A0A087XD35_POEFO Loading...

Milk fat globule EGF and factor V/VIII domain containing b

AlphaFold DB , UniProt , Accession A0A087XD35, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 479 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	58.5	Low	55.8	Low	235 Å²	235	165.7 Å²	165.7	100%	1.158	78%	0.783	S	S	*	*				0	60.2	0	-73.1	-160.9	-67.5	0	0	109.5
2	E	55.5	Low	55.8	Low	196 Å²	196	165.4 Å²	165.4	92%	0.916	78%	0.781	S	S	*	*			trans	-139.4	17.3	179.2	-142.9	180	-172.4	0	0	112.6
3	E	54.5	Low	55.7	Low	173 Å²	173	163.7 Å²	163.7	81%	0.808	78%	0.778	S	S	*	*	S	Bend	trans	-139.6	-5.4	171.2	-82.2	-153	138.9	0	0	114.6
4	L	54.2	Low	55.6	Low	134 Å²	134	162.7 Å²	162.7	70%	0.702	78%	0.779	S	S	*	*	S	Bend	trans	-90.9	-16.9	-176.2	-95.5	139.5	0	0	0	114.7
5	A	55.7	Low	55.5	Low	92 Å²	92	160.8 Å²	160.8	76%	0.76	78%	0.781	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.7	-17.2	-179	0	0	0	0	0	113.7
6	R	57.6	Low	54.9	Low	214 Å²	214	157.6 Å²	157.6	81%	0.808	79%	0.789	S	S	*	*	T	Hydrogen-bonded Turn	trans	-91.5	-17.3	-178.2	-128.2	168.3	99.6	-177.6	5.7	114
7	Y	54.9	Low	54.5	Low	201 Å²	201	155.4 Å²	155.4	79%	0.788	79%	0.79	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88	-28.3	177.1	-108.1	-89.6	0	0	0	113.7
8	F	56.1	Low	54	Low	152 Å²	152	155.6 Å²	155.6	67%	0.667	79%	0.793	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.6	-25.6	-176.4	-108.4	-89.6	0	0	0	114.3
9	F	54.5	Low	53.4	Low	164 Å²	164	153.3 Å²	153.3	72%	0.719	79%	0.787	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.8	-22.5	-179.3	-139.5	-96.4	0	0	0	113.2
10	W	56.4	Low	53.1	Low	196 Å²	196	155.6 Å²	155.6	74%	0.742	79%	0.791	S	S	*	*	T	Hydrogen-bonded Turn	trans	-89.1	-17	176.7	-71.9	82.8	0	0	0	113.1
11	A	56	Low	52.4	Low	66 Å²	66	151.7 Å²	151.7	55%	0.545	79%	0.79	S	S	.	*	G	3₁₀ helix	trans	-81.6	-15.6	178	0	0	0	0	0	114.3	L13	A11-L13 VanDerWaalsContact C-N 3.26Å; A11-L13 PolarHBondContact O-N 3.11Å
12	Q	55	Low	51.9	Low	162 Å²	162	147.6 Å²	147.6	76%	0.757	78%	0.777	S	S	*	*	G	3₁₀ helix	trans	-81.5	-2.3	174.7	-70.8	-165.1	-38.7	0	0	113.9
13	L	55.5	Low	51.5	Low	143 Å²	143	148.1 Å²	148.1	75%	0.749	78%	0.777	S	S	*	*	G	3₁₀ helix	trans	-96.8	7.5	-177.3	-118.2	146.5	0	0	0	114.5	A11	A11-L13 VanDerWaalsContact C-N 3.26Å; A11-L13 PolarHBondContact O-N 3.11Å
14	L	54.2	Low	51.3	Low	150 Å²	150	142.6 Å²	142.6	79%	0.785	77%	0.766	S	S	*	*	S	Bend	trans	-132.5	4	-169.8	-105.3	155.4	0	0	0	117.9
15	V	53.3	Low	51.6	Low	134 Å²	134	142.2 Å²	142.2	81%	0.812	77%	0.765	S	S	*	*	S	Bend	trans	-125.6	-8.2	-174.1	-175.3	0	0	0	0	116.1
16	A	45.9	Very low	51.7	Low	109 Å²	109	141.9 Å²	141.9	90%	0.901	75%	0.75	S	S	*	*	S	Bend	trans	-104.6	35.6	-179.6	0	0	0	0	0	114.3
17	C	49	Very low	52.1	Low	121 Å²	121	133.5 Å²	133.5	82%	0.818	72%	0.724	S	S	*	*	S	Bend	trans	-111	17.5	179.4	-134.4	0	0	0	0	114.3
18	L	44.3	Very low	52.4	Low	159 Å²	159	133.3 Å²	133.3	83%	0.832	73%	0.727	S	S	*	*			trans	-143.4	137.9	177.3	-73.5	168	0	0	0	110.9
19	V	44	Very low	52.9	Low	112 Å²	112	131.7 Å²	131.7	68%	0.679	73%	0.729	S	S	*	*	S	Bend	trans	81.9	94.2	169.2	-142.6	0	0	0	0	112.9
20	F	45.9	Very low	53.5	Low	198 Å²	198	128.2 Å²	128.2	87%	0.868	72%	0.718	S	S	*	*			cis	-155.3	132.8	48.9	-75	-90.1	0	0	0	111.4
21	G	40.2	Very low	54.6	Low	75 Å²	75	121.8 Å²	121.8	77%	0.773	70%	0.701	S	S	*	*			trans	-99.7	158.9	167.7	0	0	0	0	0	112.1
22	V	46.3	Very low	55.7	Low	148 Å²	148	119.2 Å²	119.2	90%	0.897	68%	0.678	S	S	*	*			trans	-140.7	108.1	152.2	-174.3	0	0	0	0	107.4
23	K	47.2	Very low	56.8	Low	207 Å²	207	117.9 Å²	117.9	90%	0.9	67%	0.67	S	S	*	*			trans	-96.5	110.6	167.1	-82.5	-176.4	173.7	-178	0	107.7
24	G	51.2	Low	57.7	Low	57 Å²	57	115.1 Å²	115.1	59%	0.588	66%	0.656	S	S	*	*			trans	-98.6	120.9	165	0	0	0	0	0	109.5	L26	G24-L26 PolarHBondContact O-N 3.42Å; G24-L26 VanDerWaalsContact O-N 3.14Å
25	D	59.1	Low	58.6	Low	126 Å²	126	111.2 Å²	111.2	67%	0.674	65%	0.652	S	S	*	*			trans	-68.9	103.3	179.1	-77.7	-33.6	0	0	0	111.1	C27	D25-C27 PolarHBondContact O-N 3.28Å
26	L	59	Low	59.8	Low	85 Å²	85	104.9 Å²	104.9	45%	0.445	61%	0.614	S	S	.	*	G	3₁₀ helix	trans	-73.4	-17.3	-173.1	-120.5	84.9	0	0	0	114.8	G24 K28 P45 F46	G24-L26 PolarHBondContact O-N 3.42Å; G24-L26 VanDerWaalsContact O-N 3.14Å; L26-K28 VanDerWaalsContact C-N 3.29Å; L26-K28 PolarHBondContact O-N 3.41Å; L26-P45 HydrophobicContact CD1-CB 4.43Å; L26-P45 HydrophobicContact CD2-CB 4.16Å; L26-F46 HydrophobicContact CB-CB 4.46Å; L26-F46 HydrophobicContact CB-CD1 4.39Å; L26-F46 HydrophobicContact CD2-CD1 3.45Å; L26-F46 VanDerWaalsContact CD2-CD1 3.45Å; L26-F46 HydrophobicContact CD2-CE1 3.79Å
27	C	66	Low	61.5	Low	38 Å²	38	103.8 Å²	103.8	26%	0.257	60%	0.596	S	S	.	*	G	3₁₀ helix	trans	-86.9	22.8	-177.8	-68.6	0	0	0	0	114.6	D25 V29 C38 V39 T40	D25-C27 PolarHBondContact O-N 3.28Å; C27-V29 PolarHBondContact O-N 3.14Å; C27-C38 HydrophobicContact CB-CB 3.91Å; C27-C38 WeakPolarHBondContact CB-SG 3.14Å; C27-C38 WeakPolarHBondContact SG-CB 3.41Å; C27-C38 CovalentContact SG-SG 2.06Å; C27-C38 PolarHBondContact SG-SG 3.47Å; C27-V39 PolarHBondContact SG-N 2.06Å; C27-T40 HydrophobicContact CB-CG2 4.22Å
28	K	60.8	Low	63	Low	197 Å²	197	98.9 Å²	98.9	86%	0.857	56%	0.563	S	S	*	*	G	3₁₀ helix	trans	-73.3	-15.1	175.6	-124.2	177	-176.4	177.2	0	113.5	L26	L26-K28 VanDerWaalsContact C-N 3.29Å; L26-K28 PolarHBondContact O-N 3.41Å
29	V	67	Low	64.7	Low	118 Å²	118	94 Å²	94	72%	0.715	54%	0.54	S	S	*	.	S	Bend	trans	-134.5	127.2	168.8	-178.3	0	0	0	0	107.1	C27 V31	C27-V29 PolarHBondContact O-N 3.14Å; V29-V31 PolarHBondContact O-N 3Å; V29-V31 VanDerWaalsContact O-N 3.11Å
30	N	67.9	Low	66.1	Low	92 Å²	92	92.5 Å²	92.5	49%	0.492	53%	0.531	S	S	.	.			trans	-70	109.4	-173.1	-162.8	9.5	0	0	0	110.8	G36 C38	N30-G36 PolarHBondContact ND2-O 3.42Å; N30-C38 WeakPolarHBondContact OD1-CB 3.26Å; N30-C38 PolarHBondContact OD1-N 2.02Å; N30-C38 VanDerWaalsContact OD1-N 3.16Å
31	V	78.6	Confident	66.8	Low	61 Å²	61	84.1 Å²	84.1	37%	0.37	50%	0.5	S	S	.	.			trans	-80.5	-20.3	-178.1	-173.7	0	0	0	0	111.9	V29 F46 T58	V29-V31 PolarHBondContact O-N 3Å; V29-V31 VanDerWaalsContact O-N 3.11Å; V31-F46 HydrophobicContact CB-CE2 4.3Å; V31-F46 HydrophobicContact CG1-CE2 4.21Å; V31-F46 HydrophobicContact CG1-CZ 4.21Å; V31-T58 HydrophobicContact CG1-CG2 4.41Å
32	C	79.1	Confident	67.3	Low	11 Å²	11	88.1 Å²	88.1	7%	0.074	51%	0.51	C	S	.	.			trans	-71.2	135.5	-177.4	-44.7	0	0	0	0	111.4	G36 C38 C48	C32-G36 WeakPolarHBondContact CB-O 2.94Å; C32-C38 VanDerWaalsContact SG-CA 3.51Å; C32-C38 PolarHBondContact SG-N 2.87Å; C32-C38 VanDerWaalsContact SG-N 3.42Å; C32-C48 WeakPolarHBondContact CA-SG 3.47Å; C32-C48 HydrophobicContact CB-CB 3.74Å; C32-C48 WeakPolarHBondContact CB-SG 3.04Å; C32-C48 WeakPolarHBondContact SG-CA 3.46Å; C32-C48 WeakPolarHBondContact SG-CB 3.14Å; C32-C48 CovalentContact SG-SG 2.02Å; C32-C48 PolarHBondContact SG-SG 3.09Å
33	K	78.4	Confident	68	Low	134 Å²	134	85.2 Å²	85.2	58%	0.583	51%	0.51	S	S	*	.	S	Bend	trans	-92.3	170.7	179	-61.9	-64.6	-178.3	178.9	0	111	G35 G36 T58 C59	K33-G35 PolarHBondContact O-N 2.88Å; K33-G35 VanDerWaalsContact O-N 3.09Å; K33-G36 PolarHBondContact O-N 2.87Å; K33-T58 PolarHBondContact N-O 2.93Å; K33-C59 WeakPolarHBondContact O-CB 2.97Å
34	N	74.6	Confident	68.5	Low	85 Å²	85	77.9 Å²	77.9	46%	0.455	49%	0.485	S	S	.	.	T	Hydrogen-bonded Turn	trans	52.8	36	172.5	-57.2	-35.7	0	0	0	114.9	P51 F54 C59	N34-P51 VanDerWaalsContact O-CG 3.26Å; N34-P51 WeakPolarHBondContact O-CG 3.34Å; N34-F54 HydrophobicContact CB-CD1 3.99Å; N34-F54 HydrophobicContact CB-CD2 4.33Å; N34-F54 HydrophobicContact CB-CE1 4.03Å; N34-F54 HydrophobicContact CB-CE2 4.38Å; N34-F54 HydrophobicContact CB-CG 4.14Å; N34-F54 HydrophobicContact CB-CZ 4.23Å; N34-C59 PolarHBondContact ND2-O 3.17Å
35	G	73.1	Confident	69.2	Low	69 Å²	69	79.4 Å²	79.4	71%	0.711	48%	0.484	S	S	*	.	T	Hydrogen-bonded Turn	trans	82.8	9.9	178.1	0	0	0	0	0	115.1	K33	K33-G35 PolarHBondContact O-N 2.88Å; K33-G35 VanDerWaalsContact O-N 3.09Å
36	G	78.9	Confident	69.8	Low	1 Å²	1	76 Å²	76	1%	0.01	46%	0.463	C	S	.	.			trans	-65	152.8	174.5	0	0	0	0	0	113.9	N30 C32 K33 I49	N30-G36 PolarHBondContact ND2-O 3.42Å; C32-G36 WeakPolarHBondContact CB-O 2.94Å; K33-G36 PolarHBondContact O-N 2.87Å; G36-I49 CarbonylContact C-O 3.56Å; G36-I49 WeakPolarHBondContact CA-O 3.2Å
37	T	79.8	Confident	70.7	Confident	85 Å²	85	75.8 Å²	75.8	52%	0.521	46%	0.462	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	120.6	-179.8	-57.2	0	0	0	0	111	I49	T37-I49 PolarHBondContact N-O 3.16Å; T37-I49 PolarHBondContact O-N 2.91Å
38	C	81.6	Confident	71.3	Confident	18 Å²	18	74.8 Å²	74.8	12%	0.122	46%	0.456	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.3	127.3	176.3	-171.3	0	0	0	0	111.3	C27 N30 C32	C27-C38 HydrophobicContact CB-CB 3.91Å; C27-C38 WeakPolarHBondContact CB-SG 3.14Å; C27-C38 WeakPolarHBondContact SG-CB 3.41Å; C27-C38 CovalentContact SG-SG 2.06Å; C27-C38 PolarHBondContact SG-SG 3.47Å; N30-C38 WeakPolarHBondContact OD1-CB 3.26Å; N30-C38 PolarHBondContact OD1-N 2.02Å; N30-C38 VanDerWaalsContact OD1-N 3.16Å; C32-C38 VanDerWaalsContact SG-CA 3.51Å; C32-C38 PolarHBondContact SG-N 2.87Å; C32-C38 VanDerWaalsContact SG-N 3.42Å
39	V	79.6	Confident	72.2	Confident	58 Å²	58	70.2 Å²	70.2	35%	0.352	44%	0.439	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.1	139.8	170.3	-64.8	0	0	0	0	109.9	C27 G41 F46 I47 I49	C27-V39 PolarHBondContact SG-N 2.06Å; V39-G41 PolarHBondContact O-N 3.39Å; V39-F46 CarbonylContact O-C 3.55Å; V39-I47 HydrophobicContact CG2-CB 4.13Å; V39-I47 WeakPolarHBondContact CG2-O 3.22Å; V39-I47 PolarHBondContact N-O 2.79Å; V39-I47 PolarHBondContact O-N 2.86Å; V39-I49 HydrophobicContact CG1-CD1 4.19Å; V39-I49 HydrophobicContact CG2-CD1 4.09Å; V39-I49 HydrophobicContact CG2-CG1 4.2Å
40	T	73	Confident	72.7	Confident	79 Å²	79	66.5 Å²	66.5	49%	0.485	42%	0.418	S	S	.	.			trans	-71.9	121.9	177.4	46.2	0	0	0	0	110	C27	C27-T40 HydrophobicContact CB-CG2 4.22Å
41	G	61.2	Low	72.8	Confident	22 Å²	22	64.6 Å²	64.6	23%	0.227	41%	0.411	C	S	.	.			trans	-88.2	150.1	-176.6	0	0	0	0	0	113.8	V39 G43 S44	V39-G41 PolarHBondContact O-N 3.39Å; G41-G43 PolarHBondContact O-N 2.01Å; G41-S44 CarbonylContact C-O 2.9Å
42	T	50.1	Low	72.3	Confident	160 Å²	160	69.7 Å²	69.7	98%	0.982	44%	0.436	S	S	*	.	S	Bend	trans	-84.4	79.9	169.7	45.6	0	0	0	0	109.8
43	G	61.7	Low	71.6	Confident	87 Å²	87	71 Å²	71	90%	0.897	45%	0.451	S	S	*	.	S	Bend	trans	136.8	-27.5	175.1	0	0	0	0	0	114.7	G41	G41-G43 PolarHBondContact O-N 2.01Å
44	S	57.7	Low	71.3	Confident	52 Å²	52	68 Å²	68	36%	0.364	44%	0.438	S	S	.	.	S	Bend	trans	-116.2	150.6	165.8	61.8	0	0	0	0	109.3	G41 F46 I47	G41-S44 CarbonylContact C-O 2.9Å; S44-F46 PolarHBondContact O-N 3.01Å; S44-F46 PolarHBondContact OG-O 3.48Å; S44-I47 WeakPolarHBondContact OG-CG1 3.26Å
45	P	66.1	Low	71.1	Confident	89 Å²	89	65.8 Å²	65.8	58%	0.578	43%	0.429	S	S	*	.	S	Bend	trans	-67.6	-21.9	-170.1	26.7	-34.5	0	0	0	113.8	L26	L26-P45 HydrophobicContact CD1-CB 4.43Å; L26-P45 HydrophobicContact CD2-CB 4.16Å
46	F	72.6	Confident	70.9	Confident	54 Å²	54	64 Å²	64	24%	0.237	41%	0.411	C	S	.	.			trans	-158.4	161.7	169.3	66.4	-79.9	0	0	0	110.7	L26 V31 V39 S44 T58	L26-F46 HydrophobicContact CB-CB 4.46Å; L26-F46 HydrophobicContact CB-CD1 4.39Å; L26-F46 HydrophobicContact CD2-CD1 3.45Å; L26-F46 VanDerWaalsContact CD2-CD1 3.45Å; L26-F46 HydrophobicContact CD2-CE1 3.79Å; V31-F46 HydrophobicContact CB-CE2 4.3Å; V31-F46 HydrophobicContact CG1-CE2 4.21Å; V31-F46 HydrophobicContact CG1-CZ 4.21Å; V39-F46 CarbonylContact O-C 3.55Å; S44-F46 PolarHBondContact O-N 3.01Å; S44-F46 PolarHBondContact OG-O 3.48Å; F46-T58 HydrophobicContact CE2-CG2 4.5Å
47	I	76.1	Confident	70.7	Confident	81 Å²	81	72.8 Å²	72.8	42%	0.415	45%	0.452	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.5	134	174	-62	172.2	0	0	0	107.6	V39 S44	V39-I47 HydrophobicContact CG2-CB 4.13Å; V39-I47 WeakPolarHBondContact CG2-O 3.22Å; V39-I47 PolarHBondContact N-O 2.79Å; V39-I47 PolarHBondContact O-N 2.86Å; S44-I47 WeakPolarHBondContact OG-CG1 3.26Å
48	C	80.2	Confident	70.5	Confident	18 Å²	18	70.9 Å²	70.9	12%	0.122	44%	0.44	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.8	125.7	174.3	-73.8	0	0	0	0	110.9	C32 E57	C32-C48 WeakPolarHBondContact CA-SG 3.47Å; C32-C48 HydrophobicContact CB-CB 3.74Å; C32-C48 WeakPolarHBondContact CB-SG 3.04Å; C32-C48 WeakPolarHBondContact SG-CA 3.46Å; C32-C48 WeakPolarHBondContact SG-CB 3.14Å; C32-C48 CovalentContact SG-SG 2.02Å; C32-C48 PolarHBondContact SG-SG 3.09Å; C48-E57 WeakPolarHBondContact CB-O 3.47Å
49	I	78.9	Confident	70.3	Confident	101 Å²	101	70 Å²	70	52%	0.518	43%	0.434	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.6	112	170	-56.2	175.2	0	0	0	107.6	G36 T37 V39	G36-I49 CarbonylContact C-O 3.56Å; G36-I49 WeakPolarHBondContact CA-O 3.2Å; T37-I49 PolarHBondContact N-O 3.16Å; T37-I49 PolarHBondContact O-N 2.91Å; V39-I49 HydrophobicContact CG1-CD1 4.19Å; V39-I49 HydrophobicContact CG2-CD1 4.09Å; V39-I49 HydrophobicContact CG2-CG1 4.2Å
50	C	78	Confident	70.2	Confident	39 Å²	39	72.3 Å²	72.3	26%	0.264	44%	0.444	S	S	.	.	P	Polyproline II helix	trans	-89.3	142.6	-176.2	-52.5	0	0	0	0	112.2	F54 C59	C50-F54 VanDerWaalsContact CB-O 3.27Å; C50-F54 WeakPolarHBondContact CB-O 3.48Å; C50-C59 WeakPolarHBondContact CA-SG 2.96Å; C50-C59 HydrophobicContact CB-CB 3.63Å; C50-C59 WeakPolarHBondContact CB-SG 3.33Å; C50-C59 WeakPolarHBondContact SG-CA 3.27Å; C50-C59 WeakPolarHBondContact SG-CB 3.44Å; C50-C59 CovalentContact SG-SG 2.01Å; C50-C59 PolarHBondContact SG-SG 2.76Å
51	P	70.5	Confident	69.9	Low	52 Å²	52	73.7 Å²	73.7	34%	0.338	45%	0.446	S	S	.	.	P	Polyproline II helix	trans	-73.5	156.3	171.4	29.6	-31.5	0	0	0	111.8	N34 G53 F54	N34-P51 VanDerWaalsContact O-CG 3.26Å; N34-P51 WeakPolarHBondContact O-CG 3.34Å; P51-G53 PolarHBondContact O-N 3.31Å; P51-F54 HydrophobicContact CG-CD2 4.38Å; P51-F54 PolarHBondContact O-N 3.19Å; P51-F54 VanDerWaalsContact O-N 3.17Å
52	D	66.8	Low	69.9	Low	169 Å²	169	77.2 Å²	77.2	90%	0.904	46%	0.463	S	S	*	.	T	Hydrogen-bonded Turn	trans	-49.1	130.4	-176.7	-67.7	-14	0	0	0	112.6
53	G	64.1	Low	70.2	Confident	38 Å²	38	76.1 Å²	76.1	39%	0.392	45%	0.447	S	S	.	.	T	Hydrogen-bonded Turn	trans	94.3	-5.2	-178.9	0	0	0	0	0	115.2	P51 T62 E63	P51-G53 PolarHBondContact O-N 3.31Å; G53-T62 WeakPolarHBondContact O-CA 3.36Å; G53-E63 PolarHBondContact O-N 3.2Å; G53-E63 VanDerWaalsContact O-N 3.14Å
54	F	72.1	Confident	70.1	Confident	72 Å²	72	76.7 Å²	76.7	32%	0.316	43%	0.433	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	139.2	174	-63.9	-86.5	0	0	0	112.2	N34 C50 P51 C59 E61 T62	N34-F54 HydrophobicContact CB-CD1 3.99Å; N34-F54 HydrophobicContact CB-CD2 4.33Å; N34-F54 HydrophobicContact CB-CE1 4.03Å; N34-F54 HydrophobicContact CB-CE2 4.38Å; N34-F54 HydrophobicContact CB-CG 4.14Å; N34-F54 HydrophobicContact CB-CZ 4.23Å; C50-F54 VanDerWaalsContact CB-O 3.27Å; C50-F54 WeakPolarHBondContact CB-O 3.48Å; P51-F54 HydrophobicContact CG-CD2 4.38Å; P51-F54 PolarHBondContact O-N 3.19Å; P51-F54 VanDerWaalsContact O-N 3.17Å; F54-C59 HydrophobicContact CB-CB 4.43Å; F54-E61 CarbonylContact C-O 3.44Å; F54-E61 WeakPolarHBondContact CA-O 3.45Å; F54-T62 HydrophobicContact CD1-CG2 3.82Å; F54-T62 HydrophobicContact CE1-CG2 3.62Å; F54-T62 HydrophobicContact CZ-CG2 4.46Å
55	S	71.5	Confident	70.3	Confident	38 Å²	38	76.4 Å²	76.4	27%	0.266	44%	0.438	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.7	179.2	-178.1	65.3	0	0	0	0	111.9	C59 N60 E61	S55-C59 CarbonylContact O-C 3.53Å; S55-C59 WeakPolarHBondContact O-CA 3.17Å; S55-N60 PolarHBondContact O-N 2.95Å; S55-E61 PolarHBondContact N-O 3.04Å; S55-E61 WeakPolarHBondContact O-CB 3.41Å; S55-E61 PolarHBondContact O-N 3.26Å
56	G	69.6	Low	70.3	Confident	32 Å²	32	74.5 Å²	74.5	33%	0.33	43%	0.426	S	S	.	.	S	Bend	trans	90.8	162.2	-175.8	0	0	0	0	0	113.8	T58 C59	G56-T58 PolarHBondContact O-N 3.46Å; G56-C59 PolarHBondContact O-N 3.14Å
57	E	73.9	Confident	70.1	Confident	185 Å²	185	73.2 Å²	73.2	86%	0.864	42%	0.423	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61	-20.7	-171	-66.8	-169.3	158.9	0	0	114.9	C48	C48-E57 WeakPolarHBondContact CB-O 3.47Å
58	T	76.2	Confident	69.8	Low	45 Å²	45	73.8 Å²	73.8	28%	0.276	43%	0.43	S	S	.	.	T	Hydrogen-bonded Turn	trans	-122.4	15	175.5	51.2	0	0	0	0	113.2	V31 K33 F46 G56 N60	V31-T58 HydrophobicContact CG1-CG2 4.41Å; K33-T58 PolarHBondContact N-O 2.93Å; F46-T58 HydrophobicContact CE2-CG2 4.5Å; G56-T58 PolarHBondContact O-N 3.46Å; T58-N60 VanDerWaalsContact C-N 3.33Å; T58-N60 PolarHBondContact O-N 3.39Å
59	C	77.6	Confident	69.1	Low	0 Å²	0	78.7 Å²	78.7	0%	0	46%	0.462	C	S	.	.	S	Bend	trans	61.6	35.3	-178.2	-41.7	0	0	0	0	114	K33 N34 C50 F54 S55 G56	K33-C59 WeakPolarHBondContact O-CB 2.97Å; N34-C59 PolarHBondContact ND2-O 3.17Å; C50-C59 WeakPolarHBondContact CA-SG 2.96Å; C50-C59 HydrophobicContact CB-CB 3.63Å; C50-C59 WeakPolarHBondContact CB-SG 3.33Å; C50-C59 WeakPolarHBondContact SG-CA 3.27Å; C50-C59 WeakPolarHBondContact SG-CB 3.44Å; C50-C59 CovalentContact SG-SG 2.01Å; C50-C59 PolarHBondContact SG-SG 2.76Å; F54-C59 HydrophobicContact CB-CB 4.43Å; S55-C59 CarbonylContact O-C 3.53Å; S55-C59 WeakPolarHBondContact O-CA 3.17Å; G56-C59 PolarHBondContact O-N 3.14Å
60	N	75.7	Confident	69	Low	105 Å²	105	78 Å²	78	56%	0.561	46%	0.459	S	S	*	.			trans	-86.9	-28.8	-178.3	118.8	20.9	0	0	0	112.2	S55 T58	S55-N60 PolarHBondContact O-N 2.95Å; T58-N60 VanDerWaalsContact C-N 3.33Å; T58-N60 PolarHBondContact O-N 3.39Å
61	E	67.7	Low	69	Low	109 Å²	109	77.9 Å²	77.9	51%	0.509	46%	0.458	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.8	151.2	-171.6	-59.6	175.2	-169.4	0	0	109.5	F54 S55	F54-E61 CarbonylContact C-O 3.44Å; F54-E61 WeakPolarHBondContact CA-O 3.45Å; S55-E61 PolarHBondContact N-O 3.04Å; S55-E61 WeakPolarHBondContact O-CB 3.41Å; S55-E61 PolarHBondContact O-N 3.26Å
62	T	60.1	Low	69.6	Low	96 Å²	96	76 Å²	76	59%	0.589	45%	0.446	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-104.3	130.3	173.5	47.3	0	0	0	0	109.1	G53 F54 T64	G53-T62 WeakPolarHBondContact O-CA 3.36Å; F54-T62 HydrophobicContact CD1-CG2 3.82Å; F54-T62 HydrophobicContact CE1-CG2 3.62Å; F54-T62 HydrophobicContact CZ-CG2 4.46Å; T62-T64 PolarHBondContact O-N 3.07Å; T62-T64 VanDerWaalsContact O-N 3.07Å
63	E	57.9	Low	70.4	Confident	137 Å²	137	72.9 Å²	72.9	64%	0.64	43%	0.426	S	S	*	.			trans	-67	106.7	-173.7	-161.9	169.4	-157.4	0	0	110.9	G53	G53-E63 PolarHBondContact O-N 3.2Å; G53-E63 VanDerWaalsContact O-N 3.14Å
64	T	58.4	Low	71.2	Confident	99 Å²	99	74.4 Å²	74.4	61%	0.607	43%	0.425	S	S	*	.			trans	-71.2	129.8	165.6	41.6	0	0	0	0	108.5	T62	T62-T64 PolarHBondContact O-N 3.07Å; T62-T64 VanDerWaalsContact O-N 3.07Å
65	G	63.2	Low	71.6	Confident	45 Å²	45	78 Å²	78	46%	0.464	45%	0.447	S	S	.	.			trans	-55.9	173.3	-168.9	0	0	0	0	0	116.5	C67 T68	G65-C67 PolarHBondContact O-N 3.49Å; G65-T68 PolarHBondContact O-N 3.29Å
66	P	64.6	Low	72.1	Confident	50 Å²	50	76.3 Å²	76.3	33%	0.325	44%	0.436	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.4	-9.9	-161	24.6	-35.9	0	0	0	116.7	A80 E92 Y93	P66-A80 HydrophobicContact CG-CB 4.25Å; P66-E92 HydrophobicContact CB-CB 4.2Å; P66-E92 HydrophobicContact CG-CB 3.9Å; P66-Y93 HydrophobicContact CB-CD1 3.78Å; P66-Y93 HydrophobicContact CB-CG 4.38Å
67	C	69.6	Low	72.9	Confident	27 Å²	27	78.4 Å²	78.4	18%	0.182	44%	0.442	C	S	.	.	T	Hydrogen-bonded Turn	trans	-102.6	14.3	176.9	-70.8	0	0	0	0	113.4	G65 P69 N70 C78 A80	G65-C67 PolarHBondContact O-N 3.49Å; C67-P69 CarbonylContact C-O 3.51Å; C67-P69 CarbonylContact O-C 3.59Å; C67-N70 PolarHBondContact O-N 2.95Å; C67-C78 VanDerWaalsContact CA-SG 3.54Å; C67-C78 HydrophobicContact CB-CB 3.8Å; C67-C78 WeakPolarHBondContact CB-SG 3.28Å; C67-C78 VanDerWaalsContact SG-C 3.59Å; C67-C78 WeakPolarHBondContact SG-CB 3.14Å; C67-C78 CovalentContact SG-SG 2.05Å; C67-C78 PolarHBondContact SG-SG 3.02Å; C67-A80 PolarHBondContact SG-N 2.91Å
68	T	68.3	Low	73.2	Confident	93 Å²	93	70.6 Å²	70.6	57%	0.571	41%	0.408	S	S	*	.	S	Bend	trans	-133.7	110.3	179.7	-55.3	0	0	0	0	111.8	G65	G65-T68 PolarHBondContact O-N 3.29Å
69	P	66.6	Low	73.6	Confident	120 Å²	120	72.5 Å²	72.5	78%	0.779	41%	0.414	S	S	*	.	S	Bend	cis	-68.1	158.8	-3.4	28.4	-33.7	0	0	0	113.2	C67 P71	C67-P69 CarbonylContact C-O 3.51Å; C67-P69 CarbonylContact O-C 3.59Å; P69-P71 VanDerWaalsContact O-CD 3.25Å; P69-P71 WeakPolarHBondContact O-CD 3.26Å
70	N	76	Confident	73.3	Confident	87 Å²	87	75.6 Å²	75.6	47%	0.465	44%	0.439	S	S	.	.			trans	-60.2	116.7	-176.3	-178.9	0.5	0	0	0	111.1	C67 C72 G76 C78	C67-N70 PolarHBondContact O-N 2.95Å; N70-C72 WeakPolarHBondContact OD1-CB 3.07Å; N70-C72 PolarHBondContact OD1-N 2.93Å; N70-G76 PolarHBondContact ND2-O 3.42Å; N70-G76 VanDerWaalsContact ND2-O 3.09Å; N70-C78 VanDerWaalsContact OD1-CB 3.26Å; N70-C78 WeakPolarHBondContact OD1-CB 3.37Å
71	P	78.7	Confident	72.8	Confident	36 Å²	36	74.5 Å²	74.5	23%	0.234	44%	0.436	C	S	.	.			trans	-79.9	-10	-178.2	32.1	-36.5	0	0	0	114.6	P69 C78 Y93	P69-P71 VanDerWaalsContact O-CD 3.25Å; P69-P71 WeakPolarHBondContact O-CD 3.26Å; P71-C78 VanDerWaalsContact CD-SG 3.57Å; P71-Y93 HydrophobicContact CB-CD2 4.45Å; P71-Y93 HydrophobicContact CB-CE2 3.66Å; P71-Y93 HydrophobicContact CG-CD2 3.48Å; P71-Y93 VanDerWaalsContact CG-CD2 3.48Å; P71-Y93 HydrophobicContact CG-CE1 4.29Å; P71-Y93 HydrophobicContact CG-CE2 3.16Å; P71-Y93 HydrophobicContact CG-CG 4.16Å
72	C	84.2	Confident	72.3	Confident	12 Å²	12	72.7 Å²	72.7	8%	0.081	45%	0.447	C	S	.	.			trans	-82.2	129.6	-177.5	-50	0	0	0	0	111.4	N70 G76 C78 C95	N70-C72 WeakPolarHBondContact OD1-CB 3.07Å; N70-C72 PolarHBondContact OD1-N 2.93Å; C72-G76 WeakPolarHBondContact CB-O 3.07Å; C72-C78 VanDerWaalsContact SG-CA 3.6Å; C72-C78 VanDerWaalsContact SG-CB 3.58Å; C72-C95 WeakPolarHBondContact CA-SG 2.94Å; C72-C95 HydrophobicContact CB-CB 3.74Å; C72-C95 WeakPolarHBondContact CB-SG 3.41Å; C72-C95 WeakPolarHBondContact SG-CA 3.44Å; C72-C95 WeakPolarHBondContact SG-CB 3.25Å; C72-C95 CovalentContact SG-SG 2.02Å; C72-C95 PolarHBondContact SG-SG 3.08Å
73	Q	83.3	Confident	72	Confident	105 Å²	105	75.5 Å²	75.5	49%	0.491	45%	0.453	S	S	.	.	S	Bend	trans	-86.4	168.6	178.6	-57.5	-174	5.1	0	0	111.4	D75 G76 H105 C106	Q73-D75 PolarHBondContact O-N 2.79Å; Q73-G76 PolarHBondContact O-N 3.2Å; Q73-G76 VanDerWaalsContact O-N 3.08Å; Q73-H105 WeakPolarHBondContact CB-O 3.28Å; Q73-H105 PolarHBondContact N-O 3.45Å; Q73-C106 WeakPolarHBondContact O-CB 3.48Å
74	N	80.4	Confident	71.4	Confident	69 Å²	69	80.9 Å²	80.9	37%	0.369	47%	0.468	S	S	.	.	T	Hydrogen-bonded Turn	trans	52.5	47.7	175.2	-57.8	-48.1	0	0	0	114	G76 Y101 C106	N74-G76 PolarHBondContact O-N 3.05Å; N74-Y101 HydrophobicContact CB-CD1 3.84Å; N74-Y101 HydrophobicContact CB-CD2 4.45Å; N74-Y101 HydrophobicContact CB-CE1 3.86Å; N74-Y101 HydrophobicContact CB-CE2 4.47Å; N74-Y101 HydrophobicContact CB-CG 4.14Å; N74-Y101 WeakPolarHBondContact ND2-CD1 3.41Å; N74-Y101 WeakPolarHBondContact ND2-CE1 3.34Å; N74-C106 PolarHBondContact ND2-O 3.12Å
75	D	80.8	Confident	71	Confident	148 Å²	148	87.4 Å²	87.4	79%	0.791	48%	0.481	S	S	*	.	T	Hydrogen-bonded Turn	trans	56.6	29.7	-178.3	-61.6	-37.1	0	0	0	114.4	Q73	Q73-D75 PolarHBondContact O-N 2.79Å
76	G	82.3	Confident	69.9	Low	2 Å²	2	97.4 Å²	97.4	2%	0.021	51%	0.505	C	S	.	.	P	Polyproline II helix	trans	-67.1	144.4	171.7	0	0	0	0	0	112.9	N70 C72 Q73 N74 K96	N70-G76 PolarHBondContact ND2-O 3.42Å; N70-G76 VanDerWaalsContact ND2-O 3.09Å; C72-G76 WeakPolarHBondContact CB-O 3.07Å; Q73-G76 PolarHBondContact O-N 3.2Å; Q73-G76 VanDerWaalsContact O-N 3.08Å; N74-G76 PolarHBondContact O-N 3.05Å; G76-K96 WeakPolarHBondContact CA-O 3.37Å
77	V	85.4	Confident	68.8	Low	76 Å²	76	97.9 Å²	97.9	46%	0.461	52%	0.519	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.8	120.7	179.9	-178	0	0	0	0	109.6	K96	V77-K96 HydrophobicContact CB-CB 4.41Å; V77-K96 PolarHBondContact N-O 2.91Å; V77-K96 PolarHBondContact O-N 3.19Å
78	C	81.1	Confident	67.8	Low	22 Å²	22	104.2 Å²	104.2	15%	0.149	55%	0.551	C	S	.	*	E	Extended strand (participates in β ladder)	trans	-85.9	126.6	176.5	-169.9	0	0	0	0	111.6	C67 N70 P71 C72	C67-C78 VanDerWaalsContact CA-SG 3.54Å; C67-C78 HydrophobicContact CB-CB 3.8Å; C67-C78 WeakPolarHBondContact CB-SG 3.28Å; C67-C78 VanDerWaalsContact SG-C 3.59Å; C67-C78 WeakPolarHBondContact SG-CB 3.14Å; C67-C78 CovalentContact SG-SG 2.05Å; C67-C78 PolarHBondContact SG-SG 3.02Å; N70-C78 VanDerWaalsContact OD1-CB 3.26Å; N70-C78 WeakPolarHBondContact OD1-CB 3.37Å; P71-C78 VanDerWaalsContact CD-SG 3.57Å; C72-C78 VanDerWaalsContact SG-CA 3.6Å; C72-C78 VanDerWaalsContact SG-CB 3.58Å
79	E	82.8	Confident	66.7	Low	85 Å²	85	105.7 Å²	105.7	40%	0.397	56%	0.56	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-115.6	117.7	171.5	-68.7	-178.1	175.9	0	0	109.2	T81 Y93 V94 K96	E79-T81 PolarHBondContact O-N 2.05Å; E79-Y93 CarbonylContact O-C 3.43Å; E79-Y93 VanDerWaalsContact O-CA 3.28Å; E79-Y93 WeakPolarHBondContact O-CA 3.04Å; E79-V94 PolarHBondContact N-O 2.87Å; E79-V94 PolarHBondContact O-N 3Å; E79-K96 VanDerWaalsContact CD-CE 3.45Å; E79-K96 WeakPolarHBondContact OE1-CE 3.42Å; E79-K96 IonicContact OE1-NZ 3.47Å; E79-K96 PolarHBondContact OE1-NZ 3.47Å; E79-K96 WeakPolarHBondContact OE2-CE 3.18Å; E79-K96 IonicContact OE2-NZ 2.69Å; E79-K96 PolarHBondContact OE2-NZ 2.84Å
80	A	71.9	Confident	66	Low	64 Å²	64	109.6 Å²	109.6	53%	0.529	57%	0.565	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-73.1	114	176.1	0	0	0	0	0	109.3	P66 C67 G82	P66-A80 HydrophobicContact CG-CB 4.25Å; C67-A80 PolarHBondContact SG-N 2.91Å; A80-G82 VanDerWaalsContact C-N 3.34Å; A80-G82 PolarHBondContact O-N 2.94Å
81	T	66.1	Low	65.1	Low	82 Å²	82	109 Å²	109	50%	0.503	57%	0.565	S	S	.	*			trans	-85	83.1	-177.7	-28.1	0	0	0	0	108.1	E79 Q83 E92	E79-T81 PolarHBondContact O-N 2.05Å; T81-Q83 PolarHBondContact O-N 2.69Å; T81-E92 PolarHBondContact N-O 2.99Å
82	G	57.8	Low	64.4	Low	72 Å²	72	113.4 Å²	113.4	74%	0.742	58%	0.582	S	S	*	*			trans	-56.8	104.8	179.3	0	0	0	0	0	112.1	A80	A80-G82 VanDerWaalsContact C-N 3.34Å; A80-G82 PolarHBondContact O-N 2.94Å
83	Q	53.1	Low	63.8	Low	154 Å²	154	115.2 Å²	115.2	72%	0.72	59%	0.587	S	S	*	*			trans	25.3	98.8	160.6	-63.3	-176.2	-11.1	0	0	117.4	T81	T81-Q83 PolarHBondContact O-N 2.69Å
84	R	44	Very low	63.7	Low	251 Å²	251	113.6 Å²	113.6	95%	0.947	59%	0.585	S	S	*	*			trans	-139.9	104.1	136.2	-72.9	-157.1	178.3	-161.2	0.5	110.6	R86	R84-R86 PolarHBondContact O-N 2.85Å
85	R	50.5	Low	63.8	Low	236 Å²	236	111.1 Å²	111.1	89%	0.891	57%	0.572	S	S	*	*			trans	-62.1	122.2	179.1	-60.9	-179.7	-178.9	-176.7	-0.3	111.7
86	R	40.3	Very low	64	Low	255 Å²	255	109.4 Å²	109.4	96%	0.962	56%	0.558	S	S	*	*			trans	-173	101.6	138.5	-151.1	171.3	-175.4	168.1	0.6	110.4	R84	R84-R86 PolarHBondContact O-N 2.85Å
87	G	40.6	Very low	64	Low	60 Å²	60	111.5 Å²	111.5	62%	0.619	57%	0.572	S	S	*	*	S	Bend	trans	121.2	103.6	165.2	0	0	0	0	0	116.1	V89	G87-V89 VanDerWaalsContact C-N 3.28Å; G87-V89 PolarHBondContact O-N 2.85Å
88	D	48.8	Very low	63.7	Low	160 Å²	160	112.4 Å²	112.4	86%	0.856	57%	0.571	S	S	*	*	S	Bend	trans	35.9	11.7	140.6	-44.2	-12.6	0	0	0	123
89	V	46.2	Very low	63.5	Low	123 Å²	123	116.7 Å²	116.7	75%	0.745	60%	0.599	S	S	*	*			trans	-141	110.2	166.6	-174.9	0	0	0	0	109.8	G87 T91	G87-V89 VanDerWaalsContact C-N 3.28Å; G87-V89 PolarHBondContact O-N 2.85Å; V89-T91 PolarHBondContact O-N 3.09Å
90	F	52.2	Low	63.1	Low	203 Å²	203	114 Å²	114	89%	0.89	59%	0.594	S	S	*	*			trans	-92.5	91	-176.4	-61.6	-88.8	0	0	0	111.3
91	T	55.8	Low	63.3	Low	75 Å²	75	114.4 Å²	114.4	46%	0.46	58%	0.582	S	S	.	*			trans	-129.3	111.5	162.2	50.1	0	0	0	0	109.4	V89 Y93	V89-T91 PolarHBondContact O-N 3.09Å; T91-Y93 PolarHBondContact O-N 2.02Å
92	E	65.4	Low	64	Low	127 Å²	127	115.8 Å²	115.8	59%	0.593	58%	0.583	S	S	*	*	S	Bend	trans	-77.3	6	-176.8	-64.3	-173.5	150.8	0	0	113.8	P66 T81	P66-E92 HydrophobicContact CB-CB 4.2Å; P66-E92 HydrophobicContact CG-CB 3.9Å; T81-E92 PolarHBondContact N-O 2.99Å
93	Y	71.4	Confident	64.8	Low	51 Å²	51	114.1 Å²	114.1	20%	0.2	57%	0.566	C	S	.	*	E	Extended strand (participates in β ladder)	trans	-145	156.2	174.8	66.1	-82.8	0	0	0	111	P66 P71 E79 T91 H105	P66-Y93 HydrophobicContact CB-CD1 3.78Å; P66-Y93 HydrophobicContact CB-CG 4.38Å; P71-Y93 HydrophobicContact CB-CD2 4.45Å; P71-Y93 HydrophobicContact CB-CE2 3.66Å; P71-Y93 HydrophobicContact CG-CD2 3.48Å; P71-Y93 VanDerWaalsContact CG-CD2 3.48Å; P71-Y93 HydrophobicContact CG-CE1 4.29Å; P71-Y93 HydrophobicContact CG-CE2 3.16Å; P71-Y93 HydrophobicContact CG-CG 4.16Å; E79-Y93 CarbonylContact O-C 3.43Å; E79-Y93 VanDerWaalsContact O-CA 3.28Å; E79-Y93 WeakPolarHBondContact O-CA 3.04Å; T91-Y93 PolarHBondContact O-N 2.02Å; Y93-H105 AromaticContact CE2-CE1 3.73Å; Y93-H105 AromaticContact CE2-ND1 3.77Å; Y93-H105 AromaticContact CZ-CE1 3.66Å; Y93-H105 PolarHBondContact OH-CE1 2.79Å
94	V	80.9	Confident	66	Low	71 Å²	71	111.4 Å²	111.4	43%	0.43	56%	0.56	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-127.2	133.6	174.1	172.9	0	0	0	0	109	E79	E79-V94 PolarHBondContact N-O 2.87Å; E79-V94 PolarHBondContact O-N 3Å
95	C	82.6	Confident	67.7	Low	16 Å²	16	102.1 Å²	102.1	11%	0.108	53%	0.527	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.4	123.6	173.2	-68.1	0	0	0	0	111.1	C72 V104	C72-C95 WeakPolarHBondContact CA-SG 2.94Å; C72-C95 HydrophobicContact CB-CB 3.74Å; C72-C95 WeakPolarHBondContact CB-SG 3.41Å; C72-C95 WeakPolarHBondContact SG-CA 3.44Å; C72-C95 WeakPolarHBondContact SG-CB 3.25Å; C72-C95 CovalentContact SG-SG 2.02Å; C72-C95 PolarHBondContact SG-SG 3.08Å; C95-V104 WeakPolarHBondContact CB-O 3.38Å
96	K	84.4	Confident	69.1	Low	112 Å²	112	90.9 Å²	90.9	49%	0.487	48%	0.484	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.6	113.9	167.2	-72.8	-177.3	177.2	166.1	0	109.7	G76 V77 E79	G76-K96 WeakPolarHBondContact CA-O 3.37Å; V77-K96 HydrophobicContact CB-CB 4.41Å; V77-K96 PolarHBondContact N-O 2.91Å; V77-K96 PolarHBondContact O-N 3.19Å; E79-K96 VanDerWaalsContact CD-CE 3.45Å; E79-K96 WeakPolarHBondContact OE1-CE 3.42Å; E79-K96 IonicContact OE1-NZ 3.47Å; E79-K96 PolarHBondContact OE1-NZ 3.47Å; E79-K96 WeakPolarHBondContact OE2-CE 3.18Å; E79-K96 IonicContact OE2-NZ 2.69Å; E79-K96 PolarHBondContact OE2-NZ 2.84Å
97	C	81.9	Confident	70.9	Confident	47 Å²	47	83 Å²	83	32%	0.318	46%	0.458	S	S	.	.	P	Polyproline II helix	trans	-83.4	144.6	-176.8	-52.5	0	0	0	0	112.9	Y101 C106	C97-Y101 VanDerWaalsContact CB-O 3.28Å; C97-Y101 WeakPolarHBondContact CB-O 2.99Å; C97-C106 WeakPolarHBondContact CA-SG 3.41Å; C97-C106 HydrophobicContact CB-CB 3.7Å; C97-C106 WeakPolarHBondContact CB-SG 3.18Å; C97-C106 PolarHBondContact N-SG 3.18Å; C97-C106 WeakPolarHBondContact SG-CA 3.3Å; C97-C106 WeakPolarHBondContact SG-CB 3.39Å; C97-C106 CovalentContact SG-SG 2.03Å; C97-C106 PolarHBondContact SG-SG 3.43Å
98	Q	80.4	Confident	72.3	Confident	94 Å²	94	83.2 Å²	83.2	44%	0.439	45%	0.448	S	S	.	.	P	Polyproline II helix	trans	-68	156.7	169.9	-70	-69	-17.4	0	0	111	G100 Y101	Q98-G100 PolarHBondContact O-N 3.49Å; Q98-Y101 PolarHBondContact O-N 3.21Å; Q98-Y101 VanDerWaalsContact O-N 3.12Å
99	P	77.4	Confident	73.4	Confident	113 Å²	113	78.5 Å²	78.5	73%	0.734	43%	0.427	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.7	129.1	178	-25.1	33.9	0	0	0	112.5
100	G	72.6	Confident	74.3	Confident	29 Å²	29	75.8 Å²	75.8	30%	0.299	41%	0.411	S	S	.	.	T	Hydrogen-bonded Turn	trans	88.5	9.7	-178.4	0	0	0	0	0	114.7	Q98 S109 V110	Q98-G100 PolarHBondContact O-N 3.49Å; G100-S109 CarbonylContact O-C 3.43Å; G100-V110 PolarHBondContact O-N 3.08Å
101	Y	77.4	Confident	74.3	Confident	72 Å²	72	73.1 Å²	73.1	28%	0.282	40%	0.401	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	143.6	169.8	-65.5	-91.2	0	0	0	111.6	N74 C97 Q98 T108	N74-Y101 HydrophobicContact CB-CD1 3.84Å; N74-Y101 HydrophobicContact CB-CD2 4.45Å; N74-Y101 HydrophobicContact CB-CE1 3.86Å; N74-Y101 HydrophobicContact CB-CE2 4.47Å; N74-Y101 HydrophobicContact CB-CG 4.14Å; N74-Y101 WeakPolarHBondContact ND2-CD1 3.41Å; N74-Y101 WeakPolarHBondContact ND2-CE1 3.34Å; C97-Y101 VanDerWaalsContact CB-O 3.28Å; C97-Y101 WeakPolarHBondContact CB-O 2.99Å; Q98-Y101 PolarHBondContact O-N 3.21Å; Q98-Y101 VanDerWaalsContact O-N 3.12Å; Y101-T108 CarbonylContact C-O 3.52Å; Y101-T108 WeakPolarHBondContact CA-O 3Å
102	E	80.3	Confident	74	Confident	110 Å²	110	72.5 Å²	72.5	51%	0.514	41%	0.41	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.4	173.7	178	78.4	-174.1	173	0	0	112.1	C106 Q107 T108 V110	E102-C106 CarbonylContact O-C 3.49Å; E102-Q107 PolarHBondContact O-N 2.82Å; E102-T108 HydrophobicContact CG-CG2 4.3Å; E102-T108 PolarHBondContact N-O 2.03Å; E102-T108 VanDerWaalsContact O-CB 3.3Å; E102-T108 WeakPolarHBondContact O-CB 3.49Å; E102-T108 PolarHBondContact O-N 3.02Å; E102-V110 HydrophobicContact CB-CG2 3.68Å; E102-V110 VanDerWaalsContact CD-CG2 3.43Å; E102-V110 HydrophobicContact CG-CG2 3.38Å
103	G	75	Confident	73	Confident	37 Å²	37	71.3 Å²	71.3	38%	0.381	42%	0.421	S	S	.	.	S	Bend	trans	102.9	165.5	-176.2	0	0	0	0	0	113.1	H105 C106	G103-H105 PolarHBondContact O-N 3.48Å; G103-C106 PolarHBondContact O-N 3.48Å; G103-C106 VanDerWaalsContact O-N 3.08Å
104	V	78.1	Confident	71.7	Confident	98 Å²	98	75.3 Å²	75.3	59%	0.594	45%	0.446	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61	-29.4	-172.4	-175.8	0	0	0	0	112.8	C95	C95-V104 WeakPolarHBondContact CB-O 3.38Å
105	H	78.4	Confident	70.2	Confident	56 Å²	56	80.2 Å²	80.2	26%	0.259	47%	0.469	S	S	.	.	T	Hydrogen-bonded Turn	trans	-118.8	20.6	175.8	-55.6	-52.9	0	0	0	112.3	Q73 Y93 G103 Q107	Q73-H105 WeakPolarHBondContact CB-O 3.28Å; Q73-H105 PolarHBondContact N-O 3.45Å; Y93-H105 AromaticContact CE2-CE1 3.73Å; Y93-H105 AromaticContact CE2-ND1 3.77Å; Y93-H105 AromaticContact CZ-CE1 3.66Å; Y93-H105 PolarHBondContact OH-CE1 2.79Å; G103-H105 PolarHBondContact O-N 3.48Å; H105-Q107 PolarHBondContact O-N 3.33Å
106	C	81.6	Confident	68.6	Low	0 Å²	0	87.1 Å²	87.1	0%	0	51%	0.505	C	S	.	.	S	Bend	trans	56.7	28	-176.4	-47.2	0	0	0	0	113.9	Q73 N74 C97 E102 G103 T108	Q73-C106 WeakPolarHBondContact O-CB 3.48Å; N74-C106 PolarHBondContact ND2-O 3.12Å; C97-C106 WeakPolarHBondContact CA-SG 3.41Å; C97-C106 HydrophobicContact CB-CB 3.7Å; C97-C106 WeakPolarHBondContact CB-SG 3.18Å; C97-C106 PolarHBondContact N-SG 3.18Å; C97-C106 WeakPolarHBondContact SG-CA 3.3Å; C97-C106 WeakPolarHBondContact SG-CB 3.39Å; C97-C106 CovalentContact SG-SG 2.03Å; C97-C106 PolarHBondContact SG-SG 3.43Å; E102-C106 CarbonylContact O-C 3.49Å; G103-C106 PolarHBondContact O-N 3.48Å; G103-C106 VanDerWaalsContact O-N 3.08Å; C106-T108 VanDerWaalsContact C-N 3.32Å; C106-T108 PolarHBondContact O-N 3.3Å
107	Q	77.8	Confident	66.9	Low	89 Å²	89	85.9 Å²	85.9	42%	0.416	51%	0.511	S	S	.	.			trans	-75.3	-20.4	-174.3	70.5	-85.6	22.5	0	0	113.4	E102 H105	E102-Q107 PolarHBondContact O-N 2.82Å; H105-Q107 PolarHBondContact O-N 3.33Å
108	T	70.3	Confident	65.4	Low	64 Å²	64	90.2 Å²	90.2	39%	0.393	54%	0.536	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.1	121.5	-174.1	-50.6	0	0	0	0	109.7	Y101 E102 C106	Y101-T108 CarbonylContact C-O 3.52Å; Y101-T108 WeakPolarHBondContact CA-O 3Å; E102-T108 HydrophobicContact CG-CG2 4.3Å; E102-T108 PolarHBondContact N-O 2.03Å; E102-T108 VanDerWaalsContact O-CB 3.3Å; E102-T108 WeakPolarHBondContact O-CB 3.49Å; E102-T108 PolarHBondContact O-N 3.02Å; C106-T108 VanDerWaalsContact C-N 3.32Å; C106-T108 PolarHBondContact O-N 3.3Å
109	S	70.3	Confident	64.2	Low	61 Å²	61	91.8 Å²	91.8	43%	0.427	54%	0.541	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.1	124.1	168	-179.5	0	0	0	0	109.8	G100 Q111	G100-S109 CarbonylContact O-C 3.43Å; S109-Q111 VanDerWaalsContact C-N 3.31Å; S109-Q111 PolarHBondContact OG-N 2.74Å
110	V	66.1	Low	63	Low	66 Å²	66	92.3 Å²	92.3	40%	0.4	54%	0.538	S	S	.	.			trans	-95.2	13.4	175.7	-155.5	0	0	0	0	111	G100 E102 G112	G100-V110 PolarHBondContact O-N 3.08Å; E102-V110 HydrophobicContact CB-CG2 3.68Å; E102-V110 VanDerWaalsContact CD-CG2 3.43Å; E102-V110 HydrophobicContact CG-CG2 3.38Å; V110-G112 PolarHBondContact O-N 2.8Å
111	Q	51.2	Low	62.5	Low	148 Å²	148	96 Å²	96	69%	0.692	55%	0.554	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.2	72.2	170.8	-66	-177.7	13.4	0	0	110.2	S109	S109-Q111 VanDerWaalsContact C-N 3.31Å; S109-Q111 PolarHBondContact OG-N 2.74Å
112	G	49.6	Very low	62.1	Low	62 Å²	62	96.7 Å²	96.7	64%	0.639	56%	0.563	S	S	*	*	T	Hydrogen-bonded Turn	trans	-140.5	8.2	174.7	0	0	0	0	0	112.9	V110 N114	V110-G112 PolarHBondContact O-N 2.8Å; G112-N114 PolarHBondContact O-N 3.15Å
113	A	45.6	Very low	62	Low	101 Å²	101	94.1 Å²	94.1	84%	0.835	55%	0.553	S	S	*	*			trans	-73.8	67.8	162.6	0	0	0	0	0	109.1	L115	A113-L115 PolarHBondContact O-N 2.85Å; A113-L115 VanDerWaalsContact O-N 3.15Å
114	N	43.8	Very low	62.5	Low	136 Å²	136	93.4 Å²	93.4	73%	0.727	54%	0.541	S	S	*	.			trans	-60.8	114.5	157.7	-95.7	-55.8	0	0	0	107.2	G112 N116	G112-N114 PolarHBondContact O-N 3.15Å; N114-N116 PolarHBondContact O-N 3.05Å
115	L	49.3	Very low	62.6	Low	173 Å²	173	92 Å²	92	91%	0.906	54%	0.54	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.3	64.7	160.9	-153.4	91.8	0	0	0	108.7	A113	A113-L115 PolarHBondContact O-N 2.85Å; A113-L115 VanDerWaalsContact O-N 3.15Å
116	N	48.3	Very low	62.7	Low	161 Å²	161	92.5 Å²	92.5	86%	0.861	56%	0.561	S	S	*	*	T	Hydrogen-bonded Turn	trans	178	40.6	167	-97.8	-10.3	0	0	0	112.4	N114	N114-N116 PolarHBondContact O-N 3.05Å
117	S	48.8	Very low	62.7	Low	87 Å²	87	100.3 Å²	100.3	61%	0.608	60%	0.597	S	S	*	*			trans	-129.9	82.5	161.1	-155.5	0	0	0	0	108.9	K119	S117-K119 PolarHBondContact O-N 3.19Å
118	T	50.7	Low	63.1	Low	137 Å²	137	97.3 Å²	97.3	84%	0.84	59%	0.585	S	S	*	*			trans	-62.7	76.5	155.1	39.6	0	0	0	0	107.8
119	K	56.5	Low	64.1	Low	127 Å²	127	95.1 Å²	95.1	55%	0.552	57%	0.572	S	S	*	*			trans	-126.1	117	176.3	-163.7	172.4	-176.3	176.2	0	107.5	S117 D139	S117-K119 PolarHBondContact O-N 3.19Å; K119-D139 VanDerWaalsContact CE-OD2 3.24Å; K119-D139 WeakPolarHBondContact CE-OD2 3.02Å; K119-D139 IonicContact NZ-OD2 3.88Å
120	D	51.8	Low	64.9	Low	124 Å²	124	97.3 Å²	97.3	66%	0.663	58%	0.576	S	S	*	*			trans	83.4	42.7	177.8	-55.6	-14.5	0	0	0	117.6
121	V	62.6	Low	65.9	Low	108 Å²	108	97.6 Å²	97.6	66%	0.655	58%	0.575	S	S	*	*			trans	-84.1	115.5	148.2	-180	0	0	0	0	106.4	D123	V121-D123 PolarHBondContact O-N 2.79Å
122	N	68.6	Low	67.5	Low	85 Å²	85	93.7 Å²	93.7	46%	0.455	57%	0.574	S	S	.	*			trans	-64.4	100.9	175.3	177.5	-11.4	0	0	0	109.3	C124 A125 D137	N122-C124 PolarHBondContact O-N 3.39Å; N122-C124 WeakPolarHBondContact OD1-CA 3.28Å; N122-C124 VanDerWaalsContact OD1-CB 3.24Å; N122-C124 WeakPolarHBondContact OD1-CB 3.46Å; N122-C124 PolarHBondContact OD1-N 3.45Å; N122-A125 VanDerWaalsContact O-CB 3.28Å; N122-A125 WeakPolarHBondContact O-CB 3.41Å; N122-A125 PolarHBondContact O-N 2.99Å; N122-A125 PolarHBondContact OD1-N 2.86Å; N122-D137 WeakPolarHBondContact CA-OD1 3.24Å; N122-D137 PolarHBondContact OD1-OD1 3.46Å
123	D	77.6	Confident	69.4	Low	57 Å²	57	91.5 Å²	91.5	31%	0.305	55%	0.551	S	S	.	*	T	Hydrogen-bonded Turn	trans	-67.7	-16.4	-176.2	-72.9	-51.6	0	0	0	111.5	V121 D137 D141 F142	V121-D123 PolarHBondContact O-N 2.79Å; D123-D137 PolarHBondContact N-OD1 2.88Å; D123-D141 WeakPolarHBondContact OD2-CA 3.24Å; D123-D141 PolarHBondContact OD2-N 2.78Å; D123-F142 HydrophobicContact CB-CB 3.87Å; D123-F142 HydrophobicContact CB-CD1 4.03Å; D123-F142 HydrophobicContact CB-CG 4.38Å
124	C	84.6	Confident	71.6	Confident	21 Å²	21	91.3 Å²	91.3	14%	0.142	54%	0.54	C	S	.	.	T	Hydrogen-bonded Turn	trans	-81	-12.7	173.1	-67.1	0	0	0	0	114.7	N122 G126 H127 C135 D137	N122-C124 PolarHBondContact O-N 3.39Å; N122-C124 WeakPolarHBondContact OD1-CA 3.28Å; N122-C124 VanDerWaalsContact OD1-CB 3.24Å; N122-C124 WeakPolarHBondContact OD1-CB 3.46Å; N122-C124 PolarHBondContact OD1-N 3.45Å; C124-G126 PolarHBondContact O-N 3.32Å; C124-H127 PolarHBondContact O-N 3.19Å; C124-C135 WeakPolarHBondContact CA-SG 3.4Å; C124-C135 HydrophobicContact CB-CB 3.62Å; C124-C135 WeakPolarHBondContact CB-SG 3.02Å; C124-C135 WeakPolarHBondContact SG-CB 2.99Å; C124-C135 CovalentContact SG-SG 2.03Å; C124-C135 PolarHBondContact SG-SG 3.27Å; C124-D137 PolarHBondContact SG-N 3.05Å
125	A	81	Confident	73.8	Confident	69 Å²	69	86.5 Å²	86.5	57%	0.57	52%	0.517	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.8	-29.8	-178.7	0	0	0	0	0	112.8	N122 H127	N122-A125 VanDerWaalsContact O-CB 3.28Å; N122-A125 WeakPolarHBondContact O-CB 3.41Å; N122-A125 PolarHBondContact O-N 2.99Å; N122-A125 PolarHBondContact OD1-N 2.86Å; A125-H127 PolarHBondContact O-N 3.3Å; A125-H127 PolarHBondContact O-ND1 3.21Å
126	G	79.9	Confident	75.7	Confident	67 Å²	67	86.9 Å²	86.9	69%	0.691	51%	0.506	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.6	1.6	177.2	0	0	0	0	0	115.3	C124	C124-G126 PolarHBondContact O-N 3.32Å
127	H	82.9	Confident	77.3	Confident	164 Å²	164	82.2 Å²	82.2	76%	0.759	48%	0.481	S	S	*	.			trans	50.1	55.1	-171.5	-58.8	72.8	0	0	0	112.8	C124 A125 C129	C124-H127 PolarHBondContact O-N 3.19Å; A125-H127 PolarHBondContact O-N 3.3Å; A125-H127 PolarHBondContact O-ND1 3.21Å; H127-C129 PolarHBondContact O-N 3.06Å
128	P	85.8	Confident	78.9	Confident	25 Å²	25	81.6 Å²	81.6	16%	0.162	47%	0.471	C	S	.	.			trans	-70.6	-13.7	-173.2	31.2	-38.2	0	0	0	113.9	F142 H154	P128-F142 HydrophobicContact CB-CD2 4.06Å; P128-F142 HydrophobicContact CB-CE1 4.2Å; P128-F142 HydrophobicContact CB-CE2 3.71Å; P128-F142 HydrophobicContact CB-CG 4.49Å; P128-F142 HydrophobicContact CB-CZ 3.82Å; P128-F142 HydrophobicContact CG-CD1 4.25Å; P128-F142 HydrophobicContact CG-CD2 3.55Å; P128-F142 HydrophobicContact CG-CE1 4.4Å; P128-F142 HydrophobicContact CG-CE2 3.74Å; P128-F142 HydrophobicContact CG-CG 3.86Å; P128-F142 HydrophobicContact CG-CZ 4.19Å; P128-H154 VanDerWaalsContact O-CB 3.3Å; P128-H154 WeakPolarHBondContact O-CB 3.39Å; P128-H154 PolarHBondContact O-ND1 3.1Å
129	C	90.7	Very high	80.2	Confident	18 Å²	18	81 Å²	81	12%	0.122	46%	0.462	C	S	.	.			trans	-88.9	116	-179.4	-51.5	0	0	0	0	111.1	H127 G133 C135 C144	H127-C129 PolarHBondContact O-N 3.06Å; C129-G133 WeakPolarHBondContact CB-O 3.24Å; C129-C135 WeakPolarHBondContact SG-CA 3.3Å; C129-C135 WeakPolarHBondContact SG-CB 3.49Å; C129-C144 WeakPolarHBondContact CA-SG 3.47Å; C129-C144 HydrophobicContact CB-CB 3.8Å; C129-C144 WeakPolarHBondContact CB-SG 3.3Å; C129-C144 WeakPolarHBondContact SG-CA 3.46Å; C129-C144 WeakPolarHBondContact SG-CB 3.29Å; C129-C144 CovalentContact SG-SG 2.01Å; C129-C144 PolarHBondContact SG-SG 3.5Å
130	E	88.6	Confident	80.7	Confident	108 Å²	108	77.7 Å²	77.7	51%	0.505	46%	0.464	S	S	.	.			trans	-81.9	175.4	174.9	-57.8	-170.3	170.5	0	0	112.1	G132 G133 H154 C155 Q156	E130-G132 PolarHBondContact O-N 3.31Å; E130-G133 PolarHBondContact O-N 2.03Å; E130-H154 WeakPolarHBondContact CB-O 3.33Å; E130-H154 PolarHBondContact N-O 2.95Å; E130-C155 WeakPolarHBondContact O-CB 3.22Å; E130-Q156 WeakPolarHBondContact OE2-CB 3.48Å
131	N	86.9	Confident	81.8	Confident	72 Å²	72	75 Å²	75	39%	0.385	45%	0.45	S	S	.	.	T	Hydrogen-bonded Turn	trans	52.6	32.9	170.1	-60.7	-56.8	0	0	0	115.4	Y150 C155	N131-Y150 HydrophobicContact CB-CD1 3.62Å; N131-Y150 HydrophobicContact CB-CD2 3.91Å; N131-Y150 HydrophobicContact CB-CE1 3.68Å; N131-Y150 HydrophobicContact CB-CE2 3.98Å; N131-Y150 HydrophobicContact CB-CG 3.72Å; N131-Y150 VanDerWaalsContact CG-CE1 3.4Å; N131-C155 PolarHBondContact ND2-O 2.85Å
132	G	85	Confident	82.8	Confident	66 Å²	66	70.9 Å²	70.9	68%	0.68	42%	0.423	S	S	*	.	T	Hydrogen-bonded Turn	trans	77.2	18.5	179	0	0	0	0	0	114.3	E130	E130-G132 PolarHBondContact O-N 3.31Å
133	G	88.8	Confident	83.7	Confident	15 Å²	15	73.5 Å²	73.5	16%	0.155	43%	0.431	C	S	.	.	P	Polyproline II helix	trans	-66.9	141.6	172.3	0	0	0	0	0	112.8	C129 E130 H145	C129-G133 WeakPolarHBondContact CB-O 3.24Å; E130-G133 PolarHBondContact O-N 2.03Å; G133-H145 CarbonylContact C-O 3.47Å; G133-H145 VanDerWaalsContact CA-O 3.29Å; G133-H145 WeakPolarHBondContact CA-O 2.97Å
134	T	90.4	Very high	84.1	Confident	97 Å²	97	71.4 Å²	71.4	60%	0.595	42%	0.42	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-93.2	123.9	175.8	-53.7	0	0	0	0	109.7	H145	T134-H145 PolarHBondContact N-O 3.49Å; T134-H145 PolarHBondContact O-N 2.96Å
135	C	90.4	Very high	84.3	Confident	36 Å²	36	75.7 Å²	75.7	24%	0.243	44%	0.438	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.9	136.2	179.9	-163.6	0	0	0	0	111.8	C124 C129	C124-C135 WeakPolarHBondContact CA-SG 3.4Å; C124-C135 HydrophobicContact CB-CB 3.62Å; C124-C135 WeakPolarHBondContact CB-SG 3.02Å; C124-C135 WeakPolarHBondContact SG-CB 2.99Å; C124-C135 CovalentContact SG-SG 2.03Å; C124-C135 PolarHBondContact SG-SG 3.27Å; C129-C135 WeakPolarHBondContact SG-CA 3.3Å; C129-C135 WeakPolarHBondContact SG-CB 3.49Å
136	R	89.4	Confident	84.6	Confident	181 Å²	181	73.6 Å²	73.6	68%	0.683	42%	0.419	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-121.8	121	167.9	-178	176.9	176.6	166.6	0.4	109.5	K143	R136-K143 PolarHBondContact N-O 2.79Å; R136-K143 PolarHBondContact O-N 2.83Å
137	D	83.1	Confident	85	Confident	62 Å²	62	72.4 Å²	72.4	33%	0.332	40%	0.399	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.1	139.6	177.4	-162.7	55	0	0	0	110.5	N122 D123 C124	N122-D137 WeakPolarHBondContact CA-OD1 3.24Å; N122-D137 PolarHBondContact OD1-OD1 3.46Å; D123-D137 PolarHBondContact N-OD1 2.88Å; C124-D137 PolarHBondContact SG-N 3.05Å
138	L	81.6	Confident	85	Confident	74 Å²	74	65.6 Å²	65.6	39%	0.387	37%	0.37	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.2	160	174.7	-54.9	171.5	0	0	0	108.1	G140 D141 K143	L138-G140 PolarHBondContact O-N 2.88Å; L138-D141 CarbonylContact C-O 3.48Å; L138-D141 VanDerWaalsContact CA-O 3.3Å; L138-D141 WeakPolarHBondContact CA-O 3.4Å; L138-D141 VanDerWaalsContact CB-O 3.24Å; L138-D141 WeakPolarHBondContact CB-O 2.98Å; L138-D141 PolarHBondContact N-O 2.78Å; L138-D141 PolarHBondContact O-N 3.22Å; L138-K143 HydrophobicContact CD1-CB 3.89Å
139	D	78.3	Confident	85	Confident	124 Å²	124	65 Å²	65	66%	0.663	37%	0.366	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.6	95.6	178.1	-74.5	22.9	0	0	0	111.1	K119	K119-D139 VanDerWaalsContact CE-OD2 3.24Å; K119-D139 WeakPolarHBondContact CE-OD2 3.02Å; K119-D139 IonicContact NZ-OD2 3.88Å
140	G	67.5	Low	84.8	Confident	58 Å²	58	67.4 Å²	67.4	60%	0.598	37%	0.373	S	S	*	.	T	Hydrogen-bonded Turn	trans	81	14.3	177.6	0	0	0	0	0	116.2	L138	L138-G140 PolarHBondContact O-N 2.88Å
141	D	74.3	Confident	84.4	Confident	67 Å²	67	62.6 Å²	62.6	36%	0.358	35%	0.351	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.9	169.8	168.1	-159.7	3.7	0	0	0	110.1	D123 L138 K153	D123-D141 WeakPolarHBondContact OD2-CA 3.24Å; D123-D141 PolarHBondContact OD2-N 2.78Å; L138-D141 CarbonylContact C-O 3.48Å; L138-D141 VanDerWaalsContact CA-O 3.3Å; L138-D141 WeakPolarHBondContact CA-O 3.4Å; L138-D141 VanDerWaalsContact CB-O 3.24Å; L138-D141 WeakPolarHBondContact CB-O 2.98Å; L138-D141 PolarHBondContact N-O 2.78Å; L138-D141 PolarHBondContact O-N 3.22Å; D141-K153 VanDerWaalsContact OD1-CE 3.22Å; D141-K153 WeakPolarHBondContact OD1-CE 3.33Å; D141-K153 IonicContact OD1-NZ 3.98Å; D141-K153 PolarHBondContact OD1-NZ 3.2Å; D141-K153 IonicContact OD2-NZ 3.51Å; D141-K153 PolarHBondContact OD2-NZ 3.04Å
142	F	84.1	Confident	83.9	Confident	22 Å²	22	60.8 Å²	60.8	10%	0.096	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	152.9	171.2	68.6	-80.3	0	0	0	111	D123 P128 C144 K153 H154	D123-F142 HydrophobicContact CB-CB 3.87Å; D123-F142 HydrophobicContact CB-CD1 4.03Å; D123-F142 HydrophobicContact CB-CG 4.38Å; P128-F142 HydrophobicContact CB-CD2 4.06Å; P128-F142 HydrophobicContact CB-CE1 4.2Å; P128-F142 HydrophobicContact CB-CE2 3.71Å; P128-F142 HydrophobicContact CB-CG 4.49Å; P128-F142 HydrophobicContact CB-CZ 3.82Å; P128-F142 HydrophobicContact CG-CD1 4.25Å; P128-F142 HydrophobicContact CG-CD2 3.55Å; P128-F142 HydrophobicContact CG-CE1 4.4Å; P128-F142 HydrophobicContact CG-CE2 3.74Å; P128-F142 HydrophobicContact CG-CG 3.86Å; P128-F142 HydrophobicContact CG-CZ 4.19Å; F142-C144 VanDerWaalsContact CE2-SG 3.55Å; F142-K153 HydrophobicContact CE2-CG 4.12Å; F142-K153 HydrophobicContact CZ-CD 4.12Å; F142-K153 VanDerWaalsContact CZ-CE 3.48Å; F142-K153 HydrophobicContact CZ-CG 3.86Å; F142-H154 AromaticContact CE2-ND1 3.85Å; F142-H154 AromaticContact CZ-CE1 3.21Å; F142-H154 WeakPolarHBondContact CZ-CE1 3.15Å; F142-H154 AromaticContact CZ-ND1 3.52Å; F142-H154 AromaticContact CZ-NE2 3.77Å
143	K	86	Confident	83.6	Confident	140 Å²	140	62.5 Å²	62.5	61%	0.609	34%	0.338	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-122.9	116.5	173	-175.8	172.8	-177.8	175.6	0	110.4	R136 L138	R136-K143 PolarHBondContact N-O 2.79Å; R136-K143 PolarHBondContact O-N 2.83Å; L138-K143 HydrophobicContact CD1-CB 3.89Å
144	C	87.6	Confident	83.2	Confident	14 Å²	14	64.9 Å²	64.9	10%	0.095	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.9	129.8	170.4	-62	0	0	0	0	111.4	C129 F142 K153 C155	C129-C144 WeakPolarHBondContact CA-SG 3.47Å; C129-C144 HydrophobicContact CB-CB 3.8Å; C129-C144 WeakPolarHBondContact CB-SG 3.3Å; C129-C144 WeakPolarHBondContact SG-CA 3.46Å; C129-C144 WeakPolarHBondContact SG-CB 3.29Å; C129-C144 CovalentContact SG-SG 2.01Å; C129-C144 PolarHBondContact SG-SG 3.5Å; F142-C144 VanDerWaalsContact CE2-SG 3.55Å; C144-K153 WeakPolarHBondContact CB-O 3.22Å; C144-K153 PolarHBondContact SG-O 3.07Å; C144-C155 WeakPolarHBondContact CB-SG 3.37Å
145	H	88.3	Confident	83	Confident	111 Å²	111	60.3 Å²	60.3	51%	0.514	32%	0.317	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.9	103.2	162.9	-176.8	83	0	0	0	108.4	G133 T134	G133-H145 CarbonylContact C-O 3.47Å; G133-H145 VanDerWaalsContact CA-O 3.29Å; G133-H145 WeakPolarHBondContact CA-O 2.97Å; T134-H145 PolarHBondContact N-O 3.49Å; T134-H145 PolarHBondContact O-N 2.96Å
146	C	87.1	Confident	82.5	Confident	24 Å²	24	62.3 Å²	62.3	16%	0.162	32%	0.323	C	S	.	.	P	Polyproline II helix	trans	-87.6	126.2	-176	-53.8	0	0	0	0	111.4	Y150 C155	C146-Y150 WeakPolarHBondContact CB-O 3.27Å; C146-C155 WeakPolarHBondContact CA-SG 3.41Å; C146-C155 HydrophobicContact CB-CB 3.7Å; C146-C155 WeakPolarHBondContact CB-SG 3.38Å; C146-C155 WeakPolarHBondContact SG-CA 3.48Å; C146-C155 WeakPolarHBondContact SG-CB 3.32Å; C146-C155 CovalentContact SG-SG 2.03Å; C146-C155 PolarHBondContact SG-SG 2.03Å
147	P	87.8	Confident	81.8	Confident	42 Å²	42	56.1 Å²	56.1	27%	0.273	30%	0.303	S	S	.	.	P	Polyproline II helix	trans	-66	141.1	171.1	28	-34.2	0	0	0	110.1	Y150	P147-Y150 WeakPolarHBondContact O-CB 3.46Å; P147-Y150 PolarHBondContact O-N 3.44Å
148	S	84	Confident	81.8	Confident	21 Å²	21	59.7 Å²	59.7	15%	0.147	31%	0.312	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59.7	132.5	173.8	-169.7	0	0	0	0	110.2	F286	S148-F286 WeakPolarHBondContact CB-O 3.47Å; S148-F286 PolarHBondContact OG-O 3.32Å
149	P	84.7	Confident	81.9	Confident	13 Å²	13	56.2 Å²	56.2	8%	0.084	29%	0.294	C	S	.	.	T	Hydrogen-bonded Turn	cis	-103.9	23	14.9	40.9	-36.7	0	0	0	114.9	R158 C159 I160 T228	P149-R158 HydrophobicContact CG-CG 4.18Å; P149-C159 WeakPolarHBondContact O-CB 3.37Å; P149-C159 PolarHBondContact O-N 2.84Å; P149-I160 HydrophobicContact CB-CG2 3.37Å; P149-I160 HydrophobicContact CG-CG2 3.48Å; P149-I160 VanDerWaalsContact CG-CG2 3.48Å; P149-T228 HydrophobicContact CB-CG2 4.49Å
150	Y	86.3	Confident	82.3	Confident	68 Å²	68	53 Å²	53	27%	0.267	28%	0.276	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.8	146.3	-176.9	-62.1	-82.8	0	0	0	112.4	N131 C146 P147 L157 R158	N131-Y150 HydrophobicContact CB-CD1 3.62Å; N131-Y150 HydrophobicContact CB-CD2 3.91Å; N131-Y150 HydrophobicContact CB-CE1 3.68Å; N131-Y150 HydrophobicContact CB-CE2 3.98Å; N131-Y150 HydrophobicContact CB-CG 3.72Å; N131-Y150 VanDerWaalsContact CG-CE1 3.4Å; C146-Y150 WeakPolarHBondContact CB-O 3.27Å; P147-Y150 WeakPolarHBondContact O-CB 3.46Å; P147-Y150 PolarHBondContact O-N 3.44Å; Y150-L157 CarbonylContact C-O 3.58Å; Y150-L157 VanDerWaalsContact CA-O 3.3Å; Y150-L157 WeakPolarHBondContact CA-O 3.02Å; Y150-R158 HydrophobicContact CD1-CB 4.25Å; Y150-R158 HydrophobicContact CD1-CG 4.26Å; Y150-R158 HydrophobicContact CE1-CB 4.22Å; Y150-R158 HydrophobicContact CE1-CG 4.03Å
151	V	80.5	Confident	83.1	Confident	7 Å²	7	52 Å²	52	4%	0.042	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.3	174.2	-177.8	-56.9	0	0	0	0	110.5	C155 Q156 L157 C159	V151-C155 CarbonylContact O-C 3.59Å; V151-C155 WeakPolarHBondContact O-CA 3.19Å; V151-Q156 PolarHBondContact O-N 2.97Å; V151-L157 HydrophobicContact CG2-CB 3.8Å; V151-L157 PolarHBondContact N-O 3.33Å; V151-L157 WeakPolarHBondContact O-CB 3.44Å; V151-L157 PolarHBondContact O-N 2.85Å; V151-C159 HydrophobicContact CB-CB 4.45Å; V151-C159 HydrophobicContact CG1-CB 3.74Å; V151-C159 HydrophobicContact CG2-CB 3.81Å
152	G	76.3	Confident	83.7	Confident	35 Å²	35	53.8 Å²	53.8	36%	0.361	27%	0.269	S	S	.	.	S	Bend	trans	103.6	168.8	-176.7	0	0	0	0	0	111.8	H154 C155	G152-H154 PolarHBondContact O-N 2.79Å; G152-C155 PolarHBondContact O-N 2.75Å
153	K	79.4	Confident	83.9	Confident	102 Å²	102	53.8 Å²	53.8	44%	0.443	27%	0.269	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.6	-35.1	-179.6	-175.5	171.6	-179.3	169.3	0	111.7	D141 F142 C144	D141-K153 VanDerWaalsContact OD1-CE 3.22Å; D141-K153 WeakPolarHBondContact OD1-CE 3.33Å; D141-K153 IonicContact OD1-NZ 3.98Å; D141-K153 PolarHBondContact OD1-NZ 3.2Å; D141-K153 IonicContact OD2-NZ 3.51Å; D141-K153 PolarHBondContact OD2-NZ 3.04Å; F142-K153 HydrophobicContact CE2-CG 4.12Å; F142-K153 HydrophobicContact CZ-CD 4.12Å; F142-K153 VanDerWaalsContact CZ-CE 3.48Å; F142-K153 HydrophobicContact CZ-CG 3.86Å; C144-K153 WeakPolarHBondContact CB-O 3.22Å; C144-K153 PolarHBondContact SG-O 3.07Å
154	H	80.8	Confident	83.8	Confident	65 Å²	65	47.6 Å²	47.6	30%	0.301	25%	0.245	S	C	.	.	T	Hydrogen-bonded Turn	trans	-109.5	11.9	-179	-60.4	-89.9	0	0	0	112.7	P128 E130 F142 G152 Q156	P128-H154 VanDerWaalsContact O-CB 3.3Å; P128-H154 WeakPolarHBondContact O-CB 3.39Å; P128-H154 PolarHBondContact O-ND1 3.1Å; E130-H154 WeakPolarHBondContact CB-O 3.33Å; E130-H154 PolarHBondContact N-O 2.95Å; F142-H154 AromaticContact CE2-ND1 3.85Å; F142-H154 AromaticContact CZ-CE1 3.21Å; F142-H154 WeakPolarHBondContact CZ-CE1 3.15Å; F142-H154 AromaticContact CZ-ND1 3.52Å; F142-H154 AromaticContact CZ-NE2 3.77Å; G152-H154 PolarHBondContact O-N 2.79Å; H154-Q156 HydrophobicContact CB-CB 4.49Å; H154-Q156 PolarHBondContact O-N 2.01Å; H154-Q156 VanDerWaalsContact O-N 3.14Å
155	C	85.9	Confident	83.9	Confident	0 Å²	0	46.9 Å²	46.9	0%	0	24%	0.241	C	C	.	.	S	Bend	trans	56.9	23.8	-172.5	-47.2	0	0	0	0	114.6	E130 N131 C144 C146 V151 G152	E130-C155 WeakPolarHBondContact O-CB 3.22Å; N131-C155 PolarHBondContact ND2-O 2.85Å; C144-C155 WeakPolarHBondContact CB-SG 3.37Å; C146-C155 WeakPolarHBondContact CA-SG 3.41Å; C146-C155 HydrophobicContact CB-CB 3.7Å; C146-C155 WeakPolarHBondContact CB-SG 3.38Å; C146-C155 WeakPolarHBondContact SG-CA 3.48Å; C146-C155 WeakPolarHBondContact SG-CB 3.32Å; C146-C155 CovalentContact SG-SG 2.03Å; C146-C155 PolarHBondContact SG-SG 2.03Å; V151-C155 CarbonylContact O-C 3.59Å; V151-C155 WeakPolarHBondContact O-CA 3.19Å; G152-C155 PolarHBondContact O-N 2.75Å
156	Q	80.6	Confident	83.9	Confident	79 Å²	79	45.7 Å²	45.7	37%	0.369	24%	0.236	S	C	.	.			trans	-78.8	-22	-176.2	74.2	-80.4	28	0	0	113	E130 V151 H154	E130-Q156 WeakPolarHBondContact OE2-CB 3.48Å; V151-Q156 PolarHBondContact O-N 2.97Å; H154-Q156 HydrophobicContact CB-CB 4.49Å; H154-Q156 PolarHBondContact O-N 2.01Å; H154-Q156 VanDerWaalsContact O-N 3.14Å
157	L	74.5	Confident	83.2	Confident	50 Å²	50	45.5 Å²	45.5	26%	0.262	24%	0.238	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.6	139.4	-176.2	-57.7	175.2	0	0	0	110.7	Y150 V151	Y150-L157 CarbonylContact C-O 3.58Å; Y150-L157 VanDerWaalsContact CA-O 3.3Å; Y150-L157 WeakPolarHBondContact CA-O 3.02Å; V151-L157 HydrophobicContact CG2-CB 3.8Å; V151-L157 PolarHBondContact N-O 3.33Å; V151-L157 WeakPolarHBondContact O-CB 3.44Å; V151-L157 PolarHBondContact O-N 2.85Å
158	R	81.9	Confident	82.7	Confident	138 Å²	138	44.9 Å²	44.9	52%	0.521	24%	0.239	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	104.2	-180	-164.2	-171.6	176.9	-163	-1.2	110.6	P149 Y150 I160	P149-R158 HydrophobicContact CG-CG 4.18Å; Y150-R158 HydrophobicContact CD1-CB 4.25Å; Y150-R158 HydrophobicContact CD1-CG 4.26Å; Y150-R158 HydrophobicContact CE1-CB 4.22Å; Y150-R158 HydrophobicContact CE1-CG 4.03Å; R158-I160 HydrophobicContact CG-CD1 4.45Å; R158-I160 HydrophobicContact CG-CG1 4.01Å; R158-I160 HydrophobicContact CG-CG2 4.14Å; R158-I160 PolarHBondContact O-N 2.77Å
159	C	85	Confident	82.4	Confident	0 Å²	0	45.7 Å²	45.7	0%	0	25%	0.25	C	S	.	.			trans	-83.7	76.2	-176.5	-177.9	0	0	0	0	111.1	P149 V151 T228 C315	P149-C159 WeakPolarHBondContact O-CB 3.37Å; P149-C159 PolarHBondContact O-N 2.84Å; V151-C159 HydrophobicContact CB-CB 4.45Å; V151-C159 HydrophobicContact CG1-CB 3.74Å; V151-C159 HydrophobicContact CG2-CB 3.81Å; C159-T228 HydrophobicContact CB-CG2 3.83Å; C159-T228 VanDerWaalsContact O-CB 3.32Å; C159-T228 WeakPolarHBondContact O-CB 3.46Å; C159-T228 VanDerWaalsContact O-CG2 3.24Å; C159-T228 WeakPolarHBondContact O-CG2 3.35Å; C159-T228 PolarHBondContact O-OG1 3.03Å; C159-T228 WeakPolarHBondContact SG-CG2 3.46Å; C159-C315 HydrophobicContact CB-CB 3.96Å; C159-C315 WeakPolarHBondContact CB-SG 3.21Å; C159-C315 WeakPolarHBondContact SG-CB 3.33Å; C159-C315 PolarHBondContact SG-N 2.68Å; C159-C315 CovalentContact SG-SG 2.02Å; C159-C315 PolarHBondContact SG-SG 2.71Å
160	I	85.4	Confident	82.4	Confident	58 Å²	58	45.1 Å²	45.1	30%	0.297	25%	0.246	S	C	.	.			trans	-131.9	21.9	-178.8	60.6	153.2	0	0	0	114	P149 R158 V313	P149-I160 HydrophobicContact CB-CG2 3.37Å; P149-I160 HydrophobicContact CG-CG2 3.48Å; P149-I160 VanDerWaalsContact CG-CG2 3.48Å; R158-I160 HydrophobicContact CG-CD1 4.45Å; R158-I160 HydrophobicContact CG-CG1 4.01Å; R158-I160 HydrophobicContact CG-CG2 4.14Å; R158-I160 PolarHBondContact O-N 2.77Å; I160-V313 HydrophobicContact CB-CG1 4.04Å; I160-V313 WeakPolarHBondContact O-CG1 3.4Å
161	S	84	Confident	82.4	Confident	36 Å²	36	44 Å²	44	25%	0.252	25%	0.251	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.8	142.1	-179.8	-43.5	0	0	0	0	110.7	V313 G314	S161-V313 WeakPolarHBondContact O-CA 3.34Å; S161-G314 WeakPolarHBondContact CB-O 3.34Å; S161-G314 PolarHBondContact N-O 2.92Å; S161-G314 VanDerWaalsContact N-O 3.16Å; S161-G314 PolarHBondContact O-N 3.04Å
162	L	87.1	Confident	82.8	Confident	104 Å²	104	49.4 Å²	49.4	55%	0.545	28%	0.276	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.5	128	171.5	-51.8	-179	0	0	0	108.5	G164 E311 V313	L162-G164 VanDerWaalsContact C-N 3.34Å; L162-E311 HydrophobicContact CB-CG 3.93Å; L162-E311 HydrophobicContact CD1-CG 4.41Å; L162-E311 HydrophobicContact CD2-CG 3.79Å; L162-E311 HydrophobicContact CG-CG 4.23Å; L162-V313 HydrophobicContact CD2-CG2 4.13Å
163	L	88.1	Confident	83.4	Confident	22 Å²	22	52.8 Å²	52.8	12%	0.115	29%	0.294	C	S	.	.			trans	-83.9	-10.4	-171.5	-62.7	-175.3	0	0	0	113.6	I170 M221 M225 F227 L312	L163-I170 HydrophobicContact CB-CD1 4.31Å; L163-M221 HydrophobicContact CB-CE 4.07Å; L163-M221 HydrophobicContact CD1-CE 4.14Å; L163-M225 HydrophobicContact CD1-CE 4.4Å; L163-M225 HydrophobicContact CD2-CE 3.72Å; L163-F227 HydrophobicContact CD1-CD1 3.65Å; L163-F227 HydrophobicContact CD1-CE1 3.65Å; L163-L312 HydrophobicContact CB-CB 4.14Å; L163-L312 HydrophobicContact CD1-CB 4.03Å; L163-L312 HydrophobicContact CG-CB 4.36Å; L163-L312 PolarHBondContact N-O 2.84Å
164	G	85.1	Confident	84.1	Confident	10 Å²	10	49 Å²	49	10%	0.103	28%	0.278	C	S	.	.	S	Bend	trans	113.9	29.3	162.9	0	0	0	0	0	115	L162 G168 G169 I170 E311	L162-G164 VanDerWaalsContact C-N 3.34Å; G164-G168 CarbonylContact O-C 3.49Å; G164-G168 PolarHBondContact O-N 3.09Å; G164-G169 PolarHBondContact O-N 2.86Å; G164-I170 PolarHBondContact O-N 3.44Å; G164-E311 PolarHBondContact N-OE1 2.8Å; G164-E311 VanDerWaalsContact N-OE1 3.1Å
165	M	89.9	Confident	84.9	Confident	0 Å²	0	46.2 Å²	46.2	0%	0	27%	0.265	C	S	.	.	S	Bend	trans	-65.5	-49.2	168	-64.1	-69.5	-67.9	0	0	110.7	I170 I175 R196 I219 M310 E311 L312	M165-I170 HydrophobicContact CG-CD1 3.89Å; M165-I170 HydrophobicContact SD-CB 4.2Å; M165-I170 HydrophobicContact SD-CD1 3.67Å; M165-I170 HydrophobicContact SD-CG2 4.04Å; M165-I175 HydrophobicContact CE-CD1 3.75Å; M165-I175 HydrophobicContact CE-CG1 4.41Å; M165-I175 HydrophobicContact SD-CD1 4.1Å; M165-R196 WeakPolarHBondContact O-CB 3.24Å; M165-R196 WeakPolarHBondContact O-CD 3.3Å; M165-R196 WeakPolarHBondContact O-CG 3.41Å; M165-R196 PolarHBondContact O-NH1 2.88Å; M165-I219 HydrophobicContact CE-CG1 4.49Å; M165-I219 HydrophobicContact SD-CG1 4.16Å; M165-M310 VanDerWaalsContact CB-O 3.23Å; M165-M310 WeakPolarHBondContact CB-O 3.45Å; M165-M310 HydrophobicContact CE-CE 3.64Å; M165-M310 HydrophobicContact CE-CG 4.05Å; M165-E311 WeakPolarHBondContact CB-OE1 3.3Å; M165-E311 PolarHBondContact N-OE1 3.08Å; M165-E311 PolarHBondContact N-OE2 3.33Å; M165-L312 HydrophobicContact CG-CG 4.45Å
166	E	87.2	Confident	85.4	Confident	86 Å²	86	49.1 Å²	49.1	40%	0.402	28%	0.283	S	S	.	.	S	Bend	trans	-72.1	-48.5	176.8	-178.5	177.7	-173.6	0	0	111.4	G168 L197 H198 E311	E166-G168 PolarHBondContact O-N 2.88Å; E166-G168 VanDerWaalsContact O-N 3.16Å; E166-L197 HydrophobicContact CB-CB 4.16Å; E166-H198 IonicContact OE1-CD2 3.44Å; E166-H198 PolarHBondContact OE1-CD2 3.29Å; E166-H198 IonicContact OE1-CG 3.33Å; E166-H198 IonicContact OE2-CD2 2.84Å; E166-E311 WeakPolarHBondContact CB-OE2 3.4Å; E166-E311 PolarHBondContact N-OE2 3.4Å
167	G	73.4	Confident	86.2	Confident	20 Å²	20	46.5 Å²	46.5	21%	0.206	28%	0.275	C	S	.	.	S	Bend	trans	-74.6	-0.2	-173.9	0	0	0	0	0	115.8	G169 V442 H443	G167-G169 VanDerWaalsContact C-N 3.25Å; G167-G169 PolarHBondContact O-N 2.85Å; G167-V442 WeakPolarHBondContact O-CG1 3.45Å; G167-H443 WeakPolarHBondContact O-CB 3.22Å; G167-H443 PolarHBondContact O-N 2.95Å; G167-H443 VanDerWaalsContact O-N 3.09Å
168	G	76.8	Confident	87.3	Confident	29 Å²	29	46.1 Å²	46.1	30%	0.299	28%	0.276	S	S	.	.	S	Bend	trans	75.2	7.2	-178.7	0	0	0	0	0	115.3	G164 E166 I170	G164-G168 CarbonylContact O-C 3.49Å; G164-G168 PolarHBondContact O-N 3.09Å; E166-G168 PolarHBondContact O-N 2.88Å; E166-G168 VanDerWaalsContact O-N 3.16Å; G168-I170 PolarHBondContact O-N 3.19Å
169	G	76.4	Confident	88	Confident	37 Å²	37	40.4 Å²	40.4	38%	0.381	26%	0.258	S	S	.	.			trans	-63.7	-27.5	173.6	0	0	0	0	0	113.3	G164 G167	G164-G169 PolarHBondContact O-N 2.86Å; G167-G169 VanDerWaalsContact C-N 3.25Å; G167-G169 PolarHBondContact O-N 2.85Å
170	I	86.3	Confident	88.5	Confident	1 Å²	1	42.6 Å²	42.6	1%	0.005	27%	0.269	C	S	.	.	S	Bend	trans	-98.7	115.3	171	-61.2	172.7	0	0	0	108.1	L163 G164 M165 G168 Q174 I175 R196 I219 M221 L312	L163-I170 HydrophobicContact CB-CD1 4.31Å; G164-I170 PolarHBondContact O-N 3.44Å; M165-I170 HydrophobicContact CG-CD1 3.89Å; M165-I170 HydrophobicContact SD-CB 4.2Å; M165-I170 HydrophobicContact SD-CD1 3.67Å; M165-I170 HydrophobicContact SD-CG2 4.04Å; G168-I170 PolarHBondContact O-N 3.19Å; I170-Q174 HydrophobicContact CG2-CB 3.85Å; I170-I175 HydrophobicContact CG2-CD1 4.31Å; I170-I175 HydrophobicContact CG2-CG1 4.01Å; I170-R196 PolarHBondContact O-NH1 2.97Å; I170-R196 PolarHBondContact O-NH2 2.76Å; I170-I219 HydrophobicContact CD1-CG2 4.17Å; I170-I219 HydrophobicContact CG2-CG2 3.93Å; I170-M221 HydrophobicContact CD1-CE 4.07Å; I170-M221 HydrophobicContact CD1-SD 3.83Å; I170-M221 HydrophobicContact CG1-CE 4.3Å; I170-M221 HydrophobicContact CG1-SD 4.36Å; I170-L312 HydrophobicContact CD1-CD1 4.45Å
171	A	85.6	Confident	88.9	Confident	44 Å²	44	41.4 Å²	41.4	36%	0.364	26%	0.261	S	S	.	.			trans	-69.9	154.4	179.2	0	0	0	0	0	111.6	S173 Q174	A171-S173 PolarHBondContact O-N 2.82Å; A171-Q174 HydrophobicContact CB-CG 4.31Å; A171-Q174 VanDerWaalsContact O-CB 3.3Å; A171-Q174 WeakPolarHBondContact O-CB 3.24Å; A171-Q174 PolarHBondContact O-N 3.31Å
172	E	89.4	Confident	89.2	Confident	122 Å²	122	45.8 Å²	45.8	57%	0.57	27%	0.273	S	S	*	.	G	3₁₀ helix	trans	-60.8	-34.5	-179.2	-61.5	178.2	175	0	0	112.5	Q174 I175 E193	E172-Q174 PolarHBondContact O-N 3.14Å; E172-Q174 VanDerWaalsContact O-N 3.15Å; E172-I175 PolarHBondContact O-N 3.41Å; E172-I175 VanDerWaalsContact O-N 3.1Å; E172-E193 HydrophobicContact CB-CB 4.22Å; E172-E193 HydrophobicContact CG-CB 3.84Å
173	S	89.3	Confident	89.1	Confident	105 Å²	105	41.6 Å²	41.6	73%	0.734	25%	0.251	S	S	*	.	G	3₁₀ helix	trans	-62.9	-17.7	175.9	56.8	0	0	0	0	113.9	A171	A171-S173 PolarHBondContact O-N 2.82Å
174	Q	94.2	Very high	89	Confident	24 Å²	24	45.7 Å²	45.7	11%	0.112	27%	0.271	C	S	.	.	G	3₁₀ helix	trans	-84.7	-11.4	178.3	-62.9	179.8	-98.4	0	0	113	I170 A171 E172 I219 N220 H222	I170-Q174 HydrophobicContact CG2-CB 3.85Å; A171-Q174 HydrophobicContact CB-CG 4.31Å; A171-Q174 VanDerWaalsContact O-CB 3.3Å; A171-Q174 WeakPolarHBondContact O-CB 3.24Å; A171-Q174 PolarHBondContact O-N 3.31Å; E172-Q174 PolarHBondContact O-N 3.14Å; E172-Q174 VanDerWaalsContact O-N 3.15Å; Q174-I219 WeakPolarHBondContact O-CA 3.02Å; Q174-N220 WeakPolarHBondContact CB-O 3.15Å; Q174-N220 PolarHBondContact NE2-O 3.37Å; Q174-N220 PolarHBondContact O-N 2.61Å; Q174-H222 WeakPolarHBondContact CG-NE2 3.49Å; Q174-H222 PolarHBondContact NE2-CD2 3.43Å
175	I	96.3	Very high	88.9	Confident	5 Å²	5	54.2 Å²	54.2	3%	0.026	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	118.3	-171.9	-46.1	170.2	0	0	0	109.4	M165 I170 E172 T192 I217 Q218	M165-I175 HydrophobicContact CE-CD1 3.75Å; M165-I175 HydrophobicContact CE-CG1 4.41Å; M165-I175 HydrophobicContact SD-CD1 4.1Å; I170-I175 HydrophobicContact CG2-CD1 4.31Å; I170-I175 HydrophobicContact CG2-CG1 4.01Å; E172-I175 PolarHBondContact O-N 3.41Å; E172-I175 VanDerWaalsContact O-N 3.1Å; I175-T192 HydrophobicContact CG2-CG2 4.4Å; I175-T192 PolarHBondContact O-OG1 2.91Å; I175-I217 HydrophobicContact CG2-CD1 3.96Å; I175-I217 HydrophobicContact CG2-CG1 4.04Å; I175-Q218 WeakPolarHBondContact CA-O 3.04Å
176	T	96.9	Very high	88.6	Confident	61 Å²	61	56.2 Å²	56.2	37%	0.374	33%	0.334	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	159.2	178.8	60.2	0	0	0	0	110.9	I217 Q218	T176-I217 CarbonylContact O-C 3.58Å; T176-I217 WeakPolarHBondContact O-CA 3.23Å; T176-Q218 PolarHBondContact N-O 3.21Å; T176-Q218 PolarHBondContact O-N 2.02Å
177	A	97.4	Very high	88.5	Confident	25 Å²	25	59.6 Å²	59.6	21%	0.207	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.1	163.8	176.3	0	0	0	0	0	111.2	S179 T192 W206 W216 I217	A177-S179 VanDerWaalsContact C-N 3.33Å; A177-T192 HydrophobicContact CB-CG2 3.3Å; A177-W206 HydrophobicContact CB-CZ2 3.96Å; A177-W216 CarbonylContact C-O 3.56Å; A177-W216 WeakPolarHBondContact CA-O 3.39Å; A177-W216 VanDerWaalsContact CB-O 3.29Å; A177-W216 WeakPolarHBondContact CB-O 3.38Å; A177-I217 HydrophobicContact CB-CB 4.45Å; A177-I217 HydrophobicContact CB-CG1 4.46Å
178	S	96.9	Very high	89.2	Confident	41 Å²	41	60.5 Å²	60.5	29%	0.287	35%	0.353	S	S	.	.	S	Bend	trans	-63.2	-39.9	172.7	56.7	0	0	0	0	112.7	D212 P215 W216	S178-D212 VanDerWaalsContact CB-OD2 3.24Å; S178-D212 WeakPolarHBondContact CB-OD2 3.42Å; S178-D212 PolarHBondContact OG-OD2 2.83Å; S178-P215 VanDerWaalsContact OG-CA 3.28Å; S178-P215 WeakPolarHBondContact OG-CA 3.49Å; S178-W216 PolarHBondContact N-O 2.8Å; S178-W216 PolarHBondContact OG-N 2.84Å; S178-W216 PolarHBondContact OG-O 3.04Å
179	S	96.6	Very high	90	Very high	19 Å²	19	64.5 Å²	64.5	13%	0.133	36%	0.359	C	S	.	.			trans	-158.2	161.7	-175.9	67.9	0	0	0	0	111	A177 W206 A209 D212	A177-S179 VanDerWaalsContact C-N 3.33Å; S179-W206 PolarHBondContact O-NE1 2.84Å; S179-A209 PolarHBondContact OG-N 3.33Å; S179-D212 WeakPolarHBondContact CB-OD2 3.28Å; S179-D212 VanDerWaalsContact OG-CB 3.25Å; S179-D212 WeakPolarHBondContact OG-CB 3.04Å; S179-D212 PolarHBondContact OG-OD2 3.49Å
180	I	95.8	Very high	90.8	Very high	45 Å²	45	62.7 Å²	62.7	23%	0.231	34%	0.341	C	S	.	.			trans	-131.9	145.4	176.5	56.2	171.9	0	0	0	109.5	Y182 R189	I180-Y182 HydrophobicContact CD1-CE2 3.71Å; I180-Y182 VanDerWaalsContact CD1-OH 3.28Å; I180-Y182 WeakPolarHBondContact CD1-OH 3.28Å; I180-Y182 HydrophobicContact CG1-CE2 3.8Å; I180-R189 HydrophobicContact CD1-CG 4.39Å
181	R	93.3	Very high	91.2	Very high	34 Å²	34	62.7 Å²	62.7	13%	0.128	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.1	134.3	179	-176.6	177.3	-83.3	-136.4	-2.5	111.4	T183 W190 S207 A208	R181-T183 HydrophobicContact CG-CG2 4.05Å; R181-W190 HydrophobicContact CB-CB 4.34Å; R181-W190 PolarHBondContact O-N 3.13Å; R181-S207 VanDerWaalsContact CB-O 3.31Å; R181-S207 WeakPolarHBondContact CB-O 3.21Å; R181-S207 WeakPolarHBondContact CD-OG 3.31Å; R181-S207 PolarHBondContact N-O 2.92Å; R181-A208 PolarHBondContact NE-O 2.79Å
182	Y	91.6	Very high	91.6	Very high	128 Å²	128	61.4 Å²	61.4	50%	0.502	33%	0.328	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	135.5	166.4	-67.2	-90.1	0	0	0	109.9	I180 Q188 R189	I180-Y182 HydrophobicContact CD1-CE2 3.71Å; I180-Y182 VanDerWaalsContact CD1-OH 3.28Å; I180-Y182 WeakPolarHBondContact CD1-OH 3.28Å; I180-Y182 HydrophobicContact CG1-CE2 3.8Å; Y182-Q188 CarbonylContact C-O 3.52Å; Y182-Q188 WeakPolarHBondContact CA-O 3.44Å; Y182-R189 HydrophobicContact CD1-CB 4.04Å; Y182-R189 HydrophobicContact CD1-CG 4.18Å; Y182-R189 HydrophobicContact CE1-CB 3.82Å; Y182-R189 HydrophobicContact CE1-CG 3.58Å; Y182-R189 PolarHBondContact OH-NE 2.91Å
183	T	85.2	Confident	91.8	Very high	15 Å²	15	57.4 Å²	57.4	9%	0.092	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	168.9	174.8	53.2	0	0	0	0	110.6	R181 L185 G186 L187 Q188 W190	R181-T183 HydrophobicContact CG-CG2 4.05Å; T183-L185 PolarHBondContact O-N 2.87Å; T183-G186 PolarHBondContact O-N 2.78Å; T183-G186 VanDerWaalsContact O-N 3.15Å; T183-L187 PolarHBondContact O-N 2.88Å; T183-Q188 PolarHBondContact N-O 2.74Å; T183-Q188 PolarHBondContact O-N 2.77Å; T183-Q188 WeakPolarHBondContact OG1-CB 3.32Å; T183-Q188 PolarHBondContact OG1-OE1 2.87Å; T183-W190 PolarHBondContact OG1-NE1 2.86Å; T183-W190 VanDerWaalsContact OG1-NE1 3.12Å
184	M	84.5	Confident	92	Very high	108 Å²	108	54.1 Å²	54.1	53%	0.532	28%	0.284	S	S	.	.	G	3₁₀ helix	trans	49.8	60.2	-178.4	-68.4	-58.2	-150.1	0	0	113.5	G186 L187 Q188 I238	M184-G186 PolarHBondContact O-N 3.41Å; M184-L187 HydrophobicContact CB-CB 4.32Å; M184-L187 WeakPolarHBondContact O-CB 3.08Å; M184-L187 WeakPolarHBondContact O-CG 3.46Å; M184-L187 PolarHBondContact O-N 2.86Å; M184-Q188 HydrophobicContact CB-CG 4.26Å; M184-Q188 HydrophobicContact CG-CG 4.33Å; M184-I238 HydrophobicContact CE-CD1 3.97Å
185	L	84.3	Confident	92.1	Very high	190 Å²	190	53 Å²	53	100%	0.995	28%	0.278	S	S	*	.	G	3₁₀ helix	trans	54.1	27.3	179.6	-59	170.7	0	0	0	114	T183	T183-L185 PolarHBondContact O-N 2.87Å
186	G	82.6	Confident	92.1	Very high	42 Å²	42	54.3 Å²	54.3	43%	0.433	28%	0.283	S	S	.	.	G	3₁₀ helix	trans	97.1	-7.1	179.4	0	0	0	0	0	115	T183 M184 Q188	T183-G186 PolarHBondContact O-N 2.78Å; T183-G186 VanDerWaalsContact O-N 3.15Å; M184-G186 PolarHBondContact O-N 3.41Å; G186-Q188 VanDerWaalsContact C-N 3.3Å; G186-Q188 PolarHBondContact O-N 3.17Å
187	L	84.9	Confident	91.9	Very high	157 Å²	157	52 Å²	52	82%	0.822	27%	0.268	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.2	-26	-179.2	-66.3	170.2	0	0	0	113.4	T183 M184	T183-L187 PolarHBondContact O-N 2.88Å; M184-L187 HydrophobicContact CB-CB 4.32Å; M184-L187 WeakPolarHBondContact O-CB 3.08Å; M184-L187 WeakPolarHBondContact O-CG 3.46Å; M184-L187 PolarHBondContact O-N 2.86Å
188	Q	88.8	Confident	91.7	Very high	39 Å²	39	54.8 Å²	54.8	18%	0.182	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	111.3	-179.6	-73.4	178.2	-11	0	0	110.1	Y182 T183 M184 G186 V203	Y182-Q188 CarbonylContact C-O 3.52Å; Y182-Q188 WeakPolarHBondContact CA-O 3.44Å; T183-Q188 PolarHBondContact N-O 2.74Å; T183-Q188 PolarHBondContact O-N 2.77Å; T183-Q188 WeakPolarHBondContact OG1-CB 3.32Å; T183-Q188 PolarHBondContact OG1-OE1 2.87Å; M184-Q188 HydrophobicContact CB-CG 4.26Å; M184-Q188 HydrophobicContact CG-CG 4.33Å; G186-Q188 VanDerWaalsContact C-N 3.3Å; G186-Q188 PolarHBondContact O-N 3.17Å; Q188-V203 HydrophobicContact CB-CG2 3.87Å; Q188-V203 HydrophobicContact CG-CG2 3.79Å
189	R	93.3	Very high	91.5	Very high	112 Å²	112	55 Å²	55	42%	0.423	28%	0.275	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	114.6	-180	-179.9	176.7	173.4	-105.1	-3.2	110.5	I180 Y182 G191 E193 V203	I180-R189 HydrophobicContact CD1-CG 4.39Å; Y182-R189 HydrophobicContact CD1-CB 4.04Å; Y182-R189 HydrophobicContact CD1-CG 4.18Å; Y182-R189 HydrophobicContact CE1-CB 3.82Å; Y182-R189 HydrophobicContact CE1-CG 3.58Å; Y182-R189 PolarHBondContact OH-NE 2.91Å; R189-G191 VanDerWaalsContact C-N 3.32Å; R189-G191 PolarHBondContact O-N 3.41Å; R189-E193 IonicContact CZ-OE1 3.88Å; R189-E193 IonicContact NH1-OE1 3.95Å; R189-E193 PolarHBondContact NH1-OE1 3.04Å; R189-E193 IonicContact NH1-OE2 3.59Å; R189-V203 WeakPolarHBondContact O-CG1 3.43Å
190	W	94.1	Very high	91.1	Very high	0 Å²	0	61.4 Å²	61.4	0%	0	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.2	68.6	178.5	-64.8	72.9	0	0	0	110.3	R181 T183 V203 A205 S207 A235 R237 T307	R181-W190 HydrophobicContact CB-CB 4.34Å; R181-W190 PolarHBondContact O-N 3.13Å; T183-W190 PolarHBondContact OG1-NE1 2.86Å; T183-W190 VanDerWaalsContact OG1-NE1 3.12Å; W190-V203 HydrophobicContact CB-CG1 4.43Å; W190-V203 HydrophobicContact CD2-CG1 3.65Å; W190-V203 HydrophobicContact CE3-CG1 4.08Å; W190-V203 HydrophobicContact CG-CG1 3.82Å; W190-V203 HydrophobicContact CZ2-CG1 4.25Å; W190-V203 HydrophobicContact CZ2-CG2 4.39Å; W190-A205 HydrophobicContact CE3-CB 4.15Å; W190-A205 VanDerWaalsContact CE3-O 3.3Å; W190-A205 HydrophobicContact CZ3-CB 4.03Å; W190-S207 PolarHBondContact O-N 3.32Å; W190-A235 HydrophobicContact CZ3-CB 4.03Å; W190-R237 HydrophobicContact CH2-CB 4.25Å; W190-R237 HydrophobicContact CZ2-CB 4.12Å; W190-R237 HydrophobicContact CZ2-CG 3.99Å; W190-T307 HydrophobicContact CE3-CG2 4.16Å; W190-T307 HydrophobicContact CZ3-CG2 4.03Å
191	G	93.9	Very high	90.8	Very high	0 Å²	0	61.8 Å²	61.8	0%	0	32%	0.315	C	S	.	.			trans	-74.7	169.1	-173.9	0	0	0	0	0	114.8	R189 E193 L194 W206	R189-G191 VanDerWaalsContact C-N 3.32Å; R189-G191 PolarHBondContact O-N 3.41Å; G191-E193 VanDerWaalsContact C-N 3.32Å; G191-E193 VanDerWaalsContact C-OE2 3.26Å; G191-E193 VanDerWaalsContact CA-OE2 3.29Å; G191-E193 WeakPolarHBondContact CA-OE2 3.49Å; G191-L194 PolarHBondContact O-N 2.89Å; G191-W206 WeakPolarHBondContact O-CA 3.42Å; G191-W206 WeakPolarHBondContact O-CB 3.28Å
192	T	95.4	Very high	90.5	Very high	18 Å²	18	67.5 Å²	67.5	11%	0.11	35%	0.347	C	S	.	.	G	3₁₀ helix	trans	-68.9	-31.1	179.3	42.9	0	0	0	0	112.8	I175 A177 L194 A195 I217	I175-T192 HydrophobicContact CG2-CG2 4.4Å; I175-T192 PolarHBondContact O-OG1 2.91Å; A177-T192 HydrophobicContact CB-CG2 3.3Å; T192-L194 PolarHBondContact O-N 2.88Å; T192-L194 VanDerWaalsContact O-N 3.15Å; T192-A195 VanDerWaalsContact O-CB 3.26Å; T192-A195 WeakPolarHBondContact O-CB 3.36Å; T192-A195 PolarHBondContact O-N 2.86Å; T192-A195 VanDerWaalsContact O-N 3.08Å; T192-I217 HydrophobicContact CG2-CD1 4.26Å; T192-I217 HydrophobicContact CG2-CG1 4.43Å
193	E	91.9	Very high	90.5	Very high	37 Å²	37	62.9 Å²	62.9	17%	0.173	33%	0.333	C	S	.	.	G	3₁₀ helix	trans	-58.4	-25.5	177.2	66	-80.1	-169.3	0	0	113	E172 R189 G191 R196	E172-E193 HydrophobicContact CB-CB 4.22Å; E172-E193 HydrophobicContact CG-CB 3.84Å; R189-E193 IonicContact CZ-OE1 3.88Å; R189-E193 IonicContact NH1-OE1 3.95Å; R189-E193 PolarHBondContact NH1-OE1 3.04Å; R189-E193 IonicContact NH1-OE2 3.59Å; G191-E193 VanDerWaalsContact C-N 3.32Å; G191-E193 VanDerWaalsContact C-OE2 3.26Å; G191-E193 VanDerWaalsContact CA-OE2 3.29Å; G191-E193 WeakPolarHBondContact CA-OE2 3.49Å; E193-R196 PolarHBondContact O-NE 2.03Å
194	L	94.8	Very high	90.9	Very high	37 Å²	37	62.8 Å²	62.8	19%	0.194	33%	0.332	C	S	.	.	G	3₁₀ helix	trans	-88.2	-6.2	-178.8	-57.2	178.9	0	0	0	113.5	G191 T192 R196 N199 V203 N204 A205	G191-L194 PolarHBondContact O-N 2.89Å; T192-L194 PolarHBondContact O-N 2.88Å; T192-L194 VanDerWaalsContact O-N 3.15Å; L194-R196 PolarHBondContact O-N 3.47Å; L194-N199 PolarHBondContact O-ND2 2.77Å; L194-V203 HydrophobicContact CD1-CB 4.38Å; L194-V203 HydrophobicContact CD1-CG1 3.64Å; L194-N204 CarbonylContact O-C 3.53Å; L194-N204 VanDerWaalsContact O-O 3.07Å; L194-A205 WeakPolarHBondContact O-CA 3.49Å
195	A	96.4	Very high	91.4	Very high	0 Å²	0	57.7 Å²	57.7	0%	0	31%	0.306	C	S	.	.			trans	-72	32.2	-177.1	0	0	0	0	0	114.1	T192 W206 I217 M310	T192-A195 VanDerWaalsContact O-CB 3.26Å; T192-A195 WeakPolarHBondContact O-CB 3.36Å; T192-A195 PolarHBondContact O-N 2.86Å; T192-A195 VanDerWaalsContact O-N 3.08Å; A195-W206 HydrophobicContact CB-CB 3.71Å; A195-I217 HydrophobicContact CB-CD1 3.56Å; A195-M310 PolarHBondContact O-N 2.91Å
196	R	95.4	Very high	92.1	Very high	32 Å²	32	48.6 Å²	48.6	12%	0.121	26%	0.259	C	S	.	.	B	Isolated β-bridge	trans	-99.8	139.1	-175.4	-57.1	-178.5	-179.5	-90.7	2.3	109.8	M165 I170 E193 L194 N199 R309	M165-R196 WeakPolarHBondContact O-CB 3.24Å; M165-R196 WeakPolarHBondContact O-CD 3.3Å; M165-R196 WeakPolarHBondContact O-CG 3.41Å; M165-R196 PolarHBondContact O-NH1 2.88Å; I170-R196 PolarHBondContact O-NH1 2.97Å; I170-R196 PolarHBondContact O-NH2 2.76Å; E193-R196 PolarHBondContact O-NE 2.03Å; L194-R196 PolarHBondContact O-N 3.47Å; R196-N199 HydrophobicContact CB-CB 4.5Å; R196-N199 VanDerWaalsContact O-CB 3.32Å; R196-N199 WeakPolarHBondContact O-CB 3.04Å; R196-N199 PolarHBondContact O-N 3.07Å; R196-R309 WeakPolarHBondContact O-CB 3.15Å; R196-R309 WeakPolarHBondContact O-CD 3.29Å; R196-R309 WeakPolarHBondContact O-CG 3.42Å
197	L	93.4	Very high	92.7	Very high	14 Å²	14	46.6 Å²	46.6	7%	0.073	24%	0.238	C	C	.	.	T	Hydrogen-bonded Turn	trans	-57.1	147	178.8	-156.8	71.2	0	0	0	111	E166 N199 V231 Q233 T281 M310 E311	E166-L197 HydrophobicContact CB-CB 4.16Å; L197-N199 PolarHBondContact O-N 2.89Å; L197-V231 HydrophobicContact CD1-CG1 4Å; L197-V231 HydrophobicContact CD2-CG1 4.01Å; L197-Q233 HydrophobicContact CD1-CB 3.75Å; L197-T281 HydrophobicContact CD1-CG2 4.02Å; L197-T281 HydrophobicContact CD2-CG2 4.47Å; L197-T281 HydrophobicContact CG-CG2 4.48Å; L197-M310 PolarHBondContact N-O 2.95Å; L197-E311 HydrophobicContact CB-CB 4.17Å; L197-E311 HydrophobicContact CD2-CB 4.16Å
198	H	92.3	Very high	93.3	Very high	83 Å²	83	39.3 Å²	39.3	38%	0.384	20%	0.201	S	C	.	.	T	Hydrogen-bonded Turn	trans	58.7	5.9	177.3	-60	-60.5	0	0	0	116.9	E166 K200	E166-H198 IonicContact OE1-CD2 3.44Å; E166-H198 PolarHBondContact OE1-CD2 3.29Å; E166-H198 IonicContact OE1-CG 3.33Å; E166-H198 IonicContact OE2-CD2 2.84Å; H198-K200 WeakPolarHBondContact O-CG 3.06Å; H198-K200 PolarHBondContact O-N 3.37Å
199	N	92.1	Very high	93.6	Very high	46 Å²	46	37.8 Å²	37.8	25%	0.246	20%	0.195	C	C	.	.			trans	-57	137.1	177.1	-167.5	17.3	0	0	0	111.2	L194 R196 L197 N204 R309	L194-N199 PolarHBondContact O-ND2 2.77Å; R196-N199 HydrophobicContact CB-CB 4.5Å; R196-N199 VanDerWaalsContact O-CB 3.32Å; R196-N199 WeakPolarHBondContact O-CB 3.04Å; R196-N199 PolarHBondContact O-N 3.07Å; L197-N199 PolarHBondContact O-N 2.89Å; N199-N204 HydrophobicContact CB-CB 4.49Å; N199-N204 PolarHBondContact ND2-O 3.31Å; N199-N204 PolarHBondContact O-ND2 2.84Å; N199-R309 PolarHBondContact O-NH1 2.98Å
200	K	89.9	Confident	93.5	Very high	152 Å²	152	37.2 Å²	37.2	66%	0.661	21%	0.205	S	C	*	.			trans	-118.9	148.3	-173.2	-60.8	-61.2	-178.8	175.1	0	110.3	H198	H198-K200 WeakPolarHBondContact O-CG 3.06Å; H198-K200 PolarHBondContact O-N 3.37Å
201	G	88.1	Confident	93.4	Very high	53 Å²	53	44.6 Å²	44.6	55%	0.546	24%	0.24	S	C	.	.	S	Bend	trans	144.1	175.4	179.4	0	0	0	0	0	111.8	V203	G201-V203 VanDerWaalsContact C-N 3.26Å
202	L	86.8	Confident	93.5	Very high	154 Å²	154	46.4 Å²	46.4	81%	0.806	25%	0.249	S	C	*	.	S	Bend	trans	-65.7	-32.3	172.8	-74	164.5	0	0	0	112.1
203	V	91.7	Very high	93.3	Very high	32 Å²	32	54.6 Å²	54.6	19%	0.194	28%	0.284	C	S	.	.	S	Bend	trans	-129.1	115.4	172.8	-173.2	0	0	0	0	106.3	Q188 R189 W190 L194 G201	Q188-V203 HydrophobicContact CB-CG2 3.87Å; Q188-V203 HydrophobicContact CG-CG2 3.79Å; R189-V203 WeakPolarHBondContact O-CG1 3.43Å; W190-V203 HydrophobicContact CB-CG1 4.43Å; W190-V203 HydrophobicContact CD2-CG1 3.65Å; W190-V203 HydrophobicContact CE3-CG1 4.08Å; W190-V203 HydrophobicContact CG-CG1 3.82Å; W190-V203 HydrophobicContact CZ2-CG1 4.25Å; W190-V203 HydrophobicContact CZ2-CG2 4.39Å; L194-V203 HydrophobicContact CD1-CB 4.38Å; L194-V203 HydrophobicContact CD1-CG1 3.64Å; G201-V203 VanDerWaalsContact C-N 3.26Å
204	N	94	Very high	93.4	Very high	13 Å²	13	59 Å²	59	7%	0.07	31%	0.308	C	S	.	.			trans	-144.9	13.9	-165.2	69.7	-29.8	0	0	0	113.7	L194 N199 R309	L194-N204 CarbonylContact O-C 3.53Å; L194-N204 VanDerWaalsContact O-O 3.07Å; N199-N204 HydrophobicContact CB-CB 4.49Å; N199-N204 PolarHBondContact ND2-O 3.31Å; N199-N204 PolarHBondContact O-ND2 2.84Å; N204-R309 PolarHBondContact ND2-NH1 3.25Å; N204-R309 VanDerWaalsContact O-CD 3.3Å; N204-R309 WeakPolarHBondContact O-CD 3.47Å; N204-R309 WeakPolarHBondContact O-CG 3.35Å
205	A	96.4	Very high	93.5	Very high	0 Å²	0	57.5 Å²	57.5	0%	0	30%	0.301	C	S	.	.	S	Bend	trans	-147.1	165.4	-179.7	0	0	0	0	0	110.6	W190 L194 A235 T307 R309	W190-A205 HydrophobicContact CE3-CB 4.15Å; W190-A205 VanDerWaalsContact CE3-O 3.3Å; W190-A205 HydrophobicContact CZ3-CB 4.03Å; L194-A205 WeakPolarHBondContact O-CA 3.49Å; A205-A235 HydrophobicContact CB-CB 3.71Å; A205-T307 HydrophobicContact CB-CG2 3.6Å; A205-R309 HydrophobicContact CB-CG 3.69Å
206	W	97.2	Very high	93.6	Very high	0 Å²	0	60.3 Å²	60.3	0%	0	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.6	138	163.7	167.2	68.5	0	0	0	109.5	A177 S179 G191 A195 A208 P215 I217 P299 T307 L308	A177-W206 HydrophobicContact CB-CZ2 3.96Å; S179-W206 PolarHBondContact O-NE1 2.84Å; G191-W206 WeakPolarHBondContact O-CA 3.42Å; G191-W206 WeakPolarHBondContact O-CB 3.28Å; A195-W206 HydrophobicContact CB-CB 3.71Å; W206-A208 HydrophobicContact CH2-CB 4.37Å; W206-A208 HydrophobicContact CZ2-CB 3.99Å; W206-P215 HydrophobicContact CH2-CB 4.38Å; W206-I217 HydrophobicContact CB-CD1 4.17Å; W206-I217 HydrophobicContact CD2-CB 4.23Å; W206-I217 HydrophobicContact CD2-CD1 3.86Å; W206-I217 HydrophobicContact CE3-CB 3.9Å; W206-I217 HydrophobicContact CE3-CD1 3.86Å; W206-I217 HydrophobicContact CE3-CG1 4.46Å; W206-I217 HydrophobicContact CE3-CG2 4.01Å; W206-I217 HydrophobicContact CG-CD1 3.99Å; W206-I217 HydrophobicContact CH2-CB 3.89Å; W206-I217 HydrophobicContact CH2-CG2 4.21Å; W206-I217 HydrophobicContact CZ2-CB 4.2Å; W206-I217 HydrophobicContact CZ3-CB 3.74Å; W206-I217 HydrophobicContact CZ3-CG2 3.69Å; W206-P299 HydrophobicContact CH2-CG 4.19Å; W206-P299 HydrophobicContact CZ3-CG 4.1Å; W206-T307 CarbonylContact O-C 3.53Å; W206-T307 VanDerWaalsContact O-CA 3.27Å; W206-T307 WeakPolarHBondContact O-CA 3.43Å; W206-T307 WeakPolarHBondContact O-CG2 3Å; W206-L308 HydrophobicContact CE3-CB 4.02Å; W206-L308 HydrophobicContact CE3-CD2 4.49Å; W206-L308 HydrophobicContact CZ3-CB 4.36Å; W206-L308 HydrophobicContact CZ3-CD2 4.4Å; W206-L308 PolarHBondContact N-O 3.01Å; W206-L308 VanDerWaalsContact N-O 3.16Å; W206-L308 PolarHBondContact O-N 2.86Å
207	S	96.5	Very high	93.7	Very high	0 Å²	0	58.8 Å²	58.8	0%	0	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.2	134	169.1	175	0	0	0	0	109.7	R181 W190 C306 T307	R181-S207 VanDerWaalsContact CB-O 3.31Å; R181-S207 WeakPolarHBondContact CB-O 3.21Å; R181-S207 WeakPolarHBondContact CD-OG 3.31Å; R181-S207 PolarHBondContact N-O 2.92Å; W190-S207 PolarHBondContact O-N 3.32Å; S207-C306 WeakPolarHBondContact CA-O 3.44Å; S207-T307 PolarHBondContact OG-OG1 3.26Å
208	A	96.9	Very high	93.8	Very high	4 Å²	4	59.1 Å²	59.1	3%	0.033	31%	0.307	C	S	.	.			trans	-69.3	151.4	174.6	0	0	0	0	0	112.5	R181 W206 P215 C306	R181-A208 PolarHBondContact NE-O 2.79Å; W206-A208 HydrophobicContact CH2-CB 4.37Å; W206-A208 HydrophobicContact CZ2-CB 3.99Å; A208-P215 HydrophobicContact CB-CB 3.41Å; A208-P215 VanDerWaalsContact CB-CB 3.41Å; A208-P215 HydrophobicContact CB-CG 4.12Å; A208-C306 HydrophobicContact CB-CB 4.1Å; A208-C306 PolarHBondContact N-O 2.95Å
209	A	95.3	Very high	94.1	Very high	7 Å²	7	55.1 Å²	55.1	6%	0.058	29%	0.288	C	S	.	.			trans	-64.9	144.8	176.7	0	0	0	0	0	111	S179 H211 D212	S179-A209 PolarHBondContact OG-N 3.33Å; A209-H211 VanDerWaalsContact CB-CE1 3.44Å; A209-H211 WeakPolarHBondContact CB-CE1 3.35Å; A209-H211 PolarHBondContact O-N 2.77Å; A209-H211 VanDerWaalsContact O-N 3.14Å; A209-D212 HydrophobicContact CB-CB 4.49Å; A209-D212 PolarHBondContact O-N 2.99Å; A209-D212 VanDerWaalsContact O-N 3.14Å
210	P	91.3	Very high	94.2	Very high	99 Å²	99	54.2 Å²	54.2	64%	0.643	28%	0.283	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.1	-26.5	-177.2	-15.4	22.1	0	0	0	115
211	H	92.4	Very high	94.2	Very high	155 Å²	155	47.9 Å²	47.9	72%	0.718	26%	0.256	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.7	-9.6	-177.9	55	-95.4	0	0	0	113.3	A209 K213	A209-H211 VanDerWaalsContact CB-CE1 3.44Å; A209-H211 WeakPolarHBondContact CB-CE1 3.35Å; A209-H211 PolarHBondContact O-N 2.77Å; A209-H211 VanDerWaalsContact O-N 3.14Å; H211-K213 PolarHBondContact O-N 2.82Å
212	D	94.9	Very high	94.2	Very high	39 Å²	39	51.1 Å²	51.1	21%	0.209	26%	0.257	C	S	.	.			trans	-82.5	109	178.9	-173.4	-3.5	0	0	0	110.1	S178 S179 A209 N214 P215	S178-D212 VanDerWaalsContact CB-OD2 3.24Å; S178-D212 WeakPolarHBondContact CB-OD2 3.42Å; S178-D212 PolarHBondContact OG-OD2 2.83Å; S179-D212 WeakPolarHBondContact CB-OD2 3.28Å; S179-D212 VanDerWaalsContact OG-CB 3.25Å; S179-D212 WeakPolarHBondContact OG-CB 3.04Å; S179-D212 PolarHBondContact OG-OD2 3.49Å; A209-D212 HydrophobicContact CB-CB 4.49Å; A209-D212 PolarHBondContact O-N 2.99Å; A209-D212 VanDerWaalsContact O-N 3.14Å; D212-N214 VanDerWaalsContact OD1-C 3.29Å; D212-N214 PolarHBondContact OD1-N 2.8Å; D212-P215 WeakPolarHBondContact OD2-CA 3.49Å
213	K	91.9	Very high	94.2	Very high	190 Å²	190	48 Å²	48	83%	0.826	23%	0.234	S	C	*	.	S	Bend	trans	-80.4	-21.2	-179	-65.6	-174.7	-179.7	179.6	0	113.2	H211	H211-K213 PolarHBondContact O-N 2.82Å
214	N	94.1	Very high	94.1	Very high	128 Å²	128	48.9 Å²	48.9	68%	0.684	24%	0.24	S	C	*	.	S	Bend	trans	-129.4	60.4	-175.9	-67.1	-35.4	0	0	0	109.9	D212	D212-N214 VanDerWaalsContact OD1-C 3.29Å; D212-N214 PolarHBondContact OD1-N 2.8Å
215	P	97.3	Very high	93.9	Very high	6 Å²	6	48.4 Å²	48.4	4%	0.039	24%	0.237	C	C	.	.			trans	-67.8	146.3	-174.1	30.6	-36.2	0	0	0	111	S178 W206 A208 D212 P299 C306	S178-P215 VanDerWaalsContact OG-CA 3.28Å; S178-P215 WeakPolarHBondContact OG-CA 3.49Å; W206-P215 HydrophobicContact CH2-CB 4.38Å; A208-P215 HydrophobicContact CB-CB 3.41Å; A208-P215 VanDerWaalsContact CB-CB 3.41Å; A208-P215 HydrophobicContact CB-CG 4.12Å; D212-P215 WeakPolarHBondContact OD2-CA 3.49Å; P215-P299 HydrophobicContact CG-CB 4.31Å; P215-P299 VanDerWaalsContact O-CD 3.31Å; P215-P299 WeakPolarHBondContact O-CD 3.36Å; P215-C306 HydrophobicContact CG-CB 4.43Å
216	W	97.3	Very high	93.7	Very high	60 Å²	60	51.2 Å²	51.2	23%	0.227	25%	0.248	C	C	.	.			trans	-145.1	150.4	172.5	57.8	-100.8	0	0	0	111	A177 S178 Q218 R296 I297 I298	A177-W216 CarbonylContact C-O 3.56Å; A177-W216 WeakPolarHBondContact CA-O 3.39Å; A177-W216 VanDerWaalsContact CB-O 3.29Å; A177-W216 WeakPolarHBondContact CB-O 3.38Å; S178-W216 PolarHBondContact N-O 2.8Å; S178-W216 PolarHBondContact OG-N 2.84Å; S178-W216 PolarHBondContact OG-O 3.04Å; W216-Q218 HydrophobicContact CE3-CB 3.72Å; W216-Q218 HydrophobicContact CZ3-CB 3.57Å; W216-R296 HydrophobicContact CB-CG 3.66Å; W216-R296 HydrophobicContact CD2-CG 4.43Å; W216-R296 VanDerWaalsContact CD2-NE 3.3Å; W216-R296 HydrophobicContact CE3-CG 4.33Å; W216-R296 HydrophobicContact CG-CG 4.18Å; W216-I297 WeakPolarHBondContact CA-O 3.43Å; W216-I298 HydrophobicContact CB-CG1 4.13Å
217	I	97.6	Very high	93.5	Very high	0 Å²	0	51.2 Å²	51.2	0%	0	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122	138	166.8	-172.3	166.3	0	0	0	108.3	I175 T176 A177 T192 A195 W206 R296 I297 L308 M310	I175-I217 HydrophobicContact CG2-CD1 3.96Å; I175-I217 HydrophobicContact CG2-CG1 4.04Å; T176-I217 CarbonylContact O-C 3.58Å; T176-I217 WeakPolarHBondContact O-CA 3.23Å; A177-I217 HydrophobicContact CB-CB 4.45Å; A177-I217 HydrophobicContact CB-CG1 4.46Å; T192-I217 HydrophobicContact CG2-CD1 4.26Å; T192-I217 HydrophobicContact CG2-CG1 4.43Å; A195-I217 HydrophobicContact CB-CD1 3.56Å; W206-I217 HydrophobicContact CB-CD1 4.17Å; W206-I217 HydrophobicContact CD2-CB 4.23Å; W206-I217 HydrophobicContact CD2-CD1 3.86Å; W206-I217 HydrophobicContact CE3-CB 3.9Å; W206-I217 HydrophobicContact CE3-CD1 3.86Å; W206-I217 HydrophobicContact CE3-CG1 4.46Å; W206-I217 HydrophobicContact CE3-CG2 4.01Å; W206-I217 HydrophobicContact CG-CD1 3.99Å; W206-I217 HydrophobicContact CH2-CB 3.89Å; W206-I217 HydrophobicContact CH2-CG2 4.21Å; W206-I217 HydrophobicContact CZ2-CB 4.2Å; W206-I217 HydrophobicContact CZ3-CB 3.74Å; W206-I217 HydrophobicContact CZ3-CG2 3.69Å; I217-R296 CarbonylContact O-C 3.6Å; I217-R296 VanDerWaalsContact O-CA 3.28Å; I217-R296 WeakPolarHBondContact O-CA 3.07Å; I217-I297 HydrophobicContact CG2-CB 3.86Å; I217-I297 PolarHBondContact N-O 2.83Å; I217-I297 PolarHBondContact O-N 3.37Å; I217-L308 HydrophobicContact CG2-CD2 4.09Å; I217-M310 HydrophobicContact CD1-CE 3.82Å; I217-M310 HydrophobicContact CG1-CE 4.01Å; I217-M310 HydrophobicContact CG2-CE 3.91Å; I217-M310 HydrophobicContact CG2-SD 4.27Å
218	Q	96.7	Very high	93.3	Very high	20 Å²	20	51.3 Å²	51.3	9%	0.093	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.4	141.7	-171	178.3	-178.8	-53.3	0	0	110.1	I175 T176 W216 F258 I295 R296	I175-Q218 WeakPolarHBondContact CA-O 3.04Å; T176-Q218 PolarHBondContact N-O 3.21Å; T176-Q218 PolarHBondContact O-N 2.02Å; W216-Q218 HydrophobicContact CE3-CB 3.72Å; W216-Q218 HydrophobicContact CZ3-CB 3.57Å; Q218-F258 HydrophobicContact CG-CZ 4.46Å; Q218-I295 CarbonylContact C-O 3.38Å; Q218-I295 VanDerWaalsContact CA-O 3.32Å; Q218-I295 WeakPolarHBondContact CA-O 3.27Å; Q218-R296 HydrophobicContact CB-CB 4.49Å; Q218-R296 HydrophobicContact CB-CG 4.5Å
219	I	97.1	Very high	93.2	Very high	0 Å²	0	51.1 Å²	51.1	0%	0	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	128.1	177.2	-52.5	80.2	0	0	0	108.1	M165 I170 Q174 M221 Y294 I295 M310 L312	M165-I219 HydrophobicContact CE-CG1 4.49Å; M165-I219 HydrophobicContact SD-CG1 4.16Å; I170-I219 HydrophobicContact CD1-CG2 4.17Å; I170-I219 HydrophobicContact CG2-CG2 3.93Å; Q174-I219 WeakPolarHBondContact O-CA 3.02Å; I219-M221 HydrophobicContact CG2-SD 3.83Å; I219-Y294 WeakPolarHBondContact O-CA 3.23Å; I219-I295 HydrophobicContact CB-CG2 4.08Å; I219-I295 HydrophobicContact CD1-CG2 4.05Å; I219-I295 PolarHBondContact N-O 3.26Å; I219-I295 PolarHBondContact O-N 2.88Å; I219-I295 VanDerWaalsContact O-N 3.14Å; I219-M310 HydrophobicContact CD1-CE 3.26Å; I219-M310 HydrophobicContact CD1-SD 4.34Å; I219-M310 HydrophobicContact CG1-CE 3.88Å; I219-L312 HydrophobicContact CB-CD1 3.99Å; I219-L312 HydrophobicContact CD1-CD1 4.15Å; I219-L312 HydrophobicContact CG1-CD1 3.94Å; I219-L312 HydrophobicContact CG2-CD1 4.04Å
220	N	95.5	Very high	93.3	Very high	27 Å²	27	50.8 Å²	50.8	14%	0.144	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.9	111.7	171.8	179.5	7.6	0	0	0	109.9	Q174 H222 Q293 Y294	Q174-N220 WeakPolarHBondContact CB-O 3.15Å; Q174-N220 PolarHBondContact NE2-O 3.37Å; Q174-N220 PolarHBondContact O-N 2.61Å; N220-H222 PolarHBondContact O-N 2.85Å; N220-H222 PolarHBondContact OD1-N 2.76Å; N220-Q293 PolarHBondContact OD1-NE2 3.15Å; N220-Y294 HydrophobicContact CB-CD1 3.82Å; N220-Y294 HydrophobicContact CB-CE1 3.55Å; N220-Y294 PolarHBondContact ND2-OH 3.18Å
221	M	90.1	Very high	93.6	Very high	18 Å²	18	46.7 Å²	46.7	9%	0.089	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.2	-1.5	179.9	-63.2	-55.2	-62.7	0	0	114.1	L163 I170 I219 R223 M225 F227 Q293 L312	L163-M221 HydrophobicContact CB-CE 4.07Å; L163-M221 HydrophobicContact CD1-CE 4.14Å; I170-M221 HydrophobicContact CD1-CE 4.07Å; I170-M221 HydrophobicContact CD1-SD 3.83Å; I170-M221 HydrophobicContact CG1-CE 4.3Å; I170-M221 HydrophobicContact CG1-SD 4.36Å; I219-M221 HydrophobicContact CG2-SD 3.83Å; M221-R223 WeakPolarHBondContact CB-O 3.01Å; M221-R223 PolarHBondContact O-N 3.49Å; M221-M225 HydrophobicContact CB-CG 3.66Å; M221-M225 HydrophobicContact CE-CE 4.4Å; M221-M225 HydrophobicContact CE-CG 4.13Å; M221-M225 HydrophobicContact CG-CB 4.48Å; M221-M225 HydrophobicContact CG-CG 3.89Å; M221-F227 HydrophobicContact CG-CE1 3.87Å; M221-F227 HydrophobicContact CG-CZ 3.53Å; M221-F227 HydrophobicContact SD-CE1 4.33Å; M221-Q293 WeakPolarHBondContact CB-O 3.44Å; M221-Q293 PolarHBondContact N-O 2.78Å; M221-L312 HydrophobicContact SD-CD1 4.39Å
222	H	87.5	Confident	93.8	Very high	121 Å²	121	39.3 Å²	39.3	56%	0.56	18%	0.183	S	C	*	.	E	Extended strand (participates in β ladder)	trans	60.4	-14.2	-172.5	-66.2	-62.2	0	0	0	116.2	Q174 N220	Q174-H222 WeakPolarHBondContact CG-NE2 3.49Å; Q174-H222 PolarHBondContact NE2-CD2 3.43Å; N220-H222 PolarHBondContact O-N 2.85Å; N220-H222 PolarHBondContact OD1-N 2.76Å
223	R	86.6	Confident	93.9	Very high	89 Å²	89	37.6 Å²	37.6	34%	0.336	17%	0.174	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.5	164.4	173.7	59.7	176.3	154.7	-127.4	-20.8	110.3	M221 M225 Q293 I447 E449	M221-R223 WeakPolarHBondContact CB-O 3.01Å; M221-R223 PolarHBondContact O-N 3.49Å; R223-M225 HydrophobicContact CG-CG 4.34Å; R223-M225 HydrophobicContact CG-SD 3.84Å; R223-M225 PolarHBondContact O-N 2.76Å; R223-Q293 WeakPolarHBondContact O-CA 3.02Å; R223-I447 VanDerWaalsContact NH1-CD1 3.31Å; R223-E449 IonicContact NH1-OE1 3.77Å; R223-E449 PolarHBondContact NH1-OE1 3.3Å
224	T	89.4	Confident	94.1	Very high	50 Å²	50	28.6 Å²	28.6	31%	0.307	14%	0.135	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.9	121.9	176.9	-51.1	0	0	0	0	110.1	Q253 I291 L317	T224-Q253 PolarHBondContact OG1-OE1 3.07Å; T224-I291 HydrophobicContact CG2-CG2 3.55Å; T224-L317 HydrophobicContact CG2-CD1 3.51Å; T224-L317 HydrophobicContact CG2-CG 4.49Å
225	M	89.9	Confident	94.2	Very high	4 Å²	4	22.5 Å²	22.5	2%	0.02	10%	0.102	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	159.2	179.9	-60.7	-67.3	-68.9	0	0	110	L163 M221 R223 F227 I291 A292 E316	L163-M225 HydrophobicContact CD1-CE 4.4Å; L163-M225 HydrophobicContact CD2-CE 3.72Å; M221-M225 HydrophobicContact CB-CG 3.66Å; M221-M225 HydrophobicContact CE-CE 4.4Å; M221-M225 HydrophobicContact CE-CG 4.13Å; M221-M225 HydrophobicContact CG-CB 4.48Å; M221-M225 HydrophobicContact CG-CG 3.89Å; R223-M225 HydrophobicContact CG-CG 4.34Å; R223-M225 HydrophobicContact CG-SD 3.84Å; R223-M225 PolarHBondContact O-N 2.76Å; M225-F227 HydrophobicContact CB-CE1 4.29Å; M225-F227 HydrophobicContact CB-CE2 4.29Å; M225-F227 HydrophobicContact CB-CZ 4.04Å; M225-I291 WeakPolarHBondContact O-CA 2.99Å; M225-A292 PolarHBondContact N-O 3.38Å; M225-A292 PolarHBondContact O-N 3.35Å; M225-E316 HydrophobicContact CE-CG 3.65Å; M225-E316 HydrophobicContact SD-CG 3.7Å
226	R	91.4	Very high	93.9	Very high	59 Å²	59	24.2 Å²	24.2	22%	0.223	11%	0.114	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.6	111.7	167.5	-174	-171.9	-62.5	-117	0.5	108.7	P289 I290 I291 G314 C315 L317	R226-P289 HydrophobicContact CG-CB 4.05Å; R226-I290 CarbonylContact C-O 3.58Å; R226-I290 WeakPolarHBondContact CA-O 3.02Å; R226-I291 HydrophobicContact CG-CG1 4.46Å; R226-G314 CarbonylContact O-C 3.19Å; R226-G314 WeakPolarHBondContact O-CA 3.45Å; R226-C315 WeakPolarHBondContact CB-O 3.02Å; R226-C315 PolarHBondContact N-O 2.87Å; R226-C315 PolarHBondContact O-N 2.8Å; R226-L317 HydrophobicContact CB-CD2 4.31Å
227	F	93.9	Very high	93.5	Very high	0 Å²	0	24.5 Å²	24.5	0%	0	12%	0.115	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.9	124.4	173.8	-51.7	-81.6	0	0	0	110	L163 M221 M225 F286 P289 I290 A292 I295 L312	L163-F227 HydrophobicContact CD1-CD1 3.65Å; L163-F227 HydrophobicContact CD1-CE1 3.65Å; M221-F227 HydrophobicContact CG-CE1 3.87Å; M221-F227 HydrophobicContact CG-CZ 3.53Å; M221-F227 HydrophobicContact SD-CE1 4.33Å; M225-F227 HydrophobicContact CB-CE1 4.29Å; M225-F227 HydrophobicContact CB-CE2 4.29Å; M225-F227 HydrophobicContact CB-CZ 4.04Å; F227-F286 HydrophobicContact CB-CD2 4.13Å; F227-F286 HydrophobicContact CB-CE2 4.21Å; F227-P289 CarbonylContact O-C 3.54Å; F227-P289 WeakPolarHBondContact O-CA 3.18Å; F227-I290 HydrophobicContact CB-CB 4.25Å; F227-I290 HydrophobicContact CD2-CB 4.39Å; F227-I290 HydrophobicContact CD2-CG2 4.28Å; F227-I290 PolarHBondContact N-O 2.82Å; F227-I290 PolarHBondContact O-N 2.91Å; F227-A292 HydrophobicContact CE2-CB 4.11Å; F227-A292 VanDerWaalsContact CE2-O 3.26Å; F227-A292 WeakPolarHBondContact CE2-O 3.26Å; F227-I295 HydrophobicContact CB-CD1 4.15Å; F227-I295 HydrophobicContact CD1-CD1 4.1Å; F227-I295 HydrophobicContact CD2-CB 4.5Å; F227-I295 HydrophobicContact CD2-CD1 4.02Å; F227-I295 HydrophobicContact CE1-CB 4.44Å; F227-I295 HydrophobicContact CE1-CD1 4.49Å; F227-I295 HydrophobicContact CE1-CG2 4Å; F227-I295 HydrophobicContact CE2-CB 4.05Å; F227-I295 HydrophobicContact CE2-CD1 4.41Å; F227-I295 HydrophobicContact CE2-CG2 4.44Å; F227-I295 HydrophobicContact CG-CD1 3.83Å; F227-I295 HydrophobicContact CZ-CB 4.01Å; F227-I295 HydrophobicContact CZ-CG2 3.9Å; F227-L312 HydrophobicContact CE1-CD1 4.08Å
228	T	93.2	Very high	92.8	Very high	1 Å²	1	30.9 Å²	30.9	1%	0.006	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	-10.6	178.1	51.2	0	0	0	0	112.2	P149 C159 L285 F286 P289 V313	P149-T228 HydrophobicContact CB-CG2 4.49Å; C159-T228 HydrophobicContact CB-CG2 3.83Å; C159-T228 VanDerWaalsContact O-CB 3.32Å; C159-T228 WeakPolarHBondContact O-CB 3.46Å; C159-T228 VanDerWaalsContact O-CG2 3.24Å; C159-T228 WeakPolarHBondContact O-CG2 3.35Å; C159-T228 PolarHBondContact O-OG1 3.03Å; C159-T228 WeakPolarHBondContact SG-CG2 3.46Å; T228-L285 CarbonylContact O-C 3.52Å; T228-L285 VanDerWaalsContact O-CA 3.28Å; T228-L285 WeakPolarHBondContact O-CA 3.46Å; T228-F286 PolarHBondContact O-N 3.14Å; T228-P289 HydrophobicContact CG2-CB 4.12Å; T228-V313 PolarHBondContact N-O 3.22Å; T228-V313 PolarHBondContact OG1-O 3.19Å
229	G	94.9	Very high	92.2	Very high	0 Å²	0	33.3 Å²	33.3	0%	0	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	180	-176.5	173.4	0	0	0	0	0	114.6	N284 V313	G229-N284 CarbonylContact C-O 3.47Å; G229-N284 WeakPolarHBondContact CA-O 3.41Å; G229-V313 PolarHBondContact N-O 3.26Å; G229-V313 VanDerWaalsContact N-O 3.15Å; G229-V313 PolarHBondContact O-N 3.17Å
230	V	96.8	Very high	91.8	Very high	0 Å²	0	36.5 Å²	36.5	0%	0	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.9	139.3	174.8	62.7	0	0	0	0	109.9	T232 F247 N284 F286 I297 M310 L312	V230-T232 HydrophobicContact CG1-CG2 4.45Å; V230-T232 HydrophobicContact CG2-CG2 4.1Å; V230-F247 HydrophobicContact CG1-CE2 3.88Å; V230-F247 HydrophobicContact CG1-CZ 3.74Å; V230-N284 HydrophobicContact CG1-CB 4.34Å; V230-N284 PolarHBondContact N-O 2.88Å; V230-N284 PolarHBondContact O-N 3.23Å; V230-F286 HydrophobicContact CB-CZ 4.06Å; V230-F286 HydrophobicContact CG1-CE1 4.18Å; V230-F286 HydrophobicContact CG1-CZ 3.75Å; V230-I297 HydrophobicContact CG2-CD1 4.44Å; V230-M310 HydrophobicContact CG2-CB 4.36Å; V230-L312 HydrophobicContact CB-CD2 4.49Å; V230-L312 HydrophobicContact CG2-CD2 4.18Å
231	V	97.1	Very high	91.7	Very high	14 Å²	14	38.1 Å²	38.1	9%	0.085	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.1	127.8	170.7	-174.8	0	0	0	0	107.9	L197 T281 K282 T283 M310 E311 V313	L197-V231 HydrophobicContact CD1-CG1 4Å; L197-V231 HydrophobicContact CD2-CG1 4.01Å; V231-T281 HydrophobicContact CG1-CG2 4.41Å; V231-K282 CarbonylContact C-O 3.6Å; V231-K282 WeakPolarHBondContact CA-O 3.1Å; V231-T283 HydrophobicContact CG2-CG2 4.17Å; V231-M310 CarbonylContact O-C 3.54Å; V231-M310 WeakPolarHBondContact O-CA 3.44Å; V231-M310 VanDerWaalsContact O-CB 3.3Å; V231-M310 WeakPolarHBondContact O-CB 3.49Å; V231-E311 HydrophobicContact CB-CB 4.33Å; V231-E311 PolarHBondContact N-O 2.88Å; V231-E311 PolarHBondContact O-N 2.7Å; V231-V313 HydrophobicContact CG2-CG2 3.85Å
232	T	97.7	Very high	92	Very high	0 Å²	0	37.3 Å²	37.3	0%	0	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	149.1	-179.4	66.7	0	0	0	0	111.2	V230 I244 F247 N275 T281 K282 L308 R309	V230-T232 HydrophobicContact CG1-CG2 4.45Å; V230-T232 HydrophobicContact CG2-CG2 4.1Å; T232-I244 HydrophobicContact CG2-CD1 4.39Å; T232-F247 HydrophobicContact CG2-CE1 4.09Å; T232-F247 HydrophobicContact CG2-CZ 4.17Å; T232-N275 WeakPolarHBondContact CB-OD1 3.25Å; T232-N275 PolarHBondContact O-ND2 2.56Å; T232-N275 PolarHBondContact OG1-OD1 2.92Å; T232-T281 CarbonylContact O-C 3.4Å; T232-T281 WeakPolarHBondContact O-CA 3.3Å; T232-K282 PolarHBondContact N-O 3.4Å; T232-K282 PolarHBondContact O-N 2.86Å; T232-K282 PolarHBondContact OG1-O 2.96Å; T232-L308 HydrophobicContact CG2-CD1 3.85Å; T232-R309 CarbonylContact C-O 3.37Å; T232-R309 WeakPolarHBondContact CA-O 3.46Å
233	Q	96.9	Very high	92.4	Very high	3 Å²	3	31.7 Å²	31.7	1%	0.014	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146	145.7	177.7	-170.3	-175.9	31.7	0	0	109.4	L197 N275 D279 T281 R309	L197-Q233 HydrophobicContact CD1-CB 3.75Å; Q233-N275 WeakPolarHBondContact CA-ND2 3.14Å; Q233-D279 PolarHBondContact NE2-O 3.29Å; Q233-T281 HydrophobicContact CB-CG2 4.33Å; Q233-T281 HydrophobicContact CG-CG2 4.3Å; Q233-R309 HydrophobicContact CB-CB 4.06Å; Q233-R309 VanDerWaalsContact CD-NH2 3.28Å; Q233-R309 PolarHBondContact N-O 2.75Å; Q233-R309 PolarHBondContact O-N 2.9Å
234	G	95.4	Very high	92.9	Very high	0 Å²	0	27.4 Å²	27.4	0%	0	16%	0.158	C	C	.	.			trans	-80.8	-161.2	177.8	0	0	0	0	0	113.6	N278 R309	G234-N278 CarbonylContact C-O 3.44Å; G234-N278 VanDerWaalsContact CA-O 3.25Å; G234-N278 WeakPolarHBondContact CA-O 3.15Å; G234-N278 PolarHBondContact N-O 2.94Å; G234-R309 PolarHBondContact O-NE 2.75Å; G234-R309 PolarHBondContact O-NH2 2.96Å
235	A	95.2	Very high	93.2	Very high	0 Å²	0	30.1 Å²	30.1	0%	0	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.6	174.5	163.2	0	0	0	0	0	111	W190 A205 E242 N278 T307	W190-A235 HydrophobicContact CZ3-CB 4.03Å; A205-A235 HydrophobicContact CB-CB 3.71Å; A235-E242 PolarHBondContact N-O 3.08Å; A235-E242 PolarHBondContact O-N 3.14Å; A235-N278 PolarHBondContact N-O 3.16Å; A235-N278 WeakPolarHBondContact O-CB 3.07Å; A235-T307 HydrophobicContact CB-CG2 3.7Å
236	S	92.3	Very high	93.5	Very high	42 Å²	42	30.7 Å²	30.7	29%	0.294	17%	0.171	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	135.6	175.2	-174.9	0	0	0	0	110.1	T240	S236-T240 CarbonylContact C-O 3.53Å; S236-T240 WeakPolarHBondContact CA-O 3.07Å; S236-T240 PolarHBondContact OG-O 3.03Å
237	R	87.8	Confident	93.8	Very high	67 Å²	67	27.9 Å²	27.9	25%	0.253	16%	0.161	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	111.3	177.2	-176	170.8	62.4	102.1	5.9	108.8	W190 G239 T240 E242	W190-R237 HydrophobicContact CH2-CB 4.25Å; W190-R237 HydrophobicContact CZ2-CB 4.12Å; W190-R237 HydrophobicContact CZ2-CG 3.99Å; R237-G239 VanDerWaalsContact C-N 3.26Å; R237-G239 PolarHBondContact O-N 2.89Å; R237-T240 PolarHBondContact N-O 2.9Å; R237-T240 WeakPolarHBondContact O-CB 3.45Å; R237-T240 PolarHBondContact O-N 3.37Å; R237-T240 PolarHBondContact O-OG1 2.99Å; R237-E242 IonicContact CZ-OE1 3.4Å; R237-E242 VanDerWaalsContact CZ-OE1 3.24Å; R237-E242 IonicContact NE-OE1 2.87Å; R237-E242 PolarHBondContact NE-OE1 2.93Å; R237-E242 IonicContact NE-OE2 2.71Å; R237-E242 IonicContact NH2-OE1 3.76Å; R237-E242 PolarHBondContact NH2-OE1 2.74Å
238	I	84.2	Confident	93.9	Very high	134 Å²	134	30.3 Å²	30.3	69%	0.687	17%	0.171	S	C	*	.	T	Hydrogen-bonded Turn	trans	50.5	48.9	178.5	-46.4	176.1	0	0	0	110.6	M184 T240	M184-I238 HydrophobicContact CE-CD1 3.97Å; I238-T240 PolarHBondContact O-N 2.83Å
239	G	82.7	Confident	94.1	Very high	71 Å²	71	30.3 Å²	30.3	73%	0.732	17%	0.171	S	C	*	.	T	Hydrogen-bonded Turn	trans	76.6	-5.9	-178.8	0	0	0	0	0	115.6	R237	R237-G239 VanDerWaalsContact C-N 3.26Å; R237-G239 PolarHBondContact O-N 2.89Å
240	T	89.4	Confident	94.2	Very high	66 Å²	66	30.4 Å²	30.4	41%	0.405	17%	0.172	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.4	119.6	174.5	65.9	0	0	0	0	111.3	S236 R237 I238	S236-T240 CarbonylContact C-O 3.53Å; S236-T240 WeakPolarHBondContact CA-O 3.07Å; S236-T240 PolarHBondContact OG-O 3.03Å; R237-T240 PolarHBondContact N-O 2.9Å; R237-T240 WeakPolarHBondContact O-CB 3.45Å; R237-T240 PolarHBondContact O-N 3.37Å; R237-T240 PolarHBondContact O-OG1 2.99Å; I238-T240 PolarHBondContact O-N 2.83Å
241	Q	93.9	Very high	94.3	Very high	62 Å²	62	31 Å²	31	29%	0.29	18%	0.176	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.3	125.1	177.2	37.4	176.7	-23.6	0	0	111.6	F243 N278 R303	Q241-F243 HydrophobicContact CB-CD1 4.48Å; Q241-F243 HydrophobicContact CB-CE1 4.38Å; Q241-N278 HydrophobicContact CB-CB 3.8Å; Q241-R303 VanDerWaalsContact CD-CZ 3.45Å; Q241-R303 VanDerWaalsContact OE1-NH1 3.16Å
242	E	95.1	Very high	94.3	Very high	1 Å²	1	30.6 Å²	30.6	1%	0.005	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	127.6	-179.1	-60.4	-176	162.8	0	0	109.4	A235 R237 R303 K304 A305 T307	A235-E242 PolarHBondContact N-O 3.08Å; A235-E242 PolarHBondContact O-N 3.14Å; R237-E242 IonicContact CZ-OE1 3.4Å; R237-E242 VanDerWaalsContact CZ-OE1 3.24Å; R237-E242 IonicContact NE-OE1 2.87Å; R237-E242 PolarHBondContact NE-OE1 2.93Å; R237-E242 IonicContact NE-OE2 2.71Å; R237-E242 IonicContact NH2-OE1 3.76Å; R237-E242 PolarHBondContact NH2-OE1 2.74Å; E242-R303 WeakPolarHBondContact CA-O 3.47Å; E242-K304 HydrophobicContact CG-CB 4.14Å; E242-A305 HydrophobicContact CB-CB 4.39Å; E242-A305 HydrophobicContact CG-CB 4.31Å; E242-T307 WeakPolarHBondContact CB-OG1 3.33Å; E242-T307 PolarHBondContact OE2-OG1 3.28Å
243	F	96.3	Very high	94.1	Very high	2 Å²	2	35 Å²	35	1%	0.009	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-164.7	160.7	-177.2	55.1	-98	0	0	0	112.5	Q241 K245 N275 V276 D277 R303 T307	Q241-F243 HydrophobicContact CB-CD1 4.48Å; Q241-F243 HydrophobicContact CB-CE1 4.38Å; F243-K245 HydrophobicContact CD2-CG 4.11Å; F243-K245 HydrophobicContact CE2-CG 3.73Å; F243-N275 HydrophobicContact CB-CB 4.1Å; F243-N275 HydrophobicContact CD2-CB 4.02Å; F243-N275 VanDerWaalsContact CD2-O 3.23Å; F243-N275 WeakPolarHBondContact CD2-O 3.44Å; F243-N275 WeakPolarHBondContact CE2-O 3.36Å; F243-N275 HydrophobicContact CG-CB 4.23Å; F243-V276 WeakPolarHBondContact CZ-O 3.38Å; F243-D277 VanDerWaalsContact CD1-C 3.44Å; F243-D277 WeakPolarHBondContact CD1-O 3.32Å; F243-D277 WeakPolarHBondContact CG-O 3.17Å; F243-R303 HydrophobicContact CD1-CB 4.31Å; F243-R303 HydrophobicContact CD2-CB 4.13Å; F243-R303 HydrophobicContact CE1-CB 4.18Å; F243-R303 HydrophobicContact CE1-CG 4.28Å; F243-R303 HydrophobicContact CE2-CB 3.95Å; F243-R303 HydrophobicContact CG-CB 4.31Å; F243-R303 HydrophobicContact CZ-CB 3.99Å; F243-R303 HydrophobicContact CZ-CG 4.23Å; F243-R303 PolarHBondContact N-O 3.03Å; F243-R303 PolarHBondContact O-N 2.89Å; F243-T307 WeakPolarHBondContact CA-O 3.26Å
244	I	97.1	Very high	93.9	Very high	0 Å²	0	38.4 Å²	38.4	0%	0	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.3	131.7	170.7	66	168.9	0	0	0	110.5	T232 F247 G274 N275 P299 C306 T307 L308	T232-I244 HydrophobicContact CG2-CD1 4.39Å; I244-F247 HydrophobicContact CD1-CB 4.14Å; I244-F247 HydrophobicContact CD1-CD1 3.69Å; I244-F247 HydrophobicContact CD1-CE1 4.38Å; I244-F247 HydrophobicContact CD1-CG 4.09Å; I244-G274 CarbonylContact O-C 3.54Å; I244-G274 WeakPolarHBondContact O-CA 3.32Å; I244-N275 PolarHBondContact O-N 3.16Å; I244-P299 HydrophobicContact CG2-CB 3.75Å; I244-P299 HydrophobicContact CG2-CG 3.89Å; I244-C306 HydrophobicContact CG2-CB 4.45Å; I244-T307 PolarHBondContact N-O 3.42Å; I244-L308 HydrophobicContact CD1-CD1 3.68Å; I244-L308 HydrophobicContact CD1-CD2 4.21Å; I244-L308 HydrophobicContact CD1-CG 4.42Å; I244-L308 HydrophobicContact CG1-CD1 4.11Å
245	K	95.8	Very high	93.7	Very high	106 Å²	106	39.5 Å²	39.5	46%	0.461	22%	0.224	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.3	-29.5	175.7	-72.2	-172	174.7	-169.5	0	113	F243 G274 V301	F243-K245 HydrophobicContact CD2-CG 4.11Å; F243-K245 HydrophobicContact CE2-CG 3.73Å; K245-G274 WeakPolarHBondContact O-CA 3.25Å; K245-G274 PolarHBondContact O-N 2.03Å; K245-V301 WeakPolarHBondContact CA-O 3.37Å; K245-V301 HydrophobicContact CB-CB 4.19Å; K245-V301 HydrophobicContact CB-CG1 4.03Å; K245-V301 HydrophobicContact CD-CG1 4.27Å; K245-V301 PolarHBondContact N-O 2.9Å
246	A	96.6	Very high	93.5	Very high	16 Å²	16	49.9 Å²	49.9	13%	0.132	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.3	146.8	176.8	0	0	0	0	0	110.2	I271 F272 V300 V301	A246-I271 HydrophobicContact CB-CG2 3.89Å; A246-F272 VanDerWaalsContact CA-O 3.22Å; A246-F272 WeakPolarHBondContact CA-O 3.24Å; A246-V300 PolarHBondContact O-N 2.87Å; A246-V301 HydrophobicContact CB-CB 4.03Å; A246-V301 HydrophobicContact CB-CG2 4.09Å; A246-V301 PolarHBondContact N-O 2.97Å; A246-V301 VanDerWaalsContact N-O 3.17Å; A246-V301 PolarHBondContact O-N 3.4Å; A246-V301 VanDerWaalsContact O-N 3.13Å
247	F	97.3	Very high	93.7	Very high	0 Å²	0	52.4 Å²	52.4	0%	0	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.7	160.4	-180	64.2	-85.1	0	0	0	111.9	V230 T232 I244 V249 F272 N284 I297 I298	V230-F247 HydrophobicContact CG1-CE2 3.88Å; V230-F247 HydrophobicContact CG1-CZ 3.74Å; T232-F247 HydrophobicContact CG2-CE1 4.09Å; T232-F247 HydrophobicContact CG2-CZ 4.17Å; I244-F247 HydrophobicContact CD1-CB 4.14Å; I244-F247 HydrophobicContact CD1-CD1 3.69Å; I244-F247 HydrophobicContact CD1-CE1 4.38Å; I244-F247 HydrophobicContact CD1-CG 4.09Å; F247-V249 HydrophobicContact CD2-CG2 3.95Å; F247-V249 HydrophobicContact CE2-CG2 3.76Å; F247-F272 HydrophobicContact CD1-CB 4.07Å; F247-F272 HydrophobicContact CD2-CB 4.04Å; F247-F272 HydrophobicContact CD2-CD2 4.28Å; F247-F272 HydrophobicContact CE1-CB 3.65Å; F247-F272 HydrophobicContact CE2-CB 3.62Å; F247-F272 AromaticContact CE2-CD2 3.96Å; F247-F272 HydrophobicContact CE2-CD2 3.96Å; F247-F272 AromaticContact CE2-CG 3.93Å; F247-F272 HydrophobicContact CE2-CG 3.93Å; F247-F272 HydrophobicContact CG-CB 4.25Å; F247-F272 HydrophobicContact CZ-CB 3.41Å; F247-F272 VanDerWaalsContact CZ-CB 3.41Å; F247-F272 HydrophobicContact CZ-CG 4.05Å; F247-F272 PolarHBondContact N-O 2.49Å; F247-F272 PolarHBondContact O-N 2.82Å; F247-N284 HydrophobicContact CZ-CB 4.39Å; F247-I297 HydrophobicContact CB-CG2 4.29Å; F247-I297 HydrophobicContact CD2-CG2 3.79Å; F247-I297 HydrophobicContact CE2-CG2 4.41Å; F247-I297 HydrophobicContact CG-CG2 4.18Å; F247-I298 CarbonylContact C-O 3.55Å; F247-I298 VanDerWaalsContact CA-O 3.24Å; F247-I298 WeakPolarHBondContact CA-O 3.46Å; F247-I298 WeakPolarHBondContact CB-O 3.46Å
248	K	96.9	Very high	94	Very high	52 Å²	52	51.9 Å²	51.9	23%	0.226	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	161.3	167.9	-69	179.5	179.7	-171.6	0	109.5	M260 D269 I271 I298 V300	K248-M260 HydrophobicContact CB-CE 3.66Å; K248-M260 HydrophobicContact CD-CE 3.49Å; K248-M260 VanDerWaalsContact CD-CE 3.49Å; K248-M260 HydrophobicContact CG-CE 4.18Å; K248-D269 HydrophobicContact CD-CB 3.99Å; K248-D269 IonicContact NZ-OD2 3.32Å; K248-D269 PolarHBondContact NZ-OD2 2.75Å; K248-I271 HydrophobicContact CG-CG1 4.18Å; K248-I298 HydrophobicContact CB-CB 4.42Å; K248-I298 PolarHBondContact N-O 2.57Å; K248-I298 PolarHBondContact O-N 2.94Å; K248-V300 HydrophobicContact CB-CG2 4.41Å; K248-V300 HydrophobicContact CD-CG2 4.28Å; K248-V300 HydrophobicContact CG-CG2 3.85Å
249	V	97.4	Very high	94.5	Very high	1 Å²	1	49.8 Å²	49.8	1%	0.006	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	137.1	176.3	-177.8	0	0	0	0	108.7	F247 Y261 F272 F286 I290 I295 R296 I297	F247-V249 HydrophobicContact CD2-CG2 3.95Å; F247-V249 HydrophobicContact CE2-CG2 3.76Å; V249-Y261 WeakPolarHBondContact O-CB 3.18Å; V249-Y261 PolarHBondContact O-N 2.93Å; V249-F272 HydrophobicContact CB-CE2 4.16Å; V249-F272 HydrophobicContact CG2-CD2 3.84Å; V249-F272 HydrophobicContact CG2-CE2 3.69Å; V249-F286 HydrophobicContact CG1-CZ 4.29Å; V249-F286 HydrophobicContact CG2-CE1 3.87Å; V249-F286 HydrophobicContact CG2-CZ 3.98Å; V249-I290 HydrophobicContact CG1-CD1 3.81Å; V249-I295 HydrophobicContact CG1-CD1 4.03Å; V249-I295 HydrophobicContact CG1-CG1 3.9Å; V249-R296 WeakPolarHBondContact CA-O 3.26Å; V249-I297 HydrophobicContact CG1-CD1 4.29Å; V249-I297 HydrophobicContact CG2-CD1 3.83Å
250	A	97.2	Very high	95.2	Very high	1 Å²	1	49.2 Å²	49.2	1%	0.008	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	148	171.6	0	0	0	0	0	110.1	F258 T259 M260 R296 I298	A250-F258 HydrophobicContact CB-CB 4.24Å; A250-F258 HydrophobicContact CB-CD1 4.13Å; A250-T259 CarbonylContact C-O 3.53Å; A250-T259 WeakPolarHBondContact CA-O 3.45Å; A250-M260 HydrophobicContact CB-SD 3.69Å; A250-R296 HydrophobicContact CB-CB 4.31Å; A250-R296 PolarHBondContact N-O 3Å; A250-R296 PolarHBondContact O-N 3.29Å; A250-I298 HydrophobicContact CB-CD1 3.97Å
251	S	97	Very high	95.4	Very high	14 Å²	14	46.9 Å²	46.9	10%	0.098	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.9	151	-176.7	51.1	0	0	0	0	112.1	T259 Y294	S251-T259 PolarHBondContact N-O 3.15Å; S251-T259 PolarHBondContact O-N 3.1Å; S251-T259 PolarHBondContact O-OG1 3.08Å; S251-T259 PolarHBondContact OG-OG1 2.67Å; S251-Y294 WeakPolarHBondContact CA-O 3.5Å
252	S	97.3	Very high	95.4	Very high	4 Å²	4	50.3 Å²	50.3	3%	0.028	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.4	148.1	-178.8	177.2	0	0	0	0	111.4	D254 G255 T257 Q293 Y294	S252-D254 PolarHBondContact OG-N 3.4Å; S252-D254 PolarHBondContact OG-OD1 3.49Å; S252-G255 WeakPolarHBondContact OG-CA 3.42Å; S252-G255 PolarHBondContact OG-N 2.87Å; S252-T257 WeakPolarHBondContact CB-O 3.43Å; S252-T257 PolarHBondContact OG-O 3.35Å; S252-Q293 PolarHBondContact O-N 3.14Å; S252-Y294 PolarHBondContact N-O 3.43Å; S252-Y294 PolarHBondContact O-N 3.14Å
253	Q	94.8	Very high	94.9	Very high	92 Å²	92	52.3 Å²	52.3	43%	0.43	26%	0.256	S	S	.	.	S	Bend	trans	-93.4	-30.1	172.2	-61	-65.2	2.6	0	0	112.1	T224 I291	T224-Q253 PolarHBondContact OG1-OE1 3.07Å; Q253-I291 PolarHBondContact NE2-O 2.65Å
254	D	92.7	Very high	94.1	Very high	75 Å²	75	59.9 Å²	59.9	40%	0.401	29%	0.291	S	S	.	.	S	Bend	trans	-106.3	-9.4	-172.5	63.8	0.5	0	0	0	113.5	S252 R256 T257	S252-D254 PolarHBondContact OG-N 3.4Å; S252-D254 PolarHBondContact OG-OD1 3.49Å; D254-R256 PolarHBondContact O-N 2.74Å; D254-R256 PolarHBondContact OD1-N 2.76Å; D254-T257 PolarHBondContact OD1-N 2.92Å; D254-T257 PolarHBondContact OD1-OG1 3.31Å; D254-T257 PolarHBondContact OD2-OG1 3.21Å
255	G	91.4	Very high	93	Very high	24 Å²	24	64 Å²	64	25%	0.247	33%	0.333	C	S	.	.	S	Bend	trans	73.3	5.1	-174.9	0	0	0	0	0	114.2	S252 F258	S252-G255 WeakPolarHBondContact OG-CA 3.42Å; S252-G255 PolarHBondContact OG-N 2.87Å; G255-F258 WeakPolarHBondContact O-CE2 3.29Å
256	R	91.1	Very high	92.4	Very high	218 Å²	218	63.7 Å²	63.7	82%	0.823	33%	0.334	S	S	*	.	S	Bend	trans	-111.5	-48.3	-179.3	-60.3	-177	-178.1	-149.9	0.4	111.3	D254	D254-R256 PolarHBondContact O-N 2.74Å; D254-R256 PolarHBondContact OD1-N 2.76Å
257	T	94.8	Very high	91.6	Very high	94 Å²	94	74.3 Å²	74.3	58%	0.577	37%	0.37	S	S	*	.	S	Bend	trans	-102.5	115	-177.8	56.7	0	0	0	0	109.9	S252 D254	S252-T257 WeakPolarHBondContact CB-O 3.43Å; S252-T257 PolarHBondContact OG-O 3.35Å; D254-T257 PolarHBondContact OD1-N 2.92Å; D254-T257 PolarHBondContact OD1-OG1 3.31Å; D254-T257 PolarHBondContact OD2-OG1 3.21Å
258	F	95.6	Very high	91	Very high	56 Å²	56	82.8 Å²	82.8	25%	0.246	41%	0.407	C	S	.	.			trans	-104.2	129.8	-179	-77.5	-94.3	0	0	0	110.9	Q218 A250 G255 R296	Q218-F258 HydrophobicContact CG-CZ 4.46Å; A250-F258 HydrophobicContact CB-CB 4.24Å; A250-F258 HydrophobicContact CB-CD1 4.13Å; G255-F258 WeakPolarHBondContact O-CE2 3.29Å; F258-R296 HydrophobicContact CD1-CB 4.15Å; F258-R296 HydrophobicContact CE1-CB 3.9Å
259	T	95.1	Very high	90.7	Very high	90 Å²	90	82.3 Å²	82.3	55%	0.552	41%	0.407	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-102.6	129.8	174.8	49.8	0	0	0	0	109.1	A250 S251	A250-T259 CarbonylContact C-O 3.53Å; A250-T259 WeakPolarHBondContact CA-O 3.45Å; S251-T259 PolarHBondContact N-O 3.15Å; S251-T259 PolarHBondContact O-N 3.1Å; S251-T259 PolarHBondContact O-OG1 3.08Å; S251-T259 PolarHBondContact OG-OG1 2.67Å
260	M	95.5	Very high	90.5	Very high	59 Å²	59	84.7 Å²	84.7	29%	0.291	42%	0.418	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.6	137.3	177.1	-63.6	-61.4	-70.4	0	0	109.8	K248 A250 D269 I298	K248-M260 HydrophobicContact CB-CE 3.66Å; K248-M260 HydrophobicContact CD-CE 3.49Å; K248-M260 VanDerWaalsContact CD-CE 3.49Å; K248-M260 HydrophobicContact CG-CE 4.18Å; A250-M260 HydrophobicContact CB-SD 3.69Å; M260-D269 HydrophobicContact CB-CB 4.38Å; M260-D269 HydrophobicContact CE-CB 4.42Å; M260-I298 HydrophobicContact CE-CD1 4.14Å; M260-I298 HydrophobicContact SD-CD1 4.06Å
261	Y	95.4	Very high	90.4	Very high	18 Å²	18	88.9 Å²	88.9	7%	0.071	44%	0.44	C	S	.	.	P	Polyproline II helix	trans	-67	133	177.7	-178.3	-98.5	0	0	0	111.5	V249 Q270 F272 F286 D287 P288 I290	V249-Y261 WeakPolarHBondContact O-CB 3.18Å; V249-Y261 PolarHBondContact O-N 2.93Å; Y261-Q270 HydrophobicContact CD1-CB 3.72Å; Y261-Q270 HydrophobicContact CD1-CG 4.08Å; Y261-Q270 HydrophobicContact CE1-CB 4.05Å; Y261-Q270 HydrophobicContact CE1-CG 4.04Å; Y261-Q270 PolarHBondContact O-N 2.73Å; Y261-F272 AromaticContact CD1-CE2 3.72Å; Y261-F272 HydrophobicContact CD1-CE2 3.72Å; Y261-F272 AromaticContact CD1-CZ 3.47Å; Y261-F272 HydrophobicContact CD1-CZ 3.47Å; Y261-F272 VanDerWaalsContact CD1-CZ 3.47Å; Y261-F272 HydrophobicContact CE1-CE1 4.48Å; Y261-F272 HydrophobicContact CE1-CE2 4.27Å; Y261-F272 AromaticContact CE1-CZ 3.56Å; Y261-F272 HydrophobicContact CE1-CZ 3.56Å; Y261-F272 HydrophobicContact CG-CZ 4.43Å; Y261-F286 HydrophobicContact CE2-CB 4.31Å; Y261-D287 WeakPolarHBondContact OH-CA 3.34Å; Y261-D287 PolarHBondContact OH-N 3.06Å; Y261-D287 PolarHBondContact OH-O 2.81Å; Y261-P288 WeakPolarHBondContact CE2-O 3.47Å; Y261-P288 WeakPolarHBondContact OH-CD 3.32Å; Y261-P288 PolarHBondContact OH-O 2.94Å; Y261-P288 VanDerWaalsContact OH-O 3.09Å; Y261-I290 HydrophobicContact CD2-CD1 3.48Å; Y261-I290 VanDerWaalsContact CD2-CD1 3.48Å; Y261-I290 HydrophobicContact CD2-CG1 3.49Å; Y261-I290 VanDerWaalsContact CD2-CG1 3.49Å; Y261-I290 HydrophobicContact CE2-CD1 4.02Å; Y261-I290 HydrophobicContact CE2-CG1 3.66Å; Y261-I290 HydrophobicContact CG-CD1 4.07Å
262	R	92.3	Very high	90.3	Very high	134 Å²	134	88.9 Å²	88.9	51%	0.506	44%	0.438	S	S	.	.			trans	-138.7	138.6	-178.8	-65.9	179.1	-175	161.1	2.8	109.6	D269	R262-D269 IonicContact CZ-OD1 2.85Å; R262-D269 IonicContact NE-OD1 3.43Å; R262-D269 PolarHBondContact NE-OD1 2.85Å; R262-D269 IonicContact NH2-OD1 2.7Å
263	T	86.1	Confident	90.2	Very high	42 Å²	42	91.4 Å²	91.4	26%	0.258	46%	0.459	S	S	.	.			trans	-79.2	149.5	174.1	-49	0	0	0	0	109.6	G265 Q266 Q270	T263-G265 PolarHBondContact O-N 2.78Å; T263-Q266 PolarHBondContact O-N 2.82Å; T263-Q270 PolarHBondContact OG1-OE1 3.16Å
264	E	78.2	Confident	90.2	Very high	162 Å²	162	87.3 Å²	87.3	76%	0.757	44%	0.441	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.4	129.4	-178.8	-160.3	168.7	-169.9	0	0	111	Q266	E264-Q266 PolarHBondContact O-N 2.93Å
265	G	75.3	Confident	90.4	Very high	86 Å²	86	84 Å²	84	89%	0.887	42%	0.424	S	S	*	.	T	Hydrogen-bonded Turn	trans	83.8	-5.8	-176.8	0	0	0	0	0	116.3	T263	T263-G265 PolarHBondContact O-N 2.78Å
266	Q	82.2	Confident	90.5	Very high	100 Å²	100	88.7 Å²	88.7	47%	0.467	45%	0.447	S	S	.	.			trans	-99.1	131.7	178	-63.5	-168.3	-2.8	0	0	113.2	T263 E264	T263-Q266 PolarHBondContact O-N 2.82Å; E264-Q266 PolarHBondContact O-N 2.93Å
267	R	79.4	Confident	90.5	Very high	238 Å²	238	81 Å²	81	90%	0.898	42%	0.422	S	S	*	.	S	Bend	trans	-81.9	-18.9	173	-70.4	-172.8	178.8	-174.1	0.3	113.8
268	K	85.8	Confident	90.4	Very high	178 Å²	178	78.2 Å²	78.2	77%	0.774	40%	0.404	S	S	*	.	S	Bend	trans	-94.4	150.4	-178.5	-68.6	-177.4	178.9	178.1	0	110.2	Q270	K268-Q270 PolarHBondContact O-N 2.85Å
269	D	90.9	Very high	90.1	Very high	43 Å²	43	79.3 Å²	79.3	23%	0.23	41%	0.412	C	S	.	.	P	Polyproline II helix	trans	-63.3	135.7	173.6	-45.5	-32.4	0	0	0	110	K248 M260 R262 I271	K248-D269 HydrophobicContact CD-CB 3.99Å; K248-D269 IonicContact NZ-OD2 3.32Å; K248-D269 PolarHBondContact NZ-OD2 2.75Å; M260-D269 HydrophobicContact CB-CB 4.38Å; M260-D269 HydrophobicContact CE-CB 4.42Å; R262-D269 IonicContact CZ-OD1 2.85Å; R262-D269 IonicContact NE-OD1 3.43Å; R262-D269 PolarHBondContact NE-OD1 2.85Å; R262-D269 IonicContact NH2-OD1 2.7Å; D269-I271 PolarHBondContact O-N 2.68Å
270	Q	92.6	Very high	90	Very high	50 Å²	50	76.2 Å²	76.2	23%	0.234	40%	0.398	C	S	.	.	P	Polyproline II helix	trans	-69	132.9	177.6	-179.9	64.1	46.7	0	0	110	Y261 T263 K268 F272	Y261-Q270 HydrophobicContact CD1-CB 3.72Å; Y261-Q270 HydrophobicContact CD1-CG 4.08Å; Y261-Q270 HydrophobicContact CE1-CB 4.05Å; Y261-Q270 HydrophobicContact CE1-CG 4.04Å; Y261-Q270 PolarHBondContact O-N 2.73Å; T263-Q270 PolarHBondContact OG1-OE1 3.16Å; K268-Q270 PolarHBondContact O-N 2.85Å; Q270-F272 HydrophobicContact CB-CE2 4.41Å; Q270-F272 HydrophobicContact CG-CD2 4.48Å; Q270-F272 HydrophobicContact CG-CE1 4.22Å; Q270-F272 HydrophobicContact CG-CE2 3.98Å; Q270-F272 HydrophobicContact CG-CZ 3.85Å
271	I	94.4	Very high	90	Very high	90 Å²	90	76.8 Å²	76.8	46%	0.462	41%	0.405	S	S	.	.			trans	-106.8	126.8	174.4	-60.4	168.4	0	0	0	108.2	A246 K248 D269	A246-I271 HydrophobicContact CB-CG2 3.89Å; K248-I271 HydrophobicContact CG-CG1 4.18Å; D269-I271 PolarHBondContact O-N 2.68Å
272	F	95.5	Very high	90.1	Very high	14 Å²	14	80.3 Å²	80.3	6%	0.061	42%	0.421	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.6	142.7	177.8	-64.6	-84.8	0	0	0	110.6	A246 F247 V249 Y261 Q270 N284 F286	A246-F272 VanDerWaalsContact CA-O 3.22Å; A246-F272 WeakPolarHBondContact CA-O 3.24Å; F247-F272 HydrophobicContact CD1-CB 4.07Å; F247-F272 HydrophobicContact CD2-CB 4.04Å; F247-F272 HydrophobicContact CD2-CD2 4.28Å; F247-F272 HydrophobicContact CE1-CB 3.65Å; F247-F272 HydrophobicContact CE2-CB 3.62Å; F247-F272 AromaticContact CE2-CD2 3.96Å; F247-F272 HydrophobicContact CE2-CD2 3.96Å; F247-F272 AromaticContact CE2-CG 3.93Å; F247-F272 HydrophobicContact CE2-CG 3.93Å; F247-F272 HydrophobicContact CG-CB 4.25Å; F247-F272 HydrophobicContact CZ-CB 3.41Å; F247-F272 VanDerWaalsContact CZ-CB 3.41Å; F247-F272 HydrophobicContact CZ-CG 4.05Å; F247-F272 PolarHBondContact N-O 2.49Å; F247-F272 PolarHBondContact O-N 2.82Å; V249-F272 HydrophobicContact CB-CE2 4.16Å; V249-F272 HydrophobicContact CG2-CD2 3.84Å; V249-F272 HydrophobicContact CG2-CE2 3.69Å; Y261-F272 AromaticContact CD1-CE2 3.72Å; Y261-F272 HydrophobicContact CD1-CE2 3.72Å; Y261-F272 AromaticContact CD1-CZ 3.47Å; Y261-F272 HydrophobicContact CD1-CZ 3.47Å; Y261-F272 VanDerWaalsContact CD1-CZ 3.47Å; Y261-F272 HydrophobicContact CE1-CE1 4.48Å; Y261-F272 HydrophobicContact CE1-CE2 4.27Å; Y261-F272 AromaticContact CE1-CZ 3.56Å; Y261-F272 HydrophobicContact CE1-CZ 3.56Å; Y261-F272 HydrophobicContact CG-CZ 4.43Å; Q270-F272 HydrophobicContact CB-CE2 4.41Å; Q270-F272 HydrophobicContact CG-CD2 4.48Å; Q270-F272 HydrophobicContact CG-CE1 4.22Å; Q270-F272 HydrophobicContact CG-CE2 3.98Å; Q270-F272 HydrophobicContact CG-CZ 3.85Å; F272-N284 HydrophobicContact CD1-CB 3.87Å; F272-F286 AromaticContact CE1-CD1 3.74Å; F272-F286 HydrophobicContact CE1-CD1 3.74Å; F272-F286 AromaticContact CE1-CE1 3.9Å; F272-F286 HydrophobicContact CE1-CE1 3.9Å; F272-F286 HydrophobicContact CE2-CD1 4.32Å; F272-F286 HydrophobicContact CE2-CE1 4.05Å; F272-F286 AromaticContact CZ-CD1 3.48Å; F272-F286 HydrophobicContact CZ-CD1 3.48Å; F272-F286 VanDerWaalsContact CZ-CD1 3.48Å; F272-F286 AromaticContact CZ-CE1 3.61Å; F272-F286 HydrophobicContact CZ-CE1 3.61Å
273	A	95.4	Very high	90.2	Very high	56 Å²	56	77.6 Å²	77.6	46%	0.463	42%	0.419	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.3	127.7	173.3	0	0	0	0	0	109.9	N284	A273-N284 PolarHBondContact O-ND2 2.86Å; A273-N284 PolarHBondContact O-OD1 2.95Å
274	G	94.6	Very high	90.6	Very high	6 Å²	6	76.6 Å²	76.6	6%	0.062	41%	0.412	C	S	.	.			trans	-87.4	-151.9	175.2	0	0	0	0	0	112.6	I244 K245	I244-G274 CarbonylContact O-C 3.54Å; I244-G274 WeakPolarHBondContact O-CA 3.32Å; K245-G274 WeakPolarHBondContact O-CA 3.25Å; K245-G274 PolarHBondContact O-N 2.03Å
275	N	96.2	Very high	91.3	Very high	7 Å²	7	72.9 Å²	72.9	4%	0.037	40%	0.397	C	S	.	.			trans	-81.9	161.2	-175.7	-62	82.7	0	0	0	112.2	T232 Q233 F243 I244 G280	T232-N275 WeakPolarHBondContact CB-OD1 3.25Å; T232-N275 PolarHBondContact O-ND2 2.56Å; T232-N275 PolarHBondContact OG1-OD1 2.92Å; Q233-N275 WeakPolarHBondContact CA-ND2 3.14Å; F243-N275 HydrophobicContact CB-CB 4.1Å; F243-N275 HydrophobicContact CD2-CB 4.02Å; F243-N275 VanDerWaalsContact CD2-O 3.23Å; F243-N275 WeakPolarHBondContact CD2-O 3.44Å; F243-N275 WeakPolarHBondContact CE2-O 3.36Å; F243-N275 HydrophobicContact CG-CB 4.23Å; I244-N275 PolarHBondContact O-N 3.16Å; N275-G280 PolarHBondContact ND2-O 2.88Å
276	V	93.8	Very high	92.2	Very high	122 Å²	122	68.8 Å²	68.8	74%	0.739	36%	0.355	S	S	*	.	S	Bend	trans	-110.8	-15.8	175.7	-65.7	0	0	0	0	112.7	F243	F243-V276 WeakPolarHBondContact CZ-O 3.38Å
277	D	92.5	Very high	92.5	Very high	56 Å²	56	68 Å²	68	30%	0.299	35%	0.354	S	S	.	.	S	Bend	trans	-142.9	-176.5	-178.1	60.5	16.6	0	0	0	110.7	F243 G280	F243-D277 VanDerWaalsContact CD1-C 3.44Å; F243-D277 WeakPolarHBondContact CD1-O 3.32Å; F243-D277 WeakPolarHBondContact CG-O 3.17Å; D277-G280 WeakPolarHBondContact OD1-CA 3.36Å; D277-G280 PolarHBondContact OD1-N 2.75Å; D277-G280 PolarHBondContact OD2-N 3.1Å
278	N	90.9	Very high	92.9	Very high	36 Å²	36	59.1 Å²	59.1	19%	0.193	33%	0.327	C	S	.	.	S	Bend	trans	-84.6	-25.4	-179.6	59.4	-63.7	0	0	0	114.9	G234 A235 Q241 R309	G234-N278 CarbonylContact C-O 3.44Å; G234-N278 VanDerWaalsContact CA-O 3.25Å; G234-N278 WeakPolarHBondContact CA-O 3.15Å; G234-N278 PolarHBondContact N-O 2.94Å; A235-N278 PolarHBondContact N-O 3.16Å; A235-N278 WeakPolarHBondContact O-CB 3.07Å; Q241-N278 HydrophobicContact CB-CB 3.8Å; N278-R309 PolarHBondContact O-NH2 2.87Å
279	D	90.3	Very high	93.2	Very high	78 Å²	78	52.2 Å²	52.2	42%	0.417	30%	0.301	S	S	.	.	S	Bend	trans	-123.5	-17.3	-170.8	-81.3	-38.8	0	0	0	114.4	Q233 R309	Q233-D279 PolarHBondContact NE2-O 3.29Å; D279-R309 IonicContact OD1-CZ 3.45Å; D279-R309 IonicContact OD1-NH1 3.43Å; D279-R309 IonicContact OD1-NH2 2.67Å; D279-R309 PolarHBondContact OD1-NH2 3.45Å
280	G	93.8	Very high	93.4	Very high	25 Å²	25	50.6 Å²	50.6	26%	0.258	29%	0.292	S	S	.	.			trans	-66.1	135	172.6	0	0	0	0	0	110.6	N275 D277	N275-G280 PolarHBondContact ND2-O 2.88Å; D277-G280 WeakPolarHBondContact OD1-CA 3.36Å; D277-G280 PolarHBondContact OD1-N 2.75Å; D277-G280 PolarHBondContact OD2-N 3.1Å
281	T	95.3	Very high	93.4	Very high	72 Å²	72	52 Å²	52	44%	0.442	30%	0.301	S	S	.	.			trans	-86.1	140.5	174.7	58.1	0	0	0	0	109.9	L197 V231 T232 Q233	L197-T281 HydrophobicContact CD1-CG2 4.02Å; L197-T281 HydrophobicContact CD2-CG2 4.47Å; L197-T281 HydrophobicContact CG-CG2 4.48Å; V231-T281 HydrophobicContact CG1-CG2 4.41Å; T232-T281 CarbonylContact O-C 3.4Å; T232-T281 WeakPolarHBondContact O-CA 3.3Å; Q233-T281 HydrophobicContact CB-CG2 4.33Å; Q233-T281 HydrophobicContact CG-CG2 4.3Å
282	K	96	Very high	93.4	Very high	91 Å²	91	47.8 Å²	47.8	40%	0.396	28%	0.279	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	122	175	-178.1	67.7	178	177.7	0	109.1	V231 T232	V231-K282 CarbonylContact C-O 3.6Å; V231-K282 WeakPolarHBondContact CA-O 3.1Å; T232-K282 PolarHBondContact N-O 3.4Å; T232-K282 PolarHBondContact O-N 2.86Å; T232-K282 PolarHBondContact OG1-O 2.96Å
283	T	94.7	Very high	93.4	Very high	77 Å²	77	49 Å²	49	47%	0.472	29%	0.285	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.5	131.3	176.6	-53.3	0	0	0	0	109.6	V231 L285	V231-T283 HydrophobicContact CG2-CG2 4.17Å; T283-L285 HydrophobicContact CG2-CD2 4.38Å
284	N	94.9	Very high	93.5	Very high	21 Å²	21	48.3 Å²	48.3	11%	0.112	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123	125.9	170.6	-71.3	-85.6	0	0	0	108.5	G229 V230 F247 F272 A273	G229-N284 CarbonylContact C-O 3.47Å; G229-N284 WeakPolarHBondContact CA-O 3.41Å; V230-N284 HydrophobicContact CG1-CB 4.34Å; V230-N284 PolarHBondContact N-O 2.88Å; V230-N284 PolarHBondContact O-N 3.23Å; F247-N284 HydrophobicContact CZ-CB 4.39Å; F272-N284 HydrophobicContact CD1-CB 3.87Å; A273-N284 PolarHBondContact O-ND2 2.86Å; A273-N284 PolarHBondContact O-OD1 2.95Å
285	L	93.2	Very high	93.7	Very high	84 Å²	84	48 Å²	48	44%	0.44	27%	0.267	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.7	149.4	174.4	-61	177.8	0	0	0	110.2	T228 T283	T228-L285 CarbonylContact O-C 3.52Å; T228-L285 VanDerWaalsContact O-CA 3.28Å; T228-L285 WeakPolarHBondContact O-CA 3.46Å; T283-L285 HydrophobicContact CG2-CD2 4.38Å
286	F	93.3	Very high	93.7	Very high	0 Å²	0	49.9 Å²	49.9	0%	0	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.4	121.6	174.1	-53.7	-41.1	0	0	0	108.7	S148 F227 T228 V230 V249 Y261 F272 P288 I290 I295	S148-F286 WeakPolarHBondContact CB-O 3.47Å; S148-F286 PolarHBondContact OG-O 3.32Å; F227-F286 HydrophobicContact CB-CD2 4.13Å; F227-F286 HydrophobicContact CB-CE2 4.21Å; T228-F286 PolarHBondContact O-N 3.14Å; V230-F286 HydrophobicContact CB-CZ 4.06Å; V230-F286 HydrophobicContact CG1-CE1 4.18Å; V230-F286 HydrophobicContact CG1-CZ 3.75Å; V249-F286 HydrophobicContact CG1-CZ 4.29Å; V249-F286 HydrophobicContact CG2-CE1 3.87Å; V249-F286 HydrophobicContact CG2-CZ 3.98Å; Y261-F286 HydrophobicContact CE2-CB 4.31Å; F272-F286 AromaticContact CE1-CD1 3.74Å; F272-F286 HydrophobicContact CE1-CD1 3.74Å; F272-F286 AromaticContact CE1-CE1 3.9Å; F272-F286 HydrophobicContact CE1-CE1 3.9Å; F272-F286 HydrophobicContact CE2-CD1 4.32Å; F272-F286 HydrophobicContact CE2-CE1 4.05Å; F272-F286 AromaticContact CZ-CD1 3.48Å; F272-F286 HydrophobicContact CZ-CD1 3.48Å; F272-F286 VanDerWaalsContact CZ-CD1 3.48Å; F272-F286 AromaticContact CZ-CE1 3.61Å; F272-F286 HydrophobicContact CZ-CE1 3.61Å; F286-P288 CarbonylContact C-O 3.56Å; F286-P288 CarbonylContact O-C 3.54Å; F286-I290 HydrophobicContact CB-CD1 4.41Å; F286-I290 HydrophobicContact CB-CG1 4.2Å; F286-I290 HydrophobicContact CD1-CD1 4.3Å; F286-I290 HydrophobicContact CD2-CD1 3.69Å; F286-I290 HydrophobicContact CD2-CG1 4.06Å; F286-I290 HydrophobicContact CE2-CD1 3.98Å; F286-I290 HydrophobicContact CG-CD1 3.88Å; F286-I290 HydrophobicContact CG-CG1 4.17Å; F286-I290 HydrophobicContact CZ-CD1 4.4Å; F286-I295 HydrophobicContact CE2-CD1 4.09Å
287	D	88.5	Confident	93.9	Very high	83 Å²	83	44.1 Å²	44.1	44%	0.444	24%	0.239	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.2	104.3	174.9	-168.9	20.6	0	0	0	109.5	Y261	Y261-D287 WeakPolarHBondContact OH-CA 3.34Å; Y261-D287 PolarHBondContact OH-N 3.06Å; Y261-D287 PolarHBondContact OH-O 2.81Å
288	P	89	Confident	94.1	Very high	52 Å²	52	43.1 Å²	43.1	34%	0.338	23%	0.233	S	C	.	.	E	Extended strand (participates in β ladder)	cis	-72.9	158.5	6.9	31.2	-36.6	0	0	0	114.5	Y261 F286	Y261-P288 WeakPolarHBondContact CE2-O 3.47Å; Y261-P288 WeakPolarHBondContact OH-CD 3.32Å; Y261-P288 PolarHBondContact OH-O 2.94Å; Y261-P288 VanDerWaalsContact OH-O 3.09Å; F286-P288 CarbonylContact C-O 3.56Å; F286-P288 CarbonylContact O-C 3.54Å
289	P	91.8	Very high	94.4	Very high	34 Å²	34	41.8 Å²	41.8	22%	0.221	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-65	145	176.1	27.8	-35.2	0	0	0	112.2	R226 F227 T228	R226-P289 HydrophobicContact CG-CB 4.05Å; F227-P289 CarbonylContact O-C 3.54Å; F227-P289 WeakPolarHBondContact O-CA 3.18Å; T228-P289 HydrophobicContact CG2-CB 4.12Å
290	I	94	Very high	94.7	Very high	9 Å²	9	41.6 Å²	41.6	5%	0.046	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.2	128.3	-177.1	-56.3	175.1	0	0	0	109.5	R226 F227 V249 Y261 F286 A292	R226-I290 CarbonylContact C-O 3.58Å; R226-I290 WeakPolarHBondContact CA-O 3.02Å; F227-I290 HydrophobicContact CB-CB 4.25Å; F227-I290 HydrophobicContact CD2-CB 4.39Å; F227-I290 HydrophobicContact CD2-CG2 4.28Å; F227-I290 PolarHBondContact N-O 2.82Å; F227-I290 PolarHBondContact O-N 2.91Å; V249-I290 HydrophobicContact CG1-CD1 3.81Å; Y261-I290 HydrophobicContact CD2-CD1 3.48Å; Y261-I290 VanDerWaalsContact CD2-CD1 3.48Å; Y261-I290 HydrophobicContact CD2-CG1 3.49Å; Y261-I290 VanDerWaalsContact CD2-CG1 3.49Å; Y261-I290 HydrophobicContact CE2-CD1 4.02Å; Y261-I290 HydrophobicContact CE2-CG1 3.66Å; Y261-I290 HydrophobicContact CG-CD1 4.07Å; F286-I290 HydrophobicContact CB-CD1 4.41Å; F286-I290 HydrophobicContact CB-CG1 4.2Å; F286-I290 HydrophobicContact CD1-CD1 4.3Å; F286-I290 HydrophobicContact CD2-CD1 3.69Å; F286-I290 HydrophobicContact CD2-CG1 4.06Å; F286-I290 HydrophobicContact CE2-CD1 3.98Å; F286-I290 HydrophobicContact CG-CD1 3.88Å; F286-I290 HydrophobicContact CG-CG1 4.17Å; F286-I290 HydrophobicContact CZ-CD1 4.4Å; I290-A292 HydrophobicContact CG2-CB 4.18Å
291	I	93.1	Very high	94.8	Very high	80 Å²	80	43.9 Å²	43.9	41%	0.41	24%	0.237	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	111.7	173.2	-62.2	172.9	0	0	0	108.2	T224 M225 R226 Q253 L317	T224-I291 HydrophobicContact CG2-CG2 3.55Å; M225-I291 WeakPolarHBondContact O-CA 2.99Å; R226-I291 HydrophobicContact CG-CG1 4.46Å; Q253-I291 PolarHBondContact NE2-O 2.65Å; I291-L317 HydrophobicContact CB-CD2 4.42Å; I291-L317 HydrophobicContact CD1-CD2 3.88Å; I291-L317 HydrophobicContact CG1-CD2 3.92Å; I291-L317 HydrophobicContact CG2-CD1 3.99Å; I291-L317 HydrophobicContact CG2-CD2 3.7Å; I291-L317 HydrophobicContact CG2-CG 4.34Å
292	A	95.5	Very high	94.7	Very high	1 Å²	1	42.2 Å²	42.2	1%	0.008	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-162.3	160.8	-177.2	0	0	0	0	0	112.8	M225 F227 I290	M225-A292 PolarHBondContact N-O 3.38Å; M225-A292 PolarHBondContact O-N 3.35Å; F227-A292 HydrophobicContact CE2-CB 4.11Å; F227-A292 VanDerWaalsContact CE2-O 3.26Å; F227-A292 WeakPolarHBondContact CE2-O 3.26Å; I290-A292 HydrophobicContact CG2-CB 4.18Å
293	Q	94.9	Very high	94.7	Very high	40 Å²	40	42 Å²	42	19%	0.187	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.1	-37.4	167.4	176.6	176	-20.9	0	0	112	N220 M221 R223 S252	N220-Q293 PolarHBondContact OD1-NE2 3.15Å; M221-Q293 WeakPolarHBondContact CB-O 3.44Å; M221-Q293 PolarHBondContact N-O 2.78Å; R223-Q293 WeakPolarHBondContact O-CA 3.02Å; S252-Q293 PolarHBondContact O-N 3.14Å
294	Y	97.7	Very high	94.6	Very high	40 Å²	40	46.8 Å²	46.8	16%	0.157	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	131.4	-179.7	-61.9	-96.9	0	0	0	109.8	I219 N220 S251 S252	I219-Y294 WeakPolarHBondContact O-CA 3.23Å; N220-Y294 HydrophobicContact CB-CD1 3.82Å; N220-Y294 HydrophobicContact CB-CE1 3.55Å; N220-Y294 PolarHBondContact ND2-OH 3.18Å; S251-Y294 WeakPolarHBondContact CA-O 3.5Å; S252-Y294 PolarHBondContact N-O 3.43Å; S252-Y294 PolarHBondContact O-N 3.14Å
295	I	97.5	Very high	94.5	Very high	0 Å²	0	46.1 Å²	46.1	0%	0	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	137.8	171.6	-167	166.5	0	0	0	109.4	Q218 I219 F227 V249 F286 L312	Q218-I295 CarbonylContact C-O 3.38Å; Q218-I295 VanDerWaalsContact CA-O 3.32Å; Q218-I295 WeakPolarHBondContact CA-O 3.27Å; I219-I295 HydrophobicContact CB-CG2 4.08Å; I219-I295 HydrophobicContact CD1-CG2 4.05Å; I219-I295 PolarHBondContact N-O 3.26Å; I219-I295 PolarHBondContact O-N 2.88Å; I219-I295 VanDerWaalsContact O-N 3.14Å; F227-I295 HydrophobicContact CB-CD1 4.15Å; F227-I295 HydrophobicContact CD1-CD1 4.1Å; F227-I295 HydrophobicContact CD2-CB 4.5Å; F227-I295 HydrophobicContact CD2-CD1 4.02Å; F227-I295 HydrophobicContact CE1-CB 4.44Å; F227-I295 HydrophobicContact CE1-CD1 4.49Å; F227-I295 HydrophobicContact CE1-CG2 4Å; F227-I295 HydrophobicContact CE2-CB 4.05Å; F227-I295 HydrophobicContact CE2-CD1 4.41Å; F227-I295 HydrophobicContact CE2-CG2 4.44Å; F227-I295 HydrophobicContact CG-CD1 3.83Å; F227-I295 HydrophobicContact CZ-CB 4.01Å; F227-I295 HydrophobicContact CZ-CG2 3.9Å; V249-I295 HydrophobicContact CG1-CD1 4.03Å; V249-I295 HydrophobicContact CG1-CG1 3.9Å; F286-I295 HydrophobicContact CE2-CD1 4.09Å; I295-L312 HydrophobicContact CD1-CD2 4.24Å; I295-L312 HydrophobicContact CG2-CD1 3.65Å; I295-L312 HydrophobicContact CG2-CD2 4.07Å
296	R	97.4	Very high	94.6	Very high	47 Å²	47	43.2 Å²	43.2	18%	0.177	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	124.9	-178.4	-177	-178.7	-85.3	-168.1	-1.7	109.6	W216 I217 Q218 V249 A250 F258 I298	W216-R296 HydrophobicContact CB-CG 3.66Å; W216-R296 HydrophobicContact CD2-CG 4.43Å; W216-R296 VanDerWaalsContact CD2-NE 3.3Å; W216-R296 HydrophobicContact CE3-CG 4.33Å; W216-R296 HydrophobicContact CG-CG 4.18Å; I217-R296 CarbonylContact O-C 3.6Å; I217-R296 VanDerWaalsContact O-CA 3.28Å; I217-R296 WeakPolarHBondContact O-CA 3.07Å; Q218-R296 HydrophobicContact CB-CB 4.49Å; Q218-R296 HydrophobicContact CB-CG 4.5Å; V249-R296 WeakPolarHBondContact CA-O 3.26Å; A250-R296 HydrophobicContact CB-CB 4.31Å; A250-R296 PolarHBondContact N-O 3Å; A250-R296 PolarHBondContact O-N 3.29Å; F258-R296 HydrophobicContact CD1-CB 4.15Å; F258-R296 HydrophobicContact CE1-CB 3.9Å; R296-I298 HydrophobicContact CG-CD1 4.41Å; R296-I298 HydrophobicContact CG-CG1 3.92Å
297	I	97.6	Very high	94.7	Very high	0 Å²	0	43.2 Å²	43.2	0%	0	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.5	127.8	172.8	-53.4	-58.1	0	0	0	108	W216 I217 V230 F247 V249 L308 M310	W216-I297 WeakPolarHBondContact CA-O 3.43Å; I217-I297 HydrophobicContact CG2-CB 3.86Å; I217-I297 PolarHBondContact N-O 2.83Å; I217-I297 PolarHBondContact O-N 3.37Å; V230-I297 HydrophobicContact CG2-CD1 4.44Å; F247-I297 HydrophobicContact CB-CG2 4.29Å; F247-I297 HydrophobicContact CD2-CG2 3.79Å; F247-I297 HydrophobicContact CE2-CG2 4.41Å; F247-I297 HydrophobicContact CG-CG2 4.18Å; V249-I297 HydrophobicContact CG1-CD1 4.29Å; V249-I297 HydrophobicContact CG2-CD1 3.83Å; I297-L308 HydrophobicContact CG2-CD2 4.1Å; I297-M310 HydrophobicContact CG1-SD 3.93Å
298	I	97.6	Very high	95.1	Very high	36 Å²	36	39.3 Å²	39.3	19%	0.185	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	97.1	-173	-54.2	174	0	0	0	108.1	W216 F247 K248 A250 M260 R296 V300	W216-I298 HydrophobicContact CB-CG1 4.13Å; F247-I298 CarbonylContact C-O 3.55Å; F247-I298 VanDerWaalsContact CA-O 3.24Å; F247-I298 WeakPolarHBondContact CA-O 3.46Å; F247-I298 WeakPolarHBondContact CB-O 3.46Å; K248-I298 HydrophobicContact CB-CB 4.42Å; K248-I298 PolarHBondContact N-O 2.57Å; K248-I298 PolarHBondContact O-N 2.94Å; A250-I298 HydrophobicContact CB-CD1 3.97Å; M260-I298 HydrophobicContact CE-CD1 4.14Å; M260-I298 HydrophobicContact SD-CD1 4.06Å; R296-I298 HydrophobicContact CG-CD1 4.41Å; R296-I298 HydrophobicContact CG-CG1 3.92Å; I298-V300 PolarHBondContact O-N 3.33Å
299	P	97.2	Very high	95.5	Very high	8 Å²	8	36.8 Å²	36.8	5%	0.052	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-57.7	131.5	173.2	-25.1	35.7	0	0	0	111.7	W206 P215 I244 C306	W206-P299 HydrophobicContact CH2-CG 4.19Å; W206-P299 HydrophobicContact CZ3-CG 4.1Å; P215-P299 HydrophobicContact CG-CB 4.31Å; P215-P299 VanDerWaalsContact O-CD 3.31Å; P215-P299 WeakPolarHBondContact O-CD 3.36Å; I244-P299 HydrophobicContact CG2-CB 3.75Å; I244-P299 HydrophobicContact CG2-CG 3.89Å; P299-C306 HydrophobicContact CB-CB 4.07Å; P299-C306 HydrophobicContact CG-CB 4.39Å
300	V	94.9	Very high	95.7	Very high	74 Å²	74	35.2 Å²	35.2	45%	0.448	18%	0.175	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	-45.1	-179.9	-179.6	0	0	0	0	110.9	A246 K248 I298	A246-V300 PolarHBondContact O-N 2.87Å; K248-V300 HydrophobicContact CB-CG2 4.41Å; K248-V300 HydrophobicContact CD-CG2 4.28Å; K248-V300 HydrophobicContact CG-CG2 3.85Å; I298-V300 PolarHBondContact O-N 3.33Å
301	V	95.8	Very high	95.8	Very high	72 Å²	72	34.8 Å²	34.8	44%	0.436	17%	0.173	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	128.7	179.5	-174.6	0	0	0	0	108	K245 A246	K245-V301 WeakPolarHBondContact CA-O 3.37Å; K245-V301 HydrophobicContact CB-CB 4.19Å; K245-V301 HydrophobicContact CB-CG1 4.03Å; K245-V301 HydrophobicContact CD-CG1 4.27Å; K245-V301 PolarHBondContact N-O 2.9Å; A246-V301 HydrophobicContact CB-CB 4.03Å; A246-V301 HydrophobicContact CB-CG2 4.09Å; A246-V301 PolarHBondContact N-O 2.97Å; A246-V301 VanDerWaalsContact N-O 3.17Å; A246-V301 PolarHBondContact O-N 3.4Å; A246-V301 VanDerWaalsContact O-N 3.13Å
302	C	95.2	Very high	95.9	Very high	37 Å²	37	31 Å²	31	25%	0.25	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	147.4	-175	-53.6	0	0	0	0	110.8	C306	C302-C306 HydrophobicContact CB-CB 3.94Å; C302-C306 WeakPolarHBondContact CB-SG 3.48Å; C302-C306 WeakPolarHBondContact SG-CA 3.31Å; C302-C306 WeakPolarHBondContact SG-CB 3.48Å; C302-C306 CovalentContact SG-SG 2.03Å; C302-C306 PolarHBondContact SG-SG 3.05Å
303	R	94.4	Very high	95.8	Very high	88 Å²	88	31.4 Å²	31.4	33%	0.332	16%	0.155	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.1	114.4	170.2	-175.1	-177.6	-174.9	165.6	-2.1	108.9	Q241 E242 F243 A305	Q241-R303 VanDerWaalsContact CD-CZ 3.45Å; Q241-R303 VanDerWaalsContact OE1-NH1 3.16Å; E242-R303 WeakPolarHBondContact CA-O 3.47Å; F243-R303 HydrophobicContact CD1-CB 4.31Å; F243-R303 HydrophobicContact CD2-CB 4.13Å; F243-R303 HydrophobicContact CE1-CB 4.18Å; F243-R303 HydrophobicContact CE1-CG 4.28Å; F243-R303 HydrophobicContact CE2-CB 3.95Å; F243-R303 HydrophobicContact CG-CB 4.31Å; F243-R303 HydrophobicContact CZ-CB 3.99Å; F243-R303 HydrophobicContact CZ-CG 4.23Å; F243-R303 PolarHBondContact N-O 3.03Å; F243-R303 PolarHBondContact O-N 2.89Å; R303-A305 PolarHBondContact O-N 3.41Å
304	K	92.6	Very high	95.6	Very high	177 Å²	177	29.5 Å²	29.5	77%	0.77	15%	0.147	S	C	*	.	S	Bend	trans	63.3	-50.9	-179.7	-64.1	-70.5	-173.3	177.3	0	114.6	E242	E242-K304 HydrophobicContact CG-CB 4.14Å
305	A	92.9	Very high	95.1	Very high	6 Å²	6	27.6 Å²	27.6	5%	0.05	14%	0.139	C	C	.	.	S	Bend	trans	-145.3	155.4	172.4	0	0	0	0	0	110.2	E242 R303 T307	E242-A305 HydrophobicContact CB-CB 4.39Å; E242-A305 HydrophobicContact CG-CB 4.31Å; R303-A305 PolarHBondContact O-N 3.41Å; A305-T307 VanDerWaalsContact C-N 3.33Å; A305-T307 PolarHBondContact O-N 2.83Å; A305-T307 VanDerWaalsContact O-N 3.08Å
306	C	95.9	Very high	94.3	Very high	24 Å²	24	28.7 Å²	28.7	16%	0.162	15%	0.145	C	C	.	.			trans	-81.3	85.7	173.5	-60	0	0	0	0	109.1	S207 A208 P215 I244 P299 C302	S207-C306 WeakPolarHBondContact CA-O 3.44Å; A208-C306 HydrophobicContact CB-CB 4.1Å; A208-C306 PolarHBondContact N-O 2.95Å; P215-C306 HydrophobicContact CG-CB 4.43Å; I244-C306 HydrophobicContact CG2-CB 4.45Å; P299-C306 HydrophobicContact CB-CB 4.07Å; P299-C306 HydrophobicContact CG-CB 4.39Å; C302-C306 HydrophobicContact CB-CB 3.94Å; C302-C306 WeakPolarHBondContact CB-SG 3.48Å; C302-C306 WeakPolarHBondContact SG-CA 3.31Å; C302-C306 WeakPolarHBondContact SG-CB 3.48Å; C302-C306 CovalentContact SG-SG 2.03Å; C302-C306 PolarHBondContact SG-SG 3.05Å
307	T	96	Very high	93.4	Very high	0 Å²	0	29.5 Å²	29.5	0%	0	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	134.1	-177.3	-51.6	0	0	0	0	110	W190 A205 W206 S207 A235 E242 F243 I244 A305	W190-T307 HydrophobicContact CE3-CG2 4.16Å; W190-T307 HydrophobicContact CZ3-CG2 4.03Å; A205-T307 HydrophobicContact CB-CG2 3.6Å; W206-T307 CarbonylContact O-C 3.53Å; W206-T307 VanDerWaalsContact O-CA 3.27Å; W206-T307 WeakPolarHBondContact O-CA 3.43Å; W206-T307 WeakPolarHBondContact O-CG2 3Å; S207-T307 PolarHBondContact OG-OG1 3.26Å; A235-T307 HydrophobicContact CB-CG2 3.7Å; E242-T307 WeakPolarHBondContact CB-OG1 3.33Å; E242-T307 PolarHBondContact OE2-OG1 3.28Å; F243-T307 WeakPolarHBondContact CA-O 3.26Å; I244-T307 PolarHBondContact N-O 3.42Å; A305-T307 VanDerWaalsContact C-N 3.33Å; A305-T307 PolarHBondContact O-N 2.83Å; A305-T307 VanDerWaalsContact O-N 3.08Å
308	L	96.9	Very high	91.9	Very high	0 Å²	0	35.9 Å²	35.9	0%	0	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.2	133.7	-172.3	177.6	66	0	0	0	112.3	W206 I217 T232 I244 I297 M310	W206-L308 HydrophobicContact CE3-CB 4.02Å; W206-L308 HydrophobicContact CE3-CD2 4.49Å; W206-L308 HydrophobicContact CZ3-CB 4.36Å; W206-L308 HydrophobicContact CZ3-CD2 4.4Å; W206-L308 PolarHBondContact N-O 3.01Å; W206-L308 VanDerWaalsContact N-O 3.16Å; W206-L308 PolarHBondContact O-N 2.86Å; I217-L308 HydrophobicContact CG2-CD2 4.09Å; T232-L308 HydrophobicContact CG2-CD1 3.85Å; I244-L308 HydrophobicContact CD1-CD1 3.68Å; I244-L308 HydrophobicContact CD1-CD2 4.21Å; I244-L308 HydrophobicContact CD1-CG 4.42Å; I244-L308 HydrophobicContact CG1-CD1 4.11Å; I297-L308 HydrophobicContact CG2-CD2 4.1Å; L308-M310 HydrophobicContact CD1-CB 4.25Å; L308-M310 HydrophobicContact CD2-CB 4.42Å; L308-M310 HydrophobicContact CD2-CG 4.47Å; L308-M310 HydrophobicContact CD2-SD 3.87Å; L308-M310 HydrophobicContact CG-CB 4.24Å
309	R	97.5	Very high	90.2	Very high	0 Å²	0	34.9 Å²	34.9	0%	0	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	139.6	156.3	-71.5	178.1	-73	179.4	0.2	107.5	R196 N199 N204 A205 T232 Q233 G234 N278 D279	R196-R309 WeakPolarHBondContact O-CB 3.15Å; R196-R309 WeakPolarHBondContact O-CD 3.29Å; R196-R309 WeakPolarHBondContact O-CG 3.42Å; N199-R309 PolarHBondContact O-NH1 2.98Å; N204-R309 PolarHBondContact ND2-NH1 3.25Å; N204-R309 VanDerWaalsContact O-CD 3.3Å; N204-R309 WeakPolarHBondContact O-CD 3.47Å; N204-R309 WeakPolarHBondContact O-CG 3.35Å; A205-R309 HydrophobicContact CB-CG 3.69Å; T232-R309 CarbonylContact C-O 3.37Å; T232-R309 WeakPolarHBondContact CA-O 3.46Å; Q233-R309 HydrophobicContact CB-CB 4.06Å; Q233-R309 VanDerWaalsContact CD-NH2 3.28Å; Q233-R309 PolarHBondContact N-O 2.75Å; Q233-R309 PolarHBondContact O-N 2.9Å; G234-R309 PolarHBondContact O-NE 2.75Å; G234-R309 PolarHBondContact O-NH2 2.96Å; N278-R309 PolarHBondContact O-NH2 2.87Å; D279-R309 IonicContact OD1-CZ 3.45Å; D279-R309 IonicContact OD1-NH1 3.43Å; D279-R309 IonicContact OD1-NH2 2.67Å; D279-R309 PolarHBondContact OD1-NH2 3.45Å
310	M	96.1	Very high	89.1	Confident	0 Å²	0	34.5 Å²	34.5	0%	0	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.7	162.2	-177.9	66.7	-176.4	174.7	0	0	113.8	M165 A195 L197 I217 I219 V230 V231 I297 L308	M165-M310 VanDerWaalsContact CB-O 3.23Å; M165-M310 WeakPolarHBondContact CB-O 3.45Å; M165-M310 HydrophobicContact CE-CE 3.64Å; M165-M310 HydrophobicContact CE-CG 4.05Å; A195-M310 PolarHBondContact O-N 2.91Å; L197-M310 PolarHBondContact N-O 2.95Å; I217-M310 HydrophobicContact CD1-CE 3.82Å; I217-M310 HydrophobicContact CG1-CE 4.01Å; I217-M310 HydrophobicContact CG2-CE 3.91Å; I217-M310 HydrophobicContact CG2-SD 4.27Å; I219-M310 HydrophobicContact CD1-CE 3.26Å; I219-M310 HydrophobicContact CD1-SD 4.34Å; I219-M310 HydrophobicContact CG1-CE 3.88Å; V230-M310 HydrophobicContact CG2-CB 4.36Å; V231-M310 CarbonylContact O-C 3.54Å; V231-M310 WeakPolarHBondContact O-CA 3.44Å; V231-M310 VanDerWaalsContact O-CB 3.3Å; V231-M310 WeakPolarHBondContact O-CB 3.49Å; I297-M310 HydrophobicContact CG1-SD 3.93Å; L308-M310 HydrophobicContact CD1-CB 4.25Å; L308-M310 HydrophobicContact CD2-CB 4.42Å; L308-M310 HydrophobicContact CD2-CG 4.47Å; L308-M310 HydrophobicContact CD2-SD 3.87Å; L308-M310 HydrophobicContact CG-CB 4.24Å
311	E	95.9	Very high	88.2	Confident	1 Å²	1	31.3 Å²	31.3	1%	0.005	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.9	136.2	166.6	179.8	60	-92.9	0	0	109.2	L162 G164 M165 E166 L197 V231	L162-E311 HydrophobicContact CB-CG 3.93Å; L162-E311 HydrophobicContact CD1-CG 4.41Å; L162-E311 HydrophobicContact CD2-CG 3.79Å; L162-E311 HydrophobicContact CG-CG 4.23Å; G164-E311 PolarHBondContact N-OE1 2.8Å; G164-E311 VanDerWaalsContact N-OE1 3.1Å; M165-E311 WeakPolarHBondContact CB-OE1 3.3Å; M165-E311 PolarHBondContact N-OE1 3.08Å; M165-E311 PolarHBondContact N-OE2 3.33Å; E166-E311 WeakPolarHBondContact CB-OE2 3.4Å; E166-E311 PolarHBondContact N-OE2 3.4Å; L197-E311 HydrophobicContact CB-CB 4.17Å; L197-E311 HydrophobicContact CD2-CB 4.16Å; V231-E311 HydrophobicContact CB-CB 4.33Å; V231-E311 PolarHBondContact N-O 2.88Å; V231-E311 PolarHBondContact O-N 2.7Å
312	L	95.3	Very high	87.5	Confident	0 Å²	0	29.8 Å²	29.8	0%	0	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.8	138.1	178.2	-68.6	174.7	0	0	0	109.1	L163 M165 I170 I219 M221 F227 V230 I295	L163-L312 HydrophobicContact CB-CB 4.14Å; L163-L312 HydrophobicContact CD1-CB 4.03Å; L163-L312 HydrophobicContact CG-CB 4.36Å; L163-L312 PolarHBondContact N-O 2.84Å; M165-L312 HydrophobicContact CG-CG 4.45Å; I170-L312 HydrophobicContact CD1-CD1 4.45Å; I219-L312 HydrophobicContact CB-CD1 3.99Å; I219-L312 HydrophobicContact CD1-CD1 4.15Å; I219-L312 HydrophobicContact CG1-CD1 3.94Å; I219-L312 HydrophobicContact CG2-CD1 4.04Å; M221-L312 HydrophobicContact SD-CD1 4.39Å; F227-L312 HydrophobicContact CE1-CD1 4.08Å; V230-L312 HydrophobicContact CB-CD2 4.49Å; V230-L312 HydrophobicContact CG2-CD2 4.18Å; I295-L312 HydrophobicContact CD1-CD2 4.24Å; I295-L312 HydrophobicContact CG2-CD1 3.65Å; I295-L312 HydrophobicContact CG2-CD2 4.07Å
313	V	93.6	Very high	87.2	Confident	9 Å²	9	31 Å²	31	6%	0.055	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	130.1	-177.9	-174.7	0	0	0	0	108.8	I160 S161 L162 T228 G229 V231	I160-V313 HydrophobicContact CB-CG1 4.04Å; I160-V313 WeakPolarHBondContact O-CG1 3.4Å; S161-V313 WeakPolarHBondContact O-CA 3.34Å; L162-V313 HydrophobicContact CD2-CG2 4.13Å; T228-V313 PolarHBondContact N-O 3.22Å; T228-V313 PolarHBondContact OG1-O 3.19Å; G229-V313 PolarHBondContact N-O 3.26Å; G229-V313 VanDerWaalsContact N-O 3.15Å; G229-V313 PolarHBondContact O-N 3.17Å; V231-V313 HydrophobicContact CG2-CG2 3.85Å
314	G	90.5	Very high	86.9	Confident	0 Å²	0	27.9 Å²	27.9	0%	0	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	173.3	-164.7	-177.5	0	0	0	0	0	113.8	S161 R226	S161-G314 WeakPolarHBondContact CB-O 3.34Å; S161-G314 PolarHBondContact N-O 2.92Å; S161-G314 VanDerWaalsContact N-O 3.16Å; S161-G314 PolarHBondContact O-N 3.04Å; R226-G314 CarbonylContact O-C 3.19Å; R226-G314 WeakPolarHBondContact O-CA 3.45Å
315	C	85.3	Confident	86.7	Confident	1 Å²	1	19.4 Å²	19.4	1%	0.007	11%	0.111	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-154.4	172.6	178	63.1	0	0	0	0	110.1	C159 R226	C159-C315 HydrophobicContact CB-CB 3.96Å; C159-C315 WeakPolarHBondContact CB-SG 3.21Å; C159-C315 WeakPolarHBondContact SG-CB 3.33Å; C159-C315 PolarHBondContact SG-N 2.68Å; C159-C315 CovalentContact SG-SG 2.02Å; C159-C315 PolarHBondContact SG-SG 2.71Å; R226-C315 WeakPolarHBondContact CB-O 3.02Å; R226-C315 PolarHBondContact N-O 2.87Å; R226-C315 PolarHBondContact O-N 2.8Å
316	E	81.6	Confident	86.7	Confident	23 Å²	23	19.1 Å²	19.1	11%	0.107	11%	0.109	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.4	151.7	175.6	-72.6	161.4	-145.2	0	0	111.4	M225 N318 G319 K445 I447	M225-E316 HydrophobicContact CE-CG 3.65Å; M225-E316 HydrophobicContact SD-CG 3.7Å; E316-N318 PolarHBondContact O-N 2.89Å; E316-G319 PolarHBondContact O-N 3.43Å; E316-K445 IonicContact OE1-NZ 2.68Å; E316-K445 PolarHBondContact OE1-NZ 2.92Å; E316-I447 WeakPolarHBondContact OE1-CD1 3.12Å
317	L	77.8	Confident	86.3	Confident	63 Å²	63	23.3 Å²	23.3	33%	0.33	12%	0.124	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.5	-32.4	-176	-78.4	171.9	0	0	0	113.8	T224 R226 I291 G319	T224-L317 HydrophobicContact CG2-CD1 3.51Å; T224-L317 HydrophobicContact CG2-CG 4.49Å; R226-L317 HydrophobicContact CB-CD2 4.31Å; I291-L317 HydrophobicContact CB-CD2 4.42Å; I291-L317 HydrophobicContact CD1-CD2 3.88Å; I291-L317 HydrophobicContact CG1-CD2 3.92Å; I291-L317 HydrophobicContact CG2-CD1 3.99Å; I291-L317 HydrophobicContact CG2-CD2 3.7Å; I291-L317 HydrophobicContact CG2-CG 4.34Å; L317-G319 PolarHBondContact O-N 3.2Å
318	N	67.9	Low	85.6	Confident	134 Å²	134	26.8 Å²	26.8	72%	0.717	15%	0.149	S	C	*	.	T	Hydrogen-bonded Turn	trans	-75.4	1.5	179.2	-63.8	-8.6	0	0	0	112.6	E316 C320 R388	E316-N318 PolarHBondContact O-N 2.89Å; N318-C320 PolarHBondContact O-N 3.36Å; N318-C320 VanDerWaalsContact O-N 3.14Å; N318-R388 PolarHBondContact O-NH2 3.15Å
319	G	61.3	Low	85.1	Confident	15 Å²	15	34.5 Å²	34.5	16%	0.155	18%	0.178	C	C	.	.	S	Bend	trans	64.7	17.6	172.5	0	0	0	0	0	114.8	E316 L317	E316-G319 PolarHBondContact O-N 3.43Å; L317-G319 PolarHBondContact O-N 3.2Å
320	C	73.1	Confident	84.5	Confident	1 Å²	1	41 Å²	41	1%	0.007	21%	0.212	C	C	.	.			trans	-130	44.7	-165.3	-164.3	0	0	0	0	112.7	N318 R388 T390 G476 C477	N318-C320 PolarHBondContact O-N 3.36Å; N318-C320 VanDerWaalsContact O-N 3.14Å; C320-R388 PolarHBondContact SG-NE 3.4Å; C320-T390 HydrophobicContact CB-CG2 3.93Å; C320-T390 VanDerWaalsContact O-CB 3.26Å; C320-T390 WeakPolarHBondContact O-CB 3.44Å; C320-T390 WeakPolarHBondContact O-CG2 3.13Å; C320-T390 PolarHBondContact O-OG1 3.17Å; C320-G476 CarbonylContact C-O 3.6Å; C320-C477 HydrophobicContact CB-CB 3.83Å; C320-C477 WeakPolarHBondContact CB-SG 3.35Å; C320-C477 WeakPolarHBondContact SG-CB 3.46Å; C320-C477 PolarHBondContact SG-N 3.14Å; C320-C477 CovalentContact SG-SG 2.03Å; C320-C477 PolarHBondContact SG-SG 3.32Å
321	S	76.8	Confident	84.4	Confident	6 Å²	6	41.1 Å²	41.1	4%	0.042	21%	0.213	C	C	.	.			trans	-121.1	22.9	178.9	61.8	0	0	0	0	111.6
322	E	81	Confident	84.3	Confident	40 Å²	40	44.8 Å²	44.8	19%	0.187	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.9	148.8	-176.5	-63.7	-56.3	142.6	0	0	110.6	M324 L475 G476	E322-M324 HydrophobicContact CB-CE 4.26Å; E322-M324 WeakPolarHBondContact O-CE 3.47Å; E322-M324 PolarHBondContact O-N 2.82Å; E322-L475 CarbonylContact O-C 3.51Å; E322-L475 VanDerWaalsContact O-CA 3.29Å; E322-L475 WeakPolarHBondContact O-CA 3.32Å; E322-G476 PolarHBondContact N-O 2.73Å; E322-G476 VanDerWaalsContact N-O 3.08Å; E322-G476 PolarHBondContact O-N 3.12Å
323	P	88.2	Confident	84.3	Confident	63 Å²	63	48.2 Å²	48.2	41%	0.409	25%	0.25	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.4	127.8	174.2	27.7	-33.3	0	0	0	110.6	G325 E473	P323-G325 PolarHBondContact O-N 2.93Å; P323-E473 HydrophobicContact CB-CG 3.79Å
324	M	89.4	Confident	84.4	Confident	22 Å²	22	56.6 Å²	56.6	11%	0.108	28%	0.281	C	S	.	.			trans	-78.2	-7.4	-178.9	-65.1	-67.7	90.6	0	0	113.7	E322 V331 L383 K387 L474 G476	E322-M324 HydrophobicContact CB-CE 4.26Å; E322-M324 WeakPolarHBondContact O-CE 3.47Å; E322-M324 PolarHBondContact O-N 2.82Å; M324-V331 WeakPolarHBondContact O-CG2 3.41Å; M324-L383 HydrophobicContact CB-CD2 4.41Å; M324-K387 HydrophobicContact SD-CD 3.93Å; M324-L474 HydrophobicContact CB-CB 4Å; M324-L474 HydrophobicContact CG-CB 4.15Å; M324-L474 PolarHBondContact N-O 3.09Å; M324-G476 WeakPolarHBondContact CE-O 3.38Å
325	G	87.3	Confident	84.7	Confident	0 Å²	0	57.3 Å²	57.3	0%	0	28%	0.284	C	S	.	.	S	Bend	trans	114	23.8	160.9	0	0	0	0	0	115.4	P323 S328 R329 L330 V331 E473	P323-G325 PolarHBondContact O-N 2.93Å; G325-S328 WeakPolarHBondContact CA-OG 3.29Å; G325-R329 CarbonylContact O-C 3.54Å; G325-R329 WeakPolarHBondContact O-CA 3.33Å; G325-R329 PolarHBondContact O-N 3.1Å; G325-R329 VanDerWaalsContact O-N 3.09Å; G325-L330 PolarHBondContact O-N 3.27Å; G325-L330 VanDerWaalsContact O-N 3.14Å; G325-V331 PolarHBondContact O-N 3.14Å; G325-E473 PolarHBondContact N-OE1 3.47Å; G325-E473 VanDerWaalsContact N-OE1 3.13Å
326	M	92.4	Very high	85.3	Confident	0 Å²	0	57.6 Å²	57.6	0%	0	29%	0.286	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64.8	-47.8	170.2	-63	-69.5	-75.7	0	0	110.3	V331 I336 R358 V381 M472 E473	M326-V331 HydrophobicContact SD-CB 4.14Å; M326-V331 HydrophobicContact SD-CG1 3.93Å; M326-V331 HydrophobicContact SD-CG2 4.32Å; M326-I336 HydrophobicContact CE-CD1 3.68Å; M326-I336 HydrophobicContact CE-CG1 4.13Å; M326-I336 HydrophobicContact CE-CG2 4.49Å; M326-I336 HydrophobicContact SD-CD1 3.85Å; M326-I336 HydrophobicContact SD-CG1 4.17Å; M326-R358 WeakPolarHBondContact O-CB 3.41Å; M326-R358 WeakPolarHBondContact O-CD 3.4Å; M326-R358 WeakPolarHBondContact O-CG 3.17Å; M326-R358 PolarHBondContact O-NH1 3.42Å; M326-V381 HydrophobicContact CE-CG2 3.87Å; M326-V381 HydrophobicContact SD-CG1 4.04Å; M326-V381 HydrophobicContact SD-CG2 3.85Å; M326-M472 VanDerWaalsContact CB-O 3.32Å; M326-M472 WeakPolarHBondContact CB-O 3.5Å; M326-M472 HydrophobicContact CE-CE 4.47Å; M326-M472 HydrophobicContact CE-CG 4.07Å; M326-E473 VanDerWaalsContact CB-OE1 3.25Å; M326-E473 WeakPolarHBondContact CB-OE1 3.4Å; M326-E473 WeakPolarHBondContact CG-OE1 3.15Å; M326-E473 PolarHBondContact N-OE1 3.16Å; M326-E473 PolarHBondContact N-OE2 3.32Å
327	K	89.3	Confident	86.1	Confident	111 Å²	111	59.3 Å²	59.3	48%	0.483	30%	0.297	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.3	-43.4	179.3	-176.8	171.5	176.3	175.1	0	112.3	R329 L359 D360 E473	K327-R329 PolarHBondContact O-N 3.15Å; K327-L359 HydrophobicContact CB-CB 4.4Å; K327-D360 HydrophobicContact CD-CB 4.46Å; K327-D360 IonicContact NZ-OD2 2.97Å; K327-D360 PolarHBondContact NZ-OD2 3.04Å; K327-E473 VanDerWaalsContact CB-OE2 3.25Å; K327-E473 WeakPolarHBondContact CB-OE2 3.36Å; K327-E473 PolarHBondContact N-OE2 2.81Å
328	S	80.4	Confident	87	Confident	73 Å²	73	57.3 Å²	57.3	51%	0.51	29%	0.29	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.8	-9.9	-178	63.8	0	0	0	0	114.2	G325 L330	G325-S328 WeakPolarHBondContact CA-OG 3.29Å; S328-L330 VanDerWaalsContact C-N 3.26Å; S328-L330 PolarHBondContact O-N 3.37Å; S328-L330 WeakPolarHBondContact OG-CG 3.07Å
329	R	86.4	Confident	88.4	Confident	163 Å²	163	52.9 Å²	52.9	62%	0.615	27%	0.27	S	S	*	.	S	Bend	trans	67.4	16.6	-175	-50.5	-174.4	180	-161.9	3	115.5	G325 K327 V331	G325-R329 CarbonylContact O-C 3.54Å; G325-R329 WeakPolarHBondContact O-CA 3.33Å; G325-R329 PolarHBondContact O-N 3.1Å; G325-R329 VanDerWaalsContact O-N 3.09Å; K327-R329 PolarHBondContact O-N 3.15Å; R329-V331 PolarHBondContact O-N 3.01Å
330	L	85.2	Confident	90	Very high	135 Å²	135	53.5 Å²	53.5	71%	0.707	27%	0.272	S	S	*	.			trans	-63.1	-36.4	167.1	-64.8	169.1	0	0	0	110.9	G325 S328 L332	G325-L330 PolarHBondContact O-N 3.27Å; G325-L330 VanDerWaalsContact O-N 3.14Å; S328-L330 VanDerWaalsContact C-N 3.26Å; S328-L330 PolarHBondContact O-N 3.37Å; S328-L330 WeakPolarHBondContact OG-CG 3.07Å; L330-L332 PolarHBondContact O-N 3.44Å
331	V	92.6	Very high	91	Very high	4 Å²	4	55.8 Å²	55.8	2%	0.024	29%	0.286	C	S	.	.	S	Bend	trans	-75.3	114	163.1	179.1	0	0	0	0	107.6	M324 G325 M326 R329 Q335 I336 R358 V381 L383	M324-V331 WeakPolarHBondContact O-CG2 3.41Å; G325-V331 PolarHBondContact O-N 3.14Å; M326-V331 HydrophobicContact SD-CB 4.14Å; M326-V331 HydrophobicContact SD-CG1 3.93Å; M326-V331 HydrophobicContact SD-CG2 4.32Å; R329-V331 PolarHBondContact O-N 3.01Å; V331-Q335 HydrophobicContact CG1-CB 3.77Å; V331-I336 HydrophobicContact CG1-CD1 4.17Å; V331-I336 HydrophobicContact CG1-CG1 3.87Å; V331-R358 VanDerWaalsContact O-CZ 3.25Å; V331-R358 PolarHBondContact O-NH1 3.5Å; V331-R358 PolarHBondContact O-NH2 3.09Å; V331-V381 HydrophobicContact CG1-CG1 3.86Å; V331-L383 HydrophobicContact CG2-CD2 4.43Å
332	L	94.6	Very high	91.8	Very high	77 Å²	77	57.7 Å²	57.7	40%	0.403	29%	0.293	S	S	.	.			trans	-72.5	157.3	-178.7	-59.6	173	0	0	0	111.7	L330 R334 Q335	L330-L332 PolarHBondContact O-N 3.44Å; L332-R334 HydrophobicContact CB-CG 4.04Å; L332-R334 PolarHBondContact O-N 3.33Å; L332-Q335 HydrophobicContact CB-CG 4.48Å; L332-Q335 VanDerWaalsContact CB-OE1 3.3Å; L332-Q335 WeakPolarHBondContact O-CB 3.4Å; L332-Q335 PolarHBondContact O-N 2.88Å
333	D	95.6	Very high	92.2	Very high	73 Å²	73	61.9 Å²	61.9	39%	0.39	31%	0.307	S	S	.	.	G	3₁₀ helix	trans	-57.9	-35.2	-179	-68	-17.7	0	0	0	112.6	Q335 I336 H355 R358	D333-Q335 PolarHBondContact O-N 3.29Å; D333-I336 PolarHBondContact O-N 3.44Å; D333-H355 HydrophobicContact CB-CB 3.66Å; D333-H355 IonicContact OD2-CD2 3.77Å; D333-R358 IonicContact OD1-CZ 2.75Å; D333-R358 IonicContact OD1-NE 2.65Å; D333-R358 PolarHBondContact OD1-NE 2.76Å; D333-R358 IonicContact OD1-NH2 2.86Å; D333-R358 PolarHBondContact OD1-NH2 3.31Å
334	R	95.3	Very high	92	Very high	185 Å²	185	59.2 Å²	59.2	70%	0.698	29%	0.29	S	S	*	.	G	3₁₀ helix	trans	-65.1	-18.9	176.6	67.2	-178.7	175.5	99.7	-0.8	114.5	L332 I336	L332-R334 HydrophobicContact CB-CG 4.04Å; L332-R334 PolarHBondContact O-N 3.33Å; R334-I336 VanDerWaalsContact C-N 3.31Å
335	Q	97	Very high	91.6	Very high	14 Å²	14	66.7 Å²	66.7	7%	0.065	32%	0.317	C	S	.	.	G	3₁₀ helix	trans	-84.9	-9.3	179.4	-70.9	168.9	-108.7	0	0	112.3	V331 L332 D333 V381 D382 L384	V331-Q335 HydrophobicContact CG1-CB 3.77Å; L332-Q335 HydrophobicContact CB-CG 4.48Å; L332-Q335 VanDerWaalsContact CB-OE1 3.3Å; L332-Q335 WeakPolarHBondContact O-CB 3.4Å; L332-Q335 PolarHBondContact O-N 2.88Å; D333-Q335 PolarHBondContact O-N 3.29Å; Q335-V381 WeakPolarHBondContact O-CA 3.3Å; Q335-D382 HydrophobicContact CB-CB 4.47Å; Q335-D382 WeakPolarHBondContact CB-O 3.02Å; Q335-D382 PolarHBondContact NE2-O 2.78Å; Q335-D382 PolarHBondContact O-N 2.86Å; Q335-L384 HydrophobicContact CG-CD2 4.13Å; Q335-L384 HydrophobicContact CG-CG 4.38Å
336	I	97.8	Very high	91.3	Very high	8 Å²	8	69.4 Å²	69.4	4%	0.041	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	115.3	-176.3	-51.9	167.2	0	0	0	108.4	M326 V331 D333 R334 P354 H355 L379 Q380	M326-I336 HydrophobicContact CE-CD1 3.68Å; M326-I336 HydrophobicContact CE-CG1 4.13Å; M326-I336 HydrophobicContact CE-CG2 4.49Å; M326-I336 HydrophobicContact SD-CD1 3.85Å; M326-I336 HydrophobicContact SD-CG1 4.17Å; V331-I336 HydrophobicContact CG1-CD1 4.17Å; V331-I336 HydrophobicContact CG1-CG1 3.87Å; D333-I336 PolarHBondContact O-N 3.44Å; R334-I336 VanDerWaalsContact C-N 3.31Å; I336-P354 HydrophobicContact CG2-CB 4.02Å; I336-P354 WeakPolarHBondContact CG2-O 3.43Å; I336-H355 HydrophobicContact CB-CB 4.5Å; I336-H355 HydrophobicContact CD1-CB 4.41Å; I336-L379 HydrophobicContact CG2-CD1 3.92Å; I336-Q380 WeakPolarHBondContact CA-O 3.28Å
337	T	97.5	Very high	90.9	Very high	58 Å²	58	73.2 Å²	73.2	36%	0.356	36%	0.364	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	161.2	-180	59.9	0	0	0	0	110.1	Q380	T337-Q380 PolarHBondContact N-O 3.05Å; T337-Q380 WeakPolarHBondContact O-CA 3.44Å; T337-Q380 PolarHBondContact O-N 2.88Å; T337-Q380 VanDerWaalsContact O-O 3.13Å
338	A	97.6	Very high	90.5	Very high	22 Å²	22	73.3 Å²	73.3	18%	0.182	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.1	167.7	177	0	0	0	0	0	110.8	P354 W368 W378 L379	A338-P354 HydrophobicContact CB-CB 3.87Å; A338-P354 HydrophobicContact CB-CG 3.56Å; A338-W368 HydrophobicContact CB-CD2 4.5Å; A338-W368 HydrophobicContact CB-CZ2 3.8Å; A338-W368 VanDerWaalsContact CB-NE1 3.29Å; A338-W378 VanDerWaalsContact C-CZ3 3.49Å; A338-W378 CarbonylContact C-O 3.56Å; A338-W378 VanDerWaalsContact CA-O 3.25Å; A338-W378 WeakPolarHBondContact CA-O 3.21Å; A338-W378 WeakPolarHBondContact CB-O 3.46Å; A338-L379 HydrophobicContact CB-CD1 4.01Å
339	S	96.8	Very high	90.5	Very high	41 Å²	41	73.7 Å²	73.7	29%	0.287	38%	0.377	S	S	.	.	S	Bend	trans	-60	-44.8	171.6	46.9	0	0	0	0	112.8	E377 W378	S339-E377 WeakPolarHBondContact CB-OE2 3.42Å; S339-E377 WeakPolarHBondContact OG-CA 3.25Å; S339-E377 PolarHBondContact OG-OE2 2.97Å; S339-W378 PolarHBondContact N-O 2.85Å; S339-W378 PolarHBondContact OG-N 3.45Å; S339-W378 PolarHBondContact OG-O 3.2Å
340	S	95.9	Very high	90.4	Very high	27 Å²	27	67.7 Å²	67.7	19%	0.189	36%	0.355	C	S	.	.			trans	-158.3	171.2	-177	73.9	0	0	0	0	111.7	W368 P370 A371 E377	S340-W368 PolarHBondContact O-NE1 3.29Å; S340-P370 WeakPolarHBondContact OG-CA 3.39Å; S340-P370 WeakPolarHBondContact OG-CB 3.25Å; S340-A371 PolarHBondContact OG-N 3.29Å; S340-E377 WeakPolarHBondContact CB-OE2 3.41Å; S340-E377 PolarHBondContact OG-OE2 3.13Å
341	T	94.1	Very high	90.7	Very high	49 Å²	49	61.7 Å²	61.7	30%	0.301	33%	0.325	S	S	.	.			trans	-139.7	135.2	-178.6	59.4	0	0	0	0	111.4	L353 P354 I369	T341-L353 HydrophobicContact CG2-CD2 4.35Å; T341-P354 HydrophobicContact CG2-CG 3.85Å; T341-I369 CarbonylContact C-O 3.57Å; T341-I369 WeakPolarHBondContact CA-O 3.49Å
342	F	92.6	Very high	90.7	Very high	46 Å²	46	61.6 Å²	61.6	20%	0.202	32%	0.324	C	S	.	.			trans	-88.9	144.6	176	-176.5	-114.6	0	0	0	112.6	W352 I369 P370 R467	F342-W352 AromaticContact CD1-CD1 3.84Å; F342-W352 PolarHBondContact O-N 2.76Å; F342-I369 HydrophobicContact CB-CB 4.01Å; F342-I369 HydrophobicContact CB-CG2 3.56Å; F342-I369 HydrophobicContact CD1-CG2 4.1Å; F342-I369 HydrophobicContact CG-CG2 4.05Å; F342-I369 PolarHBondContact N-O 2.6Å; F342-P370 WeakPolarHBondContact CB-O 3.16Å; F342-R467 VanDerWaalsContact CD2-NH1 3.28Å; F342-R467 VanDerWaalsContact CG-NH1 3.34Å
343	R	89.5	Confident	90.8	Very high	128 Å²	128	60.6 Å²	60.6	48%	0.483	32%	0.318	S	S	.	.	B	Isolated β-bridge	trans	-118.9	116.9	172.7	-61.3	-177.2	-174.2	-162.3	-5.8	109.1	W345 G346 D348 T351	R343-W345 PolarHBondContact O-N 3.32Å; R343-G346 PolarHBondContact O-N 2.7Å; R343-D348 IonicContact CZ-OD1 3.29Å; R343-D348 VanDerWaalsContact CZ-OD1 3.29Å; R343-D348 IonicContact NE-OD1 3.92Å; R343-D348 IonicContact NH1-OD1 2.73Å; R343-D348 PolarHBondContact NH1-OD1 3.23Å; R343-D348 IonicContact NH2-OD1 2.86Å; R343-T351 HydrophobicContact CG-CG2 3.88Å
344	T	83.9	Confident	90.8	Very high	8 Å²	8	57.9 Å²	57.9	5%	0.049	31%	0.305	C	S	.	.	G	3₁₀ helix	trans	-68.9	125.1	175.6	-50.9	0	0	0	0	109.2	G346 M347 F350 W352 F400	T344-G346 PolarHBondContact O-N 3.43Å; T344-M347 PolarHBondContact O-N 2.83Å; T344-M347 VanDerWaalsContact O-N 3.14Å; T344-F350 PolarHBondContact N-O 3.44Å; T344-W352 PolarHBondContact OG1-NE1 3.08Å; T344-F400 HydrophobicContact CG2-CD2 4.33Å; T344-F400 HydrophobicContact CG2-CE2 3.94Å
345	W	81.9	Confident	90.8	Very high	178 Å²	178	51.1 Å²	51.1	67%	0.674	28%	0.281	S	S	*	.	G	3₁₀ helix	trans	54.8	22.5	-177.8	-51.8	-50.7	0	0	0	115	R343 M347 F400	R343-W345 PolarHBondContact O-N 3.32Å; W345-M347 HydrophobicContact CB-CE 4.13Å; W345-M347 HydrophobicContact CD2-CE 4.27Å; W345-M347 HydrophobicContact CE3-CE 3.39Å; W345-M347 HydrophobicContact CZ3-CE 4.13Å; W345-M347 PolarHBondContact O-N 2.87Å; W345-F400 HydrophobicContact CE3-CZ 4.49Å; W345-F400 HydrophobicContact CH2-CD1 4.06Å; W345-F400 HydrophobicContact CH2-CD2 4.13Å; W345-F400 AromaticContact CH2-CE1 3.63Å; W345-F400 HydrophobicContact CH2-CE1 3.63Å; W345-F400 AromaticContact CH2-CE2 3.76Å; W345-F400 HydrophobicContact CH2-CE2 3.76Å; W345-F400 HydrophobicContact CH2-CG 4.3Å; W345-F400 AromaticContact CH2-CZ 3.48Å; W345-F400 HydrophobicContact CH2-CZ 3.48Å; W345-F400 VanDerWaalsContact CH2-CZ 3.48Å; W345-F400 HydrophobicContact CZ2-CD2 4.48Å; W345-F400 HydrophobicContact CZ2-CE2 4.43Å; W345-F400 AromaticContact CZ3-CE1 3.99Å; W345-F400 HydrophobicContact CZ3-CE1 3.99Å; W345-F400 AromaticContact CZ3-CE2 3.83Å; W345-F400 HydrophobicContact CZ3-CE2 3.83Å; W345-F400 AromaticContact CZ3-CZ 3.45Å; W345-F400 HydrophobicContact CZ3-CZ 3.45Å; W345-F400 VanDerWaalsContact CZ3-CZ 3.45Å
346	G	81	Confident	90.7	Very high	57 Å²	57	53.1 Å²	53.1	59%	0.588	29%	0.288	S	S	*	.	G	3₁₀ helix	trans	68.2	8.3	-177.6	0	0	0	0	0	114.9	R343 T344	R343-G346 PolarHBondContact O-N 2.7Å; T344-G346 PolarHBondContact O-N 3.43Å
347	M	83.3	Confident	90.7	Very high	81 Å²	81	52.7 Å²	52.7	40%	0.399	29%	0.286	S	S	.	.			trans	-87	129	179.8	-72.5	-167	-78.1	0	0	111.5	T344 W345 A349 F350	T344-M347 PolarHBondContact O-N 2.83Å; T344-M347 VanDerWaalsContact O-N 3.14Å; W345-M347 HydrophobicContact CB-CE 4.13Å; W345-M347 HydrophobicContact CD2-CE 4.27Å; W345-M347 HydrophobicContact CE3-CE 3.39Å; W345-M347 HydrophobicContact CZ3-CE 4.13Å; W345-M347 PolarHBondContact O-N 2.87Å; M347-A349 PolarHBondContact O-N 2.71Å; M347-F350 HydrophobicContact CB-CD2 3.97Å; M347-F350 HydrophobicContact CE-CD2 3.5Å; M347-F350 VanDerWaalsContact CE-CD2 3.5Å; M347-F350 HydrophobicContact CE-CE2 3.53Å; M347-F350 CarbonylContact O-C 3.59Å; M347-F350 PolarHBondContact O-N 3.4Å; M347-F350 HydrophobicContact SD-CD2 4.16Å; M347-F350 HydrophobicContact SD-CE2 4.15Å
348	D	80.5	Confident	90.6	Very high	113 Å²	113	50.5 Å²	50.5	60%	0.604	27%	0.272	S	S	*	.	G	3₁₀ helix	trans	-60.1	-34	178.9	-69.8	-32.3	0	0	0	112.3	R343 F350 T351	R343-D348 IonicContact CZ-OD1 3.29Å; R343-D348 VanDerWaalsContact CZ-OD1 3.29Å; R343-D348 IonicContact NE-OD1 3.92Å; R343-D348 IonicContact NH1-OD1 2.73Å; R343-D348 PolarHBondContact NH1-OD1 3.23Å; R343-D348 IonicContact NH2-OD1 2.86Å; D348-F350 PolarHBondContact O-N 3.45Å; D348-F350 VanDerWaalsContact O-N 3.16Å; D348-T351 WeakPolarHBondContact CA-OG1 3.36Å; D348-T351 WeakPolarHBondContact O-CB 3.42Å; D348-T351 PolarHBondContact O-N 3.18Å; D348-T351 PolarHBondContact O-OG1 3.41Å
349	A	80.4	Confident	90.4	Very high	80 Å²	80	50.2 Å²	50.2	66%	0.661	27%	0.267	S	S	*	.	G	3₁₀ helix	trans	-62.5	-19.7	177.2	0	0	0	0	0	114.1	M347	M347-A349 PolarHBondContact O-N 2.71Å
350	F	85.7	Confident	90.1	Very high	37 Å²	37	50.2 Å²	50.2	16%	0.162	26%	0.264	C	S	.	.	G	3₁₀ helix	trans	-118.1	39.9	179.1	-59.8	-81.1	0	0	0	111.8	T344 M347 D348 K364 T365 F400	T344-F350 PolarHBondContact N-O 3.44Å; M347-F350 HydrophobicContact CB-CD2 3.97Å; M347-F350 HydrophobicContact CE-CD2 3.5Å; M347-F350 VanDerWaalsContact CE-CD2 3.5Å; M347-F350 HydrophobicContact CE-CE2 3.53Å; M347-F350 CarbonylContact O-C 3.59Å; M347-F350 PolarHBondContact O-N 3.4Å; M347-F350 HydrophobicContact SD-CD2 4.16Å; M347-F350 HydrophobicContact SD-CE2 4.15Å; D348-F350 PolarHBondContact O-N 3.45Å; D348-F350 VanDerWaalsContact O-N 3.16Å; F350-K364 HydrophobicContact CE1-CB 4.37Å; F350-K364 HydrophobicContact CE1-CD 3.91Å; F350-T365 HydrophobicContact CB-CG2 4.35Å; F350-F400 HydrophobicContact CD1-CZ 4.33Å; F350-F400 HydrophobicContact CE1-CZ 4.17Å
351	T	91	Very high	89.9	Confident	10 Å²	10	51.1 Å²	51.1	6%	0.061	26%	0.264	C	S	.	.	B	Isolated β-bridge	trans	-86.4	132.5	174.5	-50.6	0	0	0	0	111.2	R343 D348 L353 Y356	R343-T351 HydrophobicContact CG-CG2 3.88Å; D348-T351 WeakPolarHBondContact CA-OG1 3.36Å; D348-T351 WeakPolarHBondContact O-CB 3.42Å; D348-T351 PolarHBondContact O-N 3.18Å; D348-T351 PolarHBondContact O-OG1 3.41Å; T351-L353 HydrophobicContact CG2-CD2 3.58Å; T351-L353 HydrophobicContact CG2-CG 3.76Å; T351-L353 PolarHBondContact O-N 2.96Å; T351-Y356 WeakPolarHBondContact O-CE2 3.48Å
352	W	93.6	Very high	89.7	Confident	2 Å²	2	55.6 Å²	55.6	1%	0.008	28%	0.282	C	S	.	.			trans	-93.5	71.6	179.6	-63.9	80.9	0	0	0	110.9	F342 T344 T365 A367 I369 A397 D399	F342-W352 AromaticContact CD1-CD1 3.84Å; F342-W352 PolarHBondContact O-N 2.76Å; T344-W352 PolarHBondContact OG1-NE1 3.08Å; W352-T365 HydrophobicContact CD2-CG2 4.23Å; W352-T365 HydrophobicContact CG-CG2 4.47Å; W352-T365 HydrophobicContact CZ2-CG2 4.35Å; W352-A367 HydrophobicContact CE3-CB 3.95Å; W352-A367 HydrophobicContact CZ3-CB 3.85Å; W352-I369 HydrophobicContact CB-CB 3.63Å; W352-I369 HydrophobicContact CB-CD1 4.37Å; W352-I369 HydrophobicContact CB-CG1 3.92Å; W352-I369 HydrophobicContact CD2-CB 4.35Å; W352-I369 HydrophobicContact CD2-CD1 3.34Å; W352-I369 HydrophobicContact CD2-CG1 3.71Å; W352-I369 HydrophobicContact CE3-CD1 3.52Å; W352-I369 HydrophobicContact CE3-CG1 3.67Å; W352-I369 HydrophobicContact CG-CB 3.91Å; W352-I369 HydrophobicContact CG-CD1 3.73Å; W352-I369 HydrophobicContact CG-CG1 3.82Å; W352-I369 HydrophobicContact CH2-CD1 4.29Å; W352-I369 HydrophobicContact CZ2-CD1 4.13Å; W352-I369 HydrophobicContact CZ3-CD1 4Å; W352-I369 HydrophobicContact CZ3-CG1 4.44Å; W352-A397 HydrophobicContact CZ3-CB 4.48Å; W352-D399 HydrophobicContact CH2-CB 4.3Å; W352-D399 HydrophobicContact CZ2-CB 4Å; W352-D399 WeakPolarHBondContact CZ2-OD1 3.35Å
353	L	95.4	Very high	89.4	Confident	55 Å²	55	56 Å²	56	29%	0.288	30%	0.299	S	S	.	.			trans	-69.2	155.2	-172.6	-65.7	167.8	0	0	0	112.9	T341 T351 H355 Y356	T341-L353 HydrophobicContact CG2-CD2 4.35Å; T351-L353 HydrophobicContact CG2-CD2 3.58Å; T351-L353 HydrophobicContact CG2-CG 3.76Å; T351-L353 PolarHBondContact O-N 2.96Å; L353-H355 VanDerWaalsContact C-N 3.32Å; L353-H355 VanDerWaalsContact CB-CE1 3.49Å; L353-H355 WeakPolarHBondContact CB-CE1 3.46Å; L353-H355 WeakPolarHBondContact CD1-CE1 3.28Å; L353-H355 PolarHBondContact O-N 2.8Å; L353-Y356 HydrophobicContact CB-CD2 4.03Å; L353-Y356 HydrophobicContact CB-CE2 4.15Å; L353-Y356 HydrophobicContact CB-CG 4.47Å; L353-Y356 HydrophobicContact CD1-CE2 4.29Å; L353-Y356 HydrophobicContact CG-CE2 4.4Å; L353-Y356 WeakPolarHBondContact O-CB 3.41Å; L353-Y356 PolarHBondContact O-N 2.87Å
354	P	96.6	Very high	89.1	Confident	16 Å²	16	57.9 Å²	57.9	10%	0.104	31%	0.311	C	S	.	.	G	3₁₀ helix	trans	-60.8	-39.3	-176.6	-24.9	38	0	0	0	112.8	I336 A338 T341 Y356 A357 L379	I336-P354 HydrophobicContact CG2-CB 4.02Å; I336-P354 WeakPolarHBondContact CG2-O 3.43Å; A338-P354 HydrophobicContact CB-CB 3.87Å; A338-P354 HydrophobicContact CB-CG 3.56Å; T341-P354 HydrophobicContact CG2-CG 3.85Å; P354-Y356 PolarHBondContact O-N 2.81Å; P354-A357 WeakPolarHBondContact O-CB 3.42Å; P354-A357 PolarHBondContact O-N 2.87Å; P354-L379 HydrophobicContact CB-CD1 3.81Å
355	H	94.6	Very high	89.4	Confident	43 Å²	43	58.3 Å²	58.3	20%	0.199	31%	0.313	C	S	.	.	G	3₁₀ helix	trans	-68.4	-5.8	179.2	65.1	-101.6	0	0	0	114.1	D333 I336 L353 A357 R358	D333-H355 HydrophobicContact CB-CB 3.66Å; D333-H355 IonicContact OD2-CD2 3.77Å; I336-H355 HydrophobicContact CB-CB 4.5Å; I336-H355 HydrophobicContact CD1-CB 4.41Å; L353-H355 VanDerWaalsContact C-N 3.32Å; L353-H355 VanDerWaalsContact CB-CE1 3.49Å; L353-H355 WeakPolarHBondContact CB-CE1 3.46Å; L353-H355 WeakPolarHBondContact CD1-CE1 3.28Å; L353-H355 PolarHBondContact O-N 2.8Å; H355-A357 VanDerWaalsContact C-N 3.34Å; H355-R358 WeakPolarHBondContact O-CD 3.42Å; H355-R358 WeakPolarHBondContact O-CG 3.33Å; H355-R358 PolarHBondContact O-NE 3.07Å
356	Y	95.5	Very high	89.9	Confident	56 Å²	56	50.5 Å²	50.5	22%	0.22	29%	0.285	C	S	.	.	G	3₁₀ helix	trans	-84.1	-7.3	168.7	-63	-24.2	0	0	0	113.4	T351 L353 P354 R358 K361 N366 A367	T351-Y356 WeakPolarHBondContact O-CE2 3.48Å; L353-Y356 HydrophobicContact CB-CD2 4.03Å; L353-Y356 HydrophobicContact CB-CE2 4.15Å; L353-Y356 HydrophobicContact CB-CG 4.47Å; L353-Y356 HydrophobicContact CD1-CE2 4.29Å; L353-Y356 HydrophobicContact CG-CE2 4.4Å; L353-Y356 WeakPolarHBondContact O-CB 3.41Å; L353-Y356 PolarHBondContact O-N 2.87Å; P354-Y356 PolarHBondContact O-N 2.81Å; Y356-R358 PolarHBondContact O-N 3.37Å; Y356-K361 HydrophobicContact CD1-CD 4.08Å; Y356-K361 VanDerWaalsContact CD1-NZ 3.3Å; Y356-K361 HydrophobicContact CG-CD 4.25Å; Y356-K361 VanDerWaalsContact O-CD 3.26Å; Y356-K361 WeakPolarHBondContact O-CD 3.32Å; Y356-N366 CarbonylContact O-C 3.57Å; Y356-N366 VanDerWaalsContact O-O 3.12Å; Y356-A367 WeakPolarHBondContact CB-O 3.37Å
357	A	96.9	Very high	90.6	Very high	0 Å²	0	47.8 Å²	47.8	0%	0	26%	0.257	C	S	.	.			trans	-71.4	37.5	176.2	0	0	0	0	0	114.3	P354 H355 W368 L379 L470 M472	P354-A357 WeakPolarHBondContact O-CB 3.42Å; P354-A357 PolarHBondContact O-N 2.87Å; H355-A357 VanDerWaalsContact C-N 3.34Å; A357-W368 HydrophobicContact CB-CB 3.7Å; A357-L379 HydrophobicContact CB-CD1 4.25Å; A357-L379 HydrophobicContact CB-CD2 3.37Å; A357-L379 HydrophobicContact CB-CG 4.45Å; A357-L470 WeakPolarHBondContact CA-O 3.35Å; A357-M472 WeakPolarHBondContact O-CG 3.33Å; A357-M472 PolarHBondContact O-N 2.82Å
358	R	96.6	Very high	91.3	Very high	12 Å²	12	43.9 Å²	43.9	5%	0.045	24%	0.238	C	C	.	.	B	Isolated β-bridge	trans	-96.3	133.8	-179.1	-60.9	176.7	179.8	-82.7	2.4	109.4	M326 V331 D333 H355 Y356 D360 K361	M326-R358 WeakPolarHBondContact O-CB 3.41Å; M326-R358 WeakPolarHBondContact O-CD 3.4Å; M326-R358 WeakPolarHBondContact O-CG 3.17Å; M326-R358 PolarHBondContact O-NH1 3.42Å; V331-R358 VanDerWaalsContact O-CZ 3.25Å; V331-R358 PolarHBondContact O-NH1 3.5Å; V331-R358 PolarHBondContact O-NH2 3.09Å; D333-R358 IonicContact OD1-CZ 2.75Å; D333-R358 IonicContact OD1-NE 2.65Å; D333-R358 PolarHBondContact OD1-NE 2.76Å; D333-R358 IonicContact OD1-NH2 2.86Å; D333-R358 PolarHBondContact OD1-NH2 3.31Å; H355-R358 WeakPolarHBondContact O-CD 3.42Å; H355-R358 WeakPolarHBondContact O-CG 3.33Å; H355-R358 PolarHBondContact O-NE 3.07Å; Y356-R358 PolarHBondContact O-N 3.37Å; R358-D360 PolarHBondContact O-N 3.16Å; R358-K361 HydrophobicContact CB-CB 4.39Å; R358-K361 VanDerWaalsContact O-CB 3.24Å; R358-K361 WeakPolarHBondContact O-CB 3.41Å; R358-K361 PolarHBondContact O-N 3.09Å
359	L	93	Very high	92	Very high	15 Å²	15	38.5 Å²	38.5	8%	0.079	21%	0.209	C	C	.	.	T	Hydrogen-bonded Turn	trans	-53.1	137.6	178.4	-167.2	71.7	0	0	0	111.7	K327 K361 V393 Q395 M472 E473	K327-L359 HydrophobicContact CB-CB 4.4Å; L359-K361 PolarHBondContact O-N 3.5Å; L359-V393 HydrophobicContact CD1-CB 4.5Å; L359-V393 HydrophobicContact CD1-CG1 3.91Å; L359-V393 HydrophobicContact CD2-CB 4.27Å; L359-V393 HydrophobicContact CD2-CG1 3.96Å; L359-Q395 HydrophobicContact CD1-CB 3.78Å; L359-M472 PolarHBondContact N-O 3.15Å; L359-E473 HydrophobicContact CB-CB 3.88Å; L359-E473 HydrophobicContact CD2-CB 3.84Å; L359-E473 HydrophobicContact CG-CB 4.42Å
360	D	90.8	Very high	92.8	Very high	42 Å²	42	34.7 Å²	34.7	23%	0.225	18%	0.177	C	C	.	.	T	Hydrogen-bonded Turn	trans	58.1	14.4	-179.2	-61.9	-38.5	0	0	0	116.3	K327 R358 Q362 Q395 H443	K327-D360 HydrophobicContact CD-CB 4.46Å; K327-D360 IonicContact NZ-OD2 2.97Å; K327-D360 PolarHBondContact NZ-OD2 3.04Å; R358-D360 PolarHBondContact O-N 3.16Å; D360-Q362 PolarHBondContact O-N 3.45Å; D360-Q362 PolarHBondContact O-NE2 3Å; D360-Q362 VanDerWaalsContact O-NE2 3.12Å; D360-Q395 PolarHBondContact OD1-NE2 3.11Å; D360-Q395 PolarHBondContact OD1-OE1 2.84Å; D360-H443 IonicContact OD1-CD2 2.78Å; D360-H443 IonicContact OD1-CE1 3.24Å; D360-H443 PolarHBondContact OD1-CE1 2.87Å; D360-H443 IonicContact OD1-NE2 3.61Å; D360-H443 PolarHBondContact OD1-NE2 2.83Å; D360-H443 IonicContact OD2-CE1 3.7Å; D360-H443 PolarHBondContact OD2-CE1 2.87Å; D360-H443 IonicContact OD2-NE2 3.45Å; D360-H443 PolarHBondContact OD2-NE2 3.48Å
361	K	90.8	Very high	93.3	Very high	46 Å²	46	35 Å²	35	20%	0.2	19%	0.187	C	C	.	.			trans	-57.7	133	173.1	-174.4	-177.5	169.3	80.3	0	109.7	Y356 R358 L359 N366 R471	Y356-K361 HydrophobicContact CD1-CD 4.08Å; Y356-K361 VanDerWaalsContact CD1-NZ 3.3Å; Y356-K361 HydrophobicContact CG-CD 4.25Å; Y356-K361 VanDerWaalsContact O-CD 3.26Å; Y356-K361 WeakPolarHBondContact O-CD 3.32Å; R358-K361 HydrophobicContact CB-CB 4.39Å; R358-K361 VanDerWaalsContact O-CB 3.24Å; R358-K361 WeakPolarHBondContact O-CB 3.41Å; R358-K361 PolarHBondContact O-N 3.09Å; L359-K361 PolarHBondContact O-N 3.5Å; K361-N366 HydrophobicContact CB-CB 4.48Å; K361-N366 HydrophobicContact CG-CB 4.19Å; K361-N366 WeakPolarHBondContact O-CB 3.33Å; K361-N366 PolarHBondContact O-ND2 2.89Å; K361-R471 PolarHBondContact O-NH1 2.85Å
362	Q	89.3	Confident	93.4	Very high	143 Å²	143	39.3 Å²	39.3	67%	0.668	21%	0.209	S	C	*	.			trans	-108.4	158.9	176.1	-56.6	-57.9	-37.1	0	0	110.1	D360	D360-Q362 PolarHBondContact O-N 3.45Å; D360-Q362 PolarHBondContact O-NE2 3Å; D360-Q362 VanDerWaalsContact O-NE2 3.12Å
363	G	86.8	Confident	93.5	Very high	55 Å²	55	42.1 Å²	42.1	57%	0.567	22%	0.224	S	C	*	.	S	Bend	trans	131.9	178.2	-179.4	0	0	0	0	0	112.1
364	K	84.5	Confident	93.5	Very high	166 Å²	166	41.3 Å²	41.3	72%	0.722	22%	0.223	S	C	*	.	S	Bend	trans	-69	-44.1	177.5	-62.3	-173.9	-176.6	178.7	0	111.6	F350	F350-K364 HydrophobicContact CE1-CB 4.37Å; F350-K364 HydrophobicContact CE1-CD 3.91Å
365	T	89	Confident	93.5	Very high	17 Å²	17	46.8 Å²	46.8	10%	0.104	24%	0.241	C	C	.	.	S	Bend	trans	-110.2	107.1	168.2	46.5	0	0	0	0	108.4	F350 W352	F350-T365 HydrophobicContact CB-CG2 4.35Å; W352-T365 HydrophobicContact CD2-CG2 4.23Å; W352-T365 HydrophobicContact CG-CG2 4.47Å; W352-T365 HydrophobicContact CZ2-CG2 4.35Å
366	N	93	Very high	93.5	Very high	14 Å²	14	48.4 Å²	48.4	8%	0.075	26%	0.258	C	S	.	.			trans	-131.3	9.5	-168.8	71.7	-32.2	0	0	0	114	Y356 K361 R471	Y356-N366 CarbonylContact O-C 3.57Å; Y356-N366 VanDerWaalsContact O-O 3.12Å; K361-N366 HydrophobicContact CB-CB 4.48Å; K361-N366 HydrophobicContact CG-CB 4.19Å; K361-N366 WeakPolarHBondContact O-CB 3.33Å; K361-N366 PolarHBondContact O-ND2 2.89Å; N366-R471 PolarHBondContact ND2-NH1 2.87Å; N366-R471 WeakPolarHBondContact O-CD 3.17Å; N366-R471 VanDerWaalsContact O-CG 3.26Å; N366-R471 WeakPolarHBondContact O-CG 3.49Å
367	A	95.9	Very high	93.6	Very high	0 Å²	0	46.3 Å²	46.3	0%	0	25%	0.25	C	C	.	.	S	Bend	trans	-140.7	176.4	176.9	0	0	0	0	0	110.6	W352 Y356 A397 T469 R471	W352-A367 HydrophobicContact CE3-CB 3.95Å; W352-A367 HydrophobicContact CZ3-CB 3.85Å; Y356-A367 WeakPolarHBondContact CB-O 3.37Å; A367-A397 HydrophobicContact CB-CB 3.7Å; A367-T469 HydrophobicContact CB-CG2 3.63Å; A367-R471 HydrophobicContact CB-CG 3.79Å
368	W	97.1	Very high	93.6	Very high	0 Å²	0	49.3 Å²	49.3	0%	0	26%	0.261	C	S	.	.	B	Isolated β-bridge	trans	-94.3	138.9	163.1	166.9	68.1	0	0	0	110.6	A338 S340 A357 P370 E377 W378 L379 P461 I468 T469 L470	A338-W368 HydrophobicContact CB-CD2 4.5Å; A338-W368 HydrophobicContact CB-CZ2 3.8Å; A338-W368 VanDerWaalsContact CB-NE1 3.29Å; S340-W368 PolarHBondContact O-NE1 3.29Å; A357-W368 HydrophobicContact CB-CB 3.7Å; W368-P370 HydrophobicContact CH2-CB 4.36Å; W368-P370 HydrophobicContact CH2-CG 4.33Å; W368-P370 HydrophobicContact CZ2-CB 3.81Å; W368-P370 HydrophobicContact CZ2-CG 4.2Å; W368-E377 HydrophobicContact CH2-CB 4.39Å; W368-W378 WeakPolarHBondContact CZ2-O 3.38Å; W368-L379 HydrophobicContact CB-CD1 4.37Å; W368-L379 HydrophobicContact CD2-CB 4.21Å; W368-L379 HydrophobicContact CD2-CD1 3.92Å; W368-L379 HydrophobicContact CD2-CG 4.45Å; W368-L379 HydrophobicContact CE3-CB 3.78Å; W368-L379 HydrophobicContact CE3-CD1 4.23Å; W368-L379 HydrophobicContact CE3-CD2 4.09Å; W368-L379 HydrophobicContact CE3-CG 4.26Å; W368-L379 HydrophobicContact CG-CD1 3.99Å; W368-L379 HydrophobicContact CH2-CB 4Å; W368-L379 HydrophobicContact CZ2-CB 4.42Å; W368-L379 HydrophobicContact CZ3-CB 3.67Å; W368-P461 HydrophobicContact CH2-CG 4.46Å; W368-P461 HydrophobicContact CZ3-CG 4.28Å; W368-I468 HydrophobicContact CH2-CG2 4.37Å; W368-I468 HydrophobicContact CZ3-CG2 4.04Å; W368-T469 WeakPolarHBondContact O-CA 3.25Å; W368-L470 HydrophobicContact CE3-CB 4.12Å; W368-L470 PolarHBondContact N-O 3.31Å; W368-L470 PolarHBondContact O-N 2.84Å; W368-L470 VanDerWaalsContact O-N 3.07Å
369	I	96.3	Very high	93.7	Very high	0 Å²	0	48.7 Å²	48.7	0%	0	26%	0.259	C	S	.	.			trans	-135.8	127.1	173.3	-60.8	-174.1	0	0	0	107.7	T341 F342 W352 R467 T469	T341-I369 CarbonylContact C-O 3.57Å; T341-I369 WeakPolarHBondContact CA-O 3.49Å; F342-I369 HydrophobicContact CB-CB 4.01Å; F342-I369 HydrophobicContact CB-CG2 3.56Å; F342-I369 HydrophobicContact CD1-CG2 4.1Å; F342-I369 HydrophobicContact CG-CG2 4.05Å; F342-I369 PolarHBondContact N-O 2.6Å; W352-I369 HydrophobicContact CB-CB 3.63Å; W352-I369 HydrophobicContact CB-CD1 4.37Å; W352-I369 HydrophobicContact CB-CG1 3.92Å; W352-I369 HydrophobicContact CD2-CB 4.35Å; W352-I369 HydrophobicContact CD2-CD1 3.34Å; W352-I369 HydrophobicContact CD2-CG1 3.71Å; W352-I369 HydrophobicContact CE3-CD1 3.52Å; W352-I369 HydrophobicContact CE3-CG1 3.67Å; W352-I369 HydrophobicContact CG-CB 3.91Å; W352-I369 HydrophobicContact CG-CD1 3.73Å; W352-I369 HydrophobicContact CG-CG1 3.82Å; W352-I369 HydrophobicContact CH2-CD1 4.29Å; W352-I369 HydrophobicContact CZ2-CD1 4.13Å; W352-I369 HydrophobicContact CZ3-CD1 4Å; W352-I369 HydrophobicContact CZ3-CG1 4.44Å; I369-R467 HydrophobicContact CG2-CG 3.87Å; I369-T469 HydrophobicContact CD1-CG2 4.2Å; I369-T469 HydrophobicContact CG1-CG2 3.98Å
370	P	96.9	Very high	93.9	Very high	0 Å²	0	49 Å²	49	0%	0	26%	0.26	C	S	.	.			trans	-73.4	156	174	30.5	-32.5	0	0	0	111.8	S340 F342 W368 I372 E377 R467 I468	S340-P370 WeakPolarHBondContact OG-CA 3.39Å; S340-P370 WeakPolarHBondContact OG-CB 3.25Å; F342-P370 WeakPolarHBondContact CB-O 3.16Å; W368-P370 HydrophobicContact CH2-CB 4.36Å; W368-P370 HydrophobicContact CH2-CG 4.33Å; W368-P370 HydrophobicContact CZ2-CB 3.81Å; W368-P370 HydrophobicContact CZ2-CG 4.2Å; P370-I372 VanDerWaalsContact C-N 3.26Å; P370-I372 WeakPolarHBondContact CG-O 3.48Å; P370-I372 PolarHBondContact O-N 2.87Å; P370-E377 HydrophobicContact CB-CB 4.02Å; P370-E377 HydrophobicContact CB-CG 3.61Å; P370-E377 VanDerWaalsContact CB-OE2 3.23Å; P370-E377 WeakPolarHBondContact CB-OE2 3.12Å; P370-E377 HydrophobicContact CG-CB 4.16Å; P370-E377 HydrophobicContact CG-CG 3.9Å; P370-R467 PolarHBondContact O-NH1 3.18Å; P370-I468 VanDerWaalsContact CD-O 3.24Å; P370-I468 WeakPolarHBondContact CD-O 3.32Å; P370-I468 HydrophobicContact CG-CB 3.63Å; P370-I468 HydrophobicContact CG-CD1 3.93Å; P370-I468 HydrophobicContact CG-CG1 4.34Å; P370-I468 HydrophobicContact CG-CG2 3.75Å
371	A	95.1	Very high	94.2	Very high	44 Å²	44	47 Å²	47	36%	0.364	25%	0.249	S	C	.	.	S	Bend	trans	-56.8	-42.4	178.9	0	0	0	0	0	111.7	S340	S340-A371 PolarHBondContact OG-N 3.29Å
372	I	94.4	Very high	94.6	Very high	100 Å²	100	46 Å²	46	51%	0.513	25%	0.246	S	C	.	.	S	Bend	trans	-119.7	153.1	178.8	62.5	172.5	0	0	0	111.4	P370 S374 E377	P370-I372 VanDerWaalsContact C-N 3.26Å; P370-I372 WeakPolarHBondContact CG-O 3.48Å; P370-I372 PolarHBondContact O-N 2.87Å; I372-S374 PolarHBondContact O-N 2.95Å; I372-E377 HydrophobicContact CG1-CG 4.43Å; I372-E377 WeakPolarHBondContact CG1-OE1 3.44Å; I372-E377 WeakPolarHBondContact O-CG 3.49Å
373	N	94.2	Very high	94.8	Very high	61 Å²	61	39.6 Å²	39.6	33%	0.326	22%	0.216	S	C	.	.			trans	-91.3	86.5	174.2	-75.8	-36.2	0	0	0	109.9	W464 E466 R467 I468	N373-W464 HydrophobicContact CB-CZ2 3.81Å; N373-E466 PolarHBondContact ND2-O 2.83Å; N373-R467 WeakPolarHBondContact OD1-CA 3.46Å; N373-R467 VanDerWaalsContact OD1-CG 3.27Å; N373-R467 WeakPolarHBondContact OD1-CG 3.37Å; N373-I468 PolarHBondContact OD1-N 2.91Å
374	S	96.4	Very high	95.2	Very high	38 Å²	38	40.8 Å²	40.8	27%	0.266	21%	0.209	S	C	.	.			trans	-132.1	152.3	-179.9	179	0	0	0	0	111.4	I372 S376 E377	I372-S374 PolarHBondContact O-N 2.95Å; S374-S376 WeakPolarHBondContact CB-OG 3.45Å; S374-S376 PolarHBondContact O-N 2.74Å; S374-S376 PolarHBondContact OG-N 2.67Å; S374-S376 PolarHBondContact OG-OG 3.43Å; S374-E377 WeakPolarHBondContact O-CB 3.32Å; S374-E377 WeakPolarHBondContact O-CG 3.44Å; S374-E377 PolarHBondContact O-N 3.18Å
375	R	95.6	Very high	95.5	Very high	130 Å²	130	35.3 Å²	35.3	49%	0.491	19%	0.192	S	C	.	.	T	Hydrogen-bonded Turn	trans	-69.3	-7.6	172.5	-66.2	-177.5	175.5	171.6	3.5	113.4	W462 W464	R375-W462 HydrophobicContact CB-CE3 4.45Å; R375-W462 HydrophobicContact CB-CZ3 4.46Å; R375-W462 HydrophobicContact CG-CE3 4.31Å; R375-W462 PolarHBondContact NE-O 3.13Å; R375-W462 VanDerWaalsContact NE-O 3.13Å; R375-W464 HydrophobicContact CG-CH2 4.18Å; R375-W464 HydrophobicContact CG-CZ3 4.12Å
376	S	95.1	Very high	95.7	Very high	78 Å²	78	38.7 Å²	38.7	55%	0.545	21%	0.214	S	C	.	.	T	Hydrogen-bonded Turn	trans	-83.6	-11	173.4	57.5	0	0	0	0	113.5	S374	S374-S376 WeakPolarHBondContact CB-OG 3.45Å; S374-S376 PolarHBondContact O-N 2.74Å; S374-S376 PolarHBondContact OG-N 2.67Å; S374-S376 PolarHBondContact OG-OG 3.43Å
377	E	97.8	Very high	95.6	Very high	11 Å²	11	39.6 Å²	39.6	5%	0.051	22%	0.217	C	C	.	.			trans	-71.4	148.6	-179.8	-61.1	-57.7	130.5	0	0	111.2	S339 S340 W368 P370 I372 S374 P461 I468	S339-E377 WeakPolarHBondContact CB-OE2 3.42Å; S339-E377 WeakPolarHBondContact OG-CA 3.25Å; S339-E377 PolarHBondContact OG-OE2 2.97Å; S340-E377 WeakPolarHBondContact CB-OE2 3.41Å; S340-E377 PolarHBondContact OG-OE2 3.13Å; W368-E377 HydrophobicContact CH2-CB 4.39Å; P370-E377 HydrophobicContact CB-CB 4.02Å; P370-E377 HydrophobicContact CB-CG 3.61Å; P370-E377 VanDerWaalsContact CB-OE2 3.23Å; P370-E377 WeakPolarHBondContact CB-OE2 3.12Å; P370-E377 HydrophobicContact CG-CB 4.16Å; P370-E377 HydrophobicContact CG-CG 3.9Å; I372-E377 HydrophobicContact CG1-CG 4.43Å; I372-E377 WeakPolarHBondContact CG1-OE1 3.44Å; I372-E377 WeakPolarHBondContact O-CG 3.49Å; S374-E377 WeakPolarHBondContact O-CB 3.32Å; S374-E377 WeakPolarHBondContact O-CG 3.44Å; S374-E377 PolarHBondContact O-N 3.18Å; E377-P461 VanDerWaalsContact O-CD 3.23Å; E377-P461 WeakPolarHBondContact O-CD 3.24Å; E377-I468 HydrophobicContact CB-CD1 4.25Å; E377-I468 HydrophobicContact CG-CD1 4.29Å
378	W	97.5	Very high	95.4	Very high	63 Å²	63	42.3 Å²	42.3	24%	0.239	23%	0.228	C	C	.	.			trans	-149.4	148.4	179.5	55.6	-97.7	0	0	0	111.7	A338 S339 W368 Q380 R458 V459 L460	A338-W378 VanDerWaalsContact C-CZ3 3.49Å; A338-W378 CarbonylContact C-O 3.56Å; A338-W378 VanDerWaalsContact CA-O 3.25Å; A338-W378 WeakPolarHBondContact CA-O 3.21Å; A338-W378 WeakPolarHBondContact CB-O 3.46Å; S339-W378 PolarHBondContact N-O 2.85Å; S339-W378 PolarHBondContact OG-N 3.45Å; S339-W378 PolarHBondContact OG-O 3.2Å; W368-W378 WeakPolarHBondContact CZ2-O 3.38Å; W378-Q380 HydrophobicContact CE3-CB 3.65Å; W378-Q380 HydrophobicContact CZ3-CB 3.44Å; W378-Q380 VanDerWaalsContact CZ3-CB 3.44Å; W378-Q380 HydrophobicContact CZ3-CG 4.44Å; W378-R458 HydrophobicContact CE3-CG 4.2Å; W378-V459 WeakPolarHBondContact CA-O 3.24Å; W378-L460 HydrophobicContact CB-CD2 3.52Å
379	L	98.1	Very high	95.2	Very high	0 Å²	0	42.3 Å²	42.3	0%	0	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	130.7	167.9	-179.5	72	0	0	0	108.3	I336 A338 P354 A357 W368 R458 V459 L470 M472	I336-L379 HydrophobicContact CG2-CD1 3.92Å; A338-L379 HydrophobicContact CB-CD1 4.01Å; P354-L379 HydrophobicContact CB-CD1 3.81Å; A357-L379 HydrophobicContact CB-CD1 4.25Å; A357-L379 HydrophobicContact CB-CD2 3.37Å; A357-L379 HydrophobicContact CB-CG 4.45Å; W368-L379 HydrophobicContact CB-CD1 4.37Å; W368-L379 HydrophobicContact CD2-CB 4.21Å; W368-L379 HydrophobicContact CD2-CD1 3.92Å; W368-L379 HydrophobicContact CD2-CG 4.45Å; W368-L379 HydrophobicContact CE3-CB 3.78Å; W368-L379 HydrophobicContact CE3-CD1 4.23Å; W368-L379 HydrophobicContact CE3-CD2 4.09Å; W368-L379 HydrophobicContact CE3-CG 4.26Å; W368-L379 HydrophobicContact CG-CD1 3.99Å; W368-L379 HydrophobicContact CH2-CB 4Å; W368-L379 HydrophobicContact CZ2-CB 4.42Å; W368-L379 HydrophobicContact CZ3-CB 3.67Å; L379-R458 CarbonylContact O-C 3.54Å; L379-R458 VanDerWaalsContact O-CA 3.26Å; L379-R458 WeakPolarHBondContact O-CA 3Å; L379-V459 PolarHBondContact N-O 3.33Å; L379-V459 VanDerWaalsContact N-O 3.08Å; L379-V459 PolarHBondContact O-N 3.13Å; L379-L470 HydrophobicContact CD2-CD2 3.96Å; L379-M472 HydrophobicContact CD2-CG 4.21Å; L379-M472 HydrophobicContact CD2-SD 3.6Å; L379-M472 VanDerWaalsContact CD2-SD 3.6Å
380	Q	97.4	Very high	95	Very high	21 Å²	21	42.9 Å²	42.9	10%	0.098	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	142.2	-174.4	-179.6	-179.9	-57.8	0	0	111.3	I336 T337 W378 W420 V457 R458	I336-Q380 WeakPolarHBondContact CA-O 3.28Å; T337-Q380 PolarHBondContact N-O 3.05Å; T337-Q380 WeakPolarHBondContact O-CA 3.44Å; T337-Q380 PolarHBondContact O-N 2.88Å; T337-Q380 VanDerWaalsContact O-O 3.13Å; W378-Q380 HydrophobicContact CE3-CB 3.65Å; W378-Q380 HydrophobicContact CZ3-CB 3.44Å; W378-Q380 VanDerWaalsContact CZ3-CB 3.44Å; W378-Q380 HydrophobicContact CZ3-CG 4.44Å; Q380-W420 HydrophobicContact CG-CH2 4.1Å; Q380-V457 CarbonylContact C-O 3.03Å; Q380-V457 VanDerWaalsContact CA-O 3.31Å; Q380-V457 WeakPolarHBondContact CA-O 3.44Å; Q380-R458 HydrophobicContact CB-CG 3.77Å; Q380-R458 HydrophobicContact CG-CG 4Å; Q380-R458 VanDerWaalsContact OE1-CZ 3.27Å
381	V	98	Very high	94.8	Very high	1 Å²	1	42.9 Å²	42.9	1%	0.006	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	127.1	171.2	-175.2	0	0	0	0	109.2	M326 V331 Q335 L383 Y456 V457 M472 L474	M326-V381 HydrophobicContact CE-CG2 3.87Å; M326-V381 HydrophobicContact SD-CG1 4.04Å; M326-V381 HydrophobicContact SD-CG2 3.85Å; V331-V381 HydrophobicContact CG1-CG1 3.86Å; Q335-V381 WeakPolarHBondContact O-CA 3.3Å; V381-L383 HydrophobicContact CG1-CD2 3.95Å; V381-Y456 WeakPolarHBondContact O-CA 3.35Å; V381-V457 PolarHBondContact N-O 2.71Å; V381-V457 PolarHBondContact O-N 3.07Å; V381-M472 HydrophobicContact CG2-CE 4.01Å; V381-L474 HydrophobicContact CB-CD1 4Å; V381-L474 HydrophobicContact CG1-CD1 4.11Å; V381-L474 HydrophobicContact CG2-CD1 4.19Å
382	D	97.3	Very high	94.8	Very high	24 Å²	24	40.8 Å²	40.8	13%	0.128	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.4	113.4	169.2	-175.8	-4	0	0	0	109.8	Q335 L384 R455 Y456	Q335-D382 HydrophobicContact CB-CB 4.47Å; Q335-D382 WeakPolarHBondContact CB-O 3.02Å; Q335-D382 PolarHBondContact NE2-O 2.78Å; Q335-D382 PolarHBondContact O-N 2.86Å; D382-L384 VanDerWaalsContact C-N 3.26Å; D382-L384 PolarHBondContact O-N 3.18Å; D382-L384 WeakPolarHBondContact OD1-CA 3.29Å; D382-L384 PolarHBondContact OD1-N 3.47Å; D382-R455 WeakPolarHBondContact OD1-CG 3.22Å; D382-R455 IonicContact OD1-CZ 3.64Å; D382-R455 IonicContact OD1-NE 2.87Å; D382-R455 PolarHBondContact OD1-NE 2.96Å; D382-R455 IonicContact OD1-NH2 3.74Å; D382-R455 PolarHBondContact OD1-NH2 3.23Å; D382-R455 IonicContact OD2-CZ 3.38Å; D382-R455 IonicContact OD2-NE 2.76Å; D382-R455 IonicContact OD2-NH2 3.87Å; D382-R455 PolarHBondContact OD2-NH2 2.93Å; D382-Y456 HydrophobicContact CB-CD1 3.77Å; D382-Y456 HydrophobicContact CB-CE1 3.52Å; D382-Y456 VanDerWaalsContact OD2-CE1 3.25Å; D382-Y456 WeakPolarHBondContact OD2-CE1 3.3Å; D382-Y456 PolarHBondContact OD2-OH 3.01Å
383	L	95	Very high	94.8	Very high	9 Å²	9	36.7 Å²	36.7	5%	0.047	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.8	1.4	-179.8	-59.9	172.8	0	0	0	113.6	M324 V331 V381 S385 K387 I389 R455 V457 L474	M324-L383 HydrophobicContact CB-CD2 4.41Å; V331-L383 HydrophobicContact CG2-CD2 4.43Å; V381-L383 HydrophobicContact CG1-CD2 3.95Å; L383-S385 PolarHBondContact O-N 3.32Å; L383-K387 HydrophobicContact CB-CD 4.22Å; L383-K387 HydrophobicContact CB-CG 4.34Å; L383-K387 HydrophobicContact CD1-CB 4.19Å; L383-K387 HydrophobicContact CD1-CD 4.4Å; L383-K387 HydrophobicContact CD1-CG 4.43Å; L383-I389 HydrophobicContact CD1-CD1 3.4Å; L383-I389 HydrophobicContact CD1-CG1 4.3Å; L383-R455 WeakPolarHBondContact CB-O 3.44Å; L383-R455 PolarHBondContact N-O 3.38Å; L383-V457 HydrophobicContact CD1-CG2 4.41Å; L383-L474 HydrophobicContact CD2-CD1 4.29Å
384	L	93.7	Very high	94.9	Very high	79 Å²	79	33.9 Å²	33.9	41%	0.414	18%	0.178	S	C	.	.	E	Extended strand (participates in β ladder)	trans	67.6	-40.7	-177.9	-52.7	176.2	0	0	0	114.9	Q335 D382 R455	Q335-L384 HydrophobicContact CG-CD2 4.13Å; Q335-L384 HydrophobicContact CG-CG 4.38Å; D382-L384 VanDerWaalsContact C-N 3.26Å; D382-L384 PolarHBondContact O-N 3.18Å; D382-L384 WeakPolarHBondContact OD1-CA 3.29Å; D382-L384 PolarHBondContact OD1-N 3.47Å; L384-R455 WeakPolarHBondContact O-CD 3.42Å; L384-R455 PolarHBondContact O-NE 3.12Å
385	S	92	Very high	94.8	Very high	51 Å²	51	32.3 Å²	32.3	36%	0.357	17%	0.167	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	154.6	170.8	56.1	0	0	0	0	110.6	L383 K387	L383-S385 PolarHBondContact O-N 3.32Å; S385-K387 PolarHBondContact O-N 3.03Å
386	P	93	Very high	94.8	Very high	88 Å²	88	26.1 Å²	26.1	57%	0.571	14%	0.143	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-60.2	124	166.8	-19.9	32.7	0	0	0	109.8
387	K	91.4	Very high	94.7	Very high	34 Å²	34	22.4 Å²	22.4	15%	0.148	12%	0.117	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	156.3	176.8	-59	-167.2	179.4	-133.6	0	110.2	M324 L383 S385 I389 Y453 S454 D478	M324-K387 HydrophobicContact SD-CD 3.93Å; L383-K387 HydrophobicContact CB-CD 4.22Å; L383-K387 HydrophobicContact CB-CG 4.34Å; L383-K387 HydrophobicContact CD1-CB 4.19Å; L383-K387 HydrophobicContact CD1-CD 4.4Å; L383-K387 HydrophobicContact CD1-CG 4.43Å; S385-K387 PolarHBondContact O-N 3.03Å; K387-I389 HydrophobicContact CB-CD1 4.1Å; K387-I389 PolarHBondContact O-N 2.92Å; K387-Y453 WeakPolarHBondContact O-CA 3.47Å; K387-S454 PolarHBondContact N-O 2.88Å; K387-S454 PolarHBondContact O-N 2.92Å; K387-D478 WeakPolarHBondContact CD-OD1 3.48Å; K387-D478 WeakPolarHBondContact CE-OD1 3.02Å; K387-D478 WeakPolarHBondContact CG-OD1 3.27Å; K387-D478 IonicContact NZ-OD1 3.56Å; K387-D478 PolarHBondContact NZ-OD1 2.82Å; K387-D478 IonicContact NZ-OD2 2.83Å; K387-D478 PolarHBondContact NZ-OD2 3.42Å
388	R	91.8	Very high	94.4	Very high	57 Å²	57	27 Å²	27	22%	0.215	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.2	112.7	173.5	-169	168.3	79.1	-169.6	-1.9	109.3	N318 C320 Y453 G476 C477	N318-R388 PolarHBondContact O-NH2 3.15Å; C320-R388 PolarHBondContact SG-NE 3.4Å; R388-Y453 HydrophobicContact CB-CD1 4.03Å; R388-Y453 HydrophobicContact CB-CE1 3.64Å; R388-Y453 VanDerWaalsContact CD-CZ 3.47Å; R388-Y453 WeakPolarHBondContact CD-OH 3.2Å; R388-Y453 HydrophobicContact CG-CD1 4.46Å; R388-Y453 HydrophobicContact CG-CE1 3.97Å; R388-Y453 HydrophobicContact CG-CE2 4.05Å; R388-G476 CarbonylContact O-C 3.57Å; R388-G476 WeakPolarHBondContact O-CA 3.38Å; R388-C477 PolarHBondContact N-O 3.06Å; R388-C477 PolarHBondContact O-N 3.18Å; R388-C477 VanDerWaalsContact O-N 3.1Å
389	I	93.3	Very high	93.7	Very high	0 Å²	0	25 Å²	25	0%	0	13%	0.131	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.5	123.7	-178.1	-48.2	-57.2	0	0	0	109.3	L383 K387 F448 F452 V457	L383-I389 HydrophobicContact CD1-CD1 3.4Å; L383-I389 HydrophobicContact CD1-CG1 4.3Å; K387-I389 HydrophobicContact CB-CD1 4.1Å; K387-I389 PolarHBondContact O-N 2.92Å; I389-F448 HydrophobicContact CG2-CD2 3.9Å; I389-F448 HydrophobicContact CG2-CE2 3.73Å; I389-F452 HydrophobicContact CB-CD2 4.45Å; I389-F452 HydrophobicContact CB-CE1 4.19Å; I389-F452 HydrophobicContact CB-CE2 3.97Å; I389-F452 HydrophobicContact CB-CZ 3.84Å; I389-F452 HydrophobicContact CG1-CE2 4.12Å; I389-F452 HydrophobicContact CG1-CZ 4.37Å; I389-F452 HydrophobicContact CG2-CE1 4.24Å; I389-F452 HydrophobicContact CG2-CE2 4.47Å; I389-F452 HydrophobicContact CG2-CZ 3.89Å; I389-F452 PolarHBondContact N-O 3.47Å; I389-F452 PolarHBondContact O-N 2.76Å; I389-F452 VanDerWaalsContact O-N 3.17Å; I389-V457 HydrophobicContact CG1-CG2 4.12Å
390	T	91.1	Very high	93	Very high	12 Å²	12	31.3 Å²	31.3	7%	0.074	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115	-17.2	-174.7	58.5	0	0	0	0	112.5	C320 I447 F448 P451 L475	C320-T390 HydrophobicContact CB-CG2 3.93Å; C320-T390 VanDerWaalsContact O-CB 3.26Å; C320-T390 WeakPolarHBondContact O-CB 3.44Å; C320-T390 WeakPolarHBondContact O-CG2 3.13Å; C320-T390 PolarHBondContact O-OG1 3.17Å; T390-I447 WeakPolarHBondContact O-CA 3.49Å; T390-I447 WeakPolarHBondContact O-CG2 3.38Å; T390-F448 PolarHBondContact O-N 3.03Å; T390-P451 HydrophobicContact CG2-CB 4.02Å; T390-L475 PolarHBondContact N-O 2.93Å; T390-L475 PolarHBondContact OG1-O 3.22Å
391	G	92.4	Very high	92.2	Very high	0 Å²	0	32.5 Å²	32.5	0%	0	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-175.4	-176.6	178.2	0	0	0	0	0	114.8	N446 F448 L475	G391-N446 CarbonylContact C-O 3.57Å; G391-N446 WeakPolarHBondContact CA-O 3.39Å; G391-F448 VanDerWaalsContact C-CE2 3.48Å; G391-L475 PolarHBondContact N-O 3.23Å; G391-L475 PolarHBondContact O-N 3.26Å
392	I	95.3	Very high	91.8	Very high	0 Å²	0	35.5 Å²	35.5	0%	0	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.8	141.9	177.2	-171.9	171.4	0	0	0	109.4	T394 F409 I411 N446 F448 V459 M472 E473 L474	I392-T394 HydrophobicContact CD1-CG2 4.06Å; I392-T394 HydrophobicContact CG1-CG2 4.05Å; I392-F409 HydrophobicContact CG2-CE2 3.93Å; I392-F409 HydrophobicContact CG2-CZ 3.81Å; I392-I411 HydrophobicContact CD1-CD1 4.22Å; I392-N446 HydrophobicContact CG2-CB 4.04Å; I392-N446 PolarHBondContact N-O 2.8Å; I392-N446 PolarHBondContact O-N 3.48Å; I392-F448 HydrophobicContact CB-CE2 4.44Å; I392-F448 HydrophobicContact CB-CZ 3.85Å; I392-F448 HydrophobicContact CG2-CE1 3.94Å; I392-F448 HydrophobicContact CG2-CZ 3.54Å; I392-V459 HydrophobicContact CD1-CG2 3.57Å; I392-M472 HydrophobicContact CD1-CB 4.3Å; I392-M472 HydrophobicContact CD1-CE 3.76Å; I392-M472 HydrophobicContact CD1-SD 4.07Å; I392-M472 HydrophobicContact CG1-CB 4.39Å; I392-M472 HydrophobicContact CG1-CE 4.39Å; I392-E473 CarbonylContact C-O 3.56Å; I392-E473 WeakPolarHBondContact CA-O 3.23Å; I392-L474 HydrophobicContact CB-CD2 4.28Å; I392-L474 HydrophobicContact CD1-CD2 4.13Å; I392-L474 HydrophobicContact CG1-CD2 4.1Å
393	V	94.2	Very high	91.5	Very high	14 Å²	14	37.6 Å²	37.6	9%	0.085	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	127.7	167.9	-173.5	0	0	0	0	107.9	L359 H443 K444 K445 M472 E473 L475	L359-V393 HydrophobicContact CD1-CB 4.5Å; L359-V393 HydrophobicContact CD1-CG1 3.91Å; L359-V393 HydrophobicContact CD2-CB 4.27Å; L359-V393 HydrophobicContact CD2-CG1 3.96Å; V393-H443 HydrophobicContact CG1-CB 3.77Å; V393-K444 CarbonylContact C-O 3.48Å; V393-K444 WeakPolarHBondContact CA-O 3.29Å; V393-K445 HydrophobicContact CG2-CB 4.18Å; V393-K445 HydrophobicContact CG2-CD 4.46Å; V393-K445 HydrophobicContact CG2-CG 4.12Å; V393-M472 CarbonylContact O-C 3.58Å; V393-M472 WeakPolarHBondContact O-CA 3.46Å; V393-M472 WeakPolarHBondContact O-CB 3.47Å; V393-E473 HydrophobicContact CB-CB 4.39Å; V393-E473 PolarHBondContact N-O 3.19Å; V393-E473 PolarHBondContact O-N 2.79Å; V393-L475 HydrophobicContact CG2-CD1 3.92Å; V393-L475 HydrophobicContact CG2-CD2 4.25Å; V393-L475 HydrophobicContact CG2-CG 4.2Å
394	T	96.4	Very high	91.5	Very high	1 Å²	1	37.9 Å²	37.9	1%	0.006	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	150.9	179.1	64.8	0	0	0	0	111.3	I392 F409 N437 K444 L470 R471	I392-T394 HydrophobicContact CD1-CG2 4.06Å; I392-T394 HydrophobicContact CG1-CG2 4.05Å; T394-F409 HydrophobicContact CG2-CE1 3.87Å; T394-F409 HydrophobicContact CG2-CZ 3.96Å; T394-N437 VanDerWaalsContact CB-OD1 3.29Å; T394-N437 WeakPolarHBondContact CB-OD1 3.45Å; T394-N437 PolarHBondContact O-ND2 2.89Å; T394-N437 PolarHBondContact OG1-OD1 2.76Å; T394-K444 PolarHBondContact N-O 2.86Å; T394-K444 PolarHBondContact O-N 3.14Å; T394-L470 HydrophobicContact CG2-CD1 3.95Å; T394-R471 CarbonylContact C-O 3.55Å; T394-R471 WeakPolarHBondContact CA-O 3.49Å
395	Q	95.3	Very high	91.6	Very high	6 Å²	6	35 Å²	35	3%	0.028	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.3	139.5	179.1	-174.2	-173.4	45.8	0	0	108.5	L359 D360 N437 N441 H443 R471	L359-Q395 HydrophobicContact CD1-CB 3.78Å; D360-Q395 PolarHBondContact OD1-NE2 3.11Å; D360-Q395 PolarHBondContact OD1-OE1 2.84Å; Q395-N437 WeakPolarHBondContact CA-ND2 3.49Å; Q395-N437 PolarHBondContact N-OD1 2.83Å; Q395-N441 PolarHBondContact NE2-O 2.8Å; Q395-H443 PolarHBondContact NE2-CD2 2.79Å; Q395-H443 PolarHBondContact NE2-NE2 3.44Å; Q395-R471 HydrophobicContact CB-CB 4.08Å; Q395-R471 VanDerWaalsContact CD-NH2 3.28Å; Q395-R471 PolarHBondContact N-O 2.84Å; Q395-R471 PolarHBondContact O-N 3Å; Q395-R471 VanDerWaalsContact OE1-NE 3.1Å
396	G	94.5	Very high	91.9	Very high	0 Å²	0	32.6 Å²	32.6	0%	0	18%	0.177	C	C	.	.			trans	-76.5	-163.2	174.7	0	0	0	0	0	112.7	Q404 N440 R471	G396-Q404 WeakPolarHBondContact CA-O 3.44Å; G396-N440 CarbonylContact C-O 3.53Å; G396-N440 PolarHBondContact N-O 3.49Å; G396-R471 PolarHBondContact O-NE 2.97Å; G396-R471 PolarHBondContact O-NH2 2.52Å
397	A	94	Very high	92	Very high	0 Å²	0	30.1 Å²	30.1	0%	0	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.5	-173.6	165.4	0	0	0	0	0	111.3	W352 A367 Q404 N440 T469	W352-A397 HydrophobicContact CZ3-CB 4.48Å; A367-A397 HydrophobicContact CB-CB 3.7Å; A397-Q404 PolarHBondContact N-O 3.37Å; A397-Q404 PolarHBondContact O-N 2.91Å; A397-N440 WeakPolarHBondContact O-CB 3.08Å; A397-T469 HydrophobicContact CB-CG2 3.56Å
398	K	90.6	Very high	92.3	Very high	108 Å²	108	28.9 Å²	28.9	47%	0.47	16%	0.158	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.2	125.6	-178.7	-172.3	177.7	-177.9	175.4	0	109.1	G401 S402	K398-G401 WeakPolarHBondContact CE-O 3.26Å; K398-S402 WeakPolarHBondContact CA-O 3.35Å; K398-S402 WeakPolarHBondContact CG-O 3.27Å
399	D	83.8	Confident	92.6	Very high	21 Å²	21	26.2 Å²	26.2	11%	0.112	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	113.3	175	-172.9	28.6	0	0	0	109	W352 G401 S402	W352-D399 HydrophobicContact CH2-CB 4.3Å; W352-D399 HydrophobicContact CZ2-CB 4Å; W352-D399 WeakPolarHBondContact CZ2-OD1 3.35Å; D399-G401 PolarHBondContact O-N 2.66Å; D399-S402 PolarHBondContact N-O 2.98Å; D399-S402 PolarHBondContact O-N 2.86Å
400	F	82.9	Confident	92.7	Very high	131 Å²	131	27.3 Å²	27.3	58%	0.575	15%	0.152	S	C	*	.	T	Hydrogen-bonded Turn	trans	45.4	25.3	177.9	-71.1	-79.7	0	0	0	118	T344 W345 F350	T344-F400 HydrophobicContact CG2-CD2 4.33Å; T344-F400 HydrophobicContact CG2-CE2 3.94Å; W345-F400 HydrophobicContact CE3-CZ 4.49Å; W345-F400 HydrophobicContact CH2-CD1 4.06Å; W345-F400 HydrophobicContact CH2-CD2 4.13Å; W345-F400 AromaticContact CH2-CE1 3.63Å; W345-F400 HydrophobicContact CH2-CE1 3.63Å; W345-F400 AromaticContact CH2-CE2 3.76Å; W345-F400 HydrophobicContact CH2-CE2 3.76Å; W345-F400 HydrophobicContact CH2-CG 4.3Å; W345-F400 AromaticContact CH2-CZ 3.48Å; W345-F400 HydrophobicContact CH2-CZ 3.48Å; W345-F400 VanDerWaalsContact CH2-CZ 3.48Å; W345-F400 HydrophobicContact CZ2-CD2 4.48Å; W345-F400 HydrophobicContact CZ2-CE2 4.43Å; W345-F400 AromaticContact CZ3-CE1 3.99Å; W345-F400 HydrophobicContact CZ3-CE1 3.99Å; W345-F400 AromaticContact CZ3-CE2 3.83Å; W345-F400 HydrophobicContact CZ3-CE2 3.83Å; W345-F400 AromaticContact CZ3-CZ 3.45Å; W345-F400 HydrophobicContact CZ3-CZ 3.45Å; W345-F400 VanDerWaalsContact CZ3-CZ 3.45Å; F350-F400 HydrophobicContact CD1-CZ 4.33Å; F350-F400 HydrophobicContact CE1-CZ 4.17Å
401	G	81.3	Confident	93.1	Very high	47 Å²	47	26.7 Å²	26.7	49%	0.485	15%	0.149	S	C	.	.	T	Hydrogen-bonded Turn	trans	123.8	-29.1	-175	0	0	0	0	0	113.5	K398 D399	K398-G401 WeakPolarHBondContact CE-O 3.26Å; D399-G401 PolarHBondContact O-N 2.66Å
402	S	87.9	Confident	93.3	Very high	63 Å²	63	26.9 Å²	26.9	44%	0.441	15%	0.15	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.2	125.3	-174.3	-58.5	0	0	0	0	111	K398 D399	K398-S402 WeakPolarHBondContact CA-O 3.35Å; K398-S402 WeakPolarHBondContact CG-O 3.27Å; D399-S402 PolarHBondContact N-O 2.98Å; D399-S402 PolarHBondContact O-N 2.86Å
403	I	91.9	Very high	93.4	Very high	69 Å²	69	28.7 Å²	28.7	35%	0.354	16%	0.158	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.2	123.7	177.6	-61.7	174.1	0	0	0	107.9	F405 N440 H465	I403-F405 HydrophobicContact CG2-CD1 3.84Å; I403-F405 HydrophobicContact CG2-CE1 3.93Å; I403-N440 HydrophobicContact CB-CB 4.5Å; I403-N440 HydrophobicContact CG2-CB 3.65Å; I403-H465 PolarHBondContact O-ND1 2.77Å; I403-H465 VanDerWaalsContact O-ND1 3.13Å
404	Q	94.6	Very high	93.5	Very high	15 Å²	15	28.3 Å²	28.3	7%	0.07	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.2	134.1	-177.2	-61	175	-7	0	0	109.8	G396 A397 E466 R467 T469	G396-Q404 WeakPolarHBondContact CA-O 3.44Å; A397-Q404 PolarHBondContact N-O 3.37Å; A397-Q404 PolarHBondContact O-N 2.91Å; Q404-E466 HydrophobicContact CG-CB 3.98Å; Q404-R467 HydrophobicContact CG-CB 4.23Å; Q404-T469 HydrophobicContact CB-CG2 4.37Å; Q404-T469 WeakPolarHBondContact CB-OG1 3.45Å; Q404-T469 PolarHBondContact OE1-OG1 2.99Å; Q404-T469 VanDerWaalsContact OE1-OG1 3.07Å
405	F	96.2	Very high	93.5	Very high	17 Å²	17	32.8 Å²	32.8	8%	0.075	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-162.1	159	-178.6	57.2	-94	0	0	0	112.1	I403 N437 S438 D439 W464 H465	I403-F405 HydrophobicContact CG2-CD1 3.84Å; I403-F405 HydrophobicContact CG2-CE1 3.93Å; F405-N437 HydrophobicContact CB-CB 4.08Å; F405-N437 HydrophobicContact CD2-CB 4.16Å; F405-N437 WeakPolarHBondContact CD2-O 3.35Å; F405-N437 WeakPolarHBondContact CE2-O 3.24Å; F405-N437 HydrophobicContact CG-CB 4.35Å; F405-S438 VanDerWaalsContact CZ-C 3.43Å; F405-S438 VanDerWaalsContact CZ-O 3.27Å; F405-S438 WeakPolarHBondContact CZ-O 3.08Å; F405-D439 WeakPolarHBondContact CB-O 3.4Å; F405-W464 CarbonylContact O-C 3.58Å; F405-W464 VanDerWaalsContact O-CA 3.3Å; F405-W464 WeakPolarHBondContact O-CA 3.35Å; F405-W464 WeakPolarHBondContact O-CB 3.46Å; F405-H465 HydrophobicContact CD1-CB 3.9Å; F405-H465 HydrophobicContact CD2-CB 3.96Å; F405-H465 HydrophobicContact CE1-CB 3.49Å; F405-H465 VanDerWaalsContact CE1-CB 3.49Å; F405-H465 AromaticContact CE1-CG 3.59Å; F405-H465 AromaticContact CE1-ND1 3.8Å; F405-H465 HydrophobicContact CE2-CB 3.54Å; F405-H465 HydrophobicContact CG-CB 4.13Å; F405-H465 HydrophobicContact CZ-CB 3.3Å; F405-H465 AromaticContact CZ-CG 3.62Å; F405-H465 PolarHBondContact N-O 2.85Å; F405-H465 PolarHBondContact O-N 3.16Å
406	V	97.6	Very high	93.4	Very high	2 Å²	2	36.5 Å²	36.5	1%	0.012	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.8	120.3	171.5	179.3	0	0	0	0	109.1	S408 F409 N437 P461 I468	V406-S408 VanDerWaalsContact CG1-O 3.24Å; V406-S408 WeakPolarHBondContact CG1-O 3.16Å; V406-F409 HydrophobicContact CG1-CB 4.05Å; V406-F409 HydrophobicContact CG1-CD1 4.39Å; V406-N437 PolarHBondContact O-N 2.73Å; V406-P461 HydrophobicContact CG1-CB 4.18Å; V406-P461 HydrophobicContact CG2-CB 4.26Å; V406-P461 HydrophobicContact CG2-CG 4.48Å; V406-I468 HydrophobicContact CG2-CG2 4.03Å
407	S	95.9	Very high	93.3	Very high	36 Å²	36	37.5 Å²	37.5	25%	0.252	21%	0.211	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.9	-23.9	-177.8	59.4	0	0	0	0	113.1	G436 N437 E463 W464	S407-G436 WeakPolarHBondContact O-CA 3.29Å; S407-G436 PolarHBondContact O-N 3.22Å; S407-N437 WeakPolarHBondContact CA-O 3.49Å; S407-E463 PolarHBondContact N-O 2.7Å; S407-E463 WeakPolarHBondContact OG-CB 3.3Å; S407-E463 PolarHBondContact OG-O 2.79Å; S407-W464 PolarHBondContact OG-N 3.26Å
408	S	97	Very high	93.2	Very high	8 Å²	8	48.1 Å²	48.1	6%	0.056	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.7	149.6	168.6	67.5	0	0	0	0	111.7	V406 F434 W462 E463	V406-S408 VanDerWaalsContact CG1-O 3.24Å; V406-S408 WeakPolarHBondContact CG1-O 3.16Å; S408-F434 VanDerWaalsContact CA-O 3.25Å; S408-F434 WeakPolarHBondContact CA-O 3.41Å; S408-W462 WeakPolarHBondContact O-CB 3.26Å; S408-W462 PolarHBondContact O-N 2.87Å; S408-E463 PolarHBondContact N-O 3.26Å; S408-E463 VanDerWaalsContact N-O 3.16Å; S408-E463 PolarHBondContact O-N 2.95Å; S408-E463 VanDerWaalsContact O-N 3.14Å; S408-E463 VanDerWaalsContact OG-CB 3.22Å; S408-E463 WeakPolarHBondContact OG-CB 3.18Å; S408-E463 WeakPolarHBondContact OG-CG 3.47Å; S408-E463 PolarHBondContact OG-N 2.86Å; S408-E463 PolarHBondContact OG-OE2 3.48Å; S408-E463 VanDerWaalsContact OG-OE2 3.04Å
409	F	97.7	Very high	93.4	Very high	0 Å²	0	46.3 Å²	46.3	0%	0	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151	162.3	-177.5	63.1	-89.1	0	0	0	112.2	I392 T394 V406 I411 F434 N446 V459 L460	I392-F409 HydrophobicContact CG2-CE2 3.93Å; I392-F409 HydrophobicContact CG2-CZ 3.81Å; T394-F409 HydrophobicContact CG2-CE1 3.87Å; T394-F409 HydrophobicContact CG2-CZ 3.96Å; V406-F409 HydrophobicContact CG1-CB 4.05Å; V406-F409 HydrophobicContact CG1-CD1 4.39Å; F409-I411 HydrophobicContact CD2-CD1 3.89Å; F409-I411 HydrophobicContact CD2-CG1 4.11Å; F409-I411 HydrophobicContact CE2-CD1 3.77Å; F409-I411 HydrophobicContact CE2-CG1 3.91Å; F409-F434 HydrophobicContact CD1-CB 4.38Å; F409-F434 HydrophobicContact CD2-CB 4.11Å; F409-F434 HydrophobicContact CD2-CD2 4.3Å; F409-F434 HydrophobicContact CE1-CB 4Å; F409-F434 HydrophobicContact CE2-CB 3.68Å; F409-F434 HydrophobicContact CE2-CD2 4.02Å; F409-F434 HydrophobicContact CE2-CG 4.02Å; F409-F434 HydrophobicContact CG-CB 4.43Å; F409-F434 HydrophobicContact CZ-CB 3.63Å; F409-F434 HydrophobicContact CZ-CG 4.3Å; F409-F434 PolarHBondContact N-O 3.05Å; F409-F434 PolarHBondContact O-N 2.81Å; F409-N446 HydrophobicContact CZ-CB 4.35Å; F409-V459 HydrophobicContact CB-CG1 4.2Å; F409-V459 HydrophobicContact CD2-CG1 3.99Å; F409-V459 HydrophobicContact CG-CG1 4.21Å; F409-L460 CarbonylContact C-O 3.6Å; F409-L460 VanDerWaalsContact CA-O 3.29Å; F409-L460 WeakPolarHBondContact CA-O 3.23Å; F409-L460 WeakPolarHBondContact CB-O 3.34Å
410	K	97.3	Very high	94	Very high	23 Å²	23	48.4 Å²	48.4	10%	0.1	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113	160.6	169.3	-60.6	177.3	175.2	-176.4	0	109.8	V422 D431 I433 L460 W462	K410-V422 HydrophobicContact CB-CG1 4.31Å; K410-V422 HydrophobicContact CD-CG1 4.42Å; K410-D431 HydrophobicContact CD-CB 4Å; K410-D431 IonicContact NZ-OD2 3.83Å; K410-D431 PolarHBondContact NZ-OD2 3.03Å; K410-I433 HydrophobicContact CG-CG1 4.19Å; K410-L460 HydrophobicContact CB-CB 4.17Å; K410-L460 HydrophobicContact CB-CD1 4.42Å; K410-L460 PolarHBondContact N-O 3.22Å; K410-L460 PolarHBondContact O-N 3.16Å; K410-W462 HydrophobicContact CD-CE3 4.19Å; K410-W462 HydrophobicContact CD-CZ3 4.49Å
411	I	97.7	Very high	94.7	Very high	0 Å²	0	46.2 Å²	46.2	0%	0	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	130.9	176	-63.6	-67.1	0	0	0	109	I392 F409 V422 L423 F434 F448 F452 V457 R458 V459	I392-I411 HydrophobicContact CD1-CD1 4.22Å; F409-I411 HydrophobicContact CD2-CD1 3.89Å; F409-I411 HydrophobicContact CD2-CG1 4.11Å; F409-I411 HydrophobicContact CE2-CD1 3.77Å; F409-I411 HydrophobicContact CE2-CG1 3.91Å; I411-V422 WeakPolarHBondContact O-CA 3.33Å; I411-L423 HydrophobicContact CB-CD1 3.78Å; I411-L423 HydrophobicContact CB-CG 4.14Å; I411-L423 HydrophobicContact CG2-CD1 3.75Å; I411-L423 HydrophobicContact CG2-CG 4.09Å; I411-L423 PolarHBondContact O-N 2.72Å; I411-F434 HydrophobicContact CB-CE2 4.23Å; I411-F434 HydrophobicContact CG1-CD2 4.09Å; I411-F434 HydrophobicContact CG1-CE2 3.93Å; I411-F448 HydrophobicContact CD1-CZ 4.16Å; I411-F448 HydrophobicContact CG1-CE1 3.8Å; I411-F448 HydrophobicContact CG1-CZ 3.77Å; I411-F448 HydrophobicContact CG2-CZ 4.39Å; I411-F452 HydrophobicContact CG2-CE1 4.37Å; I411-F452 HydrophobicContact CG2-CZ 4.04Å; I411-V457 HydrophobicContact CG2-CG1 4.15Å; I411-R458 WeakPolarHBondContact CA-O 3.38Å; I411-V459 HydrophobicContact CD1-CB 4.35Å; I411-V459 HydrophobicContact CD1-CG1 4.37Å; I411-V459 HydrophobicContact CD1-CG2 3.86Å
412	A	97.3	Very high	95.4	Very high	4 Å²	4	45.8 Å²	45.8	3%	0.033	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	147.9	170.1	0	0	0	0	0	110.1	W420 T421 V422 R458 L460	A412-W420 HydrophobicContact CB-CE3 4.09Å; A412-T421 CarbonylContact C-O 3.54Å; A412-T421 VanDerWaalsContact CA-O 3.29Å; A412-T421 WeakPolarHBondContact CA-O 3.33Å; A412-V422 HydrophobicContact CB-CG2 4.21Å; A412-R458 HydrophobicContact CB-CB 4.15Å; A412-R458 PolarHBondContact N-O 2.99Å; A412-R458 PolarHBondContact O-N 3.46Å; A412-L460 HydrophobicContact CB-CD1 3.96Å; A412-L460 HydrophobicContact CB-CG 4.42Å
413	H	96.9	Very high	95.7	Very high	38 Å²	38	43.9 Å²	43.9	18%	0.176	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.6	156	-177.2	71.7	-71.4	0	0	0	111.4	T421 F452 Y456	H413-T421 PolarHBondContact N-O 3.02Å; H413-T421 PolarHBondContact ND1-O 3.19Å; H413-T421 PolarHBondContact O-N 3.42Å; H413-F452 HydrophobicContact CB-CD2 3.84Å; H413-F452 HydrophobicContact CB-CE2 3.42Å; H413-F452 VanDerWaalsContact CB-CE2 3.42Å; H413-F452 HydrophobicContact CB-CZ 4.22Å; H413-F452 AromaticContact CD2-CD2 3.65Å; H413-F452 AromaticContact CG-CD2 3.68Å; H413-F452 AromaticContact CG-CE2 3.8Å; H413-Y456 VanDerWaalsContact CA-O 3.3Å; H413-Y456 WeakPolarHBondContact CA-O 3.47Å
414	S	97.5	Very high	95.7	Very high	5 Å²	5	45.9 Å²	45.9	4%	0.035	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-158.4	146.3	-175.2	178.4	0	0	0	0	111.8	D416 G417 S419 S454 Y456	S414-D416 PolarHBondContact OG-N 2.9Å; S414-D416 PolarHBondContact OG-OD1 3.44Å; S414-G417 WeakPolarHBondContact OG-CA 3.31Å; S414-G417 PolarHBondContact OG-N 3.2Å; S414-S419 WeakPolarHBondContact CB-O 3.38Å; S414-S419 PolarHBondContact OG-O 2.89Å; S414-S454 PolarHBondContact N-OG 2.91Å; S414-S454 VanDerWaalsContact N-OG 3.08Å; S414-S454 PolarHBondContact O-OG 2.94Å; S414-Y456 PolarHBondContact N-O 3.05Å; S414-Y456 WeakPolarHBondContact O-CB 3.5Å; S414-Y456 WeakPolarHBondContact O-CD2 3.32Å; S414-Y456 PolarHBondContact O-N 2.94Å
415	N	95.4	Very high	95.4	Very high	96 Å²	96	47.5 Å²	47.5	51%	0.513	25%	0.245	S	C	.	.	S	Bend	trans	-100.1	-20.4	173.5	-73.9	-30.3	0	0	0	113.3	S454 R455	N415-S454 VanDerWaalsContact OD1-CA 3.28Å; N415-S454 WeakPolarHBondContact OD1-CA 3.19Å; N415-R455 PolarHBondContact OD1-N 2.91Å
416	D	93.6	Very high	94.7	Very high	83 Å²	83	54 Å²	54	44%	0.444	28%	0.276	S	S	.	.	S	Bend	trans	-109.3	-10.1	-176.8	63.7	5.7	0	0	0	113.3	S414 R418 S419	S414-D416 PolarHBondContact OG-N 2.9Å; S414-D416 PolarHBondContact OG-OD1 3.44Å; D416-R418 PolarHBondContact O-N 2.87Å; D416-R418 PolarHBondContact OD1-N 2.74Å; D416-S419 VanDerWaalsContact CG-OG 3.25Å; D416-S419 PolarHBondContact OD1-N 3.46Å; D416-S419 PolarHBondContact OD1-OG 3.41Å; D416-S419 VanDerWaalsContact OD1-OG 3.11Å; D416-S419 PolarHBondContact OD2-N 2.84Å; D416-S419 PolarHBondContact OD2-OG 2.83Å
417	G	92	Very high	94	Very high	22 Å²	22	58.7 Å²	58.7	23%	0.227	31%	0.309	C	S	.	.	S	Bend	trans	74.2	0	-174.6	0	0	0	0	0	114.6	S414 W420	S414-G417 WeakPolarHBondContact OG-CA 3.31Å; S414-G417 PolarHBondContact OG-N 3.2Å; G417-W420 PolarHBondContact O-NE1 2.9Å; G417-W420 VanDerWaalsContact O-NE1 3.13Å
418	R	92.3	Very high	93.5	Very high	223 Å²	223	60.9 Å²	60.9	84%	0.842	32%	0.321	S	S	*	.	S	Bend	trans	-112.8	-47.3	-175	-63.5	-177.3	-178.8	-171.7	0.5	112.2	D416 W420	D416-R418 PolarHBondContact O-N 2.87Å; D416-R418 PolarHBondContact OD1-N 2.74Å; R418-W420 VanDerWaalsContact O-CD1 3.3Å
419	S	95.7	Very high	93	Very high	70 Å²	70	70.3 Å²	70.3	49%	0.49	36%	0.355	S	S	.	.	S	Bend	trans	-94.4	127.5	176.4	60.6	0	0	0	0	109.5	S414 D416	S414-S419 WeakPolarHBondContact CB-O 3.38Å; S414-S419 PolarHBondContact OG-O 2.89Å; D416-S419 VanDerWaalsContact CG-OG 3.25Å; D416-S419 PolarHBondContact OD1-N 3.46Å; D416-S419 PolarHBondContact OD1-OG 3.41Å; D416-S419 VanDerWaalsContact OD1-OG 3.11Å; D416-S419 PolarHBondContact OD2-N 2.84Å; D416-S419 PolarHBondContact OD2-OG 2.83Å
420	W	96.3	Very high	92.6	Very high	65 Å²	65	77.7 Å²	77.7	25%	0.246	39%	0.387	C	S	.	.			trans	-121.8	130.6	-173	-68.8	87.2	0	0	0	110.9	Q380 A412 G417 R418 R458	Q380-W420 HydrophobicContact CG-CH2 4.1Å; A412-W420 HydrophobicContact CB-CE3 4.09Å; G417-W420 PolarHBondContact O-NE1 2.9Å; G417-W420 VanDerWaalsContact O-NE1 3.13Å; R418-W420 VanDerWaalsContact O-CD1 3.3Å; W420-R458 VanDerWaalsContact CE2-NH1 3.33Å; W420-R458 HydrophobicContact CE3-CB 4.2Å; W420-R458 HydrophobicContact CE3-CG 4.09Å; W420-R458 HydrophobicContact CH2-CB 4.3Å; W420-R458 VanDerWaalsContact CH2-CD 3.47Å; W420-R458 HydrophobicContact CH2-CG 3.49Å; W420-R458 VanDerWaalsContact CH2-CG 3.49Å; W420-R458 VanDerWaalsContact CH2-NE 3.3Å; W420-R458 HydrophobicContact CZ2-CG 4.27Å; W420-R458 VanDerWaalsContact CZ2-NH2 3.3Å; W420-R458 HydrophobicContact CZ3-CB 3.7Å; W420-R458 VanDerWaalsContact CZ3-CD 3.46Å; W420-R458 HydrophobicContact CZ3-CG 3.41Å; W420-R458 VanDerWaalsContact CZ3-CG 3.41Å
421	T	95.7	Very high	92.4	Very high	84 Å²	84	79.7 Å²	79.7	52%	0.515	40%	0.399	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	124.6	175.9	-55.1	0	0	0	0	109.5	A412 H413	A412-T421 CarbonylContact C-O 3.54Å; A412-T421 VanDerWaalsContact CA-O 3.29Å; A412-T421 WeakPolarHBondContact CA-O 3.33Å; H413-T421 PolarHBondContact N-O 3.02Å; H413-T421 PolarHBondContact ND1-O 3.19Å; H413-T421 PolarHBondContact O-N 3.42Å
422	V	96.2	Very high	92.2	Very high	39 Å²	39	82 Å²	82	24%	0.236	41%	0.409	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.8	138.5	175.2	-175.8	0	0	0	0	108.8	K410 I411 A412 Q424 D431 L460	K410-V422 HydrophobicContact CB-CG1 4.31Å; K410-V422 HydrophobicContact CD-CG1 4.42Å; I411-V422 WeakPolarHBondContact O-CA 3.33Å; A412-V422 HydrophobicContact CB-CG2 4.21Å; V422-Q424 PolarHBondContact O-N 3.24Å; V422-D431 HydrophobicContact CG1-CB 4.1Å; V422-L460 HydrophobicContact CG2-CD1 4.44Å
423	L	95	Very high	92.1	Very high	22 Å²	22	86 Å²	86	12%	0.115	43%	0.429	C	S	.	.			trans	-63	132.5	174.7	-63.7	-176.3	0	0	0	110.3	I411 K432 F434 F448 F452	I411-L423 HydrophobicContact CB-CD1 3.78Å; I411-L423 HydrophobicContact CB-CG 4.14Å; I411-L423 HydrophobicContact CG2-CD1 3.75Å; I411-L423 HydrophobicContact CG2-CG 4.09Å; I411-L423 PolarHBondContact O-N 2.72Å; L423-K432 PolarHBondContact O-N 3.28Å; L423-F434 HydrophobicContact CD1-CE2 4.23Å; L423-F434 HydrophobicContact CD1-CZ 4.09Å; L423-F448 HydrophobicContact CD1-CD1 3.98Å; L423-F448 HydrophobicContact CD1-CE1 4.36Å; L423-F448 HydrophobicContact CD1-CG 4.16Å; L423-F452 HydrophobicContact CD1-CD1 3.92Å; L423-F452 HydrophobicContact CD1-CE1 3.56Å; L423-F452 HydrophobicContact CD1-CZ 4.41Å; L423-F452 HydrophobicContact CD2-CD1 3.65Å; L423-F452 HydrophobicContact CD2-CE1 3.96Å; L423-F452 HydrophobicContact CD2-CG 4.06Å; L423-F452 HydrophobicContact CG-CD1 4.39Å; L423-F452 HydrophobicContact CG-CE1 4.25Å
424	Q	92.4	Very high	92	Very high	112 Å²	112	84.7 Å²	84.7	52%	0.523	42%	0.423	S	S	.	.	B	Isolated β-bridge	trans	-111.9	152.4	179.4	-66.6	-179.9	-15.4	0	0	110.4	V422 K430	V422-Q424 PolarHBondContact O-N 3.24Å; Q424-K430 CarbonylContact C-O 3.56Å; Q424-K430 VanDerWaalsContact CA-O 3.27Å; Q424-K430 WeakPolarHBondContact CA-O 3.46Å
425	D	87.6	Confident	91.8	Very high	48 Å²	48	88.9 Å²	88.9	26%	0.257	45%	0.448	S	S	.	.			trans	-75.7	132.5	171.6	-170.3	-74.6	0	0	0	110.2	S427 T428 R429 K430	D425-S427 PolarHBondContact O-N 3.06Å; D425-S427 WeakPolarHBondContact OD1-CB 3.44Å; D425-S427 PolarHBondContact OD1-N 3.04Å; D425-S427 PolarHBondContact OD1-OG 2.93Å; D425-T428 PolarHBondContact OD1-N 3.31Å; D425-R429 WeakPolarHBondContact O-CA 3.26Å; D425-R429 PolarHBondContact O-N 2.96Å; D425-K430 PolarHBondContact N-O 3.4Å
426	E	81.5	Confident	91.7	Very high	153 Å²	153	84.6 Å²	84.6	72%	0.715	43%	0.426	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.4	-34.7	-177.7	-71	-169.5	153.4	0	0	112.8	P450	E426-P450 WeakPolarHBondContact OE1-CD 3.4Å
427	S	83.5	Confident	91.8	Very high	101 Å²	101	81 Å²	81	71%	0.706	41%	0.407	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.6	-36.9	-174.1	69.3	0	0	0	0	112.7	D425	D425-S427 PolarHBondContact O-N 3.06Å; D425-S427 WeakPolarHBondContact OD1-CB 3.44Å; D425-S427 PolarHBondContact OD1-N 3.04Å; D425-S427 PolarHBondContact OD1-OG 2.93Å
428	T	85.7	Confident	91.7	Very high	83 Å²	83	84.7 Å²	84.7	51%	0.509	43%	0.43	S	S	.	.	T	Hydrogen-bonded Turn	trans	-108.3	-12.3	-172.8	62.9	0	0	0	0	114.3	D425 K430	D425-T428 PolarHBondContact OD1-N 3.31Å; T428-K430 PolarHBondContact O-N 2.78Å
429	R	85.4	Confident	91.6	Very high	206 Å²	206	76 Å²	76	78%	0.777	40%	0.4	S	S	*	.			trans	53.1	17.3	-172.8	-60.9	-175.3	178.5	177.8	-0.9	114.6	D425	D425-R429 WeakPolarHBondContact O-CA 3.26Å; D425-R429 PolarHBondContact O-N 2.96Å
430	K	90.5	Very high	91.2	Very high	155 Å²	155	73.9 Å²	73.9	67%	0.674	38%	0.383	S	S	*	.	S	Bend	trans	-93.2	157.9	172.9	-69.4	-177.1	179	179.8	0	109.4	Q424 D425 T428 K432	Q424-K430 CarbonylContact C-O 3.56Å; Q424-K430 VanDerWaalsContact CA-O 3.27Å; Q424-K430 WeakPolarHBondContact CA-O 3.46Å; D425-K430 PolarHBondContact N-O 3.4Å; T428-K430 PolarHBondContact O-N 2.78Å; K430-K432 PolarHBondContact O-N 3.03Å
431	D	92.2	Very high	90.6	Very high	65 Å²	65	75 Å²	75	35%	0.348	39%	0.394	S	S	.	.	B	Isolated β-bridge	trans	-50.7	124.8	172.9	-63.7	-3.8	0	0	0	110.7	K410 V422 I433	K410-D431 HydrophobicContact CD-CB 4Å; K410-D431 IonicContact NZ-OD2 3.83Å; K410-D431 PolarHBondContact NZ-OD2 3.03Å; V422-D431 HydrophobicContact CG1-CB 4.1Å; D431-I433 PolarHBondContact O-N 2.74Å
432	K	93.4	Very high	90.1	Very high	49 Å²	49	74 Å²	74	21%	0.213	39%	0.388	C	S	.	.	P	Polyproline II helix	trans	-74.8	122.1	178.6	-167.6	164	-177.3	164.2	0	109.2	L423 K430 F434 E449	L423-K432 PolarHBondContact O-N 3.28Å; K430-K432 PolarHBondContact O-N 3.03Å; K432-F434 HydrophobicContact CB-CE2 4.34Å; K432-F434 HydrophobicContact CB-CZ 4.4Å; K432-F434 HydrophobicContact CD-CE1 4.1Å; K432-F434 HydrophobicContact CD-CZ 3.83Å; K432-F434 HydrophobicContact CG-CE1 4.24Å; K432-F434 HydrophobicContact CG-CE2 4.2Å; K432-F434 HydrophobicContact CG-CZ 3.91Å; K432-E449 PolarHBondContact NZ-O 3.04Å; K432-E449 VanDerWaalsContact NZ-O 3.09Å
433	I	94.8	Very high	89.8	Confident	87 Å²	87	74.2 Å²	74.2	45%	0.446	39%	0.386	S	S	.	.	P	Polyproline II helix	trans	-100.8	120.6	175.8	-59.9	172.8	0	0	0	107.9	K410 D431	K410-I433 HydrophobicContact CG-CG1 4.19Å; D431-I433 PolarHBondContact O-N 2.74Å
434	F	94.9	Very high	89.5	Confident	11 Å²	11	77.1 Å²	77.1	5%	0.048	40%	0.398	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.8	138.3	177.6	-62.4	-84.7	0	0	0	110.3	S408 F409 I411 L423 K432 G436 N446 F448	S408-F434 VanDerWaalsContact CA-O 3.25Å; S408-F434 WeakPolarHBondContact CA-O 3.41Å; F409-F434 HydrophobicContact CD1-CB 4.38Å; F409-F434 HydrophobicContact CD2-CB 4.11Å; F409-F434 HydrophobicContact CD2-CD2 4.3Å; F409-F434 HydrophobicContact CE1-CB 4Å; F409-F434 HydrophobicContact CE2-CB 3.68Å; F409-F434 HydrophobicContact CE2-CD2 4.02Å; F409-F434 HydrophobicContact CE2-CG 4.02Å; F409-F434 HydrophobicContact CG-CB 4.43Å; F409-F434 HydrophobicContact CZ-CB 3.63Å; F409-F434 HydrophobicContact CZ-CG 4.3Å; F409-F434 PolarHBondContact N-O 3.05Å; F409-F434 PolarHBondContact O-N 2.81Å; I411-F434 HydrophobicContact CB-CE2 4.23Å; I411-F434 HydrophobicContact CG1-CD2 4.09Å; I411-F434 HydrophobicContact CG1-CE2 3.93Å; L423-F434 HydrophobicContact CD1-CE2 4.23Å; L423-F434 HydrophobicContact CD1-CZ 4.09Å; K432-F434 HydrophobicContact CB-CE2 4.34Å; K432-F434 HydrophobicContact CB-CZ 4.4Å; K432-F434 HydrophobicContact CD-CE1 4.1Å; K432-F434 HydrophobicContact CD-CZ 3.83Å; K432-F434 HydrophobicContact CG-CE1 4.24Å; K432-F434 HydrophobicContact CG-CE2 4.2Å; K432-F434 HydrophobicContact CG-CZ 3.91Å; F434-G436 PolarHBondContact O-N 2.82Å; F434-N446 HydrophobicContact CD1-CB 4.11Å; F434-F448 HydrophobicContact CD1-CE1 4.49Å; F434-F448 AromaticContact CE1-CD1 3.71Å; F434-F448 HydrophobicContact CE1-CD1 3.71Å; F434-F448 AromaticContact CE1-CE1 3.94Å; F434-F448 HydrophobicContact CE1-CE1 3.94Å; F434-F448 HydrophobicContact CE2-CD1 4.32Å; F434-F448 HydrophobicContact CE2-CE1 4.11Å; F434-F448 AromaticContact CZ-CD1 3.53Å; F434-F448 HydrophobicContact CZ-CD1 3.53Å; F434-F448 AromaticContact CZ-CE1 3.73Å; F434-F448 HydrophobicContact CZ-CE1 3.73Å
435	T	94.6	Very high	89.3	Confident	93 Å²	93	75.2 Å²	75.2	57%	0.571	39%	0.388	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-73.7	122.9	171.3	-47.6	0	0	0	0	109.4	N446	T435-N446 PolarHBondContact O-ND2 2.85Å; T435-N446 PolarHBondContact O-OD1 2.75Å
436	G	93.3	Very high	89.3	Confident	5 Å²	5	74 Å²	74	5%	0.052	38%	0.381	C	S	.	.			trans	-87.9	-148.4	177.3	0	0	0	0	0	113.1	S407 F434 K444	S407-G436 WeakPolarHBondContact O-CA 3.29Å; S407-G436 PolarHBondContact O-N 3.22Å; F434-G436 PolarHBondContact O-N 2.82Å; G436-K444 WeakPolarHBondContact O-CG 3.36Å
437	N	94.1	Very high	89.6	Confident	7 Å²	7	68.1 Å²	68.1	4%	0.037	35%	0.354	C	S	.	.			trans	-82.6	156.9	-174.6	-62.3	85.5	0	0	0	111.6	T394 Q395 F405 V406 S407 V442	T394-N437 VanDerWaalsContact CB-OD1 3.29Å; T394-N437 WeakPolarHBondContact CB-OD1 3.45Å; T394-N437 PolarHBondContact O-ND2 2.89Å; T394-N437 PolarHBondContact OG1-OD1 2.76Å; Q395-N437 WeakPolarHBondContact CA-ND2 3.49Å; Q395-N437 PolarHBondContact N-OD1 2.83Å; F405-N437 HydrophobicContact CB-CB 4.08Å; F405-N437 HydrophobicContact CD2-CB 4.16Å; F405-N437 WeakPolarHBondContact CD2-O 3.35Å; F405-N437 WeakPolarHBondContact CE2-O 3.24Å; F405-N437 HydrophobicContact CG-CB 4.35Å; V406-N437 PolarHBondContact O-N 2.73Å; S407-N437 WeakPolarHBondContact CA-O 3.49Å; N437-V442 PolarHBondContact ND2-O 2.83Å
438	S	90.7	Very high	89.8	Confident	101 Å²	101	63.5 Å²	63.5	71%	0.706	32%	0.321	S	S	*	.	S	Bend	trans	-110.4	-6.2	171.2	49.8	0	0	0	0	112.9	F405	F405-S438 VanDerWaalsContact CZ-C 3.43Å; F405-S438 VanDerWaalsContact CZ-O 3.27Å; F405-S438 WeakPolarHBondContact CZ-O 3.08Å
439	D	89.6	Confident	89.7	Confident	41 Å²	41	65.1 Å²	65.1	22%	0.219	32%	0.323	C	S	.	.	S	Bend	trans	-151.2	-176.6	179.8	66.2	58.6	0	0	0	110.9	F405 N441 V442	F405-D439 WeakPolarHBondContact CB-O 3.4Å; D439-N441 PolarHBondContact OD1-N 3.13Å; D439-V442 WeakPolarHBondContact OD1-CB 3.27Å; D439-V442 PolarHBondContact OD1-N 3.08Å; D439-V442 WeakPolarHBondContact OD2-CB 3.25Å; D439-V442 WeakPolarHBondContact OD2-CG2 3.34Å
440	N	87.3	Confident	89.6	Confident	24 Å²	24	58.6 Å²	58.6	13%	0.128	31%	0.308	C	S	.	.	S	Bend	trans	-85.9	-15.6	-177	62	-56.2	0	0	0	115.9	G396 A397 I403 R471	G396-N440 CarbonylContact C-O 3.53Å; G396-N440 PolarHBondContact N-O 3.49Å; A397-N440 WeakPolarHBondContact O-CB 3.08Å; I403-N440 HydrophobicContact CB-CB 4.5Å; I403-N440 HydrophobicContact CG2-CB 3.65Å; N440-R471 PolarHBondContact O-NH2 3.36Å
441	N	84.9	Confident	89.6	Confident	90 Å²	90	54.2 Å²	54.2	48%	0.481	30%	0.295	S	S	.	.	S	Bend	trans	-129.1	-30.6	-165	-80.2	-20.2	0	0	0	114.8	Q395 D439 R471	Q395-N441 PolarHBondContact NE2-O 2.8Å; D439-N441 PolarHBondContact OD1-N 3.13Å; N441-R471 PolarHBondContact OD1-NH2 2.97Å
442	V	85.3	Confident	89.5	Confident	62 Å²	62	51.9 Å²	51.9	38%	0.376	28%	0.282	S	S	.	.	S	Bend	trans	-70	137.3	179	179.3	0	0	0	0	109.4	G167 N437 D439	G167-V442 WeakPolarHBondContact O-CG1 3.45Å; N437-V442 PolarHBondContact ND2-O 2.83Å; D439-V442 WeakPolarHBondContact OD1-CB 3.27Å; D439-V442 PolarHBondContact OD1-N 3.08Å; D439-V442 WeakPolarHBondContact OD2-CB 3.25Å; D439-V442 WeakPolarHBondContact OD2-CG2 3.34Å
443	H	89.3	Confident	89.5	Confident	44 Å²	44	54.4 Å²	54.4	20%	0.204	29%	0.291	C	S	.	.			trans	-77.9	131.7	179.3	-62.3	159.4	0	0	0	110	G167 D360 V393 Q395	G167-H443 WeakPolarHBondContact O-CB 3.22Å; G167-H443 PolarHBondContact O-N 2.95Å; G167-H443 VanDerWaalsContact O-N 3.09Å; D360-H443 IonicContact OD1-CD2 2.78Å; D360-H443 IonicContact OD1-CE1 3.24Å; D360-H443 PolarHBondContact OD1-CE1 2.87Å; D360-H443 IonicContact OD1-NE2 3.61Å; D360-H443 PolarHBondContact OD1-NE2 2.83Å; D360-H443 IonicContact OD2-CE1 3.7Å; D360-H443 PolarHBondContact OD2-CE1 2.87Å; D360-H443 IonicContact OD2-NE2 3.45Å; D360-H443 PolarHBondContact OD2-NE2 3.48Å; V393-H443 HydrophobicContact CG1-CB 3.77Å; Q395-H443 PolarHBondContact NE2-CD2 2.79Å; Q395-H443 PolarHBondContact NE2-NE2 3.44Å
444	K	88.4	Confident	89.5	Confident	83 Å²	83	50.3 Å²	50.3	36%	0.361	27%	0.269	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109	108	169.2	-173.7	73.2	177.9	177	0	109.4	V393 T394 G436	V393-K444 CarbonylContact C-O 3.48Å; V393-K444 WeakPolarHBondContact CA-O 3.29Å; T394-K444 PolarHBondContact N-O 2.86Å; T394-K444 PolarHBondContact O-N 3.14Å; G436-K444 WeakPolarHBondContact O-CG 3.36Å
445	K	87.4	Confident	89.6	Confident	72 Å²	72	53.2 Å²	53.2	31%	0.313	28%	0.28	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.5	125.6	173.7	-177.2	170.9	166.7	-179.9	0	109.8	E316 V393 L475	E316-K445 IonicContact OE1-NZ 2.68Å; E316-K445 PolarHBondContact OE1-NZ 2.92Å; V393-K445 HydrophobicContact CG2-CB 4.18Å; V393-K445 HydrophobicContact CG2-CD 4.46Å; V393-K445 HydrophobicContact CG2-CG 4.12Å; K445-L475 HydrophobicContact CD-CD1 3.86Å; K445-L475 HydrophobicContact CG-CD1 4.1Å
446	N	89.3	Confident	89.8	Confident	23 Å²	23	50.2 Å²	50.2	12%	0.123	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.3	138.9	171.2	-77.4	-75.8	0	0	0	109	G391 I392 F409 F434 T435	G391-N446 CarbonylContact C-O 3.57Å; G391-N446 WeakPolarHBondContact CA-O 3.39Å; I392-N446 HydrophobicContact CG2-CB 4.04Å; I392-N446 PolarHBondContact N-O 2.8Å; I392-N446 PolarHBondContact O-N 3.48Å; F409-N446 HydrophobicContact CZ-CB 4.35Å; F434-N446 HydrophobicContact CD1-CB 4.11Å; T435-N446 PolarHBondContact O-ND2 2.85Å; T435-N446 PolarHBondContact O-OD1 2.75Å
447	I	86.3	Confident	90	Very high	28 Å²	28	50.1 Å²	50.1	14%	0.144	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	143.2	178.9	-78.6	169.8	0	0	0	109.8	R223 E316 T390 E449	R223-I447 VanDerWaalsContact NH1-CD1 3.31Å; E316-I447 WeakPolarHBondContact OE1-CD1 3.12Å; T390-I447 WeakPolarHBondContact O-CA 3.49Å; T390-I447 WeakPolarHBondContact O-CG2 3.38Å; I447-E449 HydrophobicContact CG2-CG 4.14Å
448	F	89.5	Confident	90.1	Very high	4 Å²	4	51.9 Å²	51.9	2%	0.018	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.8	110	-178.1	-52.4	-39.4	0	0	0	108.3	I389 T390 G391 I392 I411 L423 F434 P450 P451 F452	I389-F448 HydrophobicContact CG2-CD2 3.9Å; I389-F448 HydrophobicContact CG2-CE2 3.73Å; T390-F448 PolarHBondContact O-N 3.03Å; G391-F448 VanDerWaalsContact C-CE2 3.48Å; I392-F448 HydrophobicContact CB-CE2 4.44Å; I392-F448 HydrophobicContact CB-CZ 3.85Å; I392-F448 HydrophobicContact CG2-CE1 3.94Å; I392-F448 HydrophobicContact CG2-CZ 3.54Å; I411-F448 HydrophobicContact CD1-CZ 4.16Å; I411-F448 HydrophobicContact CG1-CE1 3.8Å; I411-F448 HydrophobicContact CG1-CZ 3.77Å; I411-F448 HydrophobicContact CG2-CZ 4.39Å; L423-F448 HydrophobicContact CD1-CD1 3.98Å; L423-F448 HydrophobicContact CD1-CE1 4.36Å; L423-F448 HydrophobicContact CD1-CG 4.16Å; F434-F448 HydrophobicContact CD1-CE1 4.49Å; F434-F448 AromaticContact CE1-CD1 3.71Å; F434-F448 HydrophobicContact CE1-CD1 3.71Å; F434-F448 AromaticContact CE1-CE1 3.94Å; F434-F448 HydrophobicContact CE1-CE1 3.94Å; F434-F448 HydrophobicContact CE2-CD1 4.32Å; F434-F448 HydrophobicContact CE2-CE1 4.11Å; F434-F448 AromaticContact CZ-CD1 3.53Å; F434-F448 HydrophobicContact CZ-CD1 3.53Å; F434-F448 AromaticContact CZ-CE1 3.73Å; F434-F448 HydrophobicContact CZ-CE1 3.73Å; F448-P450 CarbonylContact C-O 3.5Å; F448-P450 CarbonylContact O-C 3.5Å; F448-P451 WeakPolarHBondContact O-CA 3.25Å; F448-P451 VanDerWaalsContact O-N 3.13Å; F448-F452 HydrophobicContact CB-CD1 4.27Å; F448-F452 HydrophobicContact CB-CE1 4.22Å; F448-F452 HydrophobicContact CD2-CD1 4.16Å; F448-F452 AromaticContact CD2-CE1 3.36Å; F448-F452 HydrophobicContact CD2-CE1 3.36Å; F448-F452 HydrophobicContact CD2-CZ 4.17Å; F448-F452 AromaticContact CE2-CE1 3.81Å; F448-F452 HydrophobicContact CE2-CE1 3.81Å; F448-F452 HydrophobicContact CE2-CZ 4.21Å; F448-F452 HydrophobicContact CG-CD1 4.41Å; F448-F452 AromaticContact CG-CE1 3.86Å; F448-F452 HydrophobicContact CG-CE1 3.86Å
449	E	82.8	Confident	90.5	Very high	118 Å²	118	47.1 Å²	47.1	55%	0.551	23%	0.23	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-118	114.2	172.6	-71.4	174.2	-168.4	0	0	107.1	R223 K432 I447	R223-E449 IonicContact NH1-OE1 3.77Å; R223-E449 PolarHBondContact NH1-OE1 3.3Å; K432-E449 PolarHBondContact NZ-O 3.04Å; K432-E449 VanDerWaalsContact NZ-O 3.09Å; I447-E449 HydrophobicContact CG2-CG 4.14Å
450	P	83.6	Confident	90.9	Very high	69 Å²	69	47 Å²	47	45%	0.448	23%	0.229	S	C	.	.	E	Extended strand (participates in β ladder)	cis	-72	157.4	-5.6	31.1	-34.5	0	0	0	113	E426 F448	E426-P450 WeakPolarHBondContact OE1-CD 3.4Å; F448-P450 CarbonylContact C-O 3.5Å; F448-P450 CarbonylContact O-C 3.5Å
451	P	88.9	Confident	91.4	Very high	62 Å²	62	45.9 Å²	45.9	40%	0.403	22%	0.223	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.4	155.4	170.4	30.9	-35.5	0	0	0	110.2	T390 F448	T390-P451 HydrophobicContact CG2-CB 4.02Å; F448-P451 WeakPolarHBondContact O-CA 3.25Å; F448-P451 VanDerWaalsContact O-N 3.13Å
452	F	91.9	Very high	92	Very high	17 Å²	17	44.9 Å²	44.9	8%	0.075	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.6	157.6	-177.4	66.1	-88.4	0	0	0	111.8	I389 I411 H413 L423 F448 V457	I389-F452 HydrophobicContact CB-CD2 4.45Å; I389-F452 HydrophobicContact CB-CE1 4.19Å; I389-F452 HydrophobicContact CB-CE2 3.97Å; I389-F452 HydrophobicContact CB-CZ 3.84Å; I389-F452 HydrophobicContact CG1-CE2 4.12Å; I389-F452 HydrophobicContact CG1-CZ 4.37Å; I389-F452 HydrophobicContact CG2-CE1 4.24Å; I389-F452 HydrophobicContact CG2-CE2 4.47Å; I389-F452 HydrophobicContact CG2-CZ 3.89Å; I389-F452 PolarHBondContact N-O 3.47Å; I389-F452 PolarHBondContact O-N 2.76Å; I389-F452 VanDerWaalsContact O-N 3.17Å; I411-F452 HydrophobicContact CG2-CE1 4.37Å; I411-F452 HydrophobicContact CG2-CZ 4.04Å; H413-F452 HydrophobicContact CB-CD2 3.84Å; H413-F452 HydrophobicContact CB-CE2 3.42Å; H413-F452 VanDerWaalsContact CB-CE2 3.42Å; H413-F452 HydrophobicContact CB-CZ 4.22Å; H413-F452 AromaticContact CD2-CD2 3.65Å; H413-F452 AromaticContact CG-CD2 3.68Å; H413-F452 AromaticContact CG-CE2 3.8Å; L423-F452 HydrophobicContact CD1-CD1 3.92Å; L423-F452 HydrophobicContact CD1-CE1 3.56Å; L423-F452 HydrophobicContact CD1-CZ 4.41Å; L423-F452 HydrophobicContact CD2-CD1 3.65Å; L423-F452 HydrophobicContact CD2-CE1 3.96Å; L423-F452 HydrophobicContact CD2-CG 4.06Å; L423-F452 HydrophobicContact CG-CD1 4.39Å; L423-F452 HydrophobicContact CG-CE1 4.25Å; F448-F452 HydrophobicContact CB-CD1 4.27Å; F448-F452 HydrophobicContact CB-CE1 4.22Å; F448-F452 HydrophobicContact CD2-CD1 4.16Å; F448-F452 AromaticContact CD2-CE1 3.36Å; F448-F452 HydrophobicContact CD2-CE1 3.36Å; F448-F452 HydrophobicContact CD2-CZ 4.17Å; F448-F452 AromaticContact CE2-CE1 3.81Å; F448-F452 HydrophobicContact CE2-CE1 3.81Å; F448-F452 HydrophobicContact CE2-CZ 4.21Å; F448-F452 HydrophobicContact CG-CD1 4.41Å; F448-F452 AromaticContact CG-CE1 3.86Å; F448-F452 HydrophobicContact CG-CE1 3.86Å; F452-V457 HydrophobicContact CE2-CG2 4.32Å
453	Y	92.8	Very high	92.5	Very high	102 Å²	102	46.6 Å²	46.6	40%	0.4	22%	0.216	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	126.9	177.6	-70.5	-99.7	0	0	0	109.8	K387 R388 E479	K387-Y453 WeakPolarHBondContact O-CA 3.47Å; R388-Y453 HydrophobicContact CB-CD1 4.03Å; R388-Y453 HydrophobicContact CB-CE1 3.64Å; R388-Y453 VanDerWaalsContact CD-CZ 3.47Å; R388-Y453 WeakPolarHBondContact CD-OH 3.2Å; R388-Y453 HydrophobicContact CG-CD1 4.46Å; R388-Y453 HydrophobicContact CG-CE1 3.97Å; R388-Y453 HydrophobicContact CG-CE2 4.05Å; Y453-E479 VanDerWaalsContact CE1-CD 3.5Å; Y453-E479 HydrophobicContact CE1-CG 4.09Å; Y453-E479 VanDerWaalsContact CE1-OE1 3.32Å; Y453-E479 WeakPolarHBondContact CE1-OE1 3.41Å; Y453-E479 VanDerWaalsContact CZ-OE1 3.26Å; Y453-E479 PolarHBondContact OH-OE1 3.49Å
454	S	95.4	Very high	92.9	Very high	0 Å²	0	47.7 Å²	47.7	0%	0	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-157.9	150.3	177.2	-161.2	0	0	0	0	113.3	K387 S414 N415 Y456	K387-S454 PolarHBondContact N-O 2.88Å; K387-S454 PolarHBondContact O-N 2.92Å; S414-S454 PolarHBondContact N-OG 2.91Å; S414-S454 VanDerWaalsContact N-OG 3.08Å; S414-S454 PolarHBondContact O-OG 2.94Å; N415-S454 VanDerWaalsContact OD1-CA 3.28Å; N415-S454 WeakPolarHBondContact OD1-CA 3.19Å; S454-Y456 PolarHBondContact OG-N 3.07Å; S454-Y456 PolarHBondContact OG-O 3.07Å
455	R	96	Very high	93.3	Very high	72 Å²	72	47.8 Å²	47.8	27%	0.272	22%	0.22	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.4	-41.1	166.1	177.2	177.7	166.9	177.4	-1.4	111.9	D382 L383 L384 N415	D382-R455 WeakPolarHBondContact OD1-CG 3.22Å; D382-R455 IonicContact OD1-CZ 3.64Å; D382-R455 IonicContact OD1-NE 2.87Å; D382-R455 PolarHBondContact OD1-NE 2.96Å; D382-R455 IonicContact OD1-NH2 3.74Å; D382-R455 PolarHBondContact OD1-NH2 3.23Å; D382-R455 IonicContact OD2-CZ 3.38Å; D382-R455 IonicContact OD2-NE 2.76Å; D382-R455 IonicContact OD2-NH2 3.87Å; D382-R455 PolarHBondContact OD2-NH2 2.93Å; L383-R455 WeakPolarHBondContact CB-O 3.44Å; L383-R455 PolarHBondContact N-O 3.38Å; L384-R455 WeakPolarHBondContact O-CD 3.42Å; L384-R455 PolarHBondContact O-NE 3.12Å; N415-R455 PolarHBondContact OD1-N 2.91Å
456	Y	97.9	Very high	93.6	Very high	31 Å²	31	50.6 Å²	50.6	12%	0.122	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	127.6	-176.3	-62.3	-86.1	0	0	0	111	V381 D382 H413 S414 S454	V381-Y456 WeakPolarHBondContact O-CA 3.35Å; D382-Y456 HydrophobicContact CB-CD1 3.77Å; D382-Y456 HydrophobicContact CB-CE1 3.52Å; D382-Y456 VanDerWaalsContact OD2-CE1 3.25Å; D382-Y456 WeakPolarHBondContact OD2-CE1 3.3Å; D382-Y456 PolarHBondContact OD2-OH 3.01Å; H413-Y456 VanDerWaalsContact CA-O 3.3Å; H413-Y456 WeakPolarHBondContact CA-O 3.47Å; S414-Y456 PolarHBondContact N-O 3.05Å; S414-Y456 WeakPolarHBondContact O-CB 3.5Å; S414-Y456 WeakPolarHBondContact O-CD2 3.32Å; S414-Y456 PolarHBondContact O-N 2.94Å; S454-Y456 PolarHBondContact OG-N 3.07Å; S454-Y456 PolarHBondContact OG-O 3.07Å
457	V	97.9	Very high	93.8	Very high	2 Å²	2	51.8 Å²	51.8	1%	0.012	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	131.3	176.5	-176.1	0	0	0	0	109.4	Q380 V381 L383 I389 I411 F452 L474	Q380-V457 CarbonylContact C-O 3.03Å; Q380-V457 VanDerWaalsContact CA-O 3.31Å; Q380-V457 WeakPolarHBondContact CA-O 3.44Å; V381-V457 PolarHBondContact N-O 2.71Å; V381-V457 PolarHBondContact O-N 3.07Å; L383-V457 HydrophobicContact CD1-CG2 4.41Å; I389-V457 HydrophobicContact CG1-CG2 4.12Å; I411-V457 HydrophobicContact CG2-CG1 4.15Å; F452-V457 HydrophobicContact CE2-CG2 4.32Å; V457-L474 HydrophobicContact CB-CD1 4.18Å; V457-L474 HydrophobicContact CG1-CD2 4.11Å; V457-L474 HydrophobicContact CG2-CD1 4.36Å
458	R	97.8	Very high	94.3	Very high	45 Å²	45	50.5 Å²	50.5	17%	0.17	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	131	174.2	-88.5	180	-172.2	170.8	6.5	111.1	W378 L379 Q380 I411 A412 W420 L460	W378-R458 HydrophobicContact CE3-CG 4.2Å; L379-R458 CarbonylContact O-C 3.54Å; L379-R458 VanDerWaalsContact O-CA 3.26Å; L379-R458 WeakPolarHBondContact O-CA 3Å; Q380-R458 HydrophobicContact CB-CG 3.77Å; Q380-R458 HydrophobicContact CG-CG 4Å; Q380-R458 VanDerWaalsContact OE1-CZ 3.27Å; I411-R458 WeakPolarHBondContact CA-O 3.38Å; A412-R458 HydrophobicContact CB-CB 4.15Å; A412-R458 PolarHBondContact N-O 2.99Å; A412-R458 PolarHBondContact O-N 3.46Å; W420-R458 VanDerWaalsContact CE2-NH1 3.33Å; W420-R458 HydrophobicContact CE3-CB 4.2Å; W420-R458 HydrophobicContact CE3-CG 4.09Å; W420-R458 HydrophobicContact CH2-CB 4.3Å; W420-R458 VanDerWaalsContact CH2-CD 3.47Å; W420-R458 HydrophobicContact CH2-CG 3.49Å; W420-R458 VanDerWaalsContact CH2-CG 3.49Å; W420-R458 VanDerWaalsContact CH2-NE 3.3Å; W420-R458 HydrophobicContact CZ2-CG 4.27Å; W420-R458 VanDerWaalsContact CZ2-NH2 3.3Å; W420-R458 HydrophobicContact CZ3-CB 3.7Å; W420-R458 VanDerWaalsContact CZ3-CD 3.46Å; W420-R458 HydrophobicContact CZ3-CG 3.41Å; W420-R458 VanDerWaalsContact CZ3-CG 3.41Å; R458-L460 HydrophobicContact CB-CD2 4.28Å
459	V	98	Very high	94.7	Very high	1 Å²	1	50.3 Å²	50.3	1%	0.006	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.8	126.3	167	-173.3	0	0	0	0	108.6	W378 L379 I392 F409 I411 L470 M472	W378-V459 WeakPolarHBondContact CA-O 3.24Å; L379-V459 PolarHBondContact N-O 3.33Å; L379-V459 VanDerWaalsContact N-O 3.08Å; L379-V459 PolarHBondContact O-N 3.13Å; I392-V459 HydrophobicContact CD1-CG2 3.57Å; F409-V459 HydrophobicContact CB-CG1 4.2Å; F409-V459 HydrophobicContact CD2-CG1 3.99Å; F409-V459 HydrophobicContact CG-CG1 4.21Å; I411-V459 HydrophobicContact CD1-CB 4.35Å; I411-V459 HydrophobicContact CD1-CG1 4.37Å; I411-V459 HydrophobicContact CD1-CG2 3.86Å; V459-L470 HydrophobicContact CB-CD2 4.21Å; V459-L470 HydrophobicContact CG1-CD2 3.86Å; V459-M472 HydrophobicContact CG2-CE 3.96Å; V459-M472 HydrophobicContact CG2-SD 3.59Å; V459-M472 VanDerWaalsContact CG2-SD 3.59Å
460	L	97.9	Very high	95.3	Very high	37 Å²	37	44.8 Å²	44.8	19%	0.194	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	99.5	-178.2	-52.1	180	0	0	0	108.9	W378 F409 K410 A412 V422 R458 W462	W378-L460 HydrophobicContact CB-CD2 3.52Å; F409-L460 CarbonylContact C-O 3.6Å; F409-L460 VanDerWaalsContact CA-O 3.29Å; F409-L460 WeakPolarHBondContact CA-O 3.23Å; F409-L460 WeakPolarHBondContact CB-O 3.34Å; K410-L460 HydrophobicContact CB-CB 4.17Å; K410-L460 HydrophobicContact CB-CD1 4.42Å; K410-L460 PolarHBondContact N-O 3.22Å; K410-L460 PolarHBondContact O-N 3.16Å; A412-L460 HydrophobicContact CB-CD1 3.96Å; A412-L460 HydrophobicContact CB-CG 4.42Å; V422-L460 HydrophobicContact CG2-CD1 4.44Å; R458-L460 HydrophobicContact CB-CD2 4.28Å; L460-W462 PolarHBondContact O-N 2.88Å
461	P	97.8	Very high	96	Very high	1 Å²	1	41.5 Å²	41.5	1%	0.006	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-59.8	133.1	177.1	-22.4	35.1	0	0	0	111.4	W368 E377 V406 W464 I468	W368-P461 HydrophobicContact CH2-CG 4.46Å; W368-P461 HydrophobicContact CZ3-CG 4.28Å; E377-P461 VanDerWaalsContact O-CD 3.23Å; E377-P461 WeakPolarHBondContact O-CD 3.24Å; V406-P461 HydrophobicContact CG1-CB 4.18Å; V406-P461 HydrophobicContact CG2-CB 4.26Å; V406-P461 HydrophobicContact CG2-CG 4.48Å; P461-W464 HydrophobicContact CB-CE3 4.43Å; P461-I468 HydrophobicContact CB-CD1 4.01Å; P461-I468 HydrophobicContact CB-CG1 4.15Å; P461-I468 HydrophobicContact CB-CG2 3.88Å; P461-I468 HydrophobicContact CG-CD1 4.38Å; P461-I468 HydrophobicContact CG-CG2 3.57Å
462	W	96.9	Very high	96.3	Very high	69 Å²	69	38.6 Å²	38.6	26%	0.261	16%	0.164	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	-45	-176.6	-169.7	-106.8	0	0	0	112.2	R375 S408 K410 L460	R375-W462 HydrophobicContact CB-CE3 4.45Å; R375-W462 HydrophobicContact CB-CZ3 4.46Å; R375-W462 HydrophobicContact CG-CE3 4.31Å; R375-W462 PolarHBondContact NE-O 3.13Å; R375-W462 VanDerWaalsContact NE-O 3.13Å; S408-W462 WeakPolarHBondContact O-CB 3.26Å; S408-W462 PolarHBondContact O-N 2.87Å; K410-W462 HydrophobicContact CD-CE3 4.19Å; K410-W462 HydrophobicContact CD-CZ3 4.49Å; L460-W462 PolarHBondContact O-N 2.88Å
463	E	97.1	Very high	96.5	Very high	98 Å²	98	38.1 Å²	38.1	46%	0.458	16%	0.162	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.8	153.3	171.2	-58.9	167.7	161.8	0	0	109.8	S407 S408	S407-E463 PolarHBondContact N-O 2.7Å; S407-E463 WeakPolarHBondContact OG-CB 3.3Å; S407-E463 PolarHBondContact OG-O 2.79Å; S408-E463 PolarHBondContact N-O 3.26Å; S408-E463 VanDerWaalsContact N-O 3.16Å; S408-E463 PolarHBondContact O-N 2.95Å; S408-E463 VanDerWaalsContact O-N 3.14Å; S408-E463 VanDerWaalsContact OG-CB 3.22Å; S408-E463 WeakPolarHBondContact OG-CB 3.18Å; S408-E463 WeakPolarHBondContact OG-CG 3.47Å; S408-E463 PolarHBondContact OG-N 2.86Å; S408-E463 PolarHBondContact OG-OE2 3.48Å; S408-E463 VanDerWaalsContact OG-OE2 3.04Å
464	W	97.1	Very high	96.6	Very high	67 Å²	67	33.3 Å²	33.3	25%	0.254	14%	0.143	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.8	160.3	-175.1	52.8	86.6	0	0	0	111	N373 R375 F405 S407 P461 I468	N373-W464 HydrophobicContact CB-CZ2 3.81Å; R375-W464 HydrophobicContact CG-CH2 4.18Å; R375-W464 HydrophobicContact CG-CZ3 4.12Å; F405-W464 CarbonylContact O-C 3.58Å; F405-W464 VanDerWaalsContact O-CA 3.3Å; F405-W464 WeakPolarHBondContact O-CA 3.35Å; F405-W464 WeakPolarHBondContact O-CB 3.46Å; S407-W464 PolarHBondContact OG-N 3.26Å; P461-W464 HydrophobicContact CB-CE3 4.43Å; W464-I468 HydrophobicContact CB-CG1 4.26Å; W464-I468 HydrophobicContact CD2-CD1 4.11Å; W464-I468 HydrophobicContact CD2-CG1 3.45Å; W464-I468 VanDerWaalsContact CD2-CG1 3.45Å; W464-I468 HydrophobicContact CE3-CD1 3.87Å; W464-I468 HydrophobicContact CE3-CG1 3.57Å; W464-I468 HydrophobicContact CG-CG1 3.76Å; W464-I468 HydrophobicContact CH2-CD1 4.18Å; W464-I468 HydrophobicContact CZ2-CD1 4.41Å; W464-I468 HydrophobicContact CZ2-CG1 4.48Å; W464-I468 HydrophobicContact CZ3-CD1 3.9Å; W464-I468 HydrophobicContact CZ3-CG1 4.14Å
465	H	96	Very high	96.4	Very high	86 Å²	86	33.9 Å²	33.9	40%	0.398	15%	0.146	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.4	124	170.9	-176.4	-86.6	0	0	0	109.4	I403 F405 R467	I403-H465 PolarHBondContact O-ND1 2.77Å; I403-H465 VanDerWaalsContact O-ND1 3.13Å; F405-H465 HydrophobicContact CD1-CB 3.9Å; F405-H465 HydrophobicContact CD2-CB 3.96Å; F405-H465 HydrophobicContact CE1-CB 3.49Å; F405-H465 VanDerWaalsContact CE1-CB 3.49Å; F405-H465 AromaticContact CE1-CG 3.59Å; F405-H465 AromaticContact CE1-ND1 3.8Å; F405-H465 HydrophobicContact CE2-CB 3.54Å; F405-H465 HydrophobicContact CG-CB 4.13Å; F405-H465 HydrophobicContact CZ-CB 3.3Å; F405-H465 AromaticContact CZ-CG 3.62Å; F405-H465 PolarHBondContact N-O 2.85Å; F405-H465 PolarHBondContact O-N 3.16Å; H465-R467 PolarHBondContact O-N 3.03Å
466	E	93.8	Very high	96.1	Very high	131 Å²	131	30.4 Å²	30.4	61%	0.612	13%	0.133	S	C	*	.	S	Bend	trans	61.5	-65.4	-175	-65.6	-68.3	155.5	0	0	114.5	N373 Q404	N373-E466 PolarHBondContact ND2-O 2.83Å; Q404-E466 HydrophobicContact CG-CB 3.98Å
467	R	94.5	Very high	95.5	Very high	48 Å²	48	29.6 Å²	29.6	18%	0.181	13%	0.132	C	C	.	.	S	Bend	trans	-149.6	148	-175.3	-172.3	173.4	-107.7	-88.1	3.9	110.8	F342 I369 P370 N373 Q404 H465 T469	F342-R467 VanDerWaalsContact CD2-NH1 3.28Å; F342-R467 VanDerWaalsContact CG-NH1 3.34Å; I369-R467 HydrophobicContact CG2-CG 3.87Å; P370-R467 PolarHBondContact O-NH1 3.18Å; N373-R467 WeakPolarHBondContact OD1-CA 3.46Å; N373-R467 VanDerWaalsContact OD1-CG 3.27Å; N373-R467 WeakPolarHBondContact OD1-CG 3.37Å; Q404-R467 HydrophobicContact CG-CB 4.23Å; H465-R467 PolarHBondContact O-N 3.03Å; R467-T469 PolarHBondContact O-N 2.97Å; R467-T469 PolarHBondContact O-OG1 2.6Å
468	I	97.1	Very high	94.4	Very high	0 Å²	0	33.9 Å²	33.9	0%	0	15%	0.154	C	C	.	.			trans	-62.3	112.8	175.3	-61.6	171.7	0	0	0	108.4	W368 P370 N373 E377 V406 P461 W464	W368-I468 HydrophobicContact CH2-CG2 4.37Å; W368-I468 HydrophobicContact CZ3-CG2 4.04Å; P370-I468 VanDerWaalsContact CD-O 3.24Å; P370-I468 WeakPolarHBondContact CD-O 3.32Å; P370-I468 HydrophobicContact CG-CB 3.63Å; P370-I468 HydrophobicContact CG-CD1 3.93Å; P370-I468 HydrophobicContact CG-CG1 4.34Å; P370-I468 HydrophobicContact CG-CG2 3.75Å; N373-I468 PolarHBondContact OD1-N 2.91Å; E377-I468 HydrophobicContact CB-CD1 4.25Å; E377-I468 HydrophobicContact CG-CD1 4.29Å; V406-I468 HydrophobicContact CG2-CG2 4.03Å; P461-I468 HydrophobicContact CB-CD1 4.01Å; P461-I468 HydrophobicContact CB-CG1 4.15Å; P461-I468 HydrophobicContact CB-CG2 3.88Å; P461-I468 HydrophobicContact CG-CD1 4.38Å; P461-I468 HydrophobicContact CG-CG2 3.57Å; W464-I468 HydrophobicContact CB-CG1 4.26Å; W464-I468 HydrophobicContact CD2-CD1 4.11Å; W464-I468 HydrophobicContact CD2-CG1 3.45Å; W464-I468 VanDerWaalsContact CD2-CG1 3.45Å; W464-I468 HydrophobicContact CE3-CD1 3.87Å; W464-I468 HydrophobicContact CE3-CG1 3.57Å; W464-I468 HydrophobicContact CG-CG1 3.76Å; W464-I468 HydrophobicContact CH2-CD1 4.18Å; W464-I468 HydrophobicContact CZ2-CD1 4.41Å; W464-I468 HydrophobicContact CZ2-CG1 4.48Å; W464-I468 HydrophobicContact CZ3-CD1 3.9Å; W464-I468 HydrophobicContact CZ3-CG1 4.14Å
469	T	96.6	Very high	92.7	Very high	1 Å²	1	41 Å²	41	1%	0.006	19%	0.19	C	C	.	.			trans	-141.4	123.5	179.9	-57.4	0	0	0	0	109.4	A367 W368 I369 A397 Q404 R467	A367-T469 HydrophobicContact CB-CG2 3.63Å; W368-T469 WeakPolarHBondContact O-CA 3.25Å; I369-T469 HydrophobicContact CD1-CG2 4.2Å; I369-T469 HydrophobicContact CG1-CG2 3.98Å; A397-T469 HydrophobicContact CB-CG2 3.56Å; Q404-T469 HydrophobicContact CB-CG2 4.37Å; Q404-T469 WeakPolarHBondContact CB-OG1 3.45Å; Q404-T469 PolarHBondContact OE1-OG1 2.99Å; Q404-T469 VanDerWaalsContact OE1-OG1 3.07Å; R467-T469 PolarHBondContact O-N 2.97Å; R467-T469 PolarHBondContact O-OG1 2.6Å
470	L	96.6	Very high	92.4	Very high	1 Å²	1	43 Å²	43	1%	0.005	20%	0.199	C	C	.	.	B	Isolated β-bridge	trans	-139	131.6	-172.2	-171.2	65.9	0	0	0	112.6	A357 W368 L379 T394 V459 M472	A357-L470 WeakPolarHBondContact CA-O 3.35Å; W368-L470 HydrophobicContact CE3-CB 4.12Å; W368-L470 PolarHBondContact N-O 3.31Å; W368-L470 PolarHBondContact O-N 2.84Å; W368-L470 VanDerWaalsContact O-N 3.07Å; L379-L470 HydrophobicContact CD2-CD2 3.96Å; T394-L470 HydrophobicContact CG2-CD1 3.95Å; V459-L470 HydrophobicContact CB-CD2 4.21Å; V459-L470 HydrophobicContact CG1-CD2 3.86Å; L470-M472 HydrophobicContact CD2-CG 4.49Å; L470-M472 HydrophobicContact CD2-SD 4.06Å; L470-M472 HydrophobicContact CG-CB 4.4Å
471	R	97.5	Very high	92.1	Very high	1 Å²	1	43.3 Å²	43.3	0%	0.004	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	139	156.8	-69.9	179.6	-75.9	178.3	3.5	107.4	K361 N366 A367 T394 Q395 G396 N440 N441	K361-R471 PolarHBondContact O-NH1 2.85Å; N366-R471 PolarHBondContact ND2-NH1 2.87Å; N366-R471 WeakPolarHBondContact O-CD 3.17Å; N366-R471 VanDerWaalsContact O-CG 3.26Å; N366-R471 WeakPolarHBondContact O-CG 3.49Å; A367-R471 HydrophobicContact CB-CG 3.79Å; T394-R471 CarbonylContact C-O 3.55Å; T394-R471 WeakPolarHBondContact CA-O 3.49Å; Q395-R471 HydrophobicContact CB-CB 4.08Å; Q395-R471 VanDerWaalsContact CD-NH2 3.28Å; Q395-R471 PolarHBondContact N-O 2.84Å; Q395-R471 PolarHBondContact O-N 3Å; Q395-R471 VanDerWaalsContact OE1-NE 3.1Å; G396-R471 PolarHBondContact O-NE 2.97Å; G396-R471 PolarHBondContact O-NH2 2.52Å; N440-R471 PolarHBondContact O-NH2 3.36Å; N441-R471 PolarHBondContact OD1-NH2 2.97Å
472	M	96.6	Very high	91.8	Very high	1 Å²	1	45.7 Å²	45.7	1%	0.005	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.8	161.6	-177.2	60.5	175.2	-89.5	0	0	114.2	M326 A357 L359 L379 V381 I392 V393 V459 L470 L474	M326-M472 VanDerWaalsContact CB-O 3.32Å; M326-M472 WeakPolarHBondContact CB-O 3.5Å; M326-M472 HydrophobicContact CE-CE 4.47Å; M326-M472 HydrophobicContact CE-CG 4.07Å; A357-M472 WeakPolarHBondContact O-CG 3.33Å; A357-M472 PolarHBondContact O-N 2.82Å; L359-M472 PolarHBondContact N-O 3.15Å; L379-M472 HydrophobicContact CD2-CG 4.21Å; L379-M472 HydrophobicContact CD2-SD 3.6Å; L379-M472 VanDerWaalsContact CD2-SD 3.6Å; V381-M472 HydrophobicContact CG2-CE 4.01Å; I392-M472 HydrophobicContact CD1-CB 4.3Å; I392-M472 HydrophobicContact CD1-CE 3.76Å; I392-M472 HydrophobicContact CD1-SD 4.07Å; I392-M472 HydrophobicContact CG1-CB 4.39Å; I392-M472 HydrophobicContact CG1-CE 4.39Å; V393-M472 CarbonylContact O-C 3.58Å; V393-M472 WeakPolarHBondContact O-CA 3.46Å; V393-M472 WeakPolarHBondContact O-CB 3.47Å; V459-M472 HydrophobicContact CG2-CE 3.96Å; V459-M472 HydrophobicContact CG2-SD 3.59Å; V459-M472 VanDerWaalsContact CG2-SD 3.59Å; L470-M472 HydrophobicContact CD2-CG 4.49Å; L470-M472 HydrophobicContact CD2-SD 4.06Å; L470-M472 HydrophobicContact CG-CB 4.4Å; M472-L474 HydrophobicContact CE-CD1 4.14Å; M472-L474 HydrophobicContact CE-CD2 3.66Å; M472-L474 HydrophobicContact CE-CG 3.6Å
473	E	95.4	Very high	91.5	Very high	7 Å²	7	44.3 Å²	44.3	3%	0.033	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.9	135.1	166.2	180	64.1	-88.1	0	0	108.7	P323 G325 M326 K327 L359 I392 V393 L475	P323-E473 HydrophobicContact CB-CG 3.79Å; G325-E473 PolarHBondContact N-OE1 3.47Å; G325-E473 VanDerWaalsContact N-OE1 3.13Å; M326-E473 VanDerWaalsContact CB-OE1 3.25Å; M326-E473 WeakPolarHBondContact CB-OE1 3.4Å; M326-E473 WeakPolarHBondContact CG-OE1 3.15Å; M326-E473 PolarHBondContact N-OE1 3.16Å; M326-E473 PolarHBondContact N-OE2 3.32Å; K327-E473 VanDerWaalsContact CB-OE2 3.25Å; K327-E473 WeakPolarHBondContact CB-OE2 3.36Å; K327-E473 PolarHBondContact N-OE2 2.81Å; L359-E473 HydrophobicContact CB-CB 3.88Å; L359-E473 HydrophobicContact CD2-CB 3.84Å; L359-E473 HydrophobicContact CG-CB 4.42Å; I392-E473 CarbonylContact C-O 3.56Å; I392-E473 WeakPolarHBondContact CA-O 3.23Å; V393-E473 HydrophobicContact CB-CB 4.39Å; V393-E473 PolarHBondContact N-O 3.19Å; V393-E473 PolarHBondContact O-N 2.79Å; E473-L475 HydrophobicContact CG-CD2 4.41Å
474	L	94.9	Very high	91.1	Very high	0 Å²	0	40.9 Å²	40.9	0%	0	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90	143.7	174.5	-72	173.9	0	0	0	109.2	M324 V381 L383 I392 V457 M472	M324-L474 HydrophobicContact CB-CB 4Å; M324-L474 HydrophobicContact CG-CB 4.15Å; M324-L474 PolarHBondContact N-O 3.09Å; V381-L474 HydrophobicContact CB-CD1 4Å; V381-L474 HydrophobicContact CG1-CD1 4.11Å; V381-L474 HydrophobicContact CG2-CD1 4.19Å; L383-L474 HydrophobicContact CD2-CD1 4.29Å; I392-L474 HydrophobicContact CB-CD2 4.28Å; I392-L474 HydrophobicContact CD1-CD2 4.13Å; I392-L474 HydrophobicContact CG1-CD2 4.1Å; V457-L474 HydrophobicContact CB-CD1 4.18Å; V457-L474 HydrophobicContact CG1-CD2 4.11Å; V457-L474 HydrophobicContact CG2-CD1 4.36Å; M472-L474 HydrophobicContact CE-CD1 4.14Å; M472-L474 HydrophobicContact CE-CD2 3.66Å; M472-L474 HydrophobicContact CE-CG 3.6Å
475	L	91.6	Very high	90.7	Very high	12 Å²	12	39.2 Å²	39.2	6%	0.063	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	137.1	177.5	-54.3	179.3	0	0	0	110	E322 T390 G391 V393 K445 E473	E322-L475 CarbonylContact O-C 3.51Å; E322-L475 VanDerWaalsContact O-CA 3.29Å; E322-L475 WeakPolarHBondContact O-CA 3.32Å; T390-L475 PolarHBondContact N-O 2.93Å; T390-L475 PolarHBondContact OG1-O 3.22Å; G391-L475 PolarHBondContact N-O 3.23Å; G391-L475 PolarHBondContact O-N 3.26Å; V393-L475 HydrophobicContact CG2-CD1 3.92Å; V393-L475 HydrophobicContact CG2-CD2 4.25Å; V393-L475 HydrophobicContact CG2-CG 4.2Å; K445-L475 HydrophobicContact CD-CD1 3.86Å; K445-L475 HydrophobicContact CG-CD1 4.1Å; E473-L475 HydrophobicContact CG-CD2 4.41Å
476	G	89.6	Confident	90.4	Very high	0 Å²	0	35.9 Å²	35.9	0%	0	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	178.7	-158.1	-177.9	0	0	0	0	0	113.4	C320 E322 M324 R388	C320-G476 CarbonylContact C-O 3.6Å; E322-G476 PolarHBondContact N-O 2.73Å; E322-G476 VanDerWaalsContact N-O 3.08Å; E322-G476 PolarHBondContact O-N 3.12Å; M324-G476 WeakPolarHBondContact CE-O 3.38Å; R388-G476 CarbonylContact O-C 3.57Å; R388-G476 WeakPolarHBondContact O-CA 3.38Å
477	C	83.7	Confident	90.1	Very high	14 Å²	14	28.5 Å²	28.5	10%	0.095	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-156	155.8	172	56.7	0	0	0	0	110.3	C320 R388	C320-C477 HydrophobicContact CB-CB 3.83Å; C320-C477 WeakPolarHBondContact CB-SG 3.35Å; C320-C477 WeakPolarHBondContact SG-CB 3.46Å; C320-C477 PolarHBondContact SG-N 3.14Å; C320-C477 CovalentContact SG-SG 2.03Å; C320-C477 PolarHBondContact SG-SG 3.32Å; R388-C477 PolarHBondContact N-O 3.06Å; R388-C477 PolarHBondContact O-N 3.18Å; R388-C477 VanDerWaalsContact O-N 3.1Å
478	D	76.8	Confident	89.7	Confident	92 Å²	92	26.9 Å²	26.9	49%	0.492	13%	0.134	S	C	.	.			trans	-76.5	138.2	158.1	-67.3	-45.3	0	0	0	107.6	K387	K387-D478 WeakPolarHBondContact CD-OD1 3.48Å; K387-D478 WeakPolarHBondContact CE-OD1 3.02Å; K387-D478 WeakPolarHBondContact CG-OD1 3.27Å; K387-D478 IonicContact NZ-OD1 3.56Å; K387-D478 PolarHBondContact NZ-OD1 2.82Å; K387-D478 IonicContact NZ-OD2 2.83Å; K387-D478 PolarHBondContact NZ-OD2 3.42Å
479	E	60.5	Low	89.1	Confident	194 Å²	194	29.4 Å²	29.4	91%	0.907	15%	0.146	S	C	*	.			trans	-73.5	0	169.8	-77.2	-166.4	149.4	0	0	111.5	Y453	Y453-E479 VanDerWaalsContact CE1-CD 3.5Å; Y453-E479 HydrophobicContact CE1-CG 4.09Å; Y453-E479 VanDerWaalsContact CE1-OE1 3.32Å; Y453-E479 WeakPolarHBondContact CE1-OE1 3.41Å; Y453-E479 VanDerWaalsContact CZ-OE1 3.26Å; Y453-E479 PolarHBondContact OH-OE1 3.49Å

Retrieved 479 of 479 residues in 1057.6 ms (Link to these results)

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