A0A096M3P4_POEFO Loading...

Dynein cytoplasmic 1 intermediate chain 1

AlphaFold DB , UniProt , Accession A0A096M3P4, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 462 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	34.6	Very low	32.5	Very low	238 Å²	238	150 Å²	150	100%	1.172	85%	0.849	S	S	*	*				0	107.7	0	-75.4	-176.1	-177.5	0	0	106.8
2	L	35.8	Very low	32.7	Very low	142 Å²	142	149.1 Å²	149.1	74%	0.743	84%	0.839	S	S	*	*			cis	-151.3	129.6	-4.3	-91	110.6	0	0	0	102.9
3	E	27.9	Very low	32.8	Very low	180 Å²	180	155.5 Å²	155.5	84%	0.841	84%	0.842	S	S	*	*				50	131.7	104.1	-69.9	-173.8	151.7	0	0	114
4	A	31.2	Very low	32.6	Very low	95 Å²	95	155.1 Å²	155.1	79%	0.785	84%	0.839	S	S	*	*			cis	-163.8	156.9	36.2	0	0	0	0	0	112.6
5	K	33.9	Very low	32.8	Very low	197 Å²	197	156.4 Å²	156.4	86%	0.857	84%	0.838	S	S	*	*			trans	-68.2	164.7	154	-75.2	-179	170.3	179.3	0	110
6	P	35.3	Very low	33	Very low	128 Å²	128	156.4 Å²	156.4	83%	0.831	84%	0.837	S	S	*	*				-138.1	155.5	95.7	29.2	-11.7	0	0	0	113.5
7	G	26.9	Very low	33.1	Very low	67 Å²	67	156.1 Å²	156.1	69%	0.691	84%	0.836	S	S	*	*			trans	-90.9	-145.5	165.4	0	0	0	0	0	111.4
8	P	46.8	Very low	33	Very low	125 Å²	125	156.7 Å²	156.7	81%	0.812	84%	0.839	S	S	*	*				-114.2	155.1	-97.3	36.5	-27	0	0	0	112.1
9	E	27.3	Very low	33.2	Very low	200 Å²	200	158.5 Å²	158.5	94%	0.935	84%	0.838	S	S	*	*			trans	-177.8	107.5	158.2	-107.7	165.8	-149.8	0	0	109.9
10	A	29.4	Very low	33.6	Very low	104 Å²	104	160 Å²	160	86%	0.86	84%	0.84	S	S	*	*			trans	-161.4	78	157.4	0	0	0	0	0	107.4
11	E	28.8	Very low	33.8	Very low	174 Å²	174	157.6 Å²	157.6	81%	0.813	84%	0.837	S	S	*	*			trans	-65.3	140.2	161.5	-81.8	-172.2	155.9	0	0	110.6
12	L	34.7	Very low	34.2	Very low	139 Å²	139	155.6 Å²	155.6	73%	0.728	82%	0.822	S	S	*	*			trans	59.9	95.2	138.1	-61.3	162.6	0	0	0	117.2
13	R	33.5	Very low	34.1	Very low	232 Å²	232	155.4 Å²	155.4	88%	0.875	82%	0.822	S	S	*	*				174.9	153.7	123.6	-92.5	153	-172.5	-168	2.6	109.1
14	D	30.1	Very low	34.7	Very low	151 Å²	151	150.9 Å²	150.9	81%	0.807	82%	0.824	S	S	*	*			trans	90.1	119.3	178.4	-47	-20.8	0	0	0	112.5
15	E	35.4	Very low	35.1	Very low	174 Å²	174	150.7 Å²	150.7	81%	0.813	82%	0.816	S	S	*	*			cis	-158.2	133.9	7.4	-109.8	173.3	172.4	0	0	107.8	D17	E15-D17 VanDerWaalsContact C-N 3.35Å; E15-D17 PolarHBondContact O-N 2.94Å
16	D	36.3	Very low	35.5	Very low	156 Å²	156	150.4 Å²	150.4	83%	0.834	82%	0.815	S	S	*	*			trans	-89.5	59.7	-171.4	-160.2	9.8	0	0	0	110.3
17	D	34.4	Very low	36.3	Very low	152 Å²	152	149.8 Å²	149.8	81%	0.813	81%	0.812	S	S	*	*			trans	-141.1	42.9	-170.9	-112.7	-6	0	0	0	114.8	E15	E15-D17 VanDerWaalsContact C-N 3.35Å; E15-D17 PolarHBondContact O-N 2.94Å
18	N	32.3	Very low	37.3	Very low	167 Å²	167	153 Å²	153	89%	0.893	82%	0.818	S	S	*	*			trans	-139.5	47.3	170.1	-139.2	2	0	0	0	113.7
19	K	36.7	Very low	37.5	Very low	190 Å²	190	154.8 Å²	154.8	83%	0.826	82%	0.82	S	S	*	*			trans	-93.8	141.5	161.4	-89.5	177.5	178.6	165.9	0	109.3
20	E	39.9	Very low	39.1	Very low	188 Å²	188	154.6 Å²	154.6	88%	0.879	81%	0.81	S	S	*	*	S	Bend	trans	93.8	61.9	172.8	-54.5	-170.8	171.5	0	0	116.9
21	S	39.1	Very low	40.6	Very low	111 Å²	111	157.8 Å²	157.8	78%	0.776	81%	0.807	S	S	*	*	S	Bend		174.2	94.5	119.3	57.9	0	0	0	0	110.5
22	K	41.5	Very low	42.2	Very low	196 Å²	196	152.9 Å²	152.9	85%	0.852	79%	0.786	S	S	*	*			trans	-177.2	139.9	149.1	-105.6	164.9	-175.5	-174.9	0	111.6
23	D	34.4	Very low	44.4	Very low	137 Å²	137	150.3 Å²	150.3	73%	0.733	78%	0.776	S	S	*	*			trans	83.3	64.4	155.9	-53.3	-18.5	0	0	0	118.1	S25	D23-S25 VanDerWaalsContact C-N 3.33Å
24	G	41.7	Very low	46.3	Very low	86 Å²	86	146.4 Å²	146.4	89%	0.887	77%	0.768	S	S	*	*			trans	-93.2	46.3	147.9	0	0	0	0	0	112.3
25	S	37.9	Very low	48.5	Very low	90 Å²	90	146.8 Å²	146.8	63%	0.629	77%	0.765	S	S	*	*			trans	-100.7	108.4	166.5	60.4	0	0	0	0	109	D23	D23-S25 VanDerWaalsContact C-N 3.33Å
26	F	43.9	Very low	50.6	Low	191 Å²	191	141.4 Å²	141.4	84%	0.838	74%	0.74	S	S	*	*			trans	-54.8	127	156.6	-67.4	-89.1	0	0	0	106.6	V28	F26-V28 PolarHBondContact O-N 3.01Å
27	P	50.6	Low	52.6	Low	116 Å²	116	140.1 Å²	140.1	75%	0.753	72%	0.723	S	S	*	*			trans	-59.3	115.5	177.6	21.9	-29.2	0	0	0	107.4	L29	P27-L29 PolarHBondContact O-N 2.84Å
28	V	49.1	Very low	54.7	Low	135 Å²	135	139 Å²	139	82%	0.818	71%	0.713	S	S	*	*			trans	-51.7	117.4	171.2	175.9	0	0	0	0	106.2	F26 R30	F26-V28 PolarHBondContact O-N 3.01Å; V28-R30 PolarHBondContact O-N 3.39Å
29	L	51.5	Low	57	Low	162 Å²	162	138.1 Å²	138.1	85%	0.848	70%	0.704	S	S	*	*			trans	-56	102.9	174.2	-76.9	165.9	0	0	0	107.2	P27 E31	P27-L29 PolarHBondContact O-N 2.84Å; L29-E31 PolarHBondContact O-N 3.06Å
30	R	59.5	Low	59.1	Low	196 Å²	196	132.1 Å²	132.1	74%	0.74	68%	0.68	S	S	*	*			trans	-60.6	108.4	171.8	-178.4	174.3	175.1	175.1	-5.5	106.3	V28 L32	V28-R30 PolarHBondContact O-N 3.39Å; R30-L32 VanDerWaalsContact C-N 3.34Å; R30-L32 PolarHBondContact O-N 2.64Å
31	E	60.4	Low	61	Low	170 Å²	170	128.2 Å²	128.2	79%	0.794	67%	0.665	S	S	*	*			trans	-61.9	102	171.5	-72.4	-173.7	162.4	0	0	107.3	L29 T33	L29-E31 PolarHBondContact O-N 3.06Å; E31-T33 PolarHBondContact O-N 3.33Å
32	L	64	Low	62.9	Low	72 Å²	72	130 Å²	130	38%	0.377	66%	0.66	S	S	.	*			trans	-54.6	132.1	175.7	-79.3	144.1	0	0	0	109.1	R30 E36 R37 I40	R30-L32 VanDerWaalsContact C-N 3.34Å; R30-L32 PolarHBondContact O-N 2.64Å; L32-E36 HydrophobicContact CB-CB 4.43Å; L32-E36 HydrophobicContact CD2-CB 3.79Å; L32-R37 HydrophobicContact CB-CG 3.93Å; L32-R37 PolarHBondContact O-NE 3.09Å; L32-I40 HydrophobicContact CD1-CD1 3.87Å; L32-I40 HydrophobicContact CD2-CD1 3.72Å; L32-I40 HydrophobicContact CG-CD1 4.37Å
33	T	79.3	Confident	65.2	Low	84 Å²	84	122.9 Å²	122.9	52%	0.515	64%	0.636	S	S	.	*			trans	-59.1	148	176.9	-19.8	0	0	0	0	109.5	E31 E35 E36 R37	E31-T33 PolarHBondContact O-N 3.33Å; T33-E35 PolarHBondContact O-N 3.32Å; T33-E35 VanDerWaalsContact O-N 3.09Å; T33-E36 PolarHBondContact N-OE2 3Å; T33-E36 WeakPolarHBondContact O-CB 3.39Å; T33-E36 PolarHBondContact O-N 3Å; T33-E36 PolarHBondContact OG1-OE2 2.87Å; T33-R37 PolarHBondContact O-N 3.21Å
34	E	73.9	Confident	67.2	Low	151 Å²	151	120.6 Å²	120.6	71%	0.706	63%	0.63	S	S	*	*	H	α-helix	trans	-54.4	-33.3	-176.7	-104.8	174.2	173.6	0	0	113.4	R37 Q38	E34-R37 PolarHBondContact O-N 3Å; E34-Q38 WeakPolarHBondContact O-CG 3.26Å; E34-Q38 PolarHBondContact O-N 3.04Å
35	E	76.6	Confident	69	Low	158 Å²	158	124 Å²	124	74%	0.738	62%	0.623	S	S	*	*	H	α-helix	trans	-69.2	-41.4	175.7	-61.8	179.3	175.2	0	0	112.3	T33 R37 Q38 Q39	T33-E35 PolarHBondContact O-N 3.32Å; T33-E35 VanDerWaalsContact O-N 3.09Å; E35-R37 VanDerWaalsContact C-N 3.29Å; E35-R37 PolarHBondContact O-N 3.04Å; E35-Q38 PolarHBondContact O-N 3.06Å; E35-Q39 WeakPolarHBondContact O-CB 3.48Å; E35-Q39 PolarHBondContact O-N 3.47Å
36	E	79.1	Confident	71.1	Confident	62 Å²	62	122.5 Å²	122.5	29%	0.29	61%	0.605	S	S	.	*	H	α-helix	trans	-66.4	-34.9	174.9	-64.6	173	142.1	0	0	110.7	L32 T33 Q39 I40	L32-E36 HydrophobicContact CB-CB 4.43Å; L32-E36 HydrophobicContact CD2-CB 3.79Å; T33-E36 PolarHBondContact N-OE2 3Å; T33-E36 WeakPolarHBondContact O-CB 3.39Å; T33-E36 PolarHBondContact O-N 3Å; T33-E36 PolarHBondContact OG1-OE2 2.87Å; E36-Q39 PolarHBondContact O-N 3.16Å; E36-I40 WeakPolarHBondContact O-CB 3.48Å; E36-I40 WeakPolarHBondContact O-CD1 3.25Å; E36-I40 WeakPolarHBondContact O-CG1 3.29Å; E36-I40 PolarHBondContact O-N 3.19Å
37	R	78	Confident	72.8	Confident	128 Å²	128	117.7 Å²	117.7	48%	0.483	59%	0.585	S	S	.	*	H	α-helix	trans	-64	-45.6	174	-68.3	-179.1	-175.7	173.6	-1.9	111.9	L32 T33 E34 E35 Q39 I40 L41	L32-R37 HydrophobicContact CB-CG 3.93Å; L32-R37 PolarHBondContact O-NE 3.09Å; T33-R37 PolarHBondContact O-N 3.21Å; E34-R37 PolarHBondContact O-N 3Å; E35-R37 VanDerWaalsContact C-N 3.29Å; E35-R37 PolarHBondContact O-N 3.04Å; R37-Q39 VanDerWaalsContact C-N 3.3Å; R37-Q39 PolarHBondContact O-N 2.73Å; R37-I40 PolarHBondContact O-N 2.96Å; R37-L41 WeakPolarHBondContact O-CB 3.12Å; R37-L41 PolarHBondContact O-N 2.97Å
38	Q	78.3	Confident	74	Confident	128 Å²	128	114.3 Å²	114.3	60%	0.598	56%	0.564	S	S	*	*	H	α-helix	trans	-64.1	-37.9	176.7	-72.6	-179.4	-0.5	0	0	111.7	E34 E35 L41 H42	E34-Q38 WeakPolarHBondContact O-CG 3.26Å; E34-Q38 PolarHBondContact O-N 3.04Å; E35-Q38 PolarHBondContact O-N 3.06Å; Q38-L41 PolarHBondContact O-N 3.39Å; Q38-H42 WeakPolarHBondContact O-CB 3.47Å; Q38-H42 PolarHBondContact O-CD2 3.16Å; Q38-H42 PolarHBondContact O-N 3.22Å
39	Q	81.9	Confident	75.5	Confident	149 Å²	149	114.3 Å²	114.3	70%	0.696	55%	0.554	S	S	*	*	H	α-helix	trans	-67.5	-38.1	176.8	-165.8	170.2	-0.6	0	0	112.3	E35 E36 R37 S43	E35-Q39 WeakPolarHBondContact O-CB 3.48Å; E35-Q39 PolarHBondContact O-N 3.47Å; E36-Q39 PolarHBondContact O-N 3.16Å; R37-Q39 VanDerWaalsContact C-N 3.3Å; R37-Q39 PolarHBondContact O-N 2.73Å; Q39-S43 PolarHBondContact O-N 3.27Å; Q39-S43 VanDerWaalsContact O-N 3.13Å
40	I	80.4	Confident	77	Confident	64 Å²	64	110.9 Å²	110.9	33%	0.328	53%	0.532	S	S	.	.	H	α-helix	trans	-66.7	-40.4	172.5	-67.3	161.7	0	0	0	110.5	L32 E36 R37 H42 S43 F46	L32-I40 HydrophobicContact CD1-CD1 3.87Å; L32-I40 HydrophobicContact CD2-CD1 3.72Å; L32-I40 HydrophobicContact CG-CD1 4.37Å; E36-I40 WeakPolarHBondContact O-CB 3.48Å; E36-I40 WeakPolarHBondContact O-CD1 3.25Å; E36-I40 WeakPolarHBondContact O-CG1 3.29Å; E36-I40 PolarHBondContact O-N 3.19Å; R37-I40 PolarHBondContact O-N 2.96Å; I40-H42 VanDerWaalsContact C-N 3.3Å; I40-H42 PolarHBondContact O-N 2.93Å; I40-S43 WeakPolarHBondContact O-CB 3.46Å; I40-S43 PolarHBondContact O-N 3.31Å; I40-F46 HydrophobicContact CG2-CB 4.39Å; I40-F46 HydrophobicContact CG2-CD1 4.46Å; I40-F46 HydrophobicContact CG2-CD2 3.6Å; I40-F46 HydrophobicContact CG2-CE2 3.75Å; I40-F46 HydrophobicContact CG2-CG 3.94Å; I40-F46 HydrophobicContact CG2-CZ 4.21Å; I40-F46 WeakPolarHBondContact O-CB 3.33Å; I40-F46 WeakPolarHBondContact O-CD1 3.16Å; I40-F46 WeakPolarHBondContact O-CG 3.35Å
41	L	80.1	Confident	77.8	Confident	107 Å²	107	105.4 Å²	105.4	56%	0.56	52%	0.518	S	S	*	.	H	α-helix	trans	-67.8	-30	179.9	-151.5	141.9	0	0	0	112.7	R37 Q38 F46 Q47	R37-L41 WeakPolarHBondContact O-CB 3.12Å; R37-L41 PolarHBondContact O-N 2.97Å; Q38-L41 PolarHBondContact O-N 3.39Å; L41-F46 HydrophobicContact CB-CE1 4.38Å; L41-F46 HydrophobicContact CG-CE1 4.12Å; L41-Q47 PolarHBondContact O-NE2 2.57Å
42	H	78.4	Confident	78.4	Confident	147 Å²	147	100.8 Å²	100.8	68%	0.681	50%	0.503	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.9	-8.5	171.5	-82.8	-63.8	0	0	0	114.3	Q38 I40 S44	Q38-H42 WeakPolarHBondContact O-CB 3.47Å; Q38-H42 PolarHBondContact O-CD2 3.16Å; Q38-H42 PolarHBondContact O-N 3.22Å; I40-H42 VanDerWaalsContact C-N 3.3Å; I40-H42 PolarHBondContact O-N 2.93Å; H42-S44 PolarHBondContact O-N 2.88Å
43	S	89.9	Confident	79.2	Confident	48 Å²	48	99.4 Å²	99.4	34%	0.336	50%	0.499	S	S	.	.			trans	-65.5	131.5	175.4	-176.6	0	0	0	0	110.3	Q39 I40 E45 F46 Q47	Q39-S43 PolarHBondContact O-N 3.27Å; Q39-S43 VanDerWaalsContact O-N 3.13Å; I40-S43 WeakPolarHBondContact O-CB 3.46Å; I40-S43 PolarHBondContact O-N 3.31Å; S43-E45 VanDerWaalsContact C-N 3.26Å; S43-E45 PolarHBondContact O-N 3.32Å; S43-F46 PolarHBondContact O-N 3.46Å; S43-Q47 PolarHBondContact O-N 3.38Å
44	S	77.1	Confident	79.4	Confident	88 Å²	88	98.8 Å²	98.8	62%	0.615	49%	0.492	S	S	*	.	H	α-helix	trans	-63.7	-31.3	-179.5	52.9	0	0	0	0	113	H42 S48	H42-S44 PolarHBondContact O-N 2.88Å; S44-S48 WeakPolarHBondContact O-CB 3.5Å; S44-S48 PolarHBondContact O-N 2.95Å; S44-S48 PolarHBondContact O-OG 3.46Å
45	E	78.9	Confident	79.3	Confident	157 Å²	157	94.6 Å²	94.6	73%	0.734	47%	0.47	S	S	*	.	H	α-helix	trans	-70.3	-39.5	177.2	-169.1	168.4	-165.2	0	0	111.2	S43 S48 F49	S43-E45 VanDerWaalsContact C-N 3.26Å; S43-E45 PolarHBondContact O-N 3.32Å; E45-S48 PolarHBondContact O-N 2.91Å; E45-F49 PolarHBondContact O-N 3.34Å
46	F	82.1	Confident	79.3	Confident	60 Å²	60	91.6 Å²	91.6	26%	0.263	46%	0.462	S	S	.	.	H	α-helix	trans	-68.9	-41.8	175.2	-172.8	-98.3	0	0	0	111.6	I40 L41 S43 S48 F49 F50	I40-F46 HydrophobicContact CG2-CB 4.39Å; I40-F46 HydrophobicContact CG2-CD1 4.46Å; I40-F46 HydrophobicContact CG2-CD2 3.6Å; I40-F46 HydrophobicContact CG2-CE2 3.75Å; I40-F46 HydrophobicContact CG2-CG 3.94Å; I40-F46 HydrophobicContact CG2-CZ 4.21Å; I40-F46 WeakPolarHBondContact O-CB 3.33Å; I40-F46 WeakPolarHBondContact O-CD1 3.16Å; I40-F46 WeakPolarHBondContact O-CG 3.35Å; L41-F46 HydrophobicContact CB-CE1 4.38Å; L41-F46 HydrophobicContact CG-CE1 4.12Å; S43-F46 PolarHBondContact O-N 3.46Å; F46-S48 VanDerWaalsContact C-N 3.3Å; F46-S48 PolarHBondContact O-N 3.41Å; F46-F49 PolarHBondContact O-N 3.34Å; F46-F50 AromaticContact CD1-CD2 3.53Å; F46-F50 HydrophobicContact CD1-CD2 3.53Å; F46-F50 AromaticContact CD1-CE2 3.85Å; F46-F50 HydrophobicContact CD1-CE2 3.85Å; F46-F50 HydrophobicContact CD1-CG 4.22Å; F46-F50 AromaticContact CD2-CD2 3.95Å; F46-F50 HydrophobicContact CD2-CD2 3.95Å; F46-F50 AromaticContact CD2-CE2 3.82Å; F46-F50 HydrophobicContact CD2-CE2 3.82Å; F46-F50 HydrophobicContact CE1-CD1 4.39Å; F46-F50 AromaticContact CE1-CD2 3.3Å; F46-F50 HydrophobicContact CE1-CD2 3.3Å; F46-F50 HydrophobicContact CE1-CE1 4.23Å; F46-F50 AromaticContact CE1-CE2 3.18Å; F46-F50 HydrophobicContact CE1-CE2 3.18Å; F46-F50 AromaticContact CE1-CG 3.96Å; F46-F50 HydrophobicContact CE1-CG 3.96Å; F46-F50 AromaticContact CE1-CZ 3.64Å; F46-F50 HydrophobicContact CE1-CZ 3.64Å; F46-F50 AromaticContact CE2-CD2 3.76Å; F46-F50 HydrophobicContact CE2-CD2 3.76Å; F46-F50 AromaticContact CE2-CE2 3.16Å; F46-F50 HydrophobicContact CE2-CE2 3.16Å; F46-F50 HydrophobicContact CE2-CZ 4Å; F46-F50 AromaticContact CG-CD2 3.89Å; F46-F50 HydrophobicContact CG-CD2 3.89Å; F46-F50 HydrophobicContact CG-CE2 4.17Å; F46-F50 AromaticContact CZ-CD2 3.47Å; F46-F50 HydrophobicContact CZ-CD2 3.47Å; F46-F50 VanDerWaalsContact CZ-CD2 3.47Å; F46-F50 HydrophobicContact CZ-CE1 4.28Å; F46-F50 AromaticContact CZ-CE2 2.83Å; F46-F50 HydrophobicContact CZ-CE2 2.83Å; F46-F50 HydrophobicContact CZ-CG 4.44Å; F46-F50 AromaticContact CZ-CZ 3.29Å; F46-F50 HydrophobicContact CZ-CZ 3.29Å; F46-F50 WeakPolarHBondContact O-CB 3.46Å; F46-F50 WeakPolarHBondContact O-CD2 3.43Å; F46-F50 PolarHBondContact O-N 3.01Å
47	Q	79.2	Confident	79.2	Confident	89 Å²	89	94.4 Å²	94.4	42%	0.416	48%	0.477	S	S	.	.	H	α-helix	trans	-59.5	-41.6	172.9	-72.4	-179.5	-5.7	0	0	111.7	L41 S43 F49 F50 D51	L41-Q47 PolarHBondContact O-NE2 2.57Å; S43-Q47 PolarHBondContact O-N 3.38Å; Q47-F49 PolarHBondContact O-N 2.99Å; Q47-F50 PolarHBondContact O-N 3.24Å; Q47-D51 WeakPolarHBondContact O-CB 3.48Å; Q47-D51 VanDerWaalsContact O-CG 3.28Å; Q47-D51 PolarHBondContact O-N 3.45Å
48	S	75.1	Confident	78.9	Confident	45 Å²	45	90.8 Å²	90.8	32%	0.315	47%	0.465	S	S	.	.	H	α-helix	trans	-64.1	-41.6	176.6	-55.6	0	0	0	0	111.9	S44 E45 F46 C52	S44-S48 WeakPolarHBondContact O-CB 3.5Å; S44-S48 PolarHBondContact O-N 2.95Å; S44-S48 PolarHBondContact O-OG 3.46Å; E45-S48 PolarHBondContact O-N 2.91Å; F46-S48 VanDerWaalsContact C-N 3.3Å; F46-S48 PolarHBondContact O-N 3.41Å; S48-C52 WeakPolarHBondContact O-CB 3.37Å; S48-C52 PolarHBondContact O-N 2.86Å
49	F	82.4	Confident	78.4	Confident	135 Å²	135	89 Å²	89	59%	0.592	45%	0.453	S	S	*	.	H	α-helix	trans	-67.3	-40.9	175.6	-179.7	-96.6	0	0	0	112.4	E45 F46 Q47 C52 S53	E45-F49 PolarHBondContact O-N 3.34Å; F46-F49 PolarHBondContact O-N 3.34Å; Q47-F49 PolarHBondContact O-N 2.99Å; F49-C52 PolarHBondContact O-N 3.03Å; F49-S53 WeakPolarHBondContact O-CB 3.47Å; F49-S53 PolarHBondContact O-N 3.41Å; F49-S53 PolarHBondContact O-OG 3.23Å
50	F	81.8	Confident	77.8	Confident	90 Å²	90	85 Å²	85	40%	0.395	45%	0.446	S	S	.	.	H	α-helix	trans	-64.9	-45.6	176.4	-97	-105.4	0	0	0	111.3	F46 Q47 C52 S53 I54	F46-F50 AromaticContact CD1-CD2 3.53Å; F46-F50 HydrophobicContact CD1-CD2 3.53Å; F46-F50 AromaticContact CD1-CE2 3.85Å; F46-F50 HydrophobicContact CD1-CE2 3.85Å; F46-F50 HydrophobicContact CD1-CG 4.22Å; F46-F50 AromaticContact CD2-CD2 3.95Å; F46-F50 HydrophobicContact CD2-CD2 3.95Å; F46-F50 AromaticContact CD2-CE2 3.82Å; F46-F50 HydrophobicContact CD2-CE2 3.82Å; F46-F50 HydrophobicContact CE1-CD1 4.39Å; F46-F50 AromaticContact CE1-CD2 3.3Å; F46-F50 HydrophobicContact CE1-CD2 3.3Å; F46-F50 HydrophobicContact CE1-CE1 4.23Å; F46-F50 AromaticContact CE1-CE2 3.18Å; F46-F50 HydrophobicContact CE1-CE2 3.18Å; F46-F50 AromaticContact CE1-CG 3.96Å; F46-F50 HydrophobicContact CE1-CG 3.96Å; F46-F50 AromaticContact CE1-CZ 3.64Å; F46-F50 HydrophobicContact CE1-CZ 3.64Å; F46-F50 AromaticContact CE2-CD2 3.76Å; F46-F50 HydrophobicContact CE2-CD2 3.76Å; F46-F50 AromaticContact CE2-CE2 3.16Å; F46-F50 HydrophobicContact CE2-CE2 3.16Å; F46-F50 HydrophobicContact CE2-CZ 4Å; F46-F50 AromaticContact CG-CD2 3.89Å; F46-F50 HydrophobicContact CG-CD2 3.89Å; F46-F50 HydrophobicContact CG-CE2 4.17Å; F46-F50 AromaticContact CZ-CD2 3.47Å; F46-F50 HydrophobicContact CZ-CD2 3.47Å; F46-F50 VanDerWaalsContact CZ-CD2 3.47Å; F46-F50 HydrophobicContact CZ-CE1 4.28Å; F46-F50 AromaticContact CZ-CE2 2.83Å; F46-F50 HydrophobicContact CZ-CE2 2.83Å; F46-F50 HydrophobicContact CZ-CG 4.44Å; F46-F50 AromaticContact CZ-CZ 3.29Å; F46-F50 HydrophobicContact CZ-CZ 3.29Å; F46-F50 WeakPolarHBondContact O-CB 3.46Å; F46-F50 WeakPolarHBondContact O-CD2 3.43Å; F46-F50 PolarHBondContact O-N 3.01Å; Q47-F50 PolarHBondContact O-N 3.24Å; F50-C52 VanDerWaalsContact C-N 3.33Å; F50-C52 PolarHBondContact O-N 3.31Å; F50-S53 PolarHBondContact O-N 3.13Å; F50-I54 HydrophobicContact CD1-CD1 4.47Å; F50-I54 VanDerWaalsContact O-CB 3.31Å; F50-I54 WeakPolarHBondContact O-CB 3.47Å; F50-I54 WeakPolarHBondContact O-CD1 3.34Å; F50-I54 WeakPolarHBondContact O-CG1 3.37Å; F50-I54 PolarHBondContact O-N 3.07Å
51	D	76.6	Confident	77.3	Confident	82 Å²	82	88 Å²	88	44%	0.439	46%	0.462	S	S	.	.	H	α-helix	trans	-60	-44.1	175.8	-77.1	-12.2	0	0	0	111	Q47 S53 R55	Q47-D51 WeakPolarHBondContact O-CB 3.48Å; Q47-D51 VanDerWaalsContact O-CG 3.28Å; Q47-D51 PolarHBondContact O-N 3.45Å; D51-S53 PolarHBondContact O-N 3.46Å; D51-R55 WeakPolarHBondContact O-CB 3.19Å; D51-R55 VanDerWaalsContact O-CD 3.29Å; D51-R55 WeakPolarHBondContact O-CD 3.37Å; D51-R55 WeakPolarHBondContact O-CG 3.34Å; D51-R55 PolarHBondContact O-N 3.42Å
52	C	73.9	Confident	76.5	Confident	73 Å²	73	83.7 Å²	83.7	49%	0.493	44%	0.441	S	S	.	.	H	α-helix	trans	-61.4	-45.5	176	-169.9	0	0	0	0	111.8	S48 F49 F50 R55 V56	S48-C52 WeakPolarHBondContact O-CB 3.37Å; S48-C52 PolarHBondContact O-N 2.86Å; F49-C52 PolarHBondContact O-N 3.03Å; F50-C52 VanDerWaalsContact C-N 3.33Å; F50-C52 PolarHBondContact O-N 3.31Å; C52-R55 PolarHBondContact O-N 3.31Å; C52-V56 WeakPolarHBondContact O-CG2 3.46Å; C52-V56 PolarHBondContact O-N 2.76Å; C52-V56 VanDerWaalsContact O-N 3.09Å
53	S	80.9	Confident	75.6	Confident	42 Å²	42	81.5 Å²	81.5	29%	0.294	43%	0.431	S	S	.	.	H	α-helix	trans	-67.6	-42.2	-179.3	-58.3	0	0	0	0	112.3	F49 F50 D51 V56 M57	F49-S53 WeakPolarHBondContact O-CB 3.47Å; F49-S53 PolarHBondContact O-N 3.41Å; F49-S53 PolarHBondContact O-OG 3.23Å; F50-S53 PolarHBondContact O-N 3.13Å; D51-S53 PolarHBondContact O-N 3.46Å; S53-V56 PolarHBondContact O-N 2.86Å; S53-M57 WeakPolarHBondContact O-CG 3.16Å; S53-M57 PolarHBondContact O-N 2.96Å
54	I	82.4	Confident	74	Confident	71 Å²	71	84.9 Å²	84.9	36%	0.364	45%	0.446	S	S	.	.	H	α-helix	trans	-62.7	-44	176	-70.7	165.6	0	0	0	109.6	F50 V56 M57 E58	F50-I54 HydrophobicContact CD1-CD1 4.47Å; F50-I54 VanDerWaalsContact O-CB 3.31Å; F50-I54 WeakPolarHBondContact O-CB 3.47Å; F50-I54 WeakPolarHBondContact O-CD1 3.34Å; F50-I54 WeakPolarHBondContact O-CG1 3.37Å; F50-I54 PolarHBondContact O-N 3.07Å; I54-V56 PolarHBondContact O-N 3.44Å; I54-M57 PolarHBondContact O-N 3.36Å; I54-E58 HydrophobicContact CG2-CG 4.07Å; I54-E58 WeakPolarHBondContact O-CB 3.19Å; I54-E58 WeakPolarHBondContact O-CG 3.4Å; I54-E58 PolarHBondContact O-N 3.36Å
55	R	72.3	Confident	72.8	Confident	64 Å²	64	85 Å²	85	24%	0.242	45%	0.446	C	S	.	.	H	α-helix	trans	-58.6	-45.4	176.5	-73.5	163.9	-171.3	-131	-5.8	112.2	D51 C52 E58 R59 F144 E150 Y151	D51-R55 WeakPolarHBondContact O-CB 3.19Å; D51-R55 VanDerWaalsContact O-CD 3.29Å; D51-R55 WeakPolarHBondContact O-CD 3.37Å; D51-R55 WeakPolarHBondContact O-CG 3.34Å; D51-R55 PolarHBondContact O-N 3.42Å; C52-R55 PolarHBondContact O-N 3.31Å; R55-E58 PolarHBondContact O-N 2.82Å; R55-R59 WeakPolarHBondContact O-CB 3.4Å; R55-R59 PolarHBondContact O-N 3.38Å; R55-F144 HydrophobicContact CB-CZ 4.16Å; R55-F144 HydrophobicContact CG-CZ 4.48Å; R55-F144 WeakPolarHBondContact O-CE1 3.31Å; R55-F144 WeakPolarHBondContact O-CZ 3.5Å; R55-E150 PolarHBondContact NH1-O 3.35Å; R55-E150 PolarHBondContact NH2-O 3.12Å; R55-Y151 VanDerWaalsContact NH1-CE1 3.27Å
56	V	76.1	Confident	71.6	Confident	94 Å²	94	82.8 Å²	82.8	57%	0.57	44%	0.44	S	S	*	.	H	α-helix	trans	-64.4	-43	177.9	175	0	0	0	0	110.8	C52 S53 I54 R59 A60	C52-V56 WeakPolarHBondContact O-CG2 3.46Å; C52-V56 PolarHBondContact O-N 2.76Å; C52-V56 VanDerWaalsContact O-N 3.09Å; S53-V56 PolarHBondContact O-N 2.86Å; I54-V56 PolarHBondContact O-N 3.44Å; V56-R59 PolarHBondContact O-N 3.22Å; V56-A60 PolarHBondContact O-N 3.22Å
57	M	76.8	Confident	70.6	Confident	121 Å²	121	87.9 Å²	87.9	60%	0.596	47%	0.468	S	S	*	.	H	α-helix	trans	-65.3	-42.2	176.4	-74.7	-149.2	-70.8	0	0	112.5	S53 I54 R59 A60 L61	S53-M57 WeakPolarHBondContact O-CG 3.16Å; S53-M57 PolarHBondContact O-N 2.96Å; I54-M57 PolarHBondContact O-N 3.36Å; M57-R59 VanDerWaalsContact C-N 3.3Å; M57-R59 PolarHBondContact O-N 2.78Å; M57-A60 PolarHBondContact O-N 3.4Å; M57-L61 WeakPolarHBondContact O-CB 3.39Å; M57-L61 VanDerWaalsContact O-CG 3.25Å; M57-L61 WeakPolarHBondContact O-CG 3.33Å; M57-L61 PolarHBondContact O-N 3.34Å
58	E	71.3	Confident	69.7	Low	53 Å²	53	90.8 Å²	90.8	25%	0.248	49%	0.485	C	S	.	.	H	α-helix	trans	-65.8	-33.2	177	-76.8	-174	152.9	0	0	111.8	I54 R55 L61 A62 F144 K146	I54-E58 HydrophobicContact CG2-CG 4.07Å; I54-E58 WeakPolarHBondContact O-CB 3.19Å; I54-E58 WeakPolarHBondContact O-CG 3.4Å; I54-E58 PolarHBondContact O-N 3.36Å; R55-E58 PolarHBondContact O-N 2.82Å; E58-L61 PolarHBondContact O-N 2.78Å; E58-A62 WeakPolarHBondContact O-CB 3.38Å; E58-A62 PolarHBondContact O-N 3.43Å; E58-A62 VanDerWaalsContact O-N 3.13Å; E58-F144 HydrophobicContact CB-CD1 3.75Å; E58-F144 HydrophobicContact CB-CE1 3.41Å; E58-F144 VanDerWaalsContact CB-CE1 3.41Å; E58-K146 IonicContact OE1-NZ 2.57Å; E58-K146 PolarHBondContact OE1-NZ 2.73Å
59	R	68.3	Low	68.9	Low	90 Å²	90	92.6 Å²	92.6	34%	0.34	49%	0.488	S	S	.	.	H	α-helix	trans	-65.5	-42.7	173	-179.5	176.6	173	137.2	3.6	111	R55 V56 M57 A62 E117 K143 F144	R55-R59 WeakPolarHBondContact O-CB 3.4Å; R55-R59 PolarHBondContact O-N 3.38Å; V56-R59 PolarHBondContact O-N 3.22Å; M57-R59 VanDerWaalsContact C-N 3.3Å; M57-R59 PolarHBondContact O-N 2.78Å; R59-A62 PolarHBondContact O-N 3.28Å; R59-E117 IonicContact CZ-OE1 3.72Å; R59-E117 IonicContact NH1-OE1 2.69Å; R59-E117 PolarHBondContact NH1-OE1 2.93Å; R59-E117 IonicContact NH2-OE1 2.72Å; R59-E117 PolarHBondContact NH2-OE1 3.43Å; R59-K143 HydrophobicContact CG-CD 4.22Å; R59-F144 HydrophobicContact CB-CE1 4.19Å; R59-F144 HydrophobicContact CB-CZ 4.38Å
60	A	69.5	Low	67.5	Low	65 Å²	65	90.7 Å²	90.7	54%	0.537	48%	0.484	S	S	.	.	H	α-helix	trans	-67.3	-39.6	176.3	0	0	0	0	0	112.2	V56 M57 A62 E63	V56-A60 PolarHBondContact O-N 3.22Å; M57-A60 PolarHBondContact O-N 3.4Å; A60-A62 PolarHBondContact O-N 3.05Å; A60-E63 PolarHBondContact O-N 3.4Å
61	L	69.6	Low	66.5	Low	128 Å²	128	96.3 Å²	96.3	67%	0.67	50%	0.504	S	S	*	.	H	α-helix	trans	-69.1	-18.1	177.9	-73.3	170.2	0	0	0	113.7	M57 E58	M57-L61 WeakPolarHBondContact O-CB 3.39Å; M57-L61 VanDerWaalsContact O-CG 3.25Å; M57-L61 WeakPolarHBondContact O-CG 3.33Å; M57-L61 PolarHBondContact O-N 3.34Å; E58-L61 PolarHBondContact O-N 2.78Å
62	A	63.4	Low	66	Low	15 Å²	15	95.9 Å²	95.9	12%	0.124	51%	0.507	C	S	.	.	H	α-helix	trans	-89.6	-15.6	177.7	0	0	0	0	0	113.6	E58 R59 A60 D64 K143 K145	E58-A62 WeakPolarHBondContact O-CB 3.38Å; E58-A62 PolarHBondContact O-N 3.43Å; E58-A62 VanDerWaalsContact O-N 3.13Å; R59-A62 PolarHBondContact O-N 3.28Å; A60-A62 PolarHBondContact O-N 3.05Å; A62-D64 PolarHBondContact O-N 2.72Å; A62-K143 WeakPolarHBondContact CB-O 3.46Å; A62-K145 HydrophobicContact CB-CG 4.3Å
63	E	60.1	Low	65.3	Low	101 Å²	101	93.7 Å²	93.7	47%	0.472	50%	0.497	S	S	.	.			trans	-78.5	75.4	168.2	-72	-178.1	177.5	0	0	109.3	A60 S65 K143	A60-E63 PolarHBondContact O-N 3.4Å; E63-S65 PolarHBondContact O-N 2.75Å; E63-K143 IonicContact OE1-NZ 3.91Å; E63-K143 PolarHBondContact OE1-NZ 3.13Å
64	D	55.8	Low	64.1	Low	120 Å²	120	101.5 Å²	101.5	64%	0.642	52%	0.52	S	S	*	.			trans	-74	71.9	164.9	-73.4	-11.5	0	0	0	108.5	A62 D66 K145	A62-D64 PolarHBondContact O-N 2.72Å; D64-D66 PolarHBondContact O-N 2.92Å; D64-K145 IonicContact OD1-NZ 3.21Å; D64-K145 IonicContact OD2-NZ 3.36Å; D64-K145 PolarHBondContact OD2-NZ 3.47Å
65	S	53.5	Low	62.7	Low	90 Å²	90	102.3 Å²	102.3	63%	0.629	53%	0.525	S	S	*	.			trans	-80.9	99.4	160.6	30.7	0	0	0	0	106.5	E63 I67	E63-S65 PolarHBondContact O-N 2.75Å; S65-I67 PolarHBondContact O-N 3.09Å
66	D	51.8	Low	61.8	Low	111 Å²	111	104.4 Å²	104.4	59%	0.594	54%	0.541	S	S	*	.			trans	-68.5	97.1	177	-165.1	-0.6	0	0	0	109.2	D64 L68 F69	D64-D66 PolarHBondContact O-N 2.92Å; D66-L68 PolarHBondContact O-N 3.42Å; D66-L68 VanDerWaalsContact O-N 3.16Å; D66-L68 WeakPolarHBondContact OD1-CA 3.4Å; D66-L68 WeakPolarHBondContact OD1-CB 3.39Å; D66-L68 PolarHBondContact OD1-N 3.4Å; D66-F69 PolarHBondContact O-N 2.91Å
67	I	62.2	Low	60.5	Low	166 Å²	166	107.2 Å²	107.2	85%	0.851	55%	0.548	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.1	-14.4	174.6	-56.9	166.3	0	0	0	110.1	S65 F69	S65-I67 PolarHBondContact O-N 3.09Å; I67-F69 VanDerWaalsContact C-N 3.34Å
68	L	59.9	Low	59.3	Low	150 Å²	150	107.8 Å²	107.8	79%	0.785	55%	0.553	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.8	3.7	178.3	-132.4	88.4	0	0	0	113.9	D66 D70	D66-L68 PolarHBondContact O-N 3.42Å; D66-L68 VanDerWaalsContact O-N 3.16Å; D66-L68 WeakPolarHBondContact OD1-CA 3.4Å; D66-L68 WeakPolarHBondContact OD1-CB 3.39Å; D66-L68 PolarHBondContact OD1-N 3.4Å; L68-D70 PolarHBondContact O-N 3.22Å
69	F	57.7	Low	58.3	Low	83 Å²	83	111.1 Å²	111.1	36%	0.364	57%	0.567	S	S	.	*			trans	-58.5	111.5	177.4	-164.7	-97.4	0	0	0	110.1	D66 I67 Y71	D66-F69 PolarHBondContact O-N 2.91Å; I67-F69 VanDerWaalsContact C-N 3.34Å; F69-Y71 VanDerWaalsContact O-CD2 3.29Å; F69-Y71 WeakPolarHBondContact O-CD2 2.92Å; F69-Y71 PolarHBondContact O-N 3.5Å
70	D	53.5	Low	57	Low	96 Å²	96	114 Å²	114	51%	0.513	58%	0.584	S	S	.	*			trans	-78.9	109.1	-175	-169	8.7	0	0	0	109.6	L68 S72	L68-D70 PolarHBondContact O-N 3.22Å; D70-S72 PolarHBondContact O-N 3.04Å; D70-S72 VanDerWaalsContact OD1-CB 3.26Å; D70-S72 WeakPolarHBondContact OD1-CB 3.29Å; D70-S72 PolarHBondContact OD1-N 3.43Å; D70-S72 PolarHBondContact OD1-OG 2.99Å; D70-S72 WeakPolarHBondContact OD2-CB 3.08Å; D70-S72 PolarHBondContact OD2-OG 3.49Å
71	Y	61	Low	55.4	Low	208 Å²	208	114.1 Å²	114.1	82%	0.816	59%	0.591	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.9	8.5	175.3	-67.2	-92.7	0	0	0	112.9	F69 G73	F69-Y71 VanDerWaalsContact O-CD2 3.29Å; F69-Y71 WeakPolarHBondContact O-CD2 2.92Å; F69-Y71 PolarHBondContact O-N 3.5Å; Y71-G73 PolarHBondContact O-N 3.43Å; Y71-G73 VanDerWaalsContact O-N 3.16Å
72	S	66.8	Low	54	Low	72 Å²	72	115 Å²	115	50%	0.503	60%	0.597	S	S	.	*	T	Hydrogen-bonded Turn	trans	-69.4	-2.4	179.1	74.5	0	0	0	0	114.7	D70 R74	D70-S72 PolarHBondContact O-N 3.04Å; D70-S72 VanDerWaalsContact OD1-CB 3.26Å; D70-S72 WeakPolarHBondContact OD1-CB 3.29Å; D70-S72 PolarHBondContact OD1-N 3.43Å; D70-S72 PolarHBondContact OD1-OG 2.99Å; D70-S72 WeakPolarHBondContact OD2-CB 3.08Å; D70-S72 PolarHBondContact OD2-OG 3.49Å; S72-R74 VanDerWaalsContact C-N 3.31Å; S72-R74 PolarHBondContact O-N 3.38Å
73	G	57.7	Low	53.2	Low	28 Å²	28	120.1 Å²	120.1	29%	0.289	62%	0.621	S	S	.	*	S	Bend	trans	80.2	1.4	166.6	0	0	0	0	0	115.8	Y71 L76	Y71-G73 PolarHBondContact O-N 3.43Å; Y71-G73 VanDerWaalsContact O-N 3.16Å; G73-L76 PolarHBondContact O-N 3.24Å
74	R	56.9	Low	52.2	Low	205 Å²	205	118 Å²	118	77%	0.774	63%	0.626	S	S	*	*	H	α-helix	trans	-70.2	-29.4	175.7	-84.1	-177.9	176.2	174.3	-0.4	113.9	S72	S72-R74 VanDerWaalsContact C-N 3.31Å; S72-R74 PolarHBondContact O-N 3.38Å
75	D	52.9	Low	51.2	Low	89 Å²	89	118.3 Å²	118.3	48%	0.476	64%	0.638	S	S	.	*	H	α-helix	trans	-90.1	-2.2	178.8	-63.4	-22.2	0	0	0	113.3
76	L	52.6	Low	50.4	Low	107 Å²	107	117.8 Å²	117.8	56%	0.56	65%	0.646	S	S	*	*	H	α-helix	trans	-84.9	-36.6	176.1	-79.6	166.8	0	0	0	112	G73 D78 K79 E80	G73-L76 PolarHBondContact O-N 3.24Å; L76-D78 VanDerWaalsContact C-N 3.3Å; L76-D78 PolarHBondContact O-N 2.7Å; L76-K79 PolarHBondContact O-N 2.82Å; L76-E80 PolarHBondContact O-N 3.24Å
77	E	50.3	Low	50.3	Low	154 Å²	154	116.6 Å²	116.6	72%	0.72	65%	0.647	S	S	*	*	H	α-helix	trans	-66	-33.8	176.3	-70.3	-175.5	159.9	0	0	111.7	G81	E77-G81 PolarHBondContact O-N 3.28Å
78	D	50.7	Low	50.1	Low	132 Å²	132	111 Å²	111	71%	0.706	62%	0.622	S	S	*	*	H	α-helix	trans	-76.7	-21.3	176.4	-76.9	-20.9	0	0	0	113.1	L76	L76-D78 VanDerWaalsContact C-N 3.3Å; L76-D78 PolarHBondContact O-N 2.7Å
79	K	49.4	Very low	50.5	Low	124 Å²	124	104.3 Å²	104.3	54%	0.539	59%	0.588	S	S	.	*	H	α-helix	trans	-86.6	-35.3	174.4	-78.3	-174	177.6	-178.5	0	113.2	L76 G81 D82 L83	L76-K79 PolarHBondContact O-N 2.82Å; K79-G81 PolarHBondContact O-N 2.81Å; K79-D82 PolarHBondContact O-N 3Å; K79-L83 WeakPolarHBondContact O-CD1 3.36Å; K79-L83 PolarHBondContact O-N 3.45Å
80	E	42.5	Very low	51.3	Low	151 Å²	151	103.1 Å²	103.1	71%	0.706	59%	0.589	S	S	*	*	H	α-helix	trans	-64.7	-27.6	172.4	-83.9	-171.4	156.9	0	0	112.3	L76 D82	L76-E80 PolarHBondContact O-N 3.24Å; E80-D82 VanDerWaalsContact C-N 3.3Å; E80-D82 PolarHBondContact O-N 2.94Å
81	G	35.4	Very low	52.4	Low	66 Å²	66	103.4 Å²	103.4	68%	0.68	59%	0.586	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68.7	-20.6	174.1	0	0	0	0	0	115.3	E77 K79	E77-G81 PolarHBondContact O-N 3.28Å; K79-G81 PolarHBondContact O-N 2.81Å
82	D	39.9	Very low	53	Low	147 Å²	147	96.1 Å²	96.1	79%	0.786	57%	0.565	S	S	*	*	T	Hydrogen-bonded Turn	trans	-107.1	0.8	-178.5	-145.1	29.4	0	0	0	112.8	K79 E80 G84	K79-D82 PolarHBondContact O-N 3Å; E80-D82 VanDerWaalsContact C-N 3.3Å; E80-D82 PolarHBondContact O-N 2.94Å; D82-G84 PolarHBondContact O-N 2.97Å
83	L	46.9	Very low	53.3	Low	123 Å²	123	96.1 Å²	96.1	64%	0.644	55%	0.554	S	S	*	*	S	Bend	trans	-81.5	4.4	172.1	-93	144.5	0	0	0	113.1	K79	K79-L83 WeakPolarHBondContact O-CD1 3.36Å; K79-L83 PolarHBondContact O-N 3.45Å
84	G	38	Very low	54.4	Low	56 Å²	56	97.9 Å²	97.9	58%	0.577	56%	0.557	S	S	*	*			trans	-97.2	104.7	173.7	0	0	0	0	0	111.8	D82	D82-G84 PolarHBondContact O-N 2.97Å
85	S	35.2	Very low	55.4	Low	127 Å²	127	88.4 Å²	88.4	89%	0.888	52%	0.521	S	S	*	.	S	Bend	trans	109.5	92.7	161.8	-61.4	0	0	0	0	117.2
86	G	37.9	Very low	56.3	Low	78 Å²	78	87.3 Å²	87.3	80%	0.804	51%	0.511	S	S	*	.	S	Bend		90.8	53.3	121.1	0	0	0	0	0	119
87	S	49.8	Very low	57.1	Low	86 Å²	86	83.7 Å²	83.7	60%	0.601	49%	0.492	S	S	*	.			trans	175.1	102.1	144.2	49.6	0	0	0	0	107.9	L89	S87-L89 PolarHBondContact O-N 2.78Å
88	S	57.9	Low	57.9	Low	48 Å²	48	84 Å²	84	34%	0.336	49%	0.493	S	S	.	.	S	Bend	trans	-73.5	23.5	-174	54.8	0	0	0	0	114.6	A387 G424 L427	S88-A387 WeakPolarHBondContact OG-CB 3.34Å; S88-G424 PolarHBondContact O-N 3.4Å; S88-L427 VanDerWaalsContact OG-CD1 3.32Å; S88-L427 WeakPolarHBondContact OG-CD1 3.27Å
89	L	67.6	Low	58.7	Low	11 Å²	11	82.8 Å²	82.8	6%	0.058	48%	0.483	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	110.6	179.1	-80.7	170.5	0	0	0	108.6	S87 L373 L375 A387 V389 T423	S87-L89 PolarHBondContact O-N 2.78Å; L89-L373 HydrophobicContact CD1-CD2 4.45Å; L89-L375 HydrophobicContact CD1-CD1 3.76Å; L89-L375 HydrophobicContact CD1-CG 4.02Å; L89-L375 HydrophobicContact CD2-CD1 3.28Å; L89-L375 HydrophobicContact CD2-CG 4.28Å; L89-L375 HydrophobicContact CG-CD1 3.74Å; L89-A387 HydrophobicContact CD1-CB 3.91Å; L89-A387 HydrophobicContact CG-CB 4.16Å; L89-V389 HydrophobicContact CB-CG2 3.65Å; L89-V389 HydrophobicContact CD1-CB 4.22Å; L89-V389 HydrophobicContact CD1-CG2 3.5Å; L89-V389 HydrophobicContact CG-CG2 4.22Å; L89-T423 HydrophobicContact CD2-CG2 3.87Å
90	S	73.7	Confident	59.4	Low	57 Å²	57	78.1 Å²	78.1	40%	0.399	46%	0.462	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.9	124.5	172.6	45.8	0	0	0	0	109.5	C92 D422	S90-C92 PolarHBondContact O-N 3.21Å; S90-D422 PolarHBondContact N-O 3.3Å; S90-D422 VanDerWaalsContact N-O 3.1Å; S90-D422 PolarHBondContact O-N 3.33Å
91	F	78	Confident	60.4	Low	103 Å²	103	71 Å²	71	45%	0.452	43%	0.428	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.5	117.3	169.8	171.2	-108.5	0	0	0	109.3	R93 L94 W419 Y421	F91-R93 VanDerWaalsContact CE2-C 3.43Å; F91-R93 VanDerWaalsContact CE2-O 3.25Å; F91-R93 WeakPolarHBondContact CE2-O 3.48Å; F91-L94 HydrophobicContact CE2-CB 4.42Å; F91-L94 HydrophobicContact CZ-CB 3.86Å; F91-W419 AromaticContact CD2-CE3 3.97Å; F91-W419 HydrophobicContact CD2-CE3 3.97Å; F91-W419 HydrophobicContact CD2-CZ3 4.42Å; F91-W419 HydrophobicContact CE2-CD2 4.48Å; F91-W419 AromaticContact CE2-CE3 3.32Å; F91-W419 HydrophobicContact CE2-CE3 3.32Å; F91-W419 AromaticContact CE2-CZ3 3.7Å; F91-W419 HydrophobicContact CE2-CZ3 3.7Å; F91-W419 AromaticContact CZ-CE3 3.99Å; F91-W419 HydrophobicContact CZ-CE3 3.99Å; F91-W419 AromaticContact CZ-CZ3 3.91Å; F91-W419 HydrophobicContact CZ-CZ3 3.91Å; F91-Y421 HydrophobicContact CB-CD1 4.25Å; F91-Y421 HydrophobicContact CB-CE1 3.9Å; F91-Y421 HydrophobicContact CD2-CD1 4.44Å; F91-Y421 AromaticContact CD2-CE1 3.89Å; F91-Y421 HydrophobicContact CD2-CE1 3.89Å; F91-Y421 HydrophobicContact CG-CE1 4.37Å
92	C	72.7	Confident	62	Low	54 Å²	54	72.9 Å²	72.9	37%	0.365	42%	0.418	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.2	-59	-179	-78.8	0	0	0	0	111.3	S90 I420 D422	S90-C92 PolarHBondContact O-N 3.21Å; C92-I420 HydrophobicContact CB-CB 4.45Å; C92-I420 HydrophobicContact CB-CG2 4.24Å; C92-I420 WeakPolarHBondContact CB-O 3.22Å; C92-I420 PolarHBondContact N-O 3.27Å; C92-D422 WeakPolarHBondContact SG-CB 3.4Å
93	R	72.6	Confident	63.4	Low	72 Å²	72	70.7 Å²	70.7	27%	0.272	40%	0.403	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.6	151.6	-169.8	-63.4	-169.6	-173.6	-167.8	9.5	113.3	F91 I142 K143 F144 I420	F91-R93 VanDerWaalsContact CE2-C 3.43Å; F91-R93 VanDerWaalsContact CE2-O 3.25Å; F91-R93 WeakPolarHBondContact CE2-O 3.48Å; R93-I142 PolarHBondContact NH1-O 3.33Å; R93-K143 PolarHBondContact NH1-O 3.43Å; R93-F144 VanDerWaalsContact NH1-C 3.32Å; R93-F144 PolarHBondContact NH1-O 3.41Å; R93-I420 HydrophobicContact CB-CB 4.46Å; R93-I420 PolarHBondContact N-O 2.9Å; R93-I420 PolarHBondContact O-N 2.96Å
94	L	81.3	Confident	64.8	Low	66 Å²	66	65 Å²	65	35%	0.346	37%	0.373	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	123	168.3	179.4	62.3	0	0	0	108.8	F91 R417 W419	F91-L94 HydrophobicContact CE2-CB 4.42Å; F91-L94 HydrophobicContact CZ-CB 3.86Å; L94-R417 HydrophobicContact CD1-CB 3.73Å; L94-R417 HydrophobicContact CD1-CG 3.98Å; L94-W419 HydrophobicContact CB-CZ3 4.4Å; L94-W419 HydrophobicContact CD1-CD2 3.57Å; L94-W419 HydrophobicContact CD1-CE3 3.78Å; L94-W419 HydrophobicContact CD1-CG 4.19Å; L94-W419 HydrophobicContact CD1-CH2 3.78Å; L94-W419 HydrophobicContact CD1-CZ2 3.64Å; L94-W419 HydrophobicContact CD1-CZ3 3.85Å; L94-W419 HydrophobicContact CD2-CH2 3.92Å; L94-W419 HydrophobicContact CD2-CZ2 4.34Å; L94-W419 HydrophobicContact CD2-CZ3 4.27Å; L94-W419 HydrophobicContact CG-CH2 4.39Å; L94-W419 HydrophobicContact CG-CZ3 4.42Å
95	F	77.1	Confident	66.8	Low	5 Å²	5	64.5 Å²	64.5	2%	0.022	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.7	120.1	166.5	-58.9	-66.8	0	0	0	109.6	W140 V418 I420	F95-W140 HydrophobicContact CB-CD2 3.73Å; F95-W140 HydrophobicContact CB-CE3 3.74Å; F95-W140 HydrophobicContact CB-CG 4.27Å; F95-W140 HydrophobicContact CB-CH2 4.15Å; F95-W140 HydrophobicContact CB-CZ2 4.14Å; F95-W140 HydrophobicContact CB-CZ3 3.97Å; F95-W140 HydrophobicContact CD1-CB 4.43Å; F95-W140 HydrophobicContact CD1-CD2 4.16Å; F95-W140 AromaticContact CD1-CE3 3.66Å; F95-W140 HydrophobicContact CD1-CE3 3.66Å; F95-W140 HydrophobicContact CD1-CZ3 4.25Å; F95-W140 HydrophobicContact CD2-CB 4.12Å; F95-W140 HydrophobicContact CD2-CD2 4.46Å; F95-W140 HydrophobicContact CD2-CG 4.2Å; F95-W140 HydrophobicContact CE1-CB 4.46Å; F95-W140 HydrophobicContact CE1-CE3 4.46Å; F95-W140 HydrophobicContact CE2-CB 4.13Å; F95-W140 HydrophobicContact CG-CB 4.26Å; F95-W140 AromaticContact CG-CD2 3.89Å; F95-W140 HydrophobicContact CG-CD2 3.89Å; F95-W140 AromaticContact CG-CE3 3.83Å; F95-W140 HydrophobicContact CG-CE3 3.83Å; F95-W140 HydrophobicContact CG-CG 4.09Å; F95-W140 HydrophobicContact CG-CZ3 4.45Å; F95-W140 HydrophobicContact CZ-CB 4.31Å; F95-V418 HydrophobicContact CB-CB 4.15Å; F95-V418 HydrophobicContact CD2-CB 4.2Å; F95-V418 HydrophobicContact CD2-CG1 4.28Å; F95-V418 PolarHBondContact N-O 3.02Å; F95-V418 PolarHBondContact O-N 2.73Å; F95-I420 HydrophobicContact CD2-CD1 4.31Å; F95-I420 HydrophobicContact CD2-CG1 3.99Å; F95-I420 HydrophobicContact CE2-CD1 3.91Å; F95-I420 HydrophobicContact CE2-CG1 3.49Å; F95-I420 VanDerWaalsContact CE2-CG1 3.49Å; F95-I420 HydrophobicContact CZ-CG1 4.42Å
96	Y	72	Confident	69.3	Low	67 Å²	67	58.5 Å²	58.5	26%	0.263	32%	0.316	S	S	.	.			trans	-153.1	125.6	175.5	-175.8	-102.8	0	0	0	108.9	E98 S101 K102 A147 R417	Y96-E98 HydrophobicContact CE1-CG 4Å; Y96-S101 WeakPolarHBondContact CD2-OG 3.38Å; Y96-S101 WeakPolarHBondContact CE2-OG 3.45Å; Y96-K102 WeakPolarHBondContact OH-CB 3.4Å; Y96-A147 WeakPolarHBondContact O-CB 3.27Å; Y96-R417 HydrophobicContact CD2-CG 3.43Å; Y96-R417 VanDerWaalsContact CD2-CG 3.43Å; Y96-R417 HydrophobicContact CE2-CG 4.16Å; Y96-R417 HydrophobicContact CG-CG 4.05Å
97	D	71	Confident	71.5	Confident	31 Å²	31	56 Å²	56	17%	0.166	29%	0.286	C	S	.	.			trans	-114.1	122.2	171.5	-171.5	-19.3	0	0	0	109.3	H99 W100 S101 W140 P149	D97-H99 PolarHBondContact O-N 3.35Å; D97-H99 VanDerWaalsContact O-N 3.16Å; D97-H99 PolarHBondContact OD1-N 2.86Å; D97-H99 VanDerWaalsContact OD1-N 3.12Å; D97-W100 PolarHBondContact O-N 2.73Å; D97-S101 VanDerWaalsContact C-OG 3.3Å; D97-S101 PolarHBondContact N-OG 3.48Å; D97-S101 WeakPolarHBondContact O-CB 3.38Å; D97-S101 PolarHBondContact O-N 2.79Å; D97-S101 PolarHBondContact O-OG 2.86Å; D97-W140 HydrophobicContact CB-CH2 4.08Å; D97-P149 VanDerWaalsContact OD2-CD 3.31Å; D97-P149 WeakPolarHBondContact OD2-CD 3.34Å
98	E	65.7	Low	73.1	Confident	161 Å²	161	52.4 Å²	52.4	75%	0.752	26%	0.261	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.8	-28.5	-177.7	-72.9	-170.9	157.4	0	0	113.3	Y96 K102	Y96-E98 HydrophobicContact CE1-CG 4Å; E98-K102 WeakPolarHBondContact O-CB 3.49Å
99	H	67.3	Low	74.5	Confident	105 Å²	105	50.1 Å²	50.1	49%	0.486	25%	0.245	S	C	.	.	T	Hydrogen-bonded Turn	trans	-84.4	-44.2	-178.3	-170.2	41.7	0	0	0	112.3	D97 E132	D97-H99 PolarHBondContact O-N 3.35Å; D97-H99 VanDerWaalsContact O-N 3.16Å; D97-H99 PolarHBondContact OD1-N 2.86Å; D97-H99 VanDerWaalsContact OD1-N 3.12Å; H99-E132 IonicContact CE1-OE1 3.17Å; H99-E132 PolarHBondContact CE1-OE1 2.84Å; H99-E132 IonicContact ND1-OE1 2.73Å; H99-E132 IonicContact NE2-OE1 2.75Å
100	W	63.7	Low	75.5	Confident	27 Å²	27	51.5 Å²	51.5	10%	0.102	25%	0.252	C	S	.	.	T	Hydrogen-bonded Turn	trans	-100.7	-23.4	-170.2	-62.2	105.2	0	0	0	114.5	D97 R104 V136 L138 I152 H154	D97-W100 PolarHBondContact O-N 2.73Å; W100-R104 WeakPolarHBondContact O-CD 3.27Å; W100-R104 PolarHBondContact O-NE 3.04Å; W100-R104 VanDerWaalsContact O-NE 3.12Å; W100-V136 HydrophobicContact CE3-CG1 4.45Å; W100-V136 HydrophobicContact CE3-CG2 4.25Å; W100-V136 HydrophobicContact CZ3-CG2 4.4Å; W100-L138 HydrophobicContact CB-CD1 3.98Å; W100-L138 HydrophobicContact CB-CD2 4.42Å; W100-I152 HydrophobicContact CD2-CG2 4.39Å; W100-H154 AromaticContact CH2-NE2 3.25Å; W100-H154 WeakPolarHBondContact CH2-NE2 3.4Å; W100-H154 AromaticContact CZ2-NE2 3.96Å; W100-H154 AromaticContact CZ3-CD2 3.94Å; W100-H154 AromaticContact CZ3-NE2 3.53Å
101	S	64.7	Low	76.2	Confident	0 Å²	0	49.3 Å²	49.3	0%	0	24%	0.235	C	C	.	.	T	Hydrogen-bonded Turn	trans	-106.8	-9.4	-172.7	70.4	0	0	0	0	114.4	Y96 D97 H103 R104 E415 G416	Y96-S101 WeakPolarHBondContact CD2-OG 3.38Å; Y96-S101 WeakPolarHBondContact CE2-OG 3.45Å; D97-S101 VanDerWaalsContact C-OG 3.3Å; D97-S101 PolarHBondContact N-OG 3.48Å; D97-S101 WeakPolarHBondContact O-CB 3.38Å; D97-S101 PolarHBondContact O-N 2.79Å; D97-S101 PolarHBondContact O-OG 2.86Å; S101-H103 PolarHBondContact O-N 3.2Å; S101-R104 PolarHBondContact O-N 2.85Å; S101-E415 VanDerWaalsContact O-O 3.09Å; S101-G416 WeakPolarHBondContact CB-O 3.32Å
102	K	68.9	Low	76.5	Confident	107 Å²	107	44.4 Å²	44.4	47%	0.465	21%	0.213	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.8	122.7	-178.8	-170.8	173.8	-178.2	-178.3	0	111.6	Y96 E98 R104	Y96-K102 WeakPolarHBondContact OH-CB 3.4Å; E98-K102 WeakPolarHBondContact O-CB 3.49Å; K102-R104 PolarHBondContact O-N 3.27Å
103	H	69.6	Low	76.7	Confident	101 Å²	101	45 Å²	45	47%	0.468	22%	0.216	S	C	.	.	T	Hydrogen-bonded Turn	trans	57.3	21.9	179.8	-60.5	-58	0	0	0	115.2	S101 D128	S101-H103 PolarHBondContact O-N 3.2Å; H103-D128 IonicContact CD2-OD2 3.32Å; H103-D128 PolarHBondContact CD2-OD2 3.29Å; H103-D128 IonicContact CG-OD2 3.38Å
104	R	76.1	Confident	77.1	Confident	3 Å²	3	45.5 Å²	45.5	1%	0.011	22%	0.222	C	C	.	.	P	Polyproline II helix	trans	-103.2	124.1	173.2	-59.5	-164.6	-166.5	-144.3	3.2	110.3	W100 S101 K102 Y123 N126 E132 P133 G416	W100-R104 WeakPolarHBondContact O-CD 3.27Å; W100-R104 PolarHBondContact O-NE 3.04Å; W100-R104 VanDerWaalsContact O-NE 3.12Å; S101-R104 PolarHBondContact O-N 2.85Å; K102-R104 PolarHBondContact O-N 3.27Å; R104-Y123 HydrophobicContact CB-CD1 3.75Å; R104-Y123 HydrophobicContact CB-CG 4.33Å; R104-N126 HydrophobicContact CG-CB 3.89Å; R104-E132 IonicContact CZ-OE2 2.73Å; R104-E132 IonicContact NH2-OE2 3.12Å; R104-E132 PolarHBondContact NH2-OE2 2.93Å; R104-P133 PolarHBondContact NH1-O 2.72Å; R104-G416 WeakPolarHBondContact O-CA 3.36Å; R104-G416 PolarHBondContact O-N 3.1Å
105	V	80.9	Confident	77	Confident	46 Å²	46	47 Å²	47	28%	0.279	22%	0.224	S	C	.	.	P	Polyproline II helix	trans	-73.2	133.3	177	-174.3	0	0	0	0	109.6	N124 N398 S414	V105-N124 WeakPolarHBondContact CB-ND2 3.31Å; V105-N124 WeakPolarHBondContact CG2-ND2 3.47Å; V105-N124 PolarHBondContact N-OD1 2.81Å; V105-N124 PolarHBondContact O-N 2.84Å; V105-N124 PolarHBondContact O-OD1 2.88Å; V105-N398 WeakPolarHBondContact CG1-ND2 3.36Å; V105-S414 VanDerWaalsContact CA-O 3.28Å; V105-S414 WeakPolarHBondContact CA-O 3.25Å; V105-S414 WeakPolarHBondContact CG2-O 3.13Å
106	I	86.1	Confident	76.8	Confident	0 Å²	0	49.4 Å²	49.4	0%	0	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.9	121.2	169.9	-66.5	155.4	0	0	0	109.1	L109 S122 Y123 N398 D413 R417 V418	I106-L109 HydrophobicContact CG2-CD1 4.47Å; I106-L109 HydrophobicContact CG2-CD2 4Å; I106-L109 HydrophobicContact CG2-CG 3.9Å; I106-S122 WeakPolarHBondContact CA-O 2.94Å; I106-Y123 HydrophobicContact CD1-CE1 4.16Å; I106-Y123 HydrophobicContact CG1-CD1 3.99Å; I106-Y123 HydrophobicContact CG1-CE1 3.55Å; I106-N398 PolarHBondContact O-ND2 3.12Å; I106-D413 PolarHBondContact N-O 2.87Å; I106-R417 WeakPolarHBondContact CD1-O 3.31Å; I106-V418 HydrophobicContact CD1-CG2 3.53Å
107	T	83.8	Confident	77.2	Confident	27 Å²	27	47 Å²	47	17%	0.166	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.7	-32.1	-176.5	51.3	0	0	0	0	113.1	S122 N124 V159 V160 R399	T107-S122 PolarHBondContact N-O 3.2Å; T107-S122 PolarHBondContact OG1-O 3.38Å; T107-S122 PolarHBondContact OG1-OG 2.88Å; T107-N124 HydrophobicContact CG2-CB 3.9Å; T107-V159 PolarHBondContact OG1-O 3.4Å; T107-V160 WeakPolarHBondContact CB-O 3.29Å; T107-V160 PolarHBondContact OG1-O 2.57Å; T107-R399 WeakPolarHBondContact O-CG 3.41Å; T107-R399 PolarHBondContact O-NE 3.16Å
108	C	83.4	Confident	77.9	Confident	10 Å²	10	46.2 Å²	46.2	7%	0.068	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152	148	178.4	-162.1	0	0	0	0	110	S122 V162	C108-S122 WeakPolarHBondContact CA-OG 3.39Å; C108-S122 VanDerWaalsContact CB-OG 3.29Å; C108-S122 WeakPolarHBondContact CB-OG 3.44Å; C108-S122 PolarHBondContact N-OG 2.99Å; C108-S122 PolarHBondContact O-N 3.09Å; C108-S122 PolarHBondContact O-OG 3.13Å; C108-V162 HydrophobicContact CB-CG1 4.1Å
109	L	89.1	Confident	79	Confident	0 Å²	0	38.5 Å²	38.5	0%	0	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	145.7	169.1	-69.9	169.9	0	0	0	107.7	I106 L119 V120 A121 R399 R401 A410 G412 V418	I106-L109 HydrophobicContact CG2-CD1 4.47Å; I106-L109 HydrophobicContact CG2-CD2 4Å; I106-L109 HydrophobicContact CG2-CG 3.9Å; L109-L119 HydrophobicContact CB-CD1 4.42Å; L109-L119 HydrophobicContact CD2-CD1 4.35Å; L109-L119 HydrophobicContact CD2-CD2 4.4Å; L109-L119 HydrophobicContact CD2-CG 4.46Å; L109-V120 WeakPolarHBondContact CA-O 3.4Å; L109-A121 HydrophobicContact CD2-CB 3.5Å; L109-R399 HydrophobicContact CD1-CB 4.24Å; L109-R399 HydrophobicContact CG-CB 4.37Å; L109-R401 HydrophobicContact CB-CB 4.29Å; L109-R401 HydrophobicContact CB-CG 3.71Å; L109-R401 WeakPolarHBondContact O-CG 3.49Å; L109-R401 PolarHBondContact O-NE 3.17Å; L109-A410 HydrophobicContact CD1-CB 4.33Å; L109-G412 VanDerWaalsContact CD1-N 3.32Å; L109-V418 HydrophobicContact CD1-CG1 4.46Å; L109-V418 HydrophobicContact CD2-CG1 4.22Å; L109-V418 HydrophobicContact CD2-CG2 4.08Å
110	D	88.1	Confident	79.9	Confident	39 Å²	39	33.6 Å²	33.6	21%	0.209	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.8	140.3	169.2	-164.5	34.9	0	0	0	111.9	V120 V162 G163 F164	D110-V120 PolarHBondContact N-O 2.96Å; D110-V120 PolarHBondContact O-N 3.28Å; D110-V162 HydrophobicContact CB-CG1 4.49Å; D110-G163 VanDerWaalsContact OD2-CA 3.3Å; D110-G163 WeakPolarHBondContact OD2-CA 3.49Å; D110-F164 PolarHBondContact OD2-N 3.1Å
111	W	87.9	Confident	81	Confident	11 Å²	11	32.3 Å²	32.3	4%	0.042	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.7	141.7	177.5	-75	102.4	0	0	0	110.5	P113 P116 L119 I142 R401 A410 I420	W111-P113 WeakPolarHBondContact O-CD 3.37Å; W111-P116 VanDerWaalsContact CZ3-O 3.25Å; W111-P116 WeakPolarHBondContact CZ3-O 3.35Å; W111-L119 HydrophobicContact CD2-CB 4.3Å; W111-L119 HydrophobicContact CD2-CD1 3.75Å; W111-L119 HydrophobicContact CE3-CB 3.88Å; W111-L119 HydrophobicContact CE3-CD1 4.21Å; W111-L119 HydrophobicContact CG-CD1 4.08Å; W111-L119 HydrophobicContact CH2-CB 3.87Å; W111-L119 HydrophobicContact CH2-CD1 4.39Å; W111-L119 HydrophobicContact CH2-CD2 4.2Å; W111-L119 HydrophobicContact CH2-CG 4.4Å; W111-L119 HydrophobicContact CZ2-CB 4.39Å; W111-L119 HydrophobicContact CZ2-CD1 4.05Å; W111-L119 HydrophobicContact CZ2-CD2 4.18Å; W111-L119 HydrophobicContact CZ2-CG 4.46Å; W111-L119 HydrophobicContact CZ3-CB 3.61Å; W111-L119 HydrophobicContact CZ3-CD1 4.47Å; W111-L119 HydrophobicContact CZ3-CG 4.49Å; W111-I142 HydrophobicContact CH2-CD1 3.13Å; W111-I142 HydrophobicContact CH2-CG1 3.56Å; W111-I142 HydrophobicContact CZ2-CD1 4.28Å; W111-I142 HydrophobicContact CZ3-CD1 3.3Å; W111-I142 HydrophobicContact CZ3-CG1 3.73Å; W111-R401 PolarHBondContact NE1-O 2.93Å; W111-A410 HydrophobicContact CZ2-CB 3.67Å; W111-I420 HydrophobicContact CH2-CD1 4.19Å; W111-I420 HydrophobicContact CZ2-CD1 4.07Å
112	S	83.8	Confident	82	Confident	0 Å²	0	32.3 Å²	32.3	0%	0	16%	0.163	C	C	.	.			trans	-74.2	126.2	171.1	177.3	0	0	0	0	110.5	Q114 Y115 L118	S112-Q114 VanDerWaalsContact C-N 3.28Å; S112-Q114 PolarHBondContact O-N 3.01Å; S112-Q114 PolarHBondContact OG-N 3.02Å; S112-Y115 WeakPolarHBondContact CB-O 3.37Å; S112-Y115 CarbonylContact O-C 3.54Å; S112-Y115 PolarHBondContact OG-N 2.85Å; S112-L118 PolarHBondContact N-O 3.32Å
113	P	76.9	Confident	82.8	Confident	66 Å²	66	27.2 Å²	27.2	43%	0.429	14%	0.141	S	C	.	.	S	Bend	trans	-70.1	-23.1	176	-21.4	34.2	0	0	0	113.9	W111 K166	W111-P113 WeakPolarHBondContact O-CD 3.37Å; P113-K166 HydrophobicContact CG-CB 4.48Å; P113-K166 HydrophobicContact CG-CG 4.19Å
114	Q	80.6	Confident	83.2	Confident	83 Å²	83	24.4 Å²	24.4	39%	0.388	13%	0.13	S	C	.	.	S	Bend	trans	-90.8	-34.4	-178	-63.1	-165.9	3.5	0	0	112.6	S112 K166 F167 P169	S112-Q114 VanDerWaalsContact C-N 3.28Å; S112-Q114 PolarHBondContact O-N 3.01Å; S112-Q114 PolarHBondContact OG-N 3.02Å; Q114-K166 PolarHBondContact NE2-O 3.34Å; Q114-F167 PolarHBondContact NE2-O 3.49Å; Q114-P169 HydrophobicContact CB-CB 4.26Å
115	Y	79.3	Confident	83	Confident	98 Å²	98	27.2 Å²	27.2	38%	0.384	15%	0.145	S	C	.	.			trans	-120.7	90.5	177	-63.6	-55.1	0	0	0	108.1	S112 E117 L118 P169	S112-Y115 WeakPolarHBondContact CB-O 3.37Å; S112-Y115 CarbonylContact O-C 3.54Å; S112-Y115 PolarHBondContact OG-N 2.85Å; Y115-E117 PolarHBondContact O-N 2.88Å; Y115-L118 HydrophobicContact CD2-CD1 3.9Å; Y115-L118 HydrophobicContact CG-CD1 4.22Å; Y115-L118 PolarHBondContact O-N 3.03Å; Y115-P169 HydrophobicContact CD2-CB 3.86Å; Y115-P169 HydrophobicContact CE2-CB 3.46Å; Y115-P169 VanDerWaalsContact CE2-CB 3.46Å; Y115-P169 HydrophobicContact CE2-CG 4.1Å
116	P	74.7	Confident	82.3	Confident	56 Å²	56	25.8 Å²	25.8	36%	0.364	14%	0.135	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.2	-18.1	-177.8	25.9	-34.8	0	0	0	112.6	W111 L118	W111-P116 VanDerWaalsContact CZ3-O 3.25Å; W111-P116 WeakPolarHBondContact CZ3-O 3.35Å; P116-L118 VanDerWaalsContact C-N 3.33Å
117	E	80.3	Confident	81.2	Confident	17 Å²	17	34.7 Å²	34.7	8%	0.079	18%	0.177	C	C	.	.	T	Hydrogen-bonded Turn	trans	-74.4	-17.8	174.4	68.2	-90.3	-149.2	0	0	114.4	R59 Y115 N141 I142 K143	R59-E117 IonicContact CZ-OE1 3.72Å; R59-E117 IonicContact NH1-OE1 2.69Å; R59-E117 PolarHBondContact NH1-OE1 2.93Å; R59-E117 IonicContact NH2-OE1 2.72Å; R59-E117 PolarHBondContact NH2-OE1 3.43Å; Y115-E117 PolarHBondContact O-N 2.88Å; E117-N141 CarbonylContact O-C 3.17Å; E117-N141 VanDerWaalsContact O-CA 3.27Å; E117-N141 WeakPolarHBondContact O-CA 3.37Å; E117-I142 PolarHBondContact O-N 2.91Å; E117-K143 HydrophobicContact CB-CD 4.36Å; E117-K143 HydrophobicContact CB-CG 4.01Å
118	L	85.3	Confident	80	Confident	13 Å²	13	39 Å²	39	7%	0.068	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.6	122.9	-175.9	-63.6	-177.8	0	0	0	111.4	S112 Y115 P116 V139 W140 N141 E150 F164	S112-L118 PolarHBondContact N-O 3.32Å; Y115-L118 HydrophobicContact CD2-CD1 3.9Å; Y115-L118 HydrophobicContact CG-CD1 4.22Å; Y115-L118 PolarHBondContact O-N 3.03Å; P116-L118 VanDerWaalsContact C-N 3.33Å; L118-V139 HydrophobicContact CB-CG1 4.36Å; L118-V139 HydrophobicContact CD2-CG1 4.01Å; L118-W140 WeakPolarHBondContact CA-O 3.47Å; L118-N141 HydrophobicContact CD2-CB 4.06Å; L118-E150 WeakPolarHBondContact CD2-OE2 3.39Å; L118-F164 HydrophobicContact CB-CZ 4.31Å
119	L	87.5	Confident	78.8	Confident	0 Å²	0	39.7 Å²	39.7	0%	0	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	135.1	173.7	176.3	66.5	0	0	0	109.1	L109 W111 V139 W140 A410 V418 I420	L109-L119 HydrophobicContact CB-CD1 4.42Å; L109-L119 HydrophobicContact CD2-CD1 4.35Å; L109-L119 HydrophobicContact CD2-CD2 4.4Å; L109-L119 HydrophobicContact CD2-CG 4.46Å; W111-L119 HydrophobicContact CD2-CB 4.3Å; W111-L119 HydrophobicContact CD2-CD1 3.75Å; W111-L119 HydrophobicContact CE3-CB 3.88Å; W111-L119 HydrophobicContact CE3-CD1 4.21Å; W111-L119 HydrophobicContact CG-CD1 4.08Å; W111-L119 HydrophobicContact CH2-CB 3.87Å; W111-L119 HydrophobicContact CH2-CD1 4.39Å; W111-L119 HydrophobicContact CH2-CD2 4.2Å; W111-L119 HydrophobicContact CH2-CG 4.4Å; W111-L119 HydrophobicContact CZ2-CB 4.39Å; W111-L119 HydrophobicContact CZ2-CD1 4.05Å; W111-L119 HydrophobicContact CZ2-CD2 4.18Å; W111-L119 HydrophobicContact CZ2-CG 4.46Å; W111-L119 HydrophobicContact CZ3-CB 3.61Å; W111-L119 HydrophobicContact CZ3-CD1 4.47Å; W111-L119 HydrophobicContact CZ3-CG 4.49Å; L119-V139 CarbonylContact O-C 3.6Å; L119-V139 WeakPolarHBondContact O-CA 3.05Å; L119-W140 HydrophobicContact CB-CB 4.3Å; L119-W140 PolarHBondContact N-O 2.81Å; L119-W140 PolarHBondContact O-N 3.47Å; L119-A410 HydrophobicContact CD1-CB 4.06Å; L119-A410 HydrophobicContact CD2-CB 3.78Å; L119-V418 HydrophobicContact CD2-CG1 3.65Å; L119-I420 HydrophobicContact CD2-CD1 3.83Å
120	V	87.6	Confident	77.5	Confident	1 Å²	1	44.7 Å²	44.7	1%	0.006	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107	133.2	169.4	169.9	0	0	0	0	110.2	L109 D110 A137 L138 V139 V162 F164 V172	L109-V120 WeakPolarHBondContact CA-O 3.4Å; D110-V120 PolarHBondContact N-O 2.96Å; D110-V120 PolarHBondContact O-N 3.28Å; V120-A137 HydrophobicContact CG1-CB 4.49Å; V120-L138 WeakPolarHBondContact CA-O 3.25Å; V120-V139 HydrophobicContact CG2-CB 4.12Å; V120-V139 HydrophobicContact CG2-CG1 4.24Å; V120-V139 HydrophobicContact CG2-CG2 3.48Å; V120-V139 VanDerWaalsContact CG2-CG2 3.48Å; V120-V162 HydrophobicContact CB-CG1 4.45Å; V120-V162 HydrophobicContact CB-CG2 4.48Å; V120-V162 HydrophobicContact CG1-CB 4.1Å; V120-V162 HydrophobicContact CG1-CG1 3.66Å; V120-V162 HydrophobicContact CG1-CG2 3.38Å; V120-F164 HydrophobicContact CB-CD2 4.33Å; V120-F164 HydrophobicContact CB-CE2 3.61Å; V120-F164 HydrophobicContact CB-CZ 4.03Å; V120-F164 HydrophobicContact CG2-CD2 4.15Å; V120-F164 HydrophobicContact CG2-CE1 3.92Å; V120-F164 HydrophobicContact CG2-CE2 3.19Å; V120-F164 HydrophobicContact CG2-CZ 3.07Å; V120-V172 HydrophobicContact CG1-CG1 4.42Å; V120-V172 HydrophobicContact CG2-CG1 4.44Å
121	A	87.1	Confident	76.1	Confident	0 Å²	0	52 Å²	52	0%	0	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	128.8	170.9	0	0	0	0	0	110	L109 Y123 A137 L138 V418	L109-A121 HydrophobicContact CD2-CB 3.5Å; A121-Y123 HydrophobicContact CB-CE2 3.68Å; A121-A137 CarbonylContact O-C 3.47Å; A121-A137 WeakPolarHBondContact O-CA 3.44Å; A121-L138 PolarHBondContact N-O 3.35Å; A121-L138 PolarHBondContact O-N 2.9Å; A121-V418 HydrophobicContact CB-CG2 4.02Å
122	S	86	Confident	75	Confident	0 Å²	0	53.4 Å²	53.4	0%	0	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95	132.8	169.4	57.6	0	0	0	0	110.7	I106 T107 C108	I106-S122 WeakPolarHBondContact CA-O 2.94Å; T107-S122 PolarHBondContact N-O 3.2Å; T107-S122 PolarHBondContact OG1-O 3.38Å; T107-S122 PolarHBondContact OG1-OG 2.88Å; C108-S122 WeakPolarHBondContact CA-OG 3.39Å; C108-S122 VanDerWaalsContact CB-OG 3.29Å; C108-S122 WeakPolarHBondContact CB-OG 3.44Å; C108-S122 PolarHBondContact N-OG 2.99Å; C108-S122 PolarHBondContact O-N 3.09Å; C108-S122 PolarHBondContact O-OG 3.13Å
123	Y	84.6	Confident	74.2	Confident	0 Å²	0	55.3 Å²	55.3	0%	0	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	139.4	179.1	-65.8	-88.7	0	0	0	110.1	R104 I106 A121 V136 L138 W140 G416	R104-Y123 HydrophobicContact CB-CD1 3.75Å; R104-Y123 HydrophobicContact CB-CG 4.33Å; I106-Y123 HydrophobicContact CD1-CE1 4.16Å; I106-Y123 HydrophobicContact CG1-CD1 3.99Å; I106-Y123 HydrophobicContact CG1-CE1 3.55Å; A121-Y123 HydrophobicContact CB-CE2 3.68Å; Y123-V136 WeakPolarHBondContact CB-O 3.32Å; Y123-V136 PolarHBondContact N-O 3.32Å; Y123-V136 PolarHBondContact O-N 2.81Å; Y123-L138 HydrophobicContact CD2-CB 4.37Å; Y123-L138 HydrophobicContact CD2-CD1 3.91Å; Y123-L138 HydrophobicContact CD2-CG 3.79Å; Y123-L138 HydrophobicContact CE2-CB 3.78Å; Y123-L138 HydrophobicContact CE2-CD1 3.34Å; Y123-L138 HydrophobicContact CE2-CG 3.49Å; Y123-L138 VanDerWaalsContact CE2-CG 3.49Å; Y123-W140 WeakPolarHBondContact OH-CZ2 3.38Å; Y123-W140 PolarHBondContact OH-NE1 3.02Å; Y123-G416 VanDerWaalsContact CE1-O 3.32Å; Y123-G416 WeakPolarHBondContact CE1-O 3.19Å; Y123-G416 PolarHBondContact OH-O 2.74Å
124	N	78.3	Confident	73.7	Confident	43 Å²	43	55.1 Å²	55.1	23%	0.23	29%	0.286	C	S	.	.			trans	-80	-172.3	172.8	78.8	-14.3	0	0	0	112.1	V105 T107 D134	V105-N124 WeakPolarHBondContact CB-ND2 3.31Å; V105-N124 WeakPolarHBondContact CG2-ND2 3.47Å; V105-N124 PolarHBondContact N-OD1 2.81Å; V105-N124 PolarHBondContact O-N 2.84Å; V105-N124 PolarHBondContact O-OD1 2.88Å; T107-N124 HydrophobicContact CG2-CB 3.9Å; N124-D134 CarbonylContact C-O 3.57Å
125	N	71.8	Confident	73.3	Confident	62 Å²	62	51.2 Å²	51.2	33%	0.332	27%	0.267	S	S	.	.			trans	-65.4	143.9	178.6	-167.9	19	0	0	0	111.6	D134 P158	N125-D134 WeakPolarHBondContact CA-O 3.38Å; N125-D134 PolarHBondContact N-O 2.79Å; N125-D134 VanDerWaalsContact N-O 3.13Å; N125-P158 HydrophobicContact CB-CG 4.19Å
126	N	66.9	Low	73.5	Confident	15 Å²	15	46.5 Å²	46.5	8%	0.08	25%	0.249	C	C	.	.			trans	-95.8	121.1	169.7	-168.6	4	0	0	0	109.2	R104 D128	R104-N126 HydrophobicContact CG-CB 3.89Å; N126-D128 PolarHBondContact O-N 3.1Å; N126-D128 PolarHBondContact OD1-N 2.87Å; N126-D128 VanDerWaalsContact OD1-N 3.13Å
127	E	62.6	Low	73.9	Confident	187 Å²	187	43.9 Å²	43.9	87%	0.874	23%	0.231	S	C	*	.	S	Bend	trans	-70.9	-20.3	174.8	-65.6	-168.9	160.5	0	0	112.3
128	D	58.5	Low	74.2	Confident	117 Å²	117	43 Å²	43	63%	0.626	23%	0.228	S	C	*	.	S	Bend	trans	-86.8	-17.7	-175	-72.9	-32.6	0	0	0	114.7	H103 N126	H103-D128 IonicContact CD2-OD2 3.32Å; H103-D128 PolarHBondContact CD2-OD2 3.29Å; H103-D128 IonicContact CG-OD2 3.38Å; N126-D128 PolarHBondContact O-N 3.1Å; N126-D128 PolarHBondContact OD1-N 2.87Å; N126-D128 VanDerWaalsContact OD1-N 3.13Å
129	A	57	Low	74.3	Confident	26 Å²	26	42.6 Å²	42.6	22%	0.215	23%	0.225	C	C	.	.			trans	-137.3	78.7	-174.2	0	0	0	0	0	113.1	H131 E132	A129-H131 PolarHBondContact O-N 2.75Å; A129-H131 VanDerWaalsContact O-N 3.08Å; A129-E132 PolarHBondContact O-N 2.88Å
130	P	62.2	Low	74.2	Confident	104 Å²	104	42.6 Å²	42.6	68%	0.675	23%	0.225	S	C	*	.	T	Hydrogen-bonded Turn	trans	-71.5	-1.4	-176.8	28.1	-35.2	0	0	0	115.1
131	H	60.1	Low	74	Confident	192 Å²	192	42.8 Å²	42.8	89%	0.889	23%	0.226	S	C	*	.	T	Hydrogen-bonded Turn	trans	-92.4	-10.4	175.4	-69.4	-43.4	0	0	0	113.4	A129	A129-H131 PolarHBondContact O-N 2.75Å; A129-H131 VanDerWaalsContact O-N 3.08Å
132	E	64.2	Low	73.6	Confident	42 Å²	42	43.5 Å²	43.5	20%	0.196	23%	0.23	C	C	.	.	S	Bend	trans	-93.9	150.2	174.8	-71.8	176.6	-171.7	0	0	110.4	H99 R104 A129 D134	H99-E132 IonicContact CE1-OE1 3.17Å; H99-E132 PolarHBondContact CE1-OE1 2.84Å; H99-E132 IonicContact ND1-OE1 2.73Å; H99-E132 IonicContact NE2-OE1 2.75Å; R104-E132 IonicContact CZ-OE2 2.73Å; R104-E132 IonicContact NH2-OE2 3.12Å; R104-E132 PolarHBondContact NH2-OE2 2.93Å; A129-E132 PolarHBondContact O-N 2.88Å; E132-D134 PolarHBondContact O-N 2.86Å
133	P	66.4	Low	72.9	Confident	39 Å²	39	46.4 Å²	46.4	25%	0.253	24%	0.243	S	C	.	.			trans	-58.6	130.8	178.9	20.5	-30.2	0	0	0	112.3	R104 G135 V136 H154 C155	R104-P133 PolarHBondContact NH1-O 2.72Å; P133-G135 PolarHBondContact O-N 2.84Å; P133-V136 HydrophobicContact CG-CG2 4.39Å; P133-H154 HydrophobicContact CB-CB 4.06Å; P133-H154 HydrophobicContact CG-CB 3.67Å; P133-C155 WeakPolarHBondContact CB-O 3.48Å
134	D	67.8	Low	71.9	Confident	63 Å²	63	47.2 Å²	47.2	34%	0.337	25%	0.246	S	C	.	.	S	Bend	trans	-56.1	-19.4	-174.4	-62.8	17.3	0	0	0	115.3	N124 N125 E132 P158	N124-D134 CarbonylContact C-O 3.57Å; N125-D134 WeakPolarHBondContact CA-O 3.38Å; N125-D134 PolarHBondContact N-O 2.79Å; N125-D134 VanDerWaalsContact N-O 3.13Å; E132-D134 PolarHBondContact O-N 2.86Å; D134-P158 HydrophobicContact CB-CG 4.15Å
135	G	71.9	Confident	71	Confident	0 Å²	0	51.2 Å²	51.2	0%	0	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.2	128.6	176.8	0	0	0	0	0	111.1	P133 C155	P133-G135 PolarHBondContact O-N 2.84Å; G135-C155 PolarHBondContact N-O 3.18Å; G135-C155 WeakPolarHBondContact O-CA 3.4Å; G135-C155 PolarHBondContact O-N 2.85Å
136	V	83	Confident	70.6	Confident	0 Å²	0	54.1 Å²	54.1	0%	0	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	134.5	178.1	178.8	0	0	0	0	108.9	W100 Y123 P133 L138 I152 F153	W100-V136 HydrophobicContact CE3-CG1 4.45Å; W100-V136 HydrophobicContact CE3-CG2 4.25Å; W100-V136 HydrophobicContact CZ3-CG2 4.4Å; Y123-V136 WeakPolarHBondContact CB-O 3.32Å; Y123-V136 PolarHBondContact N-O 3.32Å; Y123-V136 PolarHBondContact O-N 2.81Å; P133-V136 HydrophobicContact CG-CG2 4.39Å; V136-L138 HydrophobicContact CG1-CD2 3.52Å; V136-L138 HydrophobicContact CG1-CG 4.01Å; V136-I152 HydrophobicContact CG1-CG2 4.01Å; V136-F153 CarbonylContact C-O 3.5Å; V136-F153 VanDerWaalsContact CA-O 3.3Å; V136-F153 WeakPolarHBondContact CA-O 3.14Å
137	A	83.6	Confident	70.4	Confident	0 Å²	0	55.5 Å²	55.5	0%	0	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	124.5	167	0	0	0	0	0	108.4	V120 A121 F153 W184	V120-A137 HydrophobicContact CG1-CB 4.49Å; A121-A137 CarbonylContact O-C 3.47Å; A121-A137 WeakPolarHBondContact O-CA 3.44Å; A137-F153 HydrophobicContact CB-CB 4.21Å; A137-F153 HydrophobicContact CB-CD2 4.49Å; A137-F153 PolarHBondContact N-O 2.66Å; A137-F153 PolarHBondContact O-N 2.77Å; A137-W184 HydrophobicContact CB-CH2 3.62Å; A137-W184 HydrophobicContact CB-CZ2 4.11Å; A137-W184 HydrophobicContact CB-CZ3 3.96Å
138	L	85.9	Confident	70.8	Confident	0 Å²	0	50.2 Å²	50.2	0%	0	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	131	178	-56.4	-179.1	0	0	0	109	W100 V120 A121 Y123 V136 W140 P149 Y151 I152	W100-L138 HydrophobicContact CB-CD1 3.98Å; W100-L138 HydrophobicContact CB-CD2 4.42Å; V120-L138 WeakPolarHBondContact CA-O 3.25Å; A121-L138 PolarHBondContact N-O 3.35Å; A121-L138 PolarHBondContact O-N 2.9Å; Y123-L138 HydrophobicContact CD2-CB 4.37Å; Y123-L138 HydrophobicContact CD2-CD1 3.91Å; Y123-L138 HydrophobicContact CD2-CG 3.79Å; Y123-L138 HydrophobicContact CE2-CB 3.78Å; Y123-L138 HydrophobicContact CE2-CD1 3.34Å; Y123-L138 HydrophobicContact CE2-CG 3.49Å; Y123-L138 VanDerWaalsContact CE2-CG 3.49Å; V136-L138 HydrophobicContact CG1-CD2 3.52Å; V136-L138 HydrophobicContact CG1-CG 4.01Å; L138-W140 HydrophobicContact CB-CZ2 4.22Å; L138-W140 HydrophobicContact CD1-CH2 4.16Å; L138-W140 HydrophobicContact CD1-CZ2 3.53Å; L138-P149 HydrophobicContact CB-CB 3.99Å; L138-P149 HydrophobicContact CD1-CB 4.39Å; L138-P149 HydrophobicContact CD1-CG 4.33Å; L138-P149 HydrophobicContact CD2-CB 4.09Å; L138-P149 HydrophobicContact CD2-CG 4.02Å; L138-P149 HydrophobicContact CG-CB 4.4Å; L138-Y151 WeakPolarHBondContact CA-O 3.31Å; L138-I152 HydrophobicContact CD2-CB 4.1Å; L138-I152 HydrophobicContact CD2-CG1 3.82Å; L138-I152 HydrophobicContact CD2-CG2 3.82Å
139	V	87.6	Confident	71.5	Confident	3 Å²	3	45.4 Å²	45.4	2%	0.018	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93	116.5	166.6	-176.5	0	0	0	0	107.5	L118 L119 V120 P149 E150 Y151 F153	L118-V139 HydrophobicContact CB-CG1 4.36Å; L118-V139 HydrophobicContact CD2-CG1 4.01Å; L119-V139 CarbonylContact O-C 3.6Å; L119-V139 WeakPolarHBondContact O-CA 3.05Å; V120-V139 HydrophobicContact CG2-CB 4.12Å; V120-V139 HydrophobicContact CG2-CG1 4.24Å; V120-V139 HydrophobicContact CG2-CG2 3.48Å; V120-V139 VanDerWaalsContact CG2-CG2 3.48Å; V139-P149 CarbonylContact O-C 3.53Å; V139-E150 PolarHBondContact O-N 3.23Å; V139-Y151 HydrophobicContact CB-CD2 3.97Å; V139-Y151 HydrophobicContact CB-CG 4.44Å; V139-Y151 HydrophobicContact CG1-CD2 4.12Å; V139-Y151 HydrophobicContact CG2-CD2 4.11Å; V139-Y151 HydrophobicContact CG2-CG 4.38Å; V139-Y151 PolarHBondContact N-O 3.4Å; V139-F153 HydrophobicContact CG2-CD2 4.3Å; V139-F153 HydrophobicContact CG2-CE2 3.65Å
140	W	86.2	Confident	72.4	Confident	1 Å²	1	45.7 Å²	45.7	0%	0.004	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.5	149.3	171.4	-58	107	0	0	0	110.1	F95 D97 L118 L119 Y123 L138 A147 P149	F95-W140 HydrophobicContact CB-CD2 3.73Å; F95-W140 HydrophobicContact CB-CE3 3.74Å; F95-W140 HydrophobicContact CB-CG 4.27Å; F95-W140 HydrophobicContact CB-CH2 4.15Å; F95-W140 HydrophobicContact CB-CZ2 4.14Å; F95-W140 HydrophobicContact CB-CZ3 3.97Å; F95-W140 HydrophobicContact CD1-CB 4.43Å; F95-W140 HydrophobicContact CD1-CD2 4.16Å; F95-W140 AromaticContact CD1-CE3 3.66Å; F95-W140 HydrophobicContact CD1-CE3 3.66Å; F95-W140 HydrophobicContact CD1-CZ3 4.25Å; F95-W140 HydrophobicContact CD2-CB 4.12Å; F95-W140 HydrophobicContact CD2-CD2 4.46Å; F95-W140 HydrophobicContact CD2-CG 4.2Å; F95-W140 HydrophobicContact CE1-CB 4.46Å; F95-W140 HydrophobicContact CE1-CE3 4.46Å; F95-W140 HydrophobicContact CE2-CB 4.13Å; F95-W140 HydrophobicContact CG-CB 4.26Å; F95-W140 AromaticContact CG-CD2 3.89Å; F95-W140 HydrophobicContact CG-CD2 3.89Å; F95-W140 AromaticContact CG-CE3 3.83Å; F95-W140 HydrophobicContact CG-CE3 3.83Å; F95-W140 HydrophobicContact CG-CG 4.09Å; F95-W140 HydrophobicContact CG-CZ3 4.45Å; F95-W140 HydrophobicContact CZ-CB 4.31Å; D97-W140 HydrophobicContact CB-CH2 4.08Å; L118-W140 WeakPolarHBondContact CA-O 3.47Å; L119-W140 HydrophobicContact CB-CB 4.3Å; L119-W140 PolarHBondContact N-O 2.81Å; L119-W140 PolarHBondContact O-N 3.47Å; Y123-W140 WeakPolarHBondContact OH-CZ2 3.38Å; Y123-W140 PolarHBondContact OH-NE1 3.02Å; L138-W140 HydrophobicContact CB-CZ2 4.22Å; L138-W140 HydrophobicContact CD1-CH2 4.16Å; L138-W140 HydrophobicContact CD1-CZ2 3.53Å; W140-A147 VanDerWaalsContact CZ3-O 3.29Å; W140-A147 WeakPolarHBondContact CZ3-O 3.25Å; W140-P149 HydrophobicContact CD2-CB 4.42Å; W140-P149 HydrophobicContact CE3-CB 4.02Å; W140-P149 HydrophobicContact CH2-CB 4.12Å; W140-P149 HydrophobicContact CH2-CG 4.31Å; W140-P149 HydrophobicContact CZ2-CB 4.5Å; W140-P149 HydrophobicContact CZ3-CB 3.86Å; W140-P149 HydrophobicContact CZ3-CG 4.3Å
141	N	82.9	Confident	73.1	Confident	4 Å²	4	43.1 Å²	43.1	2%	0.021	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	125.8	175	-168.3	-36	0	0	0	108.7	E117 L118 K143 F144 E150	E117-N141 CarbonylContact O-C 3.17Å; E117-N141 VanDerWaalsContact O-CA 3.27Å; E117-N141 WeakPolarHBondContact O-CA 3.37Å; L118-N141 HydrophobicContact CD2-CB 4.06Å; N141-K143 PolarHBondContact O-N 3.22Å; N141-K143 WeakPolarHBondContact OD1-CB 3.4Å; N141-K143 PolarHBondContact OD1-N 3.29Å; N141-F144 HydrophobicContact CB-CD2 3.5Å; N141-F144 HydrophobicContact CB-CE2 4.06Å; N141-F144 HydrophobicContact CB-CG 4.4Å; N141-F144 PolarHBondContact O-N 3.2Å; N141-E150 WeakPolarHBondContact CB-OE2 3.44Å; N141-E150 PolarHBondContact ND2-OE2 2.9Å
142	I	77.6	Confident	74.3	Confident	15 Å²	15	35.6 Å²	35.6	8%	0.077	18%	0.18	C	C	.	.	S	Bend	trans	-66.8	-27.1	178.2	-52.1	170.3	0	0	0	111.7	R93 W111 E117 E408	R93-I142 PolarHBondContact NH1-O 3.33Å; W111-I142 HydrophobicContact CH2-CD1 3.13Å; W111-I142 HydrophobicContact CH2-CG1 3.56Å; W111-I142 HydrophobicContact CZ2-CD1 4.28Å; W111-I142 HydrophobicContact CZ3-CD1 3.3Å; W111-I142 HydrophobicContact CZ3-CG1 3.73Å; E117-I142 PolarHBondContact O-N 2.91Å; I142-E408 WeakPolarHBondContact CD1-OE2 3.48Å
143	K	71.7	Confident	75.2	Confident	62 Å²	62	33.9 Å²	33.9	27%	0.27	17%	0.172	S	C	.	.	S	Bend	trans	-69.6	-42	-179.4	-65.4	-169.2	172.4	-159	0	110.7	R59 A62 E63 R93 E117 N141 K145	R59-K143 HydrophobicContact CG-CD 4.22Å; A62-K143 WeakPolarHBondContact CB-O 3.46Å; E63-K143 IonicContact OE1-NZ 3.91Å; E63-K143 PolarHBondContact OE1-NZ 3.13Å; R93-K143 PolarHBondContact NH1-O 3.43Å; E117-K143 HydrophobicContact CB-CD 4.36Å; E117-K143 HydrophobicContact CB-CG 4.01Å; N141-K143 PolarHBondContact O-N 3.22Å; N141-K143 WeakPolarHBondContact OD1-CB 3.4Å; N141-K143 PolarHBondContact OD1-N 3.29Å; K143-K145 PolarHBondContact O-N 3.2Å
144	F	64.8	Low	76	Confident	17 Å²	17	33.5 Å²	33.5	8%	0.075	17%	0.167	C	C	.	.			trans	-62.6	126.5	-178.3	-71.6	-55.2	0	0	0	112.7	R55 E58 R59 R93 N141 K146 E150	R55-F144 HydrophobicContact CB-CZ 4.16Å; R55-F144 HydrophobicContact CG-CZ 4.48Å; R55-F144 WeakPolarHBondContact O-CE1 3.31Å; R55-F144 WeakPolarHBondContact O-CZ 3.5Å; E58-F144 HydrophobicContact CB-CD1 3.75Å; E58-F144 HydrophobicContact CB-CE1 3.41Å; E58-F144 VanDerWaalsContact CB-CE1 3.41Å; R59-F144 HydrophobicContact CB-CE1 4.19Å; R59-F144 HydrophobicContact CB-CZ 4.38Å; R93-F144 VanDerWaalsContact NH1-C 3.32Å; R93-F144 PolarHBondContact NH1-O 3.41Å; N141-F144 HydrophobicContact CB-CD2 3.5Å; N141-F144 HydrophobicContact CB-CE2 4.06Å; N141-F144 HydrophobicContact CB-CG 4.4Å; N141-F144 PolarHBondContact O-N 3.2Å; F144-K146 VanDerWaalsContact C-N 3.28Å; F144-K146 PolarHBondContact O-N 2.93Å; F144-E150 HydrophobicContact CE2-CG 4.16Å
145	K	59.3	Low	76.5	Confident	127 Å²	127	30.7 Å²	30.7	55%	0.552	15%	0.152	S	C	*	.	S	Bend	trans	-73.5	-15.9	175.1	-81.6	-179.5	177.6	172.8	0	113.6	A62 D64 K143	A62-K145 HydrophobicContact CB-CG 4.3Å; D64-K145 IonicContact OD1-NZ 3.21Å; D64-K145 IonicContact OD2-NZ 3.36Å; D64-K145 PolarHBondContact OD2-NZ 3.47Å; K143-K145 PolarHBondContact O-N 3.2Å
146	K	61.8	Low	76.7	Confident	123 Å²	123	37.6 Å²	37.6	54%	0.535	18%	0.184	S	C	.	.	S	Bend	trans	-88	142.2	176.6	-70.6	178	-178.2	165.1	0	110.3	E58 F144 T148	E58-K146 IonicContact OE1-NZ 2.57Å; E58-K146 PolarHBondContact OE1-NZ 2.73Å; F144-K146 VanDerWaalsContact C-N 3.28Å; F144-K146 PolarHBondContact O-N 2.93Å; K146-T148 PolarHBondContact O-N 3.32Å
147	A	64.1	Low	76.6	Confident	43 Å²	43	38.6 Å²	38.6	36%	0.355	19%	0.191	S	C	.	.	S	Bend	trans	-76.2	24.9	174.5	0	0	0	0	0	113.5	Y96 W140	Y96-A147 WeakPolarHBondContact O-CB 3.27Å; W140-A147 VanDerWaalsContact CZ3-O 3.29Å; W140-A147 WeakPolarHBondContact CZ3-O 3.25Å
148	T	69.6	Low	76.5	Confident	76 Å²	76	40 Å²	40	47%	0.466	20%	0.2	S	C	.	.			trans	-95.2	133.2	177.2	51	0	0	0	0	110.1	K146	K146-T148 PolarHBondContact O-N 3.32Å
149	P	74.3	Confident	76.5	Confident	17 Å²	17	40 Å²	40	11%	0.11	20%	0.2	C	C	.	.			trans	-68.8	144.1	178	28.9	-34.7	0	0	0	111.5	D97 L138 V139 W140 I152	D97-P149 VanDerWaalsContact OD2-CD 3.31Å; D97-P149 WeakPolarHBondContact OD2-CD 3.34Å; L138-P149 HydrophobicContact CB-CB 3.99Å; L138-P149 HydrophobicContact CD1-CB 4.39Å; L138-P149 HydrophobicContact CD1-CG 4.33Å; L138-P149 HydrophobicContact CD2-CB 4.09Å; L138-P149 HydrophobicContact CD2-CG 4.02Å; L138-P149 HydrophobicContact CG-CB 4.4Å; V139-P149 CarbonylContact O-C 3.53Å; W140-P149 HydrophobicContact CD2-CB 4.42Å; W140-P149 HydrophobicContact CE3-CB 4.02Å; W140-P149 HydrophobicContact CH2-CB 4.12Å; W140-P149 HydrophobicContact CH2-CG 4.31Å; W140-P149 HydrophobicContact CZ2-CB 4.5Å; W140-P149 HydrophobicContact CZ3-CB 3.86Å; W140-P149 HydrophobicContact CZ3-CG 4.3Å; P149-I152 HydrophobicContact CB-CG1 4.36Å; P149-I152 HydrophobicContact CG-CD1 4.11Å; P149-I152 HydrophobicContact CG-CG1 3.8Å
150	E	74.7	Confident	76.4	Confident	32 Å²	32	40.6 Å²	40.6	15%	0.15	20%	0.204	C	C	.	.	S	Bend	trans	-75.9	-39.5	-178.7	-172.5	177.6	163.3	0	0	111.9	R55 L118 V139 N141 F144	R55-E150 PolarHBondContact NH1-O 3.35Å; R55-E150 PolarHBondContact NH2-O 3.12Å; L118-E150 WeakPolarHBondContact CD2-OE2 3.39Å; V139-E150 PolarHBondContact O-N 3.23Å; N141-E150 WeakPolarHBondContact CB-OE2 3.44Å; N141-E150 PolarHBondContact ND2-OE2 2.9Å; F144-E150 HydrophobicContact CE2-CG 4.16Å
151	Y	78.8	Confident	76.3	Confident	50 Å²	50	40.6 Å²	40.6	20%	0.196	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.2	135.8	175.2	-58.7	-79.9	0	0	0	110.4	R55 L138 V139 F153 N186	R55-Y151 VanDerWaalsContact NH1-CE1 3.27Å; L138-Y151 WeakPolarHBondContact CA-O 3.31Å; V139-Y151 HydrophobicContact CB-CD2 3.97Å; V139-Y151 HydrophobicContact CB-CG 4.44Å; V139-Y151 HydrophobicContact CG1-CD2 4.12Å; V139-Y151 HydrophobicContact CG2-CD2 4.11Å; V139-Y151 HydrophobicContact CG2-CG 4.38Å; V139-Y151 PolarHBondContact N-O 3.4Å; Y151-F153 HydrophobicContact CG-CZ 4.44Å; Y151-N186 HydrophobicContact CE1-CB 4.25Å; Y151-N186 HydrophobicContact CE2-CB 4.44Å
152	I	84.9	Confident	76.5	Confident	33 Å²	33	40.6 Å²	40.6	17%	0.169	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	113.5	177	-55.3	167.5	0	0	0	106.8	W100 V136 L138 P149 H154	W100-I152 HydrophobicContact CD2-CG2 4.39Å; V136-I152 HydrophobicContact CG1-CG2 4.01Å; L138-I152 HydrophobicContact CD2-CB 4.1Å; L138-I152 HydrophobicContact CD2-CG1 3.82Å; L138-I152 HydrophobicContact CD2-CG2 3.82Å; P149-I152 HydrophobicContact CB-CG1 4.36Å; P149-I152 HydrophobicContact CG-CD1 4.11Å; P149-I152 HydrophobicContact CG-CG1 3.8Å; I152-H154 WeakPolarHBondContact CG2-NE2 3.3Å
153	F	82.9	Confident	76.8	Confident	6 Å²	6	40.1 Å²	40.1	3%	0.026	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	127.5	174.9	-60.7	-59.1	0	0	0	109.8	V136 A137 V139 Y151 V172 W184	V136-F153 CarbonylContact C-O 3.5Å; V136-F153 VanDerWaalsContact CA-O 3.3Å; V136-F153 WeakPolarHBondContact CA-O 3.14Å; A137-F153 HydrophobicContact CB-CB 4.21Å; A137-F153 HydrophobicContact CB-CD2 4.49Å; A137-F153 PolarHBondContact N-O 2.66Å; A137-F153 PolarHBondContact O-N 2.77Å; V139-F153 HydrophobicContact CG2-CD2 4.3Å; V139-F153 HydrophobicContact CG2-CE2 3.65Å; Y151-F153 HydrophobicContact CG-CZ 4.44Å; F153-V172 HydrophobicContact CE2-CG2 4.14Å; F153-W184 HydrophobicContact CB-CD2 3.99Å; F153-W184 HydrophobicContact CB-CG 4.01Å; F153-W184 HydrophobicContact CB-CZ2 4.18Å; F153-W184 HydrophobicContact CD1-CB 3.8Å; F153-W184 AromaticContact CD1-CD1 3.79Å; F153-W184 AromaticContact CD1-CG 3.85Å; F153-W184 HydrophobicContact CD1-CG 3.85Å; F153-W184 HydrophobicContact CD2-CB 4.29Å; F153-W184 HydrophobicContact CD2-CD2 4.34Å; F153-W184 HydrophobicContact CD2-CG 4.27Å; F153-W184 HydrophobicContact CE1-CB 3.82Å; F153-W184 HydrophobicContact CE1-CG 4.38Å; F153-W184 HydrophobicContact CE2-CB 4.3Å; F153-W184 HydrophobicContact CG-CB 4.05Å; F153-W184 AromaticContact CG-CD1 3.88Å; F153-W184 HydrophobicContact CG-CD2 4.08Å; F153-W184 AromaticContact CG-CG 3.78Å; F153-W184 HydrophobicContact CG-CG 3.78Å; F153-W184 HydrophobicContact CZ-CB 4.08Å
154	H	82.2	Confident	77.4	Confident	32 Å²	32	37.6 Å²	37.6	15%	0.148	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.5	139.5	177.8	-54.5	127.1	0	0	0	110.6	W100 P133 I152 R191 P193	W100-H154 AromaticContact CH2-NE2 3.25Å; W100-H154 WeakPolarHBondContact CH2-NE2 3.4Å; W100-H154 AromaticContact CZ2-NE2 3.96Å; W100-H154 AromaticContact CZ3-CD2 3.94Å; W100-H154 AromaticContact CZ3-NE2 3.53Å; P133-H154 HydrophobicContact CB-CB 4.06Å; P133-H154 HydrophobicContact CG-CB 3.67Å; I152-H154 WeakPolarHBondContact CG2-NE2 3.3Å; H154-R191 WeakPolarHBondContact CE1-CD 3.48Å; H154-R191 PolarHBondContact N-O 2.95Å; H154-R191 VanDerWaalsContact ND1-CB 3.27Å; H154-R191 WeakPolarHBondContact ND1-CB 2.98Å; H154-P193 WeakPolarHBondContact O-CD 3.45Å
155	C	78.3	Confident	78.2	Confident	3 Å²	3	36.8 Å²	36.8	2%	0.02	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.2	145.9	171.4	-93.3	0	0	0	0	110.9	P133 G135 S157 V159 W184	P133-C155 WeakPolarHBondContact CB-O 3.48Å; G135-C155 PolarHBondContact N-O 3.18Å; G135-C155 WeakPolarHBondContact O-CA 3.4Å; G135-C155 PolarHBondContact O-N 2.85Å; C155-S157 WeakPolarHBondContact CB-O 3.32Å; C155-S157 PolarHBondContact O-N 3.19Å; C155-V159 HydrophobicContact CB-CG2 3.89Å; C155-W184 HydrophobicContact CB-CZ2 4.39Å; C155-W184 WeakPolarHBondContact SG-CZ2 3.39Å
156	Q	76.4	Confident	78.8	Confident	145 Å²	145	34.8 Å²	34.8	68%	0.678	18%	0.18	S	C	*	.	S	Bend	trans	-75.2	-10	179.2	-69.3	176.5	-27.3	0	0	113
157	S	80.6	Confident	79.6	Confident	21 Å²	21	31.4 Å²	31.4	15%	0.147	17%	0.165	C	C	.	.	S	Bend	trans	-132.2	147.9	179	-178.4	0	0	0	0	108	C155 V159 S178	C155-S157 WeakPolarHBondContact CB-O 3.32Å; C155-S157 PolarHBondContact O-N 3.19Å; S157-V159 PolarHBondContact O-N 2.77Å; S157-S178 PolarHBondContact OG-OG 3.15Å
158	P	82.5	Confident	80.1	Confident	29 Å²	29	33.1 Å²	33.1	19%	0.188	17%	0.166	C	C	.	.			trans	-54.4	135	178.1	-25.6	34.2	0	0	0	111.5	N125 D134 T176 Y177	N125-P158 HydrophobicContact CB-CG 4.19Å; D134-P158 HydrophobicContact CB-CG 4.15Å; P158-T176 CarbonylContact O-C 3.5Å; P158-T176 VanDerWaalsContact O-CA 3.29Å; P158-T176 WeakPolarHBondContact O-CA 3.31Å; P158-Y177 PolarHBondContact O-N 2.91Å
159	V	85	Confident	80.4	Confident	0 Å²	0	30.5 Å²	30.5	0%	0	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.2	119.4	177.5	-177.9	0	0	0	0	107.7	T107 C155 S157 S161 W184	T107-V159 PolarHBondContact OG1-O 3.4Å; C155-V159 HydrophobicContact CB-CG2 3.89Å; S157-V159 PolarHBondContact O-N 2.77Å; V159-S161 VanDerWaalsContact CG1-O 3.24Å; V159-S161 WeakPolarHBondContact CG1-O 3.25Å; V159-W184 HydrophobicContact CG1-CH2 4.11Å; V159-W184 HydrophobicContact CG2-CH2 3.93Å; V159-W184 HydrophobicContact CG2-CZ2 4.14Å
160	V	86.2	Confident	80.8	Confident	17 Å²	17	31.9 Å²	31.9	10%	0.103	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.2	-36	-178.6	179.3	0	0	0	0	110.5	T107 G175 Y177 P207 Y209	T107-V160 WeakPolarHBondContact CB-O 3.29Å; T107-V160 PolarHBondContact OG1-O 2.57Å; V160-G175 PolarHBondContact N-O 3.4Å; V160-Y177 HydrophobicContact CG2-CD2 4.1Å; V160-P207 HydrophobicContact CG2-CB 4.46Å; V160-Y209 HydrophobicContact CG1-CD1 3.66Å; V160-Y209 HydrophobicContact CG1-CE1 4.18Å
161	S	83.6	Confident	81.3	Confident	1 Å²	1	31.9 Å²	31.9	1%	0.007	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.7	148.4	-179.2	53.7	0	0	0	0	110.9	V159 G174 G175 V208 Y209 V211	V159-S161 VanDerWaalsContact CG1-O 3.24Å; V159-S161 WeakPolarHBondContact CG1-O 3.25Å; S161-G174 CarbonylContact O-C 3.57Å; S161-G174 VanDerWaalsContact O-CA 3.31Å; S161-G174 WeakPolarHBondContact O-CA 3.36Å; S161-G175 PolarHBondContact N-O 2.82Å; S161-G175 PolarHBondContact O-N 2.84Å; S161-V208 PolarHBondContact OG-O 3.07Å; S161-Y209 WeakPolarHBondContact CB-O 3.3Å; S161-V211 WeakPolarHBondContact OG-CG2 3.23Å
162	V	88	Confident	81.7	Confident	4 Å²	4	29.6 Å²	29.6	2%	0.024	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.6	145.4	177.2	73.3	0	0	0	0	108.8	C108 D110 V120 V172 V173 W184	C108-V162 HydrophobicContact CB-CG1 4.1Å; D110-V162 HydrophobicContact CB-CG1 4.49Å; V120-V162 HydrophobicContact CB-CG1 4.45Å; V120-V162 HydrophobicContact CB-CG2 4.48Å; V120-V162 HydrophobicContact CG1-CB 4.1Å; V120-V162 HydrophobicContact CG1-CG1 3.66Å; V120-V162 HydrophobicContact CG1-CG2 3.38Å; V162-V172 HydrophobicContact CG2-CG1 3.73Å; V162-V173 CarbonylContact C-O 3.56Å; V162-V173 WeakPolarHBondContact CA-O 2.97Å; V162-V173 WeakPolarHBondContact CG2-O 3.12Å; V162-W184 HydrophobicContact CG2-CZ3 3.96Å
163	G	84.1	Confident	81.8	Confident	4 Å²	4	28.1 Å²	28.1	4%	0.041	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.8	136.9	178	0	0	0	0	0	111.2	D110 V173	D110-G163 VanDerWaalsContact OD2-CA 3.3Å; D110-G163 WeakPolarHBondContact OD2-CA 3.49Å; G163-V173 PolarHBondContact N-O 3.32Å; G163-V173 PolarHBondContact O-N 2.9Å
164	F	84.3	Confident	82	Confident	9 Å²	9	27.8 Å²	27.8	4%	0.039	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76	143.4	170	-83.3	-76.8	0	0	0	111.2	D110 L118 V120 K166 V172	D110-F164 PolarHBondContact OD2-N 3.1Å; L118-F164 HydrophobicContact CB-CZ 4.31Å; V120-F164 HydrophobicContact CB-CD2 4.33Å; V120-F164 HydrophobicContact CB-CE2 3.61Å; V120-F164 HydrophobicContact CB-CZ 4.03Å; V120-F164 HydrophobicContact CG2-CD2 4.15Å; V120-F164 HydrophobicContact CG2-CE1 3.92Å; V120-F164 HydrophobicContact CG2-CE2 3.19Å; V120-F164 HydrophobicContact CG2-CZ 3.07Å; F164-K166 PolarHBondContact O-N 3.47Å; F164-V172 HydrophobicContact CD1-CG2 3.81Å; F164-V172 HydrophobicContact CE1-CG2 3.59Å; F164-V172 HydrophobicContact CZ-CG2 4.48Å
165	A	80.3	Confident	82.2	Confident	1 Å²	1	26.3 Å²	26.3	1%	0.008	13%	0.133	C	C	.	.			trans	-73.5	113.1	167.5	0	0	0	0	0	109.7	F167 H168 L171 L236	A165-F167 PolarHBondContact O-N 3.4Å; A165-H168 HydrophobicContact CB-CB 4.17Å; A165-H168 CarbonylContact O-C 3.56Å; A165-H168 PolarHBondContact O-N 3.07Å; A165-H168 VanDerWaalsContact O-O 3.11Å; A165-L171 HydrophobicContact CB-CB 3.93Å; A165-L171 PolarHBondContact N-O 2.87Å; A165-L171 VanDerWaalsContact N-O 3.14Å; A165-L236 HydrophobicContact CB-CD1 4.48Å
166	K	73.3	Confident	82.6	Confident	85 Å²	85	26.2 Å²	26.2	37%	0.37	13%	0.132	S	C	.	.	T	Hydrogen-bonded Turn	trans	-52.9	-31.4	-177.6	-58.2	-173.6	177.2	167.2	0	114.2	P113 Q114 F164 V213	P113-K166 HydrophobicContact CG-CB 4.48Å; P113-K166 HydrophobicContact CG-CG 4.19Å; Q114-K166 PolarHBondContact NE2-O 3.34Å; F164-K166 PolarHBondContact O-N 3.47Å; K166-V213 VanDerWaalsContact CE-O 3.3Å; K166-V213 WeakPolarHBondContact CE-O 3.35Å; K166-V213 PolarHBondContact NZ-O 3.13Å
167	F	77.2	Confident	83.1	Confident	52 Å²	52	26 Å²	26	23%	0.228	13%	0.126	C	C	.	.	T	Hydrogen-bonded Turn	trans	-102.1	-20.2	-174.4	-57	-75.1	0	0	0	113.9	Q114 A165 G215 Q217 N220	Q114-F167 PolarHBondContact NE2-O 3.49Å; A165-F167 PolarHBondContact O-N 3.4Å; F167-G215 WeakPolarHBondContact CE2-O 3.36Å; F167-G215 WeakPolarHBondContact CZ-O 3.48Å; F167-Q217 HydrophobicContact CB-CG 4.38Å; F167-Q217 HydrophobicContact CD1-CB 3.79Å; F167-Q217 HydrophobicContact CD1-CG 4.3Å; F167-Q217 HydrophobicContact CE1-CB 4.27Å; F167-Q217 HydrophobicContact CG-CB 4.28Å; F167-N220 WeakPolarHBondContact CD2-OD1 3.35Å; F167-N220 WeakPolarHBondContact CE2-OD1 3.44Å
168	H	76	Confident	83.3	Confident	78 Å²	78	26.7 Å²	26.7	36%	0.361	13%	0.131	S	C	.	.			trans	-122.4	100.2	-178.8	-67.5	98.7	0	0	0	108.4	A165 N170 L171	A165-H168 HydrophobicContact CB-CB 4.17Å; A165-H168 CarbonylContact O-C 3.56Å; A165-H168 PolarHBondContact O-N 3.07Å; A165-H168 VanDerWaalsContact O-O 3.11Å; H168-N170 PolarHBondContact O-N 2.91Å; H168-L171 HydrophobicContact CB-CB 4.1Å; H168-L171 HydrophobicContact CB-CD1 3.75Å; H168-L171 HydrophobicContact CB-CG 3.88Å; H168-L171 PolarHBondContact O-N 3.36Å; H168-L171 VanDerWaalsContact O-N 3.11Å
169	P	75.4	Confident	83.3	Confident	21 Å²	21	25.4 Å²	25.4	14%	0.136	12%	0.123	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66.9	-17.2	-172	27.1	-31.8	0	0	0	112.8	Q114 Y115	Q114-P169 HydrophobicContact CB-CB 4.26Å; Y115-P169 HydrophobicContact CD2-CB 3.86Å; Y115-P169 HydrophobicContact CE2-CB 3.46Å; Y115-P169 VanDerWaalsContact CE2-CB 3.46Å; Y115-P169 HydrophobicContact CE2-CG 4.1Å
170	N	82.1	Confident	83.3	Confident	47 Å²	47	27.9 Å²	27.9	25%	0.251	14%	0.135	S	C	.	.	T	Hydrogen-bonded Turn	trans	-88.3	-14.5	-176.2	-66.7	-18.4	0	0	0	113.2	H168 D185 N186 R187	H168-N170 PolarHBondContact O-N 2.91Å; N170-D185 WeakPolarHBondContact O-CA 3.38Å; N170-N186 VanDerWaalsContact CA-CG 3.44Å; N170-N186 WeakPolarHBondContact CA-ND2 3.46Å; N170-N186 WeakPolarHBondContact CA-OD1 3.4Å; N170-N186 WeakPolarHBondContact CB-OD1 3.41Å; N170-N186 PolarHBondContact O-N 3.28Å; N170-N186 PolarHBondContact O-OD1 3.16Å; N170-N186 PolarHBondContact OD1-ND2 2.89Å; N170-N186 PolarHBondContact OD1-OD1 3.15Å; N170-R187 HydrophobicContact CB-CG 4.09Å
171	L	85.5	Confident	83.4	Confident	31 Å²	31	27.1 Å²	27.1	16%	0.162	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.4	125.5	-176.2	-62.4	-177.6	0	0	0	110.5	A165 H168 L183 W184 D185	A165-L171 HydrophobicContact CB-CB 3.93Å; A165-L171 PolarHBondContact N-O 2.87Å; A165-L171 VanDerWaalsContact N-O 3.14Å; H168-L171 HydrophobicContact CB-CB 4.1Å; H168-L171 HydrophobicContact CB-CD1 3.75Å; H168-L171 HydrophobicContact CB-CG 3.88Å; H168-L171 PolarHBondContact O-N 3.36Å; H168-L171 VanDerWaalsContact O-N 3.11Å; L171-L183 HydrophobicContact CD2-CD2 3.89Å; L171-W184 WeakPolarHBondContact CA-O 3.47Å; L171-D185 HydrophobicContact CD2-CB 4.05Å
172	V	87	Confident	83.6	Confident	3 Å²	3	27.1 Å²	27.1	2%	0.018	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	133.6	171.6	-172.5	0	0	0	0	107.9	V120 F153 V162 F164 W184	V120-V172 HydrophobicContact CG1-CG1 4.42Å; V120-V172 HydrophobicContact CG2-CG1 4.44Å; F153-V172 HydrophobicContact CE2-CG2 4.14Å; V162-V172 HydrophobicContact CG2-CG1 3.73Å; F164-V172 HydrophobicContact CD1-CG2 3.81Å; F164-V172 HydrophobicContact CE1-CG2 3.59Å; F164-V172 HydrophobicContact CZ-CG2 4.48Å; V172-W184 HydrophobicContact CB-CB 4.34Å; V172-W184 HydrophobicContact CB-CE3 3.96Å; V172-W184 HydrophobicContact CG1-CE3 3.72Å; V172-W184 HydrophobicContact CG1-CZ3 4.05Å; V172-W184 PolarHBondContact N-O 3.03Å; V172-W184 PolarHBondContact O-N 2.89Å
173	V	87.2	Confident	83.5	Confident	1 Å²	1	27.4 Å²	27.4	1%	0.006	13%	0.131	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112	136.3	177.9	-171.6	0	0	0	0	109	V162 G163 I181 V182 L183 V211 L222 L236	V162-V173 CarbonylContact C-O 3.56Å; V162-V173 WeakPolarHBondContact CA-O 2.97Å; V162-V173 WeakPolarHBondContact CG2-O 3.12Å; G163-V173 PolarHBondContact N-O 3.32Å; G163-V173 PolarHBondContact O-N 2.9Å; V173-I181 HydrophobicContact CG1-CG2 3.63Å; V173-V182 WeakPolarHBondContact CA-O 3.17Å; V173-L183 HydrophobicContact CG2-CD1 4.42Å; V173-V211 HydrophobicContact CB-CG1 4.23Å; V173-V211 HydrophobicContact CG1-CG1 3.83Å; V173-L222 HydrophobicContact CB-CD1 4.25Å; V173-L222 HydrophobicContact CG1-CD1 3.92Å; V173-L222 HydrophobicContact CG1-CD2 3.72Å; V173-L222 HydrophobicContact CG1-CG 4.47Å; V173-L222 HydrophobicContact CG2-CD1 4.19Å; V173-L236 HydrophobicContact CG2-CD2 4.18Å
174	G	86	Confident	83.7	Confident	0 Å²	0	27.2 Å²	27.2	0%	0	13%	0.129	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	145.7	174.3	0	0	0	0	0	111.7	S161 I181 V182	S161-G174 CarbonylContact O-C 3.57Å; S161-G174 VanDerWaalsContact O-CA 3.31Å; S161-G174 WeakPolarHBondContact O-CA 3.36Å; G174-I181 WeakPolarHBondContact O-CA 3.2Å; G174-V182 PolarHBondContact N-O 2.86Å; G174-V182 WeakPolarHBondContact O-CG2 3.33Å; G174-V182 PolarHBondContact O-N 2.85Å
175	G	87.6	Confident	83.8	Confident	0 Å²	0	28.7 Å²	28.7	0%	0	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.5	127.5	166.1	0	0	0	0	0	109.9	V160 S161	V160-G175 PolarHBondContact N-O 3.4Å; S161-G175 PolarHBondContact N-O 2.82Å; S161-G175 PolarHBondContact O-N 2.84Å
176	T	86.9	Confident	83.6	Confident	2 Å²	2	29.7 Å²	29.7	1%	0.012	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.2	161.1	176.8	65.8	0	0	0	0	111.8	P158 S178 G179 Q180 V182 V208	P158-T176 CarbonylContact O-C 3.5Å; P158-T176 VanDerWaalsContact O-CA 3.29Å; P158-T176 WeakPolarHBondContact O-CA 3.31Å; T176-S178 PolarHBondContact O-N 3.47Å; T176-S178 PolarHBondContact OG1-OG 3.07Å; T176-G179 PolarHBondContact O-N 3.43Å; T176-Q180 PolarHBondContact N-O 2.77Å; T176-Q180 WeakPolarHBondContact OG1-CB 3.43Å; T176-Q180 PolarHBondContact OG1-N 2.85Å; T176-Q180 VanDerWaalsContact OG1-N 3.15Å; T176-Q180 PolarHBondContact OG1-O 2.89Å; T176-V182 HydrophobicContact CG2-CG1 3.83Å; T176-V182 HydrophobicContact CG2-CG2 4.33Å; T176-V208 PolarHBondContact O-N 3.34Å
177	Y	86.4	Confident	83.8	Confident	139 Å²	139	34.8 Å²	34.8	55%	0.545	16%	0.16	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.7	-30.3	173	-172.8	-94.1	0	0	0	112.4	P158 V160 G179 P207	P158-Y177 PolarHBondContact O-N 2.91Å; V160-Y177 HydrophobicContact CG2-CD2 4.1Å; Y177-G179 PolarHBondContact O-N 2.88Å; Y177-P207 HydrophobicContact CD1-CG 4.26Å; Y177-P207 HydrophobicContact CD2-CB 3.73Å; Y177-P207 HydrophobicContact CD2-CG 3.31Å; Y177-P207 HydrophobicContact CE1-CG 4.19Å; Y177-P207 HydrophobicContact CE2-CB 4.06Å; Y177-P207 HydrophobicContact CE2-CG 3.22Å; Y177-P207 HydrophobicContact CG-CB 4.31Å; Y177-P207 HydrophobicContact CG-CG 3.85Å; Y177-P207 WeakPolarHBondContact O-CA 3.32Å; Y177-P207 WeakPolarHBondContact O-CG 3.39Å
178	S	84.2	Confident	83.5	Confident	37 Å²	37	34 Å²	34	26%	0.259	16%	0.161	S	C	.	.	T	Hydrogen-bonded Turn	trans	-71.7	-5.3	177.6	59.1	0	0	0	0	114.8	S157 T176 L199	S157-S178 PolarHBondContact OG-OG 3.15Å; T176-S178 PolarHBondContact O-N 3.47Å; T176-S178 PolarHBondContact OG1-OG 3.07Å; S178-L199 WeakPolarHBondContact O-CD1 3.38Å
179	G	82.9	Confident	82.8	Confident	1 Å²	1	36.1 Å²	36.1	1%	0.01	17%	0.17	C	C	.	.	S	Bend	trans	87.6	3	-175	0	0	0	0	0	114.2	T176 Y177 H206	T176-G179 PolarHBondContact O-N 3.43Å; Y177-G179 PolarHBondContact O-N 2.88Å; G179-H206 WeakPolarHBondContact CA-O 3.46Å
180	Q	86.1	Confident	82.4	Confident	53 Å²	53	44 Å²	44	25%	0.248	20%	0.198	C	C	.	.			trans	-82.7	146.8	172.7	-61.7	-179.4	-2.5	0	0	110.3	T176 L199	T176-Q180 PolarHBondContact N-O 2.77Å; T176-Q180 WeakPolarHBondContact OG1-CB 3.43Å; T176-Q180 PolarHBondContact OG1-N 2.85Å; T176-Q180 VanDerWaalsContact OG1-N 3.15Å; T176-Q180 PolarHBondContact OG1-O 2.89Å; Q180-L199 HydrophobicContact CG-CD1 3.73Å
181	I	87.4	Confident	81.8	Confident	0 Å²	0	48.5 Å²	48.5	0%	0	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.1	128.5	170.3	-60.4	157.3	0	0	0	106.2	V173 G174 R196 T197 L222 T224 W234	V173-I181 HydrophobicContact CG1-CG2 3.63Å; G174-I181 WeakPolarHBondContact O-CA 3.2Å; I181-R196 WeakPolarHBondContact O-CA 3.3Å; I181-T197 HydrophobicContact CB-CG2 3.74Å; I181-T197 HydrophobicContact CD1-CG2 4.32Å; I181-T197 HydrophobicContact CG2-CG2 4.5Å; I181-T197 PolarHBondContact N-OG1 2.86Å; I181-T197 PolarHBondContact O-N 2.97Å; I181-L222 HydrophobicContact CG2-CD2 3.82Å; I181-T224 HydrophobicContact CD1-CG2 3.5Å; I181-T224 HydrophobicContact CG1-CG2 4.09Å; I181-W234 HydrophobicContact CD1-CD2 4.06Å; I181-W234 VanDerWaalsContact CD1-CE2 3.41Å; I181-W234 HydrophobicContact CD1-CG 4.16Å; I181-W234 HydrophobicContact CD1-CZ2 3.87Å
182	V	87	Confident	81.4	Confident	1 Å²	1	50.6 Å²	50.6	1%	0.006	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	142.2	-178.8	-63.2	0	0	0	0	108.9	V173 G174 T176 W184 P193 R196	V173-V182 WeakPolarHBondContact CA-O 3.17Å; G174-V182 PolarHBondContact N-O 2.86Å; G174-V182 WeakPolarHBondContact O-CG2 3.33Å; G174-V182 PolarHBondContact O-N 2.85Å; T176-V182 HydrophobicContact CG2-CG1 3.83Å; T176-V182 HydrophobicContact CG2-CG2 4.33Å; V182-W184 HydrophobicContact CG2-CD2 4.44Å; V182-W184 HydrophobicContact CG2-CH2 3.75Å; V182-W184 HydrophobicContact CG2-CZ2 3.65Å; V182-W184 HydrophobicContact CG2-CZ3 4.18Å; V182-P193 HydrophobicContact CB-CB 4.08Å; V182-P193 HydrophobicContact CG1-CB 4.44Å; V182-R196 HydrophobicContact CG1-CG 4.21Å
183	L	87.4	Confident	80.9	Confident	10 Å²	10	51.1 Å²	51.1	5%	0.052	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	129.4	174.7	-175.6	148.9	0	0	0	108.9	L171 V173 V194 Q195 L239	L171-L183 HydrophobicContact CD2-CD2 3.89Å; V173-L183 HydrophobicContact CG2-CD1 4.42Å; L183-V194 PolarHBondContact O-N 2.79Å; L183-Q195 HydrophobicContact CB-CB 4.4Å; L183-Q195 PolarHBondContact N-O 3.4Å; L183-Q195 PolarHBondContact O-N 2.81Å; L183-L239 HydrophobicContact CB-CD1 3.95Å; L183-L239 HydrophobicContact CD1-CD1 3.9Å
184	W	86.7	Confident	80.4	Confident	1 Å²	1	54.9 Å²	54.9	0%	0.004	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	140.5	176.5	-56.3	-75.4	0	0	0	109.5	A137 F153 C155 V159 V162 L171 V172 V182 P193	A137-W184 HydrophobicContact CB-CH2 3.62Å; A137-W184 HydrophobicContact CB-CZ2 4.11Å; A137-W184 HydrophobicContact CB-CZ3 3.96Å; F153-W184 HydrophobicContact CB-CD2 3.99Å; F153-W184 HydrophobicContact CB-CG 4.01Å; F153-W184 HydrophobicContact CB-CZ2 4.18Å; F153-W184 HydrophobicContact CD1-CB 3.8Å; F153-W184 AromaticContact CD1-CD1 3.79Å; F153-W184 AromaticContact CD1-CG 3.85Å; F153-W184 HydrophobicContact CD1-CG 3.85Å; F153-W184 HydrophobicContact CD2-CB 4.29Å; F153-W184 HydrophobicContact CD2-CD2 4.34Å; F153-W184 HydrophobicContact CD2-CG 4.27Å; F153-W184 HydrophobicContact CE1-CB 3.82Å; F153-W184 HydrophobicContact CE1-CG 4.38Å; F153-W184 HydrophobicContact CE2-CB 4.3Å; F153-W184 HydrophobicContact CG-CB 4.05Å; F153-W184 AromaticContact CG-CD1 3.88Å; F153-W184 HydrophobicContact CG-CD2 4.08Å; F153-W184 AromaticContact CG-CG 3.78Å; F153-W184 HydrophobicContact CG-CG 3.78Å; F153-W184 HydrophobicContact CZ-CB 4.08Å; C155-W184 HydrophobicContact CB-CZ2 4.39Å; C155-W184 WeakPolarHBondContact SG-CZ2 3.39Å; V159-W184 HydrophobicContact CG1-CH2 4.11Å; V159-W184 HydrophobicContact CG2-CH2 3.93Å; V159-W184 HydrophobicContact CG2-CZ2 4.14Å; V162-W184 HydrophobicContact CG2-CZ3 3.96Å; L171-W184 WeakPolarHBondContact CA-O 3.47Å; V172-W184 HydrophobicContact CB-CB 4.34Å; V172-W184 HydrophobicContact CB-CE3 3.96Å; V172-W184 HydrophobicContact CG1-CE3 3.72Å; V172-W184 HydrophobicContact CG1-CZ3 4.05Å; V172-W184 PolarHBondContact N-O 3.03Å; V172-W184 PolarHBondContact O-N 2.89Å; V182-W184 HydrophobicContact CG2-CD2 4.44Å; V182-W184 HydrophobicContact CG2-CH2 3.75Å; V182-W184 HydrophobicContact CG2-CZ2 3.65Å; V182-W184 HydrophobicContact CG2-CZ3 4.18Å; W184-P193 VanDerWaalsContact CD1-CA 3.46Å
185	D	86.4	Confident	80	Confident	40 Å²	40	58.3 Å²	58.3	21%	0.214	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	122.1	173.1	-175.3	-8.1	0	0	0	108.6	N170 L171 R187 S188 V194	N170-D185 WeakPolarHBondContact O-CA 3.38Å; L171-D185 HydrophobicContact CD2-CB 4.05Å; D185-R187 PolarHBondContact O-N 2.92Å; D185-R187 WeakPolarHBondContact OD1-CB 3.33Å; D185-R187 WeakPolarHBondContact OD1-CG 3.39Å; D185-R187 PolarHBondContact OD1-N 3.46Å; D185-S188 PolarHBondContact O-N 3.21Å; D185-S188 PolarHBondContact O-OG 3.27Å; D185-V194 HydrophobicContact CB-CG2 3.86Å
186	N	77.9	Confident	79.7	Confident	22 Å²	22	62.9 Å²	62.9	12%	0.118	29%	0.285	C	S	.	.	T	Hydrogen-bonded Turn	trans	-69.8	-17.1	179.9	75.1	-5.2	0	0	0	113.5	Y151 N170 S188	Y151-N186 HydrophobicContact CE1-CB 4.25Å; Y151-N186 HydrophobicContact CE2-CB 4.44Å; N170-N186 VanDerWaalsContact CA-CG 3.44Å; N170-N186 WeakPolarHBondContact CA-ND2 3.46Å; N170-N186 WeakPolarHBondContact CA-OD1 3.4Å; N170-N186 WeakPolarHBondContact CB-OD1 3.41Å; N170-N186 PolarHBondContact O-N 3.28Å; N170-N186 PolarHBondContact O-OD1 3.16Å; N170-N186 PolarHBondContact OD1-ND2 2.89Å; N170-N186 PolarHBondContact OD1-OD1 3.15Å; N186-S188 VanDerWaalsContact C-N 3.3Å
187	R	77.6	Confident	79.4	Confident	192 Å²	192	63 Å²	63	73%	0.725	29%	0.285	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.4	-26.3	176.6	-55.9	179.5	83	174.2	4.6	111.1	N170 D185	N170-R187 HydrophobicContact CB-CG 4.09Å; D185-R187 PolarHBondContact O-N 2.92Å; D185-R187 WeakPolarHBondContact OD1-CB 3.33Å; D185-R187 WeakPolarHBondContact OD1-CG 3.39Å; D185-R187 PolarHBondContact OD1-N 3.46Å
188	S	70.1	Confident	78.9	Confident	35 Å²	35	59.3 Å²	59.3	25%	0.245	28%	0.278	C	S	.	.	S	Bend	trans	-88	115.3	175.2	74.9	0	0	0	0	108.7	D185 N186 R190 V194	D185-S188 PolarHBondContact O-N 3.21Å; D185-S188 PolarHBondContact O-OG 3.27Å; N186-S188 VanDerWaalsContact C-N 3.3Å; S188-R190 PolarHBondContact O-N 2.87Å; S188-V194 WeakPolarHBondContact OG-CG2 3.36Å
189	H	60.6	Low	78.2	Confident	122 Å²	122	62.3 Å²	62.3	57%	0.565	29%	0.291	S	S	*	.			trans	-67.4	14.5	173	-71.1	-67.7	0	0	0	113.5	R191	H189-R191 PolarHBondContact O-N 2.91Å
190	R	67.7	Low	77.6	Confident	188 Å²	188	65.2 Å²	65.2	71%	0.709	31%	0.311	S	S	*	.			trans	-78.4	116.9	172.7	-67.7	-169.8	179.3	-165.5	1.2	108	S188 T192	S188-R190 PolarHBondContact O-N 2.87Å; R190-T192 PolarHBondContact O-N 2.9Å
191	R	69.3	Low	76.5	Confident	140 Å²	140	66.3 Å²	66.3	53%	0.528	33%	0.329	S	S	.	.	S	Bend	trans	-70.2	-12.7	175.5	-54.8	-171.7	-177.4	-173.2	0.4	113.1	H154 H189	H154-R191 WeakPolarHBondContact CE1-CD 3.48Å; H154-R191 PolarHBondContact N-O 2.95Å; H154-R191 VanDerWaalsContact ND1-CB 3.27Å; H154-R191 WeakPolarHBondContact ND1-CB 2.98Å; H189-R191 PolarHBondContact O-N 2.91Å
192	T	76.8	Confident	75.5	Confident	76 Å²	76	68.3 Å²	68.3	47%	0.466	35%	0.346	S	S	.	.	S	Bend	trans	-87.1	150.7	174	55.3	0	0	0	0	111	R190 V194	R190-T192 PolarHBondContact O-N 2.9Å; T192-V194 PolarHBondContact O-N 2.87Å
193	P	76.1	Confident	74.9	Confident	13 Å²	13	68.3 Å²	68.3	8%	0.084	35%	0.346	C	S	.	.			trans	-57.6	141.2	176.3	27.1	-37.4	0	0	0	111.4	H154 V182 W184 R196	H154-P193 WeakPolarHBondContact O-CD 3.45Å; V182-P193 HydrophobicContact CB-CB 4.08Å; V182-P193 HydrophobicContact CG1-CB 4.44Å; W184-P193 VanDerWaalsContact CD1-CA 3.46Å; P193-R196 HydrophobicContact CB-CG 4.41Å; P193-R196 HydrophobicContact CG-CG 4.11Å; P193-R196 VanDerWaalsContact CG-CZ 3.49Å
194	V	77.6	Confident	74.6	Confident	81 Å²	81	67.9 Å²	67.9	49%	0.491	34%	0.344	S	S	.	.	S	Bend	trans	-75.1	-40.9	-178.5	179.4	0	0	0	0	109.9	L183 D185 S188 T192	L183-V194 PolarHBondContact O-N 2.79Å; D185-V194 HydrophobicContact CB-CG2 3.86Å; S188-V194 WeakPolarHBondContact OG-CG2 3.36Å; T192-V194 PolarHBondContact O-N 2.87Å
195	Q	76.4	Confident	74.4	Confident	72 Å²	72	71.3 Å²	71.3	34%	0.336	37%	0.365	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.2	147.4	179.6	-165	169.5	10.6	0	0	110.7	L183 L239	L183-Q195 HydrophobicContact CB-CB 4.4Å; L183-Q195 PolarHBondContact N-O 3.4Å; L183-Q195 PolarHBondContact O-N 2.81Å; Q195-L239 HydrophobicContact CB-CD1 4.36Å; Q195-L239 HydrophobicContact CG-CB 4.33Å; Q195-L239 HydrophobicContact CG-CD1 4.11Å
196	R	81.6	Confident	74.3	Confident	96 Å²	96	73.9 Å²	73.9	36%	0.362	38%	0.375	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.1	140.8	174.9	-57.1	-172.3	175.9	126.2	-1.5	109.1	I181 V182 P193	I181-R196 WeakPolarHBondContact O-CA 3.3Å; V182-R196 HydrophobicContact CG1-CG 4.21Å; P193-R196 HydrophobicContact CB-CG 4.41Å; P193-R196 HydrophobicContact CG-CG 4.11Å; P193-R196 VanDerWaalsContact CG-CZ 3.49Å
197	T	82	Confident	74.7	Confident	3 Å²	3	73.3 Å²	73.3	2%	0.018	37%	0.373	C	S	.	.			trans	-75.5	144.7	170	60.5	0	0	0	0	110.4	I181 W234 L239	I181-T197 HydrophobicContact CB-CG2 3.74Å; I181-T197 HydrophobicContact CD1-CG2 4.32Å; I181-T197 HydrophobicContact CG2-CG2 4.5Å; I181-T197 PolarHBondContact N-OG1 2.86Å; I181-T197 PolarHBondContact O-N 2.97Å; T197-W234 HydrophobicContact CG2-CD2 4.48Å; T197-W234 HydrophobicContact CG2-CE3 4.05Å; T197-W234 HydrophobicContact CG2-CH2 4.14Å; T197-W234 HydrophobicContact CG2-CZ3 3.85Å; T197-L239 HydrophobicContact CG2-CB 3.91Å; T197-L239 HydrophobicContact CG2-CD2 4.26Å; T197-L239 WeakPolarHBondContact CG2-O 3.34Å
198	P	74.2	Confident	75.2	Confident	62 Å²	62	64.2 Å²	64.2	40%	0.403	34%	0.339	S	S	.	.			trans	-71.1	143.8	173.6	29.4	-32.8	0	0	0	110.5	S200 S240	P198-S200 PolarHBondContact O-N 3.29Å; P198-S200 VanDerWaalsContact O-N 3.12Å; P198-S240 VanDerWaalsContact CG-O 3.26Å; P198-S240 WeakPolarHBondContact CG-O 2.96Å
199	L	71.4	Confident	75.9	Confident	100 Å²	100	66 Å²	66	52%	0.524	34%	0.341	S	S	.	.			trans	-75.1	101	170.9	-147	75	0	0	0	108.5	S178 Q180	S178-L199 WeakPolarHBondContact O-CD1 3.38Å; Q180-L199 HydrophobicContact CG-CD1 3.73Å
200	S	69.6	Low	76.8	Confident	62 Å²	62	61.4 Å²	61.4	43%	0.434	32%	0.322	S	S	.	.			trans	-132	156.9	-178.4	179.8	0	0	0	0	109.5	P198 A202 A203	P198-S200 PolarHBondContact O-N 3.29Å; P198-S200 VanDerWaalsContact O-N 3.12Å; S200-A202 PolarHBondContact O-N 3.44Å; S200-A202 VanDerWaalsContact O-N 3.14Å; S200-A203 CarbonylContact O-C 3.52Å; S200-A203 VanDerWaalsContact O-CA 3.31Å; S200-A203 WeakPolarHBondContact O-CA 3.36Å; S200-A203 VanDerWaalsContact O-CB 3.32Å; S200-A203 WeakPolarHBondContact O-CB 3.46Å; S200-A203 PolarHBondContact O-N 2.91Å
201	A	62.7	Low	77.7	Confident	76 Å²	76	53.1 Å²	53.1	63%	0.628	29%	0.292	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.1	-18.3	177.3	0	0	0	0	0	113.6	R230	A201-R230 PolarHBondContact O-NH1 2.84Å
202	A	66.3	Low	78.4	Confident	43 Å²	43	48.7 Å²	48.7	36%	0.355	28%	0.279	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.3	-22.1	170.2	0	0	0	0	0	112.6	S200 P242 T245	S200-A202 PolarHBondContact O-N 3.44Å; S200-A202 VanDerWaalsContact O-N 3.14Å; A202-P242 HydrophobicContact CB-CG 3.84Å; A202-P242 WeakPolarHBondContact O-CG 3.45Å; A202-T245 PolarHBondContact O-OG1 3.02Å
203	A	75.3	Confident	78.7	Confident	1 Å²	1	45.2 Å²	45.2	1%	0.008	26%	0.258	C	S	.	.	S	Bend	trans	-89.7	-172.4	173.1	0	0	0	0	0	110.4	S200 W234	S200-A203 CarbonylContact O-C 3.52Å; S200-A203 VanDerWaalsContact O-CA 3.31Å; S200-A203 WeakPolarHBondContact O-CA 3.36Å; S200-A203 VanDerWaalsContact O-CB 3.32Å; S200-A203 WeakPolarHBondContact O-CB 3.46Å; S200-A203 PolarHBondContact O-N 2.91Å; A203-W234 HydrophobicContact CB-CH2 3.74Å; A203-W234 HydrophobicContact CB-CZ2 3.95Å
204	H	81.3	Confident	78.8	Confident	0 Å²	0	45 Å²	45	0%	0	26%	0.256	C	S	.	.			trans	-77.7	140.3	178.7	-59.9	-56.5	0	0	0	111.2	V208 T224 S226 R230 C232	H204-V208 HydrophobicContact CB-CG2 4.07Å; H204-T224 WeakPolarHBondContact NE2-CB 3.44Å; H204-T224 PolarHBondContact NE2-OG1 3.02Å; H204-S226 WeakPolarHBondContact ND1-CB 3.4Å; H204-R230 PolarHBondContact CE1-O 3.06Å; H204-C232 PolarHBondContact CE1-SG 2.87Å
205	T	81.4	Confident	78.6	Confident	74 Å²	74	42.1 Å²	42.1	45%	0.454	24%	0.243	S	C	.	.	S	Bend	trans	-105.5	-19.8	172.8	50.5	0	0	0	0	112.6	D228	T205-D228 WeakPolarHBondContact CA-OD2 3.42Å; T205-D228 WeakPolarHBondContact CB-OD2 3.15Å; T205-D228 PolarHBondContact N-OD2 3.46Å; T205-D228 VanDerWaalsContact N-OD2 3.13Å; T205-D228 PolarHBondContact OG1-OD2 2.92Å
206	H	85.3	Confident	78.5	Confident	93 Å²	93	42.8 Å²	42.8	43%	0.431	25%	0.252	S	S	.	.	S	Bend	trans	-114.1	169.9	177.1	-72.3	72.2	0	0	0	112	G179 S226 D228	G179-H206 WeakPolarHBondContact CA-O 3.46Å; H206-S226 PolarHBondContact O-OG 3.23Å; H206-D228 WeakPolarHBondContact CB-OD2 3.4Å; H206-D228 IonicContact CE1-OD1 3.07Å; H206-D228 PolarHBondContact CE1-OD1 3.14Å; H206-D228 IonicContact CE1-OD2 3.99Å; H206-D228 IonicContact CG-OD1 3.39Å; H206-D228 IonicContact CG-OD2 3.46Å; H206-D228 PolarHBondContact N-OD2 3.46Å; H206-D228 IonicContact ND1-OD1 2.62Å; H206-D228 PolarHBondContact ND1-OD1 2.85Å; H206-D228 IonicContact ND1-OD2 2.89Å; H206-D228 PolarHBondContact ND1-OD2 3.3Å
207	P	85.9	Confident	78	Confident	11 Å²	11	44.4 Å²	44.4	7%	0.071	26%	0.264	C	S	.	.			trans	-53.2	139	-176.8	-26.6	36	0	0	0	113.5	V160 Y177 Y209 S226 T227	V160-P207 HydrophobicContact CG2-CB 4.46Å; Y177-P207 HydrophobicContact CD1-CG 4.26Å; Y177-P207 HydrophobicContact CD2-CB 3.73Å; Y177-P207 HydrophobicContact CD2-CG 3.31Å; Y177-P207 HydrophobicContact CE1-CG 4.19Å; Y177-P207 HydrophobicContact CE2-CB 4.06Å; Y177-P207 HydrophobicContact CE2-CG 3.22Å; Y177-P207 HydrophobicContact CG-CB 4.31Å; Y177-P207 HydrophobicContact CG-CG 3.85Å; Y177-P207 WeakPolarHBondContact O-CA 3.32Å; Y177-P207 WeakPolarHBondContact O-CG 3.39Å; P207-Y209 PolarHBondContact O-N 3.04Å; P207-S226 WeakPolarHBondContact O-CA 3.37Å; P207-S226 PolarHBondContact O-OG 3.4Å; P207-T227 PolarHBondContact O-N 3.02Å; P207-T227 PolarHBondContact O-OG1 2.76Å
208	V	87.4	Confident	77.5	Confident	0 Å²	0	51.9 Å²	51.9	0%	0	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.8	98.6	176.7	-172.8	0	0	0	0	108.9	S161 T176 H204 V211 V225	S161-V208 PolarHBondContact OG-O 3.07Å; T176-V208 PolarHBondContact O-N 3.34Å; H204-V208 HydrophobicContact CB-CG2 4.07Å; V208-V211 HydrophobicContact CG1-CG2 3.66Å; V208-V225 WeakPolarHBondContact CA-O 3.39Å; V208-V225 WeakPolarHBondContact CG1-O 3.45Å
209	Y	84.2	Confident	77.5	Confident	73 Å²	73	51.4 Å²	51.4	29%	0.286	31%	0.305	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.5	-29	-178.3	-77.3	-60.8	0	0	0	113.8	V160 S161 P207 V225 T227 V258 T259	V160-Y209 HydrophobicContact CG1-CD1 3.66Å; V160-Y209 HydrophobicContact CG1-CE1 4.18Å; S161-Y209 WeakPolarHBondContact CB-O 3.3Å; P207-Y209 PolarHBondContact O-N 3.04Å; Y209-V225 PolarHBondContact N-O 3.03Å; Y209-T227 WeakPolarHBondContact CD2-OG1 2.89Å; Y209-T227 HydrophobicContact CE2-CG2 3.98Å; Y209-T227 WeakPolarHBondContact CE2-OG1 3.33Å; Y209-V258 VanDerWaalsContact CD2-O 3.3Å; Y209-V258 WeakPolarHBondContact CD2-O 3.42Å; Y209-T259 WeakPolarHBondContact CB-O 3.47Å
210	C	79.4	Confident	77.7	Confident	25 Å²	25	47.5 Å²	47.5	17%	0.169	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140	134.3	-178.2	-78.7	0	0	0	0	111.5	T224 V225 M261	C210-T224 WeakPolarHBondContact O-CA 3.3Å; C210-V225 PolarHBondContact O-N 2.69Å; C210-M261 HydrophobicContact CB-CB 4.13Å; C210-M261 HydrophobicContact CB-CE 4.34Å
211	V	86.8	Confident	78.5	Confident	15 Å²	15	45.5 Å²	45.5	9%	0.091	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	126.2	173.5	174.8	0	0	0	0	107	S161 V173 V208 L222 T224	S161-V211 WeakPolarHBondContact OG-CG2 3.23Å; V173-V211 HydrophobicContact CB-CG1 4.23Å; V173-V211 HydrophobicContact CG1-CG1 3.83Å; V208-V211 HydrophobicContact CG1-CG2 3.66Å; V211-L222 HydrophobicContact CG1-CD1 3.49Å; V211-L222 VanDerWaalsContact CG1-CD1 3.49Å; V211-L222 HydrophobicContact CG1-CG 4.24Å; V211-T224 HydrophobicContact CB-CG2 4.44Å; V211-T224 HydrophobicContact CG1-CG2 4.19Å; V211-T224 HydrophobicContact CG2-CG2 3.89Å
212	N	84.3	Confident	79.6	Confident	46 Å²	46	41.9 Å²	41.9	25%	0.246	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.1	137.5	176.6	-157.4	-26	0	0	0	110.5	I223 M261 F263	N212-I223 PolarHBondContact N-O 3.44Å; N212-I223 PolarHBondContact O-N 3.39Å; N212-M261 HydrophobicContact CB-CE 4.14Å; N212-F263 HydrophobicContact CB-CD2 4.23Å; N212-F263 HydrophobicContact CB-CE2 3.89Å
213	V	82.8	Confident	80.5	Confident	3 Å²	3	39.8 Å²	39.8	2%	0.018	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.4	120.6	175	179.6	0	0	0	0	108.8	K166 L222 L236	K166-V213 VanDerWaalsContact CE-O 3.3Å; K166-V213 WeakPolarHBondContact CE-O 3.35Å; K166-V213 PolarHBondContact NZ-O 3.13Å; V213-L222 HydrophobicContact CG2-CD1 3.47Å; V213-L222 VanDerWaalsContact CG2-CD1 3.47Å; V213-L236 HydrophobicContact CG1-CD1 4.33Å; V213-L236 HydrophobicContact CG2-CD2 4.45Å
214	V	78.3	Confident	81.1	Confident	9 Å²	9	39.8 Å²	39.8	6%	0.055	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	134.9	-177.9	-166.1	0	0	0	0	110	N221 I223 F263 V268	V214-N221 PolarHBondContact N-O 3.01Å; V214-N221 CarbonylContact O-C 3.58Å; V214-N221 PolarHBondContact O-N 2.89Å; V214-I223 HydrophobicContact CB-CD1 4.02Å; V214-I223 HydrophobicContact CG2-CD1 3.91Å; V214-I223 HydrophobicContact CG2-CG1 4.49Å; V214-F263 HydrophobicContact CG1-CD1 4.22Å; V214-F263 HydrophobicContact CG1-CE1 4.42Å; V214-F263 HydrophobicContact CG2-CD1 3.93Å; V214-F263 HydrophobicContact CG2-CD2 3.63Å; V214-F263 HydrophobicContact CG2-CE1 3.79Å; V214-F263 HydrophobicContact CG2-CE2 3.49Å; V214-F263 VanDerWaalsContact CG2-CE2 3.49Å; V214-F263 HydrophobicContact CG2-CG 3.87Å; V214-F263 HydrophobicContact CG2-CZ 3.6Å; V214-V268 HydrophobicContact CG1-CB 4.03Å; V214-V268 HydrophobicContact CG1-CG1 3.66Å; V214-V268 HydrophobicContact CG1-CG2 3.98Å
215	G	74.5	Confident	81.3	Confident	20 Å²	20	39.8 Å²	39.8	21%	0.206	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	145	-160.1	176.7	0	0	0	0	0	112	F167 A219	F167-G215 WeakPolarHBondContact CE2-O 3.36Å; F167-G215 WeakPolarHBondContact CZ-O 3.48Å; G215-A219 WeakPolarHBondContact CA-O 3.37Å
216	T	74	Confident	81.5	Confident	87 Å²	87	36.3 Å²	36.3	53%	0.534	20%	0.2	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	161.4	173.2	60.7	0	0	0	0	108.3	N218 A219 N220	T216-N218 PolarHBondContact O-N 3.41Å; T216-A219 PolarHBondContact N-O 3.35Å; T216-A219 CarbonylContact O-C 3.58Å; T216-A219 PolarHBondContact O-N 3.23Å; T216-N220 VanDerWaalsContact C-OD1 3.24Å; T216-N220 PolarHBondContact O-N 3.08Å; T216-N220 PolarHBondContact O-OD1 3.41Å
217	Q	71.8	Confident	81.4	Confident	130 Å²	130	33.1 Å²	33.1	61%	0.607	19%	0.187	S	C	*	.	T	Hydrogen-bonded Turn	trans	-44.1	-34.8	-176.3	-169.2	170.4	22.8	0	0	115.2	F167 N220	F167-Q217 HydrophobicContact CB-CG 4.38Å; F167-Q217 HydrophobicContact CD1-CB 3.79Å; F167-Q217 HydrophobicContact CD1-CG 4.3Å; F167-Q217 HydrophobicContact CE1-CB 4.27Å; F167-Q217 HydrophobicContact CG-CB 4.28Å; Q217-N220 PolarHBondContact O-ND2 3.48Å
218	N	71.3	Confident	81.1	Confident	159 Å²	159	33.9 Å²	33.9	85%	0.85	19%	0.191	S	C	*	.	T	Hydrogen-bonded Turn	trans	-93	-17.6	-179.3	-61.7	-18.7	0	0	0	114.5	T216	T216-N218 PolarHBondContact O-N 3.41Å
219	A	72.8	Confident	80.6	Confident	53 Å²	53	33.9 Å²	33.9	44%	0.438	19%	0.191	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.8	67.5	-178.3	0	0	0	0	0	109.6	G215 T216	G215-A219 WeakPolarHBondContact CA-O 3.37Å; T216-A219 PolarHBondContact N-O 3.35Å; T216-A219 CarbonylContact O-C 3.58Å; T216-A219 PolarHBondContact O-N 3.23Å
220	N	77.4	Confident	80.5	Confident	17 Å²	17	33.2 Å²	33.2	9%	0.091	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.5	118	179.6	-65.1	-36.8	0	0	0	110.3	F167 T216 Q217 L236	F167-N220 WeakPolarHBondContact CD2-OD1 3.35Å; F167-N220 WeakPolarHBondContact CE2-OD1 3.44Å; T216-N220 VanDerWaalsContact C-OD1 3.24Å; T216-N220 PolarHBondContact O-N 3.08Å; T216-N220 PolarHBondContact O-OD1 3.41Å; Q217-N220 PolarHBondContact O-ND2 3.48Å; N220-L236 HydrophobicContact CB-CD1 3.71Å; N220-L236 HydrophobicContact CB-CG 4.36Å
221	N	84.9	Confident	80.8	Confident	20 Å²	20	32 Å²	32	11%	0.107	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	130.9	171.6	-61.3	-71	0	0	0	108.8	V214 W234 Q243 R285	V214-N221 PolarHBondContact N-O 3.01Å; V214-N221 CarbonylContact O-C 3.58Å; V214-N221 PolarHBondContact O-N 2.89Å; N221-W234 CarbonylContact C-O 3.57Å; N221-W234 WeakPolarHBondContact CA-O 3.23Å; N221-Q243 PolarHBondContact OD1-OE1 2.89Å; N221-R285 VanDerWaalsContact CG-NH2 3.25Å; N221-R285 PolarHBondContact ND2-NH1 3.1Å; N221-R285 PolarHBondContact ND2-NH2 3.42Å
222	L	85.6	Confident	80.7	Confident	0 Å²	0	31.3 Å²	31.3	0%	0	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.7	116.4	170.7	178	78.5	0	0	0	107.8	V173 I181 V211 V213 T224 S233 W234 L236 L239	V173-L222 HydrophobicContact CB-CD1 4.25Å; V173-L222 HydrophobicContact CG1-CD1 3.92Å; V173-L222 HydrophobicContact CG1-CD2 3.72Å; V173-L222 HydrophobicContact CG1-CG 4.47Å; V173-L222 HydrophobicContact CG2-CD1 4.19Å; I181-L222 HydrophobicContact CG2-CD2 3.82Å; V211-L222 HydrophobicContact CG1-CD1 3.49Å; V211-L222 VanDerWaalsContact CG1-CD1 3.49Å; V211-L222 HydrophobicContact CG1-CG 4.24Å; V213-L222 HydrophobicContact CG2-CD1 3.47Å; V213-L222 VanDerWaalsContact CG2-CD1 3.47Å; L222-T224 HydrophobicContact CD2-CG2 4.03Å; L222-T224 HydrophobicContact CG-CG2 4Å; L222-S233 CarbonylContact O-C 3.55Å; L222-S233 WeakPolarHBondContact O-CA 3.35Å; L222-W234 HydrophobicContact CB-CB 4.13Å; L222-W234 HydrophobicContact CD2-CB 4.26Å; L222-W234 PolarHBondContact N-O 2.84Å; L222-W234 PolarHBondContact O-N 3.46Å; L222-L236 HydrophobicContact CB-CD2 4.23Å; L222-L239 HydrophobicContact CD2-CD2 4.49Å
223	I	86.9	Confident	80.8	Confident	0 Å²	0	29.1 Å²	29.1	0%	0	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.9	130.5	177.1	-59.5	173.3	0	0	0	108.2	N212 V214 M231 M261 F263	N212-I223 PolarHBondContact N-O 3.44Å; N212-I223 PolarHBondContact O-N 3.39Å; V214-I223 HydrophobicContact CB-CD1 4.02Å; V214-I223 HydrophobicContact CG2-CD1 3.91Å; V214-I223 HydrophobicContact CG2-CG1 4.49Å; I223-M231 HydrophobicContact CB-CE 4.22Å; I223-M231 HydrophobicContact CD1-CE 3.84Å; I223-M231 HydrophobicContact CG1-CE 3.87Å; I223-M231 HydrophobicContact CG2-CE 3.36Å; I223-M231 HydrophobicContact CG2-CG 3.77Å; I223-M231 HydrophobicContact CG2-SD 4.33Å; I223-M261 HydrophobicContact CB-CE 4.35Å; I223-M261 HydrophobicContact CG2-CE 3.84Å; I223-M261 HydrophobicContact CG2-SD 3.71Å; I223-F263 HydrophobicContact CB-CE2 4.47Å; I223-F263 HydrophobicContact CB-CZ 3.94Å; I223-F263 HydrophobicContact CD1-CE1 3.55Å; I223-F263 HydrophobicContact CD1-CE2 4.39Å; I223-F263 HydrophobicContact CD1-CZ 3.33Å; I223-F263 HydrophobicContact CG1-CZ 4.2Å; I223-F263 HydrophobicContact CG2-CZ 3.94Å
224	T	86.3	Confident	80.9	Confident	0 Å²	0	29 Å²	29	0%	0	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.6	139.1	-177.1	55.5	0	0	0	0	109.3	I181 H204 C210 V211 L222 M231 C232 W234	I181-T224 HydrophobicContact CD1-CG2 3.5Å; I181-T224 HydrophobicContact CG1-CG2 4.09Å; H204-T224 WeakPolarHBondContact NE2-CB 3.44Å; H204-T224 PolarHBondContact NE2-OG1 3.02Å; C210-T224 WeakPolarHBondContact O-CA 3.3Å; V211-T224 HydrophobicContact CB-CG2 4.44Å; V211-T224 HydrophobicContact CG1-CG2 4.19Å; V211-T224 HydrophobicContact CG2-CG2 3.89Å; L222-T224 HydrophobicContact CD2-CG2 4.03Å; L222-T224 HydrophobicContact CG-CG2 4Å; T224-M231 WeakPolarHBondContact O-CA 3.48Å; T224-C232 PolarHBondContact N-O 3.2Å; T224-C232 PolarHBondContact O-N 2.94Å; T224-C232 PolarHBondContact OG1-O 3.23Å; T224-W234 PolarHBondContact OG1-NE1 3.11Å
225	V	86.1	Confident	81.2	Confident	1 Å²	1	29.4 Å²	29.4	1%	0.006	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	133.3	-178.6	179.6	0	0	0	0	109.6	V208 Y209 C210 M231 V258 M261	V208-V225 WeakPolarHBondContact CA-O 3.39Å; V208-V225 WeakPolarHBondContact CG1-O 3.45Å; Y209-V225 PolarHBondContact N-O 3.03Å; C210-V225 PolarHBondContact O-N 2.69Å; V225-M231 HydrophobicContact CG2-CB 4.3Å; V225-M231 HydrophobicContact CG2-CG 4.26Å; V225-V258 HydrophobicContact CG1-CB 3.51Å; V225-V258 HydrophobicContact CG1-CG1 3.46Å; V225-V258 VanDerWaalsContact CG1-CG1 3.46Å; V225-V258 HydrophobicContact CG1-CG2 4.17Å; V225-M261 HydrophobicContact CG2-CB 4.17Å; V225-M261 HydrophobicContact CG2-CE 3.74Å; V225-M261 HydrophobicContact CG2-CG 4.29Å; V225-M261 HydrophobicContact CG2-SD 3.36Å; V225-M261 WeakPolarHBondContact CG2-SD 3.49Å
226	S	86.4	Confident	81.3	Confident	0 Å²	0	29 Å²	29	0%	0	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	157.6	-178.7	174.8	0	0	0	0	111.2	H204 H206 P207 D228 G229 R230	H204-S226 WeakPolarHBondContact ND1-CB 3.4Å; H206-S226 PolarHBondContact O-OG 3.23Å; P207-S226 WeakPolarHBondContact O-CA 3.37Å; P207-S226 PolarHBondContact O-OG 3.4Å; S226-D228 PolarHBondContact O-N 3.15Å; S226-D228 VanDerWaalsContact O-N 3.09Å; S226-D228 PolarHBondContact OG-N 3.16Å; S226-G229 PolarHBondContact O-N 3.09Å; S226-G229 VanDerWaalsContact O-N 3.1Å; S226-R230 PolarHBondContact N-O 2.91Å
227	T	82.6	Confident	81.3	Confident	26 Å²	26	31.7 Å²	31.7	16%	0.16	17%	0.171	C	C	.	.	T	Hydrogen-bonded Turn	trans	-56.4	-19.6	171.7	-33.9	0	0	0	0	112.9	P207 Y209 G229 A257	P207-T227 PolarHBondContact O-N 3.02Å; P207-T227 PolarHBondContact O-OG1 2.76Å; Y209-T227 WeakPolarHBondContact CD2-OG1 2.89Å; Y209-T227 HydrophobicContact CE2-CG2 3.98Å; Y209-T227 WeakPolarHBondContact CE2-OG1 3.33Å; T227-G229 PolarHBondContact O-N 3.37Å; T227-A257 HydrophobicContact CG2-CB 3.96Å; T227-A257 VanDerWaalsContact O-CA 3.3Å; T227-A257 WeakPolarHBondContact O-CA 3.36Å; T227-A257 WeakPolarHBondContact O-CB 3.4Å
228	D	79.3	Confident	81.4	Confident	28 Å²	28	31.2 Å²	31.2	15%	0.15	17%	0.17	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.4	-3.1	173.1	-83.8	-45	0	0	0	114.8	T205 H206 S226 R230 P255	T205-D228 WeakPolarHBondContact CA-OD2 3.42Å; T205-D228 WeakPolarHBondContact CB-OD2 3.15Å; T205-D228 PolarHBondContact N-OD2 3.46Å; T205-D228 VanDerWaalsContact N-OD2 3.13Å; T205-D228 PolarHBondContact OG1-OD2 2.92Å; H206-D228 WeakPolarHBondContact CB-OD2 3.4Å; H206-D228 IonicContact CE1-OD1 3.07Å; H206-D228 PolarHBondContact CE1-OD1 3.14Å; H206-D228 IonicContact CE1-OD2 3.99Å; H206-D228 IonicContact CG-OD1 3.39Å; H206-D228 IonicContact CG-OD2 3.46Å; H206-D228 PolarHBondContact N-OD2 3.46Å; H206-D228 IonicContact ND1-OD1 2.62Å; H206-D228 PolarHBondContact ND1-OD1 2.85Å; H206-D228 IonicContact ND1-OD2 2.89Å; H206-D228 PolarHBondContact ND1-OD2 3.3Å; S226-D228 PolarHBondContact O-N 3.15Å; S226-D228 VanDerWaalsContact O-N 3.09Å; S226-D228 PolarHBondContact OG-N 3.16Å; D228-R230 HydrophobicContact CB-CB 4.41Å; D228-R230 HydrophobicContact CB-CG 4.22Å; D228-R230 PolarHBondContact O-N 2.91Å; D228-P255 WeakPolarHBondContact O-CB 3.33Å
229	G	77.8	Confident	81.4	Confident	0 Å²	0	23.7 Å²	23.7	0%	0	13%	0.13	C	C	.	.	S	Bend	trans	65.4	25.9	-171	0	0	0	0	0	112.2	S226 T227 L248 V256	S226-G229 PolarHBondContact O-N 3.09Å; S226-G229 VanDerWaalsContact O-N 3.1Å; T227-G229 PolarHBondContact O-N 3.37Å; G229-L248 WeakPolarHBondContact O-CA 3.29Å; G229-L248 VanDerWaalsContact O-CB 3.32Å; G229-L248 WeakPolarHBondContact O-CB 3.4Å; G229-L248 PolarHBondContact O-N 3.05Å; G229-V256 WeakPolarHBondContact CA-O 3.38Å
230	R	82.4	Confident	81.4	Confident	58 Å²	58	24.4 Å²	24.4	22%	0.219	13%	0.131	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108	132	174.6	-66.3	-171.8	176.5	168.2	-3.6	110.2	A201 H204 S226 D228 M246 E247	A201-R230 PolarHBondContact O-NH1 2.84Å; H204-R230 PolarHBondContact CE1-O 3.06Å; S226-R230 PolarHBondContact N-O 2.91Å; D228-R230 HydrophobicContact CB-CB 4.41Å; D228-R230 HydrophobicContact CB-CG 4.22Å; D228-R230 PolarHBondContact O-N 2.91Å; R230-M246 WeakPolarHBondContact CA-O 3.43Å; R230-E247 HydrophobicContact CG-CG 4.08Å; R230-E247 IonicContact CZ-OE1 2.77Å; R230-E247 IonicContact NE-OE1 3.46Å; R230-E247 PolarHBondContact NE-OE1 3.03Å; R230-E247 IonicContact NH2-OE1 2.69Å; R230-E247 PolarHBondContact NH2-OE1 2.97Å
231	M	84.6	Confident	81.2	Confident	0 Å²	0	30.4 Å²	30.4	0%	0	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.1	123.4	167.9	173.5	-95	-171.2	0	0	107.8	I223 T224 V225 M246 L248 Y271 R285	I223-M231 HydrophobicContact CB-CE 4.22Å; I223-M231 HydrophobicContact CD1-CE 3.84Å; I223-M231 HydrophobicContact CG1-CE 3.87Å; I223-M231 HydrophobicContact CG2-CE 3.36Å; I223-M231 HydrophobicContact CG2-CG 3.77Å; I223-M231 HydrophobicContact CG2-SD 4.33Å; T224-M231 WeakPolarHBondContact O-CA 3.48Å; V225-M231 HydrophobicContact CG2-CB 4.3Å; V225-M231 HydrophobicContact CG2-CG 4.26Å; M231-M246 PolarHBondContact N-O 2.98Å; M231-M246 PolarHBondContact O-N 3.23Å; M231-M246 HydrophobicContact SD-CB 4.26Å; M231-M246 HydrophobicContact SD-CG 4.44Å; M231-M246 HydrophobicContact SD-SD 4.31Å; M231-L248 HydrophobicContact CB-CD1 4.4Å; M231-Y271 HydrophobicContact CE-CE1 4.26Å; M231-Y271 HydrophobicContact CG-CE2 4.38Å; M231-R285 HydrophobicContact CE-CB 4.25Å; M231-R285 HydrophobicContact CE-CG 3.98Å
232	C	84.4	Confident	80.6	Confident	0 Å²	0	30.7 Å²	30.7	0%	0	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	126.1	177.6	-63.5	0	0	0	0	109.4	H204 T224 W234 P242 E244	H204-C232 PolarHBondContact CE1-SG 2.87Å; T224-C232 PolarHBondContact N-O 3.2Å; T224-C232 PolarHBondContact O-N 2.94Å; T224-C232 PolarHBondContact OG1-O 3.23Å; C232-W234 HydrophobicContact CB-CZ2 4.22Å; C232-W234 VanDerWaalsContact CB-NE1 3.34Å; C232-P242 HydrophobicContact CB-CB 4.48Å; C232-E244 CarbonylContact C-O 3.4Å; C232-E244 WeakPolarHBondContact CA-O 3.41Å
233	S	86.5	Confident	80.1	Confident	0 Å²	0	36 Å²	36	0%	0	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.3	124.4	169.3	-174	0	0	0	0	109.4	L222 Q243 E244	L222-S233 CarbonylContact O-C 3.55Å; L222-S233 WeakPolarHBondContact O-CA 3.35Å; S233-Q243 PolarHBondContact O-N 2.84Å; S233-E244 PolarHBondContact N-O 2.85Å; S233-E244 PolarHBondContact O-N 2.9Å
234	W	86	Confident	79.6	Confident	1 Å²	1	38.9 Å²	38.9	0%	0.004	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	153.4	177.6	-52.9	83.5	0	0	0	109.7	I181 T197 A203 N221 L222 T224 C232 L239 P242	I181-W234 HydrophobicContact CD1-CD2 4.06Å; I181-W234 VanDerWaalsContact CD1-CE2 3.41Å; I181-W234 HydrophobicContact CD1-CG 4.16Å; I181-W234 HydrophobicContact CD1-CZ2 3.87Å; T197-W234 HydrophobicContact CG2-CD2 4.48Å; T197-W234 HydrophobicContact CG2-CE3 4.05Å; T197-W234 HydrophobicContact CG2-CH2 4.14Å; T197-W234 HydrophobicContact CG2-CZ3 3.85Å; A203-W234 HydrophobicContact CB-CH2 3.74Å; A203-W234 HydrophobicContact CB-CZ2 3.95Å; N221-W234 CarbonylContact C-O 3.57Å; N221-W234 WeakPolarHBondContact CA-O 3.23Å; L222-W234 HydrophobicContact CB-CB 4.13Å; L222-W234 HydrophobicContact CD2-CB 4.26Å; L222-W234 PolarHBondContact N-O 2.84Å; L222-W234 PolarHBondContact O-N 3.46Å; T224-W234 PolarHBondContact OG1-NE1 3.11Å; C232-W234 HydrophobicContact CB-CZ2 4.22Å; C232-W234 VanDerWaalsContact CB-NE1 3.34Å; W234-L239 HydrophobicContact CB-CD2 4.03Å; W234-P242 HydrophobicContact CD2-CB 4.08Å; W234-P242 VanDerWaalsContact CE3-CA 3.5Å; W234-P242 HydrophobicContact CE3-CB 4.01Å; W234-P242 HydrophobicContact CH2-CB 3.78Å; W234-P242 HydrophobicContact CH2-CG 3.96Å; W234-P242 HydrophobicContact CZ2-CB 3.85Å; W234-P242 HydrophobicContact CZ2-CG 4.35Å; W234-P242 HydrophobicContact CZ3-CB 3.87Å; W234-P242 HydrophobicContact CZ3-CG 4.22Å
235	S	84.5	Confident	79.4	Confident	17 Å²	17	41.6 Å²	41.6	12%	0.119	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.9	142	163.2	166.9	0	0	0	0	109.2	D237 M238 L239	S235-D237 PolarHBondContact O-N 2.81Å; S235-D237 PolarHBondContact OG-N 2.9Å; S235-M238 CarbonylContact O-C 3.58Å; S235-M238 PolarHBondContact O-N 3.5Å; S235-L239 WeakPolarHBondContact O-CD2 3.2Å
236	L	74.9	Confident	79	Confident	11 Å²	11	42.9 Å²	42.9	6%	0.058	22%	0.223	C	C	.	.	S	Bend	trans	-60.9	-28.7	177.6	-68.4	174.1	0	0	0	112.3	A165 V173 V213 N220 L222	A165-L236 HydrophobicContact CB-CD1 4.48Å; V173-L236 HydrophobicContact CG2-CD2 4.18Å; V213-L236 HydrophobicContact CG1-CD1 4.33Å; V213-L236 HydrophobicContact CG2-CD2 4.45Å; N220-L236 HydrophobicContact CB-CD1 3.71Å; N220-L236 HydrophobicContact CB-CG 4.36Å; L222-L236 HydrophobicContact CB-CD2 4.23Å
237	D	75.6	Confident	78.5	Confident	145 Å²	145	48.1 Å²	48.1	78%	0.775	25%	0.247	S	C	*	.	S	Bend	trans	-86.7	-28.1	-177.2	-59.2	-37.4	0	0	0	112.7	S235	S235-D237 PolarHBondContact O-N 2.81Å; S235-D237 PolarHBondContact OG-N 2.9Å
238	M	74.2	Confident	78	Confident	120 Å²	120	47 Å²	47	59%	0.591	24%	0.24	S	C	*	.			trans	-127.2	86.1	-176.7	-171.4	165.4	-71.8	0	0	110.6	S235	S235-M238 CarbonylContact O-C 3.58Å; S235-M238 PolarHBondContact O-N 3.5Å
239	L	71.4	Confident	77.6	Confident	1 Å²	1	48.4 Å²	48.4	1%	0.005	25%	0.25	C	C	.	.			trans	-89.8	1.7	177.4	-66.7	177.3	0	0	0	113.6	L183 Q195 T197 L222 W234 S235 Q241	L183-L239 HydrophobicContact CB-CD1 3.95Å; L183-L239 HydrophobicContact CD1-CD1 3.9Å; Q195-L239 HydrophobicContact CB-CD1 4.36Å; Q195-L239 HydrophobicContact CG-CB 4.33Å; Q195-L239 HydrophobicContact CG-CD1 4.11Å; T197-L239 HydrophobicContact CG2-CB 3.91Å; T197-L239 HydrophobicContact CG2-CD2 4.26Å; T197-L239 WeakPolarHBondContact CG2-O 3.34Å; L222-L239 HydrophobicContact CD2-CD2 4.49Å; W234-L239 HydrophobicContact CB-CD2 4.03Å; S235-L239 WeakPolarHBondContact O-CD2 3.2Å; L239-Q241 VanDerWaalsContact C-N 3.32Å; L239-Q241 PolarHBondContact O-N 3.34Å
240	S	71.6	Confident	76.8	Confident	68 Å²	68	52.1 Å²	52.1	48%	0.476	26%	0.264	S	S	.	.	S	Bend	trans	-70.5	-28.8	-179.9	53.6	0	0	0	0	113.3	P198	P198-S240 VanDerWaalsContact CG-O 3.26Å; P198-S240 WeakPolarHBondContact CG-O 2.96Å
241	Q	73.3	Confident	75.7	Confident	143 Å²	143	55.4 Å²	55.4	67%	0.668	29%	0.286	S	S	*	.	S	Bend	trans	-143.3	143.6	178.2	-69.5	-176.7	-6.1	0	0	109.9	L239	L239-Q241 VanDerWaalsContact C-N 3.32Å; L239-Q241 PolarHBondContact O-N 3.34Å
242	P	73.1	Confident	74.4	Confident	25 Å²	25	65.3 Å²	65.3	16%	0.162	33%	0.329	C	S	.	.			trans	-67.9	140.2	172	27.8	-30.6	0	0	0	109.2	A202 C232 W234 T245	A202-P242 HydrophobicContact CB-CG 3.84Å; A202-P242 WeakPolarHBondContact O-CG 3.45Å; C232-P242 HydrophobicContact CB-CB 4.48Å; W234-P242 HydrophobicContact CD2-CB 4.08Å; W234-P242 VanDerWaalsContact CE3-CA 3.5Å; W234-P242 HydrophobicContact CE3-CB 4.01Å; W234-P242 HydrophobicContact CH2-CB 3.78Å; W234-P242 HydrophobicContact CH2-CG 3.96Å; W234-P242 HydrophobicContact CZ2-CB 3.85Å; W234-P242 HydrophobicContact CZ2-CG 4.35Å; W234-P242 HydrophobicContact CZ3-CB 3.87Å; W234-P242 HydrophobicContact CZ3-CG 4.22Å; P242-T245 WeakPolarHBondContact CG-OG1 3.44Å
243	Q	74.6	Confident	73.2	Confident	112 Å²	112	68.7 Å²	68.7	52%	0.523	35%	0.353	S	S	.	.	S	Bend	trans	-76	-43.1	176.9	-72	-168	-17	0	0	111.2	N221 S233	N221-Q243 PolarHBondContact OD1-OE1 2.89Å; S233-Q243 PolarHBondContact O-N 2.84Å
244	E	77.1	Confident	72.4	Confident	60 Å²	60	77.3 Å²	77.3	28%	0.28	39%	0.391	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.1	126.5	176.8	-61.2	176.5	146.6	0	0	107.8	C232 S233 R285 H286	C232-E244 CarbonylContact C-O 3.4Å; C232-E244 WeakPolarHBondContact CA-O 3.41Å; S233-E244 PolarHBondContact N-O 2.85Å; S233-E244 PolarHBondContact O-N 2.9Å; E244-R285 IonicContact OE2-NE 2.66Å; E244-R285 PolarHBondContact OE2-NE 3.44Å; E244-R285 IonicContact OE2-NH2 2.77Å; E244-H286 IonicContact OE1-ND1 3.79Å
245	T	80.6	Confident	71.4	Confident	57 Å²	57	81 Å²	81	35%	0.35	42%	0.415	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	123.2	168.4	-57.8	0	0	0	0	107.3	A202 P242	A202-T245 PolarHBondContact O-OG1 3.02Å; P242-T245 WeakPolarHBondContact CG-OG1 3.44Å
246	M	78.3	Confident	70.9	Confident	29 Å²	29	80.5 Å²	80.5	14%	0.143	41%	0.411	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	125.3	178.9	-66.9	-172.6	65.6	0	0	109.6	R230 M231 R285 A290	R230-M246 WeakPolarHBondContact CA-O 3.43Å; M231-M246 PolarHBondContact N-O 2.98Å; M231-M246 PolarHBondContact O-N 3.23Å; M231-M246 HydrophobicContact SD-CB 4.26Å; M231-M246 HydrophobicContact SD-CG 4.44Å; M231-M246 HydrophobicContact SD-SD 4.31Å; M246-R285 VanDerWaalsContact SD-O 3.34Å; M246-A290 HydrophobicContact CE-CB 3.74Å
247	E	76.6	Confident	71.1	Confident	109 Å²	109	81.1 Å²	81.1	51%	0.509	42%	0.417	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.1	123.2	170.4	-52	-165.1	143.4	0	0	109.2	R230 V249	R230-E247 HydrophobicContact CG-CG 4.08Å; R230-E247 IonicContact CZ-OE1 2.77Å; R230-E247 IonicContact NE-OE1 3.46Å; R230-E247 PolarHBondContact NE-OE1 3.03Å; R230-E247 IonicContact NH2-OE1 2.69Å; R230-E247 PolarHBondContact NH2-OE1 2.97Å; E247-V249 VanDerWaalsContact C-N 3.29Å; E247-V249 HydrophobicContact CB-CG2 3.97Å; E247-V249 PolarHBondContact O-N 3.01Å
248	L	71.8	Confident	71.3	Confident	2 Å²	2	74.2 Å²	74.2	1%	0.01	38%	0.381	C	S	.	.			trans	-81.2	80.2	174.3	-63.5	170.2	0	0	0	108.5	G229 M231 V256 V258 V273 A283 I292	G229-L248 WeakPolarHBondContact O-CA 3.29Å; G229-L248 VanDerWaalsContact O-CB 3.32Å; G229-L248 WeakPolarHBondContact O-CB 3.4Å; G229-L248 PolarHBondContact O-N 3.05Å; M231-L248 HydrophobicContact CB-CD1 4.4Å; L248-V256 PolarHBondContact O-N 3.01Å; L248-V258 HydrophobicContact CD1-CG2 3.81Å; L248-V273 HydrophobicContact CD1-CG1 4.21Å; L248-V273 HydrophobicContact CD1-CG2 4.24Å; L248-A283 HydrophobicContact CD2-CB 4Å; L248-I292 HydrophobicContact CB-CD1 4.29Å; L248-I292 HydrophobicContact CD2-CG1 4.17Å
249	V	70.8	Confident	71.6	Confident	58 Å²	58	69.5 Å²	69.5	35%	0.352	36%	0.359	S	S	.	.			trans	-106.2	117.3	176.2	-179.2	0	0	0	0	108.8	E247 S253	E247-V249 VanDerWaalsContact C-N 3.29Å; E247-V249 HydrophobicContact CB-CG2 3.97Å; E247-V249 PolarHBondContact O-N 3.01Å; V249-S253 WeakPolarHBondContact CG1-O 3.4Å
250	Y	61.8	Low	71.9	Confident	78 Å²	78	69.7 Å²	69.7	31%	0.306	36%	0.361	S	S	.	.	S	Bend	trans	-89.6	123.7	169.6	-172.2	-112.8	0	0	0	109.4	K252 S253 Y281 I292 M295	Y250-K252 VanDerWaalsContact C-N 3.29Å; Y250-K252 PolarHBondContact O-N 3.14Å; Y250-S253 PolarHBondContact O-N 3.28Å; Y250-S253 VanDerWaalsContact O-N 3.12Å; Y250-S253 PolarHBondContact O-OG 2.97Å; Y250-Y281 HydrophobicContact CD2-CE1 4.34Å; Y250-Y281 HydrophobicContact CG-CE1 4.14Å; Y250-I292 HydrophobicContact CD2-CB 4.41Å; Y250-I292 HydrophobicContact CD2-CG2 3.81Å; Y250-I292 HydrophobicContact CE2-CG2 4.37Å; Y250-M295 HydrophobicContact CD1-SD 4.14Å; Y250-M295 HydrophobicContact CE1-SD 3.61Å
251	N	57.7	Low	72.6	Confident	128 Å²	128	67.2 Å²	67.2	68%	0.684	34%	0.342	S	S	*	.	T	Hydrogen-bonded Turn	trans	45.8	40.4	171	-73.4	-18.6	0	0	0	116.8	S253	N251-S253 PolarHBondContact O-N 3.02Å
252	K	57.8	Low	73.1	Confident	207 Å²	207	60.8 Å²	60.8	90%	0.9	31%	0.313	S	S	*	.	T	Hydrogen-bonded Turn	trans	61.6	14.8	177.7	-53.3	-179.6	177.9	179	0	115.4	Y250	Y250-K252 VanDerWaalsContact C-N 3.29Å; Y250-K252 PolarHBondContact O-N 3.14Å
253	S	60.2	Low	73.5	Confident	72 Å²	72	60.8 Å²	60.8	50%	0.503	31%	0.311	S	S	.	.	S	Bend	trans	-81.3	178.9	166.4	65.3	0	0	0	0	110.6	V249 Y250 N251	V249-S253 WeakPolarHBondContact CG1-O 3.4Å; Y250-S253 PolarHBondContact O-N 3.28Å; Y250-S253 VanDerWaalsContact O-N 3.12Å; Y250-S253 PolarHBondContact O-OG 2.97Å; N251-S253 PolarHBondContact O-N 3.02Å
254	K	67.8	Low	73.7	Confident	180 Å²	180	56.2 Å²	56.2	78%	0.783	29%	0.291	S	S	*	.	S	Bend	trans	-51.4	153.7	-178.5	-67.8	177.4	-178.7	176.6	0	111.7	V256	K254-V256 PolarHBondContact O-N 3.37Å
255	P	66.8	Low	73.2	Confident	78 Å²	78	55.5 Å²	55.5	51%	0.506	29%	0.291	S	S	.	.			trans	-53.7	131.9	172.9	23	-33.2	0	0	0	110.1	D228 A257	D228-P255 WeakPolarHBondContact O-CB 3.33Å; P255-A257 PolarHBondContact O-N 2.76Å
256	V	74	Confident	72.3	Confident	8 Å²	8	56.5 Å²	56.5	5%	0.048	31%	0.312	C	S	.	.			trans	-75.7	115.1	178.7	175.8	0	0	0	0	108.1	G229 L248 K254 V258 Y281	G229-V256 WeakPolarHBondContact CA-O 3.38Å; L248-V256 PolarHBondContact O-N 3.01Å; K254-V256 PolarHBondContact O-N 3.37Å; V256-V258 PolarHBondContact O-N 2.75Å; V256-Y281 HydrophobicContact CB-CE2 4.33Å; V256-Y281 HydrophobicContact CG1-CD2 4Å; V256-Y281 HydrophobicContact CG1-CE2 3.45Å; V256-Y281 VanDerWaalsContact CG1-CE2 3.45Å; V256-Y281 HydrophobicContact CG2-CE2 4.02Å
257	A	77.6	Confident	71.9	Confident	23 Å²	23	59 Å²	59	19%	0.19	33%	0.326	C	S	.	.			trans	-67.6	122.2	173.4	0	0	0	0	0	110	T227 P255 S275 E276	T227-A257 HydrophobicContact CG2-CB 3.96Å; T227-A257 VanDerWaalsContact O-CA 3.3Å; T227-A257 WeakPolarHBondContact O-CA 3.36Å; T227-A257 WeakPolarHBondContact O-CB 3.4Å; P255-A257 PolarHBondContact O-N 2.76Å; A257-S275 CarbonylContact O-C 3.59Å; A257-S275 WeakPolarHBondContact O-CA 3.17Å; A257-E276 HydrophobicContact CB-CB 4.31Å; A257-E276 HydrophobicContact CB-CG 3.95Å; A257-E276 WeakPolarHBondContact CB-OE2 3.49Å; A257-E276 PolarHBondContact O-N 2.78Å
258	V	80.6	Confident	71.7	Confident	1 Å²	1	56.4 Å²	56.4	1%	0.006	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	130.2	-176.9	179.7	0	0	0	0	110.4	Y209 V225 L248 V256 G260 V273 G274	Y209-V258 VanDerWaalsContact CD2-O 3.3Å; Y209-V258 WeakPolarHBondContact CD2-O 3.42Å; V225-V258 HydrophobicContact CG1-CB 3.51Å; V225-V258 HydrophobicContact CG1-CG1 3.46Å; V225-V258 VanDerWaalsContact CG1-CG1 3.46Å; V225-V258 HydrophobicContact CG1-CG2 4.17Å; L248-V258 HydrophobicContact CD1-CG2 3.81Å; V256-V258 PolarHBondContact O-N 2.75Å; V258-G260 VanDerWaalsContact CG1-O 3.28Å; V258-G260 WeakPolarHBondContact CG1-O 3.37Å; V258-V273 HydrophobicContact CG1-CB 3.79Å; V258-V273 HydrophobicContact CG1-CG1 4.24Å; V258-V273 HydrophobicContact CG2-CB 4.17Å; V258-V273 HydrophobicContact CG2-CG2 4.4Å; V258-G274 CarbonylContact C-O 3.57Å; V258-G274 VanDerWaalsContact CA-O 3.25Å; V258-G274 WeakPolarHBondContact CA-O 3.11Å; V258-G274 WeakPolarHBondContact CG1-O 3.21Å
259	T	79.6	Confident	72	Confident	21 Å²	21	59.9 Å²	59.9	13%	0.129	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.9	-33.9	179.8	50.8	0	0	0	0	112.9	Y209 G274 E276 V303	Y209-T259 WeakPolarHBondContact CB-O 3.47Å; T259-G274 PolarHBondContact N-O 3.36Å; T259-G274 PolarHBondContact OG1-O 3.12Å; T259-E276 HydrophobicContact CG2-CB 4.39Å; T259-E276 HydrophobicContact CG2-CG 3.31Å; T259-V303 VanDerWaalsContact CB-O 3.23Å; T259-V303 WeakPolarHBondContact CB-O 3.32Å; T259-V303 PolarHBondContact OG1-O 2.97Å
260	G	78.3	Confident	72.6	Confident	5 Å²	5	60.1 Å²	60.1	5%	0.052	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.8	146.4	-172.4	0	0	0	0	0	111.6	V258 V273 G274	V258-G260 VanDerWaalsContact CG1-O 3.28Å; V258-G260 WeakPolarHBondContact CG1-O 3.37Å; G260-V273 WeakPolarHBondContact O-CA 3.28Å; G260-G274 PolarHBondContact O-N 3.13Å
261	M	85.8	Confident	73.7	Confident	16 Å²	16	56.5 Å²	56.5	8%	0.079	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.8	135.6	173.7	177.2	-175.6	55.1	0	0	110	C210 N212 I223 V225 F263 Y271 V272 V273	C210-M261 HydrophobicContact CB-CB 4.13Å; C210-M261 HydrophobicContact CB-CE 4.34Å; N212-M261 HydrophobicContact CB-CE 4.14Å; I223-M261 HydrophobicContact CB-CE 4.35Å; I223-M261 HydrophobicContact CG2-CE 3.84Å; I223-M261 HydrophobicContact CG2-SD 3.71Å; V225-M261 HydrophobicContact CG2-CB 4.17Å; V225-M261 HydrophobicContact CG2-CE 3.74Å; V225-M261 HydrophobicContact CG2-CG 4.29Å; V225-M261 HydrophobicContact CG2-SD 3.36Å; V225-M261 WeakPolarHBondContact CG2-SD 3.49Å; M261-F263 HydrophobicContact CE-CE2 3.65Å; M261-F263 HydrophobicContact CE-CZ 4.12Å; M261-F263 HydrophobicContact CG-CE2 4.06Å; M261-F263 HydrophobicContact CG-CZ 4.41Å; M261-F263 HydrophobicContact SD-CE2 3.58Å; M261-F263 VanDerWaalsContact SD-CE2 3.58Å; M261-F263 HydrophobicContact SD-CZ 3.59Å; M261-F263 VanDerWaalsContact SD-CZ 3.59Å; M261-Y271 HydrophobicContact CG-CD2 4.19Å; M261-Y271 HydrophobicContact SD-CD2 4.09Å; M261-V272 WeakPolarHBondContact CA-O 3.4Å; M261-V273 HydrophobicContact CB-CG1 4.5Å; M261-V273 HydrophobicContact CG-CG1 4.33Å
262	A	84.3	Confident	75.1	Confident	8 Å²	8	50.5 Å²	50.5	7%	0.066	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.8	148.4	172	0	0	0	0	0	111.4	V272 I306 C308	A262-V272 PolarHBondContact N-O 2.8Å; A262-V272 PolarHBondContact O-N 3.4Å; A262-I306 HydrophobicContact CB-CB 4.24Å; A262-I306 HydrophobicContact CB-CG2 3.68Å; A262-C308 HydrophobicContact CB-CB 4.45Å; A262-C308 VanDerWaalsContact CB-SG 3.59Å
263	F	82.3	Confident	76.4	Confident	25 Å²	25	40.7 Å²	40.7	11%	0.11	25%	0.246	C	C	.	.			trans	-106.5	130.3	173.8	-69	-89.6	0	0	0	109.1	N212 V214 I223 M261 Y271	N212-F263 HydrophobicContact CB-CD2 4.23Å; N212-F263 HydrophobicContact CB-CE2 3.89Å; V214-F263 HydrophobicContact CG1-CD1 4.22Å; V214-F263 HydrophobicContact CG1-CE1 4.42Å; V214-F263 HydrophobicContact CG2-CD1 3.93Å; V214-F263 HydrophobicContact CG2-CD2 3.63Å; V214-F263 HydrophobicContact CG2-CE1 3.79Å; V214-F263 HydrophobicContact CG2-CE2 3.49Å; V214-F263 VanDerWaalsContact CG2-CE2 3.49Å; V214-F263 HydrophobicContact CG2-CG 3.87Å; V214-F263 HydrophobicContact CG2-CZ 3.6Å; I223-F263 HydrophobicContact CB-CE2 4.47Å; I223-F263 HydrophobicContact CB-CZ 3.94Å; I223-F263 HydrophobicContact CD1-CE1 3.55Å; I223-F263 HydrophobicContact CD1-CE2 4.39Å; I223-F263 HydrophobicContact CD1-CZ 3.33Å; I223-F263 HydrophobicContact CG1-CZ 4.2Å; I223-F263 HydrophobicContact CG2-CZ 3.94Å; M261-F263 HydrophobicContact CE-CE2 3.65Å; M261-F263 HydrophobicContact CE-CZ 4.12Å; M261-F263 HydrophobicContact CG-CE2 4.06Å; M261-F263 HydrophobicContact CG-CZ 4.41Å; M261-F263 HydrophobicContact SD-CE2 3.58Å; M261-F263 VanDerWaalsContact SD-CE2 3.58Å; M261-F263 HydrophobicContact SD-CZ 3.59Å; M261-F263 VanDerWaalsContact SD-CZ 3.59Å; F263-Y271 VanDerWaalsContact CE1-CB 3.44Å; F263-Y271 HydrophobicContact CE1-CD1 4.29Å; F263-Y271 HydrophobicContact CE1-CG 4.06Å; F263-Y271 HydrophobicContact CZ-CG 4.4Å
264	P	77.8	Confident	77.6	Confident	16 Å²	16	37.2 Å²	37.2	10%	0.104	22%	0.222	C	C	.	.			trans	-57.5	139.1	164.4	-22	34.2	0	0	0	110.7	G266 D267 N270	P264-G266 PolarHBondContact O-N 2.75Å; P264-D267 PolarHBondContact O-N 3.37Å; P264-N270 VanDerWaalsContact CD-O 3.23Å; P264-N270 WeakPolarHBondContact CD-O 3.18Å
265	T	66.4	Low	78.5	Confident	45 Å²	45	28.7 Å²	28.7	28%	0.276	19%	0.185	S	C	.	.	T	Hydrogen-bonded Turn	trans	-71.6	116	175	47.3	0	0	0	0	109.4	H309	T265-H309 PolarHBondContact OG1-O 3.42Å
266	G	63.1	Low	79.3	Confident	77 Å²	77	28.6 Å²	28.6	79%	0.794	18%	0.178	S	C	*	.	T	Hydrogen-bonded Turn	trans	118.8	-27.2	-179	0	0	0	0	0	114.2	P264	P264-G266 PolarHBondContact O-N 2.75Å
267	D	69.6	Low	79.7	Confident	82 Å²	82	35.6 Å²	35.6	44%	0.439	21%	0.21	S	C	.	.			trans	-113.6	113.7	-179	-83.7	-10.4	0	0	0	111.8	P264 N269 N270	P264-D267 PolarHBondContact O-N 3.37Å; D267-N269 VanDerWaalsContact C-N 3.29Å; D267-N270 HydrophobicContact CB-CB 4.17Å; D267-N270 PolarHBondContact OD2-ND2 3.24Å
268	V	71.8	Confident	79.9	Confident	54 Å²	54	34.5 Å²	34.5	33%	0.327	20%	0.201	S	C	.	.	S	Bend	trans	-79.3	-17.6	174.9	171.8	0	0	0	0	112	V214	V214-V268 HydrophobicContact CG1-CB 4.03Å; V214-V268 HydrophobicContact CG1-CG1 3.66Å; V214-V268 HydrophobicContact CG1-CG2 3.98Å
269	N	78.6	Confident	80.2	Confident	75 Å²	75	35.1 Å²	35.1	40%	0.401	21%	0.205	S	C	.	.	S	Bend	trans	-96.7	-35.9	-173	-68	-16.7	0	0	0	112.9	D267 S284 R285	D267-N269 VanDerWaalsContact C-N 3.29Å; N269-S284 CarbonylContact O-C 3.56Å; N269-S284 VanDerWaalsContact O-CA 3.27Å; N269-S284 WeakPolarHBondContact O-CA 3.34Å; N269-R285 PolarHBondContact O-N 3.2Å
270	N	83.5	Confident	80.6	Confident	63 Å²	63	34.1 Å²	34.1	34%	0.337	20%	0.199	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.9	134.8	-178.5	-61.5	-33	0	0	0	109.1	P264 D267 S284	P264-N270 VanDerWaalsContact CD-O 3.23Å; P264-N270 WeakPolarHBondContact CD-O 3.18Å; D267-N270 HydrophobicContact CB-CB 4.17Å; D267-N270 PolarHBondContact OD2-ND2 3.24Å; N270-S284 PolarHBondContact OD1-OG 3.03Å
271	Y	84.1	Confident	81	Confident	2 Å²	2	34.2 Å²	34.2	1%	0.008	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.3	154.1	175.6	62.9	-83.7	0	0	0	110.4	M231 M261 F263 V273 T282 A283 R285	M231-Y271 HydrophobicContact CE-CE1 4.26Å; M231-Y271 HydrophobicContact CG-CE2 4.38Å; M261-Y271 HydrophobicContact CG-CD2 4.19Å; M261-Y271 HydrophobicContact SD-CD2 4.09Å; F263-Y271 VanDerWaalsContact CE1-CB 3.44Å; F263-Y271 HydrophobicContact CE1-CD1 4.29Å; F263-Y271 HydrophobicContact CE1-CG 4.06Å; F263-Y271 HydrophobicContact CZ-CG 4.4Å; Y271-V273 HydrophobicContact CD2-CG1 3.47Å; Y271-V273 VanDerWaalsContact CD2-CG1 3.47Å; Y271-V273 HydrophobicContact CE2-CG1 3.44Å; Y271-V273 VanDerWaalsContact CE2-CG1 3.44Å; Y271-T282 CarbonylContact O-C 3.59Å; Y271-T282 WeakPolarHBondContact O-CA 3.34Å; Y271-A283 HydrophobicContact CD1-CB 4.41Å; Y271-A283 VanDerWaalsContact CD1-O 3.23Å; Y271-A283 WeakPolarHBondContact CD1-O 3.13Å; Y271-A283 HydrophobicContact CD2-CB 4.25Å; Y271-A283 HydrophobicContact CE1-CB 3.84Å; Y271-A283 HydrophobicContact CE2-CB 3.66Å; Y271-A283 VanDerWaalsContact CZ-CB 3.42Å; Y271-A283 PolarHBondContact N-O 2.85Å; Y271-A283 PolarHBondContact O-N 3.26Å; Y271-R285 HydrophobicContact CD1-CB 4.49Å; Y271-R285 HydrophobicContact CE1-CB 4.12Å
272	V	86.4	Confident	80.9	Confident	2 Å²	2	34.1 Å²	34.1	1%	0.012	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	131.5	179.8	-173.3	0	0	0	0	107.7	M261 A262 V280 Y281 T282 I306 F321	M261-V272 WeakPolarHBondContact CA-O 3.4Å; A262-V272 PolarHBondContact N-O 2.8Å; A262-V272 PolarHBondContact O-N 3.4Å; V272-V280 HydrophobicContact CG1-CG1 3.24Å; V272-Y281 CarbonylContact C-O 3.59Å; V272-Y281 WeakPolarHBondContact CA-O 3.36Å; V272-T282 HydrophobicContact CG2-CG2 4.1Å; V272-I306 HydrophobicContact CB-CG2 4.36Å; V272-I306 HydrophobicContact CG1-CD1 4.44Å; V272-I306 HydrophobicContact CG1-CG2 4.09Å; V272-F321 HydrophobicContact CG1-CD2 4.15Å; V272-F321 HydrophobicContact CG1-CE2 4.12Å; V272-F321 HydrophobicContact CG2-CD1 4.48Å
273	V	86.1	Confident	80.7	Confident	1 Å²	1	33.8 Å²	33.8	1%	0.006	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	138.5	176.7	-61.9	0	0	0	0	110.4	L248 V258 G260 M261 Y271 V280 Y281	L248-V273 HydrophobicContact CD1-CG1 4.21Å; L248-V273 HydrophobicContact CD1-CG2 4.24Å; V258-V273 HydrophobicContact CG1-CB 3.79Å; V258-V273 HydrophobicContact CG1-CG1 4.24Å; V258-V273 HydrophobicContact CG2-CB 4.17Å; V258-V273 HydrophobicContact CG2-CG2 4.4Å; G260-V273 WeakPolarHBondContact O-CA 3.28Å; M261-V273 HydrophobicContact CB-CG1 4.5Å; M261-V273 HydrophobicContact CG-CG1 4.33Å; Y271-V273 HydrophobicContact CD2-CG1 3.47Å; Y271-V273 VanDerWaalsContact CD2-CG1 3.47Å; Y271-V273 HydrophobicContact CE2-CG1 3.44Å; Y271-V273 VanDerWaalsContact CE2-CG1 3.44Å; V273-V280 CarbonylContact O-C 3.59Å; V273-V280 WeakPolarHBondContact O-CA 3.43Å; V273-Y281 HydrophobicContact CG2-CD2 4.37Å; V273-Y281 HydrophobicContact CG2-CG 4.49Å; V273-Y281 WeakPolarHBondContact CG2-O 3.42Å; V273-Y281 PolarHBondContact N-O 3.41Å; V273-Y281 PolarHBondContact O-N 3.01Å
274	G	86.1	Confident	80.7	Confident	0 Å²	0	33.4 Å²	33.4	0%	0	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	130	178.8	0	0	0	0	0	110.2	V258 T259 G260	V258-G274 CarbonylContact C-O 3.57Å; V258-G274 VanDerWaalsContact CA-O 3.25Å; V258-G274 WeakPolarHBondContact CA-O 3.11Å; V258-G274 WeakPolarHBondContact CG1-O 3.21Å; T259-G274 PolarHBondContact N-O 3.36Å; T259-G274 PolarHBondContact OG1-O 3.12Å; G260-G274 PolarHBondContact O-N 3.13Å
275	S	86.5	Confident	80.3	Confident	0 Å²	0	34 Å²	34	0%	0	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.3	156.9	175.6	79.2	0	0	0	0	112.6	A257 E277 G278 T279 V303	A257-S275 CarbonylContact O-C 3.59Å; A257-S275 WeakPolarHBondContact O-CA 3.17Å; S275-E277 PolarHBondContact O-N 2.84Å; S275-E277 PolarHBondContact OG-N 3.37Å; S275-G278 PolarHBondContact O-N 2.65Å; S275-G278 PolarHBondContact OG-N 3.01Å; S275-T279 VanDerWaalsContact CB-O 3.3Å; S275-T279 WeakPolarHBondContact CB-O 3.49Å; S275-T279 PolarHBondContact N-O 3.26Å; S275-T279 PolarHBondContact OG-N 2.98Å; S275-T279 PolarHBondContact OG-O 3.24Å; S275-T279 PolarHBondContact OG-OG1 3.35Å; S275-V303 PolarHBondContact O-N 2.9Å
276	E	83	Confident	80.3	Confident	76 Å²	76	37.9 Å²	37.9	36%	0.355	21%	0.211	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.5	-17.5	166.6	-66.9	-178.8	178	0	0	112.5	A257 T259 G278 P302	A257-E276 HydrophobicContact CB-CB 4.31Å; A257-E276 HydrophobicContact CB-CG 3.95Å; A257-E276 WeakPolarHBondContact CB-OE2 3.49Å; A257-E276 PolarHBondContact O-N 2.78Å; T259-E276 HydrophobicContact CG2-CB 4.39Å; T259-E276 HydrophobicContact CG2-CG 3.31Å; E276-G278 VanDerWaalsContact C-N 3.27Å; E276-G278 PolarHBondContact O-N 3.46Å; E276-P302 VanDerWaalsContact O-CA 3.24Å; E276-P302 WeakPolarHBondContact O-CA 3.39Å; E276-P302 WeakPolarHBondContact O-CB 3.42Å; E276-P302 WeakPolarHBondContact O-CG 3.39Å
277	E	82.7	Confident	80.3	Confident	155 Å²	155	36.3 Å²	36.3	72%	0.724	20%	0.195	S	C	*	.	T	Hydrogen-bonded Turn	trans	-85.2	2.4	179.3	-61.4	-172	166.2	0	0	112.9	S275 T279	S275-E277 PolarHBondContact O-N 2.84Å; S275-E277 PolarHBondContact OG-N 3.37Å; E277-T279 VanDerWaalsContact C-N 3.33Å
278	G	81.6	Confident	79.8	Confident	0 Å²	0	39 Å²	39	0%	0	22%	0.22	C	C	.	.	S	Bend	trans	83.7	9.4	-179.4	0	0	0	0	0	114.3	S275 E276 H299 G301	S275-G278 PolarHBondContact O-N 2.65Å; S275-G278 PolarHBondContact OG-N 3.01Å; E276-G278 VanDerWaalsContact C-N 3.27Å; E276-G278 PolarHBondContact O-N 3.46Å; G278-H299 WeakPolarHBondContact O-CB 3.3Å; G278-G301 WeakPolarHBondContact CA-O 3.43Å
279	T	87.5	Confident	79.2	Confident	14 Å²	14	43.8 Å²	43.8	9%	0.086	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	133.8	179.3	60.9	0	0	0	0	109.6	S275 E277 Y281 M295 E297	S275-T279 VanDerWaalsContact CB-O 3.3Å; S275-T279 WeakPolarHBondContact CB-O 3.49Å; S275-T279 PolarHBondContact N-O 3.26Å; S275-T279 PolarHBondContact OG-N 2.98Å; S275-T279 PolarHBondContact OG-O 3.24Å; S275-T279 PolarHBondContact OG-OG1 3.35Å; E277-T279 VanDerWaalsContact C-N 3.33Å; T279-Y281 WeakPolarHBondContact OG1-CE2 3.46Å; T279-Y281 VanDerWaalsContact OG1-CZ 3.26Å; T279-Y281 PolarHBondContact OG1-OH 2.9Å; T279-Y281 VanDerWaalsContact OG1-OH 3.1Å; T279-M295 HydrophobicContact CG2-CE 3.49Å; T279-M295 VanDerWaalsContact CG2-CE 3.49Å; T279-E297 HydrophobicContact CG2-CG 4.03Å
280	V	87.6	Confident	78.5	Confident	0 Å²	0	43 Å²	43	0%	0	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	134.3	176	-176	0	0	0	0	107.4	V272 V273 F296 V303 I306 F321 T323	V272-V280 HydrophobicContact CG1-CG1 3.24Å; V273-V280 CarbonylContact O-C 3.59Å; V273-V280 WeakPolarHBondContact O-CA 3.43Å; V280-F296 HydrophobicContact CB-CB 4.14Å; V280-F296 PolarHBondContact N-O 3.16Å; V280-F296 WeakPolarHBondContact O-CD2 3.08Å; V280-F296 PolarHBondContact O-N 3.36Å; V280-V303 HydrophobicContact CG2-CG2 3.95Å; V280-I306 HydrophobicContact CG1-CD1 4.38Å; V280-F321 HydrophobicContact CG1-CE2 3.81Å; V280-F321 HydrophobicContact CG1-CZ 4.38Å; V280-T323 HydrophobicContact CG1-CG2 4.36Å; V280-T323 HydrophobicContact CG2-CG2 3.67Å
281	Y	86.2	Confident	77.7	Confident	7 Å²	7	40.8 Å²	40.8	3%	0.027	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	137.9	177.9	-57.9	-81.3	0	0	0	109.8	Y250 V256 V272 V273 T279 I292 E294 M295	Y250-Y281 HydrophobicContact CD2-CE1 4.34Å; Y250-Y281 HydrophobicContact CG-CE1 4.14Å; V256-Y281 HydrophobicContact CB-CE2 4.33Å; V256-Y281 HydrophobicContact CG1-CD2 4Å; V256-Y281 HydrophobicContact CG1-CE2 3.45Å; V256-Y281 VanDerWaalsContact CG1-CE2 3.45Å; V256-Y281 HydrophobicContact CG2-CE2 4.02Å; V272-Y281 CarbonylContact C-O 3.59Å; V272-Y281 WeakPolarHBondContact CA-O 3.36Å; V273-Y281 HydrophobicContact CG2-CD2 4.37Å; V273-Y281 HydrophobicContact CG2-CG 4.49Å; V273-Y281 WeakPolarHBondContact CG2-O 3.42Å; V273-Y281 PolarHBondContact N-O 3.41Å; V273-Y281 PolarHBondContact O-N 3.01Å; T279-Y281 WeakPolarHBondContact OG1-CE2 3.46Å; T279-Y281 VanDerWaalsContact OG1-CZ 3.26Å; T279-Y281 PolarHBondContact OG1-OH 2.9Å; T279-Y281 VanDerWaalsContact OG1-OH 3.1Å; Y281-I292 HydrophobicContact CD1-CD1 4.12Å; Y281-I292 HydrophobicContact CD1-CG1 4.46Å; Y281-I292 HydrophobicContact CD1-CG2 3.47Å; Y281-I292 VanDerWaalsContact CD1-CG2 3.47Å; Y281-I292 HydrophobicContact CE1-CD1 4.43Å; Y281-I292 HydrophobicContact CE1-CG2 4.26Å; Y281-I292 HydrophobicContact CG-CD1 4.18Å; Y281-I292 HydrophobicContact CG-CG1 4.43Å; Y281-I292 HydrophobicContact CG-CG2 4.09Å; Y281-E294 WeakPolarHBondContact CA-O 3.08Å; Y281-M295 HydrophobicContact CD1-CB 3.97Å; Y281-M295 HydrophobicContact CD1-CG 3.92Å; Y281-M295 HydrophobicContact CE1-CB 3.96Å; Y281-M295 HydrophobicContact CE1-CE 4Å; Y281-M295 HydrophobicContact CE1-CG 3.52Å; Y281-M295 HydrophobicContact CE1-SD 3.71Å; Y281-M295 WeakPolarHBondContact OH-CE 3.06Å
282	T	83.5	Confident	77.2	Confident	14 Å²	14	42.1 Å²	42.1	9%	0.086	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.9	128.6	163.3	55.1	0	0	0	0	108.4	Y271 V272 C293 E294 F296 T335	Y271-T282 CarbonylContact O-C 3.59Å; Y271-T282 WeakPolarHBondContact O-CA 3.34Å; V272-T282 HydrophobicContact CG2-CG2 4.1Å; T282-C293 PolarHBondContact O-N 2.81Å; T282-E294 PolarHBondContact N-O 3.27Å; T282-E294 PolarHBondContact O-N 3.49Å; T282-E294 WeakPolarHBondContact OG1-CB 3.25Å; T282-E294 PolarHBondContact OG1-N 3.35Å; T282-F296 HydrophobicContact CG2-CD2 4.34Å; T282-F296 HydrophobicContact CG2-CE2 3.41Å; T282-F296 VanDerWaalsContact CG2-CE2 3.41Å; T282-F296 HydrophobicContact CG2-CZ 4.05Å; T282-T335 HydrophobicContact CG2-CG2 4.13Å
283	A	80.9	Confident	76.6	Confident	1 Å²	1	44.6 Å²	44.6	1%	0.008	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	149.6	177.7	0	0	0	0	0	110.9	L248 Y271 G291	L248-A283 HydrophobicContact CD2-CB 4Å; Y271-A283 HydrophobicContact CD1-CB 4.41Å; Y271-A283 VanDerWaalsContact CD1-O 3.23Å; Y271-A283 WeakPolarHBondContact CD1-O 3.13Å; Y271-A283 HydrophobicContact CD2-CB 4.25Å; Y271-A283 HydrophobicContact CE1-CB 3.84Å; Y271-A283 HydrophobicContact CE2-CB 3.66Å; Y271-A283 VanDerWaalsContact CZ-CB 3.42Å; Y271-A283 PolarHBondContact N-O 2.85Å; Y271-A283 PolarHBondContact O-N 3.26Å; A283-G291 VanDerWaalsContact CA-O 3.27Å; A283-G291 WeakPolarHBondContact CA-O 3.25Å
284	S	80.9	Confident	76.2	Confident	18 Å²	18	48 Å²	48	13%	0.126	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	130.6	173.1	-58.7	0	0	0	0	110.2	N269 N270 G291	N269-S284 CarbonylContact O-C 3.56Å; N269-S284 VanDerWaalsContact O-CA 3.27Å; N269-S284 WeakPolarHBondContact O-CA 3.34Å; N270-S284 PolarHBondContact OD1-OG 3.03Å; S284-G291 PolarHBondContact N-O 3.04Å; S284-G291 PolarHBondContact O-N 2.91Å
285	R	70.4	Confident	76	Confident	29 Å²	29	49.4 Å²	49.4	11%	0.109	28%	0.279	C	S	.	.	S	Bend	trans	-69.4	-41.7	-178.5	172.1	-178.5	153.4	-160.2	-7.2	112.5	N221 M231 E244 M246 N269 Y271	N221-R285 VanDerWaalsContact CG-NH2 3.25Å; N221-R285 PolarHBondContact ND2-NH1 3.1Å; N221-R285 PolarHBondContact ND2-NH2 3.42Å; M231-R285 HydrophobicContact CE-CB 4.25Å; M231-R285 HydrophobicContact CE-CG 3.98Å; E244-R285 IonicContact OE2-NE 2.66Å; E244-R285 PolarHBondContact OE2-NE 3.44Å; E244-R285 IonicContact OE2-NH2 2.77Å; M246-R285 VanDerWaalsContact SD-O 3.34Å; N269-R285 PolarHBondContact O-N 3.2Å; Y271-R285 HydrophobicContact CD1-CB 4.49Å; Y271-R285 HydrophobicContact CE1-CB 4.12Å
286	H	67	Low	75.9	Confident	125 Å²	125	49.4 Å²	49.4	58%	0.579	28%	0.279	S	S	*	.	S	Bend	trans	-134.8	125.5	-173.6	-158.2	82.1	0	0	0	111	E244	E244-H286 IonicContact OE1-ND1 3.79Å
287	G	62.8	Low	75.8	Confident	45 Å²	45	51.8 Å²	51.8	46%	0.464	29%	0.289	S	S	.	.	S	Bend	trans	150.2	179.6	175.9	0	0	0	0	0	114.4	K289 A290	G287-K289 PolarHBondContact O-N 3.21Å; G287-A290 WeakPolarHBondContact O-CB 3.39Å; G287-A290 PolarHBondContact O-N 3.03Å; G287-A290 VanDerWaalsContact O-N 3.08Å
288	S	57.7	Low	75.6	Confident	137 Å²	137	45.9 Å²	45.9	96%	0.958	27%	0.271	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.4	-14.7	174.7	52.9	0	0	0	0	113.6
289	K	60.9	Low	75.8	Confident	156 Å²	156	46.6 Å²	46.6	68%	0.678	27%	0.274	S	S	*	.	T	Hydrogen-bonded Turn	trans	-108.6	37.9	168.9	-62.2	-175.3	178.3	-176.4	0	111.7	G287 G291	G287-K289 PolarHBondContact O-N 3.21Å; K289-G291 PolarHBondContact O-N 3.08Å; K289-G291 VanDerWaalsContact O-N 3.13Å
290	A	62.4	Low	75.6	Confident	59 Å²	59	54.8 Å²	54.8	49%	0.488	31%	0.311	S	S	.	.	B	Isolated β-bridge	trans	-60.3	117	172.7	0	0	0	0	0	109.2	M246 G287	M246-A290 HydrophobicContact CE-CB 3.74Å; G287-A290 WeakPolarHBondContact O-CB 3.39Å; G287-A290 PolarHBondContact O-N 3.03Å; G287-A290 VanDerWaalsContact O-N 3.08Å
291	G	67.1	Low	75.5	Confident	15 Å²	15	55.3 Å²	55.3	16%	0.155	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	127.7	-165.2	-173.3	0	0	0	0	0	112.8	A283 S284 K289 C293	A283-G291 VanDerWaalsContact CA-O 3.27Å; A283-G291 WeakPolarHBondContact CA-O 3.25Å; S284-G291 PolarHBondContact N-O 3.04Å; S284-G291 PolarHBondContact O-N 2.91Å; K289-G291 PolarHBondContact O-N 3.08Å; K289-G291 VanDerWaalsContact O-N 3.13Å; G291-C293 PolarHBondContact O-N 3.34Å
292	I	73.9	Confident	75.5	Confident	31 Å²	31	57.6 Å²	57.6	16%	0.159	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.3	120.4	179.6	-65.7	168.1	0	0	0	109.1	L248 Y250 Y281	L248-I292 HydrophobicContact CB-CD1 4.29Å; L248-I292 HydrophobicContact CD2-CG1 4.17Å; Y250-I292 HydrophobicContact CD2-CB 4.41Å; Y250-I292 HydrophobicContact CD2-CG2 3.81Å; Y250-I292 HydrophobicContact CE2-CG2 4.37Å; Y281-I292 HydrophobicContact CD1-CD1 4.12Å; Y281-I292 HydrophobicContact CD1-CG1 4.46Å; Y281-I292 HydrophobicContact CD1-CG2 3.47Å; Y281-I292 VanDerWaalsContact CD1-CG2 3.47Å; Y281-I292 HydrophobicContact CE1-CD1 4.43Å; Y281-I292 HydrophobicContact CE1-CG2 4.26Å; Y281-I292 HydrophobicContact CG-CD1 4.18Å; Y281-I292 HydrophobicContact CG-CG1 4.43Å; Y281-I292 HydrophobicContact CG-CG2 4.09Å
293	C	73.1	Confident	75.8	Confident	53 Å²	53	56.9 Å²	56.9	36%	0.358	33%	0.328	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.9	-53.6	178.6	-72.7	0	0	0	0	111.7	T282 G291	T282-C293 PolarHBondContact O-N 2.81Å; G291-C293 PolarHBondContact O-N 3.34Å
294	E	77.6	Confident	76.1	Confident	73 Å²	73	58 Å²	58	34%	0.341	34%	0.335	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.1	151	-174.5	-56.2	-176.1	159.5	0	0	109.9	Y281 T282 F296	Y281-E294 WeakPolarHBondContact CA-O 3.08Å; T282-E294 PolarHBondContact N-O 3.27Å; T282-E294 PolarHBondContact O-N 3.49Å; T282-E294 WeakPolarHBondContact OG1-CB 3.25Å; T282-E294 PolarHBondContact OG1-N 3.35Å; E294-F296 HydrophobicContact CB-CE2 3.88Å; E294-F296 HydrophobicContact CB-CZ 4.1Å
295	M	83.1	Confident	76.3	Confident	30 Å²	30	57.2 Å²	57.2	15%	0.148	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	128.3	-178.8	-178.1	176.3	-174.4	0	0	108.1	Y250 T279 Y281 E297	Y250-M295 HydrophobicContact CD1-SD 4.14Å; Y250-M295 HydrophobicContact CE1-SD 3.61Å; T279-M295 HydrophobicContact CG2-CE 3.49Å; T279-M295 VanDerWaalsContact CG2-CE 3.49Å; Y281-M295 HydrophobicContact CD1-CB 3.97Å; Y281-M295 HydrophobicContact CD1-CG 3.92Å; Y281-M295 HydrophobicContact CE1-CB 3.96Å; Y281-M295 HydrophobicContact CE1-CE 4Å; Y281-M295 HydrophobicContact CE1-CG 3.52Å; Y281-M295 HydrophobicContact CE1-SD 3.71Å; Y281-M295 WeakPolarHBondContact OH-CE 3.06Å; M295-E297 HydrophobicContact CE-CG 3.67Å; M295-E297 WeakPolarHBondContact CE-OE1 2.8Å; M295-E297 HydrophobicContact CG-CG 4.14Å; M295-E297 HydrophobicContact SD-CG 4.33Å
296	F	83.3	Confident	77.2	Confident	0 Å²	0	56.5 Å²	56.5	0%	0	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	106.3	178.9	-58.6	-93.2	0	0	0	107.2	V280 T282 E294 F321 W333 S334 H337	V280-F296 HydrophobicContact CB-CB 4.14Å; V280-F296 PolarHBondContact N-O 3.16Å; V280-F296 WeakPolarHBondContact O-CD2 3.08Å; V280-F296 PolarHBondContact O-N 3.36Å; T282-F296 HydrophobicContact CG2-CD2 4.34Å; T282-F296 HydrophobicContact CG2-CE2 3.41Å; T282-F296 VanDerWaalsContact CG2-CE2 3.41Å; T282-F296 HydrophobicContact CG2-CZ 4.05Å; E294-F296 HydrophobicContact CB-CE2 3.88Å; E294-F296 HydrophobicContact CB-CZ 4.1Å; F296-F321 HydrophobicContact CD1-CZ 4.19Å; F296-F321 HydrophobicContact CD2-CZ 4.14Å; F296-F321 HydrophobicContact CE1-CZ 4.29Å; F296-F321 HydrophobicContact CE2-CZ 4.29Å; F296-F321 HydrophobicContact CG-CZ 4.13Å; F296-F321 HydrophobicContact CZ-CE1 4.47Å; F296-F321 HydrophobicContact CZ-CZ 4.37Å; F296-W333 HydrophobicContact CB-CE3 3.86Å; F296-W333 HydrophobicContact CB-CH2 4.25Å; F296-W333 HydrophobicContact CB-CZ3 3.68Å; F296-W333 AromaticContact CD1-CE3 3.87Å; F296-W333 HydrophobicContact CD1-CE3 3.87Å; F296-W333 HydrophobicContact CD1-CZ3 4.28Å; F296-W333 HydrophobicContact CG-CE3 4.23Å; F296-W333 HydrophobicContact CG-CZ3 4.45Å; F296-S334 WeakPolarHBondContact CE1-O 3.41Å; F296-H337 WeakPolarHBondContact CD1-O 3.37Å; F296-H337 WeakPolarHBondContact CE1-O 3.45Å
297	E	82.2	Confident	78.2	Confident	125 Å²	125	51 Å²	51	58%	0.584	30%	0.303	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-99.2	129.8	176.2	-68.5	-174.8	166.3	0	0	109.1	T279 M295	T279-E297 HydrophobicContact CG2-CG 4.03Å; M295-E297 HydrophobicContact CE-CG 3.67Å; M295-E297 WeakPolarHBondContact CE-OE1 2.8Å; M295-E297 HydrophobicContact CG-CG 4.14Å; M295-E297 HydrophobicContact SD-CG 4.33Å
298	G	78.6	Confident	79.3	Confident	32 Å²	32	49.2 Å²	49.2	33%	0.33	28%	0.284	S	S	.	.			trans	177.7	-20.6	173.4	0	0	0	0	0	115.2	K331	G298-K331 PolarHBondContact O-NZ 3.36Å
299	H	84.4	Confident	80.5	Confident	15 Å²	15	42.7 Å²	42.7	7%	0.069	24%	0.239	C	C	.	.			trans	-80.6	147.8	170	-70.5	-77.8	0	0	0	111.7	G278 T323 S325 D327 T329 K331 W333	G278-H299 WeakPolarHBondContact O-CB 3.3Å; H299-T323 PolarHBondContact NE2-OG1 2.99Å; H299-S325 WeakPolarHBondContact ND1-CB 3.38Å; H299-D327 WeakPolarHBondContact CA-OD2 3.27Å; H299-D327 WeakPolarHBondContact CB-OD2 3.48Å; H299-D327 IonicContact CG-OD2 2.83Å; H299-D327 IonicContact ND1-OD1 3.84Å; H299-D327 PolarHBondContact ND1-OD1 2.86Å; H299-D327 IonicContact ND1-OD2 3.13Å; H299-D327 PolarHBondContact ND1-OD2 3.23Å; H299-D327 VanDerWaalsContact ND1-OD2 3.09Å; H299-T329 PolarHBondContact ND1-OG1 3.01Å; H299-K331 VanDerWaalsContact CE1-CD 3.44Å; H299-K331 WeakPolarHBondContact CE1-CD 3.45Å; H299-K331 VanDerWaalsContact CE1-CG 3.48Å; H299-K331 WeakPolarHBondContact CE1-CG 3.44Å; H299-W333 AromaticContact CD2-CZ2 3.96Å; H299-W333 AromaticContact NE2-NE1 3.86Å
300	Q	83.7	Confident	81.1	Confident	185 Å²	185	37.5 Å²	37.5	86%	0.864	22%	0.222	S	C	*	.	S	Bend	trans	-98.2	-5.2	178	-63.3	-172.8	7	0	0	112.6	D327	Q300-D327 HydrophobicContact CB-CB 4.28Å; Q300-D327 PolarHBondContact N-OD2 2.88Å
301	G	85.2	Confident	81.5	Confident	12 Å²	12	34.9 Å²	34.9	12%	0.124	20%	0.2	C	C	.	.	S	Bend	trans	-140.3	175.7	178.2	0	0	0	0	0	112.8	G278 V303 S325	G278-G301 WeakPolarHBondContact CA-O 3.43Å; G301-V303 PolarHBondContact O-N 2.83Å; G301-S325 VanDerWaalsContact C-OG 3.3Å; G301-S325 PolarHBondContact O-OG 3.17Å
302	P	87.8	Confident	81.6	Confident	54 Å²	54	40.3 Å²	40.3	35%	0.351	23%	0.23	S	C	.	.			trans	-52.4	134	179.8	-24.3	31.1	0	0	0	112.3	E276 S325 F326	E276-P302 VanDerWaalsContact O-CA 3.24Å; E276-P302 WeakPolarHBondContact O-CA 3.39Å; E276-P302 WeakPolarHBondContact O-CB 3.42Å; E276-P302 WeakPolarHBondContact O-CG 3.39Å; P302-S325 VanDerWaalsContact O-CA 3.3Å; P302-S325 WeakPolarHBondContact O-CA 3.34Å; P302-S325 PolarHBondContact O-OG 3.32Å; P302-F326 PolarHBondContact O-N 3.01Å
303	V	89.6	Confident	81.2	Confident	0 Å²	0	40.7 Å²	40.7	0%	0	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.1	129.2	171.1	-177.3	0	0	0	0	107.5	T259 S275 V280 G301 I306 T323 S324	T259-V303 VanDerWaalsContact CB-O 3.23Å; T259-V303 WeakPolarHBondContact CB-O 3.32Å; T259-V303 PolarHBondContact OG1-O 2.97Å; S275-V303 PolarHBondContact O-N 2.9Å; V280-V303 HydrophobicContact CG2-CG2 3.95Å; G301-V303 PolarHBondContact O-N 2.83Å; V303-I306 HydrophobicContact CG1-CD1 4Å; V303-I306 HydrophobicContact CG1-CG1 3.68Å; V303-T323 HydrophobicContact CG1-CG2 4.38Å; V303-S324 CarbonylContact C-O 3.58Å; V303-S324 WeakPolarHBondContact CA-O 3.35Å; V303-S324 WeakPolarHBondContact CG1-O 3.28Å
304	T	86.1	Confident	80.6	Confident	23 Å²	23	43.8 Å²	43.8	14%	0.141	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.5	-34.9	-173.8	52.1	0	0	0	0	112.7	S324 F326 V351 Y352	T304-S324 PolarHBondContact N-O 3.36Å; T304-S324 PolarHBondContact OG1-O 2.91Å; T304-S324 PolarHBondContact OG1-OG 2.98Å; T304-F326 HydrophobicContact CG2-CD2 3.9Å; T304-V351 WeakPolarHBondContact CB-O 3.4Å; T304-V351 PolarHBondContact OG1-O 2.87Å; T304-Y352 VanDerWaalsContact CB-O 3.27Å; T304-Y352 WeakPolarHBondContact CB-O 3.38Å; T304-Y352 PolarHBondContact OG1-O 2.97Å
305	G	85.8	Confident	80.3	Confident	3 Å²	3	43 Å²	43	3%	0.031	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.7	143.2	-177.8	0	0	0	0	0	110.6	T323 S324	G305-T323 WeakPolarHBondContact O-CA 3.47Å; G305-S324 VanDerWaalsContact CA-OG 3.25Å; G305-S324 WeakPolarHBondContact CA-OG 3.34Å; G305-S324 PolarHBondContact N-OG 3.33Å; G305-S324 PolarHBondContact O-N 2.88Å; G305-S324 PolarHBondContact O-OG 3.23Å
306	I	89.7	Confident	79.8	Confident	13 Å²	13	46.9 Å²	46.9	7%	0.067	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.5	133.6	174.3	-60.1	173.9	0	0	0	107.6	A262 V272 V280 V303 I322 T323	A262-I306 HydrophobicContact CB-CB 4.24Å; A262-I306 HydrophobicContact CB-CG2 3.68Å; V272-I306 HydrophobicContact CB-CG2 4.36Å; V272-I306 HydrophobicContact CG1-CD1 4.44Å; V272-I306 HydrophobicContact CG1-CG2 4.09Å; V280-I306 HydrophobicContact CG1-CD1 4.38Å; V303-I306 HydrophobicContact CG1-CD1 4Å; V303-I306 HydrophobicContact CG1-CG1 3.68Å; I306-I322 WeakPolarHBondContact CA-O 3.29Å; I306-T323 HydrophobicContact CB-CG2 4.49Å; I306-T323 HydrophobicContact CD1-CG2 4.43Å; I306-T323 HydrophobicContact CG1-CG2 3.83Å; I306-T323 HydrophobicContact CG2-CG2 4.24Å
307	S	88.4	Confident	79.5	Confident	9 Å²	9	47.2 Å²	47.2	6%	0.063	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.2	125.8	172.4	-173.4	0	0	0	0	110.1	F321 I322 V354 W356	S307-F321 CarbonylContact O-C 3.59Å; S307-F321 WeakPolarHBondContact O-CA 3.27Å; S307-I322 PolarHBondContact N-O 2.85Å; S307-I322 PolarHBondContact O-N 3.27Å; S307-V354 WeakPolarHBondContact CB-O 3.33Å; S307-W356 VanDerWaalsContact O-CD1 3.3Å; S307-W356 PolarHBondContact OG-N 3.09Å
308	C	84.8	Confident	79.2	Confident	8 Å²	8	42.6 Å²	42.6	5%	0.054	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84	151.9	168.8	-61.4	0	0	0	0	109.6	A262 S310 F321	A262-C308 HydrophobicContact CB-CB 4.45Å; A262-C308 VanDerWaalsContact CB-SG 3.59Å; C308-S310 PolarHBondContact O-N 2.72Å; C308-S310 VanDerWaalsContact O-N 3.16Å; C308-F321 HydrophobicContact CB-CB 4.5Å
309	H	83.3	Confident	79.3	Confident	1 Å²	1	42.4 Å²	42.4	1%	0.005	25%	0.254	C	S	.	.			trans	-57.1	122.6	174.7	-175	-85.1	0	0	0	110.1	T265 A311 L320 P361	T265-H309 PolarHBondContact OG1-O 3.42Å; H309-A311 PolarHBondContact CE1-O 2.94Å; H309-A311 PolarHBondContact ND1-O 2.82Å; H309-L320 HydrophobicContact CB-CB 4.34Å; H309-L320 PolarHBondContact N-O 2.88Å; H309-P361 PolarHBondContact CD2-O 2.57Å; H309-P361 VanDerWaalsContact NE2-CA 3.35Å; H309-P361 WeakPolarHBondContact NE2-CA 3.45Å; H309-P361 PolarHBondContact NE2-O 2.81Å; H309-P361 VanDerWaalsContact NE2-O 3.08Å
310	S	74.2	Confident	79.5	Confident	47 Å²	47	41.7 Å²	41.7	33%	0.329	25%	0.25	S	S	.	.			trans	-104.4	-20.7	-171.7	-171.4	0	0	0	0	113.3	C308 V312	C308-S310 PolarHBondContact O-N 2.72Å; C308-S310 VanDerWaalsContact O-N 3.16Å; S310-V312 PolarHBondContact O-N 2.76Å
311	A	70.9	Confident	79.8	Confident	3 Å²	3	33 Å²	33	3%	0.025	21%	0.209	C	C	.	.			trans	-71.7	127.7	-178.2	0	0	0	0	0	111.2	H309 P358 W435	H309-A311 PolarHBondContact CE1-O 2.94Å; H309-A311 PolarHBondContact ND1-O 2.82Å; A311-P358 WeakPolarHBondContact CA-O 3.24Å; A311-W435 HydrophobicContact CB-CH2 3.73Å; A311-W435 HydrophobicContact CB-CZ2 4.11Å
312	V	68.6	Low	80.1	Confident	130 Å²	130	32.4 Å²	32.4	79%	0.788	20%	0.204	S	C	*	.			trans	-102.2	112	174.3	-178	0	0	0	0	108	S310	S310-V312 PolarHBondContact O-N 2.76Å
313	G	64.9	Low	80.3	Confident	38 Å²	38	29.8 Å²	29.8	39%	0.392	19%	0.187	S	C	.	.			trans	-139.5	-160	-177.9	0	0	0	0	0	113.5	V315	G313-V315 PolarHBondContact O-N 3.36Å
314	T	61.6	Low	80.4	Confident	119 Å²	119	29.8 Å²	29.8	73%	0.73	19%	0.187	S	C	*	.	S	Bend	trans	-65.6	-23.4	-175.2	53.1	0	0	0	0	113.5
315	V	70.3	Confident	80.6	Confident	57 Å²	57	28.7 Å²	28.7	35%	0.345	18%	0.18	S	C	.	.	S	Bend	trans	-122.9	131.9	176.7	-177.5	0	0	0	0	107.9	G313 F317 W435	G313-V315 PolarHBondContact O-N 3.36Å; V315-F317 HydrophobicContact CB-CE2 3.9Å; V315-F317 HydrophobicContact CB-CZ 3.95Å; V315-F317 HydrophobicContact CG1-CD1 4.36Å; V315-F317 HydrophobicContact CG1-CE1 3.8Å; V315-F317 HydrophobicContact CG1-CE2 3.96Å; V315-F317 HydrophobicContact CG1-CZ 3.58Å; V315-W435 HydrophobicContact CB-CE3 4.37Å; V315-W435 WeakPolarHBondContact O-CZ3 3.31Å
316	D	72.6	Confident	80.7	Confident	110 Å²	110	32.1 Å²	32.1	59%	0.588	19%	0.194	S	C	*	.			trans	-82.1	120	176.7	-172.7	15.1	0	0	0	110.8	S318	D316-S318 VanDerWaalsContact CG-OG 3.22Å; D316-S318 WeakPolarHBondContact OD1-CB 3.33Å; D316-S318 PolarHBondContact OD1-N 3.48Å; D316-S318 PolarHBondContact OD1-OG 2.64Å; D316-S318 PolarHBondContact OD2-OG 3.01Å
317	F	77.1	Confident	80.6	Confident	7 Å²	7	33 Å²	33	3%	0.031	20%	0.199	C	C	.	.			trans	-114.2	20.3	174	-62.6	-64.3	0	0	0	112.1	V315 H319 L320 W435 F438 A439 L442	V315-F317 HydrophobicContact CB-CE2 3.9Å; V315-F317 HydrophobicContact CB-CZ 3.95Å; V315-F317 HydrophobicContact CG1-CD1 4.36Å; V315-F317 HydrophobicContact CG1-CE1 3.8Å; V315-F317 HydrophobicContact CG1-CE2 3.96Å; V315-F317 HydrophobicContact CG1-CZ 3.58Å; F317-H319 PolarHBondContact O-N 2.92Å; F317-L320 HydrophobicContact CB-CD1 4.06Å; F317-L320 HydrophobicContact CB-CG 4.41Å; F317-L320 HydrophobicContact CD1-CD1 4.15Å; F317-L320 HydrophobicContact CG-CD1 4.36Å; F317-L320 WeakPolarHBondContact O-CB 3.41Å; F317-L320 PolarHBondContact O-N 3.36Å; F317-W435 AromaticContact CD2-CE3 3.91Å; F317-W435 HydrophobicContact CD2-CE3 3.91Å; F317-W435 AromaticContact CD2-CZ3 3.82Å; F317-W435 HydrophobicContact CD2-CZ3 3.82Å; F317-W435 AromaticContact CE2-CE3 3.68Å; F317-W435 HydrophobicContact CE2-CE3 3.68Å; F317-W435 HydrophobicContact CE2-CZ3 4.09Å; F317-F438 HydrophobicContact CD1-CD1 4.46Å; F317-F438 HydrophobicContact CD1-CE1 4.37Å; F317-F438 AromaticContact CD2-CD1 3.98Å; F317-F438 HydrophobicContact CD2-CD1 3.98Å; F317-F438 HydrophobicContact CD2-CE1 4.24Å; F317-F438 HydrophobicContact CE1-CD1 4.19Å; F317-F438 HydrophobicContact CE1-CE1 4.48Å; F317-F438 AromaticContact CE2-CD1 3.67Å; F317-F438 HydrophobicContact CE2-CD1 3.67Å; F317-F438 HydrophobicContact CE2-CE1 4.35Å; F317-F438 HydrophobicContact CG-CD1 4.37Å; F317-F438 HydrophobicContact CG-CE1 4.25Å; F317-F438 AromaticContact CZ-CD1 3.79Å; F317-F438 HydrophobicContact CZ-CD1 3.79Å; F317-F438 HydrophobicContact CZ-CE1 4.47Å; F317-A439 HydrophobicContact CE1-CB 4.47Å; F317-A439 HydrophobicContact CZ-CB 4.06Å; F317-L442 HydrophobicContact CD1-CD2 4.46Å; F317-L442 HydrophobicContact CE1-CD2 4.35Å
318	S	75.3	Confident	80.6	Confident	29 Å²	29	38.8 Å²	38.8	20%	0.203	22%	0.22	C	C	.	.	T	Hydrogen-bonded Turn	trans	-52.9	-24.5	178.9	58	0	0	0	0	114.6	D316 L320	D316-S318 VanDerWaalsContact CG-OG 3.22Å; D316-S318 WeakPolarHBondContact OD1-CB 3.33Å; D316-S318 PolarHBondContact OD1-N 3.48Å; D316-S318 PolarHBondContact OD1-OG 2.64Å; D316-S318 PolarHBondContact OD2-OG 3.01Å; S318-L320 PolarHBondContact O-N 2.91Å
319	H	81.6	Confident	80.8	Confident	28 Å²	28	39 Å²	39	13%	0.13	22%	0.221	C	C	.	.	T	Hydrogen-bonded Turn	trans	-74.6	-7.6	175	65.1	-89.9	0	0	0	114	F317 S334 T335	F317-H319 PolarHBondContact O-N 2.92Å; H319-S334 CarbonylContact O-C 3.4Å; H319-S334 VanDerWaalsContact O-CA 3.25Å; H319-S334 WeakPolarHBondContact O-CA 3.23Å; H319-T335 PolarHBondContact O-N 2.98Å; H319-T335 PolarHBondContact O-OG1 2.91Å
320	L	88.3	Confident	81.2	Confident	0 Å²	0	39 Å²	39	0%	0	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.7	137.3	178.6	-62.5	-179.3	0	0	0	111.4	H309 F317 S318 W333 L341 F438 L442	H309-L320 HydrophobicContact CB-CB 4.34Å; H309-L320 PolarHBondContact N-O 2.88Å; F317-L320 HydrophobicContact CB-CD1 4.06Å; F317-L320 HydrophobicContact CB-CG 4.41Å; F317-L320 HydrophobicContact CD1-CD1 4.15Å; F317-L320 HydrophobicContact CG-CD1 4.36Å; F317-L320 WeakPolarHBondContact O-CB 3.41Å; F317-L320 PolarHBondContact O-N 3.36Å; S318-L320 PolarHBondContact O-N 2.91Å; L320-W333 WeakPolarHBondContact CA-O 3.44Å; L320-W333 WeakPolarHBondContact CD2-O 3.19Å; L320-L341 HydrophobicContact CD2-CD1 3.74Å; L320-F438 HydrophobicContact CD1-CE1 3.76Å; L320-F438 HydrophobicContact CD1-CZ 3.94Å; L320-L442 HydrophobicContact CD1-CD1 4.32Å; L320-L442 HydrophobicContact CD1-CD2 4.04Å; L320-L442 HydrophobicContact CD2-CD1 4.27Å; L320-L442 HydrophobicContact CD2-CD2 4.39Å
321	F	90.1	Very high	82	Confident	1 Å²	1	37.5 Å²	37.5	0%	0.004	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.2	150.5	171.4	62.4	-86.5	0	0	0	110.1	V272 V280 F296 S307 C308 T323 W333	V272-F321 HydrophobicContact CG1-CD2 4.15Å; V272-F321 HydrophobicContact CG1-CE2 4.12Å; V272-F321 HydrophobicContact CG2-CD1 4.48Å; V280-F321 HydrophobicContact CG1-CE2 3.81Å; V280-F321 HydrophobicContact CG1-CZ 4.38Å; F296-F321 HydrophobicContact CD1-CZ 4.19Å; F296-F321 HydrophobicContact CD2-CZ 4.14Å; F296-F321 HydrophobicContact CE1-CZ 4.29Å; F296-F321 HydrophobicContact CE2-CZ 4.29Å; F296-F321 HydrophobicContact CG-CZ 4.13Å; F296-F321 HydrophobicContact CZ-CE1 4.47Å; F296-F321 HydrophobicContact CZ-CZ 4.37Å; S307-F321 CarbonylContact O-C 3.59Å; S307-F321 WeakPolarHBondContact O-CA 3.27Å; C308-F321 HydrophobicContact CB-CB 4.5Å; F321-T323 HydrophobicContact CD2-CG2 3.91Å; F321-T323 HydrophobicContact CE2-CG2 4.06Å; F321-W333 HydrophobicContact CD1-CB 3.95Å; F321-W333 HydrophobicContact CD2-CB 3.66Å; F321-W333 AromaticContact CD2-CD1 3.9Å; F321-W333 HydrophobicContact CD2-CG 4Å; F321-W333 HydrophobicContact CE1-CB 3.56Å; F321-W333 HydrophobicContact CE2-CB 3.23Å; F321-W333 AromaticContact CE2-CD1 3.59Å; F321-W333 HydrophobicContact CE2-CD2 4.24Å; F321-W333 AromaticContact CE2-CG 3.4Å; F321-W333 HydrophobicContact CE2-CG 3.4Å; F321-W333 VanDerWaalsContact CE2-CG 3.4Å; F321-W333 HydrophobicContact CG-CB 4.01Å; F321-W333 HydrophobicContact CZ-CB 3.19Å; F321-W333 HydrophobicContact CZ-CD2 4.42Å; F321-W333 AromaticContact CZ-CG 3.73Å; F321-W333 HydrophobicContact CZ-CG 3.73Å; F321-W333 PolarHBondContact N-O 3.15Å; F321-W333 PolarHBondContact O-N 2.82Å
322	I	91.3	Very high	83	Confident	0 Å²	0	37.4 Å²	37.4	0%	0	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	143.6	174.5	-71.3	175	0	0	0	108.5	I306 S307 V330 K331 L332 V354 W356 F364	I306-I322 WeakPolarHBondContact CA-O 3.29Å; S307-I322 PolarHBondContact N-O 2.85Å; S307-I322 PolarHBondContact O-N 3.27Å; I322-V330 HydrophobicContact CG2-CG1 3.25Å; I322-K331 WeakPolarHBondContact CA-O 3.48Å; I322-L332 HydrophobicContact CD1-CD1 4.36Å; I322-L332 HydrophobicContact CG1-CD1 3.67Å; I322-V354 HydrophobicContact CG2-CB 4.34Å; I322-V354 HydrophobicContact CG2-CG1 3.84Å; I322-V354 HydrophobicContact CG2-CG2 3.56Å; I322-W356 HydrophobicContact CD1-CD2 4Å; I322-W356 HydrophobicContact CD1-CH2 4Å; I322-W356 HydrophobicContact CD1-CZ2 3.23Å; I322-W356 VanDerWaalsContact CD1-NE1 3.31Å; I322-W356 HydrophobicContact CG1-CZ2 3.64Å; I322-F364 HydrophobicContact CD1-CB 3.9Å; I322-F364 HydrophobicContact CD1-CD1 3.48Å; I322-F364 VanDerWaalsContact CD1-CD1 3.48Å; I322-F364 HydrophobicContact CD1-CD2 4.05Å; I322-F364 HydrophobicContact CD1-CE1 3.93Å; I322-F364 HydrophobicContact CD1-CE2 4.45Å; I322-F364 HydrophobicContact CD1-CG 3.54Å; I322-F364 HydrophobicContact CD1-CZ 4.39Å
323	T	91.6	Very high	84	Confident	0 Å²	0	31.2 Å²	31.2	0%	0	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	141.2	171.4	58.3	0	0	0	0	110.4	V280 H299 V303 G305 I306 F321 V330 K331 W333	V280-T323 HydrophobicContact CG1-CG2 4.36Å; V280-T323 HydrophobicContact CG2-CG2 3.67Å; H299-T323 PolarHBondContact NE2-OG1 2.99Å; V303-T323 HydrophobicContact CG1-CG2 4.38Å; G305-T323 WeakPolarHBondContact O-CA 3.47Å; I306-T323 HydrophobicContact CB-CG2 4.49Å; I306-T323 HydrophobicContact CD1-CG2 4.43Å; I306-T323 HydrophobicContact CG1-CG2 3.83Å; I306-T323 HydrophobicContact CG2-CG2 4.24Å; F321-T323 HydrophobicContact CD2-CG2 3.91Å; F321-T323 HydrophobicContact CE2-CG2 4.06Å; T323-V330 CarbonylContact O-C 3.59Å; T323-V330 WeakPolarHBondContact O-CA 3.1Å; T323-K331 PolarHBondContact N-O 2.82Å; T323-K331 PolarHBondContact O-N 2.75Å; T323-W333 PolarHBondContact OG1-NE1 2.81Å
324	S	91.5	Very high	85.1	Confident	0 Å²	0	29.4 Å²	29.4	0%	0	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	149.3	168.6	58.8	0	0	0	0	109.5	V303 T304 G305	V303-S324 CarbonylContact C-O 3.58Å; V303-S324 WeakPolarHBondContact CA-O 3.35Å; V303-S324 WeakPolarHBondContact CG1-O 3.28Å; T304-S324 PolarHBondContact N-O 3.36Å; T304-S324 PolarHBondContact OG1-O 2.91Å; T304-S324 PolarHBondContact OG1-OG 2.98Å; G305-S324 VanDerWaalsContact CA-OG 3.25Å; G305-S324 WeakPolarHBondContact CA-OG 3.34Å; G305-S324 PolarHBondContact N-OG 3.33Å; G305-S324 PolarHBondContact O-N 2.88Å; G305-S324 PolarHBondContact O-OG 3.23Å
325	S	90.3	Very high	86	Confident	0 Å²	0	25.8 Å²	25.8	0%	0	13%	0.129	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.6	162.1	179.6	175.7	0	0	0	0	111.6	H299 G301 P302 D327 W328 T329	H299-S325 WeakPolarHBondContact ND1-CB 3.38Å; G301-S325 VanDerWaalsContact C-OG 3.3Å; G301-S325 PolarHBondContact O-OG 3.17Å; P302-S325 VanDerWaalsContact O-CA 3.3Å; P302-S325 WeakPolarHBondContact O-CA 3.34Å; P302-S325 PolarHBondContact O-OG 3.32Å; S325-D327 VanDerWaalsContact CB-OD1 3.23Å; S325-D327 WeakPolarHBondContact CB-OD1 3.38Å; S325-D327 PolarHBondContact O-N 3.01Å; S325-D327 PolarHBondContact OG-N 3.38Å; S325-D327 PolarHBondContact OG-OD1 3.45Å; S325-W328 PolarHBondContact O-N 2.86Å; S325-T329 PolarHBondContact N-O 3.2Å
326	F	88.8	Confident	86.5	Confident	75 Å²	75	29.7 Å²	29.7	33%	0.329	14%	0.141	S	C	.	.	T	Hydrogen-bonded Turn	trans	-68	-2.4	169.5	-132	-106.5	0	0	0	113.3	P302 T304 W328 Y350 Y352	P302-F326 PolarHBondContact O-N 3.01Å; T304-F326 HydrophobicContact CG2-CD2 3.9Å; F326-W328 PolarHBondContact O-N 3.21Å; F326-Y350 HydrophobicContact CB-CD1 4.46Å; F326-Y350 AromaticContact CD1-CD1 3.36Å; F326-Y350 HydrophobicContact CD1-CD1 3.36Å; F326-Y350 HydrophobicContact CD1-CD2 4.33Å; F326-Y350 AromaticContact CD1-CE1 3.46Å; F326-Y350 HydrophobicContact CD1-CE1 3.46Å; F326-Y350 VanDerWaalsContact CD1-CE1 3.46Å; F326-Y350 HydrophobicContact CD1-CE2 4.4Å; F326-Y350 AromaticContact CD1-CG 3.84Å; F326-Y350 HydrophobicContact CD1-CG 3.84Å; F326-Y350 HydrophobicContact CD2-CD1 4.21Å; F326-Y350 HydrophobicContact CD2-CG 4.12Å; F326-Y350 AromaticContact CE1-CD1 3.47Å; F326-Y350 HydrophobicContact CE1-CD1 3.47Å; F326-Y350 VanDerWaalsContact CE1-CD1 3.47Å; F326-Y350 AromaticContact CE1-CD2 3.56Å; F326-Y350 HydrophobicContact CE1-CD2 3.56Å; F326-Y350 AromaticContact CE1-CE1 3.5Å; F326-Y350 HydrophobicContact CE1-CE1 3.5Å; F326-Y350 VanDerWaalsContact CE1-CE1 3.5Å; F326-Y350 AromaticContact CE1-CE2 3.57Å; F326-Y350 HydrophobicContact CE1-CE2 3.57Å; F326-Y350 AromaticContact CE1-CG 3.51Å; F326-Y350 HydrophobicContact CE1-CG 3.51Å; F326-Y350 AromaticContact CE1-CZ 3.55Å; F326-Y350 HydrophobicContact CE2-CD1 4.3Å; F326-Y350 HydrophobicContact CE2-CD2 4.17Å; F326-Y350 AromaticContact CE2-CG 3.82Å; F326-Y350 HydrophobicContact CE2-CG 3.82Å; F326-Y350 AromaticContact CG-CD1 3.77Å; F326-Y350 HydrophobicContact CG-CD1 3.77Å; F326-Y350 HydrophobicContact CG-CE1 4.3Å; F326-Y350 HydrophobicContact CG-CG 4.13Å; F326-Y350 AromaticContact CZ-CD1 3.95Å; F326-Y350 HydrophobicContact CZ-CD1 3.95Å; F326-Y350 AromaticContact CZ-CD2 3.47Å; F326-Y350 HydrophobicContact CZ-CD2 3.47Å; F326-Y350 VanDerWaalsContact CZ-CD2 3.47Å; F326-Y350 HydrophobicContact CZ-CE1 4.35Å; F326-Y350 AromaticContact CZ-CE2 3.9Å; F326-Y350 HydrophobicContact CZ-CE2 3.9Å; F326-Y350 AromaticContact CZ-CG 3.5Å; F326-Y350 HydrophobicContact CZ-CG 3.5Å; F326-Y350 WeakPolarHBondContact O-CD1 3.44Å; F326-Y350 WeakPolarHBondContact O-CE1 3.41Å; F326-Y352 AromaticContact CE2-CE1 3.87Å; F326-Y352 HydrophobicContact CE2-CE1 3.87Å
327	D	87.3	Confident	86.9	Confident	30 Å²	30	28.2 Å²	28.2	16%	0.16	13%	0.131	C	C	.	.	T	Hydrogen-bonded Turn	trans	-83.1	14.4	172.5	68.7	7.3	0	0	0	113.6	H299 Q300 S325 T329 K331	H299-D327 WeakPolarHBondContact CA-OD2 3.27Å; H299-D327 WeakPolarHBondContact CB-OD2 3.48Å; H299-D327 IonicContact CG-OD2 2.83Å; H299-D327 IonicContact ND1-OD1 3.84Å; H299-D327 PolarHBondContact ND1-OD1 2.86Å; H299-D327 IonicContact ND1-OD2 3.13Å; H299-D327 PolarHBondContact ND1-OD2 3.23Å; H299-D327 VanDerWaalsContact ND1-OD2 3.09Å; Q300-D327 HydrophobicContact CB-CB 4.28Å; Q300-D327 PolarHBondContact N-OD2 2.88Å; S325-D327 VanDerWaalsContact CB-OD1 3.23Å; S325-D327 WeakPolarHBondContact CB-OD1 3.38Å; S325-D327 PolarHBondContact O-N 3.01Å; S325-D327 PolarHBondContact OG-N 3.38Å; S325-D327 PolarHBondContact OG-OD1 3.45Å; D327-T329 VanDerWaalsContact CG-OG1 3.23Å; D327-T329 PolarHBondContact O-N 3.41Å; D327-T329 VanDerWaalsContact O-N 3.15Å; D327-T329 WeakPolarHBondContact OD1-CB 3.2Å; D327-T329 PolarHBondContact OD1-N 3.1Å; D327-T329 PolarHBondContact OD1-OG1 2.89Å; D327-T329 PolarHBondContact OD2-OG1 2.81Å; D327-K331 IonicContact OD2-NZ 3.19Å; D327-K331 PolarHBondContact OD2-NZ 2.94Å
328	W	88.2	Confident	87	Confident	132 Å²	132	32.1 Å²	32.1	50%	0.5	15%	0.152	S	C	.	.	S	Bend	trans	66.5	2.1	-175.8	-46.2	-37.6	0	0	0	114.4	S325 F326 N347 Y350	S325-W328 PolarHBondContact O-N 2.86Å; F326-W328 PolarHBondContact O-N 3.21Å; W328-N347 WeakPolarHBondContact O-CB 3.46Å; W328-Y350 AromaticContact CD1-CD1 3.42Å; W328-Y350 VanDerWaalsContact CD1-CD1 3.42Å; W328-Y350 AromaticContact CD1-CE1 3.87Å; W328-Y350 VanDerWaalsContact CD1-N 3.27Å; W328-Y350 AromaticContact CE2-CE1 3.96Å; W328-Y350 HydrophobicContact CZ2-CE1 4.37Å; W328-Y350 AromaticContact NE1-CD1 3.1Å; W328-Y350 AromaticContact NE1-CE1 3.11Å; W328-Y350 AromaticContact NE1-CG 3.93Å; W328-Y350 AromaticContact NE1-CZ 3.96Å
329	T	89.3	Confident	87.3	Confident	13 Å²	13	36 Å²	36	8%	0.08	17%	0.165	C	C	.	.			trans	-104.5	144.4	-177.3	74.7	0	0	0	0	112.1	H299 S325 D327 K331 F344 E345	H299-T329 PolarHBondContact ND1-OG1 3.01Å; S325-T329 PolarHBondContact N-O 3.2Å; D327-T329 VanDerWaalsContact CG-OG1 3.23Å; D327-T329 PolarHBondContact O-N 3.41Å; D327-T329 VanDerWaalsContact O-N 3.15Å; D327-T329 WeakPolarHBondContact OD1-CB 3.2Å; D327-T329 PolarHBondContact OD1-N 3.1Å; D327-T329 PolarHBondContact OD1-OG1 2.89Å; D327-T329 PolarHBondContact OD2-OG1 2.81Å; T329-K331 VanDerWaalsContact OG1-CE 3.3Å; T329-K331 WeakPolarHBondContact OG1-CE 3.44Å; T329-K331 PolarHBondContact OG1-NZ 2.77Å; T329-F344 WeakPolarHBondContact CA-O 3.34Å; T329-E345 HydrophobicContact CG2-CG 3.92Å
330	V	91.6	Very high	87.4	Confident	0 Å²	0	36.4 Å²	36.4	0%	0	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.4	131	163.1	179.3	0	0	0	0	107.1	I322 T323 F344 V351 V354 F364 A366	I322-V330 HydrophobicContact CG2-CG1 3.25Å; T323-V330 CarbonylContact O-C 3.59Å; T323-V330 WeakPolarHBondContact O-CA 3.1Å; V330-F344 HydrophobicContact CB-CB 4.21Å; V330-F344 HydrophobicContact CB-CD2 4.09Å; V330-F344 HydrophobicContact CG1-CD2 4.02Å; V330-F344 PolarHBondContact N-O 3.39Å; V330-F344 VanDerWaalsContact N-O 3.09Å; V330-F344 VanDerWaalsContact O-CD2 3.28Å; V330-F344 WeakPolarHBondContact O-CD2 3.39Å; V330-F344 PolarHBondContact O-N 2.92Å; V330-V351 HydrophobicContact CG2-CG1 3.95Å; V330-V351 HydrophobicContact CG2-CG2 4.27Å; V330-V354 HydrophobicContact CG1-CG2 4.09Å; V330-F364 HydrophobicContact CG1-CE2 4.17Å; V330-A366 HydrophobicContact CG2-CB 4.26Å
331	K	91.3	Very high	87.3	Confident	16 Å²	16	37 Å²	37	7%	0.07	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	135.1	179.7	-69.7	179.7	-178	143.9	0	111.1	G298 H299 I322 T323 D327 T329 W333 P340 Y342 S343	G298-K331 PolarHBondContact O-NZ 3.36Å; H299-K331 VanDerWaalsContact CE1-CD 3.44Å; H299-K331 WeakPolarHBondContact CE1-CD 3.45Å; H299-K331 VanDerWaalsContact CE1-CG 3.48Å; H299-K331 WeakPolarHBondContact CE1-CG 3.44Å; I322-K331 WeakPolarHBondContact CA-O 3.48Å; T323-K331 PolarHBondContact N-O 2.82Å; T323-K331 PolarHBondContact O-N 2.75Å; D327-K331 IonicContact OD2-NZ 3.19Å; D327-K331 PolarHBondContact OD2-NZ 2.94Å; T329-K331 VanDerWaalsContact OG1-CE 3.3Å; T329-K331 WeakPolarHBondContact OG1-CE 3.44Å; T329-K331 PolarHBondContact OG1-NZ 2.77Å; K331-W333 HydrophobicContact CB-CZ2 4.07Å; K331-W333 VanDerWaalsContact CB-NE1 3.32Å; K331-W333 HydrophobicContact CD-CZ2 3.98Å; K331-W333 VanDerWaalsContact O-CD1 3.26Å; K331-P340 HydrophobicContact CB-CB 4.29Å; K331-P340 HydrophobicContact CD-CB 4.2Å; K331-P340 HydrophobicContact CD-CG 4.37Å; K331-P340 HydrophobicContact CG-CB 4.47Å; K331-Y342 WeakPolarHBondContact CA-O 3.35Å; K331-S343 VanDerWaalsContact CE-OG 3.3Å; K331-S343 WeakPolarHBondContact CE-OG 3.37Å
332	L	91	Very high	87.2	Confident	0 Å²	0	39.6 Å²	39.6	0%	0	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.8	131.2	170	179.9	63.9	0	0	0	109.1	I322 L341 Y342 F344 W356 L442	I322-L332 HydrophobicContact CD1-CD1 4.36Å; I322-L332 HydrophobicContact CG1-CD1 3.67Å; L332-L341 HydrophobicContact CD2-CB 4.46Å; L332-L341 HydrophobicContact CD2-CD1 4.47Å; L332-L341 HydrophobicContact CG-CB 4.31Å; L332-L341 HydrophobicContact CG-CD1 4.34Å; L332-L341 WeakPolarHBondContact O-CB 3.46Å; L332-L341 PolarHBondContact O-N 2.78Å; L332-Y342 PolarHBondContact N-O 2.85Å; L332-Y342 PolarHBondContact O-N 2.9Å; L332-F344 HydrophobicContact CB-CE2 4.06Å; L332-W356 HydrophobicContact CD1-CZ2 3.84Å; L332-L442 HydrophobicContact CD2-CD1 4.39Å
333	W	90.3	Very high	87	Confident	0 Å²	0	41.2 Å²	41.2	0%	0	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	163.2	-178.7	-58.6	89	0	0	0	111.6	F296 H299 L320 F321 T323 K331 P340	F296-W333 HydrophobicContact CB-CE3 3.86Å; F296-W333 HydrophobicContact CB-CH2 4.25Å; F296-W333 HydrophobicContact CB-CZ3 3.68Å; F296-W333 AromaticContact CD1-CE3 3.87Å; F296-W333 HydrophobicContact CD1-CE3 3.87Å; F296-W333 HydrophobicContact CD1-CZ3 4.28Å; F296-W333 HydrophobicContact CG-CE3 4.23Å; F296-W333 HydrophobicContact CG-CZ3 4.45Å; H299-W333 AromaticContact CD2-CZ2 3.96Å; H299-W333 AromaticContact NE2-NE1 3.86Å; L320-W333 WeakPolarHBondContact CA-O 3.44Å; L320-W333 WeakPolarHBondContact CD2-O 3.19Å; F321-W333 HydrophobicContact CD1-CB 3.95Å; F321-W333 HydrophobicContact CD2-CB 3.66Å; F321-W333 AromaticContact CD2-CD1 3.9Å; F321-W333 HydrophobicContact CD2-CG 4Å; F321-W333 HydrophobicContact CE1-CB 3.56Å; F321-W333 HydrophobicContact CE2-CB 3.23Å; F321-W333 AromaticContact CE2-CD1 3.59Å; F321-W333 HydrophobicContact CE2-CD2 4.24Å; F321-W333 AromaticContact CE2-CG 3.4Å; F321-W333 HydrophobicContact CE2-CG 3.4Å; F321-W333 VanDerWaalsContact CE2-CG 3.4Å; F321-W333 HydrophobicContact CG-CB 4.01Å; F321-W333 HydrophobicContact CZ-CB 3.19Å; F321-W333 HydrophobicContact CZ-CD2 4.42Å; F321-W333 AromaticContact CZ-CG 3.73Å; F321-W333 HydrophobicContact CZ-CG 3.73Å; F321-W333 PolarHBondContact N-O 3.15Å; F321-W333 PolarHBondContact O-N 2.82Å; T323-W333 PolarHBondContact OG1-NE1 2.81Å; K331-W333 HydrophobicContact CB-CZ2 4.07Å; K331-W333 VanDerWaalsContact CB-NE1 3.32Å; K331-W333 HydrophobicContact CD-CZ2 3.98Å; K331-W333 VanDerWaalsContact O-CD1 3.26Å; W333-P340 HydrophobicContact CD2-CB 4.1Å; W333-P340 VanDerWaalsContact CE3-CA 3.45Å; W333-P340 HydrophobicContact CE3-CB 3.98Å; W333-P340 HydrophobicContact CH2-CB 3.83Å; W333-P340 VanDerWaalsContact CH2-CD 3.49Å; W333-P340 HydrophobicContact CH2-CG 3.93Å; W333-P340 HydrophobicContact CZ2-CB 3.92Å; W333-P340 HydrophobicContact CZ2-CG 4.36Å; W333-P340 HydrophobicContact CZ3-CB 3.87Å; W333-P340 HydrophobicContact CZ3-CG 4.11Å
334	S	87.6	Confident	86.8	Confident	0 Å²	0	41.4 Å²	41.4	0%	0	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.9	131.7	170	158.2	0	0	0	0	108.9	F296 H319 K336 H337	F296-S334 WeakPolarHBondContact CE1-O 3.41Å; H319-S334 CarbonylContact O-C 3.4Å; H319-S334 VanDerWaalsContact O-CA 3.25Å; H319-S334 WeakPolarHBondContact O-CA 3.23Å; S334-K336 PolarHBondContact O-N 2.96Å; S334-K336 PolarHBondContact OG-N 2.81Å; S334-H337 PolarHBondContact O-N 2.79Å; S334-H337 VanDerWaalsContact O-O 3.04Å
335	T	81.4	Confident	86.4	Confident	44 Å²	44	48.3 Å²	48.3	27%	0.27	23%	0.228	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58.1	-14.6	176	-46.7	0	0	0	0	113	T282 H319	T282-T335 HydrophobicContact CG2-CG2 4.13Å; H319-T335 PolarHBondContact O-N 2.98Å; H319-T335 PolarHBondContact O-OG1 2.91Å
336	K	81.2	Confident	85.7	Confident	139 Å²	139	51.5 Å²	51.5	60%	0.604	25%	0.245	S	C	*	.	T	Hydrogen-bonded Turn	trans	-82.8	-13.2	176.3	-60.8	174.9	179.8	166.2	0	113.9	S334	S334-K336 PolarHBondContact O-N 2.96Å; S334-K336 PolarHBondContact OG-N 2.81Å
337	H	80.3	Confident	85.1	Confident	79 Å²	79	48.6 Å²	48.6	37%	0.366	23%	0.233	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.4	123.3	-169.7	-60.1	-54.6	0	0	0	112.1	F296 S334 K339	F296-H337 WeakPolarHBondContact CD1-O 3.37Å; F296-H337 WeakPolarHBondContact CE1-O 3.45Å; S334-H337 PolarHBondContact O-N 2.79Å; S334-H337 VanDerWaalsContact O-O 3.04Å; H337-K339 PolarHBondContact O-N 2.9Å
338	N	78	Confident	84.5	Confident	89 Å²	89	50.7 Å²	50.7	48%	0.476	25%	0.254	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.1	3	-174.9	-61.4	6.6	0	0	0	115.6
339	K	82	Confident	84.4	Confident	111 Å²	111	46.2 Å²	46.2	48%	0.483	24%	0.24	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	152.3	179.2	-71.6	-168.9	-165.9	171.4	0	109.5	H337 R449 E453	H337-K339 PolarHBondContact O-N 2.9Å; K339-R449 PolarHBondContact O-NH1 3.1Å; K339-E453 IonicContact NZ-OE1 2.82Å; K339-E453 PolarHBondContact NZ-OE1 3.01Å
340	P	85.2	Confident	84.3	Confident	36 Å²	36	49.6 Å²	49.6	23%	0.234	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-61.3	144.6	179.2	26.2	-31.5	0	0	0	110.1	K331 W333 R449	K331-P340 HydrophobicContact CB-CB 4.29Å; K331-P340 HydrophobicContact CD-CB 4.2Å; K331-P340 HydrophobicContact CD-CG 4.37Å; K331-P340 HydrophobicContact CG-CB 4.47Å; W333-P340 HydrophobicContact CD2-CB 4.1Å; W333-P340 VanDerWaalsContact CE3-CA 3.45Å; W333-P340 HydrophobicContact CE3-CB 3.98Å; W333-P340 HydrophobicContact CH2-CB 3.83Å; W333-P340 VanDerWaalsContact CH2-CD 3.49Å; W333-P340 HydrophobicContact CH2-CG 3.93Å; W333-P340 HydrophobicContact CZ2-CB 3.92Å; W333-P340 HydrophobicContact CZ2-CG 4.36Å; W333-P340 HydrophobicContact CZ3-CB 3.87Å; W333-P340 HydrophobicContact CZ3-CG 4.11Å; P340-R449 PolarHBondContact O-NH1 3.47Å
341	L	86.1	Confident	84.2	Confident	11 Å²	11	49.6 Å²	49.6	6%	0.058	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.4	-41.7	172.4	-69.5	179.9	0	0	0	110.7	L320 L332 L442 I445 R446	L320-L341 HydrophobicContact CD2-CD1 3.74Å; L332-L341 HydrophobicContact CD2-CB 4.46Å; L332-L341 HydrophobicContact CD2-CD1 4.47Å; L332-L341 HydrophobicContact CG-CB 4.31Å; L332-L341 HydrophobicContact CG-CD1 4.34Å; L332-L341 WeakPolarHBondContact O-CB 3.46Å; L332-L341 PolarHBondContact O-N 2.78Å; L341-L442 HydrophobicContact CD1-CD1 3.94Å; L341-I445 WeakPolarHBondContact O-CG2 3.32Å; L341-R446 HydrophobicContact CD2-CG 4.16Å
342	Y	86.4	Confident	84.1	Confident	56 Å²	56	51.8 Å²	51.8	22%	0.22	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.6	149.5	-178.3	-162.5	-98	0	0	0	110.3	K331 L332 F344 T382 I445	K331-Y342 WeakPolarHBondContact CA-O 3.35Å; L332-Y342 PolarHBondContact N-O 2.85Å; L332-Y342 PolarHBondContact O-N 2.9Å; Y342-F344 AromaticContact CD1-CD1 3.58Å; Y342-F344 HydrophobicContact CD1-CD1 3.58Å; Y342-F344 HydrophobicContact CD1-CD2 4.18Å; Y342-F344 AromaticContact CD1-CE1 3.26Å; Y342-F344 HydrophobicContact CD1-CE1 3.26Å; Y342-F344 AromaticContact CD1-CE2 3.93Å; Y342-F344 HydrophobicContact CD1-CE2 3.93Å; Y342-F344 AromaticContact CD1-CG 3.99Å; Y342-F344 HydrophobicContact CD1-CG 3.99Å; Y342-F344 AromaticContact CD1-CZ 3.42Å; Y342-F344 HydrophobicContact CD1-CZ 3.42Å; Y342-F344 VanDerWaalsContact CD1-CZ 3.42Å; Y342-F344 AromaticContact CE1-CD1 3.42Å; Y342-F344 HydrophobicContact CE1-CD1 3.42Å; Y342-F344 VanDerWaalsContact CE1-CD1 3.42Å; Y342-F344 AromaticContact CE1-CE1 3.35Å; Y342-F344 HydrophobicContact CE1-CE1 3.35Å; Y342-F344 HydrophobicContact CE1-CG 4.13Å; Y342-F344 HydrophobicContact CE1-CZ 4.03Å; Y342-F344 HydrophobicContact CG-CE1 4.42Å; Y342-F344 HydrophobicContact CG-CZ 4.31Å; Y342-T382 VanDerWaalsContact CE1-O 3.32Å; Y342-T382 WeakPolarHBondContact CE1-O 3.49Å; Y342-T382 PolarHBondContact OH-O 3.32Å; Y342-I445 HydrophobicContact CD2-CG2 4.07Å
343	S	87.5	Confident	84.1	Confident	35 Å²	35	52 Å²	52	25%	0.245	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	120.2	176.2	-164.8	0	0	0	0	108	K331 E345	K331-S343 VanDerWaalsContact CE-OG 3.3Å; K331-S343 WeakPolarHBondContact CE-OG 3.37Å; S343-E345 PolarHBondContact OG-OE1 2.96Å
344	F	86.9	Confident	84.2	Confident	3 Å²	3	52 Å²	52	1%	0.013	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.3	121.3	172.8	-51.4	-83	0	0	0	107.8	T329 V330 L332 Y342 F364 W376 L378 T382	T329-F344 WeakPolarHBondContact CA-O 3.34Å; V330-F344 HydrophobicContact CB-CB 4.21Å; V330-F344 HydrophobicContact CB-CD2 4.09Å; V330-F344 HydrophobicContact CG1-CD2 4.02Å; V330-F344 PolarHBondContact N-O 3.39Å; V330-F344 VanDerWaalsContact N-O 3.09Å; V330-F344 VanDerWaalsContact O-CD2 3.28Å; V330-F344 WeakPolarHBondContact O-CD2 3.39Å; V330-F344 PolarHBondContact O-N 2.92Å; L332-F344 HydrophobicContact CB-CE2 4.06Å; Y342-F344 AromaticContact CD1-CD1 3.58Å; Y342-F344 HydrophobicContact CD1-CD1 3.58Å; Y342-F344 HydrophobicContact CD1-CD2 4.18Å; Y342-F344 AromaticContact CD1-CE1 3.26Å; Y342-F344 HydrophobicContact CD1-CE1 3.26Å; Y342-F344 AromaticContact CD1-CE2 3.93Å; Y342-F344 HydrophobicContact CD1-CE2 3.93Å; Y342-F344 AromaticContact CD1-CG 3.99Å; Y342-F344 HydrophobicContact CD1-CG 3.99Å; Y342-F344 AromaticContact CD1-CZ 3.42Å; Y342-F344 HydrophobicContact CD1-CZ 3.42Å; Y342-F344 VanDerWaalsContact CD1-CZ 3.42Å; Y342-F344 AromaticContact CE1-CD1 3.42Å; Y342-F344 HydrophobicContact CE1-CD1 3.42Å; Y342-F344 VanDerWaalsContact CE1-CD1 3.42Å; Y342-F344 AromaticContact CE1-CE1 3.35Å; Y342-F344 HydrophobicContact CE1-CE1 3.35Å; Y342-F344 HydrophobicContact CE1-CG 4.13Å; Y342-F344 HydrophobicContact CE1-CZ 4.03Å; Y342-F344 HydrophobicContact CG-CE1 4.42Å; Y342-F344 HydrophobicContact CG-CZ 4.31Å; F344-F364 HydrophobicContact CD1-CZ 4.35Å; F344-F364 AromaticContact CD2-CZ 3.96Å; F344-F364 HydrophobicContact CD2-CZ 3.96Å; F344-F364 HydrophobicContact CE1-CE1 4.46Å; F344-F364 HydrophobicContact CE1-CZ 4.23Å; F344-F364 HydrophobicContact CE2-CE1 4.15Å; F344-F364 AromaticContact CE2-CZ 3.83Å; F344-F364 HydrophobicContact CE2-CZ 3.83Å; F344-F364 HydrophobicContact CG-CZ 4.26Å; F344-F364 HydrophobicContact CZ-CE1 4.06Å; F344-F364 HydrophobicContact CZ-CZ 4.01Å; F344-W376 HydrophobicContact CB-CH2 4.37Å; F344-W376 HydrophobicContact CD1-CE3 4.01Å; F344-W376 HydrophobicContact CD1-CH2 4.35Å; F344-W376 AromaticContact CD1-CZ3 3.86Å; F344-W376 HydrophobicContact CD1-CZ3 3.86Å; F344-W376 HydrophobicContact CE1-CE3 4.44Å; F344-L378 HydrophobicContact CE1-CD2 3.49Å; F344-L378 VanDerWaalsContact CE1-CD2 3.49Å; F344-L378 HydrophobicContact CZ-CD2 3.37Å; F344-T382 WeakPolarHBondContact CD1-O 3.01Å; F344-T382 WeakPolarHBondContact CE1-O 3.41Å
345	E	83	Confident	84.3	Confident	146 Å²	146	53.6 Å²	53.6	68%	0.682	27%	0.269	S	S	*	.			trans	-124.1	21.9	-172.4	-56.4	-171.9	171.1	0	0	112.6	T329 S343	T329-E345 HydrophobicContact CG2-CG 3.92Å; S343-E345 PolarHBondContact OG-OE1 2.96Å
346	D	76.1	Confident	84.8	Confident	67 Å²	67	51.6 Å²	51.6	36%	0.358	26%	0.257	S	S	.	.			trans	-85.7	-6.7	-179.1	-166.9	58.6	0	0	0	113.6	R372 W376 P385	D346-R372 IonicContact OD2-NH1 3.09Å; D346-W376 HydrophobicContact CB-CH2 3.69Å; D346-W376 HydrophobicContact CB-CZ2 3.96Å; D346-P385 WeakPolarHBondContact OD2-CD 3.43Å; D346-P385 WeakPolarHBondContact OD2-CG 3.16Å
347	N	76.2	Confident	85.2	Confident	14 Å²	14	45 Å²	45	8%	0.075	23%	0.228	C	C	.	.			trans	-72.9	142.7	-174	-65	39.3	0	0	0	111	W328 V351 D368	W328-N347 WeakPolarHBondContact O-CB 3.46Å; N347-V351 HydrophobicContact CB-CG2 3.96Å; N347-V351 WeakPolarHBondContact ND2-CG2 3.35Å; N347-D368 WeakPolarHBondContact CB-OD2 3.4Å; N347-D368 PolarHBondContact ND2-OD1 3.19Å
348	A	74.4	Confident	85.3	Confident	73 Å²	73	42.8 Å²	42.8	60%	0.603	22%	0.221	S	C	*	.	S	Bend	trans	-85.3	-21.2	-171.7	0	0	0	0	0	113.2	D368	A348-D368 PolarHBondContact N-OD2 3Å
349	D	85.8	Confident	85.6	Confident	39 Å²	39	41 Å²	41	21%	0.209	21%	0.213	C	C	.	.	S	Bend	trans	-157.2	-167.8	-177.3	-157.1	-6.8	0	0	0	111.5	V351 M370	D349-V351 PolarHBondContact O-N 3Å; D349-M370 HydrophobicContact CB-CG 3.69Å
350	Y	88.9	Confident	85.6	Confident	84 Å²	84	35.9 Å²	35.9	33%	0.329	19%	0.191	S	C	.	.			trans	-54	123.1	-179.2	-56.9	-50.5	0	0	0	112.1	F326 W328 D368 G369	F326-Y350 HydrophobicContact CB-CD1 4.46Å; F326-Y350 AromaticContact CD1-CD1 3.36Å; F326-Y350 HydrophobicContact CD1-CD1 3.36Å; F326-Y350 HydrophobicContact CD1-CD2 4.33Å; F326-Y350 AromaticContact CD1-CE1 3.46Å; F326-Y350 HydrophobicContact CD1-CE1 3.46Å; F326-Y350 VanDerWaalsContact CD1-CE1 3.46Å; F326-Y350 HydrophobicContact CD1-CE2 4.4Å; F326-Y350 AromaticContact CD1-CG 3.84Å; F326-Y350 HydrophobicContact CD1-CG 3.84Å; F326-Y350 HydrophobicContact CD2-CD1 4.21Å; F326-Y350 HydrophobicContact CD2-CG 4.12Å; F326-Y350 AromaticContact CE1-CD1 3.47Å; F326-Y350 HydrophobicContact CE1-CD1 3.47Å; F326-Y350 VanDerWaalsContact CE1-CD1 3.47Å; F326-Y350 AromaticContact CE1-CD2 3.56Å; F326-Y350 HydrophobicContact CE1-CD2 3.56Å; F326-Y350 AromaticContact CE1-CE1 3.5Å; F326-Y350 HydrophobicContact CE1-CE1 3.5Å; F326-Y350 VanDerWaalsContact CE1-CE1 3.5Å; F326-Y350 AromaticContact CE1-CE2 3.57Å; F326-Y350 HydrophobicContact CE1-CE2 3.57Å; F326-Y350 AromaticContact CE1-CG 3.51Å; F326-Y350 HydrophobicContact CE1-CG 3.51Å; F326-Y350 AromaticContact CE1-CZ 3.55Å; F326-Y350 HydrophobicContact CE2-CD1 4.3Å; F326-Y350 HydrophobicContact CE2-CD2 4.17Å; F326-Y350 AromaticContact CE2-CG 3.82Å; F326-Y350 HydrophobicContact CE2-CG 3.82Å; F326-Y350 AromaticContact CG-CD1 3.77Å; F326-Y350 HydrophobicContact CG-CD1 3.77Å; F326-Y350 HydrophobicContact CG-CE1 4.3Å; F326-Y350 HydrophobicContact CG-CG 4.13Å; F326-Y350 AromaticContact CZ-CD1 3.95Å; F326-Y350 HydrophobicContact CZ-CD1 3.95Å; F326-Y350 AromaticContact CZ-CD2 3.47Å; F326-Y350 HydrophobicContact CZ-CD2 3.47Å; F326-Y350 VanDerWaalsContact CZ-CD2 3.47Å; F326-Y350 HydrophobicContact CZ-CE1 4.35Å; F326-Y350 AromaticContact CZ-CE2 3.9Å; F326-Y350 HydrophobicContact CZ-CE2 3.9Å; F326-Y350 AromaticContact CZ-CG 3.5Å; F326-Y350 HydrophobicContact CZ-CG 3.5Å; F326-Y350 WeakPolarHBondContact O-CD1 3.44Å; F326-Y350 WeakPolarHBondContact O-CE1 3.41Å; W328-Y350 AromaticContact CD1-CD1 3.42Å; W328-Y350 VanDerWaalsContact CD1-CD1 3.42Å; W328-Y350 AromaticContact CD1-CE1 3.87Å; W328-Y350 VanDerWaalsContact CD1-N 3.27Å; W328-Y350 AromaticContact CE2-CE1 3.96Å; W328-Y350 HydrophobicContact CZ2-CE1 4.37Å; W328-Y350 AromaticContact NE1-CD1 3.1Å; W328-Y350 AromaticContact NE1-CE1 3.11Å; W328-Y350 AromaticContact NE1-CG 3.93Å; W328-Y350 AromaticContact NE1-CZ 3.96Å; Y350-D368 CarbonylContact O-C 3.56Å; Y350-D368 WeakPolarHBondContact O-CA 3.3Å; Y350-G369 PolarHBondContact O-N 3.43Å
351	V	89.8	Confident	85.5	Confident	0 Å²	0	34.2 Å²	34.2	0%	0	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.3	117.8	176.5	-165.4	0	0	0	0	108.4	T304 V330 N347 D349 A366 V367	T304-V351 WeakPolarHBondContact CB-O 3.4Å; T304-V351 PolarHBondContact OG1-O 2.87Å; V330-V351 HydrophobicContact CG2-CG1 3.95Å; V330-V351 HydrophobicContact CG2-CG2 4.27Å; N347-V351 HydrophobicContact CB-CG2 3.96Å; N347-V351 WeakPolarHBondContact ND2-CG2 3.35Å; D349-V351 PolarHBondContact O-N 3Å; V351-A366 HydrophobicContact CG1-CB 4.37Å; V351-V367 WeakPolarHBondContact CA-O 3.35Å; V351-V367 WeakPolarHBondContact CG1-O 3.23Å
352	Y	89	Confident	85.4	Confident	61 Å²	61	33.7 Å²	33.7	24%	0.239	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.5	-33.5	-174.3	-78.1	-71.4	0	0	0	113.8	T304 F326 V367 G369 A396 L397 R399	T304-Y352 VanDerWaalsContact CB-O 3.27Å; T304-Y352 WeakPolarHBondContact CB-O 3.38Å; T304-Y352 PolarHBondContact OG1-O 2.97Å; F326-Y352 AromaticContact CE2-CE1 3.87Å; F326-Y352 HydrophobicContact CE2-CE1 3.87Å; Y352-V367 PolarHBondContact N-O 2.54Å; Y352-G369 VanDerWaalsContact CE2-CA 3.46Å; Y352-A396 HydrophobicContact CE2-CB 4.34Å; Y352-L397 WeakPolarHBondContact CB-O 3.42Å; Y352-L397 WeakPolarHBondContact CD2-O 3.44Å; Y352-R399 PolarHBondContact O-NH1 2.88Å
353	D	89.9	Confident	85.5	Confident	5 Å²	5	31.1 Å²	31.1	3%	0.027	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-155	155.6	-179.4	-161.5	14.7	0	0	0	110.9	V367 R399 V400 R401	D353-V367 HydrophobicContact CB-CG2 3.82Å; D353-V367 WeakPolarHBondContact O-CG2 3.18Å; D353-V367 PolarHBondContact O-N 2.88Å; D353-V367 VanDerWaalsContact O-N 3.14Å; D353-R399 WeakPolarHBondContact OD2-CD 3.38Å; D353-V400 HydrophobicContact CB-CG1 4.06Å; D353-V400 PolarHBondContact OD2-N 3.29Å; D353-R401 IonicContact OD2-NH1 3.46Å
354	V	91.9	Very high	85.6	Confident	0 Å²	0	29.4 Å²	29.4	0%	0	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146	138.8	179.2	65.5	0	0	0	0	109.5	S307 I322 V330 F364 A365 A366	S307-V354 WeakPolarHBondContact CB-O 3.33Å; I322-V354 HydrophobicContact CG2-CB 4.34Å; I322-V354 HydrophobicContact CG2-CG1 3.84Å; I322-V354 HydrophobicContact CG2-CG2 3.56Å; V330-V354 HydrophobicContact CG1-CG2 4.09Å; V354-F364 HydrophobicContact CG2-CD2 3.98Å; V354-A365 CarbonylContact C-O 3.47Å; V354-A365 WeakPolarHBondContact CA-O 3.3Å; V354-A365 WeakPolarHBondContact CG2-O 3.3Å; V354-A366 HydrophobicContact CG2-CB 4.36Å
355	M	91.4	Very high	85.8	Confident	33 Å²	33	29.3 Å²	29.3	16%	0.163	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.1	131.7	179.1	-175.2	167	-85.9	0	0	112.9	F364 A365 V400 R401 W402	M355-F364 CarbonylContact O-C 3.56Å; M355-F364 WeakPolarHBondContact O-CA 3.43Å; M355-A365 PolarHBondContact N-O 3.28Å; M355-A365 PolarHBondContact O-N 3.44Å; M355-V400 HydrophobicContact CB-CG1 4.09Å; M355-R401 HydrophobicContact SD-CB 4.46Å; M355-W402 HydrophobicContact CG-CG 4.45Å; M355-W402 PolarHBondContact O-NE1 3.04Å; M355-W402 HydrophobicContact SD-CB 4.22Å; M355-W402 HydrophobicContact SD-CG 4.49Å; M355-W402 PolarHBondContact SD-N 3.17Å; M355-W402 VanDerWaalsContact SD-N 3.4Å
356	W	91.1	Very high	86.1	Confident	3 Å²	3	22.3 Å²	22.3	1%	0.011	12%	0.122	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-65.8	142.7	166.7	-81.7	100.8	0	0	0	112.1	S307 I322 L332 P361 F364 L378 F438	S307-W356 VanDerWaalsContact O-CD1 3.3Å; S307-W356 PolarHBondContact OG-N 3.09Å; I322-W356 HydrophobicContact CD1-CD2 4Å; I322-W356 HydrophobicContact CD1-CH2 4Å; I322-W356 HydrophobicContact CD1-CZ2 3.23Å; I322-W356 VanDerWaalsContact CD1-NE1 3.31Å; I322-W356 HydrophobicContact CG1-CZ2 3.64Å; L332-W356 HydrophobicContact CD1-CZ2 3.84Å; W356-P361 WeakPolarHBondContact CZ3-O 3.47Å; W356-F364 HydrophobicContact CD2-CB 4.26Å; W356-F364 HydrophobicContact CE3-CB 4.2Å; W356-L378 HydrophobicContact CH2-CD1 3.6Å; W356-L378 HydrophobicContact CZ2-CD1 4.47Å; W356-L378 HydrophobicContact CZ3-CD1 4.27Å; W356-F438 HydrophobicContact CH2-CZ 4.03Å
357	S	88.5	Confident	86.8	Confident	0 Å²	0	19.1 Å²	19.1	0%	0	11%	0.105	C	C	.	.			trans	-61.9	135.9	166.1	-177.2	0	0	0	0	110.1	V359 H360 M363	S357-V359 PolarHBondContact O-N 3.34Å; S357-V359 PolarHBondContact OG-N 3.4Å; S357-H360 PolarHBondContact OG-N 3.37Å; S357-M363 WeakPolarHBondContact CB-O 3.25Å; S357-M363 PolarHBondContact N-O 3.3Å
358	P	83.9	Confident	87.4	Confident	32 Å²	32	18.5 Å²	18.5	21%	0.208	10%	0.101	C	C	.	.	S	Bend	trans	-76.3	-13	175.4	28.9	-31.9	0	0	0	113	A311 W402 S403	A311-P358 WeakPolarHBondContact CA-O 3.24Å; P358-W402 VanDerWaalsContact CD-CB 3.48Å; P358-W402 HydrophobicContact CG-CB 4.13Å; P358-S403 WeakPolarHBondContact CG-O 3.26Å
359	V	83.7	Confident	87.8	Confident	51 Å²	51	15.3 Å²	15.3	31%	0.309	8%	0.076	S	C	.	.	S	Bend	trans	-109.9	-47.1	-174.2	174.4	0	0	0	0	111.1	S357 V430	S357-V359 PolarHBondContact O-N 3.34Å; S357-V359 PolarHBondContact OG-N 3.4Å; V359-V430 HydrophobicContact CG1-CG2 3.58Å; V359-V430 WeakPolarHBondContact O-CG2 3.37Å
360	H	83.1	Confident	87.8	Confident	5 Å²	5	19.5 Å²	19.5	2%	0.023	10%	0.096	C	C	.	.			trans	-95.1	129.4	-176.8	-172	-83.3	0	0	0	112.1	S357 A362 M363 V430	S357-H360 PolarHBondContact OG-N 3.37Å; H360-A362 VanDerWaalsContact C-N 3.35Å; H360-A362 PolarHBondContact ND1-N 2.99Å; H360-A362 VanDerWaalsContact ND1-N 3.16Å; H360-A362 PolarHBondContact O-N 3.15Å; H360-M363 HydrophobicContact CB-CB 3.91Å; H360-M363 HydrophobicContact CB-CE 3.88Å; H360-M363 WeakPolarHBondContact ND1-CB 3.43Å; H360-M363 PolarHBondContact ND1-N 3.21Å; H360-V430 HydrophobicContact CB-CG2 4.03Å
361	P	82.3	Confident	87.5	Confident	0 Å²	0	15.5 Å²	15.5	0%	0	8%	0.08	C	C	.	.	T	Hydrogen-bonded Turn	trans	-71.5	-25	-171.5	28.1	-36.7	0	0	0	114.8	H309 W356 W435 F438	H309-P361 PolarHBondContact CD2-O 2.57Å; H309-P361 VanDerWaalsContact NE2-CA 3.35Å; H309-P361 WeakPolarHBondContact NE2-CA 3.45Å; H309-P361 PolarHBondContact NE2-O 2.81Å; H309-P361 VanDerWaalsContact NE2-O 3.08Å; W356-P361 WeakPolarHBondContact CZ3-O 3.47Å; P361-W435 HydrophobicContact CB-CD2 3.93Å; P361-W435 HydrophobicContact CB-CE3 3.87Å; P361-W435 HydrophobicContact CB-CH2 3.79Å; P361-W435 HydrophobicContact CB-CZ2 3.87Å; P361-W435 HydrophobicContact CB-CZ3 3.8Å; P361-W435 HydrophobicContact CG-CD2 3.78Å; P361-W435 HydrophobicContact CG-CE3 4.24Å; P361-W435 HydrophobicContact CG-CG 4.08Å; P361-W435 HydrophobicContact CG-CH2 4.41Å; P361-W435 HydrophobicContact CG-CZ2 4Å; P361-F438 HydrophobicContact CB-CD1 4.46Å
362	A	84.6	Confident	87.4	Confident	0 Å²	0	18 Å²	18	0%	0	9%	0.09	C	C	.	.	T	Hydrogen-bonded Turn	trans	-111.9	8.8	-173.1	0	0	0	0	0	113.1	H360 L378 N379 F438	H360-A362 VanDerWaalsContact C-N 3.35Å; H360-A362 PolarHBondContact ND1-N 2.99Å; H360-A362 VanDerWaalsContact ND1-N 3.16Å; H360-A362 PolarHBondContact O-N 3.15Å; A362-L378 HydrophobicContact CB-CB 4.14Å; A362-L378 PolarHBondContact O-N 3.45Å; A362-N379 HydrophobicContact CB-CB 4.4Å; A362-F438 HydrophobicContact CB-CB 4.1Å; A362-F438 HydrophobicContact CB-CD2 3.4Å; A362-F438 VanDerWaalsContact CB-CD2 3.4Å; A362-F438 HydrophobicContact CB-CE2 3.93Å; A362-F438 HydrophobicContact CB-CG 3.76Å
363	M	87.3	Confident	87.3	Confident	2 Å²	2	15.1 Å²	15.1	1%	0.01	8%	0.078	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	132.2	-174	-176.2	166.2	64	0	0	112.2	S357 H360 W376 W402 L427	S357-M363 WeakPolarHBondContact CB-O 3.25Å; S357-M363 PolarHBondContact N-O 3.3Å; H360-M363 HydrophobicContact CB-CB 3.91Å; H360-M363 HydrophobicContact CB-CE 3.88Å; H360-M363 WeakPolarHBondContact ND1-CB 3.43Å; H360-M363 PolarHBondContact ND1-N 3.21Å; M363-W376 VanDerWaalsContact CA-O 3.23Å; M363-W376 WeakPolarHBondContact CA-O 3.4Å; M363-W402 HydrophobicContact CE-CH2 3.39Å; M363-W402 HydrophobicContact CE-CZ2 4.32Å; M363-W402 HydrophobicContact CE-CZ3 3.67Å; M363-W402 HydrophobicContact CG-CH2 4.01Å; M363-W402 HydrophobicContact CG-CZ2 4.14Å; M363-W402 HydrophobicContact SD-CH2 3.76Å; M363-W402 HydrophobicContact SD-CZ2 4.47Å; M363-L427 HydrophobicContact SD-CB 4.27Å
364	F	90.1	Very high	87.3	Confident	0 Å²	0	14.9 Å²	14.9	0%	0	8%	0.077	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.5	157.6	171.8	66.6	-89.6	0	0	0	111.2	I322 V330 F344 V354 M355 W356 W376 L378	I322-F364 HydrophobicContact CD1-CB 3.9Å; I322-F364 HydrophobicContact CD1-CD1 3.48Å; I322-F364 VanDerWaalsContact CD1-CD1 3.48Å; I322-F364 HydrophobicContact CD1-CD2 4.05Å; I322-F364 HydrophobicContact CD1-CE1 3.93Å; I322-F364 HydrophobicContact CD1-CE2 4.45Å; I322-F364 HydrophobicContact CD1-CG 3.54Å; I322-F364 HydrophobicContact CD1-CZ 4.39Å; V330-F364 HydrophobicContact CG1-CE2 4.17Å; F344-F364 HydrophobicContact CD1-CZ 4.35Å; F344-F364 AromaticContact CD2-CZ 3.96Å; F344-F364 HydrophobicContact CD2-CZ 3.96Å; F344-F364 HydrophobicContact CE1-CE1 4.46Å; F344-F364 HydrophobicContact CE1-CZ 4.23Å; F344-F364 HydrophobicContact CE2-CE1 4.15Å; F344-F364 AromaticContact CE2-CZ 3.83Å; F344-F364 HydrophobicContact CE2-CZ 3.83Å; F344-F364 HydrophobicContact CG-CZ 4.26Å; F344-F364 HydrophobicContact CZ-CE1 4.06Å; F344-F364 HydrophobicContact CZ-CZ 4.01Å; V354-F364 HydrophobicContact CG2-CD2 3.98Å; M355-F364 CarbonylContact O-C 3.56Å; M355-F364 WeakPolarHBondContact O-CA 3.43Å; W356-F364 HydrophobicContact CD2-CB 4.26Å; W356-F364 HydrophobicContact CE3-CB 4.2Å; F364-W376 HydrophobicContact CD1-CB 3.73Å; F364-W376 HydrophobicContact CD2-CB 3.94Å; F364-W376 AromaticContact CD2-CD1 3.9Å; F364-W376 HydrophobicContact CD2-CG 4.09Å; F364-W376 HydrophobicContact CE1-CB 3.3Å; F364-W376 AromaticContact CE1-CG 3.92Å; F364-W376 HydrophobicContact CE1-CG 3.92Å; F364-W376 HydrophobicContact CE2-CB 3.55Å; F364-W376 AromaticContact CE2-CD1 3.28Å; F364-W376 HydrophobicContact CE2-CD2 4.12Å; F364-W376 AromaticContact CE2-CG 3.35Å; F364-W376 HydrophobicContact CE2-CG 3.35Å; F364-W376 AromaticContact CE2-NE1 3.96Å; F364-W376 HydrophobicContact CG-CB 4.04Å; F364-W376 HydrophobicContact CZ-CB 3.21Å; F364-W376 AromaticContact CZ-CD1 3.71Å; F364-W376 AromaticContact CZ-CD2 3.78Å; F364-W376 HydrophobicContact CZ-CD2 3.78Å; F364-W376 HydrophobicContact CZ-CE3 4.36Å; F364-W376 AromaticContact CZ-CG 3.25Å; F364-W376 HydrophobicContact CZ-CG 3.25Å; F364-W376 PolarHBondContact N-O 3.39Å; F364-W376 PolarHBondContact O-N 3.39Å; F364-L378 HydrophobicContact CD1-CD1 4.21Å; F364-L378 HydrophobicContact CD1-CG 4.42Å; F364-L378 HydrophobicContact CE1-CD1 4.02Å; F364-L378 HydrophobicContact CE1-CD2 4.03Å; F364-L378 HydrophobicContact CE1-CG 3.96Å
365	A	90.5	Very high	87.2	Confident	0 Å²	0	15 Å²	15	0%	0	8%	0.078	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	136.1	174.6	0	0	0	0	0	109.5	V354 M355 L373 D374 L375 V400 W402	V354-A365 CarbonylContact C-O 3.47Å; V354-A365 WeakPolarHBondContact CA-O 3.3Å; V354-A365 WeakPolarHBondContact CG2-O 3.3Å; M355-A365 PolarHBondContact N-O 3.28Å; M355-A365 PolarHBondContact O-N 3.44Å; A365-L373 HydrophobicContact CB-CD1 4.32Å; A365-D374 CarbonylContact C-O 3.57Å; A365-D374 WeakPolarHBondContact CA-O 3.23Å; A365-L375 HydrophobicContact CB-CD2 3.52Å; A365-V400 HydrophobicContact CB-CG2 3.84Å; A365-W402 HydrophobicContact CB-CZ2 3.83Å
366	A	90.7	Very high	87	Confident	0 Å²	0	13.5 Å²	13.5	0%	0	7%	0.07	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	147.1	172.7	0	0	0	0	0	109.6	V330 V351 V354 D374	V330-A366 HydrophobicContact CG2-CB 4.26Å; V351-A366 HydrophobicContact CG1-CB 4.37Å; V354-A366 HydrophobicContact CG2-CB 4.36Å; A366-D374 PolarHBondContact N-O 3.21Å; A366-D374 PolarHBondContact O-N 3.32Å
367	V	89.8	Confident	86.8	Confident	0 Å²	0	14.4 Å²	14.4	0%	0	8%	0.075	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	134.4	177.6	-71.6	0	0	0	0	111.7	V351 Y352 D353 L373 L397 V400 V411	V351-V367 WeakPolarHBondContact CA-O 3.35Å; V351-V367 WeakPolarHBondContact CG1-O 3.23Å; Y352-V367 PolarHBondContact N-O 2.54Å; D353-V367 HydrophobicContact CB-CG2 3.82Å; D353-V367 WeakPolarHBondContact O-CG2 3.18Å; D353-V367 PolarHBondContact O-N 2.88Å; D353-V367 VanDerWaalsContact O-N 3.14Å; V367-L373 HydrophobicContact CG1-CD1 3.57Å; V367-L397 HydrophobicContact CB-CB 3.92Å; V367-L397 HydrophobicContact CB-CD1 4.41Å; V367-L397 HydrophobicContact CG1-CB 4.29Å; V367-L397 HydrophobicContact CG1-CD1 4.24Å; V367-V400 HydrophobicContact CG1-CB 3.77Å; V367-V400 HydrophobicContact CG1-CG1 4.4Å; V367-V400 HydrophobicContact CG1-CG2 4.17Å; V367-V400 HydrophobicContact CG2-CB 4.12Å; V367-V400 HydrophobicContact CG2-CG1 4.17Å; V367-V411 HydrophobicContact CG1-CG1 4.1Å; V367-V411 HydrophobicContact CG1-CG2 4.48Å
368	D	88.5	Confident	86.5	Confident	0 Å²	0	14.5 Å²	14.5	0%	0	8%	0.076	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	158.4	-176.8	-72.7	-0.8	0	0	0	112.4	N347 A348 Y350 M370 G371 R372	N347-D368 WeakPolarHBondContact CB-OD2 3.4Å; N347-D368 PolarHBondContact ND2-OD1 3.19Å; A348-D368 PolarHBondContact N-OD2 3Å; Y350-D368 CarbonylContact O-C 3.56Å; Y350-D368 WeakPolarHBondContact O-CA 3.3Å; D368-M370 PolarHBondContact O-N 3Å; D368-G371 PolarHBondContact O-N 3.44Å; D368-R372 HydrophobicContact CB-CB 4.17Å; D368-R372 PolarHBondContact N-O 3.31Å
369	G	84.2	Confident	86.5	Confident	7 Å²	7	14.5 Å²	14.5	7%	0.072	7%	0.074	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.4	-17.7	175.9	0	0	0	0	0	115.6	Y350 Y352 G371 A396	Y350-G369 PolarHBondContact O-N 3.43Å; Y352-G369 VanDerWaalsContact CE2-CA 3.46Å; G369-G371 VanDerWaalsContact C-N 3.3Å; G369-G371 PolarHBondContact O-N 3.34Å; G369-A396 WeakPolarHBondContact O-CA 3.45Å
370	M	84.4	Confident	86.3	Confident	127 Å²	127	17 Å²	17	63%	0.626	9%	0.085	S	C	*	.	T	Hydrogen-bonded Turn	trans	-88.1	11	177	-72.2	-62.4	-58.4	0	0	114.1	D349 D368	D349-M370 HydrophobicContact CB-CG 3.69Å; D368-M370 PolarHBondContact O-N 3Å
371	G	82.9	Confident	85.9	Confident	0 Å²	0	20.6 Å²	20.6	0%	0	11%	0.105	C	C	.	.	S	Bend	trans	86.4	14.5	-179.5	0	0	0	0	0	114.1	D368 G369 I391 L397	D368-G371 PolarHBondContact O-N 3.44Å; G369-G371 VanDerWaalsContact C-N 3.3Å; G369-G371 PolarHBondContact O-N 3.34Å; G371-I391 PolarHBondContact O-N 3.17Å; G371-L397 VanDerWaalsContact C-CD1 3.46Å
372	R	87.1	Confident	85.6	Confident	52 Å²	52	22.5 Å²	22.5	20%	0.196	12%	0.117	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.7	129	-178.3	-158.3	-176.5	-164.4	-146.8	5.2	110.9	D346 D368 D374 S388 V389 T390	D346-R372 IonicContact OD2-NH1 3.09Å; D368-R372 HydrophobicContact CB-CB 4.17Å; D368-R372 PolarHBondContact N-O 3.31Å; R372-D374 VanDerWaalsContact CD-OD1 3.3Å; R372-D374 WeakPolarHBondContact CD-OD1 3.01Å; R372-D374 WeakPolarHBondContact CD-OD2 3.3Å; R372-D374 WeakPolarHBondContact CG-OD1 3.41Å; R372-D374 IonicContact CZ-OD1 4Å; R372-D374 IonicContact CZ-OD2 3.63Å; R372-D374 IonicContact NE-OD1 3.32Å; R372-D374 PolarHBondContact NE-OD1 3.23Å; R372-D374 IonicContact NE-OD2 3.59Å; R372-D374 IonicContact NH1-OD1 3.44Å; R372-D374 PolarHBondContact NH1-OD1 3.34Å; R372-D374 IonicContact NH1-OD2 3.67Å; R372-D374 PolarHBondContact NH1-OD2 3.47Å; R372-S388 VanDerWaalsContact NH2-CB 3.32Å; R372-S388 PolarHBondContact NH2-OG 3.3Å; R372-S388 VanDerWaalsContact NH2-OG 3.16Å; R372-V389 WeakPolarHBondContact CA-O 3.48Å; R372-T390 HydrophobicContact CG-CG2 4.16Å
373	L	88.4	Confident	85.2	Confident	0 Å²	0	29.3 Å²	29.3	0%	0	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.1	116.7	166.8	173.3	69.7	0	0	0	108	L89 A365 V367 S388 V389 V400 V409 V411 Y421	L89-L373 HydrophobicContact CD1-CD2 4.45Å; A365-L373 HydrophobicContact CB-CD1 4.32Å; V367-L373 HydrophobicContact CG1-CD1 3.57Å; L373-S388 WeakPolarHBondContact O-CA 3.25Å; L373-V389 PolarHBondContact N-O 3.26Å; L373-V389 PolarHBondContact O-N 2.85Å; L373-V400 HydrophobicContact CD1-CG2 4.13Å; L373-V409 HydrophobicContact CD1-CG1 4.41Å; L373-V409 HydrophobicContact CD2-CG1 4.39Å; L373-V411 HydrophobicContact CD1-CG2 3.88Å; L373-V411 HydrophobicContact CD2-CG2 3.89Å; L373-V411 HydrophobicContact CG-CG2 4.36Å; L373-Y421 HydrophobicContact CD2-CD2 3.71Å; L373-Y421 HydrophobicContact CD2-CE2 4.27Å; L373-Y421 HydrophobicContact CD2-CG 4.09Å
374	D	89.1	Confident	84.9	Confident	0 Å²	0	33.1 Å²	33.1	0%	0	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	123.3	179.4	-72	-24.5	0	0	0	110.5	A365 A366 R372 P385 S388	A365-D374 CarbonylContact C-O 3.57Å; A365-D374 WeakPolarHBondContact CA-O 3.23Å; A366-D374 PolarHBondContact N-O 3.21Å; A366-D374 PolarHBondContact O-N 3.32Å; R372-D374 VanDerWaalsContact CD-OD1 3.3Å; R372-D374 WeakPolarHBondContact CD-OD1 3.01Å; R372-D374 WeakPolarHBondContact CD-OD2 3.3Å; R372-D374 WeakPolarHBondContact CG-OD1 3.41Å; R372-D374 IonicContact CZ-OD1 4Å; R372-D374 IonicContact CZ-OD2 3.63Å; R372-D374 IonicContact NE-OD1 3.32Å; R372-D374 PolarHBondContact NE-OD1 3.23Å; R372-D374 IonicContact NE-OD2 3.59Å; R372-D374 IonicContact NH1-OD1 3.44Å; R372-D374 PolarHBondContact NH1-OD1 3.34Å; R372-D374 IonicContact NH1-OD2 3.67Å; R372-D374 PolarHBondContact NH1-OD2 3.47Å; D374-P385 HydrophobicContact CB-CB 4.09Å; D374-S388 WeakPolarHBondContact OD1-CA 3.42Å; D374-S388 WeakPolarHBondContact OD1-CB 3.23Å
375	L	88.8	Confident	84.5	Confident	3 Å²	3	33.8 Å²	33.8	2%	0.016	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.8	125.6	171	-69.8	-173.6	0	0	0	110.2	L89 A365 P385 T386 A387 W402 T423	L89-L375 HydrophobicContact CD1-CD1 3.76Å; L89-L375 HydrophobicContact CD1-CG 4.02Å; L89-L375 HydrophobicContact CD2-CD1 3.28Å; L89-L375 HydrophobicContact CD2-CG 4.28Å; L89-L375 HydrophobicContact CG-CD1 3.74Å; A365-L375 HydrophobicContact CB-CD2 3.52Å; L375-P385 CarbonylContact O-C 3.53Å; L375-T386 PolarHBondContact O-N 3.44Å; L375-A387 HydrophobicContact CB-CB 4.21Å; L375-A387 PolarHBondContact N-O 3.3Å; L375-A387 PolarHBondContact O-N 3.05Å; L375-A387 VanDerWaalsContact O-N 3.15Å; L375-W402 HydrophobicContact CD2-CH2 3.88Å; L375-W402 HydrophobicContact CD2-CZ2 3.59Å; L375-T423 HydrophobicContact CD1-CG2 3.69Å
376	W	87.9	Confident	84	Confident	2 Å²	2	36 Å²	36	1%	0.008	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	132.6	-177.7	-67.8	83.1	0	0	0	109.7	F344 D346 M363 F364 V384 P385	F344-W376 HydrophobicContact CB-CH2 4.37Å; F344-W376 HydrophobicContact CD1-CE3 4.01Å; F344-W376 HydrophobicContact CD1-CH2 4.35Å; F344-W376 AromaticContact CD1-CZ3 3.86Å; F344-W376 HydrophobicContact CD1-CZ3 3.86Å; F344-W376 HydrophobicContact CE1-CE3 4.44Å; D346-W376 HydrophobicContact CB-CH2 3.69Å; D346-W376 HydrophobicContact CB-CZ2 3.96Å; M363-W376 VanDerWaalsContact CA-O 3.23Å; M363-W376 WeakPolarHBondContact CA-O 3.4Å; F364-W376 HydrophobicContact CD1-CB 3.73Å; F364-W376 HydrophobicContact CD2-CB 3.94Å; F364-W376 AromaticContact CD2-CD1 3.9Å; F364-W376 HydrophobicContact CD2-CG 4.09Å; F364-W376 HydrophobicContact CE1-CB 3.3Å; F364-W376 AromaticContact CE1-CG 3.92Å; F364-W376 HydrophobicContact CE1-CG 3.92Å; F364-W376 HydrophobicContact CE2-CB 3.55Å; F364-W376 AromaticContact CE2-CD1 3.28Å; F364-W376 HydrophobicContact CE2-CD2 4.12Å; F364-W376 AromaticContact CE2-CG 3.35Å; F364-W376 HydrophobicContact CE2-CG 3.35Å; F364-W376 AromaticContact CE2-NE1 3.96Å; F364-W376 HydrophobicContact CG-CB 4.04Å; F364-W376 HydrophobicContact CZ-CB 3.21Å; F364-W376 AromaticContact CZ-CD1 3.71Å; F364-W376 AromaticContact CZ-CD2 3.78Å; F364-W376 HydrophobicContact CZ-CD2 3.78Å; F364-W376 HydrophobicContact CZ-CE3 4.36Å; F364-W376 AromaticContact CZ-CG 3.25Å; F364-W376 HydrophobicContact CZ-CG 3.25Å; F364-W376 PolarHBondContact N-O 3.39Å; F364-W376 PolarHBondContact O-N 3.39Å; W376-V384 VanDerWaalsContact CZ3-C 3.46Å; W376-P385 HydrophobicContact CD2-CB 4.13Å; W376-P385 HydrophobicContact CH2-CB 4.49Å; W376-P385 HydrophobicContact CZ2-CB 4.05Å; W376-P385 HydrophobicContact CZ2-CG 4.25Å
377	N	86.4	Confident	83.4	Confident	21 Å²	21	36.4 Å²	36.4	11%	0.112	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	105.6	169.1	-173.9	-5.6	0	0	0	109.9	N379 N380 D381 T386	N377-N379 PolarHBondContact O-N 3.22Å; N377-N379 VanDerWaalsContact O-N 3.09Å; N377-N379 WeakPolarHBondContact OD1-CB 3.34Å; N377-N379 PolarHBondContact OD1-N 2.89Å; N377-N379 VanDerWaalsContact OD1-N 3.15Å; N377-N380 PolarHBondContact O-N 3Å; N377-D381 PolarHBondContact O-N 3.21Å; N377-T386 WeakPolarHBondContact CB-OG1 3.42Å; N377-T386 PolarHBondContact N-OG1 2.85Å
378	L	83.8	Confident	83.1	Confident	2 Å²	2	38.9 Å²	38.9	1%	0.01	21%	0.21	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68	-10	-175.9	-62.6	164.5	0	0	0	114.1	F344 W356 A362 F364 T382 F438	F344-L378 HydrophobicContact CE1-CD2 3.49Å; F344-L378 VanDerWaalsContact CE1-CD2 3.49Å; F344-L378 HydrophobicContact CZ-CD2 3.37Å; W356-L378 HydrophobicContact CH2-CD1 3.6Å; W356-L378 HydrophobicContact CZ2-CD1 4.47Å; W356-L378 HydrophobicContact CZ3-CD1 4.27Å; A362-L378 HydrophobicContact CB-CB 4.14Å; A362-L378 PolarHBondContact O-N 3.45Å; F364-L378 HydrophobicContact CD1-CD1 4.21Å; F364-L378 HydrophobicContact CD1-CG 4.42Å; F364-L378 HydrophobicContact CE1-CD1 4.02Å; F364-L378 HydrophobicContact CE1-CD2 4.03Å; F364-L378 HydrophobicContact CE1-CG 3.96Å; L378-T382 HydrophobicContact CD2-CG2 4.36Å; L378-F438 HydrophobicContact CB-CD2 4.11Å; L378-F438 HydrophobicContact CB-CE2 3.75Å; L378-F438 HydrophobicContact CD1-CE2 3.61Å; L378-F438 HydrophobicContact CD1-CZ 4.07Å; L378-F438 HydrophobicContact CG-CE2 4.32Å
379	N	83.4	Confident	82.8	Confident	33 Å²	33	40.2 Å²	40.2	18%	0.176	22%	0.218	C	C	.	.	T	Hydrogen-bonded Turn	trans	-84.6	-21.4	173.7	-75.7	-15.1	0	0	0	113.3	A362 N377 D434 F438	A362-N379 HydrophobicContact CB-CB 4.4Å; N377-N379 PolarHBondContact O-N 3.22Å; N377-N379 VanDerWaalsContact O-N 3.09Å; N377-N379 WeakPolarHBondContact OD1-CB 3.34Å; N377-N379 PolarHBondContact OD1-N 2.89Å; N377-N379 VanDerWaalsContact OD1-N 3.15Å; N379-D434 PolarHBondContact ND2-O 3.37Å; N379-F438 WeakPolarHBondContact OD1-CA 3.5Å; N379-F438 VanDerWaalsContact OD1-CB 3.25Å; N379-F438 WeakPolarHBondContact OD1-CB 3.3Å; N379-F438 PolarHBondContact OD1-N 2.83Å; N379-F438 VanDerWaalsContact OD1-N 3.1Å
380	N	78.6	Confident	82.6	Confident	102 Å²	102	44.4 Å²	44.4	55%	0.545	24%	0.243	S	C	.	.	T	Hydrogen-bonded Turn	trans	-97.3	-65.6	-179	-169.1	52.3	0	0	0	110.2	N377	N377-N380 PolarHBondContact O-N 3Å
381	D	76.3	Confident	82.3	Confident	82 Å²	82	38.9 Å²	38.9	44%	0.439	22%	0.216	S	C	.	.			trans	-137.6	134.1	-179.4	-69.5	-56.1	0	0	0	109.8	N377	N377-D381 PolarHBondContact O-N 3.21Å
382	T	75.3	Confident	81.3	Confident	39 Å²	39	47.7 Å²	47.7	24%	0.239	26%	0.257	C	S	.	.	S	Bend	trans	-93.2	-15.2	177.7	52.8	0	0	0	0	113	Y342 F344 L378 I445	Y342-T382 VanDerWaalsContact CE1-O 3.32Å; Y342-T382 WeakPolarHBondContact CE1-O 3.49Å; Y342-T382 PolarHBondContact OH-O 3.32Å; F344-T382 WeakPolarHBondContact CD1-O 3.01Å; F344-T382 WeakPolarHBondContact CE1-O 3.41Å; L378-T382 HydrophobicContact CD2-CG2 4.36Å; T382-I445 HydrophobicContact CG2-CD1 4.21Å
383	E	75.8	Confident	80.1	Confident	144 Å²	144	48 Å²	48	67%	0.673	28%	0.277	S	S	*	.	S	Bend	trans	-101.7	-29.9	-173.5	-66	-178.1	178.4	0	0	113.2
384	V	82	Confident	78.8	Confident	82 Å²	82	48.6 Å²	48.6	50%	0.497	28%	0.281	S	S	.	.	S	Bend	trans	-122.2	138.4	-174.9	-177.2	0	0	0	0	109.8	W376 T386	W376-V384 VanDerWaalsContact CZ3-C 3.46Å; V384-T386 PolarHBondContact O-N 3.09Å
385	P	80.4	Confident	77.7	Confident	13 Å²	13	52.5 Å²	52.5	8%	0.084	31%	0.309	C	S	.	.			trans	-62.4	134.6	172.9	25.9	-33.8	0	0	0	110	D346 D374 L375 W376 A387	D346-P385 WeakPolarHBondContact OD2-CD 3.43Å; D346-P385 WeakPolarHBondContact OD2-CG 3.16Å; D374-P385 HydrophobicContact CB-CB 4.09Å; L375-P385 CarbonylContact O-C 3.53Å; W376-P385 HydrophobicContact CD2-CB 4.13Å; W376-P385 HydrophobicContact CH2-CB 4.49Å; W376-P385 HydrophobicContact CZ2-CB 4.05Å; W376-P385 HydrophobicContact CZ2-CG 4.25Å; P385-A387 VanDerWaalsContact C-N 3.3Å; P385-A387 PolarHBondContact O-N 3.45Å
386	T	79.4	Confident	77.3	Confident	47 Å²	47	53 Å²	53	29%	0.288	31%	0.314	S	S	.	.	S	Bend	trans	-69.2	-32.4	179.9	-52.6	0	0	0	0	111.5	L375 N377 V384 L427	L375-T386 PolarHBondContact O-N 3.44Å; N377-T386 WeakPolarHBondContact CB-OG1 3.42Å; N377-T386 PolarHBondContact N-OG1 2.85Å; V384-T386 PolarHBondContact O-N 3.09Å; T386-L427 HydrophobicContact CG2-CD2 4.32Å
387	A	79.7	Confident	77.2	Confident	8 Å²	8	53 Å²	53	7%	0.066	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.7	129.8	171.4	0	0	0	0	0	110.3	S88 L89 L375 P385	S88-A387 WeakPolarHBondContact OG-CB 3.34Å; L89-A387 HydrophobicContact CD1-CB 3.91Å; L89-A387 HydrophobicContact CG-CB 4.16Å; L375-A387 HydrophobicContact CB-CB 4.21Å; L375-A387 PolarHBondContact N-O 3.3Å; L375-A387 PolarHBondContact O-N 3.05Å; L375-A387 VanDerWaalsContact O-N 3.15Å; P385-A387 VanDerWaalsContact C-N 3.3Å; P385-A387 PolarHBondContact O-N 3.45Å
388	S	82.3	Confident	77.2	Confident	53 Å²	53	53.2 Å²	53.2	37%	0.371	31%	0.314	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	130.8	172.5	66.7	0	0	0	0	109.7	R372 L373 D374	R372-S388 VanDerWaalsContact NH2-CB 3.32Å; R372-S388 PolarHBondContact NH2-OG 3.3Å; R372-S388 VanDerWaalsContact NH2-OG 3.16Å; L373-S388 WeakPolarHBondContact O-CA 3.25Å; D374-S388 WeakPolarHBondContact OD1-CA 3.42Å; D374-S388 WeakPolarHBondContact OD1-CB 3.23Å
389	V	82.6	Confident	77.4	Confident	27 Å²	27	55.3 Å²	55.3	16%	0.164	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	126	173.3	171.5	0	0	0	0	109.1	L89 R372 L373 Y421	L89-V389 HydrophobicContact CB-CG2 3.65Å; L89-V389 HydrophobicContact CD1-CB 4.22Å; L89-V389 HydrophobicContact CD1-CG2 3.5Å; L89-V389 HydrophobicContact CG-CG2 4.22Å; R372-V389 WeakPolarHBondContact CA-O 3.48Å; L373-V389 PolarHBondContact N-O 3.26Å; L373-V389 PolarHBondContact O-N 2.85Å; V389-Y421 HydrophobicContact CG1-CE1 3.92Å
390	T	81.2	Confident	77.8	Confident	96 Å²	96	53.7 Å²	53.7	59%	0.589	31%	0.314	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-93.9	119.2	169.7	51.3	0	0	0	0	109.1	R372 E392	R372-T390 HydrophobicContact CG-CG2 4.16Å; T390-E392 PolarHBondContact O-N 2.84Å
391	I	77.4	Confident	78.4	Confident	11 Å²	11	51.3 Å²	51.3	6%	0.056	30%	0.297	C	S	.	.			trans	-83.2	104.6	-179	-48.7	-170.6	0	0	0	108.7	G371 G393 A394 L397 V411 W419 Y421	G371-I391 PolarHBondContact O-N 3.17Å; I391-G393 PolarHBondContact O-N 2.84Å; I391-A394 HydrophobicContact CB-CB 3.88Å; I391-A394 HydrophobicContact CG2-CB 3.85Å; I391-A394 PolarHBondContact O-N 2.8Å; I391-L397 HydrophobicContact CD1-CD1 3.93Å; I391-L397 HydrophobicContact CD1-CD2 3.85Å; I391-L397 HydrophobicContact CG1-CD1 4.41Å; I391-V411 HydrophobicContact CD1-CG1 4.39Å; I391-W419 HydrophobicContact CD1-CB 4.25Å; I391-W419 HydrophobicContact CD1-CD2 4.38Å; I391-W419 HydrophobicContact CD1-CG 3.97Å; I391-W419 HydrophobicContact CG2-CD2 3.71Å; I391-W419 HydrophobicContact CG2-CE3 3.95Å; I391-W419 HydrophobicContact CG2-CG 4.32Å; I391-W419 HydrophobicContact CG2-CH2 4.01Å; I391-W419 HydrophobicContact CG2-CZ2 3.68Å; I391-W419 HydrophobicContact CG2-CZ3 4.13Å; I391-Y421 HydrophobicContact CD1-CE2 3.58Å; I391-Y421 WeakPolarHBondContact CD1-OH 3.32Å; I391-Y421 HydrophobicContact CG1-CE2 4.26Å; I391-Y421 VanDerWaalsContact CG1-OH 3.25Å; I391-Y421 WeakPolarHBondContact CG1-OH 3.45Å
392	E	62	Low	79	Confident	184 Å²	184	47.9 Å²	47.9	86%	0.86	28%	0.278	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62	120.3	178.2	-68	-169.1	165	0	0	110.9	T390	T390-E392 PolarHBondContact O-N 2.84Å
393	G	60.7	Low	79.6	Confident	60 Å²	60	46.1 Å²	46.1	62%	0.619	27%	0.268	S	S	*	.	T	Hydrogen-bonded Turn	trans	95	-6.1	179.8	0	0	0	0	0	115.5	I391 R417	I391-G393 PolarHBondContact O-N 2.84Å; G393-R417 PolarHBondContact O-NH2 2.8Å
394	A	62.8	Low	79.8	Confident	11 Å²	11	41.9 Å²	41.9	9%	0.091	25%	0.254	C	S	.	.			trans	-84.4	122.2	171.7	0	0	0	0	0	110.5	I391 L397 D413	I391-A394 HydrophobicContact CB-CB 3.88Å; I391-A394 HydrophobicContact CG2-CB 3.85Å; I391-A394 PolarHBondContact O-N 2.8Å; A394-L397 HydrophobicContact CB-CD2 3.9Å; A394-D413 WeakPolarHBondContact CA-OD2 3.48Å; A394-D413 WeakPolarHBondContact CB-OD2 3.28Å
395	S	64	Low	79.5	Confident	83 Å²	83	40 Å²	40	58%	0.58	25%	0.25	S	S	*	.	S	Bend	trans	-80.7	-31.5	-177.4	-167.1	0	0	0	0	112.3
396	A	80.5	Confident	79.3	Confident	14 Å²	14	39.3 Å²	39.3	12%	0.116	25%	0.246	C	C	.	.			trans	-164.9	136.4	173.8	0	0	0	0	0	111.3	Y352 G369 D413 S414	Y352-A396 HydrophobicContact CE2-CB 4.34Å; G369-A396 WeakPolarHBondContact O-CA 3.45Å; A396-D413 VanDerWaalsContact O-OD1 3.04Å; A396-S414 PolarHBondContact N-OG 2.87Å; A396-S414 PolarHBondContact O-N 2.79Å
397	L	86.3	Confident	79.4	Confident	0 Å²	0	42.6 Å²	42.6	0%	0	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.6	119.6	176	-54.1	173.8	0	0	0	109.6	Y352 V367 G371 I391 A394 V411 G412 D413	Y352-L397 WeakPolarHBondContact CB-O 3.42Å; Y352-L397 WeakPolarHBondContact CD2-O 3.44Å; V367-L397 HydrophobicContact CB-CB 3.92Å; V367-L397 HydrophobicContact CB-CD1 4.41Å; V367-L397 HydrophobicContact CG1-CB 4.29Å; V367-L397 HydrophobicContact CG1-CD1 4.24Å; G371-L397 VanDerWaalsContact C-CD1 3.46Å; I391-L397 HydrophobicContact CD1-CD1 3.93Å; I391-L397 HydrophobicContact CD1-CD2 3.85Å; I391-L397 HydrophobicContact CG1-CD1 4.41Å; A394-L397 HydrophobicContact CB-CD2 3.9Å; L397-V411 HydrophobicContact CB-CG1 3.92Å; L397-V411 HydrophobicContact CD1-CG1 3.76Å; L397-V411 HydrophobicContact CD2-CG1 3.66Å; L397-V411 HydrophobicContact CG-CG1 3.92Å; L397-G412 CarbonylContact C-O 3.5Å; L397-G412 WeakPolarHBondContact CA-O 3.35Å; L397-D413 HydrophobicContact CD2-CB 4.47Å
398	N	87.1	Confident	79.7	Confident	26 Å²	26	44.3 Å²	44.3	14%	0.139	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.2	-30.1	-172.5	-65.9	-44.1	0	0	0	113.6	V105 I106 G412	V105-N398 WeakPolarHBondContact CG1-ND2 3.36Å; I106-N398 PolarHBondContact O-ND2 3.12Å; N398-G412 PolarHBondContact N-O 2.7Å
399	R	88.6	Confident	80	Confident	46 Å²	46	41.8 Å²	41.8	17%	0.174	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.3	144	-169.1	-67.4	-66.3	179.8	-134.8	5.6	112.1	T107 L109 Y352 D353 V411 G412	T107-R399 WeakPolarHBondContact O-CG 3.41Å; T107-R399 PolarHBondContact O-NE 3.16Å; L109-R399 HydrophobicContact CD1-CB 4.24Å; L109-R399 HydrophobicContact CG-CB 4.37Å; Y352-R399 PolarHBondContact O-NH1 2.88Å; D353-R399 WeakPolarHBondContact OD2-CD 3.38Å; R399-V411 WeakPolarHBondContact O-CA 3.25Å; R399-G412 PolarHBondContact O-N 2.74Å
400	V	91.1	Very high	80.4	Confident	0 Å²	0	40.5 Å²	40.5	0%	0	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	133.9	174.7	66.7	0	0	0	0	110.4	D353 M355 A365 V367 L373 V409 A410 V411	D353-V400 HydrophobicContact CB-CG1 4.06Å; D353-V400 PolarHBondContact OD2-N 3.29Å; M355-V400 HydrophobicContact CB-CG1 4.09Å; A365-V400 HydrophobicContact CB-CG2 3.84Å; V367-V400 HydrophobicContact CG1-CB 3.77Å; V367-V400 HydrophobicContact CG1-CG1 4.4Å; V367-V400 HydrophobicContact CG1-CG2 4.17Å; V367-V400 HydrophobicContact CG2-CB 4.12Å; V367-V400 HydrophobicContact CG2-CG1 4.17Å; L373-V400 HydrophobicContact CD1-CG2 4.13Å; V400-V409 HydrophobicContact CG2-CG1 3.61Å; V400-A410 WeakPolarHBondContact CA-O 3.38Å; V400-V411 HydrophobicContact CG2-CG2 4.41Å
401	R	90.6	Very high	80.8	Confident	51 Å²	51	36 Å²	36	19%	0.192	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.9	129	176.7	-71.3	-62.7	-168.4	-129.6	12.7	112	L109 W111 D353 M355 A410	L109-R401 HydrophobicContact CB-CB 4.29Å; L109-R401 HydrophobicContact CB-CG 3.71Å; L109-R401 WeakPolarHBondContact O-CG 3.49Å; L109-R401 PolarHBondContact O-NE 3.17Å; W111-R401 PolarHBondContact NE1-O 2.93Å; D353-R401 IonicContact OD2-NH1 3.46Å; M355-R401 HydrophobicContact SD-CB 4.46Å; R401-A410 PolarHBondContact N-O 3.41Å; R401-A410 PolarHBondContact O-N 2.92Å
402	W	89.7	Confident	81.3	Confident	10 Å²	10	35.4 Å²	35.4	4%	0.038	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81	139.6	172	-72.2	80.6	0	0	0	111.3	M355 P358 M363 A365 L375 V409 T423	M355-W402 HydrophobicContact CG-CG 4.45Å; M355-W402 PolarHBondContact O-NE1 3.04Å; M355-W402 HydrophobicContact SD-CB 4.22Å; M355-W402 HydrophobicContact SD-CG 4.49Å; M355-W402 PolarHBondContact SD-N 3.17Å; M355-W402 VanDerWaalsContact SD-N 3.4Å; P358-W402 VanDerWaalsContact CD-CB 3.48Å; P358-W402 HydrophobicContact CG-CB 4.13Å; M363-W402 HydrophobicContact CE-CH2 3.39Å; M363-W402 HydrophobicContact CE-CZ2 4.32Å; M363-W402 HydrophobicContact CE-CZ3 3.67Å; M363-W402 HydrophobicContact CG-CH2 4.01Å; M363-W402 HydrophobicContact CG-CZ2 4.14Å; M363-W402 HydrophobicContact SD-CH2 3.76Å; M363-W402 HydrophobicContact SD-CZ2 4.47Å; A365-W402 HydrophobicContact CB-CZ2 3.83Å; L375-W402 HydrophobicContact CD2-CH2 3.88Å; L375-W402 HydrophobicContact CD2-CZ2 3.59Å; W402-V409 HydrophobicContact CD2-CG2 3.64Å; W402-V409 HydrophobicContact CE3-CG2 3.47Å; W402-V409 VanDerWaalsContact CE3-CG2 3.47Å; W402-V409 HydrophobicContact CG-CG2 4.4Å; W402-V409 HydrophobicContact CH2-CG2 3.71Å; W402-V409 HydrophobicContact CZ2-CG2 3.87Å; W402-V409 HydrophobicContact CZ3-CG2 3.5Å; W402-V409 VanDerWaalsContact CZ3-CG2 3.5Å; W402-T423 HydrophobicContact CH2-CG2 3.66Å; W402-T423 HydrophobicContact CZ3-CG2 3.57Å
403	S	87.1	Confident	82.4	Confident	3 Å²	3	26.7 Å²	26.7	2%	0.021	17%	0.166	C	C	.	.			trans	-62.1	148.8	166.2	176.3	0	0	0	0	110	P358 G405 G406 E408	P358-S403 WeakPolarHBondContact CG-O 3.26Å; S403-G405 PolarHBondContact O-N 3.39Å; S403-G405 VanDerWaalsContact O-N 3.15Å; S403-G406 PolarHBondContact O-N 2.75Å; S403-E408 WeakPolarHBondContact CB-O 3.41Å; S403-E408 PolarHBondContact N-O 2.9Å
404	S	79.4	Confident	83.6	Confident	55 Å²	55	25 Å²	25	39%	0.385	15%	0.145	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.6	-26.5	178.8	56.9	0	0	0	0	112.9	G406	S404-G406 VanDerWaalsContact C-N 3.32Å
405	G	76.9	Confident	84.5	Confident	41 Å²	41	27.7 Å²	27.7	42%	0.423	16%	0.156	S	C	.	.	T	Hydrogen-bonded Turn	trans	-81.6	-3.5	174.3	0	0	0	0	0	114.9	S403 K407	S403-G405 PolarHBondContact O-N 3.39Å; S403-G405 VanDerWaalsContact O-N 3.15Å; G405-K407 PolarHBondContact O-N 2.99Å; G405-K407 VanDerWaalsContact O-N 3.1Å
406	G	76.9	Confident	85.2	Confident	0 Å²	0	23.8 Å²	23.8	0%	0	13%	0.128	C	C	.	.	S	Bend	trans	66	8.6	175.8	0	0	0	0	0	116.1	S403 S404 T423	S403-G406 PolarHBondContact O-N 2.75Å; S404-G406 VanDerWaalsContact C-N 3.32Å; G406-T423 PolarHBondContact O-OG1 2.79Å
407	K	81.2	Confident	85.4	Confident	115 Å²	115	24.9 Å²	24.9	50%	0.5	13%	0.129	S	C	.	.	S	Bend	trans	-88.8	-48.1	176.4	-68.4	-175.6	176.8	-162.7	0	111.3	G405 T423 S428	G405-K407 PolarHBondContact O-N 2.99Å; G405-K407 VanDerWaalsContact O-N 3.1Å; K407-T423 WeakPolarHBondContact O-CB 3.24Å; K407-T423 PolarHBondContact O-N 3.01Å; K407-T423 PolarHBondContact O-OG1 3.31Å; K407-S428 WeakPolarHBondContact CG-OG 3.45Å
408	E	86	Confident	85.5	Confident	45 Å²	45	24.9 Å²	24.9	21%	0.21	13%	0.129	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.9	144.7	-173.4	-60.4	159	141.7	0	0	112.1	I142 S403 I420 Y421	I142-E408 WeakPolarHBondContact CD1-OE2 3.48Å; S403-E408 WeakPolarHBondContact CB-O 3.41Å; S403-E408 PolarHBondContact N-O 2.9Å; E408-I420 HydrophobicContact CB-CG2 4.18Å; E408-I420 HydrophobicContact CG-CG2 4.43Å; E408-Y421 CarbonylContact C-O 3.53Å; E408-Y421 VanDerWaalsContact CA-O 3.31Å; E408-Y421 WeakPolarHBondContact CA-O 3.35Å
409	V	88.8	Confident	85.5	Confident	0 Å²	0	25 Å²	25	0%	0	13%	0.128	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	122.7	173.6	178.1	0	0	0	0	108.4	L373 V400 W402 V411 I420 Y421 T423	L373-V409 HydrophobicContact CD1-CG1 4.41Å; L373-V409 HydrophobicContact CD2-CG1 4.39Å; V400-V409 HydrophobicContact CG2-CG1 3.61Å; W402-V409 HydrophobicContact CD2-CG2 3.64Å; W402-V409 HydrophobicContact CE3-CG2 3.47Å; W402-V409 VanDerWaalsContact CE3-CG2 3.47Å; W402-V409 HydrophobicContact CG-CG2 4.4Å; W402-V409 HydrophobicContact CH2-CG2 3.71Å; W402-V409 HydrophobicContact CZ2-CG2 3.87Å; W402-V409 HydrophobicContact CZ3-CG2 3.5Å; W402-V409 VanDerWaalsContact CZ3-CG2 3.5Å; V409-V411 HydrophobicContact CG1-CG2 4.12Å; V409-I420 WeakPolarHBondContact O-CA 3.38Å; V409-Y421 PolarHBondContact N-O 3.4Å; V409-Y421 PolarHBondContact O-N 3.18Å; V409-T423 HydrophobicContact CG2-CG2 3.61Å
410	A	89.2	Confident	85.5	Confident	0 Å²	0	22.9 Å²	22.9	0%	0	12%	0.12	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.5	134.5	170.2	0	0	0	0	0	110.5	L109 W111 L119 V400 R401 V418 W419 I420	L109-A410 HydrophobicContact CD1-CB 4.33Å; W111-A410 HydrophobicContact CZ2-CB 3.67Å; L119-A410 HydrophobicContact CD1-CB 4.06Å; L119-A410 HydrophobicContact CD2-CB 3.78Å; V400-A410 WeakPolarHBondContact CA-O 3.38Å; R401-A410 PolarHBondContact N-O 3.41Å; R401-A410 PolarHBondContact O-N 2.92Å; A410-V418 HydrophobicContact CB-CG1 4.48Å; A410-W419 CarbonylContact C-O 3.47Å; A410-W419 WeakPolarHBondContact CA-O 3.36Å; A410-I420 HydrophobicContact CB-CD1 3.66Å
411	V	89.6	Confident	85.3	Confident	0 Å²	0	23.3 Å²	23.3	0%	0	12%	0.121	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	132.6	176.9	-176.9	0	0	0	0	109.4	V367 L373 I391 L397 R399 V400 V409 V418 W419 Y421	V367-V411 HydrophobicContact CG1-CG1 4.1Å; V367-V411 HydrophobicContact CG1-CG2 4.48Å; L373-V411 HydrophobicContact CD1-CG2 3.88Å; L373-V411 HydrophobicContact CD2-CG2 3.89Å; L373-V411 HydrophobicContact CG-CG2 4.36Å; I391-V411 HydrophobicContact CD1-CG1 4.39Å; L397-V411 HydrophobicContact CB-CG1 3.92Å; L397-V411 HydrophobicContact CD1-CG1 3.76Å; L397-V411 HydrophobicContact CD2-CG1 3.66Å; L397-V411 HydrophobicContact CG-CG1 3.92Å; R399-V411 WeakPolarHBondContact O-CA 3.25Å; V400-V411 HydrophobicContact CG2-CG2 4.41Å; V409-V411 HydrophobicContact CG1-CG2 4.12Å; V411-V418 CarbonylContact O-C 3.58Å; V411-V418 WeakPolarHBondContact O-CA 3.47Å; V411-W419 HydrophobicContact CB-CB 4.33Å; V411-W419 PolarHBondContact N-O 3.09Å; V411-W419 PolarHBondContact O-N 3.46Å; V411-Y421 HydrophobicContact CG2-CD2 4.21Å
412	G	88	Confident	85.1	Confident	0 Å²	0	23.1 Å²	23.1	0%	0	12%	0.124	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	129.1	178.2	0	0	0	0	0	112	L109 L397 N398 R399	L109-G412 VanDerWaalsContact CD1-N 3.32Å; L397-G412 CarbonylContact C-O 3.5Å; L397-G412 WeakPolarHBondContact CA-O 3.35Å; N398-G412 PolarHBondContact N-O 2.7Å; R399-G412 PolarHBondContact O-N 2.74Å
413	D	87	Confident	84.3	Confident	0 Å²	0	22.6 Å²	22.6	0%	0	12%	0.122	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.2	159.7	175.9	-166.1	-5.1	0	0	0	111.9	I106 A394 A396 L397 E415 G416 R417	I106-D413 PolarHBondContact N-O 2.87Å; A394-D413 WeakPolarHBondContact CA-OD2 3.48Å; A394-D413 WeakPolarHBondContact CB-OD2 3.28Å; A396-D413 VanDerWaalsContact O-OD1 3.04Å; L397-D413 HydrophobicContact CD2-CB 4.47Å; D413-E415 VanDerWaalsContact C-N 3.27Å; D413-E415 PolarHBondContact O-N 3.21Å; D413-G416 PolarHBondContact O-N 2.96Å; D413-R417 HydrophobicContact CB-CB 4.1Å; D413-R417 VanDerWaalsContact CB-O 3.3Å; D413-R417 WeakPolarHBondContact CB-O 3.44Å; D413-R417 PolarHBondContact N-O 3.09Å; D413-R417 IonicContact OD2-CZ 3.81Å; D413-R417 IonicContact OD2-NE 2.79Å; D413-R417 PolarHBondContact OD2-NE 3.18Å; D413-R417 IonicContact OD2-NH2 3.75Å; D413-R417 PolarHBondContact OD2-NH2 2.94Å
414	S	84.6	Confident	83.3	Confident	24 Å²	24	23.5 Å²	23.5	17%	0.168	13%	0.132	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.5	-27.9	169.2	62.3	0	0	0	0	114.2	V105 A396 G416	V105-S414 VanDerWaalsContact CA-O 3.28Å; V105-S414 WeakPolarHBondContact CA-O 3.25Å; V105-S414 WeakPolarHBondContact CG2-O 3.13Å; A396-S414 PolarHBondContact N-OG 2.87Å; A396-S414 PolarHBondContact O-N 2.79Å; S414-G416 VanDerWaalsContact C-N 3.33Å
415	E	81.6	Confident	82.6	Confident	69 Å²	69	28.6 Å²	28.6	32%	0.322	15%	0.15	S	C	.	.	T	Hydrogen-bonded Turn	trans	-91.5	7.6	-178.8	-61.9	-170.4	167.9	0	0	113.9	S101 D413 R417	S101-E415 VanDerWaalsContact O-O 3.09Å; D413-E415 VanDerWaalsContact C-N 3.27Å; D413-E415 PolarHBondContact O-N 3.21Å; E415-R417 IonicContact OE2-CZ 3.71Å; E415-R417 IonicContact OE2-NH1 3.65Å; E415-R417 PolarHBondContact OE2-NH1 3.48Å; E415-R417 IonicContact OE2-NH2 2.99Å; E415-R417 PolarHBondContact OE2-NH2 3.12Å
416	G	78.8	Confident	81.9	Confident	0 Å²	0	34.6 Å²	34.6	0%	0	17%	0.167	C	C	.	.	S	Bend	trans	90.9	4.3	175.1	0	0	0	0	0	115.5	S101 R104 Y123 D413 S414	S101-G416 WeakPolarHBondContact CB-O 3.32Å; R104-G416 WeakPolarHBondContact O-CA 3.36Å; R104-G416 PolarHBondContact O-N 3.1Å; Y123-G416 VanDerWaalsContact CE1-O 3.32Å; Y123-G416 WeakPolarHBondContact CE1-O 3.19Å; Y123-G416 PolarHBondContact OH-O 2.74Å; D413-G416 PolarHBondContact O-N 2.96Å; S414-G416 VanDerWaalsContact C-N 3.33Å
417	R	85.6	Confident	81.2	Confident	38 Å²	38	35.6 Å²	35.6	14%	0.143	17%	0.172	C	C	.	.			trans	-81.9	133.7	174.9	-73.5	-177.7	-57.6	-101.8	-0.9	111.3	L94 Y96 I106 G393 D413 E415 W419	L94-R417 HydrophobicContact CD1-CB 3.73Å; L94-R417 HydrophobicContact CD1-CG 3.98Å; Y96-R417 HydrophobicContact CD2-CG 3.43Å; Y96-R417 VanDerWaalsContact CD2-CG 3.43Å; Y96-R417 HydrophobicContact CE2-CG 4.16Å; Y96-R417 HydrophobicContact CG-CG 4.05Å; I106-R417 WeakPolarHBondContact CD1-O 3.31Å; G393-R417 PolarHBondContact O-NH2 2.8Å; D413-R417 HydrophobicContact CB-CB 4.1Å; D413-R417 VanDerWaalsContact CB-O 3.3Å; D413-R417 WeakPolarHBondContact CB-O 3.44Å; D413-R417 PolarHBondContact N-O 3.09Å; D413-R417 IonicContact OD2-CZ 3.81Å; D413-R417 IonicContact OD2-NE 2.79Å; D413-R417 PolarHBondContact OD2-NE 3.18Å; D413-R417 IonicContact OD2-NH2 3.75Å; D413-R417 PolarHBondContact OD2-NH2 2.94Å; E415-R417 IonicContact OE2-CZ 3.71Å; E415-R417 IonicContact OE2-NH1 3.65Å; E415-R417 PolarHBondContact OE2-NH1 3.48Å; E415-R417 IonicContact OE2-NH2 2.99Å; E415-R417 PolarHBondContact OE2-NH2 3.12Å; R417-W419 HydrophobicContact CB-CZ2 4.48Å
418	V	88.1	Confident	80.2	Confident	0 Å²	0	30.9 Å²	30.9	0%	0	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	122.9	168.4	-175.1	0	0	0	0	108.8	F95 I106 L109 L119 A121 A410 V411 I420	F95-V418 HydrophobicContact CB-CB 4.15Å; F95-V418 HydrophobicContact CD2-CB 4.2Å; F95-V418 HydrophobicContact CD2-CG1 4.28Å; F95-V418 PolarHBondContact N-O 3.02Å; F95-V418 PolarHBondContact O-N 2.73Å; I106-V418 HydrophobicContact CD1-CG2 3.53Å; L109-V418 HydrophobicContact CD1-CG1 4.46Å; L109-V418 HydrophobicContact CD2-CG1 4.22Å; L109-V418 HydrophobicContact CD2-CG2 4.08Å; L119-V418 HydrophobicContact CD2-CG1 3.65Å; A121-V418 HydrophobicContact CB-CG2 4.02Å; A410-V418 HydrophobicContact CB-CG1 4.48Å; V411-V418 CarbonylContact O-C 3.58Å; V411-V418 WeakPolarHBondContact O-CA 3.47Å; V418-I420 HydrophobicContact CG1-CD1 4.15Å
419	W	87.6	Confident	79.1	Confident	29 Å²	29	30.9 Å²	30.9	11%	0.11	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101	130	178.5	-57.3	87.3	0	0	0	109.4	F91 L94 I391 A410 V411 R417 Y421	F91-W419 AromaticContact CD2-CE3 3.97Å; F91-W419 HydrophobicContact CD2-CE3 3.97Å; F91-W419 HydrophobicContact CD2-CZ3 4.42Å; F91-W419 HydrophobicContact CE2-CD2 4.48Å; F91-W419 AromaticContact CE2-CE3 3.32Å; F91-W419 HydrophobicContact CE2-CE3 3.32Å; F91-W419 AromaticContact CE2-CZ3 3.7Å; F91-W419 HydrophobicContact CE2-CZ3 3.7Å; F91-W419 AromaticContact CZ-CE3 3.99Å; F91-W419 HydrophobicContact CZ-CE3 3.99Å; F91-W419 AromaticContact CZ-CZ3 3.91Å; F91-W419 HydrophobicContact CZ-CZ3 3.91Å; L94-W419 HydrophobicContact CB-CZ3 4.4Å; L94-W419 HydrophobicContact CD1-CD2 3.57Å; L94-W419 HydrophobicContact CD1-CE3 3.78Å; L94-W419 HydrophobicContact CD1-CG 4.19Å; L94-W419 HydrophobicContact CD1-CH2 3.78Å; L94-W419 HydrophobicContact CD1-CZ2 3.64Å; L94-W419 HydrophobicContact CD1-CZ3 3.85Å; L94-W419 HydrophobicContact CD2-CH2 3.92Å; L94-W419 HydrophobicContact CD2-CZ2 4.34Å; L94-W419 HydrophobicContact CD2-CZ3 4.27Å; L94-W419 HydrophobicContact CG-CH2 4.39Å; L94-W419 HydrophobicContact CG-CZ3 4.42Å; I391-W419 HydrophobicContact CD1-CB 4.25Å; I391-W419 HydrophobicContact CD1-CD2 4.38Å; I391-W419 HydrophobicContact CD1-CG 3.97Å; I391-W419 HydrophobicContact CG2-CD2 3.71Å; I391-W419 HydrophobicContact CG2-CE3 3.95Å; I391-W419 HydrophobicContact CG2-CG 4.32Å; I391-W419 HydrophobicContact CG2-CH2 4.01Å; I391-W419 HydrophobicContact CG2-CZ2 3.68Å; I391-W419 HydrophobicContact CG2-CZ3 4.13Å; A410-W419 CarbonylContact C-O 3.47Å; A410-W419 WeakPolarHBondContact CA-O 3.36Å; V411-W419 HydrophobicContact CB-CB 4.33Å; V411-W419 PolarHBondContact N-O 3.09Å; V411-W419 PolarHBondContact O-N 3.46Å; R417-W419 HydrophobicContact CB-CZ2 4.48Å; W419-Y421 HydrophobicContact CB-CD2 4.31Å; W419-Y421 HydrophobicContact CB-CE2 3.65Å; W419-Y421 HydrophobicContact CG-CE2 4.5Å
420	I	88.3	Confident	78	Confident	0 Å²	0	33.1 Å²	33.1	0%	0	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	120.3	172.5	-52.1	-58.8	0	0	0	108.6	C92 R93 F95 W111 L119 E408 V409 A410 V418	C92-I420 HydrophobicContact CB-CB 4.45Å; C92-I420 HydrophobicContact CB-CG2 4.24Å; C92-I420 WeakPolarHBondContact CB-O 3.22Å; C92-I420 PolarHBondContact N-O 3.27Å; R93-I420 HydrophobicContact CB-CB 4.46Å; R93-I420 PolarHBondContact N-O 2.9Å; R93-I420 PolarHBondContact O-N 2.96Å; F95-I420 HydrophobicContact CD2-CD1 4.31Å; F95-I420 HydrophobicContact CD2-CG1 3.99Å; F95-I420 HydrophobicContact CE2-CD1 3.91Å; F95-I420 HydrophobicContact CE2-CG1 3.49Å; F95-I420 VanDerWaalsContact CE2-CG1 3.49Å; F95-I420 HydrophobicContact CZ-CG1 4.42Å; W111-I420 HydrophobicContact CH2-CD1 4.19Å; W111-I420 HydrophobicContact CZ2-CD1 4.07Å; L119-I420 HydrophobicContact CD2-CD1 3.83Å; E408-I420 HydrophobicContact CB-CG2 4.18Å; E408-I420 HydrophobicContact CG-CG2 4.43Å; V409-I420 WeakPolarHBondContact O-CA 3.38Å; A410-I420 HydrophobicContact CB-CD1 3.66Å; V418-I420 HydrophobicContact CG1-CD1 4.15Å
421	Y	87.1	Confident	77.2	Confident	9 Å²	9	38.6 Å²	38.6	4%	0.035	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	139.1	172.8	-69.9	-79.6	0	0	0	109.6	F91 L373 V389 I391 E408 V409 V411 W419	F91-Y421 HydrophobicContact CB-CD1 4.25Å; F91-Y421 HydrophobicContact CB-CE1 3.9Å; F91-Y421 HydrophobicContact CD2-CD1 4.44Å; F91-Y421 AromaticContact CD2-CE1 3.89Å; F91-Y421 HydrophobicContact CD2-CE1 3.89Å; F91-Y421 HydrophobicContact CG-CE1 4.37Å; L373-Y421 HydrophobicContact CD2-CD2 3.71Å; L373-Y421 HydrophobicContact CD2-CE2 4.27Å; L373-Y421 HydrophobicContact CD2-CG 4.09Å; V389-Y421 HydrophobicContact CG1-CE1 3.92Å; I391-Y421 HydrophobicContact CD1-CE2 3.58Å; I391-Y421 WeakPolarHBondContact CD1-OH 3.32Å; I391-Y421 HydrophobicContact CG1-CE2 4.26Å; I391-Y421 VanDerWaalsContact CG1-OH 3.25Å; I391-Y421 WeakPolarHBondContact CG1-OH 3.45Å; E408-Y421 CarbonylContact C-O 3.53Å; E408-Y421 VanDerWaalsContact CA-O 3.31Å; E408-Y421 WeakPolarHBondContact CA-O 3.35Å; V409-Y421 PolarHBondContact N-O 3.4Å; V409-Y421 PolarHBondContact O-N 3.18Å; V411-Y421 HydrophobicContact CG2-CD2 4.21Å; W419-Y421 HydrophobicContact CB-CD2 4.31Å; W419-Y421 HydrophobicContact CB-CE2 3.65Å; W419-Y421 HydrophobicContact CG-CE2 4.5Å
422	D	85.1	Confident	76.3	Confident	47 Å²	47	43.2 Å²	43.2	25%	0.251	23%	0.23	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.9	130.6	167.8	-173.4	22.3	0	0	0	109.1	S90 C92 G424	S90-D422 PolarHBondContact N-O 3.3Å; S90-D422 VanDerWaalsContact N-O 3.1Å; S90-D422 PolarHBondContact O-N 3.33Å; C92-D422 WeakPolarHBondContact SG-CB 3.4Å; D422-G424 PolarHBondContact O-N 2.92Å
423	T	72.9	Confident	75.8	Confident	0 Å²	0	48.8 Å²	48.8	0%	0	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.1	103.4	176.2	63.4	0	0	0	0	105.5	L89 L375 W402 G406 K407 V409	L89-T423 HydrophobicContact CD2-CG2 3.87Å; L375-T423 HydrophobicContact CD1-CG2 3.69Å; W402-T423 HydrophobicContact CH2-CG2 3.66Å; W402-T423 HydrophobicContact CZ3-CG2 3.57Å; G406-T423 PolarHBondContact O-OG1 2.79Å; K407-T423 WeakPolarHBondContact O-CB 3.24Å; K407-T423 PolarHBondContact O-N 3.01Å; K407-T423 PolarHBondContact O-OG1 3.31Å; V409-T423 HydrophobicContact CG2-CG2 3.61Å
424	G	67.6	Low	75.5	Confident	21 Å²	21	49.7 Å²	49.7	22%	0.216	26%	0.261	C	S	.	.			trans	-47.3	154	-168	0	0	0	0	0	113	S88 D422 Q426 L427 S428	S88-G424 PolarHBondContact O-N 3.4Å; D422-G424 PolarHBondContact O-N 2.92Å; G424-Q426 PolarHBondContact O-N 2.87Å; G424-L427 PolarHBondContact O-N 3.13Å; G424-S428 PolarHBondContact O-N 2.81Å
425	E	64.8	Low	75.3	Confident	163 Å²	163	49.2 Å²	49.2	76%	0.762	26%	0.255	S	S	*	.	H	α-helix	trans	-52.4	-28.1	-168.2	-164.3	167.9	-159.4	0	0	114.2	L427 A429	E425-L427 PolarHBondContact O-N 2.82Å; E425-A429 WeakPolarHBondContact O-CB 3.48Å; E425-A429 PolarHBondContact O-N 2.94Å; E425-A429 VanDerWaalsContact O-N 3.09Å
426	Q	61.1	Low	75.4	Confident	167 Å²	167	48.4 Å²	48.4	78%	0.78	26%	0.261	S	S	*	.	H	α-helix	trans	-66.2	-30.6	176	-66.7	-179.6	-5.1	0	0	114.7	G424	G424-Q426 PolarHBondContact O-N 2.87Å
427	L	63	Low	75.6	Confident	21 Å²	21	53.7 Å²	53.7	11%	0.11	28%	0.28	C	S	.	.	H	α-helix	trans	-92.4	-25.2	178.2	-71.7	167.3	0	0	0	112.2	S88 M363 T386 G424 E425	S88-L427 VanDerWaalsContact OG-CD1 3.32Å; S88-L427 WeakPolarHBondContact OG-CD1 3.27Å; M363-L427 HydrophobicContact SD-CB 4.27Å; T386-L427 HydrophobicContact CG2-CD2 4.32Å; G424-L427 PolarHBondContact O-N 3.13Å; E425-L427 PolarHBondContact O-N 2.82Å
428	S	58.8	Low	75.6	Confident	15 Å²	15	51.9 Å²	51.9	11%	0.105	27%	0.274	C	S	.	.	H	α-helix	trans	-82	-27.1	179.5	-167.4	0	0	0	0	113	K407 G424 V430	K407-S428 WeakPolarHBondContact CG-OG 3.45Å; G424-S428 PolarHBondContact O-N 2.81Å; S428-V430 PolarHBondContact O-N 2.93Å; S428-V430 VanDerWaalsContact O-N 3.13Å
429	A	63.9	Low	75.4	Confident	46 Å²	46	53 Å²	53	38%	0.38	28%	0.282	S	S	.	.			trans	-70.8	106.6	178.3	0	0	0	0	0	111.4	E425	E425-A429 WeakPolarHBondContact O-CB 3.48Å; E425-A429 PolarHBondContact O-N 2.94Å; E425-A429 VanDerWaalsContact O-N 3.09Å
430	V	66.3	Low	75.3	Confident	46 Å²	46	58.7 Å²	58.7	28%	0.279	30%	0.304	S	S	.	.			trans	-83.4	117.3	176.1	-179.4	0	0	0	0	109.6	V359 H360 S428	V359-V430 HydrophobicContact CG1-CG2 3.58Å; V359-V430 WeakPolarHBondContact O-CG2 3.37Å; H360-V430 HydrophobicContact CB-CG2 4.03Å; S428-V430 PolarHBondContact O-N 2.93Å; S428-V430 VanDerWaalsContact O-N 3.13Å
431	H	71.3	Confident	75.1	Confident	116 Å²	116	59.8 Å²	59.8	54%	0.537	31%	0.311	S	S	.	.			trans	-90	142.7	166.1	-69.4	-71.1	0	0	0	110.2	E433 D434	H431-E433 PolarHBondContact O-N 3.3Å; H431-E433 VanDerWaalsContact O-N 3.07Å; H431-D434 WeakPolarHBondContact CA-OD2 3.27Å; H431-D434 WeakPolarHBondContact CB-OD2 3.42Å; H431-D434 PolarHBondContact N-OD2 3.18Å; H431-D434 VanDerWaalsContact O-CB 3.31Å; H431-D434 WeakPolarHBondContact O-CB 3.13Å; H431-D434 PolarHBondContact O-N 3.18Å
432	P	71.1	Confident	75	Confident	97 Å²	97	59.7 Å²	59.7	63%	0.63	31%	0.311	S	S	*	.	H	α-helix	trans	-55.7	-25.9	173	-26.9	35	0	0	0	113.4	D434 W435	P432-D434 VanDerWaalsContact C-N 3.26Å; P432-D434 PolarHBondContact O-N 3.34Å; P432-W435 PolarHBondContact O-N 3.36Å
433	E	78.2	Confident	74.9	Confident	116 Å²	116	63.7 Å²	63.7	54%	0.542	33%	0.329	S	S	.	.	H	α-helix	trans	-64.3	-29.1	174	-64.8	-165.1	175.6	0	0	113.2	H431 W435 A436 R437	H431-E433 PolarHBondContact O-N 3.3Å; H431-E433 VanDerWaalsContact O-N 3.07Å; E433-W435 VanDerWaalsContact C-N 3.25Å; E433-W435 PolarHBondContact O-N 3.06Å; E433-A436 PolarHBondContact O-N 3.22Å; E433-A436 VanDerWaalsContact O-N 3.12Å; E433-R437 WeakPolarHBondContact O-CG 3.37Å; E433-R437 PolarHBondContact O-N 3.15Å; E433-R437 IonicContact OE2-CZ 3.68Å; E433-R437 IonicContact OE2-NE 3.01Å; E433-R437 IonicContact OE2-NH2 3.82Å; E433-R437 PolarHBondContact OE2-NH2 3.28Å
434	D	78.9	Confident	75.5	Confident	20 Å²	20	69.2 Å²	69.2	11%	0.107	36%	0.355	C	S	.	.	H	α-helix	trans	-67	-30.2	-177.2	-61.4	-38	0	0	0	111.7	N379 H431 P432 F438	N379-D434 PolarHBondContact ND2-O 3.37Å; H431-D434 WeakPolarHBondContact CA-OD2 3.27Å; H431-D434 WeakPolarHBondContact CB-OD2 3.42Å; H431-D434 PolarHBondContact N-OD2 3.18Å; H431-D434 VanDerWaalsContact O-CB 3.31Å; H431-D434 WeakPolarHBondContact O-CB 3.13Å; H431-D434 PolarHBondContact O-N 3.18Å; P432-D434 VanDerWaalsContact C-N 3.26Å; P432-D434 PolarHBondContact O-N 3.34Å; D434-F438 VanDerWaalsContact O-CB 3.23Å; D434-F438 WeakPolarHBondContact O-CB 3.35Å; D434-F438 PolarHBondContact O-N 3.22Å
435	W	80.8	Confident	76.3	Confident	14 Å²	14	68.8 Å²	68.8	5%	0.053	35%	0.348	C	S	.	.	H	α-helix	trans	-66.2	-42.1	172.8	-67.4	80.7	0	0	0	111.8	A311 V315 F317 P361 P432 E433 A439	A311-W435 HydrophobicContact CB-CH2 3.73Å; A311-W435 HydrophobicContact CB-CZ2 4.11Å; V315-W435 HydrophobicContact CB-CE3 4.37Å; V315-W435 WeakPolarHBondContact O-CZ3 3.31Å; F317-W435 AromaticContact CD2-CE3 3.91Å; F317-W435 HydrophobicContact CD2-CE3 3.91Å; F317-W435 AromaticContact CD2-CZ3 3.82Å; F317-W435 HydrophobicContact CD2-CZ3 3.82Å; F317-W435 AromaticContact CE2-CE3 3.68Å; F317-W435 HydrophobicContact CE2-CE3 3.68Å; F317-W435 HydrophobicContact CE2-CZ3 4.09Å; P361-W435 HydrophobicContact CB-CD2 3.93Å; P361-W435 HydrophobicContact CB-CE3 3.87Å; P361-W435 HydrophobicContact CB-CH2 3.79Å; P361-W435 HydrophobicContact CB-CZ2 3.87Å; P361-W435 HydrophobicContact CB-CZ3 3.8Å; P361-W435 HydrophobicContact CG-CD2 3.78Å; P361-W435 HydrophobicContact CG-CE3 4.24Å; P361-W435 HydrophobicContact CG-CG 4.08Å; P361-W435 HydrophobicContact CG-CH2 4.41Å; P361-W435 HydrophobicContact CG-CZ2 4Å; P432-W435 PolarHBondContact O-N 3.36Å; E433-W435 VanDerWaalsContact C-N 3.25Å; E433-W435 PolarHBondContact O-N 3.06Å; W435-A439 PolarHBondContact O-N 2.8Å
436	A	83.8	Confident	77.1	Confident	52 Å²	52	64.8 Å²	64.8	43%	0.43	33%	0.326	S	S	.	.	H	α-helix	trans	-75.3	-33.7	178.8	0	0	0	0	0	112.3	E433 R440	E433-A436 PolarHBondContact O-N 3.22Å; E433-A436 VanDerWaalsContact O-N 3.12Å; A436-R440 WeakPolarHBondContact O-CG 2.9Å; A436-R440 PolarHBondContact O-N 2.75Å; A436-R440 PolarHBondContact O-NE 2.7Å
437	R	83.9	Confident	78.1	Confident	111 Å²	111	59 Å²	59	42%	0.419	31%	0.307	S	S	.	.	H	α-helix	trans	-64	-47.7	171.1	-71.5	174.7	-168.1	-169.2	6	110.3	E433 A439 R440 T441	E433-R437 WeakPolarHBondContact O-CG 3.37Å; E433-R437 PolarHBondContact O-N 3.15Å; E433-R437 IonicContact OE2-CZ 3.68Å; E433-R437 IonicContact OE2-NE 3.01Å; E433-R437 IonicContact OE2-NH2 3.82Å; E433-R437 PolarHBondContact OE2-NH2 3.28Å; R437-A439 VanDerWaalsContact C-N 3.31Å; R437-A439 PolarHBondContact O-N 3Å; R437-R440 WeakPolarHBondContact O-CA 3.45Å; R437-R440 WeakPolarHBondContact O-CB 3.32Å; R437-R440 PolarHBondContact O-N 3.33Å; R437-T441 PolarHBondContact O-N 3.02Å; R437-T441 PolarHBondContact O-OG1 3.47Å
438	F	84.3	Confident	78.9	Confident	0 Å²	0	63.5 Å²	63.5	0%	0	33%	0.331	C	S	.	.	H	α-helix	trans	-62.5	-38.8	178.8	-172.6	-123.3	0	0	0	112.8	F317 L320 W356 P361 A362 L378 N379 D434 R440 T441 L442	F317-F438 HydrophobicContact CD1-CD1 4.46Å; F317-F438 HydrophobicContact CD1-CE1 4.37Å; F317-F438 AromaticContact CD2-CD1 3.98Å; F317-F438 HydrophobicContact CD2-CD1 3.98Å; F317-F438 HydrophobicContact CD2-CE1 4.24Å; F317-F438 HydrophobicContact CE1-CD1 4.19Å; F317-F438 HydrophobicContact CE1-CE1 4.48Å; F317-F438 AromaticContact CE2-CD1 3.67Å; F317-F438 HydrophobicContact CE2-CD1 3.67Å; F317-F438 HydrophobicContact CE2-CE1 4.35Å; F317-F438 HydrophobicContact CG-CD1 4.37Å; F317-F438 HydrophobicContact CG-CE1 4.25Å; F317-F438 AromaticContact CZ-CD1 3.79Å; F317-F438 HydrophobicContact CZ-CD1 3.79Å; F317-F438 HydrophobicContact CZ-CE1 4.47Å; L320-F438 HydrophobicContact CD1-CE1 3.76Å; L320-F438 HydrophobicContact CD1-CZ 3.94Å; W356-F438 HydrophobicContact CH2-CZ 4.03Å; P361-F438 HydrophobicContact CB-CD1 4.46Å; A362-F438 HydrophobicContact CB-CB 4.1Å; A362-F438 HydrophobicContact CB-CD2 3.4Å; A362-F438 VanDerWaalsContact CB-CD2 3.4Å; A362-F438 HydrophobicContact CB-CE2 3.93Å; A362-F438 HydrophobicContact CB-CG 3.76Å; L378-F438 HydrophobicContact CB-CD2 4.11Å; L378-F438 HydrophobicContact CB-CE2 3.75Å; L378-F438 HydrophobicContact CD1-CE2 3.61Å; L378-F438 HydrophobicContact CD1-CZ 4.07Å; L378-F438 HydrophobicContact CG-CE2 4.32Å; N379-F438 WeakPolarHBondContact OD1-CA 3.5Å; N379-F438 VanDerWaalsContact OD1-CB 3.25Å; N379-F438 WeakPolarHBondContact OD1-CB 3.3Å; N379-F438 PolarHBondContact OD1-N 2.83Å; N379-F438 VanDerWaalsContact OD1-N 3.1Å; D434-F438 VanDerWaalsContact O-CB 3.23Å; D434-F438 WeakPolarHBondContact O-CB 3.35Å; D434-F438 PolarHBondContact O-N 3.22Å; F438-R440 VanDerWaalsContact C-N 3.26Å; F438-R440 PolarHBondContact O-N 2.78Å; F438-T441 WeakPolarHBondContact CA-OG1 3.41Å; F438-T441 PolarHBondContact O-N 2.8Å; F438-T441 PolarHBondContact O-OG1 2.84Å; F438-L442 VanDerWaalsContact O-CB 3.25Å; F438-L442 WeakPolarHBondContact O-CB 3.13Å; F438-L442 PolarHBondContact O-N 2.99Å
439	A	84.3	Confident	79.6	Confident	22 Å²	22	65.7 Å²	65.7	18%	0.182	34%	0.337	C	S	.	.	H	α-helix	trans	-59.6	-38	173.3	0	0	0	0	0	112.4	F317 W435 R437 M443	F317-A439 HydrophobicContact CE1-CB 4.47Å; F317-A439 HydrophobicContact CZ-CB 4.06Å; W435-A439 PolarHBondContact O-N 2.8Å; R437-A439 VanDerWaalsContact C-N 3.31Å; R437-A439 PolarHBondContact O-N 3Å; A439-M443 WeakPolarHBondContact O-CG 3.47Å; A439-M443 PolarHBondContact O-N 2.89Å; A439-M443 VanDerWaalsContact O-N 3.17Å
440	R	84.9	Confident	79.7	Confident	149 Å²	149	66 Å²	66	56%	0.562	34%	0.339	S	S	*	.	H	α-helix	trans	-72.5	-46.9	177.6	-74.6	-176.8	-72.5	-178.7	0.5	112	A436 R437 F438 L442 M443 E444	A436-R440 WeakPolarHBondContact O-CG 2.9Å; A436-R440 PolarHBondContact O-N 2.75Å; A436-R440 PolarHBondContact O-NE 2.7Å; R437-R440 WeakPolarHBondContact O-CA 3.45Å; R437-R440 WeakPolarHBondContact O-CB 3.32Å; R437-R440 PolarHBondContact O-N 3.33Å; F438-R440 VanDerWaalsContact C-N 3.26Å; F438-R440 PolarHBondContact O-N 2.78Å; R440-L442 VanDerWaalsContact C-N 3.25Å; R440-L442 PolarHBondContact O-N 2.83Å; R440-M443 WeakPolarHBondContact O-CA 3.5Å; R440-M443 WeakPolarHBondContact O-CB 3.19Å; R440-M443 PolarHBondContact O-N 2.82Å; R440-E444 PolarHBondContact O-N 3.14Å
441	T	84.9	Confident	79.4	Confident	24 Å²	24	68.4 Å²	68.4	15%	0.147	35%	0.351	C	S	.	.	H	α-helix	trans	-60.9	-38.2	177	58.2	0	0	0	0	111	R437 F438 M443 E444 I445	R437-T441 PolarHBondContact O-N 3.02Å; R437-T441 PolarHBondContact O-OG1 3.47Å; F438-T441 WeakPolarHBondContact CA-OG1 3.41Å; F438-T441 PolarHBondContact O-N 2.8Å; F438-T441 PolarHBondContact O-OG1 2.84Å; T441-M443 VanDerWaalsContact C-N 3.32Å; T441-M443 PolarHBondContact O-N 3.43Å; T441-E444 PolarHBondContact O-N 3.46Å; T441-I445 VanDerWaalsContact O-CG1 3.27Å; T441-I445 WeakPolarHBondContact O-CG1 2.99Å; T441-I445 PolarHBondContact O-N 3.35Å
442	L	84.5	Confident	78.7	Confident	7 Å²	7	65.1 Å²	65.1	4%	0.037	35%	0.348	C	S	.	.	H	α-helix	trans	-63.4	-36.1	173	-171.5	69.9	0	0	0	112.8	F317 L320 L332 L341 F438 R440 R446	F317-L442 HydrophobicContact CD1-CD2 4.46Å; F317-L442 HydrophobicContact CE1-CD2 4.35Å; L320-L442 HydrophobicContact CD1-CD1 4.32Å; L320-L442 HydrophobicContact CD1-CD2 4.04Å; L320-L442 HydrophobicContact CD2-CD1 4.27Å; L320-L442 HydrophobicContact CD2-CD2 4.39Å; L332-L442 HydrophobicContact CD2-CD1 4.39Å; L341-L442 HydrophobicContact CD1-CD1 3.94Å; F438-L442 VanDerWaalsContact O-CB 3.25Å; F438-L442 WeakPolarHBondContact O-CB 3.13Å; F438-L442 PolarHBondContact O-N 2.99Å; R440-L442 VanDerWaalsContact C-N 3.25Å; R440-L442 PolarHBondContact O-N 2.83Å; L442-R446 WeakPolarHBondContact O-CB 3.44Å; L442-R446 WeakPolarHBondContact O-CD 3.3Å; L442-R446 WeakPolarHBondContact O-CG 3.49Å; L442-R446 PolarHBondContact O-N 3.01Å; L442-R446 VanDerWaalsContact O-N 3.1Å
443	M	84.1	Confident	77.9	Confident	130 Å²	130	65.4 Å²	65.4	64%	0.64	34%	0.341	S	S	*	.	H	α-helix	trans	-67.9	-40.2	173.6	-73.7	-178.3	-169.9	0	0	111.6	A439 R440 T441 R446 A447	A439-M443 WeakPolarHBondContact O-CG 3.47Å; A439-M443 PolarHBondContact O-N 2.89Å; A439-M443 VanDerWaalsContact O-N 3.17Å; R440-M443 WeakPolarHBondContact O-CA 3.5Å; R440-M443 WeakPolarHBondContact O-CB 3.19Å; R440-M443 PolarHBondContact O-N 2.82Å; T441-M443 VanDerWaalsContact C-N 3.32Å; T441-M443 PolarHBondContact O-N 3.43Å; M443-R446 PolarHBondContact O-N 3.05Å; M443-A447 WeakPolarHBondContact O-CB 2.95Å; M443-A447 PolarHBondContact O-N 2.89Å
444	E	85	Confident	76.5	Confident	116 Å²	116	68.2 Å²	68.2	54%	0.542	35%	0.354	S	S	.	.	H	α-helix	trans	-64.7	-45.5	176.2	-70.7	170.2	-177	0	0	111.5	R440 T441 R446 A447 N448	R440-E444 PolarHBondContact O-N 3.14Å; T441-E444 PolarHBondContact O-N 3.46Å; E444-R446 VanDerWaalsContact C-N 3.25Å; E444-R446 PolarHBondContact O-N 3.07Å; E444-A447 PolarHBondContact O-N 3.27Å; E444-A447 VanDerWaalsContact O-N 3.09Å; E444-N448 PolarHBondContact O-N 3.18Å
445	I	83.9	Confident	74.7	Confident	13 Å²	13	75.8 Å²	75.8	7%	0.067	39%	0.389	C	S	.	.	H	α-helix	trans	-57.6	-41.4	174	-69.4	165.9	0	0	0	110.7	L341 Y342 T382 T441 R449	L341-I445 WeakPolarHBondContact O-CG2 3.32Å; Y342-I445 HydrophobicContact CD2-CG2 4.07Å; T382-I445 HydrophobicContact CG2-CD1 4.21Å; T441-I445 VanDerWaalsContact O-CG1 3.27Å; T441-I445 WeakPolarHBondContact O-CG1 2.99Å; T441-I445 PolarHBondContact O-N 3.35Å; I445-R449 PolarHBondContact O-N 2.82Å
446	R	82.4	Confident	72.5	Confident	79 Å²	79	77.2 Å²	77.2	30%	0.298	41%	0.408	S	S	.	.	H	α-helix	trans	-68.1	-38.5	176.1	-74.4	171.7	-177.6	-173.5	0.8	112.7	L341 L442 M443 E444 R449 A450	L341-R446 HydrophobicContact CD2-CG 4.16Å; L442-R446 WeakPolarHBondContact O-CB 3.44Å; L442-R446 WeakPolarHBondContact O-CD 3.3Å; L442-R446 WeakPolarHBondContact O-CG 3.49Å; L442-R446 PolarHBondContact O-N 3.01Å; L442-R446 VanDerWaalsContact O-N 3.1Å; M443-R446 PolarHBondContact O-N 3.05Å; E444-R446 VanDerWaalsContact C-N 3.25Å; E444-R446 PolarHBondContact O-N 3.07Å; R446-R449 PolarHBondContact O-N 2.62Å; R446-A450 PolarHBondContact O-N 2.56Å
447	A	81.6	Confident	70.5	Confident	45 Å²	45	80.6 Å²	80.6	37%	0.372	43%	0.425	S	S	.	.	H	α-helix	trans	-66.4	-48.8	178	0	0	0	0	0	110.9	M443 E444 R449 A450 D451	M443-A447 WeakPolarHBondContact O-CB 2.95Å; M443-A447 PolarHBondContact O-N 2.89Å; E444-A447 PolarHBondContact O-N 3.27Å; E444-A447 VanDerWaalsContact O-N 3.09Å; A447-R449 PolarHBondContact O-N 3.08Å; A447-R449 VanDerWaalsContact O-N 3.17Å; A447-A450 WeakPolarHBondContact O-CA 3.5Å; A447-A450 WeakPolarHBondContact O-CB 3.4Å; A447-A450 PolarHBondContact O-N 3.36Å; A447-D451 PolarHBondContact O-N 2.8Å
448	N	80.1	Confident	68.6	Low	116 Å²	116	84.2 Å²	84.2	62%	0.62	45%	0.449	S	S	*	.	H	α-helix	trans	-56.8	-35.6	176.3	-69.2	-5.2	0	0	0	111.9	E444 G452	E444-N448 PolarHBondContact O-N 3.18Å; N448-G452 PolarHBondContact O-N 3.13Å
449	R	72.6	Confident	66.4	Low	61 Å²	61	92.3 Å²	92.3	23%	0.23	49%	0.487	C	S	.	.	H	α-helix	trans	-68.4	-42.5	173.4	178.1	178	160.6	-167.7	-16.9	112.7	K339 P340 I445 R446 A447 D451 G452 E453	K339-R449 PolarHBondContact O-NH1 3.1Å; P340-R449 PolarHBondContact O-NH1 3.47Å; I445-R449 PolarHBondContact O-N 2.82Å; R446-R449 PolarHBondContact O-N 2.62Å; A447-R449 PolarHBondContact O-N 3.08Å; A447-R449 VanDerWaalsContact O-N 3.17Å; R449-D451 VanDerWaalsContact C-N 3.3Å; R449-G452 PolarHBondContact O-N 3.12Å; R449-E453 IonicContact NE-OE1 3.64Å; R449-E453 IonicContact NH2-OE1 3.79Å; R449-E453 PolarHBondContact O-N 3.05Å
450	A	66.3	Low	64.2	Low	52 Å²	52	98.3 Å²	98.3	43%	0.43	52%	0.515	S	S	.	.	H	α-helix	trans	-63.5	-40.2	178.7	0	0	0	0	0	111.1	R446 A447 E453 E454	R446-A450 PolarHBondContact O-N 2.56Å; A447-A450 WeakPolarHBondContact O-CA 3.5Å; A447-A450 WeakPolarHBondContact O-CB 3.4Å; A447-A450 PolarHBondContact O-N 3.36Å; A450-E453 PolarHBondContact O-N 3.41Å; A450-E454 PolarHBondContact O-N 2.69Å
451	D	61.1	Low	62	Low	97 Å²	97	96.6 Å²	96.6	52%	0.519	53%	0.533	S	S	.	.	H	α-helix	trans	-66.6	-38.9	176.6	-64	-19.1	0	0	0	111.4	A447 R449 E453 E454 E455	A447-D451 PolarHBondContact O-N 2.8Å; R449-D451 VanDerWaalsContact C-N 3.3Å; D451-E453 VanDerWaalsContact C-N 3.28Å; D451-E453 PolarHBondContact O-N 3.3Å; D451-E454 PolarHBondContact O-N 3.2Å; D451-E454 VanDerWaalsContact O-N 3.15Å; D451-E455 PolarHBondContact O-N 3Å
452	G	55.5	Low	60.1	Low	46 Å²	46	103.7 Å²	103.7	47%	0.474	58%	0.583	S	S	.	*	H	α-helix	trans	-67.3	-22.7	172.7	0	0	0	0	0	114.6	N448 R449	N448-G452 PolarHBondContact O-N 3.13Å; R449-G452 PolarHBondContact O-N 3.12Å
453	E	54.8	Low	58.8	Low	104 Å²	104	108.6 Å²	108.6	49%	0.486	61%	0.611	S	S	.	*	H	α-helix	trans	-79.9	-23.8	171.5	-77.1	-174.4	164.2	0	0	112.3	K339 R449 A450 D451	K339-E453 IonicContact NZ-OE1 2.82Å; K339-E453 PolarHBondContact NZ-OE1 3.01Å; R449-E453 IonicContact NE-OE1 3.64Å; R449-E453 IonicContact NH2-OE1 3.79Å; R449-E453 PolarHBondContact O-N 3.05Å; A450-E453 PolarHBondContact O-N 3.41Å; D451-E453 VanDerWaalsContact C-N 3.28Å; D451-E453 PolarHBondContact O-N 3.3Å
454	E	48.5	Very low	57.5	Low	174 Å²	174	107.4 Å²	107.4	81%	0.813	61%	0.609	S	S	*	*	H	α-helix	trans	-77.8	-21.9	171.4	-71.5	-162.9	164.1	0	0	113.3	A450 D451	A450-E454 PolarHBondContact O-N 2.69Å; D451-E454 PolarHBondContact O-N 3.2Å; D451-E454 VanDerWaalsContact O-N 3.15Å
455	E	42	Very low	56	Low	180 Å²	180	106.9 Å²	106.9	84%	0.841	61%	0.613	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90.1	2.7	175.1	-71.2	-166.3	153.7	0	0	114.8	D451	D451-E455 PolarHBondContact O-N 3Å
456	G	33.2	Very low	54.3	Low	44 Å²	44	112.5 Å²	112.5	45%	0.454	65%	0.645	S	S	.	*	S	Bend	trans	-72.9	142.4	171.2	0	0	0	0	0	112.6	M458	G456-M458 PolarHBondContact O-N 3.17Å
457	P	41.6	Very low	52.6	Low	122 Å²	122	114.6 Å²	114.6	79%	0.792	67%	0.667	S	S	*	*			trans	-65.9	113.8	-143.9	27.5	-34.9	0	0	0	114.1
458	M	45.2	Very low	50.7	Low	187 Å²	187	119.2 Å²	119.2	92%	0.921	69%	0.686	S	S	*	*			trans	-66.5	128.1	138.2	-114.8	-177.6	-98	0	0	107.1	G456	G456-M458 PolarHBondContact O-N 3.17Å
459	E	38.5	Very low	48.6	Very low	170 Å²	170	119.4 Å²	119.4	79%	0.794	69%	0.691	S	S	*	*			trans	98.8	121.9	-176.2	-62.3	-165.3	151.7	0	0	114.4
460	L	37.6	Very low	46.7	Very low	149 Å²	149	123.9 Å²	123.9	78%	0.78	73%	0.727	S	S	*	*			cis	-136.5	121.2	17.3	-72.6	104.1	0	0	0	111.2
461	A	38.2	Very low	45.1	Very low	112 Å²	112	129.9 Å²	129.9	93%	0.926	75%	0.751	S	S	*	*			trans	-92.9	109.3	147.5	0	0	0	0	0	107
462	S	44.6	Very low	43.6	Very low	174 Å²	174	132.9 Å²	132.9	100%	1.217	77%	0.773	S	S	*	*			trans	-139.2	0	162.3	66	0	0	0	0	109.5

Retrieved 462 of 462 residues in 256.3 ms (Link to these results)

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