHBondContact O-CG 3.37Å; S65-E69 PolarHBondContact O-N 3.21Å
66	I	64.3	Low	58.4	Low	47 Å²	47	104.6 Å²	104.6	24%	0.241	55%	0.554	C	S	.	*	H	α-helix	trans	-60.9	-44.4	175.8	-66.4	162.2	0	0	0	111	L45 F58 S62 L63 S70	L45-I66 HydrophobicContact CD2-CD1 3.47Å; L45-I66 VanDerWaalsContact CD2-CD1 3.47Å; L45-I66 HydrophobicContact CG-CD1 4.16Å; F58-I66 HydrophobicContact CE2-CD1 4.02Å; F58-I66 HydrophobicContact CZ-CD1 4.28Å; S62-I66 WeakPolarHBondContact O-CD1 3.28Å; S62-I66 WeakPolarHBondContact O-CG1 3.27Å; S62-I66 PolarHBondContact O-N 3.04Å; L63-I66 PolarHBondContact O-N 3.39Å; I66-S70 VanDerWaalsContact O-CB 3.27Å; I66-S70 WeakPolarHBondContact O-CB 3.36Å; I66-S70 PolarHBondContact O-N 2.82Å
67	M	62.4	Low	57.9	Low	125 Å²	125	105.5 Å²	105.5	62%	0.616	55%	0.549	S	S	*	.	H	α-helix	trans	-67.2	-42.2	-179.7	-73	-171.5	75.3	0	0	112.2	L63 L64 S65 S70	L63-M67 WeakPolarHBondContact O-CB 3.33Å; L63-M67 WeakPolarHBondContact O-CG 3.27Å; L63-M67 PolarHBondContact O-N 3.41Å; L64-M67 PolarHBondContact O-N 2.78Å; S65-M67 PolarHBondContact O-N 2.83Å; M67-S70 PolarHBondContact O-N 2.79Å; M67-S70 PolarHBondContact O-OG 2.88Å
68	L	64	Low	57.5	Low	128 Å²	128	105.6 Å²	105.6	67%	0.67	54%	0.541	S	S	*	.	H	α-helix	trans	-68.7	-38.3	178.3	-70.7	168.5	0	0	0	111.9	L64 S65 S70 V71	L64-L68 VanDerWaalsContact O-CB 3.29Å; L64-L68 WeakPolarHBondContact O-CB 3.43Å; L64-L68 WeakPolarHBondContact O-CD1 3.36Å; L64-L68 WeakPolarHBondContact O-CG 3.48Å; L64-L68 PolarHBondContact O-N 3.06Å; S65-L68 PolarHBondContact O-N 3.08Å; L68-S70 VanDerWaalsContact C-N 3.29Å; L68-S70 PolarHBondContact O-N 2.81Å; L68-V71 WeakPolarHBondContact O-CB 3.36Å; L68-V71 WeakPolarHBondContact O-CG2 3.39Å; L68-V71 PolarHBondContact O-N 3.19Å
69	E	55.8	Low	56.5	Low	140 Å²	140	108.5 Å²	108.5	65%	0.654	56%	0.557	S	S	*	*	H	α-helix	trans	-73.7	-18.8	173.8	-74.5	-176.5	175.3	0	0	113.5	R44 S65 V71	R44-E69 PolarHBondContact NH1-O 3.19Å; S65-E69 WeakPolarHBondContact O-CB 3.47Å; S65-E69 WeakPolarHBondContact O-CG 3.37Å; S65-E69 PolarHBondContact O-N 3.21Å; E69-V71 PolarHBondContact O-N 3.49Å
70	S	51.8	Low	55.2	Low	56 Å²	56	112 Å²	112	39%	0.392	56%	0.561	S	S	.	*	T	Hydrogen-bonded Turn	trans	-79.6	-3.7	173.9	83.3	0	0	0	0	113.9	I66 M67 L68 V72	I66-S70 VanDerWaalsContact O-CB 3.27Å; I66-S70 WeakPolarHBondContact O-CB 3.36Å; I66-S70 PolarHBondContact O-N 2.82Å; M67-S70 PolarHBondContact O-N 2.79Å; M67-S70 PolarHBondContact O-OG 2.88Å; L68-S70 VanDerWaalsContact C-N 3.29Å; L68-S70 PolarHBondContact O-N 2.81Å; S70-V72 PolarHBondContact O-N 2.92Å
71	V	56	Low	54.2	Low	110 Å²	110	112.7 Å²	112.7	67%	0.667	57%	0.57	S	S	*	*			trans	-67.7	83.6	170.4	-179.3	0	0	0	0	108.1	L68 E69 E73	L68-V71 WeakPolarHBondContact O-CB 3.36Å; L68-V71 WeakPolarHBondContact O-CG2 3.39Å; L68-V71 PolarHBondContact O-N 3.19Å; E69-V71 PolarHBondContact O-N 3.49Å; V71-E73 PolarHBondContact O-N 2.8Å
72	V	52.5	Low	53.3	Low	88 Å²	88	111.7 Å²	111.7	53%	0.533	58%	0.578	S	S	.	*			trans	-72.1	107.7	165.6	179	0	0	0	0	106	S70 E74	S70-V72 PolarHBondContact O-N 2.92Å; V72-E74 PolarHBondContact O-N 2.88Å; V72-E74 VanDerWaalsContact O-N 3.14Å
73	E	50.9	Low	52.6	Low	149 Å²	149	111.3 Å²	111.3	70%	0.696	58%	0.578	S	S	*	*			trans	-56.2	117.6	168.1	-162.8	175.7	-151.5	0	0	108	V71 R75	V71-E73 PolarHBondContact O-N 2.8Å; E73-R75 PolarHBondContact O-N 2.98Å
74	E	43.7	Very low	52.1	Low	107 Å²	107	114.9 Å²	114.9	50%	0.5	59%	0.593	S	S	.	*			trans	-63.3	93.7	-174.7	-172	172.6	-143.3	0	0	109.7	R33 V72 F76	R33-E74 IonicContact CZ-OE1 3.64Å; R33-E74 IonicContact NH2-OE1 2.76Å; R33-E74 PolarHBondContact NH2-OE1 3.39Å; V72-E74 PolarHBondContact O-N 2.88Å; V72-E74 VanDerWaalsContact O-N 3.14Å; E74-F76 HydrophobicContact CG-CD2 4.25Å; E74-F76 HydrophobicContact CG-CE2 3.94Å; E74-F76 HydrophobicContact CG-CZ 4.35Å; E74-F76 PolarHBondContact O-N 2.88Å
75	R	45.3	Very low	52	Low	203 Å²	203	115.4 Å²	115.4	77%	0.766	60%	0.601	S	S	*	*			trans	-83.9	104.5	170	-68.5	-174	-178.2	177.6	2.1	108.1	E73 I77	E73-R75 PolarHBondContact O-N 2.98Å; R75-I77 PolarHBondContact O-N 3.21Å
76	F	45.4	Very low	52.3	Low	148 Å²	148	113.1 Å²	113.1	65%	0.649	59%	0.587	S	S	*	*			trans	-62.6	97.1	170.3	-78.8	-90	0	0	0	110.1	E74 S78	E74-F76 HydrophobicContact CG-CD2 4.25Å; E74-F76 HydrophobicContact CG-CE2 3.94Å; E74-F76 HydrophobicContact CG-CZ 4.35Å; E74-F76 PolarHBondContact O-N 2.88Å; F76-S78 PolarHBondContact O-N 3.06Å
77	I	40.4	Very low	53.4	Low	166 Å²	166	112.4 Å²	112.4	85%	0.851	58%	0.582	S	S	*	*			trans	-79.5	100.6	168.7	-55.9	178.4	0	0	0	107	R75	R75-I77 PolarHBondContact O-N 3.21Å
78	S	42.6	Very low	54.8	Low	55 Å²	55	106.5 Å²	106.5	39%	0.385	55%	0.553	S	S	.	*			trans	-88	123.9	170.3	-157.5	0	0	0	0	107.9	F76 R80	F76-S78 PolarHBondContact O-N 3.06Å; S78-R80 PolarHBondContact O-N 3.19Å
79	E	37.9	Very low	56.2	Low	191 Å²	191	102.6 Å²	102.6	89%	0.893	53%	0.534	S	S	*	.			trans	-61.9	127.6	166.5	-163.3	172.5	-156.1	0	0	108.2
80	R	43.1	Very low	58.1	Low	130 Å²	130	99.1 Å²	99.1	49%	0.491	52%	0.515	S	S	.	.			trans	-115.1	116.7	-174.2	-71.1	-173.9	-178.5	166	1.4	109.9	S78 L139	S78-R80 PolarHBondContact O-N 3.19Å; R80-L139 VanDerWaalsContact NH1-CD2 3.27Å
81	T	48.4	Very low	60	Low	133 Å²	133	102 Å²	102	82%	0.816	52%	0.517	S	S	*	.			trans	-57.8	144.4	150.5	-25.4	0	0	0	0	107.7	A83	T81-A83 VanDerWaalsContact C-N 3.32Å; T81-A83 PolarHBondContact O-N 3.18Å
82	S	49.8	Very low	61.8	Low	114 Å²	114	100.6 Å²	100.6	80%	0.797	50%	0.504	S	S	*	.			trans	-53.4	82.5	-169.1	60.2	0	0	0	0	114.2
83	A	50.9	Low	63.8	Low	41 Å²	41	99.8 Å²	99.8	34%	0.339	49%	0.494	S	S	.	.	P	Polyproline II helix	trans	-79.9	135.8	174.6	0	0	0	0	0	109.2	T81 Q87 L139	T81-A83 VanDerWaalsContact C-N 3.32Å; T81-A83 PolarHBondContact O-N 3.18Å; A83-Q87 VanDerWaalsContact CB-OE1 3.31Å; A83-L139 HydrophobicContact CB-CD1 3.2Å
84	Q	56.7	Low	65.9	Low	140 Å²	140	94 Å²	94	65%	0.654	47%	0.467	S	S	*	.	P	Polyproline II helix	trans	-65.1	150.4	-175.7	-66.8	-70.8	-27.4	0	0	110.4	G86 Q87	Q84-G86 PolarHBondContact O-N 3.25Å; Q84-Q87 PolarHBondContact O-N 2.94Å
85	P	63.8	Low	68.4	Low	98 Å²	98	92.1 Å²	92.1	64%	0.636	46%	0.458	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.1	140.5	172.4	-23	33.2	0	0	0	111	Q87	P85-Q87 VanDerWaalsContact C-N 3.33Å
86	G	73.3	Confident	70.7	Confident	7 Å²	7	82.5 Å²	82.5	7%	0.072	42%	0.422	C	S	.	.	T	Hydrogen-bonded Turn	trans	82.1	3.8	-177	0	0	0	0	0	115.8	Q84 F88 A187	Q84-G86 PolarHBondContact O-N 3.25Å; G86-F88 WeakPolarHBondContact O-CD2 3.35Å; G86-F88 PolarHBondContact O-N 3.06Å; G86-A187 WeakPolarHBondContact O-CB 3.33Å; G86-A187 PolarHBondContact O-N 3.24Å
87	Q	87.6	Confident	73.1	Confident	31 Å²	31	75.8 Å²	75.8	15%	0.145	39%	0.394	C	S	.	.			trans	-45.7	119.3	166.5	163.7	-124.5	44.7	0	0	114.8	A83 Q84 P85 H138 L139 E184	A83-Q87 VanDerWaalsContact CB-OE1 3.31Å; Q84-Q87 PolarHBondContact O-N 2.94Å; P85-Q87 VanDerWaalsContact C-N 3.33Å; Q87-H138 WeakPolarHBondContact O-CA 3.43Å; Q87-L139 WeakPolarHBondContact O-CG 3.19Å; Q87-L139 PolarHBondContact O-N 2.98Å; Q87-E184 PolarHBondContact NE2-OE2 2.94Å
88	F	91.8	Very high	75.7	Confident	2 Å²	2	68 Å²	68	1%	0.009	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	120.4	159.2	-61.2	-95	0	0	0	110.3	G86 Y136 I137 H138 P148 E184 I185 L195 Y197	G86-F88 WeakPolarHBondContact O-CD2 3.35Å; G86-F88 PolarHBondContact O-N 3.06Å; F88-Y136 HydrophobicContact CB-CD1 3.95Å; F88-I137 WeakPolarHBondContact CA-O 3.33Å; F88-H138 HydrophobicContact CD1-CB 3.91Å; F88-H138 HydrophobicContact CE1-CB 3.71Å; F88-H138 AromaticContact CE1-CD2 3.72Å; F88-H138 AromaticContact CE1-CG 3.62Å; F88-H138 AromaticContact CE2-CD2 3.94Å; F88-H138 HydrophobicContact CZ-CB 4.46Å; F88-H138 AromaticContact CZ-CD2 3.61Å; F88-H138 AromaticContact CZ-CG 3.88Å; F88-H138 AromaticContact CZ-NE2 3.88Å; F88-P148 HydrophobicContact CD1-CB 3.9Å; F88-P148 HydrophobicContact CD1-CG 4.04Å; F88-P148 HydrophobicContact CE1-CB 3.88Å; F88-P148 HydrophobicContact CE1-CG 3.93Å; F88-E184 CarbonylContact O-C 3.37Å; F88-E184 WeakPolarHBondContact O-CA 3.47Å; F88-I185 WeakPolarHBondContact CA-O 3.45Å; F88-I185 HydrophobicContact CB-CB 4.18Å; F88-I185 WeakPolarHBondContact CB-O 3.19Å; F88-I185 WeakPolarHBondContact CD2-O 3.29Å; F88-I185 PolarHBondContact N-O 2.85Å; F88-I185 PolarHBondContact O-N 2.87Å; F88-L195 HydrophobicContact CB-CD1 4.12Å; F88-L195 HydrophobicContact CD1-CD1 3.86Å; F88-L195 HydrophobicContact CD1-CD2 4.34Å; F88-L195 HydrophobicContact CD2-CD1 3.61Å; F88-L195 HydrophobicContact CE1-CD1 4.14Å; F88-L195 HydrophobicContact CE2-CD1 3.91Å; F88-L195 HydrophobicContact CG-CD1 3.59Å; F88-L195 HydrophobicContact CZ-CD1 4.16Å; F88-Y197 HydrophobicContact CE1-CE1 4.34Å; F88-Y197 WeakPolarHBondContact CZ-OH 3.39Å
89	T	92.9	Very high	78.2	Confident	45 Å²	45	66.7 Å²	66.7	28%	0.276	34%	0.343	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117	126.6	178.4	-52.3	0	0	0	0	110.4	Y136 I137	T89-Y136 CarbonylContact O-C 3.52Å; T89-Y136 VanDerWaalsContact O-CA 3.27Å; T89-Y136 WeakPolarHBondContact O-CA 3.2Å; T89-I137 PolarHBondContact N-O 2.96Å; T89-I137 PolarHBondContact O-N 2.87Å
90	R	94.7	Very high	81	Confident	67 Å²	67	57.8 Å²	57.8	25%	0.253	30%	0.302	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.6	138.9	178.7	-168.8	174.4	177.3	-169.6	-2.8	110.7	E93 A134 T135 Y136 S183	R90-E93 IonicContact CZ-OE2 2.79Å; R90-E93 IonicContact NH2-OE1 3.71Å; R90-E93 IonicContact NH2-OE2 2.73Å; R90-E93 PolarHBondContact NH2-OE2 3.16Å; R90-A134 HydrophobicContact CG-CB 4.25Å; R90-T135 CarbonylContact C-O 3.52Å; R90-Y136 HydrophobicContact CB-CD1 4.07Å; R90-Y136 HydrophobicContact CB-CE1 3.6Å; R90-Y136 HydrophobicContact CB-CE2 4.33Å; R90-Y136 HydrophobicContact CG-CE1 4.26Å; R90-Y136 HydrophobicContact CG-CE2 4.13Å; R90-Y136 VanDerWaalsContact N-CD1 3.32Å; R90-S183 WeakPolarHBondContact CB-O 3.32Å; R90-S183 PolarHBondContact N-O 2.87Å
91	R	92.3	Very high	83.3	Confident	116 Å²	116	53.4 Å²	53.4	44%	0.438	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	-80	-179.1	-86.4	-66.3	-136.5	-136.9	-6.9	112	T135 I137	R91-T135 PolarHBondContact N-O 2.84Å; R91-I137 HydrophobicContact CG-CD1 3.64Å; R91-I137 HydrophobicContact CG-CG1 3.65Å
92	E	92.8	Very high	85.5	Confident	82 Å²	82	51.5 Å²	51.5	38%	0.383	28%	0.279	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	154.2	-179.3	59.4	162.9	-171.8	0	0	110.1	H94 A134 T135 R245	E92-H94 IonicContact OE1-ND1 3.51Å; E92-A134 CarbonylContact O-C 3.59Å; E92-A134 VanDerWaalsContact O-CA 3.31Å; E92-A134 WeakPolarHBondContact O-CA 3.44Å; E92-T135 HydrophobicContact CG-CG2 4.26Å; E92-T135 WeakPolarHBondContact CG-OG1 3.39Å; E92-T135 PolarHBondContact N-OG1 2.92Å; E92-T135 PolarHBondContact O-N 2.74Å; E92-T135 PolarHBondContact O-OG1 2.88Å; E92-R245 IonicContact OE1-NH1 3.45Å; E92-R245 PolarHBondContact OE1-NH1 3.41Å; E92-R245 IonicContact OE2-CZ 3.8Å; E92-R245 IonicContact OE2-NH1 3.21Å; E92-R245 PolarHBondContact OE2-NH1 2.84Å; E92-R245 IonicContact OE2-NH2 2.63Å; E92-R245 PolarHBondContact OE2-NH2 2.99Å
93	E	95.3	Very high	87.6	Confident	71 Å²	71	54.6 Å²	54.6	33%	0.332	28%	0.278	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	139.2	166	178	169	98.7	0	0	109	R90 N132 M133 A134	R90-E93 IonicContact CZ-OE2 2.79Å; R90-E93 IonicContact NH2-OE1 3.71Å; R90-E93 IonicContact NH2-OE2 2.73Å; R90-E93 PolarHBondContact NH2-OE2 3.16Å; E93-N132 HydrophobicContact CG-CB 4.2Å; E93-M133 WeakPolarHBondContact CA-O 3.41Å; E93-A134 HydrophobicContact CB-CB 4.36Å
94	H	94.9	Very high	89.8	Confident	28 Å²	28	53 Å²	53	13%	0.13	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.9	152.5	173.2	57.3	-93.8	0	0	0	111.4	E92 M133 R245	E92-H94 IonicContact OE1-ND1 3.51Å; H94-M133 PolarHBondContact N-O 3.34Å; H94-M133 PolarHBondContact O-N 3.33Å; H94-R245 HydrophobicContact CB-CG 4.12Å
95	H	95.5	Very high	91.7	Very high	67 Å²	67	47 Å²	47	31%	0.31	24%	0.238	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.8	140.4	174	-57.4	157.6	0	0	0	109.8	L131 N132 R245 Q246	H95-L131 CarbonylContact C-O 3.55Å; H95-L131 VanDerWaalsContact CA-O 3.32Å; H95-L131 WeakPolarHBondContact CA-O 3.48Å; H95-N132 PolarHBondContact CD2-OD1 3.39Å; H95-N132 PolarHBondContact NE2-OD1 2.8Å; H95-R245 WeakPolarHBondContact O-CA 3.43Å; H95-Q246 HydrophobicContact CB-CB 4.47Å; H95-Q246 PolarHBondContact O-N 2.87Å
96	C	95.3	Very high	93.2	Very high	0 Å²	0	42.7 Å²	42.7	0%	0	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.5	151.7	173.8	62.4	0	0	0	0	111.9	L131 I243 Q244	C96-L131 PolarHBondContact N-O 2.53Å; C96-L131 PolarHBondContact O-N 2.65Å; C96-I243 HydrophobicContact CB-CG2 3.88Å; C96-Q244 CarbonylContact C-O 3.53Å; C96-Q244 WeakPolarHBondContact CA-O 3.48Å; C96-Q244 WeakPolarHBondContact CB-O 3.3Å
97	S	95	Very high	94.3	Very high	8 Å²	8	43.4 Å²	43.4	6%	0.056	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.2	144	167.1	100.7	0	0	0	0	108.9	K128 I243 Q244	S97-K128 PolarHBondContact OG-NZ 2.99Å; S97-I243 WeakPolarHBondContact O-CA 3.34Å; S97-Q244 PolarHBondContact N-O 2.8Å; S97-Q244 PolarHBondContact O-N 3.14Å
98	V	95.6	Very high	94.8	Very high	2 Å²	2	43.5 Å²	43.5	1%	0.012	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129	135	-178.3	59.9	0	0	0	0	110.5	L106 L131 F241 S242 I243	V98-L106 HydrophobicContact CG1-CB 4.43Å; V98-L106 HydrophobicContact CG1-CD1 3.62Å; V98-L106 HydrophobicContact CG1-CG 3.92Å; V98-L106 HydrophobicContact CG2-CD1 4.26Å; V98-L131 HydrophobicContact CB-CD1 4.2Å; V98-L131 HydrophobicContact CG1-CD1 3.85Å; V98-L131 HydrophobicContact CG1-CG 3.96Å; V98-F241 HydrophobicContact CG2-CB 4.16Å; V98-F241 HydrophobicContact CG2-CD1 3.85Å; V98-F241 HydrophobicContact CG2-CG 4.35Å; V98-S242 WeakPolarHBondContact CA-O 3.46Å; V98-I243 HydrophobicContact CG2-CG1 4.25Å
99	T	95.7	Very high	94.9	Very high	28 Å²	28	45.5 Å²	45.5	17%	0.172	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.3	150.4	165.1	59.4	0	0	0	0	109.6	R104 F241 S242	T99-R104 CarbonylContact C-O 3.55Å; T99-R104 WeakPolarHBondContact CA-O 3.22Å; T99-R104 WeakPolarHBondContact CB-O 3.32Å; T99-F241 CarbonylContact O-C 3.5Å; T99-F241 VanDerWaalsContact O-CA 3.24Å; T99-F241 WeakPolarHBondContact O-CA 3.21Å; T99-S242 PolarHBondContact N-O 3.2Å; T99-S242 PolarHBondContact O-N 3.21Å
100	D	96.2	Very high	94.7	Very high	3 Å²	3	49.9 Å²	49.9	2%	0.016	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76	178	173.5	76.7	1.4	0	0	0	112.6	Q102 K103 R104 T220 T240 F241	D100-Q102 PolarHBondContact O-N 3.28Å; D100-Q102 VanDerWaalsContact O-N 3.09Å; D100-Q102 WeakPolarHBondContact OD1-CA 3.43Å; D100-Q102 WeakPolarHBondContact OD1-CB 3.33Å; D100-Q102 PolarHBondContact OD1-N 2.74Å; D100-K103 WeakPolarHBondContact O-CA 3.48Å; D100-K103 PolarHBondContact O-N 3.48Å; D100-K103 PolarHBondContact OD1-N 3.5Å; D100-R104 PolarHBondContact N-O 3.47Å; D100-R104 WeakPolarHBondContact OD1-CB 3.47Å; D100-R104 PolarHBondContact OD1-N 3.36Å; D100-R104 IonicContact OD1-NE 2.99Å; D100-R104 IonicContact OD2-CZ 3.32Å; D100-R104 IonicContact OD2-NE 2.99Å; D100-R104 PolarHBondContact OD2-NE 3.11Å; D100-R104 IonicContact OD2-NH2 2.99Å; D100-R104 PolarHBondContact OD2-NH2 2.71Å; D100-T220 HydrophobicContact CB-CG2 3.96Å; D100-T220 PolarHBondContact OD2-OG1 2.79Å; D100-T240 CarbonylContact C-O 3.55Å; D100-F241 HydrophobicContact CB-CD1 4.06Å; D100-F241 HydrophobicContact CB-CE1 3.95Å
101	G	91.6	Very high	94.5	Very high	39 Å²	39	54.1 Å²	54.1	40%	0.402	27%	0.268	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.7	-14.1	177.6	0	0	0	0	0	115.2	T240	G101-T240 PolarHBondContact N-O 3.09Å
102	Q	94.4	Very high	94.3	Very high	93 Å²	93	53.6 Å²	53.6	44%	0.435	27%	0.274	S	S	.	.	T	Hydrogen-bonded Turn	trans	-98.2	12.3	173.2	-64.6	-61.3	-56.1	0	0	112.4	D100 R104 Y238	D100-Q102 PolarHBondContact O-N 3.28Å; D100-Q102 VanDerWaalsContact O-N 3.09Å; D100-Q102 WeakPolarHBondContact OD1-CA 3.43Å; D100-Q102 WeakPolarHBondContact OD1-CB 3.33Å; D100-Q102 PolarHBondContact OD1-N 2.74Å; Q102-R104 HydrophobicContact CB-CG 4.34Å; Q102-R104 PolarHBondContact O-N 2.96Å; Q102-Y238 HydrophobicContact CG-CD1 4.26Å; Q102-Y238 HydrophobicContact CG-CD2 3.77Å; Q102-Y238 HydrophobicContact CG-CE1 3.91Å; Q102-Y238 HydrophobicContact CG-CE2 3.34Å; Q102-Y238 HydrophobicContact CG-CG 4.2Å; Q102-Y238 VanDerWaalsContact CG-CZ 3.43Å; Q102-Y238 VanDerWaalsContact NE2-CE1 3.32Å
103	K	93.6	Very high	94.3	Very high	179 Å²	179	54 Å²	54	78%	0.778	28%	0.277	S	S	*	.			trans	61.2	22	-176.2	-52.2	-179.4	179.4	179.5	0	113.5	D100	D100-K103 WeakPolarHBondContact O-CA 3.48Å; D100-K103 PolarHBondContact O-N 3.48Å; D100-K103 PolarHBondContact OD1-N 3.5Å
104	R	96.4	Very high	94.3	Very high	6 Å²	6	54 Å²	54	2%	0.023	28%	0.277	C	S	.	.	P	Polyproline II helix	trans	-76	139	172.7	-66.8	-176.9	-63.3	-166.1	3.4	109.9	T99 D100 Q102 A117 M119 T220 A221 T222 D223 N224	T99-R104 CarbonylContact C-O 3.55Å; T99-R104 WeakPolarHBondContact CA-O 3.22Å; T99-R104 WeakPolarHBondContact CB-O 3.32Å; D100-R104 PolarHBondContact N-O 3.47Å; D100-R104 WeakPolarHBondContact OD1-CB 3.47Å; D100-R104 PolarHBondContact OD1-N 3.36Å; D100-R104 IonicContact OD1-NE 2.99Å; D100-R104 IonicContact OD2-CZ 3.32Å; D100-R104 IonicContact OD2-NE 2.99Å; D100-R104 PolarHBondContact OD2-NE 3.11Å; D100-R104 IonicContact OD2-NH2 2.99Å; D100-R104 PolarHBondContact OD2-NH2 2.71Å; Q102-R104 HydrophobicContact CB-CG 4.34Å; Q102-R104 PolarHBondContact O-N 2.96Å; R104-A117 HydrophobicContact CB-CB 4.39Å; R104-M119 HydrophobicContact CG-CB 4.37Å; R104-M119 HydrophobicContact CG-CG 3.46Å; R104-M119 VanDerWaalsContact CG-CG 3.46Å; R104-T220 PolarHBondContact NH2-OG1 2.89Å; R104-A221 PolarHBondContact NH1-O 3.22Å; R104-A221 VanDerWaalsContact NH1-O 3.09Å; R104-A221 PolarHBondContact NH2-O 2.9Å; R104-T222 PolarHBondContact NH1-O 2.75Å; R104-D223 VanDerWaalsContact NH1-C 3.27Å; R104-D223 PolarHBondContact NH1-O 2.73Å; R104-N224 WeakPolarHBondContact CD-OD1 3.4Å
105	S	96.3	Very high	94.4	Very high	16 Å²	16	53.2 Å²	53.2	11%	0.112	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83	154.5	172.2	-65.5	0	0	0	0	110.1	V118	S105-V118 PolarHBondContact N-O 3.26Å; S105-V118 PolarHBondContact O-N 3.36Å
106	L	96.7	Very high	94.5	Very high	7 Å²	7	51.6 Å²	51.6	4%	0.037	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.6	139	169.3	-56	-171.6	0	0	0	109.8	V98 L115 L116 A117 V129 V228	V98-L106 HydrophobicContact CG1-CB 4.43Å; V98-L106 HydrophobicContact CG1-CD1 3.62Å; V98-L106 HydrophobicContact CG1-CG 3.92Å; V98-L106 HydrophobicContact CG2-CD1 4.26Å; L106-L115 HydrophobicContact CD1-CD1 4.45Å; L106-L116 CarbonylContact C-O 3.59Å; L106-L116 WeakPolarHBondContact CA-O 3.27Å; L106-A117 HydrophobicContact CD2-CB 4.35Å; L106-V129 HydrophobicContact CB-CB 4.21Å; L106-V129 WeakPolarHBondContact O-CB 3.33Å; L106-V129 PolarHBondContact O-N 3.49Å; L106-V228 HydrophobicContact CD2-CG2 3.7Å
107	V	96.4	Very high	94.6	Very high	21 Å²	21	51.6 Å²	51.6	13%	0.127	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	131	177.5	179	0	0	0	0	108.8	L115 L116 V118 L120 L127	V107-L115 WeakPolarHBondContact O-CA 3.33Å; V107-L116 PolarHBondContact N-O 3.44Å; V107-L116 PolarHBondContact O-N 3.08Å; V107-V118 HydrophobicContact CB-CG2 4.21Å; V107-V118 HydrophobicContact CG2-CB 4.01Å; V107-V118 HydrophobicContact CG2-CG2 3.92Å; V107-L120 HydrophobicContact CG2-CD2 3.94Å; V107-L127 HydrophobicContact CG1-CB 4.4Å; V107-L127 HydrophobicContact CG2-CB 4.39Å
108	L	96.4	Very high	94.7	Very high	33 Å²	33	52.1 Å²	52.1	17%	0.173	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.3	123.3	177.9	177.5	66	0	0	0	111.1	K110 L115 V129 I153 T156 F158 L173	L108-K110 HydrophobicContact CD2-CD 4.48Å; L108-K110 HydrophobicContact CD2-CG 3.71Å; L108-K110 HydrophobicContact CG-CG 3.91Å; L108-L115 HydrophobicContact CB-CD2 4.22Å; L108-L115 HydrophobicContact CD1-CD2 4.24Å; L108-V129 HydrophobicContact CB-CG2 3.76Å; L108-I153 HydrophobicContact CD2-CG2 4.3Å; L108-T156 HydrophobicContact CD2-CG2 4.5Å; L108-F158 HydrophobicContact CD1-CD2 4.37Å; L108-F158 HydrophobicContact CD2-CD2 3.97Å; L108-F158 HydrophobicContact CD2-CE2 4.12Å; L108-L173 HydrophobicContact CD1-CD1 3.34Å
109	V	95.1	Very high	94.6	Very high	45 Å²	45	57.1 Å²	57.1	27%	0.273	30%	0.295	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.4	90.5	169	-177.7	0	0	0	0	108.1	N111 N112 M113 E114 L116	V109-N111 VanDerWaalsContact C-N 3.31Å; V109-N111 PolarHBondContact O-N 3.33Å; V109-N112 HydrophobicContact CG1-CB 4.3Å; V109-N112 PolarHBondContact O-N 2.9Å; V109-M113 PolarHBondContact O-N 3.49Å; V109-E114 PolarHBondContact N-O 3.1Å; V109-E114 PolarHBondContact O-N 3.48Å; V109-L116 HydrophobicContact CG2-CD1 3.57Å; V109-L116 HydrophobicContact CG2-CG 3.76Å
110	K	89.4	Confident	94.3	Very high	136 Å²	136	57.7 Å²	57.7	59%	0.591	30%	0.297	S	S	*	.	G	3₁₀ helix	trans	-56.7	-39.8	-171.8	-70.5	-172.6	177.3	-173.7	0	113.8	L108 N112 M113	L108-K110 HydrophobicContact CD2-CD 4.48Å; L108-K110 HydrophobicContact CD2-CG 3.71Å; L108-K110 HydrophobicContact CG-CG 3.91Å; K110-N112 PolarHBondContact O-N 2.93Å; K110-M113 PolarHBondContact O-N 3.38Å
111	N	89.2	Confident	93.8	Very high	156 Å²	156	64 Å²	64	83%	0.834	33%	0.326	S	S	*	.	G	3₁₀ helix	trans	-62.4	-32	-176	-65.3	-2.5	0	0	0	113.1	V109	V109-N111 VanDerWaalsContact C-N 3.31Å; V109-N111 PolarHBondContact O-N 3.33Å
112	N	88.4	Confident	93.4	Very high	106 Å²	106	66.1 Å²	66.1	57%	0.567	35%	0.347	S	S	*	.	G	3₁₀ helix	trans	-103.7	-4.3	-179.3	-65.4	9	0	0	0	112.4	V109 K110 E114	V109-N112 HydrophobicContact CG1-CB 4.3Å; V109-N112 PolarHBondContact O-N 2.9Å; K110-N112 PolarHBondContact O-N 2.93Å; N112-E114 VanDerWaalsContact C-N 3.25Å; N112-E114 HydrophobicContact CB-CB 4.3Å; N112-E114 HydrophobicContact CB-CG 3.85Å; N112-E114 WeakPolarHBondContact CB-OE2 3.5Å; N112-E114 PolarHBondContact ND2-OE2 3.06Å; N112-E114 VanDerWaalsContact ND2-OE2 3.14Å; N112-E114 PolarHBondContact O-N 2.85Å
113	M	93.1	Very high	92.5	Very high	90 Å²	90	65.6 Å²	65.6	44%	0.443	37%	0.367	S	S	.	.	T	Hydrogen-bonded Turn	trans	53.3	42.7	-170.3	-57.9	-173.4	173.5	0	0	112.6	V109 K110 F158 L173	V109-M113 PolarHBondContact O-N 3.49Å; K110-M113 PolarHBondContact O-N 3.38Å; M113-F158 HydrophobicContact CE-CE1 4.07Å; M113-F158 HydrophobicContact CE-CZ 4.39Å; M113-F158 HydrophobicContact SD-CE1 4.34Å; M113-L173 HydrophobicContact CB-CB 4.27Å; M113-L173 WeakPolarHBondContact O-CD1 3.15Å; M113-L173 WeakPolarHBondContact O-CG 3.18Å
114	E	94.5	Very high	92	Very high	72 Å²	72	63.5 Å²	63.5	34%	0.336	36%	0.355	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	148	-178.2	-70.1	179.3	129.5	0	0	112.2	V109 N112	V109-E114 PolarHBondContact N-O 3.1Å; V109-E114 PolarHBondContact O-N 3.48Å; N112-E114 VanDerWaalsContact C-N 3.25Å; N112-E114 HydrophobicContact CB-CB 4.3Å; N112-E114 HydrophobicContact CB-CG 3.85Å; N112-E114 WeakPolarHBondContact CB-OE2 3.5Å; N112-E114 PolarHBondContact ND2-OE2 3.06Å; N112-E114 VanDerWaalsContact ND2-OE2 3.14Å; N112-E114 PolarHBondContact O-N 2.85Å
115	L	97.3	Very high	91.3	Very high	10 Å²	10	65.6 Å²	65.6	5%	0.052	38%	0.378	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	130.4	164.3	-72	171.5	0	0	0	109.5	L106 V107 L108 V129 I153 L160 L173 P227 V228	L106-L115 HydrophobicContact CD1-CD1 4.45Å; V107-L115 WeakPolarHBondContact O-CA 3.33Å; L108-L115 HydrophobicContact CB-CD2 4.22Å; L108-L115 HydrophobicContact CD1-CD2 4.24Å; L115-V129 HydrophobicContact CD2-CG1 4.42Å; L115-V129 HydrophobicContact CD2-CG2 4.05Å; L115-I153 HydrophobicContact CD1-CD1 3.96Å; L115-I153 HydrophobicContact CD2-CD1 4.1Å; L115-I153 HydrophobicContact CG-CD1 4.49Å; L115-L160 HydrophobicContact CD1-CD1 4.21Å; L115-L160 HydrophobicContact CD1-CD2 4.4Å; L115-L160 HydrophobicContact CD1-CG 4.4Å; L115-L173 HydrophobicContact CD1-CD2 4.19Å; L115-L173 HydrophobicContact CG-CD1 4.22Å; L115-L173 HydrophobicContact CG-CD2 4.39Å; L115-P227 CarbonylContact O-C 3.54Å; L115-P227 WeakPolarHBondContact O-CA 3.18Å; L115-V228 HydrophobicContact CB-CB 4.15Å; L115-V228 HydrophobicContact CB-CG2 3.77Å; L115-V228 WeakPolarHBondContact O-CG2 3.49Å; L115-V228 PolarHBondContact O-N 3.45Å
116	L	97.4	Very high	90.7	Very high	33 Å²	33	70.3 Å²	70.3	17%	0.173	41%	0.411	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	142.1	173.4	-56.7	-175.4	0	0	0	110.7	L106 V107 V109 V118 R226 P227	L106-L116 CarbonylContact C-O 3.59Å; L106-L116 WeakPolarHBondContact CA-O 3.27Å; V107-L116 PolarHBondContact N-O 3.44Å; V107-L116 PolarHBondContact O-N 3.08Å; V109-L116 HydrophobicContact CG2-CD1 3.57Å; V109-L116 HydrophobicContact CG2-CG 3.76Å; L116-V118 HydrophobicContact CB-CG2 3.82Å; L116-R226 WeakPolarHBondContact CA-O 3.45Å; L116-P227 HydrophobicContact CD2-CB 4.29Å; L116-P227 HydrophobicContact CD2-CG 3.88Å
117	A	97.6	Very high	90.3	Very high	1 Å²	1	73.3 Å²	73.3	1%	0.008	43%	0.426	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.4	112.1	168.4	0	0	0	0	0	110	R104 L106 T220 S225 R226	R104-A117 HydrophobicContact CB-CB 4.39Å; L106-A117 HydrophobicContact CD2-CB 4.35Å; A117-T220 HydrophobicContact CB-CG2 3.57Å; A117-S225 WeakPolarHBondContact O-CA 3.27Å; A117-S225 PolarHBondContact O-N 2.71Å; A117-R226 PolarHBondContact N-O 3.16Å
118	V	96.4	Very high	90.2	Very high	18 Å²	18	74.4 Å²	74.4	11%	0.109	43%	0.429	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	129.6	-171	-171.7	0	0	0	0	111.7	S105 V107 L116 L120 N224	S105-V118 PolarHBondContact N-O 3.26Å; S105-V118 PolarHBondContact O-N 3.36Å; V107-V118 HydrophobicContact CB-CG2 4.21Å; V107-V118 HydrophobicContact CG2-CB 4.01Å; V107-V118 HydrophobicContact CG2-CG2 3.92Å; L116-V118 HydrophobicContact CB-CG2 3.82Å; V118-L120 HydrophobicContact CB-CD2 4.39Å; V118-L120 HydrophobicContact CG1-CD2 4.07Å; V118-L120 PolarHBondContact O-N 3.37Å; V118-L120 VanDerWaalsContact O-N 3.12Å; V118-N224 WeakPolarHBondContact CA-OD1 3.34Å
119	M	94.6	Very high	90.1	Very high	108 Å²	108	73.4 Å²	73.4	53%	0.532	43%	0.425	S	S	.	.			trans	-70.7	99.3	160.6	-76.6	-148.5	-67.8	0	0	109.1	R104 N224	R104-M119 HydrophobicContact CG-CB 4.37Å; R104-M119 HydrophobicContact CG-CG 3.46Å; R104-M119 VanDerWaalsContact CG-CG 3.46Å; M119-N224 PolarHBondContact N-OD1 2.86Å
120	L	90.3	Very high	90.1	Very high	40 Å²	40	75 Å²	75	21%	0.209	43%	0.426	C	S	.	.	P	Polyproline II helix	trans	-73.3	130.5	177.3	-65.8	176.7	0	0	0	110.1	V107 V118 R124 L127 K128	V107-L120 HydrophobicContact CG2-CD2 3.94Å; V118-L120 HydrophobicContact CB-CD2 4.39Å; V118-L120 HydrophobicContact CG1-CD2 4.07Å; V118-L120 PolarHBondContact O-N 3.37Å; V118-L120 VanDerWaalsContact O-N 3.12Å; L120-R124 HydrophobicContact CD2-CB 4.44Å; L120-L127 HydrophobicContact CD2-CB 4.36Å; L120-K128 HydrophobicContact CD1-CB 4.12Å
121	Q	85.6	Confident	90.5	Very high	136 Å²	136	68.8 Å²	68.8	64%	0.636	40%	0.399	S	S	*	.	P	Polyproline II helix	trans	-77.4	159.9	170	-58.1	-57	-48.5	0	0	110.1	R124	Q121-R124 PolarHBondContact O-N 3.25Å
122	G	81.4	Confident	90.9	Very high	82 Å²	82	62.3 Å²	62.3	85%	0.845	37%	0.365	S	S	*	.	T	Hydrogen-bonded Turn	trans	-50.2	140.4	178.7	0	0	0	0	0	112.6	R124	G122-R124 VanDerWaalsContact C-N 3.31Å; G122-R124 PolarHBondContact O-N 3.2Å
123	G	76.2	Confident	91.4	Very high	83 Å²	83	57.4 Å²	57.4	86%	0.856	34%	0.338	S	S	*	.	T	Hydrogen-bonded Turn	trans	83.5	-8.5	-179.5	0	0	0	0	0	115.7
124	R	83.6	Confident	91.6	Very high	135 Å²	135	53.2 Å²	53.2	51%	0.509	32%	0.318	S	S	.	.			trans	-100	22.8	176.9	-62.6	-175.6	69.4	-170.2	1.2	114	L120 Q121 G122 S126 L127	L120-R124 HydrophobicContact CD2-CB 4.44Å; Q121-R124 PolarHBondContact O-N 3.25Å; G122-R124 VanDerWaalsContact C-N 3.31Å; G122-R124 PolarHBondContact O-N 3.2Å; R124-S126 PolarHBondContact O-N 3.26Å; R124-L127 HydrophobicContact CB-CD1 4.24Å; R124-L127 PolarHBondContact O-N 3.24Å
125	G	80.9	Confident	91.7	Very high	49 Å²	49	50.6 Å²	50.6	51%	0.505	31%	0.307	S	S	.	.	G	3₁₀ helix	trans	-61.9	-27.3	-177.7	0	0	0	0	0	114.1	L127 K128	G125-L127 PolarHBondContact O-N 2.93Å; G125-K128 WeakPolarHBondContact O-CB 3.42Å; G125-K128 PolarHBondContact O-N 3.07Å
126	S	84.4	Confident	91.5	Very high	115 Å²	115	50.2 Å²	50.2	80%	0.804	31%	0.305	S	S	*	.	G	3₁₀ helix	trans	-65.1	-16.8	177.2	54.3	0	0	0	0	114.2	R124 K128	R124-S126 PolarHBondContact O-N 3.26Å; S126-K128 VanDerWaalsContact C-N 3.3Å
127	L	88.4	Confident	91.2	Very high	70 Å²	70	50.8 Å²	50.8	37%	0.366	31%	0.308	S	S	.	.	G	3₁₀ helix	trans	-82.6	-10.3	175.5	-60.3	178.2	0	0	0	112.7	V107 L120 R124 G125 V129	V107-L127 HydrophobicContact CG1-CB 4.4Å; V107-L127 HydrophobicContact CG2-CB 4.39Å; L120-L127 HydrophobicContact CD2-CB 4.36Å; R124-L127 HydrophobicContact CB-CD1 4.24Å; R124-L127 PolarHBondContact O-N 3.24Å; G125-L127 PolarHBondContact O-N 2.93Å; L127-V129 PolarHBondContact O-N 2.99Å
128	K	93.5	Very high	90.6	Very high	44 Å²	44	52.4 Å²	52.4	19%	0.191	32%	0.315	C	S	.	.			trans	-67.2	126.4	179.5	-179	174.4	178.1	-177.1	0	109.7	S97 L120 G125 S126 Y130	S97-K128 PolarHBondContact OG-NZ 2.99Å; L120-K128 HydrophobicContact CD1-CB 4.12Å; G125-K128 WeakPolarHBondContact O-CB 3.42Å; G125-K128 PolarHBondContact O-N 3.07Å; S126-K128 VanDerWaalsContact C-N 3.3Å; K128-Y130 HydrophobicContact CG-CE2 4.41Å
129	V	94.3	Very high	89.1	Confident	12 Å²	12	53 Å²	53	7%	0.073	32%	0.317	C	S	.	.			trans	-75	136.3	170.5	167.4	0	0	0	0	110.2	L106 L108 L115 L127 L131 I153	L106-V129 HydrophobicContact CB-CB 4.21Å; L106-V129 WeakPolarHBondContact O-CB 3.33Å; L106-V129 PolarHBondContact O-N 3.49Å; L108-V129 HydrophobicContact CB-CG2 3.76Å; L115-V129 HydrophobicContact CD2-CG1 4.42Å; L115-V129 HydrophobicContact CD2-CG2 4.05Å; L127-V129 PolarHBondContact O-N 2.99Å; V129-L131 HydrophobicContact CG1-CD2 3.85Å; V129-I153 HydrophobicContact CG1-CD1 3.97Å; V129-I153 HydrophobicContact CG1-CG2 3.95Å
130	Y	96.5	Very high	87.7	Confident	80 Å²	80	51.4 Å²	51.4	31%	0.314	31%	0.314	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	149.4	164.9	-66.7	-97.3	0	0	0	108.5	K128 R154 Q246	K128-Y130 HydrophobicContact CG-CE2 4.41Å; Y130-R154 VanDerWaalsContact O-CB 3.22Å; Y130-R154 WeakPolarHBondContact O-CB 3.49Å; Y130-R154 PolarHBondContact O-N 3.23Å; Y130-Q246 HydrophobicContact CD1-CG 4.28Å; Y130-Q246 HydrophobicContact CE1-CG 4.32Å
131	L	97.4	Very high	86.2	Confident	4 Å²	4	53.8 Å²	53.8	2%	0.021	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110	146	-179.8	-55.7	179.3	0	0	0	110.5	H95 C96 V98 V129 G152 I153	H95-L131 CarbonylContact C-O 3.55Å; H95-L131 VanDerWaalsContact CA-O 3.32Å; H95-L131 WeakPolarHBondContact CA-O 3.48Å; C96-L131 PolarHBondContact N-O 2.53Å; C96-L131 PolarHBondContact O-N 2.65Å; V98-L131 HydrophobicContact CB-CD1 4.2Å; V98-L131 HydrophobicContact CG1-CD1 3.85Å; V98-L131 HydrophobicContact CG1-CG 3.96Å; V129-L131 HydrophobicContact CG1-CD2 3.85Å; L131-G152 CarbonylContact C-O 3.55Å; L131-G152 WeakPolarHBondContact CA-O 3.38Å; L131-I153 HydrophobicContact CD2-CD1 3.54Å
132	N	97.6	Very high	85.3	Confident	20 Å²	20	52.1 Å²	52.1	11%	0.107	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.5	110.4	160.5	-68.7	7.5	0	0	0	106.9	E93 H95 G152 R154	E93-N132 HydrophobicContact CG-CB 4.2Å; H95-N132 PolarHBondContact CD2-OD1 3.39Å; H95-N132 PolarHBondContact NE2-OD1 2.8Å; N132-G152 PolarHBondContact N-O 3.07Å; N132-G152 PolarHBondContact O-N 3.06Å; N132-R154 WeakPolarHBondContact OD1-CB 3.41Å; N132-R154 WeakPolarHBondContact OD1-CG 3.01Å
133	M	97.9	Very high	84.2	Confident	3 Å²	3	54.5 Å²	54.5	2%	0.015	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.7	110.3	179	-177.7	176.9	-62.6	0	0	109.2	E93 H94 V149 L151 K198 I243	E93-M133 WeakPolarHBondContact CA-O 3.41Å; H94-M133 PolarHBondContact N-O 3.34Å; H94-M133 PolarHBondContact O-N 3.33Å; M133-V149 HydrophobicContact CG-CB 4.05Å; M133-V149 HydrophobicContact CG-CG1 3.96Å; M133-V149 HydrophobicContact SD-CB 4.48Å; M133-V149 HydrophobicContact SD-CG1 3.97Å; M133-L151 HydrophobicContact CB-CD2 4.31Å; M133-L151 HydrophobicContact CE-CD2 3.67Å; M133-L151 HydrophobicContact CG-CD2 4.02Å; M133-K198 HydrophobicContact CE-CD 3.93Å; M133-K198 HydrophobicContact SD-CD 3.72Å; M133-I243 HydrophobicContact CE-CD1 4.07Å; M133-I243 HydrophobicContact CE-CG2 3.65Å
134	A	97.8	Very high	84.1	Confident	2 Å²	2	52.7 Å²	52.7	2%	0.017	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.6	126.4	172.2	0	0	0	0	0	109.9	R90 E92 E93 Y136 V149 V150	R90-A134 HydrophobicContact CG-CB 4.25Å; E92-A134 CarbonylContact O-C 3.59Å; E92-A134 VanDerWaalsContact O-CA 3.31Å; E92-A134 WeakPolarHBondContact O-CA 3.44Å; E93-A134 HydrophobicContact CB-CB 4.36Å; A134-Y136 HydrophobicContact CB-CE2 3.89Å; A134-V149 CarbonylContact O-C 3.45Å; A134-V149 WeakPolarHBondContact O-CA 3.48Å; A134-V150 HydrophobicContact CB-CB 4.44Å; A134-V150 PolarHBondContact N-O 3.31Å; A134-V150 PolarHBondContact O-N 2.87Å
135	T	96.2	Very high	84	Confident	17 Å²	17	48.4 Å²	48.4	10%	0.104	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.1	147.3	177.2	63.3	0	0	0	0	110.8	R90 R91 E92 Q147 V149	R90-T135 CarbonylContact C-O 3.52Å; R91-T135 PolarHBondContact N-O 2.84Å; E92-T135 HydrophobicContact CG-CG2 4.26Å; E92-T135 WeakPolarHBondContact CG-OG1 3.39Å; E92-T135 PolarHBondContact N-OG1 2.92Å; E92-T135 PolarHBondContact O-N 2.74Å; E92-T135 PolarHBondContact O-OG1 2.88Å; T135-Q147 HydrophobicContact CG2-CG 4.47Å; T135-V149 HydrophobicContact CG2-CG1 4.32Å
136	Y	94.4	Very high	84.4	Confident	2 Å²	2	47.6 Å²	47.6	1%	0.008	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128	146.7	-179.5	-71.5	-109.3	0	0	0	111	F88 T89 R90 A134 Q147 P148 V150 L182 I185 L195	F88-Y136 HydrophobicContact CB-CD1 3.95Å; T89-Y136 CarbonylContact O-C 3.52Å; T89-Y136 VanDerWaalsContact O-CA 3.27Å; T89-Y136 WeakPolarHBondContact O-CA 3.2Å; R90-Y136 HydrophobicContact CB-CD1 4.07Å; R90-Y136 HydrophobicContact CB-CE1 3.6Å; R90-Y136 HydrophobicContact CB-CE2 4.33Å; R90-Y136 HydrophobicContact CG-CE1 4.26Å; R90-Y136 HydrophobicContact CG-CE2 4.13Å; R90-Y136 VanDerWaalsContact N-CD1 3.32Å; A134-Y136 HydrophobicContact CB-CE2 3.89Å; Y136-Q147 PolarHBondContact O-NE2 3.24Å; Y136-P148 PolarHBondContact N-O 3.07Å; Y136-P148 WeakPolarHBondContact O-CD 3.41Å; Y136-V150 HydrophobicContact CD2-CG2 4.16Å; Y136-V150 HydrophobicContact CE2-CB 3.77Å; Y136-V150 HydrophobicContact CE2-CG2 3.4Å; Y136-V150 VanDerWaalsContact CE2-CG2 3.4Å; Y136-L182 WeakPolarHBondContact CE1-O 3.33Å; Y136-L182 VanDerWaalsContact CZ-O 3.22Å; Y136-L182 PolarHBondContact OH-O 2.85Å; Y136-I185 HydrophobicContact CE1-CD1 4.01Å; Y136-I185 HydrophobicContact CE1-CG1 4.39Å; Y136-L195 HydrophobicContact CD1-CD2 4.47Å; Y136-L195 HydrophobicContact CD2-CD2 4.12Å; Y136-L195 HydrophobicContact CG-CD2 4.11Å
137	I	89.6	Confident	84.8	Confident	46 Å²	46	46.1 Å²	46.1	24%	0.236	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94	128.6	167.3	-68.1	179.4	0	0	0	108.8	F88 T89 R91 L139	F88-I137 WeakPolarHBondContact CA-O 3.33Å; T89-I137 PolarHBondContact N-O 2.96Å; T89-I137 PolarHBondContact O-N 2.87Å; R91-I137 HydrophobicContact CG-CD1 3.64Å; R91-I137 HydrophobicContact CG-CG1 3.65Å; I137-L139 HydrophobicContact CG2-CD2 4.04Å
138	H	85	Confident	85.1	Confident	35 Å²	35	43.2 Å²	43.2	16%	0.162	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.6	120.9	168.6	-173.6	-148.9	0	0	0	109	Q87 F88 T140 P148	Q87-H138 WeakPolarHBondContact O-CA 3.43Å; F88-H138 HydrophobicContact CD1-CB 3.91Å; F88-H138 HydrophobicContact CE1-CB 3.71Å; F88-H138 AromaticContact CE1-CD2 3.72Å; F88-H138 AromaticContact CE1-CG 3.62Å; F88-H138 AromaticContact CE2-CD2 3.94Å; F88-H138 HydrophobicContact CZ-CB 4.46Å; F88-H138 AromaticContact CZ-CD2 3.61Å; F88-H138 AromaticContact CZ-CG 3.88Å; F88-H138 AromaticContact CZ-NE2 3.88Å; H138-T140 PolarHBondContact CE1-O 2.88Å; H138-T140 PolarHBondContact ND1-O 3.25Å; H138-T140 PolarHBondContact NE2-OG1 2.82Å; H138-T140 PolarHBondContact O-N 3.2Å; H138-P148 HydrophobicContact CB-CG 4Å
139	L	66.8	Low	85.3	Confident	29 Å²	29	41.1 Å²	41.1	15%	0.152	24%	0.242	C	C	.	.	S	Bend	trans	-70.1	-20	-169.5	-50.2	-170.6	0	0	0	113.9	R80 A83 Q87 I137 P141	R80-L139 VanDerWaalsContact NH1-CD2 3.27Å; A83-L139 HydrophobicContact CB-CD1 3.2Å; Q87-L139 WeakPolarHBondContact O-CG 3.19Å; Q87-L139 PolarHBondContact O-N 2.98Å; I137-L139 HydrophobicContact CG2-CD2 4.04Å; L139-P141 WeakPolarHBondContact O-CD 3.42Å
140	T	64.6	Low	85.5	Confident	75 Å²	75	40.6 Å²	40.6	46%	0.46	24%	0.239	S	C	.	.	S	Bend	trans	-117.1	78.1	171.7	46.3	0	0	0	0	108.7	H138 D142	H138-T140 PolarHBondContact CE1-O 2.88Å; H138-T140 PolarHBondContact ND1-O 3.25Å; H138-T140 PolarHBondContact NE2-OG1 2.82Å; H138-T140 PolarHBondContact O-N 3.2Å; T140-D142 PolarHBondContact O-N 2.91Å; T140-D142 VanDerWaalsContact O-N 3.09Å
141	P	59	Low	85.6	Confident	90 Å²	90	36.9 Å²	36.9	58%	0.584	22%	0.224	S	C	*	.			trans	-68.4	112.8	-177.1	26.8	-31.6	0	0	0	109.3	L139 T143	L139-P141 WeakPolarHBondContact O-CD 3.42Å; P141-T143 VanDerWaalsContact C-N 3.3Å; P141-T143 PolarHBondContact O-N 3.19Å
142	D	65.1	Low	85.7	Confident	101 Å²	101	36.8 Å²	36.8	54%	0.54	22%	0.224	S	C	.	.			trans	-74	97.6	148.4	-177.1	-7.8	0	0	0	106	T140 G144 L145	T140-D142 PolarHBondContact O-N 2.91Å; T140-D142 VanDerWaalsContact O-N 3.09Å; D142-G144 PolarHBondContact O-N 3.06Å; D142-G144 PolarHBondContact OD1-N 3.08Å; D142-G144 VanDerWaalsContact OD1-N 3.16Å; D142-L145 HydrophobicContact CB-CD1 3.83Å; D142-L145 HydrophobicContact CB-CG 3.91Å; D142-L145 PolarHBondContact O-N 3.21Å
143	T	60	Low	85.7	Confident	132 Å²	132	36.1 Å²	36.1	81%	0.81	22%	0.221	S	C	*	.	T	Hydrogen-bonded Turn	trans	-53.6	-19.7	-177	-46.1	0	0	0	0	112.1	P141	P141-T143 VanDerWaalsContact C-N 3.3Å; P141-T143 PolarHBondContact O-N 3.19Å
144	G	72.9	Confident	85.5	Confident	45 Å²	45	40.2 Å²	40.2	46%	0.464	24%	0.236	S	C	.	.	T	Hydrogen-bonded Turn	trans	-72.9	-23.8	176.8	0	0	0	0	0	115.1	D142 R199	D142-G144 PolarHBondContact O-N 3.06Å; D142-G144 PolarHBondContact OD1-N 3.08Å; D142-G144 VanDerWaalsContact OD1-N 3.16Å; G144-R199 PolarHBondContact O-NE 3.44Å; G144-R199 PolarHBondContact O-NH2 2.84Å
145	L	81.8	Confident	85.3	Confident	46 Å²	46	46.7 Å²	46.7	24%	0.241	27%	0.271	C	S	.	.	S	Bend	trans	-78.4	-31.3	-167.9	-62.2	178.3	0	0	0	114	D142 Y197 R199 M209	D142-L145 HydrophobicContact CB-CD1 3.83Å; D142-L145 HydrophobicContact CB-CG 3.91Å; D142-L145 PolarHBondContact O-N 3.21Å; L145-Y197 HydrophobicContact CB-CD1 3.86Å; L145-Y197 HydrophobicContact CB-CD2 4.25Å; L145-Y197 HydrophobicContact CB-CE1 4Å; L145-Y197 HydrophobicContact CB-CE2 4.37Å; L145-Y197 HydrophobicContact CB-CG 3.98Å; L145-Y197 HydrophobicContact CD1-CE1 4.25Å; L145-Y197 HydrophobicContact CD1-CE2 3.97Å; L145-Y197 VanDerWaalsContact O-CB 3.29Å; L145-Y197 WeakPolarHBondContact O-CB 3.37Å; L145-R199 PolarHBondContact O-NH2 3.38Å; L145-M209 HydrophobicContact CD2-CE 3.91Å
146	G	89.5	Confident	85.2	Confident	32 Å²	32	47.3 Å²	47.3	33%	0.33	27%	0.274	S	S	.	.			trans	105.6	-176.5	-174.6	0	0	0	0	0	113.1	P148 K198	G146-P148 WeakPolarHBondContact O-CD 3.48Å; G146-K198 CarbonylContact C-O 3.6Å
147	Q	93.1	Very high	85.3	Confident	84 Å²	84	50.8 Å²	50.8	39%	0.393	29%	0.293	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.6	119.2	-178.2	174.1	56.4	59.9	0	0	110.2	T135 Y136 V149 K198	T135-Q147 HydrophobicContact CG2-CG 4.47Å; Y136-Q147 PolarHBondContact O-NE2 3.24Å; Q147-V149 HydrophobicContact CG-CG1 4.14Å; Q147-V149 PolarHBondContact O-N 2.75Å; Q147-K198 PolarHBondContact N-O 2.89Å; Q147-K198 PolarHBondContact O-N 2.86Å
148	P	95.3	Very high	85.7	Confident	9 Å²	9	50 Å²	50	6%	0.058	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.7	135.3	174.7	-0.2	8.2	0	0	0	111	F88 Y136 H138 G146 L195 F196 Y197	F88-P148 HydrophobicContact CD1-CB 3.9Å; F88-P148 HydrophobicContact CD1-CG 4.04Å; F88-P148 HydrophobicContact CE1-CB 3.88Å; F88-P148 HydrophobicContact CE1-CG 3.93Å; Y136-P148 PolarHBondContact N-O 3.07Å; Y136-P148 WeakPolarHBondContact O-CD 3.41Å; H138-P148 HydrophobicContact CB-CG 4Å; G146-P148 WeakPolarHBondContact O-CD 3.48Å; P148-L195 HydrophobicContact CB-CD2 4.38Å; P148-F196 CarbonylContact C-O 3.53Å; P148-F196 WeakPolarHBondContact CA-O 3.12Å; P148-Y197 HydrophobicContact CB-CD1 4.13Å; P148-Y197 HydrophobicContact CB-CE1 4.07Å; P148-Y197 HydrophobicContact CG-CD1 4.12Å; P148-Y197 HydrophobicContact CG-CE1 3.87Å
149	V	97.5	Very high	86.3	Confident	0 Å²	0	48.8 Å²	48.8	0%	0	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.2	152.5	-178.3	-60.4	0	0	0	0	111.6	M133 A134 T135 Q147 L151 F196 K198 L208	M133-V149 HydrophobicContact CG-CB 4.05Å; M133-V149 HydrophobicContact CG-CG1 3.96Å; M133-V149 HydrophobicContact SD-CB 4.48Å; M133-V149 HydrophobicContact SD-CG1 3.97Å; A134-V149 CarbonylContact O-C 3.45Å; A134-V149 WeakPolarHBondContact O-CA 3.48Å; T135-V149 HydrophobicContact CG2-CG1 4.32Å; Q147-V149 HydrophobicContact CG-CG1 4.14Å; Q147-V149 PolarHBondContact O-N 2.75Å; V149-L151 HydrophobicContact CG2-CD2 4.03Å; V149-L151 HydrophobicContact CG2-CG 4.33Å; V149-F196 HydrophobicContact CG2-CB 4.15Å; V149-F196 WeakPolarHBondContact CG2-O 3.36Å; V149-F196 PolarHBondContact N-O 2.99Å; V149-F196 PolarHBondContact O-N 2.94Å; V149-K198 HydrophobicContact CG1-CB 4.14Å; V149-K198 HydrophobicContact CG2-CB 4.02Å; V149-L208 HydrophobicContact CG2-CD2 4.21Å
150	V	98.5	Very high	87.8	Confident	1 Å²	1	47.7 Å²	47.7	1%	0.006	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	140.5	163.5	171.2	0	0	0	0	108.1	A134 Y136 Y159 L182 I185 F194 L195	A134-V150 HydrophobicContact CB-CB 4.44Å; A134-V150 PolarHBondContact N-O 3.31Å; A134-V150 PolarHBondContact O-N 2.87Å; Y136-V150 HydrophobicContact CD2-CG2 4.16Å; Y136-V150 HydrophobicContact CE2-CB 3.77Å; Y136-V150 HydrophobicContact CE2-CG2 3.4Å; Y136-V150 VanDerWaalsContact CE2-CG2 3.4Å; V150-Y159 HydrophobicContact CG1-CD1 3.57Å; V150-Y159 HydrophobicContact CG1-CE1 3.93Å; V150-L182 HydrophobicContact CG1-CD1 4.24Å; V150-I185 HydrophobicContact CG2-CD1 4.23Å; V150-F194 HydrophobicContact CG1-CB 4.35Å; V150-F194 HydrophobicContact CG2-CB 4.29Å; V150-L195 HydrophobicContact CG2-CD2 3.87Å; V150-L195 HydrophobicContact CG2-CG 4.36Å
151	L	98.5	Very high	89.4	Confident	1 Å²	1	44.1 Å²	44.1	1%	0.005	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	105.9	-173.2	-56.1	173.6	0	0	0	110.1	M133 V149 Y159 L160 F196 L208 I218	M133-L151 HydrophobicContact CB-CD2 4.31Å; M133-L151 HydrophobicContact CE-CD2 3.67Å; M133-L151 HydrophobicContact CG-CD2 4.02Å; V149-L151 HydrophobicContact CG2-CD2 4.03Å; V149-L151 HydrophobicContact CG2-CG 4.33Å; L151-Y159 WeakPolarHBondContact O-CA 3.07Å; L151-L160 HydrophobicContact CB-CB 4.28Å; L151-L160 HydrophobicContact CB-CD1 3.96Å; L151-L160 HydrophobicContact CB-CG 4.49Å; L151-L160 HydrophobicContact CD1-CD2 4.22Å; L151-L160 WeakPolarHBondContact O-CD1 3.49Å; L151-L160 PolarHBondContact O-N 3.27Å; L151-F196 HydrophobicContact CD1-CD2 4.1Å; L151-F196 HydrophobicContact CD1-CG 4.43Å; L151-F196 HydrophobicContact CG-CD2 4.34Å; L151-L208 HydrophobicContact CD1-CD1 3.89Å; L151-L208 HydrophobicContact CD1-CD2 4.26Å; L151-I218 HydrophobicContact CD1-CD1 3.94Å
152	G	98	Very high	91.3	Very high	2 Å²	2	39.9 Å²	39.9	2%	0.021	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.4	151.1	171	0	0	0	0	0	111.7	L131 N132 F158	L131-G152 CarbonylContact C-O 3.55Å; L131-G152 WeakPolarHBondContact CA-O 3.38Å; N132-G152 PolarHBondContact N-O 3.07Å; N132-G152 PolarHBondContact O-N 3.06Å; G152-F158 CarbonylContact C-O 3.56Å; G152-F158 WeakPolarHBondContact CA-O 3.18Å
153	I	97.4	Very high	92.7	Very high	6 Å²	6	38 Å²	38	3%	0.031	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.5	120.3	170	-51.6	-57.4	0	0	0	108.2	L108 L115 V129 L131 T156 F158 L160 L173	L108-I153 HydrophobicContact CD2-CG2 4.3Å; L115-I153 HydrophobicContact CD1-CD1 3.96Å; L115-I153 HydrophobicContact CD2-CD1 4.1Å; L115-I153 HydrophobicContact CG-CD1 4.49Å; V129-I153 HydrophobicContact CG1-CD1 3.97Å; V129-I153 HydrophobicContact CG1-CG2 3.95Å; L131-I153 HydrophobicContact CD2-CD1 3.54Å; I153-T156 WeakPolarHBondContact CB-OG1 3.18Å; I153-T156 HydrophobicContact CG2-CG2 4.19Å; I153-T156 PolarHBondContact O-N 3.4Å; I153-T156 PolarHBondContact O-OG1 2.81Å; I153-F158 HydrophobicContact CB-CB 4.2Å; I153-F158 HydrophobicContact CG1-CB 3.89Å; I153-F158 PolarHBondContact N-O 3.27Å; I153-L160 HydrophobicContact CD1-CD1 3.76Å; I153-L173 HydrophobicContact CD1-CD2 4.27Å; I153-L173 HydrophobicContact CG1-CD2 4.1Å
154	R	95.2	Very high	94.1	Very high	89 Å²	89	38.4 Å²	38.4	34%	0.336	21%	0.205	S	C	.	.	T	Hydrogen-bonded Turn	trans	-54.7	142.4	-177	-174.1	-174.3	169.2	173.2	5.3	111	Y130 N132 T156	Y130-R154 VanDerWaalsContact O-CB 3.22Å; Y130-R154 WeakPolarHBondContact O-CB 3.49Å; Y130-R154 PolarHBondContact O-N 3.23Å; N132-R154 WeakPolarHBondContact OD1-CB 3.41Å; N132-R154 WeakPolarHBondContact OD1-CG 3.01Å; R154-T156 PolarHBondContact O-N 3.49Å
155	D	93.2	Very high	94.6	Very high	139 Å²	139	41.7 Å²	41.7	74%	0.743	21%	0.212	S	C	*	.	T	Hydrogen-bonded Turn	trans	60	25.5	179.2	-49.6	-40.5	0	0	0	113.6
156	T	94.5	Very high	94.8	Very high	29 Å²	29	42 Å²	42	18%	0.178	23%	0.227	C	C	.	.	S	Bend	trans	-143.3	177.5	172.5	77	0	0	0	0	110.6	L108 I153 R154 F158	L108-T156 HydrophobicContact CD2-CG2 4.5Å; I153-T156 WeakPolarHBondContact CB-OG1 3.18Å; I153-T156 HydrophobicContact CG2-CG2 4.19Å; I153-T156 PolarHBondContact O-N 3.4Å; I153-T156 PolarHBondContact O-OG1 2.81Å; R154-T156 PolarHBondContact O-N 3.49Å; T156-F158 HydrophobicContact CG2-CD2 4.37Å; T156-F158 PolarHBondContact OG1-N 3.09Å
157	D	95.9	Very high	94.6	Very high	76 Å²	76	47.7 Å²	47.7	41%	0.406	25%	0.25	S	C	.	.	S	Bend	trans	-104.4	15.6	172.4	-55.8	-46.7	0	0	0	112.4	Y159 V175 V176 K179	D157-Y159 WeakPolarHBondContact O-CD2 3.31Å; D157-V175 HydrophobicContact CB-CG1 4.19Å; D157-V175 WeakPolarHBondContact O-CA 3.46Å; D157-V176 PolarHBondContact O-N 3.49Å; D157-K179 WeakPolarHBondContact OD1-CE 3.41Å; D157-K179 IonicContact OD1-NZ 2.72Å; D157-K179 PolarHBondContact OD1-NZ 3.34Å
158	F	97.5	Very high	94.5	Very high	30 Å²	30	50.5 Å²	50.5	13%	0.132	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.5	132.6	177.7	-63.4	-44.1	0	0	0	111.7	L108 M113 G152 I153 T156 L173 E174 V175	L108-F158 HydrophobicContact CD1-CD2 4.37Å; L108-F158 HydrophobicContact CD2-CD2 3.97Å; L108-F158 HydrophobicContact CD2-CE2 4.12Å; M113-F158 HydrophobicContact CE-CE1 4.07Å; M113-F158 HydrophobicContact CE-CZ 4.39Å; M113-F158 HydrophobicContact SD-CE1 4.34Å; G152-F158 CarbonylContact C-O 3.56Å; G152-F158 WeakPolarHBondContact CA-O 3.18Å; I153-F158 HydrophobicContact CB-CB 4.2Å; I153-F158 HydrophobicContact CG1-CB 3.89Å; I153-F158 PolarHBondContact N-O 3.27Å; T156-F158 HydrophobicContact CG2-CD2 4.37Å; T156-F158 PolarHBondContact OG1-N 3.09Å; F158-L173 HydrophobicContact CB-CB 4.46Å; F158-E174 CarbonylContact C-O 3.59Å; F158-E174 WeakPolarHBondContact CA-O 3.39Å; F158-V175 HydrophobicContact CD1-CG2 3.69Å; F158-V175 HydrophobicContact CE1-CG2 3.46Å; F158-V175 VanDerWaalsContact CE1-CG2 3.46Å
159	Y	98.3	Very high	94.5	Very high	8 Å²	8	50.7 Å²	50.7	3%	0.031	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	143.2	175.6	-72.9	-97.5	0	0	0	110.6	V150 L151 D157 L173 E174 V176 K179 L182	V150-Y159 HydrophobicContact CG1-CD1 3.57Å; V150-Y159 HydrophobicContact CG1-CE1 3.93Å; L151-Y159 WeakPolarHBondContact O-CA 3.07Å; D157-Y159 WeakPolarHBondContact O-CD2 3.31Å; Y159-L173 WeakPolarHBondContact O-CA 3.47Å; Y159-E174 PolarHBondContact N-O 3.18Å; Y159-E174 PolarHBondContact O-N 3.48Å; Y159-V176 HydrophobicContact CD2-CB 3.59Å; Y159-V176 HydrophobicContact CD2-CG2 3.52Å; Y159-V176 HydrophobicContact CE2-CB 3.79Å; Y159-V176 HydrophobicContact CE2-CG2 4.2Å; Y159-V176 HydrophobicContact CG-CB 4.46Å; Y159-V176 HydrophobicContact CG-CG2 3.96Å; Y159-K179 HydrophobicContact CE2-CG 4.49Å; Y159-L182 HydrophobicContact CD1-CD1 4.14Å; Y159-L182 HydrophobicContact CE1-CD1 4.01Å
160	L	98.5	Very high	94.5	Very high	6 Å²	6	52.4 Å²	52.4	3%	0.031	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.1	133.9	172.3	-76	77.7	0	0	0	109.2	L115 L151 I153 L171 H172 L173 F196 I218	L115-L160 HydrophobicContact CD1-CD1 4.21Å; L115-L160 HydrophobicContact CD1-CD2 4.4Å; L115-L160 HydrophobicContact CD1-CG 4.4Å; L151-L160 HydrophobicContact CB-CB 4.28Å; L151-L160 HydrophobicContact CB-CD1 3.96Å; L151-L160 HydrophobicContact CB-CG 4.49Å; L151-L160 HydrophobicContact CD1-CD2 4.22Å; L151-L160 WeakPolarHBondContact O-CD1 3.49Å; L151-L160 PolarHBondContact O-N 3.27Å; I153-L160 HydrophobicContact CD1-CD1 3.76Å; L160-L171 HydrophobicContact CB-CD1 4.31Å; L160-L171 HydrophobicContact CD2-CD1 4.31Å; L160-L171 HydrophobicContact CD2-CD2 4.18Å; L160-H172 WeakPolarHBondContact CA-O 3.33Å; L160-L173 HydrophobicContact CD1-CD2 4.05Å; L160-L173 HydrophobicContact CG-CD2 4.13Å; L160-F196 HydrophobicContact CB-CE2 3.89Å; L160-F196 HydrophobicContact CB-CZ 4.02Å; L160-F196 WeakPolarHBondContact O-CE2 3.14Å; L160-I218 HydrophobicContact CD2-CD1 3.74Å
161	S	98	Very high	94.4	Very high	0 Å²	0	53.7 Å²	53.7	0%	0	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.9	155.1	176.7	65.8	0	0	0	0	112.3	H163 H172 E174 R193	S161-H163 PolarHBondContact OG-NE2 3.29Å; S161-H172 PolarHBondContact N-O 3.36Å; S161-H172 PolarHBondContact O-N 2.93Å; S161-E174 WeakPolarHBondContact CB-OE1 3.33Å; S161-E174 WeakPolarHBondContact OG-CG 3.43Å; S161-E174 PolarHBondContact OG-OE1 2.87Å; S161-R193 CarbonylContact C-O 3.54Å; S161-R193 WeakPolarHBondContact CA-O 3.37Å
162	C	97.8	Very high	94.4	Very high	1 Å²	1	57.4 Å²	57.4	1%	0.007	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	126.2	178	-58.6	0	0	0	0	111	T170 R193 F196 S210 F213	C162-T170 WeakPolarHBondContact CA-O 3.34Å; C162-R193 PolarHBondContact N-O 2.97Å; C162-R193 VanDerWaalsContact O-CB 3.31Å; C162-R193 WeakPolarHBondContact O-CB 3.48Å; C162-F196 WeakPolarHBondContact SG-CE1 3.33Å; C162-F196 VanDerWaalsContact SG-CZ 3.55Å; C162-S210 VanDerWaalsContact SG-CB 3.58Å; C162-S210 PolarHBondContact SG-OG 2.78Å; C162-F213 HydrophobicContact CB-CD2 3.58Å; C162-F213 HydrophobicContact CB-CE2 3.66Å
163	H	95	Very high	94.3	Very high	63 Å²	63	58.1 Å²	58.1	29%	0.292	30%	0.299	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	165.6	173.4	-71.6	-90.7	0	0	0	110.8	S161 P169 T170 H172 E174	S161-H163 PolarHBondContact OG-NE2 3.29Å; H163-P169 CarbonylContact O-C 3.48Å; H163-P169 WeakPolarHBondContact O-CA 3.49Å; H163-T170 PolarHBondContact N-O 3.25Å; H163-T170 PolarHBondContact O-N 3.34Å; H163-H172 AromaticContact CD2-CD2 3.45Å; H163-H172 PolarHBondContact CD2-CD2 2.97Å; H163-H172 VanDerWaalsContact CD2-CD2 3.45Å; H163-H172 AromaticContact CD2-CG 3.74Å; H163-H172 AromaticContact CG-CD2 3.87Å; H163-E174 IonicContact CD2-OE1 2.74Å; H163-E174 IonicContact CE1-OE1 3.21Å; H163-E174 PolarHBondContact CE1-OE1 2.66Å; H163-E174 IonicContact NE2-OE1 3.34Å; H163-E174 PolarHBondContact NE2-OE1 3.17Å
164	K	89.8	Confident	94.3	Very high	140 Å²	140	59.6 Å²	59.6	61%	0.609	31%	0.306	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-102.3	114.5	165.3	-171.4	179.1	-179.8	-174	0	107.6	G166 F213	K164-G166 WeakPolarHBondContact CE-O 3.45Å; K164-G166 WeakPolarHBondContact CG-O 3.44Å; K164-F213 HydrophobicContact CB-CE1 4.03Å; K164-F213 HydrophobicContact CB-CZ 3.85Å
165	D	84.4	Confident	94.4	Very high	113 Å²	113	59 Å²	59	60%	0.604	31%	0.312	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-111	109.9	172.9	-173	9.6	0	0	0	108.6	D167 K168 T170	D165-D167 PolarHBondContact O-N 3.4Å; D165-K168 PolarHBondContact N-O 2.89Å; D165-K168 PolarHBondContact O-N 2.86Å; D165-K168 VanDerWaalsContact O-O 3.12Å; D165-T170 HydrophobicContact CB-CG2 3.82Å
166	G	84.8	Confident	94.6	Very high	54 Å²	54	52.8 Å²	52.8	56%	0.557	28%	0.28	S	S	*	.	T	Hydrogen-bonded Turn	trans	57.3	-119	-166.1	0	0	0	0	0	111.6	K164	K164-G166 WeakPolarHBondContact CE-O 3.45Å; K164-G166 WeakPolarHBondContact CG-O 3.44Å
167	D	85.1	Confident	94.5	Very high	151 Å²	151	60.1 Å²	60.1	81%	0.807	31%	0.312	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.8	-4.5	-178	-67.4	-37	0	0	0	114.2	D165	D165-D167 PolarHBondContact O-N 3.4Å
168	K	91.4	Very high	94.4	Very high	142 Å²	142	60.9 Å²	60.9	62%	0.617	32%	0.316	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-122.2	135.6	-170.8	-66.3	-179.2	-177.2	176.7	0	112	D165 W216	D165-K168 PolarHBondContact N-O 2.89Å; D165-K168 PolarHBondContact O-N 2.86Å; D165-K168 VanDerWaalsContact O-O 3.12Å; K168-W216 HydrophobicContact CB-CH2 4.28Å; K168-W216 HydrophobicContact CG-CH2 4.36Å
169	P	95.6	Very high	94.2	Very high	13 Å²	13	63 Å²	63	8%	0.084	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-61.4	136.8	167.8	-26.3	37.6	0	0	0	112.1	H163 F213 W216	H163-P169 CarbonylContact O-C 3.48Å; H163-P169 WeakPolarHBondContact O-CA 3.49Å; P169-F213 HydrophobicContact CB-CB 4.01Å; P169-F213 HydrophobicContact CB-CD1 4.14Å; P169-F213 HydrophobicContact CB-CD2 3.85Å; P169-F213 HydrophobicContact CB-CE2 4.35Å; P169-F213 HydrophobicContact CB-CG 3.72Å; P169-F213 HydrophobicContact CG-CB 3.75Å; P169-F213 HydrophobicContact CG-CD1 3.58Å; P169-F213 HydrophobicContact CG-CD2 4.2Å; P169-F213 HydrophobicContact CG-CE1 4.22Å; P169-F213 HydrophobicContact CG-CG 3.56Å; P169-W216 HydrophobicContact CB-CD2 3.93Å; P169-W216 HydrophobicContact CB-CE3 4.12Å; P169-W216 HydrophobicContact CB-CG 4.1Å; P169-W216 VanDerWaalsContact CD-CE2 3.42Å; P169-W216 VanDerWaalsContact CD-CZ2 3.44Å; P169-W216 HydrophobicContact CG-CD2 3.69Å; P169-W216 HydrophobicContact CG-CE3 4.3Å; P169-W216 HydrophobicContact CG-CG 3.83Å; P169-W216 HydrophobicContact CG-CZ2 4.2Å
170	T	96.4	Very high	93.9	Very high	36 Å²	36	68.6 Å²	68.6	22%	0.221	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	151.3	179	49.5	0	0	0	0	110.3	C162 H163 D165 H172	C162-T170 WeakPolarHBondContact CA-O 3.34Å; H163-T170 PolarHBondContact N-O 3.25Å; H163-T170 PolarHBondContact O-N 3.34Å; D165-T170 HydrophobicContact CB-CG2 3.82Å; T170-H172 WeakPolarHBondContact CB-NE2 3.48Å; T170-H172 PolarHBondContact OG1-NE2 3.34Å
171	L	97.8	Very high	93.7	Very high	29 Å²	29	70.6 Å²	70.6	15%	0.152	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.7	133.4	178	-171.8	70.8	0	0	0	108.7	L160 F196 I218 V228 M230	L160-L171 HydrophobicContact CB-CD1 4.31Å; L160-L171 HydrophobicContact CD2-CD1 4.31Å; L160-L171 HydrophobicContact CD2-CD2 4.18Å; L171-F196 HydrophobicContact CD1-CE1 4.05Å; L171-F196 HydrophobicContact CD1-CZ 3.78Å; L171-I218 HydrophobicContact CD1-CD1 4.41Å; L171-I218 HydrophobicContact CD1-CG1 4.21Å; L171-I218 HydrophobicContact CD2-CG1 4.35Å; L171-I218 HydrophobicContact CD2-CG2 4.13Å; L171-V228 HydrophobicContact CD2-CB 4.3Å; L171-V228 HydrophobicContact CD2-CG1 3.65Å; L171-M230 HydrophobicContact CB-CG 3.84Å; L171-M230 HydrophobicContact CB-SD 4.05Å; L171-M230 HydrophobicContact CD1-SD 3.86Å; L171-M230 HydrophobicContact CG-SD 4.43Å
172	H	97.1	Very high	93.6	Very high	79 Å²	79	70.7 Å²	70.7	37%	0.366	37%	0.368	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.1	164.3	-179.4	-66	-98.2	0	0	0	111.1	L160 S161 H163 T170	L160-H172 WeakPolarHBondContact CA-O 3.33Å; S161-H172 PolarHBondContact N-O 3.36Å; S161-H172 PolarHBondContact O-N 2.93Å; H163-H172 AromaticContact CD2-CD2 3.45Å; H163-H172 PolarHBondContact CD2-CD2 2.97Å; H163-H172 VanDerWaalsContact CD2-CD2 3.45Å; H163-H172 AromaticContact CD2-CG 3.74Å; H163-H172 AromaticContact CG-CD2 3.87Å; T170-H172 WeakPolarHBondContact CB-NE2 3.48Å; T170-H172 PolarHBondContact OG1-NE2 3.34Å
173	L	97.8	Very high	93.4	Very high	16 Å²	16	72.8 Å²	72.8	8%	0.084	38%	0.383	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.2	126.2	161.1	-66.5	-178.6	0	0	0	108.7	L108 M113 L115 I153 F158 Y159 L160	L108-L173 HydrophobicContact CD1-CD1 3.34Å; M113-L173 HydrophobicContact CB-CB 4.27Å; M113-L173 WeakPolarHBondContact O-CD1 3.15Å; M113-L173 WeakPolarHBondContact O-CG 3.18Å; L115-L173 HydrophobicContact CD1-CD2 4.19Å; L115-L173 HydrophobicContact CG-CD1 4.22Å; L115-L173 HydrophobicContact CG-CD2 4.39Å; I153-L173 HydrophobicContact CD1-CD2 4.27Å; I153-L173 HydrophobicContact CG1-CD2 4.1Å; F158-L173 HydrophobicContact CB-CB 4.46Å; Y159-L173 WeakPolarHBondContact O-CA 3.47Å; L160-L173 HydrophobicContact CD1-CD2 4.05Å; L160-L173 HydrophobicContact CG-CD2 4.13Å
174	E	97.1	Very high	93.3	Very high	38 Å²	38	75 Å²	75	18%	0.178	39%	0.393	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	142.9	174.8	-82.9	178	-111.5	0	0	110.4	F158 Y159 S161 H163 R193 F194	F158-E174 CarbonylContact C-O 3.59Å; F158-E174 WeakPolarHBondContact CA-O 3.39Å; Y159-E174 PolarHBondContact N-O 3.18Å; Y159-E174 PolarHBondContact O-N 3.48Å; S161-E174 WeakPolarHBondContact CB-OE1 3.33Å; S161-E174 WeakPolarHBondContact OG-CG 3.43Å; S161-E174 PolarHBondContact OG-OE1 2.87Å; H163-E174 IonicContact CD2-OE1 2.74Å; H163-E174 IonicContact CE1-OE1 3.21Å; H163-E174 PolarHBondContact CE1-OE1 2.66Å; H163-E174 IonicContact NE2-OE1 3.34Å; H163-E174 PolarHBondContact NE2-OE1 3.17Å; E174-R193 WeakPolarHBondContact OE1-CD 3.43Å; E174-R193 IonicContact OE1-NE 3.77Å; E174-R193 PolarHBondContact OE1-NE 3.12Å; E174-R193 IonicContact OE2-CZ 3.7Å; E174-R193 IonicContact OE2-NE 2.78Å; E174-R193 PolarHBondContact OE2-NE 2.9Å; E174-R193 IonicContact OE2-NH2 2.85Å; E174-R193 PolarHBondContact OE2-NH2 2.96Å; E174-F194 HydrophobicContact CB-CE1 3.84Å; E174-F194 HydrophobicContact CB-CZ 4.07Å; E174-F194 WeakPolarHBondContact OE2-CZ 3.33Å
175	V	97.3	Very high	93.5	Very high	75 Å²	75	68.3 Å²	68.3	46%	0.455	36%	0.364	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.5	128.7	169.3	179.5	0	0	0	0	108.9	D157 F158 E177	D157-V175 HydrophobicContact CB-CG1 4.19Å; D157-V175 WeakPolarHBondContact O-CA 3.46Å; F158-V175 HydrophobicContact CD1-CG2 3.69Å; F158-V175 HydrophobicContact CE1-CG2 3.46Å; F158-V175 VanDerWaalsContact CE1-CG2 3.46Å; V175-E177 HydrophobicContact CG1-CG 4.2Å
176	V	97	Very high	93.7	Very high	10 Å²	10	65.3 Å²	65.3	6%	0.061	35%	0.352	C	S	.	.			trans	-115.9	101.7	171.4	-179.6	0	0	0	0	108.4	D157 Y159 D178 L182 F194	D157-V176 PolarHBondContact O-N 3.49Å; Y159-V176 HydrophobicContact CD2-CB 3.59Å; Y159-V176 HydrophobicContact CD2-CG2 3.52Å; Y159-V176 HydrophobicContact CE2-CB 3.79Å; Y159-V176 HydrophobicContact CE2-CG2 4.2Å; Y159-V176 HydrophobicContact CG-CB 4.46Å; Y159-V176 HydrophobicContact CG-CG2 3.96Å; V176-D178 WeakPolarHBondContact CG1-O 3.49Å; V176-L182 HydrophobicContact CG1-CD1 3.96Å; V176-L182 HydrophobicContact CG1-CG 4.25Å; V176-L182 HydrophobicContact CG2-CD1 4.33Å; V176-F194 HydrophobicContact CG2-CE1 3.88Å; V176-F194 HydrophobicContact CG2-CZ 3.8Å
177	E	92.6	Very high	93.5	Very high	182 Å²	182	63.4 Å²	63.4	85%	0.85	33%	0.331	S	S	*	.	S	Bend	trans	-69.5	-47.2	-179.4	-62	-177.9	175.7	0	0	111.4	V175	V175-E177 HydrophobicContact CG1-CG 4.2Å
178	D	93.6	Very high	93.5	Very high	93 Å²	93	63.5 Å²	63.5	50%	0.497	33%	0.326	S	S	.	.			trans	-96.9	94.9	175.9	-179.7	17.2	0	0	0	111.3	V176 M180 S181	V176-D178 WeakPolarHBondContact CG1-O 3.49Å; D178-M180 PolarHBondContact O-N 3.39Å; D178-M180 WeakPolarHBondContact OD1-CA 3.39Å; D178-M180 VanDerWaalsContact OD1-CB 3.25Å; D178-M180 WeakPolarHBondContact OD1-CB 3.39Å; D178-M180 PolarHBondContact OD1-N 3.41Å; D178-S181 VanDerWaalsContact O-CB 3.29Å; D178-S181 WeakPolarHBondContact O-CB 3.37Å; D178-S181 PolarHBondContact O-N 3.22Å; D178-S181 PolarHBondContact O-OG 3Å; D178-S181 PolarHBondContact OD2-N 3.36Å
179	K	92.6	Very high	93.4	Very high	74 Å²	74	58.4 Å²	58.4	32%	0.322	31%	0.308	S	S	.	.	G	3₁₀ helix	trans	-64.5	-18.8	177	-62.8	179	-177.4	170.9	0	113.1	D157 Y159 S181 L182	D157-K179 WeakPolarHBondContact OD1-CE 3.41Å; D157-K179 IonicContact OD1-NZ 2.72Å; D157-K179 PolarHBondContact OD1-NZ 3.34Å; Y159-K179 HydrophobicContact CE2-CG 4.49Å; K179-S181 VanDerWaalsContact C-N 3.3Å; K179-L182 PolarHBondContact O-N 3.18Å
180	M	92.6	Very high	93.3	Very high	126 Å²	126	64.1 Å²	64.1	62%	0.621	34%	0.338	S	S	*	.	G	3₁₀ helix	trans	-74.7	-23.2	175.6	-61.6	-58.4	-60.6	0	0	111.7	D178 L182 S183	D178-M180 PolarHBondContact O-N 3.39Å; D178-M180 WeakPolarHBondContact OD1-CA 3.39Å; D178-M180 VanDerWaalsContact OD1-CB 3.25Å; D178-M180 WeakPolarHBondContact OD1-CB 3.39Å; D178-M180 PolarHBondContact OD1-N 3.41Å; M180-L182 PolarHBondContact O-N 3.31Å; M180-S183 WeakPolarHBondContact O-CB 3.44Å; M180-S183 PolarHBondContact O-N 3.28Å; M180-S183 PolarHBondContact O-OG 3.14Å
181	S	93.6	Very high	93.2	Very high	47 Å²	47	64.4 Å²	64.4	33%	0.329	34%	0.338	S	S	.	.	G	3₁₀ helix	trans	-60.7	-18.9	174.1	87.3	0	0	0	0	112.7	D178 K179 L191	D178-S181 VanDerWaalsContact O-CB 3.29Å; D178-S181 WeakPolarHBondContact O-CB 3.37Å; D178-S181 PolarHBondContact O-N 3.22Å; D178-S181 PolarHBondContact O-OG 3Å; D178-S181 PolarHBondContact OD2-N 3.36Å; K179-S181 VanDerWaalsContact C-N 3.3Å; S181-L191 WeakPolarHBondContact O-CD1 3.37Å
182	L	95.9	Very high	93	Very high	2 Å²	2	66.2 Å²	66.2	1%	0.01	34%	0.343	C	S	.	.	G	3₁₀ helix	trans	-93.8	3.6	176.6	-60.3	175.6	0	0	0	112.8	Y136 V150 Y159 V176 K179 M180 E184 I185 L191 F194	Y136-L182 WeakPolarHBondContact CE1-O 3.33Å; Y136-L182 VanDerWaalsContact CZ-O 3.22Å; Y136-L182 PolarHBondContact OH-O 2.85Å; V150-L182 HydrophobicContact CG1-CD1 4.24Å; Y159-L182 HydrophobicContact CD1-CD1 4.14Å; Y159-L182 HydrophobicContact CE1-CD1 4.01Å; V176-L182 HydrophobicContact CG1-CD1 3.96Å; V176-L182 HydrophobicContact CG1-CG 4.25Å; V176-L182 HydrophobicContact CG2-CD1 4.33Å; K179-L182 PolarHBondContact O-N 3.18Å; M180-L182 PolarHBondContact O-N 3.31Å; L182-E184 VanDerWaalsContact C-N 3.29Å; L182-E184 PolarHBondContact O-N 3.45Å; L182-I185 HydrophobicContact CD2-CD1 4.17Å; L182-L191 HydrophobicContact CD2-CD2 4.29Å; L182-F194 HydrophobicContact CD2-CB 4.47Å; L182-F194 HydrophobicContact CD2-CD2 3.82Å; L182-F194 HydrophobicContact CD2-CE2 4.36Å; L182-F194 HydrophobicContact CD2-CG 4.26Å
183	S	93.9	Very high	93.1	Very high	46 Å²	46	65 Å²	65	32%	0.322	34%	0.335	S	S	.	.	S	Bend	trans	-65.1	-35.8	-179.4	64.5	0	0	0	0	112.6	R90 M180	R90-S183 WeakPolarHBondContact CB-O 3.32Å; R90-S183 PolarHBondContact N-O 2.87Å; M180-S183 WeakPolarHBondContact O-CB 3.44Å; M180-S183 PolarHBondContact O-N 3.28Å; M180-S183 PolarHBondContact O-OG 3.14Å
184	E	93.1	Very high	93.1	Very high	108 Å²	108	64.4 Å²	64.4	51%	0.505	33%	0.332	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.5	129.6	176.9	-63.9	-172.2	176.5	0	0	109.8	Q87 F88 L182	Q87-E184 PolarHBondContact NE2-OE2 2.94Å; F88-E184 CarbonylContact O-C 3.37Å; F88-E184 WeakPolarHBondContact O-CA 3.47Å; L182-E184 VanDerWaalsContact C-N 3.29Å; L182-E184 PolarHBondContact O-N 3.45Å
185	I	93.3	Very high	93.1	Very high	1 Å²	1	62.6 Å²	62.6	1%	0.005	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	123.3	179.5	-60.3	171	0	0	0	106.9	F88 Y136 V150 L182 L191 R192 L195	F88-I185 WeakPolarHBondContact CA-O 3.45Å; F88-I185 HydrophobicContact CB-CB 4.18Å; F88-I185 WeakPolarHBondContact CB-O 3.19Å; F88-I185 WeakPolarHBondContact CD2-O 3.29Å; F88-I185 PolarHBondContact N-O 2.85Å; F88-I185 PolarHBondContact O-N 2.87Å; Y136-I185 HydrophobicContact CE1-CD1 4.01Å; Y136-I185 HydrophobicContact CE1-CG1 4.39Å; V150-I185 HydrophobicContact CG2-CD1 4.23Å; L182-I185 HydrophobicContact CD2-CD1 4.17Å; I185-L191 HydrophobicContact CG1-CB 4.13Å; I185-L191 HydrophobicContact CG2-CB 3.93Å; I185-R192 HydrophobicContact CG2-CB 4.46Å; I185-L195 HydrophobicContact CB-CD1 4.07Å; I185-L195 HydrophobicContact CD1-CD1 4.09Å; I185-L195 HydrophobicContact CD1-CD2 4.27Å; I185-L195 HydrophobicContact CD1-CG 3.93Å; I185-L195 HydrophobicContact CG2-CD1 3.63Å
186	S	88.9	Confident	93.1	Very high	49 Å²	49	59 Å²	59	34%	0.343	30%	0.302	S	S	.	.			trans	-82	156.3	171.7	68.6	0	0	0	0	111.3	E188 S189	S186-E188 PolarHBondContact O-N 2.93Å; S186-S189 PolarHBondContact O-N 3.06Å; S186-S189 WeakPolarHBondContact OG-CB 3.5Å; S186-S189 PolarHBondContact OG-N 2.8Å
187	A	81.4	Confident	93.1	Very high	14 Å²	14	59.2 Å²	59.2	12%	0.116	30%	0.302	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63.5	-25	-179.9	0	0	0	0	0	113.3	G86 R192	G86-A187 WeakPolarHBondContact O-CB 3.33Å; G86-A187 PolarHBondContact O-N 3.24Å; A187-R192 WeakPolarHBondContact O-CD 3.39Å; A187-R192 PolarHBondContact O-NH1 3.18Å
188	E	84.5	Confident	93.2	Very high	154 Å²	154	52 Å²	52	72%	0.72	27%	0.267	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.4	-5.5	-179.4	-56.2	71.9	-157.2	0	0	112.8	S186	S186-E188 PolarHBondContact O-N 2.93Å
189	S	90.3	Very high	93.2	Very high	34 Å²	34	51.1 Å²	51.1	24%	0.238	26%	0.257	C	S	.	.	S	Bend	trans	-75	144	179.4	176.9	0	0	0	0	111.5	S186 L191 R192	S186-S189 PolarHBondContact O-N 3.06Å; S186-S189 WeakPolarHBondContact OG-CB 3.5Å; S186-S189 PolarHBondContact OG-N 2.8Å; S189-L191 PolarHBondContact O-N 2.82Å; S189-L191 WeakPolarHBondContact OG-CB 3.29Å; S189-L191 WeakPolarHBondContact OG-CG 3.38Å; S189-L191 PolarHBondContact OG-N 2.96Å; S189-L191 VanDerWaalsContact OG-N 3.08Å; S189-R192 WeakPolarHBondContact O-CB 3.16Å; S189-R192 PolarHBondContact O-N 2.84Å
190	D	91.9	Very high	93.1	Very high	134 Å²	134	51.8 Å²	51.8	72%	0.717	26%	0.264	S	S	*	.	G	3₁₀ helix	trans	-57.5	-20.7	168.8	-69.1	-30.7	0	0	0	112.7	R192 R193	D190-R192 PolarHBondContact O-N 2.93Å; D190-R193 VanDerWaalsContact C-NH1 3.26Å; D190-R193 WeakPolarHBondContact O-CD 3.44Å; D190-R193 WeakPolarHBondContact O-CG 3.32Å; D190-R193 PolarHBondContact O-N 2.82Å; D190-R193 PolarHBondContact O-NH1 3.01Å
191	L	95.4	Very high	92.6	Very high	41 Å²	41	50.3 Å²	50.3	22%	0.215	26%	0.262	C	S	.	.	G	3₁₀ helix	trans	-66	-15.8	174.9	-63.1	176	0	0	0	112.9	S181 L182 I185 S189 R193 F194	S181-L191 WeakPolarHBondContact O-CD1 3.37Å; L182-L191 HydrophobicContact CD2-CD2 4.29Å; I185-L191 HydrophobicContact CG1-CB 4.13Å; I185-L191 HydrophobicContact CG2-CB 3.93Å; S189-L191 PolarHBondContact O-N 2.82Å; S189-L191 WeakPolarHBondContact OG-CB 3.29Å; S189-L191 WeakPolarHBondContact OG-CG 3.38Å; S189-L191 PolarHBondContact OG-N 2.96Å; S189-L191 VanDerWaalsContact OG-N 3.08Å; L191-R193 PolarHBondContact O-N 2.73Å; L191-R193 VanDerWaalsContact O-N 3.07Å; L191-F194 HydrophobicContact CD2-CD2 4.3Å; L191-F194 HydrophobicContact CD2-CE2 4.07Å; L191-F194 WeakPolarHBondContact O-CD2 3.28Å; L191-F194 PolarHBondContact O-N 2.85Å; L191-F194 VanDerWaalsContact O-N 3.08Å
192	R	94.2	Very high	91.7	Very high	67 Å²	67	50.1 Å²	50.1	25%	0.253	27%	0.268	S	S	.	.	G	3₁₀ helix	trans	-59.1	-20.1	174.3	-175	171.7	169.4	-177.3	-2.4	113.1	I185 A187 S189 D190 F194 L195 A211 N212	I185-R192 HydrophobicContact CG2-CB 4.46Å; A187-R192 WeakPolarHBondContact O-CD 3.39Å; A187-R192 PolarHBondContact O-NH1 3.18Å; S189-R192 WeakPolarHBondContact O-CB 3.16Å; S189-R192 PolarHBondContact O-N 2.84Å; D190-R192 PolarHBondContact O-N 2.93Å; R192-F194 PolarHBondContact O-N 3.18Å; R192-L195 HydrophobicContact CG-CD1 4.47Å; R192-L195 WeakPolarHBondContact O-CB 3.48Å; R192-L195 PolarHBondContact O-N 3.21Å; R192-A211 HydrophobicContact CG-CB 4.34Å; R192-A211 VanDerWaalsContact CZ-O 3.29Å; R192-A211 PolarHBondContact NE-O 2.82Å; R192-A211 PolarHBondContact NH2-O 2.74Å; R192-N212 HydrophobicContact CG-CB 4.41Å
193	R	97.3	Very high	90.6	Very high	55 Å²	55	58 Å²	58	21%	0.208	31%	0.309	C	S	.	.	G	3₁₀ helix	trans	-59.1	-24.5	173.5	71.7	-171.6	-176.2	-89.8	5.1	114.5	S161 C162 E174 D190 L191	S161-R193 CarbonylContact C-O 3.54Å; S161-R193 WeakPolarHBondContact CA-O 3.37Å; C162-R193 PolarHBondContact N-O 2.97Å; C162-R193 VanDerWaalsContact O-CB 3.31Å; C162-R193 WeakPolarHBondContact O-CB 3.48Å; E174-R193 WeakPolarHBondContact OE1-CD 3.43Å; E174-R193 IonicContact OE1-NE 3.77Å; E174-R193 PolarHBondContact OE1-NE 3.12Å; E174-R193 IonicContact OE2-CZ 3.7Å; E174-R193 IonicContact OE2-NE 2.78Å; E174-R193 PolarHBondContact OE2-NE 2.9Å; E174-R193 IonicContact OE2-NH2 2.85Å; E174-R193 PolarHBondContact OE2-NH2 2.96Å; D190-R193 VanDerWaalsContact C-NH1 3.26Å; D190-R193 WeakPolarHBondContact O-CD 3.44Å; D190-R193 WeakPolarHBondContact O-CG 3.32Å; D190-R193 PolarHBondContact O-N 2.82Å; D190-R193 PolarHBondContact O-NH1 3.01Å; L191-R193 PolarHBondContact O-N 2.73Å; L191-R193 VanDerWaalsContact O-N 3.07Å
194	F	98.2	Very high	90	Very high	3 Å²	3	58.8 Å²	58.8	1%	0.013	31%	0.31	C	S	.	.	G	3₁₀ helix	trans	-84.2	-13.1	177.2	-64.4	-72.7	0	0	0	113.6	V150 E174 V176 L182 L191 R192 F196	V150-F194 HydrophobicContact CG1-CB 4.35Å; V150-F194 HydrophobicContact CG2-CB 4.29Å; E174-F194 HydrophobicContact CB-CE1 3.84Å; E174-F194 HydrophobicContact CB-CZ 4.07Å; E174-F194 WeakPolarHBondContact OE2-CZ 3.33Å; V176-F194 HydrophobicContact CG2-CE1 3.88Å; V176-F194 HydrophobicContact CG2-CZ 3.8Å; L182-F194 HydrophobicContact CD2-CB 4.47Å; L182-F194 HydrophobicContact CD2-CD2 3.82Å; L182-F194 HydrophobicContact CD2-CE2 4.36Å; L182-F194 HydrophobicContact CD2-CG 4.26Å; L191-F194 HydrophobicContact CD2-CD2 4.3Å; L191-F194 HydrophobicContact CD2-CE2 4.07Å; L191-F194 WeakPolarHBondContact O-CD2 3.28Å; L191-F194 PolarHBondContact O-N 2.85Å; L191-F194 VanDerWaalsContact O-N 3.08Å; R192-F194 PolarHBondContact O-N 3.18Å; F194-F196 WeakPolarHBondContact O-CD2 3.33Å; F194-F196 WeakPolarHBondContact O-CE2 3.5Å
195	L	97.2	Very high	90	Very high	0 Å²	0	56.4 Å²	56.4	0%	0	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.8	134.6	-176.2	-77.9	167.5	0	0	0	111.5	F88 Y136 P148 V150 I185 R192 A211	F88-L195 HydrophobicContact CB-CD1 4.12Å; F88-L195 HydrophobicContact CD1-CD1 3.86Å; F88-L195 HydrophobicContact CD1-CD2 4.34Å; F88-L195 HydrophobicContact CD2-CD1 3.61Å; F88-L195 HydrophobicContact CE1-CD1 4.14Å; F88-L195 HydrophobicContact CE2-CD1 3.91Å; F88-L195 HydrophobicContact CG-CD1 3.59Å; F88-L195 HydrophobicContact CZ-CD1 4.16Å; Y136-L195 HydrophobicContact CD1-CD2 4.47Å; Y136-L195 HydrophobicContact CD2-CD2 4.12Å; Y136-L195 HydrophobicContact CG-CD2 4.11Å; P148-L195 HydrophobicContact CB-CD2 4.38Å; V150-L195 HydrophobicContact CG2-CD2 3.87Å; V150-L195 HydrophobicContact CG2-CG 4.36Å; I185-L195 HydrophobicContact CB-CD1 4.07Å; I185-L195 HydrophobicContact CD1-CD1 4.09Å; I185-L195 HydrophobicContact CD1-CD2 4.27Å; I185-L195 HydrophobicContact CD1-CG 3.93Å; I185-L195 HydrophobicContact CG2-CD1 3.63Å; R192-L195 HydrophobicContact CG-CD1 4.47Å; R192-L195 WeakPolarHBondContact O-CB 3.48Å; R192-L195 PolarHBondContact O-N 3.21Å; L195-A211 HydrophobicContact CB-CB 3.56Å; L195-A211 VanDerWaalsContact O-CB 3.28Å; L195-A211 WeakPolarHBondContact O-CB 3.41Å; L195-A211 PolarHBondContact O-N 2.92Å
196	F	97.7	Very high	90.1	Very high	0 Å²	0	56.4 Å²	56.4	0%	0	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	145.5	170.7	-59.6	-93.8	0	0	0	109.6	P148 V149 L151 L160 C162 L171 F194 M209 I218	P148-F196 CarbonylContact C-O 3.53Å; P148-F196 WeakPolarHBondContact CA-O 3.12Å; V149-F196 HydrophobicContact CG2-CB 4.15Å; V149-F196 WeakPolarHBondContact CG2-O 3.36Å; V149-F196 PolarHBondContact N-O 2.99Å; V149-F196 PolarHBondContact O-N 2.94Å; L151-F196 HydrophobicContact CD1-CD2 4.1Å; L151-F196 HydrophobicContact CD1-CG 4.43Å; L151-F196 HydrophobicContact CG-CD2 4.34Å; L160-F196 HydrophobicContact CB-CE2 3.89Å; L160-F196 HydrophobicContact CB-CZ 4.02Å; L160-F196 WeakPolarHBondContact O-CE2 3.14Å; C162-F196 WeakPolarHBondContact SG-CE1 3.33Å; C162-F196 VanDerWaalsContact SG-CZ 3.55Å; L171-F196 HydrophobicContact CD1-CE1 4.05Å; L171-F196 HydrophobicContact CD1-CZ 3.78Å; F194-F196 WeakPolarHBondContact O-CD2 3.33Å; F194-F196 WeakPolarHBondContact O-CE2 3.5Å; F196-M209 CarbonylContact C-O 3.6Å; F196-M209 WeakPolarHBondContact CA-O 3.18Å; F196-M209 WeakPolarHBondContact CB-O 3.46Å; F196-I218 HydrophobicContact CD1-CD1 3.75Å; F196-I218 HydrophobicContact CD1-CG1 3.97Å; F196-I218 HydrophobicContact CE1-CD1 3.55Å; F196-I218 HydrophobicContact CE1-CG1 3.66Å; F196-I218 HydrophobicContact CG-CD1 4.34Å; F196-I218 HydrophobicContact CZ-CD1 4.02Å; F196-I218 HydrophobicContact CZ-CG1 4.47Å
197	Y	96.2	Very high	90.4	Very high	14 Å²	14	54.9 Å²	54.9	6%	0.055	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.2	114.5	165.2	-64.6	-75.1	0	0	0	109.5	F88 L145 P148 L208 M209 A211	F88-Y197 HydrophobicContact CE1-CE1 4.34Å; F88-Y197 WeakPolarHBondContact CZ-OH 3.39Å; L145-Y197 HydrophobicContact CB-CD1 3.86Å; L145-Y197 HydrophobicContact CB-CD2 4.25Å; L145-Y197 HydrophobicContact CB-CE1 4Å; L145-Y197 HydrophobicContact CB-CE2 4.37Å; L145-Y197 HydrophobicContact CB-CG 3.98Å; L145-Y197 HydrophobicContact CD1-CE1 4.25Å; L145-Y197 HydrophobicContact CD1-CE2 3.97Å; L145-Y197 VanDerWaalsContact O-CB 3.29Å; L145-Y197 WeakPolarHBondContact O-CB 3.37Å; P148-Y197 HydrophobicContact CB-CD1 4.13Å; P148-Y197 HydrophobicContact CB-CE1 4.07Å; P148-Y197 HydrophobicContact CG-CD1 4.12Å; P148-Y197 HydrophobicContact CG-CE1 3.87Å; Y197-L208 WeakPolarHBondContact O-CA 3.49Å; Y197-M209 HydrophobicContact CD2-CE 3.77Å; Y197-M209 HydrophobicContact CG-CE 4.38Å; Y197-M209 PolarHBondContact N-O 3.04Å; Y197-M209 PolarHBondContact O-N 3.11Å; Y197-A211 HydrophobicContact CD2-CB 4.02Å; Y197-A211 HydrophobicContact CE2-CB 3.62Å
198	K	95.9	Very high	91.2	Very high	30 Å²	30	54.4 Å²	54.4	13%	0.13	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.5	115.6	170.1	-179.2	176.1	170.8	-74.3	0	109.1	M133 G146 Q147 V149 D200 S206 T207 L208 I243	M133-K198 HydrophobicContact CE-CD 3.93Å; M133-K198 HydrophobicContact SD-CD 3.72Å; G146-K198 CarbonylContact C-O 3.6Å; Q147-K198 PolarHBondContact N-O 2.89Å; Q147-K198 PolarHBondContact O-N 2.86Å; V149-K198 HydrophobicContact CG1-CB 4.14Å; V149-K198 HydrophobicContact CG2-CB 4.02Å; K198-D200 WeakPolarHBondContact CE-OD1 3.29Å; K198-D200 IonicContact NZ-OD1 3.36Å; K198-D200 PolarHBondContact NZ-OD1 3Å; K198-D200 IonicContact NZ-OD2 3.34Å; K198-D200 PolarHBondContact NZ-OD2 2.74Å; K198-S206 WeakPolarHBondContact CE-OG 3.24Å; K198-T207 WeakPolarHBondContact CA-O 3.22Å; K198-L208 HydrophobicContact CB-CD2 3.78Å; K198-L208 HydrophobicContact CD-CD2 4.48Å; K198-L208 HydrophobicContact CG-CD2 4.01Å; K198-I243 HydrophobicContact CD-CD1 4.41Å
199	R	93.4	Very high	91.8	Very high	75 Å²	75	47.5 Å²	47.5	28%	0.283	25%	0.254	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	118.9	173.1	-174	-179	-61.8	118.6	-4.3	109.8	G144 L145 S206 T207	G144-R199 PolarHBondContact O-NE 3.44Å; G144-R199 PolarHBondContact O-NH2 2.84Å; L145-R199 PolarHBondContact O-NH2 3.38Å; R199-S206 CarbonylContact O-C 3.49Å; R199-S206 VanDerWaalsContact O-CA 3.22Å; R199-S206 WeakPolarHBondContact O-CA 3.41Å; R199-T207 PolarHBondContact N-O 3.3Å; R199-T207 PolarHBondContact O-N 3.12Å
200	D	91.4	Very high	92.1	Very high	88 Å²	88	45.9 Å²	45.9	47%	0.471	24%	0.243	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-84	128.9	175.4	-64.4	-35.6	0	0	0	110.1	K198 V205 S206	K198-D200 WeakPolarHBondContact CE-OD1 3.29Å; K198-D200 IonicContact NZ-OD1 3.36Å; K198-D200 PolarHBondContact NZ-OD1 3Å; K198-D200 IonicContact NZ-OD2 3.34Å; K198-D200 PolarHBondContact NZ-OD2 2.74Å; D200-V205 WeakPolarHBondContact CA-O 3.17Å; D200-S206 WeakPolarHBondContact OD1-CB 3.32Å; D200-S206 PolarHBondContact OD1-OG 2.89Å
201	T	81.3	Confident	92.2	Very high	94 Å²	94	39.6 Å²	39.6	58%	0.577	21%	0.21	S	C	*	.			trans	-117.2	8.4	-179.4	61.6	0	0	0	0	112.1	V205	T201-V205 PolarHBondContact N-O 3.46Å; T201-V205 PolarHBondContact OG1-O 2.87Å
202	G	74.9	Confident	92.1	Very high	43 Å²	43	40.7 Å²	40.7	44%	0.443	22%	0.216	S	C	.	.	S	Bend	trans	179.3	-173.1	-179	0	0	0	0	0	110.6	N204	G202-N204 VanDerWaalsContact C-N 3.28Å; G202-N204 PolarHBondContact O-N 2.53Å; G202-N204 VanDerWaalsContact O-N 3.11Å
203	L	73.3	Confident	92.1	Very high	169 Å²	169	39.2 Å²	39.2	89%	0.885	21%	0.212	S	C	*	.	S	Bend	trans	-54.1	-39.2	-169.3	-165.6	74.1	0	0	0	114.3
204	N	80.6	Confident	91.8	Very high	62 Å²	62	40.4 Å²	40.4	33%	0.332	23%	0.226	S	C	.	.	S	Bend	trans	-146.4	23	177.2	-66.8	-64.5	0	0	0	111.8	G202 S242 I243 Q244	G202-N204 VanDerWaalsContact C-N 3.28Å; G202-N204 PolarHBondContact O-N 2.53Å; G202-N204 VanDerWaalsContact O-N 3.11Å; N204-S242 WeakPolarHBondContact O-CA 3.41Å; N204-S242 PolarHBondContact O-OG 3.35Å; N204-I243 PolarHBondContact O-N 3.19Å; N204-I243 VanDerWaalsContact O-N 3.12Å; N204-Q244 HydrophobicContact CB-CG 4.26Å
205	V	91.8	Very high	91.6	Very high	58 Å²	58	45.1 Å²	45.1	35%	0.352	25%	0.252	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	123.9	-177.8	-179.5	0	0	0	0	108.3	D200 T201 T240 F241	D200-V205 WeakPolarHBondContact CA-O 3.17Å; T201-V205 PolarHBondContact N-O 3.46Å; T201-V205 PolarHBondContact OG1-O 2.87Å; V205-T240 HydrophobicContact CG1-CG2 4.2Å; V205-F241 WeakPolarHBondContact CA-O 3.49Å
206	S	95.4	Very high	91.6	Very high	1 Å²	1	47.1 Å²	47.1	1%	0.007	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.7	154.6	-174.6	-40.4	0	0	0	0	111.5	K198 R199 D200 T240 F241	K198-S206 WeakPolarHBondContact CE-OG 3.24Å; R199-S206 CarbonylContact O-C 3.49Å; R199-S206 VanDerWaalsContact O-CA 3.22Å; R199-S206 WeakPolarHBondContact O-CA 3.41Å; D200-S206 WeakPolarHBondContact OD1-CB 3.32Å; D200-S206 PolarHBondContact OD1-OG 2.89Å; S206-T240 WeakPolarHBondContact O-CA 3.44Å; S206-F241 PolarHBondContact N-O 3Å; S206-F241 PolarHBondContact O-N 2.97Å
207	T	96.5	Very high	91.6	Very high	16 Å²	16	48 Å²	48	10%	0.098	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	151.8	161.1	57	0	0	0	0	109.1	K198 R199 T240	K198-T207 WeakPolarHBondContact CA-O 3.22Å; R199-T207 PolarHBondContact N-O 3.3Å; R199-T207 PolarHBondContact O-N 3.12Å; T207-T240 HydrophobicContact CG2-CG2 4.32Å
208	L	97.6	Very high	91.7	Very high	5 Å²	5	47.5 Å²	47.5	3%	0.026	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	99	-179.7	-66.4	165.1	0	0	0	108.3	V149 L151 Y197 K198 Y217 I218 F241 I243	V149-L208 HydrophobicContact CG2-CD2 4.21Å; L151-L208 HydrophobicContact CD1-CD1 3.89Å; L151-L208 HydrophobicContact CD1-CD2 4.26Å; Y197-L208 WeakPolarHBondContact O-CA 3.49Å; K198-L208 HydrophobicContact CB-CD2 3.78Å; K198-L208 HydrophobicContact CD-CD2 4.48Å; K198-L208 HydrophobicContact CG-CD2 4.01Å; L208-Y217 CarbonylContact O-C 3.5Å; L208-Y217 VanDerWaalsContact O-CA 3.27Å; L208-Y217 WeakPolarHBondContact O-CA 3.44Å; L208-I218 HydrophobicContact CB-CB 4.16Å; L208-I218 HydrophobicContact CB-CD1 3.86Å; L208-I218 HydrophobicContact CB-CG1 4.11Å; L208-I218 HydrophobicContact CD1-CD1 3.97Å; L208-I218 PolarHBondContact O-N 3.46Å; L208-F241 HydrophobicContact CD1-CD2 4.43Å; L208-I243 HydrophobicContact CD1-CD1 4.01Å; L208-I243 HydrophobicContact CD2-CD1 4.32Å; L208-I243 HydrophobicContact CG-CD1 4.33Å
209	M	97.4	Very high	91.8	Very high	8 Å²	8	46.1 Å²	46.1	4%	0.039	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.4	140.1	179.7	-172	179	67.9	0	0	110.2	L145 F196 Y197 W216 Y217	L145-M209 HydrophobicContact CD2-CE 3.91Å; F196-M209 CarbonylContact C-O 3.6Å; F196-M209 WeakPolarHBondContact CA-O 3.18Å; F196-M209 WeakPolarHBondContact CB-O 3.46Å; Y197-M209 HydrophobicContact CD2-CE 3.77Å; Y197-M209 HydrophobicContact CG-CE 4.38Å; Y197-M209 PolarHBondContact N-O 3.04Å; Y197-M209 PolarHBondContact O-N 3.11Å; M209-W216 CarbonylContact C-O 3.51Å; M209-W216 WeakPolarHBondContact CA-O 3.47Å; M209-W216 WeakPolarHBondContact CG-O 3.25Å; M209-Y217 HydrophobicContact CB-CD1 3.75Å; M209-Y217 HydrophobicContact CB-CE1 3.68Å; M209-Y217 HydrophobicContact CG-CD1 4.15Å; M209-Y217 HydrophobicContact CG-CE1 3.88Å; M209-Y217 HydrophobicContact SD-CE1 4.14Å
210	S	97.1	Very high	92.1	Very high	0 Å²	0	42.5 Å²	42.5	0%	0	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-64.5	136	173.2	-178.5	0	0	0	0	111.2	C162 N212 F213 W216	C162-S210 VanDerWaalsContact SG-CB 3.58Å; C162-S210 PolarHBondContact SG-OG 2.78Å; S210-N212 PolarHBondContact OG-N 3.2Å; S210-F213 PolarHBondContact OG-N 3.01Å; S210-W216 PolarHBondContact N-O 2.84Å
211	A	93.9	Very high	92.4	Very high	3 Å²	3	38.9 Å²	38.9	3%	0.025	22%	0.223	C	C	.	.	S	Bend	trans	-76.2	-26.5	170	0	0	0	0	0	112.3	R192 L195 Y197	R192-A211 HydrophobicContact CG-CB 4.34Å; R192-A211 VanDerWaalsContact CZ-O 3.29Å; R192-A211 PolarHBondContact NE-O 2.82Å; R192-A211 PolarHBondContact NH2-O 2.74Å; L195-A211 HydrophobicContact CB-CB 3.56Å; L195-A211 VanDerWaalsContact O-CB 3.28Å; L195-A211 WeakPolarHBondContact O-CB 3.41Å; L195-A211 PolarHBondContact O-N 2.92Å; Y197-A211 HydrophobicContact CD2-CB 4.02Å; Y197-A211 HydrophobicContact CE2-CB 3.62Å
212	N	93.1	Very high	93.1	Very high	64 Å²	64	37.9 Å²	37.9	34%	0.342	22%	0.217	S	C	.	.	S	Bend	trans	-84.2	-30.5	179.4	-158.7	31.2	0	0	0	112.4	R192 S210	R192-N212 HydrophobicContact CG-CB 4.41Å; S210-N212 PolarHBondContact OG-N 3.2Å
213	F	94.4	Very high	94.1	Very high	36 Å²	36	39.7 Å²	39.7	16%	0.158	22%	0.217	C	C	.	.	S	Bend	trans	-124.9	88.9	178.6	-55.7	-76.8	0	0	0	110.8	C162 K164 P169 S210 W216	C162-F213 HydrophobicContact CB-CD2 3.58Å; C162-F213 HydrophobicContact CB-CE2 3.66Å; K164-F213 HydrophobicContact CB-CE1 4.03Å; K164-F213 HydrophobicContact CB-CZ 3.85Å; P169-F213 HydrophobicContact CB-CB 4.01Å; P169-F213 HydrophobicContact CB-CD1 4.14Å; P169-F213 HydrophobicContact CB-CD2 3.85Å; P169-F213 HydrophobicContact CB-CE2 4.35Å; P169-F213 HydrophobicContact CB-CG 3.72Å; P169-F213 HydrophobicContact CG-CB 3.75Å; P169-F213 HydrophobicContact CG-CD1 3.58Å; P169-F213 HydrophobicContact CG-CD2 4.2Å; P169-F213 HydrophobicContact CG-CE1 4.22Å; P169-F213 HydrophobicContact CG-CG 3.56Å; S210-F213 PolarHBondContact OG-N 3.01Å; F213-W216 HydrophobicContact CB-CB 4.14Å; F213-W216 HydrophobicContact CB-CG 4.27Å; F213-W216 WeakPolarHBondContact O-CB 3.44Å; F213-W216 PolarHBondContact O-N 2.86Å
214	P	91.4	Very high	95.1	Very high	79 Å²	79	35 Å²	35	51%	0.513	19%	0.193	S	C	.	.	T	Hydrogen-bonded Turn	trans	-54.3	146	178.7	-26.4	35.1	0	0	0	112.6	W216	P214-W216 PolarHBondContact O-N 3.39Å
215	N	93.2	Very high	95.8	Very high	103 Å²	103	34.9 Å²	34.9	55%	0.551	20%	0.197	S	C	*	.	T	Hydrogen-bonded Turn	trans	65.3	8	-176.7	-50.6	-45.4	0	0	0	115.6	Y217	N215-Y217 WeakPolarHBondContact O-CD2 3.43Å; N215-Y217 VanDerWaalsContact O-CE2 3.3Å; N215-Y217 WeakPolarHBondContact O-CE2 3.41Å
216	W	97.3	Very high	96.1	Very high	42 Å²	42	38.2 Å²	38.2	16%	0.159	20%	0.203	C	C	.	.			trans	-104.5	129.8	169.3	-72.6	80.9	0	0	0	110.5	K168 P169 M209 S210 F213 P214 M230 C231 Q232	K168-W216 HydrophobicContact CB-CH2 4.28Å; K168-W216 HydrophobicContact CG-CH2 4.36Å; P169-W216 HydrophobicContact CB-CD2 3.93Å; P169-W216 HydrophobicContact CB-CE3 4.12Å; P169-W216 HydrophobicContact CB-CG 4.1Å; P169-W216 VanDerWaalsContact CD-CE2 3.42Å; P169-W216 VanDerWaalsContact CD-CZ2 3.44Å; P169-W216 HydrophobicContact CG-CD2 3.69Å; P169-W216 HydrophobicContact CG-CE3 4.3Å; P169-W216 HydrophobicContact CG-CG 3.83Å; P169-W216 HydrophobicContact CG-CZ2 4.2Å; M209-W216 CarbonylContact C-O 3.51Å; M209-W216 WeakPolarHBondContact CA-O 3.47Å; M209-W216 WeakPolarHBondContact CG-O 3.25Å; S210-W216 PolarHBondContact N-O 2.84Å; F213-W216 HydrophobicContact CB-CB 4.14Å; F213-W216 HydrophobicContact CB-CG 4.27Å; F213-W216 WeakPolarHBondContact O-CB 3.44Å; F213-W216 PolarHBondContact O-N 2.86Å; P214-W216 PolarHBondContact O-N 3.39Å; W216-M230 HydrophobicContact CB-CE 3.83Å; W216-M230 HydrophobicContact CE3-CB 3.74Å; W216-M230 HydrophobicContact CZ3-CB 4.33Å; W216-M230 WeakPolarHBondContact O-CE 3.33Å; W216-C231 WeakPolarHBondContact CA-O 3.22Å; W216-Q232 HydrophobicContact CD2-CG 3.76Å; W216-Q232 VanDerWaalsContact CE2-CG 3.44Å; W216-Q232 HydrophobicContact CE3-CG 4.21Å; W216-Q232 HydrophobicContact CG-CG 4.26Å; W216-Q232 HydrophobicContact CH2-CG 4.16Å; W216-Q232 HydrophobicContact CZ2-CG 3.65Å; W216-Q232 HydrophobicContact CZ3-CG 4.42Å
217	Y	97.8	Very high	96.2	Very high	17 Å²	17	40.5 Å²	40.5	7%	0.067	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	146.8	-174.2	-56.2	-94.9	0	0	0	110.7	L208 M209 N215 S219 M230 C231	L208-Y217 CarbonylContact O-C 3.5Å; L208-Y217 VanDerWaalsContact O-CA 3.27Å; L208-Y217 WeakPolarHBondContact O-CA 3.44Å; M209-Y217 HydrophobicContact CB-CD1 3.75Å; M209-Y217 HydrophobicContact CB-CE1 3.68Å; M209-Y217 HydrophobicContact CG-CD1 4.15Å; M209-Y217 HydrophobicContact CG-CE1 3.88Å; M209-Y217 HydrophobicContact SD-CE1 4.14Å; N215-Y217 WeakPolarHBondContact O-CD2 3.43Å; N215-Y217 VanDerWaalsContact O-CE2 3.3Å; N215-Y217 WeakPolarHBondContact O-CE2 3.41Å; Y217-S219 PolarHBondContact O-N 2.88Å; Y217-M230 CarbonylContact O-C 3.5Å; Y217-M230 VanDerWaalsContact O-CA 3.25Å; Y217-M230 WeakPolarHBondContact O-CA 3.44Å; Y217-C231 PolarHBondContact N-O 2.88Å; Y217-C231 PolarHBondContact O-N 3.22Å
218	I	98.4	Very high	96.3	Very high	5 Å²	5	40.4 Å²	40.4	3%	0.026	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-58.2	137.3	162.7	-60.2	179.4	0	0	0	107.9	L151 L160 L171 F196 L208 V228 A229 M230 F241	L151-I218 HydrophobicContact CD1-CD1 3.94Å; L160-I218 HydrophobicContact CD2-CD1 3.74Å; L171-I218 HydrophobicContact CD1-CD1 4.41Å; L171-I218 HydrophobicContact CD1-CG1 4.21Å; L171-I218 HydrophobicContact CD2-CG1 4.35Å; L171-I218 HydrophobicContact CD2-CG2 4.13Å; F196-I218 HydrophobicContact CD1-CD1 3.75Å; F196-I218 HydrophobicContact CD1-CG1 3.97Å; F196-I218 HydrophobicContact CE1-CD1 3.55Å; F196-I218 HydrophobicContact CE1-CG1 3.66Å; F196-I218 HydrophobicContact CG-CD1 4.34Å; F196-I218 HydrophobicContact CZ-CD1 4.02Å; F196-I218 HydrophobicContact CZ-CG1 4.47Å; L208-I218 HydrophobicContact CB-CB 4.16Å; L208-I218 HydrophobicContact CB-CD1 3.86Å; L208-I218 HydrophobicContact CB-CG1 4.11Å; L208-I218 HydrophobicContact CD1-CD1 3.97Å; L208-I218 PolarHBondContact O-N 3.46Å; I218-V228 HydrophobicContact CG2-CG1 3.51Å; I218-A229 CarbonylContact C-O 3.56Å; I218-M230 HydrophobicContact CG1-SD 3.99Å; I218-F241 HydrophobicContact CB-CE2 4.27Å; I218-F241 HydrophobicContact CB-CZ 4.49Å; I218-F241 HydrophobicContact CG2-CE2 4Å; I218-F241 HydrophobicContact CG2-CZ 3.75Å; I218-F241 WeakPolarHBondContact O-CE2 3.49Å
219	S	98.3	Very high	96.2	Very high	0 Å²	0	41.6 Å²	41.6	0%	0	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.2	157	-172.9	72.5	0	0	0	0	113	Y217 V228 A229 C231 R237 Y238	Y217-S219 PolarHBondContact O-N 2.88Å; S219-V228 WeakPolarHBondContact O-CA 3.37Å; S219-V228 WeakPolarHBondContact O-CG1 3.46Å; S219-A229 WeakPolarHBondContact CA-O 3.35Å; S219-A229 PolarHBondContact N-O 2.87Å; S219-A229 PolarHBondContact O-N 3.09Å; S219-A229 VanDerWaalsContact O-O 3.12Å; S219-A229 PolarHBondContact OG-O 3.19Å; S219-C231 WeakPolarHBondContact CB-SG 3.4Å; S219-R237 PolarHBondContact OG-NE 2.82Å; S219-Y238 CarbonylContact C-O 3.55Å; S219-Y238 WeakPolarHBondContact CA-O 3.39Å; S219-Y238 WeakPolarHBondContact CB-O 3.35Å
220	T	98.3	Very high	96.2	Very high	0 Å²	0	41.9 Å²	41.9	0%	0	23%	0.229	C	C	.	.	B	Isolated β-bridge	trans	-118	146.9	172.5	64.3	0	0	0	0	110.1	D100 R104 A117 V228 R237 Y238 F241	D100-T220 HydrophobicContact CB-CG2 3.96Å; D100-T220 PolarHBondContact OD2-OG1 2.79Å; R104-T220 PolarHBondContact NH2-OG1 2.89Å; A117-T220 HydrophobicContact CB-CG2 3.57Å; T220-V228 HydrophobicContact CG2-CG2 4.32Å; T220-R237 WeakPolarHBondContact O-CB 3.11Å; T220-Y238 PolarHBondContact N-O 2.83Å; T220-Y238 PolarHBondContact O-N 2.82Å; T220-F241 HydrophobicContact CG2-CE1 3.91Å; T220-F241 HydrophobicContact CG2-CZ 4.03Å
221	A	97.7	Very high	96.2	Very high	11 Å²	11	42.1 Å²	42.1	9%	0.091	23%	0.231	C	C	.	.			trans	-70.4	163.6	178.2	0	0	0	0	0	111.3	R104 D223 R226	R104-A221 PolarHBondContact NH1-O 3.22Å; R104-A221 VanDerWaalsContact NH1-O 3.09Å; R104-A221 PolarHBondContact NH2-O 2.9Å; A221-D223 VanDerWaalsContact C-N 3.33Å; A221-D223 PolarHBondContact O-N 2.93Å; A221-R226 HydrophobicContact CB-CB 3.65Å; A221-R226 HydrophobicContact CB-CG 3.87Å
222	T	95.9	Very high	96.3	Very high	73 Å²	73	46.1 Å²	46.1	45%	0.448	25%	0.249	S	C	.	.	S	Bend	trans	-60.5	-43.9	172.2	49.6	0	0	0	0	111.7	R104 Y238	R104-T222 PolarHBondContact NH1-O 2.75Å; T222-Y238 HydrophobicContact CG2-CE2 4.5Å
223	D	96.3	Very high	96.2	Very high	82 Å²	82	49.2 Å²	49.2	44%	0.439	26%	0.262	S	S	.	.	S	Bend	trans	-70.4	147	-179.5	-56.5	-12.1	0	0	0	112.2	R104 A221 R226	R104-D223 VanDerWaalsContact NH1-C 3.27Å; R104-D223 PolarHBondContact NH1-O 2.73Å; A221-D223 VanDerWaalsContact C-N 3.33Å; A221-D223 PolarHBondContact O-N 2.93Å; D223-R226 HydrophobicContact CB-CG 3.72Å; D223-R226 IonicContact OD2-CZ 2.65Å; D223-R226 IonicContact OD2-NE 2.78Å; D223-R226 PolarHBondContact OD2-NE 3.25Å; D223-R226 IonicContact OD2-NH2 3.75Å; D223-R226 PolarHBondContact OD2-NH2 2.89Å
224	N	95.3	Very high	96.1	Very high	71 Å²	71	53 Å²	53	38%	0.38	29%	0.292	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.4	152.2	174	-167.8	42.8	0	0	0	112.1	R104 V118 M119 R226	R104-N224 WeakPolarHBondContact CD-OD1 3.4Å; V118-N224 WeakPolarHBondContact CA-OD1 3.34Å; M119-N224 PolarHBondContact N-OD1 2.86Å; N224-R226 VanDerWaalsContact C-N 3.29Å; N224-R226 PolarHBondContact O-N 3.2Å
225	S	95.4	Very high	96.2	Very high	59 Å²	59	51 Å²	51	41%	0.413	28%	0.282	S	S	.	.	T	Hydrogen-bonded Turn	trans	59.6	35.8	177.1	-48.7	0	0	0	0	114.1	A117	A117-S225 WeakPolarHBondContact O-CA 3.27Å; A117-S225 PolarHBondContact O-N 2.71Å
226	R	97.4	Very high	96.3	Very high	127 Å²	127	51.3 Å²	51.3	48%	0.479	29%	0.292	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.6	153.1	172.6	-64.1	-59	-166.6	172.5	1.9	111.4	L116 A117 A221 D223 N224	L116-R226 WeakPolarHBondContact CA-O 3.45Å; A117-R226 PolarHBondContact N-O 3.16Å; A221-R226 HydrophobicContact CB-CB 3.65Å; A221-R226 HydrophobicContact CB-CG 3.87Å; D223-R226 HydrophobicContact CB-CG 3.72Å; D223-R226 IonicContact OD2-CZ 2.65Å; D223-R226 IonicContact OD2-NE 2.78Å; D223-R226 PolarHBondContact OD2-NE 3.25Å; D223-R226 IonicContact OD2-NH2 3.75Å; D223-R226 PolarHBondContact OD2-NH2 2.89Å; N224-R226 VanDerWaalsContact C-N 3.29Å; N224-R226 PolarHBondContact O-N 3.2Å
227	P	97.3	Very high	96.3	Very high	50 Å²	50	52.8 Å²	52.8	33%	0.325	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-56.7	140.2	173.5	-25.9	35	0	0	0	113.1	L115 L116	L115-P227 CarbonylContact O-C 3.54Å; L115-P227 WeakPolarHBondContact O-CA 3.18Å; L116-P227 HydrophobicContact CD2-CB 4.29Å; L116-P227 HydrophobicContact CD2-CG 3.88Å
228	V	98	Very high	96.2	Very high	13 Å²	13	55.5 Å²	55.5	8%	0.079	31%	0.309	C	S	.	.	P	Polyproline II helix	trans	-66.2	134.7	162.7	-174.1	0	0	0	0	107.3	L106 L115 L171 I218 S219 T220	L106-V228 HydrophobicContact CD2-CG2 3.7Å; L115-V228 HydrophobicContact CB-CB 4.15Å; L115-V228 HydrophobicContact CB-CG2 3.77Å; L115-V228 WeakPolarHBondContact O-CG2 3.49Å; L115-V228 PolarHBondContact O-N 3.45Å; L171-V228 HydrophobicContact CD2-CB 4.3Å; L171-V228 HydrophobicContact CD2-CG1 3.65Å; I218-V228 HydrophobicContact CG2-CG1 3.51Å; S219-V228 WeakPolarHBondContact O-CA 3.37Å; S219-V228 WeakPolarHBondContact O-CG1 3.46Å; T220-V228 HydrophobicContact CG2-CG2 4.32Å
229	A	97.3	Very high	96.2	Very high	31 Å²	31	57.5 Å²	57.5	26%	0.256	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.4	176.3	-174.9	0	0	0	0	0	111.1	I218 S219	I218-A229 CarbonylContact C-O 3.56Å; S219-A229 WeakPolarHBondContact CA-O 3.35Å; S219-A229 PolarHBondContact N-O 2.87Å; S219-A229 PolarHBondContact O-N 3.09Å; S219-A229 VanDerWaalsContact O-O 3.12Å; S219-A229 PolarHBondContact OG-O 3.19Å
230	M	97.4	Very high	96.1	Very high	14 Å²	14	60 Å²	60	7%	0.069	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.6	147.6	171.8	-58.4	-60.4	-73.7	0	0	111.4	L171 W216 Y217 I218	L171-M230 HydrophobicContact CB-CG 3.84Å; L171-M230 HydrophobicContact CB-SD 4.05Å; L171-M230 HydrophobicContact CD1-SD 3.86Å; L171-M230 HydrophobicContact CG-SD 4.43Å; W216-M230 HydrophobicContact CB-CE 3.83Å; W216-M230 HydrophobicContact CE3-CB 3.74Å; W216-M230 HydrophobicContact CZ3-CB 4.33Å; W216-M230 WeakPolarHBondContact O-CE 3.33Å; Y217-M230 CarbonylContact O-C 3.5Å; Y217-M230 VanDerWaalsContact O-CA 3.25Å; Y217-M230 WeakPolarHBondContact O-CA 3.44Å; I218-M230 HydrophobicContact CG1-SD 3.99Å
231	C	96.9	Very high	96	Very high	4 Å²	4	60.2 Å²	60.2	3%	0.027	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.2	161.3	168.1	83	0	0	0	0	112.9	W216 Y217 S219 A235 R239	W216-C231 WeakPolarHBondContact CA-O 3.22Å; Y217-C231 PolarHBondContact N-O 2.88Å; Y217-C231 PolarHBondContact O-N 3.22Å; S219-C231 WeakPolarHBondContact CB-SG 3.4Å; C231-A235 HydrophobicContact CB-CB 3.8Å; C231-R239 VanDerWaalsContact SG-CG 3.59Å
232	Q	96.1	Very high	95.9	Very high	87 Å²	87	61.1 Å²	61.1	41%	0.407	34%	0.338	S	S	.	.			trans	-86.4	170.7	168.1	-62.3	-178.9	-66.1	0	0	110.9	W216 S234 A235	W216-Q232 HydrophobicContact CD2-CG 3.76Å; W216-Q232 VanDerWaalsContact CE2-CG 3.44Å; W216-Q232 HydrophobicContact CE3-CG 4.21Å; W216-Q232 HydrophobicContact CG-CG 4.26Å; W216-Q232 HydrophobicContact CH2-CG 4.16Å; W216-Q232 HydrophobicContact CZ2-CG 3.65Å; W216-Q232 HydrophobicContact CZ3-CG 4.42Å; Q232-S234 VanDerWaalsContact C-N 3.3Å; Q232-S234 PolarHBondContact O-N 3.21Å; Q232-A235 WeakPolarHBondContact O-CB 3.48Å; Q232-A235 PolarHBondContact O-N 3.45Å
233	E	91.3	Very high	95.9	Very high	130 Å²	130	58.1 Å²	58.1	61%	0.607	32%	0.319	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.6	-34.2	-178.5	178.4	134.9	-113.5	0	0	114.7	A235 R239	E233-A235 PolarHBondContact O-N 2.88Å; E233-R239 VanDerWaalsContact CA-CZ 3.49Å; E233-R239 IonicContact OE1-CZ 2.66Å; E233-R239 IonicContact OE1-NH1 3.78Å; E233-R239 PolarHBondContact OE1-NH1 3.49Å; E233-R239 IonicContact OE1-NH2 3.2Å; E233-R239 PolarHBondContact OE1-NH2 2.69Å
234	S	91.4	Very high	95.7	Very high	115 Å²	115	58.3 Å²	58.3	80%	0.804	32%	0.318	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.8	-10	179.6	54.5	0	0	0	0	114.2	Q232	Q232-S234 VanDerWaalsContact C-N 3.3Å; Q232-S234 PolarHBondContact O-N 3.21Å
235	A	94.1	Very high	95.6	Very high	37 Å²	37	61.8 Å²	61.8	31%	0.306	33%	0.325	S	S	.	.	S	Bend	trans	-78.1	142	-177.5	0	0	0	0	0	111.9	C231 Q232 E233 R237	C231-A235 HydrophobicContact CB-CB 3.8Å; Q232-A235 WeakPolarHBondContact O-CB 3.48Å; Q232-A235 PolarHBondContact O-N 3.45Å; E233-A235 PolarHBondContact O-N 2.88Å; A235-R237 HydrophobicContact CB-CG 4.42Å; A235-R237 PolarHBondContact O-N 3.22Å
236	S	94.8	Very high	95.2	Very high	109 Å²	109	62.4 Å²	62.4	76%	0.762	32%	0.322	S	S	*	.	S	Bend	trans	-77.1	72.5	174	-166.7	0	0	0	0	111.3
237	R	96.9	Very high	93.9	Very high	74 Å²	74	65.6 Å²	65.6	28%	0.279	36%	0.363	S	S	.	.	S	Bend	trans	-145.6	154.8	-178.1	-62.7	-177	71.2	88.7	-2.4	110.4	S219 T220 A235	S219-R237 PolarHBondContact OG-NE 2.82Å; T220-R237 WeakPolarHBondContact O-CB 3.11Å; A235-R237 HydrophobicContact CB-CG 4.42Å; A235-R237 PolarHBondContact O-N 3.22Å
238	Y	96.9	Very high	93.7	Very high	73 Å²	73	66.4 Å²	66.4	29%	0.286	37%	0.365	S	S	.	.	B	Isolated β-bridge	trans	-83.8	128.6	175.5	-56.2	-70.1	0	0	0	110.1	Q102 S219 T220 T222	Q102-Y238 HydrophobicContact CG-CD1 4.26Å; Q102-Y238 HydrophobicContact CG-CD2 3.77Å; Q102-Y238 HydrophobicContact CG-CE1 3.91Å; Q102-Y238 HydrophobicContact CG-CE2 3.34Å; Q102-Y238 HydrophobicContact CG-CG 4.2Å; Q102-Y238 VanDerWaalsContact CG-CZ 3.43Å; Q102-Y238 VanDerWaalsContact NE2-CE1 3.32Å; S219-Y238 CarbonylContact C-O 3.55Å; S219-Y238 WeakPolarHBondContact CA-O 3.39Å; S219-Y238 WeakPolarHBondContact CB-O 3.35Å; T220-Y238 PolarHBondContact N-O 2.83Å; T220-Y238 PolarHBondContact O-N 2.82Å; T222-Y238 HydrophobicContact CG2-CE2 4.5Å
239	R	96.6	Very high	93.5	Very high	48 Å²	48	69.2 Å²	69.2	18%	0.181	38%	0.381	C	S	.	.			trans	-114.5	-6.9	-178.5	-63.1	-179.7	-70	145.6	1.4	113.4	C231 E233 F241	C231-R239 VanDerWaalsContact SG-CG 3.59Å; E233-R239 VanDerWaalsContact CA-CZ 3.49Å; E233-R239 IonicContact OE1-CZ 2.66Å; E233-R239 IonicContact OE1-NH1 3.78Å; E233-R239 PolarHBondContact OE1-NH1 3.49Å; E233-R239 IonicContact OE1-NH2 3.2Å; E233-R239 PolarHBondContact OE1-NH2 2.69Å; R239-F241 WeakPolarHBondContact O-CD2 3.48Å; R239-F241 WeakPolarHBondContact O-CE2 3.45Å
240	T	96.1	Very high	93.3	Very high	53 Å²	53	71.3 Å²	71.3	33%	0.325	39%	0.387	S	S	.	.			trans	-94.9	138.7	-177.7	52.4	0	0	0	0	110.2	D100 G101 V205 S206 T207	D100-T240 CarbonylContact C-O 3.55Å; G101-T240 PolarHBondContact N-O 3.09Å; V205-T240 HydrophobicContact CG1-CG2 4.2Å; S206-T240 WeakPolarHBondContact O-CA 3.44Å; T207-T240 HydrophobicContact CG2-CG2 4.32Å
241	F	96.9	Very high	93.1	Very high	3 Å²	3	74.7 Å²	74.7	1%	0.013	41%	0.406	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	139	178.3	-63.7	-90.8	0	0	0	109.4	V98 T99 D100 V205 S206 L208 I218 T220 R239 I243	V98-F241 HydrophobicContact CG2-CB 4.16Å; V98-F241 HydrophobicContact CG2-CD1 3.85Å; V98-F241 HydrophobicContact CG2-CG 4.35Å; T99-F241 CarbonylContact O-C 3.5Å; T99-F241 VanDerWaalsContact O-CA 3.24Å; T99-F241 WeakPolarHBondContact O-CA 3.21Å; D100-F241 HydrophobicContact CB-CD1 4.06Å; D100-F241 HydrophobicContact CB-CE1 3.95Å; V205-F241 WeakPolarHBondContact CA-O 3.49Å; S206-F241 PolarHBondContact N-O 3Å; S206-F241 PolarHBondContact O-N 2.97Å; L208-F241 HydrophobicContact CD1-CD2 4.43Å; I218-F241 HydrophobicContact CB-CE2 4.27Å; I218-F241 HydrophobicContact CB-CZ 4.49Å; I218-F241 HydrophobicContact CG2-CE2 4Å; I218-F241 HydrophobicContact CG2-CZ 3.75Å; I218-F241 WeakPolarHBondContact O-CE2 3.49Å; T220-F241 HydrophobicContact CG2-CE1 3.91Å; T220-F241 HydrophobicContact CG2-CZ 4.03Å; R239-F241 WeakPolarHBondContact O-CD2 3.48Å; R239-F241 WeakPolarHBondContact O-CE2 3.45Å; F241-I243 HydrophobicContact CB-CD1 4.3Å; F241-I243 HydrophobicContact CB-CG1 4Å
242	S	96.1	Very high	92.8	Very high	31 Å²	31	79.1 Å²	79.1	22%	0.217	43%	0.43	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.3	116.5	162.2	-165.5	0	0	0	0	109.2	V98 T99 N204	V98-S242 WeakPolarHBondContact CA-O 3.46Å; T99-S242 PolarHBondContact N-O 3.2Å; T99-S242 PolarHBondContact O-N 3.21Å; N204-S242 WeakPolarHBondContact O-CA 3.41Å; N204-S242 PolarHBondContact O-OG 3.35Å
243	I	95.3	Very high	92.6	Very high	10 Å²	10	78.6 Å²	78.6	5%	0.051	43%	0.431	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	119.9	-178.1	-56.5	177.7	0	0	0	108.2	C96 S97 V98 M133 K198 N204 L208 F241	C96-I243 HydrophobicContact CB-CG2 3.88Å; S97-I243 WeakPolarHBondContact O-CA 3.34Å; V98-I243 HydrophobicContact CG2-CG1 4.25Å; M133-I243 HydrophobicContact CE-CD1 4.07Å; M133-I243 HydrophobicContact CE-CG2 3.65Å; K198-I243 HydrophobicContact CD-CD1 4.41Å; N204-I243 PolarHBondContact O-N 3.19Å; N204-I243 VanDerWaalsContact O-N 3.12Å; L208-I243 HydrophobicContact CD1-CD1 4.01Å; L208-I243 HydrophobicContact CD2-CD1 4.32Å; L208-I243 HydrophobicContact CG-CD1 4.33Å; F241-I243 HydrophobicContact CB-CD1 4.3Å; F241-I243 HydrophobicContact CB-CG1 4Å
244	Q	92.8	Very high	92.7	Very high	86 Å²	86	74.9 Å²	74.9	40%	0.402	42%	0.419	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126	119	-175.8	-67	-179.7	-21.6	0	0	110.6	C96 S97 N204 Q246	C96-Q244 CarbonylContact C-O 3.53Å; C96-Q244 WeakPolarHBondContact CA-O 3.48Å; C96-Q244 WeakPolarHBondContact CB-O 3.3Å; S97-Q244 PolarHBondContact N-O 2.8Å; S97-Q244 PolarHBondContact O-N 3.14Å; N204-Q244 HydrophobicContact CB-CG 4.26Å; Q244-Q246 PolarHBondContact O-N 3.33Å; Q244-Q246 PolarHBondContact O-NE2 2.74Å; Q244-Q246 VanDerWaalsContact O-NE2 3.16Å
245	R	92.4	Very high	92.8	Very high	144 Å²	144	71.8 Å²	71.8	54%	0.543	39%	0.389	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-55.6	132.6	171.1	-171.6	171.6	-167.6	153.5	5.9	109	E92 H94 H95	E92-R245 IonicContact OE1-NH1 3.45Å; E92-R245 PolarHBondContact OE1-NH1 3.41Å; E92-R245 IonicContact OE2-CZ 3.8Å; E92-R245 IonicContact OE2-NH1 3.21Å; E92-R245 PolarHBondContact OE2-NH1 2.84Å; E92-R245 IonicContact OE2-NH2 2.63Å; E92-R245 PolarHBondContact OE2-NH2 2.99Å; H94-R245 HydrophobicContact CB-CG 4.12Å; H95-R245 WeakPolarHBondContact O-CA 3.43Å
246	Q	88.1	Confident	92.7	Very high	72 Å²	72	74.8 Å²	74.8	34%	0.336	40%	0.396	S	S	.	.			trans	-98.9	139.2	174.8	-58.2	-63.2	-71.5	0	0	108.4	H95 Y130 Q244	H95-Q246 HydrophobicContact CB-CB 4.47Å; H95-Q246 PolarHBondContact O-N 2.87Å; Y130-Q246 HydrophobicContact CD1-CG 4.28Å; Y130-Q246 HydrophobicContact CE1-CG 4.32Å; Q244-Q246 PolarHBondContact O-N 3.33Å; Q244-Q246 PolarHBondContact O-NE2 2.74Å; Q244-Q246 VanDerWaalsContact O-NE2 3.16Å
247	S	69.6	Low	92.5	Very high	194 Å²	194	71.6 Å²	71.6	100%	1.357	36%	0.363	S	S	*	.			trans	-76.8	0	174.1	55.3	0	0	0	0	112.1

Retrieved 247 of 247 residues in 73.5 ms (Link to these results)

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