A0A3Q0KVD4_SCHMA Loading...

Protein phosphatase methylesterase 1 (S33 family)

AlphaFold DB , UniProt , Accession A0A3Q0KVD4, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 389 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	36.8	Very low	33.9	Very low	246 Å²	246	162.6 Å²	162.6	100%	1.212	85%	0.849	S	S	*	*				0	129.3	0	-77.6	173.9	165.7	0	0	108.4
2	K	31.3	Very low	33.5	Very low	200 Å²	200	162.5 Å²	162.5	87%	0.87	85%	0.848	S	S	*	*			trans	-59.7	143.5	171.7	-72.5	171	173.3	175.8	0	110
3	N	33.8	Very low	32.9	Very low	143 Å²	143	156.7 Å²	156.7	77%	0.765	83%	0.83	S	S	*	*			trans	178.6	107.1	143.3	-88.1	-9.3	0	0	0	107.4
4	L	34.9	Very low	32.7	Very low	137 Å²	137	156.2 Å²	156.2	72%	0.717	83%	0.826	S	S	*	*				87	113.9	91.5	-95.7	159.6	0	0	0	110.9
5	L	38.2	Very low	32	Very low	170 Å²	170	157 Å²	157	89%	0.89	82%	0.82	S	S	*	*				-173.5	91.4	126.8	-93	167.3	0	0	0	108.8
6	T	30.7	Very low	31.7	Very low	121 Å²	121	157.4 Å²	157.4	74%	0.742	82%	0.822	S	S	*	*			trans	-95.5	123	166.6	43.7	0	0	0	0	109.1
7	T	35.9	Very low	31.2	Very low	137 Å²	137	155.3 Å²	155.3	84%	0.84	82%	0.817	S	S	*	*			trans	-137.4	89.7	159.1	44.9	0	0	0	0	108.7
8	R	32.1	Very low	31.1	Very low	241 Å²	241	152 Å²	152	91%	0.909	82%	0.816	S	S	*	*			trans	-82.1	120	166.3	-81.5	-176.5	171.9	-177.6	-2.5	108.1	T10	R8-T10 PolarHBondContact O-N 2.76Å
9	S	33.6	Very low	30.8	Very low	114 Å²	114	154 Å²	154	80%	0.797	82%	0.817	S	S	*	*			trans	-68.1	113.8	171	47.2	0	0	0	0	110.1
10	T	32.7	Very low	30.7	Very low	123 Å²	123	155.7 Å²	155.7	76%	0.755	82%	0.819	S	S	*	*			trans	-80.8	113.5	174.3	46.5	0	0	0	0	109.6	R8 L12	R8-T10 PolarHBondContact O-N 2.76Å; T10-L12 PolarHBondContact O-N 3.47Å
11	N	33.4	Very low	30.4	Very low	157 Å²	157	152 Å²	152	84%	0.84	82%	0.819	S	S	*	*			trans	-64.6	117.7	166.7	-75.5	-40	0	0	0	109.4	S13	N11-S13 PolarHBondContact O-N 3.3Å
12	L	29.3	Very low	29.8	Very low	161 Å²	161	147.5 Å²	147.5	84%	0.843	80%	0.798	S	S	*	*			trans	-70.5	104	170.5	-93.9	104.3	0	0	0	109.9	T10	T10-L12 PolarHBondContact O-N 3.47Å
13	S	24.8	Very low	29.3	Very low	87 Å²	87	143.2 Å²	143.2	61%	0.608	79%	0.793	S	S	*	*			trans	-82.2	109.3	161.2	50.4	0	0	0	0	109.1	N11 F15	N11-S13 PolarHBondContact O-N 3.3Å; S13-F15 PolarHBondContact O-N 2.87Å; S13-F15 VanDerWaalsContact O-N 3.11Å
14	I	30.4	Very low	28.8	Very low	150 Å²	150	144.1 Å²	144.1	77%	0.769	80%	0.797	S	S	*	*			trans	-74	100.1	174.8	-60.5	174.7	0	0	0	108
15	F	22.4	Very low	28.1	Very low	168 Å²	168	145.6 Å²	145.6	74%	0.737	80%	0.8	S	S	*	*			trans	-78.9	111.6	168.7	-87.6	-93.2	0	0	0	109.4	S13	S13-F15 PolarHBondContact O-N 2.87Å; S13-F15 VanDerWaalsContact O-N 3.11Å
16	L	26.6	Very low	27.4	Very low	164 Å²	164	143.5 Å²	143.5	86%	0.859	80%	0.795	S	S	*	*			trans	-95.4	98.3	166	-134.2	131.9	0	0	0	108
17	T	23.7	Very low	27.2	Very low	121 Å²	121	147.2 Å²	147.2	74%	0.742	80%	0.804	S	S	*	*			trans	-90.9	106.4	178.6	32.7	0	0	0	0	109.2
18	A	30.2	Very low	26.6	Very low	96 Å²	96	145.7 Å²	145.7	79%	0.793	80%	0.799	S	S	*	*			trans	-107.4	93.2	163.9	0	0	0	0	0	108.5
19	K	24.5	Very low	26.4	Very low	190 Å²	190	142.3 Å²	142.3	83%	0.826	80%	0.799	S	S	*	*			trans	-61.4	129.9	157.4	-79.9	175.9	171.4	178.2	0	107.5
20	H	28.5	Very low	26.1	Very low	187 Å²	187	141.2 Å²	141.2	87%	0.866	80%	0.796	S	S	*	*			trans	174	118	132	-89.5	91.1	0	0	0	107.1
21	G	24.1	Very low	25.7	Very low	80 Å²	80	143.1 Å²	143.1	83%	0.825	80%	0.801	S	S	*	*			trans	-75.1	134.7	176.9	0	0	0	0	0	111.4
22	I	25.4	Very low	25.4	Very low	150 Å²	150	147.3 Å²	147.3	77%	0.769	81%	0.807	S	S	*	*			trans	-138.5	112.7	155.7	-60.6	178.9	0	0	0	106.2	L24	I22-L24 HydrophobicContact CG2-CD1 4.34Å; I22-L24 HydrophobicContact CG2-CG 4.21Å
23	S	19.5	Very low	25.3	Very low	110 Å²	110	143.2 Å²	143.2	77%	0.769	80%	0.797	S	S	*	*			trans	-76.1	124.1	162.7	64	0	0	0	0	108.3
24	L	23.6	Very low	25.6	Very low	162 Å²	162	145.5 Å²	145.5	85%	0.848	80%	0.802	S	S	*	*			trans	-137.8	125.8	158.6	-86.7	173.8	0	0	0	109.7	I22	I22-L24 HydrophobicContact CG2-CD1 4.34Å; I22-L24 HydrophobicContact CG2-CG 4.21Å
25	H	20.6	Very low	25.6	Very low	168 Å²	168	147.3 Å²	147.3	78%	0.778	80%	0.804	S	S	*	*			trans	-57	143.4	178.9	-88.6	-103.1	0	0	0	113.4	Q27	H25-Q27 PolarHBondContact O-N 3.03Å
26	T	23.6	Very low	26.3	Very low	127 Å²	127	142.5 Å²	142.5	78%	0.779	79%	0.792	S	S	*	*			trans	20.7	95.9	143.8	54.5	0	0	0	0	117.5
27	Q	26.1	Very low	26.6	Very low	199 Å²	199	136.6 Å²	136.6	93%	0.93	77%	0.77	S	S	*	*			trans	-139.7	124.1	139.1	-86.9	-171.9	-2.7	0	0	109.5	H25	H25-Q27 PolarHBondContact O-N 3.03Å
28	S	23.7	Very low	27.1	Very low	105 Å²	105	137.8 Å²	137.8	73%	0.734	77%	0.767	S	S	*	*			trans	-55.7	136.3	-178	41.1	0	0	0	0	114.7	A30	S28-A30 PolarHBondContact O-N 2.99Å
29	N	27	Very low	27.2	Very low	170 Å²	170	138.9 Å²	138.9	91%	0.909	76%	0.759	S	S	*	*	S	Bend	trans	36.1	77.1	136.7	-61	-16.2	0	0	0	117.7
30	A	28.1	Very low	27.6	Very low	90 Å²	90	136 Å²	136	74%	0.744	75%	0.746	S	S	*	*			trans	-153.6	-0.3	156.7	0	0	0	0	0	115.7	S28	S28-A30 PolarHBondContact O-N 2.99Å
31	L	23.8	Very low	27.9	Very low	164 Å²	164	136.3 Å²	136.3	86%	0.859	74%	0.74	S	S	*	*			trans	-109	12.1	-169.3	-76.8	172.6	0	0	0	116.8
32	Y	27.7	Very low	28.6	Very low	244 Å²	244	141 Å²	141	96%	0.957	73%	0.733	S	S	*	*			trans	-107.9	51.1	171.1	-72.7	-78.7	0	0	0	112.3
33	A	27.7	Very low	29.1	Very low	76 Å²	76	136 Å²	136	63%	0.628	71%	0.707	S	S	*	*	S	Bend	trans	-123.4	100.1	161.2	0	0	0	0	0	109.2	K35	A33-K35 PolarHBondContact O-N 3.1Å
34	N	29.7	Very low	30.5	Very low	134 Å²	134	136.6 Å²	136.6	72%	0.717	70%	0.7	S	S	*	*			trans	54.9	52.4	143.7	-63.2	-24.1	0	0	0	119.2
35	K	30.4	Very low	31.8	Very low	188 Å²	188	133.2 Å²	133.2	82%	0.817	68%	0.682	S	S	*	*	S	Bend	trans	-83.1	-19.6	151.1	-84.3	-173.9	178	177.9	0	113.3	A33	A33-K35 PolarHBondContact O-N 3.1Å
36	S	36.9	Very low	33.5	Very low	68 Å²	68	130.6 Å²	130.6	48%	0.476	68%	0.678	S	S	.	*	H	α-helix	trans	-71.7	-36.7	175.6	54.8	0	0	0	0	112.3	H38 L39 F40	S36-H38 VanDerWaalsContact C-N 3.34Å; S36-H38 PolarHBondContact O-N 2.98Å; S36-L39 PolarHBondContact O-N 3.06Å; S36-F40 VanDerWaalsContact O-CB 3.32Å; S36-F40 WeakPolarHBondContact O-CB 3.1Å; S36-F40 VanDerWaalsContact O-CD2 3.26Å; S36-F40 WeakPolarHBondContact O-CD2 3.43Å; S36-F40 PolarHBondContact O-N 2.91Å
37	G	33.8	Very low	35	Very low	39 Å²	39	130.9 Å²	130.9	40%	0.402	67%	0.67	S	S	.	*	H	α-helix	trans	-58.8	-39.9	-178	0	0	0	0	0	114.1	R41	G37-R41 VanDerWaalsContact O-CB 3.29Å; G37-R41 WeakPolarHBondContact O-CB 3.38Å; G37-R41 PolarHBondContact O-N 2.84Å
38	H	34.2	Very low	36.7	Very low	146 Å²	146	124.6 Å²	124.6	68%	0.676	64%	0.638	S	S	*	*	H	α-helix	trans	-76.4	-35.5	-177.9	-116.9	-62.7	0	0	0	113.6	S36	S36-H38 VanDerWaalsContact C-N 3.34Å; S36-H38 PolarHBondContact O-N 2.98Å
39	L	32.3	Very low	38.7	Very low	119 Å²	119	120.3 Å²	120.3	62%	0.623	61%	0.608	S	S	*	*	H	α-helix	trans	-72.5	-39.2	174.4	-83.8	163	0	0	0	111.5	S36 R42 L43	S36-L39 PolarHBondContact O-N 3.06Å; L39-R42 PolarHBondContact O-N 3.09Å; L39-L43 PolarHBondContact O-N 2.62Å
40	F	33.6	Very low	41	Very low	130 Å²	130	118 Å²	118	57%	0.57	59%	0.591	S	S	*	*	H	α-helix	trans	-74.5	-30	179.4	-86.4	-84.9	0	0	0	113.6	S36 R42 L43	S36-F40 VanDerWaalsContact O-CB 3.32Å; S36-F40 WeakPolarHBondContact O-CB 3.1Å; S36-F40 VanDerWaalsContact O-CD2 3.26Å; S36-F40 WeakPolarHBondContact O-CD2 3.43Å; S36-F40 PolarHBondContact O-N 2.91Å; F40-R42 VanDerWaalsContact C-N 3.33Å; F40-L43 HydrophobicContact CD1-CD1 4.14Å; F40-L43 HydrophobicContact CE1-CD1 4.44Å; F40-L43 HydrophobicContact CG-CD1 4.47Å; F40-L43 WeakPolarHBondContact O-CB 3.47Å; F40-L43 PolarHBondContact O-N 3.4Å
41	R	35	Very low	43.4	Very low	193 Å²	193	119.2 Å²	119.2	73%	0.728	58%	0.582	S	S	*	*	H	α-helix	trans	-68	-33.6	173.6	-162.6	175.2	-178.1	-172.1	1.1	112	G37 L43 M44	G37-R41 VanDerWaalsContact O-CB 3.29Å; G37-R41 WeakPolarHBondContact O-CB 3.38Å; G37-R41 PolarHBondContact O-N 2.84Å; R41-L43 VanDerWaalsContact C-N 3.3Å; R41-L43 PolarHBondContact O-N 3.5Å; R41-M44 PolarHBondContact O-N 3.17Å
42	R	37.8	Very low	45.9	Very low	180 Å²	180	112.5 Å²	112.5	68%	0.679	55%	0.547	S	S	*	.	H	α-helix	trans	-64.6	-32.6	172.2	-82	-173.2	174.2	-178.5	-0.4	112.9	L39 F40 M44	L39-R42 PolarHBondContact O-N 3.09Å; F40-R42 VanDerWaalsContact C-N 3.33Å; R42-M44 VanDerWaalsContact C-N 3.31Å; R42-M44 PolarHBondContact O-N 3.49Å
43	L	36.3	Very low	48.3	Very low	44 Å²	44	106.3 Å²	106.3	23%	0.23	53%	0.527	C	S	.	.	T	Hydrogen-bonded Turn	trans	-71.6	-16.5	-178.2	-85.1	153.9	0	0	0	114.5	L39 F40 R41 Y48 F68	L39-L43 PolarHBondContact O-N 2.62Å; F40-L43 HydrophobicContact CD1-CD1 4.14Å; F40-L43 HydrophobicContact CE1-CD1 4.44Å; F40-L43 HydrophobicContact CG-CD1 4.47Å; F40-L43 WeakPolarHBondContact O-CB 3.47Å; F40-L43 PolarHBondContact O-N 3.4Å; R41-L43 VanDerWaalsContact C-N 3.3Å; R41-L43 PolarHBondContact O-N 3.5Å; L43-Y48 HydrophobicContact CD2-CD1 3.53Å; L43-Y48 HydrophobicContact CD2-CE1 3.1Å; L43-Y48 HydrophobicContact CG-CD1 4.22Å; L43-Y48 HydrophobicContact CG-CE1 3.91Å; L43-F68 HydrophobicContact CD2-CZ 4.27Å; L43-F68 WeakPolarHBondContact O-CE1 3.29Å
44	M	47.9	Very low	50.8	Low	123 Å²	123	108 Å²	108	61%	0.606	53%	0.532	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84	-8.4	-177.5	-71.1	-150.6	-75.4	0	0	114.7	R41 R42	R41-M44 PolarHBondContact O-N 3.17Å; R42-M44 VanDerWaalsContact C-N 3.31Å; R42-M44 PolarHBondContact O-N 3.49Å
45	N	51.3	Low	53.5	Low	91 Å²	91	109.2 Å²	109.2	49%	0.487	53%	0.53	S	S	.	.	S	Bend	trans	-78.4	131.8	177.5	-72.9	-11.7	0	0	0	110.1	Q47 Y48	N45-Q47 HydrophobicContact CB-CB 4.39Å; N45-Q47 PolarHBondContact O-N 2.98Å; N45-Q47 VanDerWaalsContact O-N 3.11Å; N45-Y48 WeakPolarHBondContact O-CB 3.46Å; N45-Y48 PolarHBondContact O-N 2.85Å
46	V	56.3	Low	56	Low	113 Å²	113	102.8 Å²	102.8	69%	0.685	51%	0.505	S	S	*	.	H	α-helix	trans	-50.4	-36.1	171.4	176.8	0	0	0	0	111	Y48 V49 E50	V46-Y48 VanDerWaalsContact C-N 3.26Å; V46-Y48 PolarHBondContact O-N 3.14Å; V46-V49 PolarHBondContact O-N 2.95Å; V46-E50 PolarHBondContact O-N 2.97Å
47	Q	55.2	Low	58.4	Low	132 Å²	132	103.3 Å²	103.3	62%	0.617	51%	0.506	S	S	*	.	H	α-helix	trans	-58	-30.3	173.4	-68.6	178.3	-23.7	0	0	114.2	N45 Q51	N45-Q47 HydrophobicContact CB-CB 4.39Å; N45-Q47 PolarHBondContact O-N 2.98Å; N45-Q47 VanDerWaalsContact O-N 3.11Å; Q47-Q51 WeakPolarHBondContact O-CG 3.29Å; Q47-Q51 PolarHBondContact O-N 3.33Å
48	Y	62.6	Low	60.8	Low	67 Å²	67	104 Å²	104	26%	0.263	51%	0.513	S	S	.	.	H	α-helix	trans	-75	-35.3	178.6	-172.5	-88.5	0	0	0	112	L43 N45 V46 E50 Q51 L52	L43-Y48 HydrophobicContact CD2-CD1 3.53Å; L43-Y48 HydrophobicContact CD2-CE1 3.1Å; L43-Y48 HydrophobicContact CG-CD1 4.22Å; L43-Y48 HydrophobicContact CG-CE1 3.91Å; N45-Y48 WeakPolarHBondContact O-CB 3.46Å; N45-Y48 PolarHBondContact O-N 2.85Å; V46-Y48 VanDerWaalsContact C-N 3.26Å; V46-Y48 PolarHBondContact O-N 3.14Å; Y48-E50 VanDerWaalsContact C-N 3.29Å; Y48-E50 PolarHBondContact O-N 2.84Å; Y48-Q51 WeakPolarHBondContact O-CB 3.36Å; Y48-Q51 PolarHBondContact O-N 3.12Å; Y48-Q51 VanDerWaalsContact O-N 3.17Å; Y48-L52 HydrophobicContact CD1-CD1 3.99Å; Y48-L52 HydrophobicContact CD1-CG 4.08Å; Y48-L52 HydrophobicContact CE1-CD1 3.69Å; Y48-L52 HydrophobicContact CE1-CD2 3.85Å; Y48-L52 HydrophobicContact CE1-CG 3.68Å; Y48-L52 PolarHBondContact O-N 2.99Å
49	V	65.6	Low	63.4	Low	16 Å²	16	101.6 Å²	101.6	10%	0.097	51%	0.511	C	S	.	.	H	α-helix	trans	-62.6	-42.5	175.5	179.9	0	0	0	0	109.4	V46 Q51 L52 Y61 K65 F68	V46-V49 PolarHBondContact O-N 2.95Å; V49-Q51 VanDerWaalsContact C-N 3.3Å; V49-Q51 PolarHBondContact O-N 3.48Å; V49-L52 WeakPolarHBondContact O-CB 3.48Å; V49-L52 PolarHBondContact O-N 2.83Å; V49-Y61 HydrophobicContact CG1-CE2 3.84Å; V49-Y61 VanDerWaalsContact O-CE2 3.31Å; V49-Y61 WeakPolarHBondContact O-CE2 3.33Å; V49-K65 HydrophobicContact CG1-CB 4.3Å; V49-K65 HydrophobicContact CG1-CG 4.39Å; V49-F68 HydrophobicContact CG2-CB 4.39Å; V49-F68 HydrophobicContact CG2-CD2 3.69Å; V49-F68 HydrophobicContact CG2-CE2 4.04Å; V49-F68 HydrophobicContact CG2-CG 3.99Å
50	E	75	Confident	66	Low	120 Å²	120	99.9 Å²	99.9	56%	0.561	50%	0.501	S	S	*	.	H	α-helix	trans	-60.4	-37.6	174.2	-66.8	174.3	174.2	0	0	112.3	V46 Y48 L52 E53	V46-E50 PolarHBondContact O-N 2.97Å; Y48-E50 VanDerWaalsContact C-N 3.29Å; Y48-E50 PolarHBondContact O-N 2.84Å; E50-L52 PolarHBondContact O-N 3.26Å; E50-E53 WeakPolarHBondContact O-CB 3.09Å; E50-E53 PolarHBondContact O-N 2.84Å
51	Q	78.3	Confident	68.4	Low	117 Å²	117	94.9 Å²	94.9	55%	0.547	48%	0.478	S	S	.	.	H	α-helix	trans	-67.6	-18.1	174.8	-70.5	172.8	16	0	0	114.4	Q47 Y48 V49	Q47-Q51 WeakPolarHBondContact O-CG 3.29Å; Q47-Q51 PolarHBondContact O-N 3.33Å; Y48-Q51 WeakPolarHBondContact O-CB 3.36Å; Y48-Q51 PolarHBondContact O-N 3.12Å; Y48-Q51 VanDerWaalsContact O-N 3.17Å; V49-Q51 VanDerWaalsContact C-N 3.3Å; V49-Q51 PolarHBondContact O-N 3.48Å
52	L	76.9	Confident	70.8	Confident	23 Å²	23	88.3 Å²	88.3	12%	0.12	47%	0.466	C	S	.	.	H	α-helix	trans	-84.9	-17.6	177.1	-71.9	174.3	0	0	0	113.3	Y48 V49 E50 K55 L56 V64	Y48-L52 HydrophobicContact CD1-CD1 3.99Å; Y48-L52 HydrophobicContact CD1-CG 4.08Å; Y48-L52 HydrophobicContact CE1-CD1 3.69Å; Y48-L52 HydrophobicContact CE1-CD2 3.85Å; Y48-L52 HydrophobicContact CE1-CG 3.68Å; Y48-L52 PolarHBondContact O-N 2.99Å; V49-L52 WeakPolarHBondContact O-CB 3.48Å; V49-L52 PolarHBondContact O-N 2.83Å; E50-L52 PolarHBondContact O-N 3.26Å; L52-K55 PolarHBondContact O-N 3.06Å; L52-L56 HydrophobicContact CB-CD1 4.05Å; L52-L56 HydrophobicContact CD1-CD1 4.29Å; L52-L56 HydrophobicContact CD2-CD1 4.48Å; L52-L56 PolarHBondContact O-N 3.19Å; L52-V64 HydrophobicContact CD1-CG1 4.25Å
53	E	77	Confident	73.1	Confident	113 Å²	113	85.3 Å²	85.3	53%	0.528	46%	0.462	S	S	.	.	T	Hydrogen-bonded Turn	trans	-50.8	-46.5	-179.7	-171.5	164.1	161.7	0	0	113.7	E50 K55 Y61	E50-E53 WeakPolarHBondContact O-CB 3.09Å; E50-E53 PolarHBondContact O-N 2.84Å; E53-K55 VanDerWaalsContact C-N 3.28Å; E53-K55 PolarHBondContact O-N 3.3Å; E53-Y61 HydrophobicContact CB-CE1 4.12Å; E53-Y61 HydrophobicContact CB-CE2 4.05Å; E53-Y61 HydrophobicContact CG-CD1 4.31Å; E53-Y61 HydrophobicContact CG-CE1 3.8Å; E53-Y61 PolarHBondContact OE2-OH 2.71Å
54	P	81	Confident	75.4	Confident	113 Å²	113	85 Å²	85	73%	0.734	46%	0.462	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75	-12.3	177.7	29.2	-36.3	0	0	0	114.4
55	K	85.4	Confident	77.1	Confident	159 Å²	159	84.8 Å²	84.8	69%	0.691	46%	0.458	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99.2	-22.2	-172.4	-66.3	-178.7	-179.1	174.9	0	113.8	L52 E53	L52-K55 PolarHBondContact O-N 3.06Å; E53-K55 VanDerWaalsContact C-N 3.28Å; E53-K55 PolarHBondContact O-N 3.3Å
56	L	84	Confident	78.5	Confident	53 Å²	53	84.7 Å²	84.7	28%	0.277	46%	0.457	S	S	.	.	S	Bend	trans	-113.3	141.5	-172.7	-71.4	170.8	0	0	0	111.3	L52 G58 I60 V64	L52-L56 HydrophobicContact CB-CD1 4.05Å; L52-L56 HydrophobicContact CD1-CD1 4.29Å; L52-L56 HydrophobicContact CD2-CD1 4.48Å; L52-L56 PolarHBondContact O-N 3.19Å; L56-G58 PolarHBondContact O-N 2.77Å; L56-I60 HydrophobicContact CD2-CG2 4.02Å; L56-V64 HydrophobicContact CD1-CG2 4.23Å
57	P	87.9	Confident	79.6	Confident	79 Å²	79	86.2 Å²	86.2	51%	0.513	45%	0.451	S	S	.	.			trans	-55.2	138.5	167.8	-23.8	33.2	0	0	0	111.3	P59 I60 Y61	P57-P59 VanDerWaalsContact C-CD 3.46Å; P57-P59 VanDerWaalsContact O-N 3.13Å; P57-I60 HydrophobicContact CB-CD1 4.29Å; P57-I60 HydrophobicContact CB-CG1 4.43Å; P57-I60 HydrophobicContact CG-CD1 4Å; P57-I60 WeakPolarHBondContact O-CA 3.33Å; P57-I60 WeakPolarHBondContact O-CB 3.4Å; P57-I60 PolarHBondContact O-N 3.27Å; P57-Y61 PolarHBondContact O-N 3.1Å
58	G	83.8	Confident	80.5	Confident	52 Å²	52	81.9 Å²	81.9	54%	0.536	43%	0.43	S	S	.	.	H	α-helix	trans	-40.4	-49.4	-176.6	0	0	0	0	0	116.8	L56 I60 Y61 A62	L56-G58 PolarHBondContact O-N 2.77Å; G58-I60 PolarHBondContact O-N 3.24Å; G58-Y61 PolarHBondContact O-N 3.49Å; G58-A62 PolarHBondContact O-N 3.23Å
59	P	88.8	Confident	81.2	Confident	97 Å²	97	86 Å²	86	63%	0.63	45%	0.449	S	S	*	.	H	α-helix	trans	-67.9	-33.8	179.1	25.4	-34.3	0	0	0	113.4	P57 A62 L63	P57-P59 VanDerWaalsContact C-CD 3.46Å; P57-P59 VanDerWaalsContact O-N 3.13Å; P59-A62 PolarHBondContact O-N 2.93Å; P59-L63 PolarHBondContact O-N 2.8Å
60	I	86.4	Confident	81.8	Confident	82 Å²	82	88.8 Å²	88.8	42%	0.421	46%	0.463	S	S	.	.	H	α-helix	trans	-71.3	-43	178	-59.2	179.1	0	0	0	109.6	L56 P57 G58 A62 L63 V64	L56-I60 HydrophobicContact CD2-CG2 4.02Å; P57-I60 HydrophobicContact CB-CD1 4.29Å; P57-I60 HydrophobicContact CB-CG1 4.43Å; P57-I60 HydrophobicContact CG-CD1 4Å; P57-I60 WeakPolarHBondContact O-CA 3.33Å; P57-I60 WeakPolarHBondContact O-CB 3.4Å; P57-I60 PolarHBondContact O-N 3.27Å; G58-I60 PolarHBondContact O-N 3.24Å; I60-A62 VanDerWaalsContact C-N 3.33Å; I60-A62 PolarHBondContact O-N 3.19Å; I60-L63 PolarHBondContact O-N 3.48Å; I60-V64 HydrophobicContact CG2-CG2 4.34Å; I60-V64 WeakPolarHBondContact O-CB 3.36Å; I60-V64 VanDerWaalsContact O-CG2 3.29Å; I60-V64 WeakPolarHBondContact O-CG2 3.32Å; I60-V64 PolarHBondContact O-N 2.79Å
61	Y	84.2	Confident	81.6	Confident	25 Å²	25	87.8 Å²	87.8	10%	0.098	45%	0.454	C	S	.	.	H	α-helix	trans	-58.4	-44.4	173.5	174.4	-119.8	0	0	0	111.8	V49 E53 P57 G58 L63 V64 K65	V49-Y61 HydrophobicContact CG1-CE2 3.84Å; V49-Y61 VanDerWaalsContact O-CE2 3.31Å; V49-Y61 WeakPolarHBondContact O-CE2 3.33Å; E53-Y61 HydrophobicContact CB-CE1 4.12Å; E53-Y61 HydrophobicContact CB-CE2 4.05Å; E53-Y61 HydrophobicContact CG-CD1 4.31Å; E53-Y61 HydrophobicContact CG-CE1 3.8Å; E53-Y61 PolarHBondContact OE2-OH 2.71Å; P57-Y61 PolarHBondContact O-N 3.1Å; G58-Y61 PolarHBondContact O-N 3.49Å; Y61-L63 PolarHBondContact O-N 3.1Å; Y61-V64 PolarHBondContact O-N 3.09Å; Y61-K65 VanDerWaalsContact O-CB 3.3Å; Y61-K65 WeakPolarHBondContact O-CB 3.42Å; Y61-K65 PolarHBondContact O-N 3.09Å
62	A	84.8	Confident	81.2	Confident	56 Å²	56	85.4 Å²	85.4	46%	0.463	45%	0.448	S	S	.	.	H	α-helix	trans	-60.7	-42.3	176.1	0	0	0	0	0	112.5	G58 P59 I60 L66	G58-A62 PolarHBondContact O-N 3.23Å; P59-A62 PolarHBondContact O-N 2.93Å; I60-A62 VanDerWaalsContact C-N 3.33Å; I60-A62 PolarHBondContact O-N 3.19Å; A62-L66 VanDerWaalsContact O-CB 3.23Å; A62-L66 WeakPolarHBondContact O-CB 3.34Å; A62-L66 PolarHBondContact O-N 3.38Å
63	L	86.7	Confident	81.3	Confident	116 Å²	116	87.6 Å²	87.6	61%	0.607	46%	0.46	S	S	*	.	H	α-helix	trans	-64.1	-43.5	174.1	-80.5	171.3	0	0	0	112.3	P59 I60 Y61 L66 W67	P59-L63 PolarHBondContact O-N 2.8Å; I60-L63 PolarHBondContact O-N 3.48Å; Y61-L63 PolarHBondContact O-N 3.1Å; L63-L66 PolarHBondContact O-N 3.29Å; L63-W67 WeakPolarHBondContact O-CB 3.23Å; L63-W67 PolarHBondContact O-N 2.84Å
64	V	84	Confident	81.1	Confident	38 Å²	38	89 Å²	89	23%	0.23	46%	0.464	C	S	.	.	H	α-helix	trans	-63.1	-46.9	177.2	170.2	0	0	0	0	110.3	L52 L56 I60 Y61 L66 W67 F68	L52-V64 HydrophobicContact CD1-CG1 4.25Å; L56-V64 HydrophobicContact CD1-CG2 4.23Å; I60-V64 HydrophobicContact CG2-CG2 4.34Å; I60-V64 WeakPolarHBondContact O-CB 3.36Å; I60-V64 VanDerWaalsContact O-CG2 3.29Å; I60-V64 WeakPolarHBondContact O-CG2 3.32Å; I60-V64 PolarHBondContact O-N 2.79Å; Y61-V64 PolarHBondContact O-N 3.09Å; V64-L66 PolarHBondContact O-N 2.89Å; V64-W67 WeakPolarHBondContact O-CB 3.44Å; V64-W67 PolarHBondContact O-N 2.83Å; V64-F68 HydrophobicContact CG1-CD2 3.61Å; V64-F68 HydrophobicContact CG1-CE2 3.53Å; V64-F68 WeakPolarHBondContact O-CD2 3.04Å; V64-F68 PolarHBondContact O-N 3.29Å
65	K	83.4	Confident	80.7	Confident	118 Å²	118	86.7 Å²	86.7	51%	0.513	45%	0.454	S	S	.	.	H	α-helix	trans	-60.5	-44.3	175.9	-174.6	173.5	-175.6	168.4	0	111.9	V49 Y61 F68 K69	V49-K65 HydrophobicContact CG1-CB 4.3Å; V49-K65 HydrophobicContact CG1-CG 4.39Å; Y61-K65 VanDerWaalsContact O-CB 3.3Å; Y61-K65 WeakPolarHBondContact O-CB 3.42Å; Y61-K65 PolarHBondContact O-N 3.09Å; K65-F68 PolarHBondContact O-N 3.45Å; K65-K69 WeakPolarHBondContact O-CB 3.35Å; K65-K69 PolarHBondContact O-N 3.27Å
66	L	82.3	Confident	80.4	Confident	90 Å²	90	81.4 Å²	81.4	47%	0.471	43%	0.432	S	S	.	.	H	α-helix	trans	-62.6	-43.9	174.6	-179.6	65.5	0	0	0	111.1	A62 L63 V64 K69 I70	A62-L66 VanDerWaalsContact O-CB 3.23Å; A62-L66 WeakPolarHBondContact O-CB 3.34Å; A62-L66 PolarHBondContact O-N 3.38Å; L63-L66 PolarHBondContact O-N 3.29Å; V64-L66 PolarHBondContact O-N 2.89Å; L66-K69 CarbonylContact O-C 3.56Å; L66-K69 WeakPolarHBondContact O-CB 3.29Å; L66-K69 PolarHBondContact O-N 3.23Å; L66-K69 VanDerWaalsContact O-N 3.12Å; L66-I70 HydrophobicContact CD1-CD1 3.92Å; L66-I70 HydrophobicContact CD1-CG1 4.22Å; L66-I70 HydrophobicContact CD2-CD1 4.25Å; L66-I70 HydrophobicContact CG-CD1 3.68Å; L66-I70 HydrophobicContact CG-CG1 4.34Å; L66-I70 WeakPolarHBondContact O-CB 3.49Å; L66-I70 VanDerWaalsContact O-CG1 3.26Å; L66-I70 WeakPolarHBondContact O-CG1 3.3Å; L66-I70 PolarHBondContact O-N 3.46Å
67	W	78.8	Confident	80.3	Confident	144 Å²	144	83.3 Å²	83.3	55%	0.545	44%	0.442	S	S	.	.	H	α-helix	trans	-62.1	-44.5	178.1	-175.7	83.6	0	0	0	111.8	L63 V64 K69 I70 R71	L63-W67 WeakPolarHBondContact O-CB 3.23Å; L63-W67 PolarHBondContact O-N 2.84Å; V64-W67 WeakPolarHBondContact O-CB 3.44Å; V64-W67 PolarHBondContact O-N 2.83Å; W67-K69 VanDerWaalsContact C-N 3.29Å; W67-K69 PolarHBondContact O-N 3.42Å; W67-I70 PolarHBondContact O-N 2.91Å; W67-R71 PolarHBondContact O-N 2.8Å
68	F	73.2	Confident	79.7	Confident	42 Å²	42	81.4 Å²	81.4	18%	0.184	43%	0.433	C	S	.	.	H	α-helix	trans	-63.8	-31.8	172.7	-84.2	-70	0	0	0	113	L43 V49 V64 K65 P72	L43-F68 HydrophobicContact CD2-CZ 4.27Å; L43-F68 WeakPolarHBondContact O-CE1 3.29Å; V49-F68 HydrophobicContact CG2-CB 4.39Å; V49-F68 HydrophobicContact CG2-CD2 3.69Å; V49-F68 HydrophobicContact CG2-CE2 4.04Å; V49-F68 HydrophobicContact CG2-CG 3.99Å; V64-F68 HydrophobicContact CG1-CD2 3.61Å; V64-F68 HydrophobicContact CG1-CE2 3.53Å; V64-F68 WeakPolarHBondContact O-CD2 3.04Å; V64-F68 PolarHBondContact O-N 3.29Å; K65-F68 PolarHBondContact O-N 3.45Å; F68-P72 WeakPolarHBondContact O-CD 3.47Å
69	K	77.2	Confident	79.2	Confident	154 Å²	154	80.8 Å²	80.8	67%	0.67	42%	0.418	S	S	*	.	H	α-helix	trans	-73.7	-34.5	173.4	-169.3	176.6	-179.3	-179.4	0	112.4	K65 L66 W67 P72 L73	K65-K69 WeakPolarHBondContact O-CB 3.35Å; K65-K69 PolarHBondContact O-N 3.27Å; L66-K69 CarbonylContact O-C 3.56Å; L66-K69 WeakPolarHBondContact O-CB 3.29Å; L66-K69 PolarHBondContact O-N 3.23Å; L66-K69 VanDerWaalsContact O-N 3.12Å; W67-K69 VanDerWaalsContact C-N 3.29Å; W67-K69 PolarHBondContact O-N 3.42Å; K69-P72 WeakPolarHBondContact O-CD 3.49Å; K69-P72 WeakPolarHBondContact O-CG 3.41Å; K69-L73 WeakPolarHBondContact O-CG 3.5Å
70	I	78.7	Confident	78.8	Confident	73 Å²	73	78.3 Å²	78.3	37%	0.374	40%	0.399	S	S	.	.	H	α-helix	trans	-77.8	-32.1	179.1	-68	169	0	0	0	112.2	L66 W67 L73 K74	L66-I70 HydrophobicContact CD1-CD1 3.92Å; L66-I70 HydrophobicContact CD1-CG1 4.22Å; L66-I70 HydrophobicContact CD2-CD1 4.25Å; L66-I70 HydrophobicContact CG-CD1 3.68Å; L66-I70 HydrophobicContact CG-CG1 4.34Å; L66-I70 WeakPolarHBondContact O-CB 3.49Å; L66-I70 VanDerWaalsContact O-CG1 3.26Å; L66-I70 WeakPolarHBondContact O-CG1 3.3Å; L66-I70 PolarHBondContact O-N 3.46Å; W67-I70 PolarHBondContact O-N 2.91Å; I70-L73 WeakPolarHBondContact O-CA 3.38Å; I70-L73 VanDerWaalsContact O-CB 3.28Å; I70-L73 WeakPolarHBondContact O-CB 3.27Å; I70-L73 PolarHBondContact O-N 2.85Å; I70-K74 PolarHBondContact O-N 3.26Å
71	R	70.3	Confident	78.5	Confident	100 Å²	100	83.6 Å²	83.6	38%	0.377	41%	0.414	S	S	.	.	H	α-helix	trans	-55.8	-51.1	-179.9	-170.4	177.3	177.6	-166.5	-2.5	113.7	W67 L73 K74	W67-R71 PolarHBondContact O-N 2.8Å; R71-L73 PolarHBondContact O-N 2.88Å; R71-K74 PolarHBondContact O-N 2.84Å
72	P	71.8	Confident	78	Confident	66 Å²	66	85.3 Å²	85.3	43%	0.429	42%	0.42	S	S	.	.	H	α-helix	trans	-64.7	-31.8	174.9	27.2	-34.2	0	0	0	111	F68 K69 K74 A75 E76	F68-P72 WeakPolarHBondContact O-CD 3.47Å; K69-P72 WeakPolarHBondContact O-CD 3.49Å; K69-P72 WeakPolarHBondContact O-CG 3.41Å; P72-K74 PolarHBondContact O-N 3.46Å; P72-A75 PolarHBondContact O-N 3.05Å; P72-E76 WeakPolarHBondContact O-CB 3.22Å; P72-E76 WeakPolarHBondContact O-CG 3.16Å; P72-E76 PolarHBondContact O-N 3.31Å
73	L	77.1	Confident	77.6	Confident	70 Å²	70	85 Å²	85	37%	0.366	41%	0.407	S	S	.	.	H	α-helix	trans	-57.7	-33.3	175.2	-66.4	176	0	0	0	112.5	K69 I70 R71 L77 F258	K69-L73 WeakPolarHBondContact O-CG 3.5Å; I70-L73 WeakPolarHBondContact O-CA 3.38Å; I70-L73 VanDerWaalsContact O-CB 3.28Å; I70-L73 WeakPolarHBondContact O-CB 3.27Å; I70-L73 PolarHBondContact O-N 2.85Å; R71-L73 PolarHBondContact O-N 2.88Å; L73-L77 WeakPolarHBondContact O-CB 3.24Å; L73-L77 WeakPolarHBondContact O-CD1 3.39Å; L73-L77 WeakPolarHBondContact O-CG 3.45Å; L73-L77 PolarHBondContact O-N 2.79Å; L73-F258 HydrophobicContact CD2-CD1 3.68Å; L73-F258 HydrophobicContact CD2-CE1 3.82Å
74	K	73	Confident	77.1	Confident	142 Å²	142	83.1 Å²	83.1	62%	0.617	40%	0.397	S	S	*	.	H	α-helix	trans	-67.1	-41.9	175.1	-69.6	-172.4	178.5	-176.2	0	112.4	I70 R71 P72 L77 A78	I70-K74 PolarHBondContact O-N 3.26Å; R71-K74 PolarHBondContact O-N 2.84Å; P72-K74 PolarHBondContact O-N 3.46Å; K74-L77 PolarHBondContact O-N 3.39Å; K74-A78 WeakPolarHBondContact O-CB 3.37Å; K74-A78 PolarHBondContact O-N 3.44Å
75	A	73.7	Confident	76.4	Confident	64 Å²	64	85.4 Å²	85.4	53%	0.529	41%	0.405	S	S	.	.	H	α-helix	trans	-66.4	-44.4	176.5	0	0	0	0	0	111	P72 L77 A78 D79	P72-A75 PolarHBondContact O-N 3.05Å; A75-L77 PolarHBondContact O-N 3.23Å; A75-A78 WeakPolarHBondContact O-CB 3.32Å; A75-A78 PolarHBondContact O-N 2.76Å; A75-D79 PolarHBondContact O-N 2.84Å
76	E	79	Confident	75.6	Confident	49 Å²	49	82.1 Å²	82.1	23%	0.229	39%	0.389	C	S	.	.	H	α-helix	trans	-63.6	-37.7	174.6	-66.4	-72.1	158.1	0	0	112.1	P72 D79 L80 L257 F258	P72-E76 WeakPolarHBondContact O-CB 3.22Å; P72-E76 WeakPolarHBondContact O-CG 3.16Å; P72-E76 PolarHBondContact O-N 3.31Å; E76-D79 PolarHBondContact O-N 2.96Å; E76-L80 VanDerWaalsContact O-CB 3.26Å; E76-L80 WeakPolarHBondContact O-CB 3.38Å; E76-L80 PolarHBondContact O-N 2.78Å; E76-L257 VanDerWaalsContact OE2-CA 3.26Å; E76-L257 WeakPolarHBondContact OE2-CA 3.39Å; E76-F258 HydrophobicContact CB-CD1 4.13Å; E76-F258 HydrophobicContact CB-CE1 4.04Å; E76-F258 PolarHBondContact OE2-N 3.17Å
77	L	81.4	Confident	74.7	Confident	92 Å²	92	82.4 Å²	82.4	48%	0.482	39%	0.391	S	S	.	.	H	α-helix	trans	-70.3	-37.1	174.3	-79	167.5	0	0	0	111.9	L73 K74 A75 D79 L80 R81 F258	L73-L77 WeakPolarHBondContact O-CB 3.24Å; L73-L77 WeakPolarHBondContact O-CD1 3.39Å; L73-L77 WeakPolarHBondContact O-CG 3.45Å; L73-L77 PolarHBondContact O-N 2.79Å; K74-L77 PolarHBondContact O-N 3.39Å; A75-L77 PolarHBondContact O-N 3.23Å; L77-D79 VanDerWaalsContact C-N 3.35Å; L77-L80 HydrophobicContact CD2-CD2 4.24Å; L77-R81 VanDerWaalsContact O-CB 3.3Å; L77-R81 WeakPolarHBondContact O-CB 3.43Å; L77-R81 PolarHBondContact O-N 3.41Å; L77-F258 HydrophobicContact CD2-CZ 4.02Å; L77-F258 HydrophobicContact CG-CE1 4.47Å; L77-F258 HydrophobicContact CG-CZ 4.4Å
78	A	75.8	Confident	73.5	Confident	40 Å²	40	83.3 Å²	83.3	33%	0.331	40%	0.399	S	S	.	.	H	α-helix	trans	-64.3	-43.4	172.2	0	0	0	0	0	110.4	K74 A75 R81 R82	K74-A78 WeakPolarHBondContact O-CB 3.37Å; K74-A78 PolarHBondContact O-N 3.44Å; A75-A78 WeakPolarHBondContact O-CB 3.32Å; A75-A78 PolarHBondContact O-N 2.76Å; A78-R81 WeakPolarHBondContact O-CB 3.47Å; A78-R81 PolarHBondContact O-N 2.97Å; A78-R82 WeakPolarHBondContact O-CG 3.06Å; A78-R82 PolarHBondContact O-N 3.41Å
79	D	74.1	Confident	72.5	Confident	39 Å²	39	86 Å²	86	21%	0.209	41%	0.412	C	S	.	.	H	α-helix	trans	-63.9	-44.8	174.6	-168.3	52.6	0	0	0	112.2	A75 E76 L77 R81 R82 R83	A75-D79 PolarHBondContact O-N 2.84Å; E76-D79 PolarHBondContact O-N 2.96Å; L77-D79 VanDerWaalsContact C-N 3.35Å; D79-R81 VanDerWaalsContact C-N 3.29Å; D79-R81 PolarHBondContact O-N 2.93Å; D79-R82 WeakPolarHBondContact O-CB 3.43Å; D79-R82 PolarHBondContact O-N 2.59Å; D79-R82 VanDerWaalsContact O-N 3.09Å; D79-R82 IonicContact OD1-NH1 2.73Å; D79-R83 WeakPolarHBondContact O-CG 3.39Å; D79-R83 PolarHBondContact O-N 2.86Å; D79-R83 IonicContact OD2-CZ 3.18Å; D79-R83 IonicContact OD2-NE 2.77Å; D79-R83 PolarHBondContact OD2-NE 3.32Å; D79-R83 IonicContact OD2-NH2 3.11Å; D79-R83 PolarHBondContact OD2-NH2 3.08Å
80	L	80.1	Confident	71.2	Confident	45 Å²	45	80.8 Å²	80.8	24%	0.236	40%	0.401	C	S	.	.	H	α-helix	trans	-56	-45.5	172	-178.4	69.7	0	0	0	110.9	E76 L77 R82 R83 I84 L257 F258	E76-L80 VanDerWaalsContact O-CB 3.26Å; E76-L80 WeakPolarHBondContact O-CB 3.38Å; E76-L80 PolarHBondContact O-N 2.78Å; L77-L80 HydrophobicContact CD2-CD2 4.24Å; L80-R82 VanDerWaalsContact C-N 3.32Å; L80-R82 PolarHBondContact O-N 2.77Å; L80-R83 PolarHBondContact O-N 2.72Å; L80-I84 HydrophobicContact CD1-CD1 4.15Å; L80-I84 HydrophobicContact CD1-CG1 4.34Å; L80-I84 HydrophobicContact CD2-CD1 4.16Å; L80-I84 HydrophobicContact CG-CD1 3.75Å; L80-I84 HydrophobicContact CG-CG1 4.28Å; L80-I84 WeakPolarHBondContact O-CB 3.47Å; L80-I84 VanDerWaalsContact O-CG1 3.29Å; L80-I84 WeakPolarHBondContact O-CG1 3.46Å; L80-I84 PolarHBondContact O-N 2.7Å; L80-L257 HydrophobicContact CB-CD1 3.97Å; L80-L257 HydrophobicContact CD1-CD1 4.03Å; L80-L257 HydrophobicContact CD1-CD2 3.82Å; L80-F258 HydrophobicContact CD1-CE2 4.49Å; L80-F258 HydrophobicContact CD2-CE2 3.94Å; L80-F258 HydrophobicContact CD2-CZ 4.03Å
81	R	79	Confident	70.1	Confident	192 Å²	192	85.6 Å²	85.6	73%	0.725	42%	0.42	S	S	*	.	H	α-helix	trans	-60.8	-41.7	177.1	-176.8	-179.6	177.3	179.8	0.6	111.2	L77 A78 D79 I84 Q85	L77-R81 VanDerWaalsContact O-CB 3.3Å; L77-R81 WeakPolarHBondContact O-CB 3.43Å; L77-R81 PolarHBondContact O-N 3.41Å; A78-R81 WeakPolarHBondContact O-CB 3.47Å; A78-R81 PolarHBondContact O-N 2.97Å; D79-R81 VanDerWaalsContact C-N 3.29Å; D79-R81 PolarHBondContact O-N 2.93Å; R81-I84 PolarHBondContact O-N 2.74Å; R81-Q85 WeakPolarHBondContact O-CB 2.97Å; R81-Q85 PolarHBondContact O-N 3.38Å
82	R	73.9	Confident	69.9	Low	61 Å²	61	83.4 Å²	83.4	23%	0.23	41%	0.414	C	S	.	.	H	α-helix	trans	-61.9	-43.8	174.3	-67.5	-179.7	-159.2	104.5	-3.1	111.2	A78 D79 L80 Q85 R86 D181 Y190 V194	A78-R82 WeakPolarHBondContact O-CG 3.06Å; A78-R82 PolarHBondContact O-N 3.41Å; D79-R82 WeakPolarHBondContact O-CB 3.43Å; D79-R82 PolarHBondContact O-N 2.59Å; D79-R82 VanDerWaalsContact O-N 3.09Å; D79-R82 IonicContact OD1-NH1 2.73Å; L80-R82 VanDerWaalsContact C-N 3.32Å; L80-R82 PolarHBondContact O-N 2.77Å; R82-Q85 PolarHBondContact O-N 2.87Å; R82-R86 PolarHBondContact O-N 3.31Å; R82-D181 IonicContact CZ-OD2 3.03Å; R82-D181 IonicContact NH2-OD2 3.9Å; R82-D181 PolarHBondContact NH2-OD2 3.2Å; R82-Y190 PolarHBondContact NE-OH 2.77Å; R82-Y190 VanDerWaalsContact NE-OH 3.12Å; R82-Y190 PolarHBondContact NH2-OH 2.91Å; R82-V194 HydrophobicContact CB-CG2 4.22Å; R82-V194 HydrophobicContact CG-CG2 4.25Å
83	R	75.9	Confident	69.7	Low	50 Å²	50	84 Å²	84	19%	0.189	42%	0.417	C	S	.	.	H	α-helix	trans	-64.8	-41.2	176	-67.2	176.9	-165.5	-140	3.6	112.7	D79 L80 R86 N87 S255 K256	D79-R83 WeakPolarHBondContact O-CG 3.39Å; D79-R83 PolarHBondContact O-N 2.86Å; D79-R83 IonicContact OD2-CZ 3.18Å; D79-R83 IonicContact OD2-NE 2.77Å; D79-R83 PolarHBondContact OD2-NE 3.32Å; D79-R83 IonicContact OD2-NH2 3.11Å; D79-R83 PolarHBondContact OD2-NH2 3.08Å; L80-R83 PolarHBondContact O-N 2.72Å; R83-R86 WeakPolarHBondContact O-CB 3.39Å; R83-R86 PolarHBondContact O-N 3.01Å; R83-N87 WeakPolarHBondContact O-CB 3.33Å; R83-N87 PolarHBondContact O-N 3.05Å; R83-S255 PolarHBondContact NH1-OG 3.44Å; R83-S255 PolarHBondContact NH2-OG 2.96Å; R83-K256 PolarHBondContact NH2-O 2.84Å
84	I	76	Confident	69.8	Low	77 Å²	77	87.2 Å²	87.2	40%	0.395	43%	0.428	S	S	.	.	H	α-helix	trans	-66.6	-42.2	176.2	-71.1	171.2	0	0	0	109.9	L80 R81 R86 N87 K88	L80-I84 HydrophobicContact CD1-CD1 4.15Å; L80-I84 HydrophobicContact CD1-CG1 4.34Å; L80-I84 HydrophobicContact CD2-CD1 4.16Å; L80-I84 HydrophobicContact CG-CD1 3.75Å; L80-I84 HydrophobicContact CG-CG1 4.28Å; L80-I84 WeakPolarHBondContact O-CB 3.47Å; L80-I84 VanDerWaalsContact O-CG1 3.29Å; L80-I84 WeakPolarHBondContact O-CG1 3.46Å; L80-I84 PolarHBondContact O-N 2.7Å; R81-I84 PolarHBondContact O-N 2.74Å; I84-R86 VanDerWaalsContact C-N 3.31Å; I84-R86 PolarHBondContact O-N 3.3Å; I84-N87 PolarHBondContact O-N 2.77Å; I84-N87 VanDerWaalsContact O-N 3.11Å; I84-K88 HydrophobicContact CG2-CD 4.25Å; I84-K88 HydrophobicContact CG2-CG 4.24Å; I84-K88 WeakPolarHBondContact O-CB 3.38Å; I84-K88 WeakPolarHBondContact O-CG 3.23Å; I84-K88 PolarHBondContact O-N 3.15Å
85	Q	70.8	Confident	70.2	Confident	86 Å²	86	83.3 Å²	83.3	40%	0.402	41%	0.413	S	S	.	.	H	α-helix	trans	-57.9	-47.1	175.2	-175.6	59.6	33.6	0	0	110.4	R81 R82 N87 K88 E89	R81-Q85 WeakPolarHBondContact O-CB 2.97Å; R81-Q85 PolarHBondContact O-N 3.38Å; R82-Q85 PolarHBondContact O-N 2.87Å; Q85-N87 PolarHBondContact O-N 3.07Å; Q85-K88 PolarHBondContact O-N 3.49Å; Q85-E89 PolarHBondContact NE2-OE1 3.31Å; Q85-E89 WeakPolarHBondContact O-CG 3.24Å; Q85-E89 PolarHBondContact O-N 3.05Å
86	R	65.6	Low	70.7	Confident	49 Å²	49	83.3 Å²	83.3	19%	0.185	40%	0.402	C	S	.	.	H	α-helix	trans	-57.5	-45	171.5	176.1	-172.5	-99.5	150.7	-13.5	112.4	R82 R83 I84 E89 R100 H192 P193	R82-R86 PolarHBondContact O-N 3.31Å; R83-R86 WeakPolarHBondContact O-CB 3.39Å; R83-R86 PolarHBondContact O-N 3.01Å; I84-R86 VanDerWaalsContact C-N 3.31Å; I84-R86 PolarHBondContact O-N 3.3Å; R86-E89 WeakPolarHBondContact O-CB 3.23Å; R86-E89 PolarHBondContact O-N 3.2Å; R86-R100 VanDerWaalsContact NE-NH2 3.1Å; R86-H192 PolarHBondContact NH1-O 2.83Å; R86-H192 PolarHBondContact NH2-O 3.11Å; R86-P193 PolarHBondContact NH2-O 3.16Å
87	N	63.8	Low	70.9	Confident	95 Å²	95	82.3 Å²	82.3	51%	0.508	40%	0.401	S	S	.	.	H	α-helix	trans	-69	-35.8	-178.2	-162.3	19.3	0	0	0	112.4	R83 I84 Q85 E89 G90	R83-N87 WeakPolarHBondContact O-CB 3.33Å; R83-N87 PolarHBondContact O-N 3.05Å; I84-N87 PolarHBondContact O-N 2.77Å; I84-N87 VanDerWaalsContact O-N 3.11Å; Q85-N87 PolarHBondContact O-N 3.07Å; N87-E89 PolarHBondContact O-N 3.04Å; N87-G90 PolarHBondContact O-N 3.12Å; N87-G90 VanDerWaalsContact O-N 3.09Å
88	K	52.7	Low	71.1	Confident	163 Å²	163	80.2 Å²	80.2	71%	0.709	39%	0.386	S	S	*	.	H	α-helix	trans	-61.4	-28.6	173.1	-77.9	-178.6	177.8	-174	0	112.3	I84 Q85 G90	I84-K88 HydrophobicContact CG2-CD 4.25Å; I84-K88 HydrophobicContact CG2-CG 4.24Å; I84-K88 WeakPolarHBondContact O-CB 3.38Å; I84-K88 WeakPolarHBondContact O-CG 3.23Å; I84-K88 PolarHBondContact O-N 3.15Å; Q85-K88 PolarHBondContact O-N 3.49Å; K88-G90 PolarHBondContact O-N 3.49Å
89	E	52.5	Low	71.5	Confident	100 Å²	100	78.8 Å²	78.8	47%	0.467	37%	0.373	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.8	1.7	178	-68.6	165.7	-165.9	0	0	113	Q85 R86 N87	Q85-E89 PolarHBondContact NE2-OE1 3.31Å; Q85-E89 WeakPolarHBondContact O-CG 3.24Å; Q85-E89 PolarHBondContact O-N 3.05Å; R86-E89 WeakPolarHBondContact O-CB 3.23Å; R86-E89 PolarHBondContact O-N 3.2Å; N87-E89 PolarHBondContact O-N 3.04Å
90	G	50.6	Low	72	Confident	43 Å²	43	77.9 Å²	77.9	44%	0.443	37%	0.367	S	S	.	.			trans	102.6	155.6	173.2	0	0	0	0	0	113.9	N87 K88	N87-G90 PolarHBondContact O-N 3.12Å; N87-G90 VanDerWaalsContact O-N 3.09Å; K88-G90 PolarHBondContact O-N 3.49Å
91	F	56.1	Low	72.3	Confident	174 Å²	174	77.3 Å²	77.3	76%	0.763	36%	0.362	S	S	*	.			trans	-65	153	174.8	-73.2	-79.5	0	0	0	111.8	T93	F91-T93 PolarHBondContact O-N 2.86Å
92	E	66.2	Low	72.6	Confident	54 Å²	54	68.6 Å²	68.6	25%	0.252	33%	0.329	S	S	.	.			trans	-72.3	100.1	176.5	-63.8	178.5	-153.2	0	0	109.3	R100 A268 Y269	E92-R100 IonicContact OE1-CZ 3.02Å; E92-R100 IonicContact OE1-NE 3.91Å; E92-R100 PolarHBondContact OE1-NE 2.88Å; E92-R100 IonicContact OE1-NH1 2.79Å; E92-R100 PolarHBondContact OE1-NH1 3.27Å; E92-R100 IonicContact OE1-NH2 3.33Å; E92-R100 PolarHBondContact OE1-NH2 3.13Å; E92-R100 IonicContact OE2-CZ 3.73Å; E92-R100 IonicContact OE2-NE 2.79Å; E92-R100 IonicContact OE2-NH1 3.02Å; E92-R100 PolarHBondContact OE2-NH1 3.22Å; E92-R100 VanDerWaalsContact OE2-NH1 3.11Å; E92-A268 HydrophobicContact CB-CB 3.65Å; E92-A268 WeakPolarHBondContact O-CB 3.44Å; E92-Y269 WeakPolarHBondContact OE2-CE2 3.18Å; E92-Y269 PolarHBondContact OE2-OH 3.03Å
93	T	66.9	Low	73.2	Confident	80 Å²	80	65.7 Å²	65.7	49%	0.491	32%	0.319	S	S	.	.			trans	-80.1	142.9	173.7	48.8	0	0	0	0	110.4	F91 I95	F91-T93 PolarHBondContact O-N 2.86Å; T93-I95 VanDerWaalsContact C-N 3.31Å; T93-I95 PolarHBondContact O-N 2.95Å; T93-I95 WeakPolarHBondContact OG1-CD1 3.14Å; T93-I95 WeakPolarHBondContact OG1-CG1 3.28Å
94	K	79.4	Confident	73.9	Confident	137 Å²	137	63.5 Å²	63.5	60%	0.596	31%	0.31	S	S	*	.			trans	-68.2	86.9	173.5	-68.9	-178.6	-178	-179.4	0	109.4	E267 A268 F369	K94-E267 WeakPolarHBondContact CE-O 3.39Å; K94-A268 HydrophobicContact CG-CB 4.49Å; K94-F369 HydrophobicContact CB-CD1 4.48Å; K94-F369 HydrophobicContact CB-CD2 4.37Å; K94-F369 HydrophobicContact CB-CE1 4.04Å; K94-F369 HydrophobicContact CB-CE2 3.94Å; K94-F369 HydrophobicContact CB-CZ 3.76Å; K94-F369 HydrophobicContact CD-CE2 4.14Å; K94-F369 HydrophobicContact CD-CZ 4.43Å; K94-F369 HydrophobicContact CG-CD2 4.43Å; K94-F369 HydrophobicContact CG-CE2 4.05Å; K94-F369 HydrophobicContact CG-CZ 4.35Å
95	I	81.7	Confident	74.6	Confident	60 Å²	60	59.8 Å²	59.8	31%	0.308	29%	0.291	S	S	.	.			trans	-112.8	127.1	179.1	-63.2	177.4	0	0	0	108.5	T93 R98 F199 F369	T93-I95 VanDerWaalsContact C-N 3.31Å; T93-I95 PolarHBondContact O-N 2.95Å; T93-I95 WeakPolarHBondContact OG1-CD1 3.14Å; T93-I95 WeakPolarHBondContact OG1-CG1 3.28Å; I95-R98 HydrophobicContact CB-CB 4.49Å; I95-R98 WeakPolarHBondContact O-CB 3.5Å; I95-R98 PolarHBondContact O-N 2.73Å; I95-F199 HydrophobicContact CG2-CE1 3.84Å; I95-F199 HydrophobicContact CG2-CZ 3.66Å; I95-F369 VanDerWaalsContact O-CD1 3.31Å; I95-F369 WeakPolarHBondContact O-CD1 3.42Å
96	H	84.2	Confident	75.5	Confident	63 Å²	63	55.7 Å²	55.7	29%	0.292	27%	0.272	S	S	.	.	T	Hydrogen-bonded Turn	trans	-52.4	145	177.9	-176.8	70.1	0	0	0	111.9	R98 F199 D370 E371	H96-R98 PolarHBondContact O-N 2.78Å; H96-R98 VanDerWaalsContact O-N 3.12Å; H96-F199 WeakPolarHBondContact O-CE1 3.46Å; H96-D370 IonicContact CE1-OD1 2.66Å; H96-D370 PolarHBondContact CE1-OD1 2.93Å; H96-D370 IonicContact ND1-OD1 3.4Å; H96-E371 HydrophobicContact CB-CB 4.11Å; H96-E371 WeakPolarHBondContact ND1-CB 3.32Å; H96-E371 PolarHBondContact ND1-N 2.96Å
97	S	83.2	Confident	76.5	Confident	29 Å²	29	53.4 Å²	53.4	20%	0.203	26%	0.264	C	S	.	.	T	Hydrogen-bonded Turn	trans	64.2	12.5	174.2	68.4	0	0	0	0	115.9	F199 Y368 F369	S97-F199 WeakPolarHBondContact OG-CD1 3.49Å; S97-Y368 VanDerWaalsContact CA-CE2 3.49Å; S97-F369 PolarHBondContact N-O 2.72Å
98	R	84.4	Confident	77.5	Confident	48 Å²	48	48.9 Å²	48.9	18%	0.181	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.9	127.9	175.4	-135.7	-178.2	177.5	177.7	-3.6	110.1	I95 H96 P197 Y368 F369	I95-R98 HydrophobicContact CB-CB 4.49Å; I95-R98 WeakPolarHBondContact O-CB 3.5Å; I95-R98 PolarHBondContact O-N 2.73Å; H96-R98 PolarHBondContact O-N 2.78Å; H96-R98 VanDerWaalsContact O-N 3.12Å; R98-P197 HydrophobicContact CG-CB 3.74Å; R98-P197 VanDerWaalsContact CZ-CG 3.5Å; R98-P197 VanDerWaalsContact CZ-O 3.32Å; R98-P197 PolarHBondContact NE-O 3.43Å; R98-P197 PolarHBondContact NH2-O 2.8Å; R98-Y368 WeakPolarHBondContact O-CA 3.15Å; R98-F369 PolarHBondContact O-N 3.48Å
99	T	83.9	Confident	79	Confident	10 Å²	10	41.6 Å²	41.6	6%	0.061	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	138.8	172.8	53.8	0	0	0	0	110.6	P197 K198 L200 I273 L367 Y368	T99-P197 WeakPolarHBondContact O-CA 3.22Å; T99-K198 PolarHBondContact N-O 2.94Å; T99-K198 PolarHBondContact O-N 3.45Å; T99-K198 PolarHBondContact OG1-O 3.46Å; T99-L200 HydrophobicContact CG2-CB 4.06Å; T99-L200 HydrophobicContact CG2-CD1 4.36Å; T99-L200 WeakPolarHBondContact OG1-CB 3.36Å; T99-L200 WeakPolarHBondContact OG1-CD1 3.41Å; T99-L200 WeakPolarHBondContact OG1-CG 3.23Å; T99-I273 HydrophobicContact CG2-CD1 4.05Å; T99-L367 CarbonylContact C-O 3.54Å; T99-L367 VanDerWaalsContact CA-O 3.25Å; T99-L367 WeakPolarHBondContact CA-O 3.34Å; T99-Y368 HydrophobicContact CG2-CD2 3.48Å; T99-Y368 VanDerWaalsContact CG2-CD2 3.48Å; T99-Y368 HydrophobicContact CG2-CE2 4.22Å; T99-Y368 HydrophobicContact CG2-CG 4.37Å
100	R	85.2	Confident	80.6	Confident	19 Å²	19	41.1 Å²	41.1	7%	0.072	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	126.4	166.6	-172.7	-170.2	-167.5	-171.3	7.3	108.4	R86 E92 F102 P197 Y264 G265 Y269 G366 L367	R86-R100 VanDerWaalsContact NE-NH2 3.1Å; E92-R100 IonicContact OE1-CZ 3.02Å; E92-R100 IonicContact OE1-NE 3.91Å; E92-R100 PolarHBondContact OE1-NE 2.88Å; E92-R100 IonicContact OE1-NH1 2.79Å; E92-R100 PolarHBondContact OE1-NH1 3.27Å; E92-R100 IonicContact OE1-NH2 3.33Å; E92-R100 PolarHBondContact OE1-NH2 3.13Å; E92-R100 IonicContact OE2-CZ 3.73Å; E92-R100 IonicContact OE2-NE 2.79Å; E92-R100 IonicContact OE2-NH1 3.02Å; E92-R100 PolarHBondContact OE2-NH1 3.22Å; E92-R100 VanDerWaalsContact OE2-NH1 3.11Å; R100-F102 PolarHBondContact O-N 2.66Å; R100-P197 HydrophobicContact CB-CB 4.23Å; R100-Y264 PolarHBondContact NH1-O 2.94Å; R100-G265 PolarHBondContact NH1-O 3.42Å; R100-G265 VanDerWaalsContact NH1-O 3.17Å; R100-Y269 HydrophobicContact CB-CE1 3.97Å; R100-Y269 HydrophobicContact CB-CE2 4.18Å; R100-Y269 WeakPolarHBondContact CB-OH 3.41Å; R100-Y269 WeakPolarHBondContact CD-OH 3.04Å; R100-G366 CarbonylContact O-C 3.35Å; R100-G366 WeakPolarHBondContact O-CA 3.31Å; R100-L367 PolarHBondContact N-O 2.78Å; R100-L367 PolarHBondContact O-N 3.35Å
101	Y	86.1	Confident	82.1	Confident	33 Å²	33	46.5 Å²	46.5	13%	0.129	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.9	124.4	169.5	-68	-67.6	0	0	0	108.9	R104 F188 P193 L200 Y364	Y101-R104 HydrophobicContact CD1-CG 4.06Å; Y101-R104 HydrophobicContact CD2-CG 4.47Å; Y101-R104 HydrophobicContact CG-CG 3.89Å; Y101-R104 PolarHBondContact OH-NH1 3.31Å; Y101-R104 VanDerWaalsContact OH-NH1 3.14Å; Y101-F188 HydrophobicContact CD2-CE1 4.22Å; Y101-P193 WeakPolarHBondContact O-CD 3.31Å; Y101-P193 WeakPolarHBondContact O-CG 3.4Å; Y101-L200 HydrophobicContact CE2-CD1 3.64Å; Y101-L200 WeakPolarHBondContact OH-CD1 3.35Å; Y101-Y364 AromaticContact CD1-CD2 3.73Å; Y101-Y364 HydrophobicContact CD1-CD2 3.73Å; Y101-Y364 HydrophobicContact CD1-CE2 4.37Å; Y101-Y364 AromaticContact CD1-CG 3.95Å; Y101-Y364 HydrophobicContact CD1-CG 3.95Å; Y101-Y364 HydrophobicContact CE1-CD1 4.11Å; Y101-Y364 AromaticContact CE1-CD2 3.48Å; Y101-Y364 HydrophobicContact CE1-CD2 3.48Å; Y101-Y364 VanDerWaalsContact CE1-CD2 3.48Å; Y101-Y364 HydrophobicContact CE1-CE1 4.31Å; Y101-Y364 AromaticContact CE1-CE2 3.74Å; Y101-Y364 HydrophobicContact CE1-CE2 3.74Å; Y101-Y364 AromaticContact CE1-CG 3.7Å; Y101-Y364 HydrophobicContact CE1-CG 3.7Å
102	F	84.9	Confident	83.4	Confident	10 Å²	10	39.4 Å²	39.4	4%	0.044	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71	-63.1	166.6	177.5	-112.4	0	0	0	107.2	R100 T191 H192 P193 Y264 I365	R100-F102 PolarHBondContact O-N 2.66Å; F102-T191 CarbonylContact C-O 3.47Å; F102-T191 CarbonylContact O-C 3.59Å; F102-H192 AromaticContact CE2-CE1 3.89Å; F102-H192 AromaticContact CE2-ND1 3.89Å; F102-P193 WeakPolarHBondContact O-CD 3.4Å; F102-Y264 HydrophobicContact CD2-CG 4.48Å; F102-Y264 AromaticContact CE2-CD1 3.66Å; F102-Y264 HydrophobicContact CE2-CD1 3.66Å; F102-Y264 AromaticContact CE2-CD2 3.56Å; F102-Y264 HydrophobicContact CE2-CD2 3.56Å; F102-Y264 AromaticContact CE2-CE1 3.79Å; F102-Y264 HydrophobicContact CE2-CE1 3.79Å; F102-Y264 AromaticContact CE2-CE2 3.6Å; F102-Y264 HydrophobicContact CE2-CE2 3.6Å; F102-Y264 AromaticContact CE2-CG 3.56Å; F102-Y264 HydrophobicContact CE2-CG 3.56Å; F102-Y264 AromaticContact CE2-CZ 3.7Å; F102-Y264 HydrophobicContact CZ-CD1 4.4Å; F102-Y264 AromaticContact CZ-CD2 3.9Å; F102-Y264 HydrophobicContact CZ-CD2 3.9Å; F102-Y264 HydrophobicContact CZ-CE1 4.12Å; F102-Y264 AromaticContact CZ-CE2 3.47Å; F102-Y264 HydrophobicContact CZ-CE2 3.47Å; F102-Y264 VanDerWaalsContact CZ-CE2 3.47Å; F102-Y264 HydrophobicContact CZ-CG 4.32Å; F102-Y264 AromaticContact CZ-CZ 3.59Å; F102-I365 WeakPolarHBondContact CA-O 3.49Å; F102-I365 HydrophobicContact CB-CB 4.31Å; F102-I365 HydrophobicContact CB-CG2 4.04Å; F102-I365 WeakPolarHBondContact CB-O 3.32Å; F102-I365 HydrophobicContact CD1-CB 4.08Å; F102-I365 HydrophobicContact CD1-CG2 3.84Å; F102-I365 HydrophobicContact CG-CG2 4.34Å; F102-I365 PolarHBondContact N-O 3.19Å
103	V	88	Confident	84.5	Confident	0 Å²	0	37.8 Å²	37.8	0%	0	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.3	142.6	179.6	173.7	0	0	0	0	109.6	F105 L108 W116 T191 Y364 I365	V103-F105 HydrophobicContact CG1-CD1 4.21Å; V103-F105 HydrophobicContact CG1-CD2 4.47Å; V103-F105 HydrophobicContact CG1-CE1 4.04Å; V103-F105 HydrophobicContact CG1-CE2 4.31Å; V103-F105 HydrophobicContact CG1-CG 4.43Å; V103-F105 HydrophobicContact CG1-CZ 4.12Å; V103-L108 HydrophobicContact CG1-CD2 4.48Å; V103-W116 HydrophobicContact CB-CZ2 4.34Å; V103-W116 HydrophobicContact CG1-CZ2 4.02Å; V103-W116 HydrophobicContact CG2-CZ2 4.03Å; V103-T191 HydrophobicContact CG2-CG2 4.31Å; V103-T191 VanDerWaalsContact CG2-O 3.29Å; V103-T191 WeakPolarHBondContact CG2-O 3.16Å; V103-Y364 CarbonylContact O-C 3.55Å; V103-Y364 VanDerWaalsContact O-CA 3.23Å; V103-Y364 WeakPolarHBondContact O-CA 3.41Å; V103-Y364 WeakPolarHBondContact O-CB 3.21Å; V103-I365 PolarHBondContact N-O 2.95Å; V103-I365 PolarHBondContact O-N 2.99Å
104	R	89.1	Confident	85.6	Confident	3 Å²	3	38 Å²	38	1%	0.011	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	105.2	168.3	-62.6	-165.3	64.2	121	2.5	109.9	Y101 F107 L108	Y101-R104 HydrophobicContact CD1-CG 4.06Å; Y101-R104 HydrophobicContact CD2-CG 4.47Å; Y101-R104 HydrophobicContact CG-CG 3.89Å; Y101-R104 PolarHBondContact OH-NH1 3.31Å; Y101-R104 VanDerWaalsContact OH-NH1 3.14Å; R104-F107 HydrophobicContact CB-CD2 3.99Å; R104-F107 PolarHBondContact O-N 2.81Å; R104-L108 PolarHBondContact O-N 2.75Å
105	F	91.2	Very high	86.1	Confident	0 Å²	0	36 Å²	36	0%	0	19%	0.185	C	C	.	.	G	3₁₀ helix	trans	-61.1	-40.3	-175.2	-65.4	-76.8	0	0	0	114.4	V103 F107 L108 F113 W116 F133 R135 G224 L362 D363 I365	V103-F105 HydrophobicContact CG1-CD1 4.21Å; V103-F105 HydrophobicContact CG1-CD2 4.47Å; V103-F105 HydrophobicContact CG1-CE1 4.04Å; V103-F105 HydrophobicContact CG1-CE2 4.31Å; V103-F105 HydrophobicContact CG1-CG 4.43Å; V103-F105 HydrophobicContact CG1-CZ 4.12Å; F105-F107 PolarHBondContact O-N 2.9Å; F105-L108 PolarHBondContact O-N 2.87Å; F105-F113 HydrophobicContact CD1-CD2 4.33Å; F105-F113 HydrophobicContact CD1-CE2 4.2Å; F105-W116 HydrophobicContact CE1-CD2 4.06Å; F105-W116 AromaticContact CE1-CE2 3.54Å; F105-W116 HydrophobicContact CE1-CE3 4.48Å; F105-W116 HydrophobicContact CE1-CH2 4.01Å; F105-W116 AromaticContact CE1-CZ2 3.52Å; F105-W116 HydrophobicContact CE1-CZ2 3.52Å; F105-W116 HydrophobicContact CE1-CZ3 4.46Å; F105-W116 AromaticContact CE1-NE1 3.9Å; F105-W116 HydrophobicContact CZ-CD2 4.49Å; F105-W116 AromaticContact CZ-CE2 3.96Å; F105-W116 AromaticContact CZ-CH2 3.53Å; F105-W116 HydrophobicContact CZ-CH2 3.53Å; F105-W116 AromaticContact CZ-CZ2 3.45Å; F105-W116 HydrophobicContact CZ-CZ2 3.45Å; F105-W116 VanDerWaalsContact CZ-CZ2 3.45Å; F105-W116 HydrophobicContact CZ-CZ3 4.09Å; F105-F133 HydrophobicContact CD1-CE1 4.2Å; F105-F133 AromaticContact CD1-CZ 3.75Å; F105-F133 HydrophobicContact CD1-CZ 3.75Å; F105-F133 AromaticContact CE1-CE1 3.85Å; F105-F133 HydrophobicContact CE1-CE1 3.85Å; F105-F133 AromaticContact CE1-CZ 3.4Å; F105-F133 HydrophobicContact CE1-CZ 3.4Å; F105-F133 HydrophobicContact CZ-CZ 4.05Å; F105-R135 PolarHBondContact O-NH1 2.71Å; F105-G224 CarbonylContact C-O 3.56Å; F105-G224 VanDerWaalsContact C-O 3.29Å; F105-L362 HydrophobicContact CD2-CB 3.62Å; F105-L362 WeakPolarHBondContact CD2-O 3.38Å; F105-L362 HydrophobicContact CE2-CB 3.42Å; F105-L362 VanDerWaalsContact CE2-CB 3.42Å; F105-L362 HydrophobicContact CE2-CD1 3.88Å; F105-L362 HydrophobicContact CE2-CG 4.29Å; F105-L362 HydrophobicContact CZ-CB 4.24Å; F105-L362 HydrophobicContact CZ-CD1 3.97Å; F105-D363 WeakPolarHBondContact CD2-O 3.21Å; F105-D363 PolarHBondContact N-O 2.92Å; F105-I365 HydrophobicContact CE2-CD1 4.17Å; F105-I365 HydrophobicContact CE2-CG1 4.29Å; F105-I365 HydrophobicContact CZ-CD1 4.29Å
106	P	89	Confident	86.7	Confident	0 Å²	0	33.8 Å²	33.8	0%	0	17%	0.173	C	C	.	.	G	3₁₀ helix	trans	-54.1	-26.6	176.8	-33.1	39.2	0	0	0	115.8	T216 F222 K223 G224 Y225 D363	P106-T216 HydrophobicContact CB-CG2 4.1Å; P106-T216 HydrophobicContact CG-CG2 3.92Å; P106-F222 HydrophobicContact CB-CD2 3.68Å; P106-F222 HydrophobicContact CB-CE2 3.76Å; P106-F222 HydrophobicContact CG-CD2 4.44Å; P106-F222 HydrophobicContact CG-CE2 4.08Å; P106-K223 PolarHBondContact O-N 2.78Å; P106-G224 VanDerWaalsContact CA-O 3.22Å; P106-G224 WeakPolarHBondContact CA-O 3.25Å; P106-Y225 HydrophobicContact CG-CD1 3.69Å; P106-Y225 HydrophobicContact CG-CE1 3.88Å; P106-D363 WeakPolarHBondContact CD-O 3.39Å; P106-D363 WeakPolarHBondContact CD-OD1 3.3Å; P106-D363 WeakPolarHBondContact CG-OD1 3.4Å
107	F	86.9	Confident	87.2	Confident	1 Å²	1	34.9 Å²	34.9	0%	0.004	18%	0.18	C	C	.	.	G	3₁₀ helix	trans	-113.4	-0.1	-171.5	-56.8	-55.8	0	0	0	113	R104 F105 N183 H186 F188 D219	R104-F107 HydrophobicContact CB-CD2 3.99Å; R104-F107 PolarHBondContact O-N 2.81Å; F105-F107 PolarHBondContact O-N 2.9Å; F107-N183 PolarHBondContact O-ND2 2.75Å; F107-H186 AromaticContact CD1-CE1 3.5Å; F107-H186 VanDerWaalsContact CD1-CE1 3.5Å; F107-H186 WeakPolarHBondContact CD1-CE1 3.46Å; F107-H186 AromaticContact CG-CE1 3.44Å; F107-H186 VanDerWaalsContact CG-CE1 3.44Å; F107-H186 WeakPolarHBondContact CG-CE1 3.38Å; F107-F188 HydrophobicContact CB-CB 4.02Å; F107-F188 HydrophobicContact CD2-CB 3.94Å; F107-F188 HydrophobicContact CD2-CD2 4.28Å; F107-F188 HydrophobicContact CD2-CG 4.4Å; F107-F188 HydrophobicContact CE2-CD2 4.45Å; F107-F188 HydrophobicContact CG-CB 4.26Å; F107-D219 HydrophobicContact CE1-CB 3.81Å; F107-D219 WeakPolarHBondContact CE1-OD2 3.5Å; F107-D219 HydrophobicContact CZ-CB 4.1Å
108	L	85.5	Confident	87.8	Confident	0 Å²	0	35.3 Å²	35.3	0%	0	18%	0.182	C	C	.	.			trans	-72.2	138	-175.9	-164.3	65.3	0	0	0	111	V103 R104 F105 E112 F113 R135 T191 K223	V103-L108 HydrophobicContact CG1-CD2 4.48Å; R104-L108 PolarHBondContact O-N 2.75Å; F105-L108 PolarHBondContact O-N 2.87Å; L108-E112 HydrophobicContact CD1-CB 3.63Å; L108-E112 HydrophobicContact CD1-CG 4.35Å; L108-E112 WeakPolarHBondContact CD1-OE2 3.24Å; L108-E112 HydrophobicContact CD2-CB 4.09Å; L108-E112 HydrophobicContact CG-CB 3.66Å; L108-F113 HydrophobicContact CD2-CB 4.04Å; L108-F113 HydrophobicContact CD2-CD2 4.28Å; L108-F113 HydrophobicContact CG-CB 4.49Å; L108-R135 PolarHBondContact O-NH2 2.94Å; L108-T191 HydrophobicContact CD1-CG2 3.52Å; L108-T191 HydrophobicContact CD2-CG2 4.07Å; L108-T191 HydrophobicContact CG-CG2 4.4Å; L108-K223 VanDerWaalsContact O-CD 3.32Å; L108-K223 WeakPolarHBondContact O-CD 3.36Å
109	T	84.2	Confident	88.3	Confident	10 Å²	10	34 Å²	34	6%	0.061	18%	0.179	C	C	.	.			trans	-61.8	159.3	173.5	61.9	0	0	0	0	111.4	E111 E112 F113 R135 P182 N183	T109-E111 VanDerWaalsContact C-N 3.29Å; T109-E111 PolarHBondContact O-N 3.1Å; T109-E112 PolarHBondContact N-OE2 2.96Å; T109-E112 PolarHBondContact O-N 2.97Å; T109-E112 VanDerWaalsContact OG1-CB 3.29Å; T109-E112 WeakPolarHBondContact OG1-CB 3.28Å; T109-E112 VanDerWaalsContact OG1-CD 3.28Å; T109-E112 WeakPolarHBondContact OG1-CG 3.31Å; T109-E112 PolarHBondContact OG1-N 3.07Å; T109-E112 PolarHBondContact OG1-OE2 3.31Å; T109-F113 VanDerWaalsContact O-CB 3.3Å; T109-F113 WeakPolarHBondContact O-CB 3.47Å; T109-F113 PolarHBondContact O-N 2.87Å; T109-R135 PolarHBondContact O-NH2 3.08Å; T109-R135 VanDerWaalsContact O-NH2 3.16Å; T109-P182 HydrophobicContact CG2-CG 4.16Å; T109-N183 HydrophobicContact CG2-CB 3.74Å; T109-N183 WeakPolarHBondContact CG2-ND2 3.36Å
110	D	85.3	Confident	88.8	Confident	89 Å²	89	34.1 Å²	34.1	48%	0.476	18%	0.18	S	C	.	.	H	α-helix	trans	-70.4	-31.1	179.8	-57.3	-51.5	0	0	0	111.7	S114 R135 K223	D110-S114 WeakPolarHBondContact O-CB 3.46Å; D110-S114 PolarHBondContact O-N 2.76Å; D110-S114 PolarHBondContact O-OG 3.34Å; D110-R135 IonicContact OD1-CZ 3.61Å; D110-R135 IonicContact OD1-NE 3.63Å; D110-R135 PolarHBondContact OD1-NE 3.22Å; D110-R135 IonicContact OD1-NH2 3.21Å; D110-R135 PolarHBondContact OD1-NH2 2.94Å; D110-K223 IonicContact OD1-NZ 2.76Å; D110-K223 IonicContact OD2-NZ 2.9Å; D110-K223 PolarHBondContact OD2-NZ 3.38Å
111	E	81.9	Confident	89.2	Confident	156 Å²	156	33.2 Å²	33.2	73%	0.729	18%	0.176	S	C	*	.	H	α-helix	trans	-62.8	-49.3	171.9	-62.1	-173.6	172	0	0	111.2	T109 S114 N115	T109-E111 VanDerWaalsContact C-N 3.29Å; T109-E111 PolarHBondContact O-N 3.1Å; E111-S114 PolarHBondContact O-N 2.85Å; E111-S114 PolarHBondContact O-OG 2.8Å; E111-N115 PolarHBondContact O-N 3.09Å
112	E	83.8	Confident	89.5	Confident	25 Å²	25	34.6 Å²	34.6	12%	0.117	19%	0.191	C	C	.	.	H	α-helix	trans	-69.3	-35.6	178.7	-71.3	172	129.7	0	0	113.5	L108 T109 S114 N115 Y190 T191	L108-E112 HydrophobicContact CD1-CB 3.63Å; L108-E112 HydrophobicContact CD1-CG 4.35Å; L108-E112 WeakPolarHBondContact CD1-OE2 3.24Å; L108-E112 HydrophobicContact CD2-CB 4.09Å; L108-E112 HydrophobicContact CG-CB 3.66Å; T109-E112 PolarHBondContact N-OE2 2.96Å; T109-E112 PolarHBondContact O-N 2.97Å; T109-E112 VanDerWaalsContact OG1-CB 3.29Å; T109-E112 WeakPolarHBondContact OG1-CB 3.28Å; T109-E112 VanDerWaalsContact OG1-CD 3.28Å; T109-E112 WeakPolarHBondContact OG1-CG 3.31Å; T109-E112 PolarHBondContact OG1-N 3.07Å; T109-E112 PolarHBondContact OG1-OE2 3.31Å; E112-S114 VanDerWaalsContact C-N 3.27Å; E112-S114 PolarHBondContact O-N 2.83Å; E112-N115 WeakPolarHBondContact O-CB 3.28Å; E112-N115 PolarHBondContact O-N 3.2Å; E112-N115 VanDerWaalsContact O-N 3.17Å; E112-Y190 WeakPolarHBondContact OE1-CA 3.31Å; E112-Y190 WeakPolarHBondContact OE1-CB 3.4Å; E112-Y190 VanDerWaalsContact OE1-CD1 3.28Å; E112-Y190 WeakPolarHBondContact OE1-CD1 3.38Å; E112-Y190 WeakPolarHBondContact OE2-CA 2.98Å; E112-T191 HydrophobicContact CB-CG2 4.16Å; E112-T191 PolarHBondContact OE1-N 2.78Å; E112-T191 VanDerWaalsContact OE1-N 3.16Å
113	F	89.6	Confident	89.8	Confident	20 Å²	20	37.8 Å²	37.8	9%	0.088	21%	0.214	C	C	.	.	H	α-helix	trans	-61.1	-40.7	172.6	-171.7	-90.6	0	0	0	110.5	F105 L108 T109 N115 W116 F133 V134 R135	F105-F113 HydrophobicContact CD1-CD2 4.33Å; F105-F113 HydrophobicContact CD1-CE2 4.2Å; L108-F113 HydrophobicContact CD2-CB 4.04Å; L108-F113 HydrophobicContact CD2-CD2 4.28Å; L108-F113 HydrophobicContact CG-CB 4.49Å; T109-F113 VanDerWaalsContact O-CB 3.3Å; T109-F113 WeakPolarHBondContact O-CB 3.47Å; T109-F113 PolarHBondContact O-N 2.87Å; F113-N115 PolarHBondContact O-N 3.01Å; F113-W116 WeakPolarHBondContact O-CB 3.28Å; F113-W116 PolarHBondContact O-N 3.02Å; F113-F133 HydrophobicContact CD1-CD1 4.5Å; F113-F133 AromaticContact CD2-CE1 3.85Å; F113-F133 HydrophobicContact CD2-CE1 3.85Å; F113-F133 AromaticContact CE1-CD1 3.81Å; F113-F133 HydrophobicContact CE1-CD1 3.81Å; F113-F133 HydrophobicContact CE1-CE1 4.07Å; F113-F133 WeakPolarHBondContact CE1-O 3.35Å; F113-F133 AromaticContact CE2-CD1 3.83Å; F113-F133 HydrophobicContact CE2-CD1 3.83Å; F113-F133 AromaticContact CE2-CE1 3.21Å; F113-F133 HydrophobicContact CE2-CE1 3.21Å; F113-F133 AromaticContact CE2-CZ 3.66Å; F113-F133 HydrophobicContact CE2-CZ 3.66Å; F113-F133 AromaticContact CZ-CD1 3.41Å; F113-F133 HydrophobicContact CZ-CD1 3.41Å; F113-F133 VanDerWaalsContact CZ-CD1 3.41Å; F113-F133 AromaticContact CZ-CE1 3.32Å; F113-F133 HydrophobicContact CZ-CE1 3.32Å; F113-F133 HydrophobicContact CZ-CE2 4.48Å; F113-F133 HydrophobicContact CZ-CG 4.06Å; F113-F133 AromaticContact CZ-CZ 3.9Å; F113-F133 HydrophobicContact CZ-CZ 3.9Å; F113-V134 WeakPolarHBondContact CZ-O 3.47Å; F113-R135 VanDerWaalsContact CB-NH2 3.33Å; F113-R135 HydrophobicContact CD1-CG 4.25Å; F113-R135 HydrophobicContact CD2-CG 4.31Å; F113-R135 HydrophobicContact CE1-CG 3.91Å; F113-R135 HydrophobicContact CE2-CG 3.97Å; F113-R135 HydrophobicContact CG-CG 4.45Å; F113-R135 HydrophobicContact CZ-CG 3.78Å
114	S	89.6	Confident	89.9	Confident	86 Å²	86	43 Å²	43	60%	0.601	24%	0.238	S	C	*	.	H	α-helix	trans	-67.6	-16.6	176.2	78.5	0	0	0	0	114.6	D110 E111 E112 W116	D110-S114 WeakPolarHBondContact O-CB 3.46Å; D110-S114 PolarHBondContact O-N 2.76Å; D110-S114 PolarHBondContact O-OG 3.34Å; E111-S114 PolarHBondContact O-N 2.85Å; E111-S114 PolarHBondContact O-OG 2.8Å; E112-S114 VanDerWaalsContact C-N 3.27Å; E112-S114 PolarHBondContact O-N 2.83Å; S114-W116 VanDerWaalsContact C-N 3.27Å; S114-W116 PolarHBondContact O-N 2.86Å
115	N	90.3	Very high	90	Very high	95 Å²	95	45.3 Å²	45.3	51%	0.508	26%	0.263	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.1	-11.7	175.5	-65.4	-29.9	0	0	0	113	E111 E112 F113 L117 P253	E111-N115 PolarHBondContact O-N 3.09Å; E112-N115 WeakPolarHBondContact O-CB 3.28Å; E112-N115 PolarHBondContact O-N 3.2Å; E112-N115 VanDerWaalsContact O-N 3.17Å; F113-N115 PolarHBondContact O-N 3.01Å; N115-L117 PolarHBondContact O-N 2.76Å; N115-P253 HydrophobicContact CB-CB 3.89Å; N115-P253 HydrophobicContact CB-CG 4.46Å
116	W	93.9	Very high	90	Very high	13 Å²	13	48.9 Å²	48.9	5%	0.049	28%	0.28	C	S	.	.	S	Bend	trans	-70.3	123	169.8	-75.4	74.8	0	0	0	109.4	V103 F105 F113 S114 F133 L250 I365	V103-W116 HydrophobicContact CB-CZ2 4.34Å; V103-W116 HydrophobicContact CG1-CZ2 4.02Å; V103-W116 HydrophobicContact CG2-CZ2 4.03Å; F105-W116 HydrophobicContact CE1-CD2 4.06Å; F105-W116 AromaticContact CE1-CE2 3.54Å; F105-W116 HydrophobicContact CE1-CE3 4.48Å; F105-W116 HydrophobicContact CE1-CH2 4.01Å; F105-W116 AromaticContact CE1-CZ2 3.52Å; F105-W116 HydrophobicContact CE1-CZ2 3.52Å; F105-W116 HydrophobicContact CE1-CZ3 4.46Å; F105-W116 AromaticContact CE1-NE1 3.9Å; F105-W116 HydrophobicContact CZ-CD2 4.49Å; F105-W116 AromaticContact CZ-CE2 3.96Å; F105-W116 AromaticContact CZ-CH2 3.53Å; F105-W116 HydrophobicContact CZ-CH2 3.53Å; F105-W116 AromaticContact CZ-CZ2 3.45Å; F105-W116 HydrophobicContact CZ-CZ2 3.45Å; F105-W116 VanDerWaalsContact CZ-CZ2 3.45Å; F105-W116 HydrophobicContact CZ-CZ3 4.09Å; F113-W116 WeakPolarHBondContact O-CB 3.28Å; F113-W116 PolarHBondContact O-N 3.02Å; S114-W116 VanDerWaalsContact C-N 3.27Å; S114-W116 PolarHBondContact O-N 2.86Å; W116-F133 HydrophobicContact CB-CD1 3.74Å; W116-F133 HydrophobicContact CB-CE1 3.87Å; W116-F133 HydrophobicContact CD2-CE1 4.14Å; W116-F133 HydrophobicContact CG-CD1 4.23Å; W116-F133 AromaticContact CG-CE1 3.84Å; W116-F133 HydrophobicContact CG-CE1 3.84Å; W116-L250 HydrophobicContact CB-CD1 4.26Å; W116-L250 HydrophobicContact CE3-CD1 3.8Å; W116-L250 HydrophobicContact CE3-CD2 4.13Å; W116-L250 HydrophobicContact CE3-CG 3.82Å; W116-L250 HydrophobicContact CZ3-CD2 4.22Å; W116-L250 HydrophobicContact CZ3-CG 4.15Å; W116-I365 HydrophobicContact CH2-CD1 3.98Å
117	L	94	Very high	90.1	Very high	86 Å²	86	49.2 Å²	49.2	45%	0.45	28%	0.283	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.7	126.6	-174.2	-176.4	71.2	0	0	0	109.8	N115 T119 R251	N115-L117 PolarHBondContact O-N 2.76Å; L117-T119 HydrophobicContact CD2-CG2 3.87Å; L117-T119 HydrophobicContact CG-CG2 4Å; L117-R251 HydrophobicContact CB-CB 4.43Å; L117-R251 PolarHBondContact N-O 2.81Å; L117-R251 PolarHBondContact O-N 2.77Å
118	V	96.1	Very high	90.5	Very high	38 Å²	38	54.8 Å²	54.8	23%	0.23	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.1	130.1	168.6	-179.3	0	0	0	0	108.9	A131 F133 F228 N249 L250	V118-A131 HydrophobicContact CG1-CB 3.68Å; V118-F133 HydrophobicContact CG2-CB 3.52Å; V118-F228 HydrophobicContact CG1-CE2 4.1Å; V118-F228 HydrophobicContact CG2-CE2 4.5Å; V118-N249 CarbonylContact C-O 3.55Å; V118-N249 WeakPolarHBondContact CA-O 3.4Å; V118-L250 HydrophobicContact CG2-CD1 3.87Å
119	T	95.1	Very high	91	Very high	19 Å²	19	54.9 Å²	54.9	12%	0.117	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	135.9	174.2	56.6	0	0	0	0	109.4	L117 N249	L117-T119 HydrophobicContact CD2-CG2 3.87Å; L117-T119 HydrophobicContact CG-CG2 4Å; T119-N249 PolarHBondContact N-O 3.46Å; T119-N249 PolarHBondContact O-N 3.22Å; T119-N249 WeakPolarHBondContact OG1-CB 3.5Å
120	T	95.4	Very high	91.4	Very high	14 Å²	14	56.8 Å²	56.8	9%	0.086	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	170	176.4	60.8	0	0	0	0	110.9	S122 S123 H124 S129 A131 F247 A248	T120-S122 PolarHBondContact O-N 3.38Å; T120-S122 PolarHBondContact OG1-N 3.24Å; T120-S123 PolarHBondContact N-OG 3.21Å; T120-S123 PolarHBondContact O-N 2.93Å; T120-S123 PolarHBondContact O-OG 3.49Å; T120-S123 PolarHBondContact OG1-N 3.04Å; T120-H124 PolarHBondContact O-ND1 3.04Å; T120-S129 PolarHBondContact OG1-O 3.38Å; T120-A131 HydrophobicContact CG2-CB 3.49Å; T120-A131 VanDerWaalsContact CG2-CB 3.49Å; T120-F247 WeakPolarHBondContact CA-O 3.44Å; T120-A248 HydrophobicContact CG2-CB 3.99Å
121	D	93.8	Very high	91.9	Very high	0 Å²	0	53.2 Å²	53.2	0%	0	30%	0.295	C	S	.	.	T	Hydrogen-bonded Turn	trans	-54.3	-39.6	167.7	56.7	5.2	0	0	0	112.7	S123 H124 G125 E126 S129 G246 F247	D121-S123 VanDerWaalsContact C-N 3.3Å; D121-S123 PolarHBondContact O-N 2.88Å; D121-H124 CarbonylContact O-C 3.53Å; D121-H124 PolarHBondContact O-N 3.23Å; D121-G125 PolarHBondContact O-N 3.04Å; D121-G125 VanDerWaalsContact O-N 3.13Å; D121-E126 HydrophobicContact CB-CB 4.31Å; D121-E126 PolarHBondContact O-N 3.22Å; D121-S129 VanDerWaalsContact OD1-CA 3.28Å; D121-S129 WeakPolarHBondContact OD1-CA 3.31Å; D121-S129 WeakPolarHBondContact OD1-CB 3.31Å; D121-S129 PolarHBondContact OD1-N 2.83Å; D121-S129 PolarHBondContact OD1-OG 3.37Å; D121-S129 WeakPolarHBondContact OD2-CB 3.24Å; D121-S129 PolarHBondContact OD2-OG 3.13Å; D121-G246 WeakPolarHBondContact OD2-CA 3.32Å; D121-G246 PolarHBondContact OD2-N 2.98Å; D121-F247 HydrophobicContact CB-CD1 3.73Å; D121-F247 HydrophobicContact CB-CE1 3.55Å; D121-F247 HydrophobicContact CB-CG 4.45Å; D121-F247 HydrophobicContact CB-CZ 4.14Å; D121-F247 PolarHBondContact N-O 3.16Å
122	S	92.1	Very high	92.5	Very high	62 Å²	62	48 Å²	48	43%	0.434	27%	0.27	S	S	.	.	G	3₁₀ helix	trans	-63.2	-35.1	179.8	-173.9	0	0	0	0	112.3	T120 H124 G125 G127 S129	T120-S122 PolarHBondContact O-N 3.38Å; T120-S122 PolarHBondContact OG1-N 3.24Å; S122-H124 PolarHBondContact O-N 2.77Å; S122-G125 PolarHBondContact O-N 2.61Å; S122-G127 VanDerWaalsContact CA-O 3.28Å; S122-G127 WeakPolarHBondContact CA-O 3.41Å; S122-G127 WeakPolarHBondContact CB-O 3.37Å; S122-S129 VanDerWaalsContact CB-O 3.24Å; S122-S129 WeakPolarHBondContact CB-O 3.28Å
123	S	91.4	Very high	93	Very high	76 Å²	76	48.1 Å²	48.1	53%	0.531	27%	0.27	S	S	.	.	G	3₁₀ helix	trans	-65.1	-20.1	174.6	68.3	0	0	0	0	113.9	T120 D121	T120-S123 PolarHBondContact N-OG 3.21Å; T120-S123 PolarHBondContact O-N 2.93Å; T120-S123 PolarHBondContact O-OG 3.49Å; T120-S123 PolarHBondContact OG1-N 3.04Å; D121-S123 VanDerWaalsContact C-N 3.3Å; D121-S123 PolarHBondContact O-N 2.88Å
124	H	90.2	Very high	93.1	Very high	109 Å²	109	49.5 Å²	49.5	51%	0.505	28%	0.281	S	S	.	.	G	3₁₀ helix	trans	-101.8	-1.8	175.5	-60.3	86.6	0	0	0	112.6	T120 D121 S122 E126	T120-H124 PolarHBondContact O-ND1 3.04Å; D121-H124 CarbonylContact O-C 3.53Å; D121-H124 PolarHBondContact O-N 3.23Å; S122-H124 PolarHBondContact O-N 2.77Å; H124-E126 VanDerWaalsContact C-N 3.26Å; H124-E126 HydrophobicContact CB-CB 4.49Å; H124-E126 HydrophobicContact CB-CG 3.89Å
125	G	90.1	Very high	93.2	Very high	53 Å²	53	47.8 Å²	47.8	55%	0.546	26%	0.261	S	S	.	.	T	Hydrogen-bonded Turn	trans	71.3	19.8	-173.4	0	0	0	0	0	113.8	D121 S122	D121-G125 PolarHBondContact O-N 3.04Å; D121-G125 VanDerWaalsContact O-N 3.13Å; S122-G125 PolarHBondContact O-N 2.61Å
126	E	91	Very high	93.1	Very high	75 Å²	75	43.6 Å²	43.6	35%	0.35	24%	0.239	S	C	.	.	S	Bend	trans	-100.7	-4.6	-175	-62.7	179.7	163.8	0	0	113.1	D121 H124 P237 L242 A245	D121-E126 HydrophobicContact CB-CB 4.31Å; D121-E126 PolarHBondContact O-N 3.22Å; H124-E126 VanDerWaalsContact C-N 3.26Å; H124-E126 HydrophobicContact CB-CB 4.49Å; H124-E126 HydrophobicContact CB-CG 3.89Å; E126-P237 VanDerWaalsContact O-CD 3.31Å; E126-P237 WeakPolarHBondContact O-CD 3.43Å; E126-L242 HydrophobicContact CB-CD1 3.88Å; E126-L242 HydrophobicContact CB-CD2 4.48Å; E126-L242 HydrophobicContact CG-CD1 4.09Å; E126-L242 HydrophobicContact CG-CD2 4.42Å; E126-A245 WeakPolarHBondContact O-CB 3.33Å
127	G	92.9	Very high	92.8	Very high	6 Å²	6	47 Å²	47	6%	0.062	26%	0.263	C	S	.	.			trans	-176	-167.7	-179.1	0	0	0	0	0	113.7	S122	S122-G127 VanDerWaalsContact CA-O 3.28Å; S122-G127 WeakPolarHBondContact CA-O 3.41Å; S122-G127 WeakPolarHBondContact CB-O 3.37Å
128	Y	94.1	Very high	92.2	Very high	118 Å²	118	48.1 Å²	48.1	46%	0.463	26%	0.261	S	S	.	.			trans	-122.2	18	-175.7	-59.1	-79	0	0	0	112.9	R235	Y128-R235 HydrophobicContact CD2-CB 3.85Å; Y128-R235 WeakPolarHBondContact CD2-O 3.49Å; Y128-R235 HydrophobicContact CE2-CB 4.41Å
129	S	95.5	Very high	91.1	Very high	2 Å²	2	51.8 Å²	51.8	1%	0.014	29%	0.288	C	S	.	.			trans	-75.6	144.6	177.1	-47.8	0	0	0	0	111.1	T120 D121 S122 F231 S233 G246	T120-S129 PolarHBondContact OG1-O 3.38Å; D121-S129 VanDerWaalsContact OD1-CA 3.28Å; D121-S129 WeakPolarHBondContact OD1-CA 3.31Å; D121-S129 WeakPolarHBondContact OD1-CB 3.31Å; D121-S129 PolarHBondContact OD1-N 2.83Å; D121-S129 PolarHBondContact OD1-OG 3.37Å; D121-S129 WeakPolarHBondContact OD2-CB 3.24Å; D121-S129 PolarHBondContact OD2-OG 3.13Å; S122-S129 VanDerWaalsContact CB-O 3.24Å; S122-S129 WeakPolarHBondContact CB-O 3.28Å; S129-F231 WeakPolarHBondContact CA-O 3.17Å; S129-F231 WeakPolarHBondContact CB-O 3.44Å; S129-S233 PolarHBondContact OG-N 3.49Å; S129-S233 PolarHBondContact OG-O 3.24Å; S129-G246 WeakPolarHBondContact OG-CA 3.27Å
130	W	93.9	Very high	90	Very high	51 Å²	51	51.7 Å²	51.7	19%	0.193	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	141.7	178.7	171.9	82.2	0	0	0	109.7	E132 Y154 P155 G230 F231	W130-E132 HydrophobicContact CH2-CB 4.4Å; W130-E132 HydrophobicContact CH2-CG 3.55Å; W130-E132 HydrophobicContact CZ2-CB 3.96Å; W130-E132 HydrophobicContact CZ2-CG 3.57Å; W130-E132 WeakPolarHBondContact CZ2-OE2 3.41Å; W130-E132 HydrophobicContact CZ3-CG 4.46Å; W130-Y154 HydrophobicContact CB-CD1 4.46Å; W130-Y154 HydrophobicContact CB-CE1 4.24Å; W130-P155 HydrophobicContact CZ2-CG 4Å; W130-G230 CarbonylContact O-C 3.55Å; W130-G230 WeakPolarHBondContact O-CA 3.35Å; W130-F231 PolarHBondContact N-O 3.45Å; W130-F231 PolarHBondContact O-N 3.4Å
131	A	94.4	Very high	88.3	Confident	14 Å²	14	54.5 Å²	54.5	12%	0.116	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.9	150	178.5	0	0	0	0	0	110.7	V118 T120 F228 R229 A248 F358	V118-A131 HydrophobicContact CG1-CB 3.68Å; T120-A131 HydrophobicContact CG2-CB 3.49Å; T120-A131 VanDerWaalsContact CG2-CB 3.49Å; A131-F228 HydrophobicContact CB-CE2 3.93Å; A131-F228 HydrophobicContact CB-CZ 4.5Å; A131-R229 WeakPolarHBondContact CA-O 3.39Å; A131-A248 HydrophobicContact CB-CB 3.76Å; A131-F358 HydrophobicContact CB-CE1 4.46Å; A131-F358 HydrophobicContact CB-CZ 3.7Å
132	E	94.4	Very high	86.7	Confident	47 Å²	47	54.7 Å²	54.7	22%	0.22	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.6	160.8	173.9	63.1	175.8	-170.4	0	0	111.3	W130 V134 R229	W130-E132 HydrophobicContact CH2-CB 4.4Å; W130-E132 HydrophobicContact CH2-CG 3.55Å; W130-E132 HydrophobicContact CZ2-CB 3.96Å; W130-E132 HydrophobicContact CZ2-CG 3.57Å; W130-E132 WeakPolarHBondContact CZ2-OE2 3.41Å; W130-E132 HydrophobicContact CZ3-CG 4.46Å; E132-V134 HydrophobicContact CB-CG2 4.23Å; E132-V134 VanDerWaalsContact CD-CG2 3.41Å; E132-V134 HydrophobicContact CG-CG2 3.75Å; E132-V134 WeakPolarHBondContact OE1-CG2 3.49Å; E132-R229 HydrophobicContact CG-CG 3.94Å; E132-R229 PolarHBondContact N-O 2.78Å; E132-R229 PolarHBondContact O-N 3.27Å; E132-R229 VanDerWaalsContact O-N 3.1Å; E132-R229 IonicContact OE1-CZ 2.59Å; E132-R229 IonicContact OE1-NE 2.72Å; E132-R229 PolarHBondContact OE1-NE 2.89Å; E132-R229 IonicContact OE1-NH2 3.15Å; E132-R229 PolarHBondContact OE1-NH2 3.18Å
133	F	94.9	Very high	84.9	Confident	26 Å²	26	54 Å²	54	11%	0.114	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	106.3	174.6	-170.8	-121.7	0	0	0	108.9	F105 F113 W116 V118 H227 F228 L250	F105-F133 HydrophobicContact CD1-CE1 4.2Å; F105-F133 AromaticContact CD1-CZ 3.75Å; F105-F133 HydrophobicContact CD1-CZ 3.75Å; F105-F133 AromaticContact CE1-CE1 3.85Å; F105-F133 HydrophobicContact CE1-CE1 3.85Å; F105-F133 AromaticContact CE1-CZ 3.4Å; F105-F133 HydrophobicContact CE1-CZ 3.4Å; F105-F133 HydrophobicContact CZ-CZ 4.05Å; F113-F133 HydrophobicContact CD1-CD1 4.5Å; F113-F133 AromaticContact CD2-CE1 3.85Å; F113-F133 HydrophobicContact CD2-CE1 3.85Å; F113-F133 AromaticContact CE1-CD1 3.81Å; F113-F133 HydrophobicContact CE1-CD1 3.81Å; F113-F133 HydrophobicContact CE1-CE1 4.07Å; F113-F133 WeakPolarHBondContact CE1-O 3.35Å; F113-F133 AromaticContact CE2-CD1 3.83Å; F113-F133 HydrophobicContact CE2-CD1 3.83Å; F113-F133 AromaticContact CE2-CE1 3.21Å; F113-F133 HydrophobicContact CE2-CE1 3.21Å; F113-F133 AromaticContact CE2-CZ 3.66Å; F113-F133 HydrophobicContact CE2-CZ 3.66Å; F113-F133 AromaticContact CZ-CD1 3.41Å; F113-F133 HydrophobicContact CZ-CD1 3.41Å; F113-F133 VanDerWaalsContact CZ-CD1 3.41Å; F113-F133 AromaticContact CZ-CE1 3.32Å; F113-F133 HydrophobicContact CZ-CE1 3.32Å; F113-F133 HydrophobicContact CZ-CE2 4.48Å; F113-F133 HydrophobicContact CZ-CG 4.06Å; F113-F133 AromaticContact CZ-CZ 3.9Å; F113-F133 HydrophobicContact CZ-CZ 3.9Å; W116-F133 HydrophobicContact CB-CD1 3.74Å; W116-F133 HydrophobicContact CB-CE1 3.87Å; W116-F133 HydrophobicContact CD2-CE1 4.14Å; W116-F133 HydrophobicContact CG-CD1 4.23Å; W116-F133 AromaticContact CG-CE1 3.84Å; W116-F133 HydrophobicContact CG-CE1 3.84Å; V118-F133 HydrophobicContact CG2-CB 3.52Å; F133-H227 WeakPolarHBondContact CA-O 3.49Å; F133-F228 HydrophobicContact CD2-CB 3.98Å; F133-F228 HydrophobicContact CE2-CB 4.39Å; F133-L250 HydrophobicContact CB-CD1 3.94Å; F133-L250 HydrophobicContact CD1-CD1 4Å; F133-L250 HydrophobicContact CD2-CD1 3.81Å; F133-L250 HydrophobicContact CD2-CD2 3.77Å; F133-L250 HydrophobicContact CD2-CG 4.46Å; F133-L250 HydrophobicContact CE1-CD1 4.45Å; F133-L250 HydrophobicContact CE2-CD1 4.3Å; F133-L250 HydrophobicContact CE2-CD2 3.65Å; F133-L250 HydrophobicContact CG-CD1 3.65Å; F133-L250 HydrophobicContact CG-CD2 4.45Å; F133-L250 HydrophobicContact CZ-CD2 4.22Å
134	V	92.4	Very high	82.9	Confident	50 Å²	50	51.9 Å²	51.9	30%	0.303	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	162	-171.6	-178.3	0	0	0	0	109.3	F113 E132 H227	F113-V134 WeakPolarHBondContact CZ-O 3.47Å; E132-V134 HydrophobicContact CB-CG2 4.23Å; E132-V134 VanDerWaalsContact CD-CG2 3.41Å; E132-V134 HydrophobicContact CG-CG2 3.75Å; E132-V134 WeakPolarHBondContact OE1-CG2 3.49Å; V134-H227 PolarHBondContact N-O 3.08Å; V134-H227 WeakPolarHBondContact O-CA 3.38Å; V134-H227 VanDerWaalsContact O-CB 3.31Å; V134-H227 WeakPolarHBondContact O-CB 3.4Å; V134-H227 PolarHBondContact O-N 3.07Å
135	R	91	Very high	80.8	Confident	50 Å²	50	53 Å²	53	19%	0.189	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.2	129.2	172.6	-65.8	-173.9	-177.9	-79.8	9	110.6	F105 L108 T109 D110 F113 Y225	F105-R135 PolarHBondContact O-NH1 2.71Å; L108-R135 PolarHBondContact O-NH2 2.94Å; T109-R135 PolarHBondContact O-NH2 3.08Å; T109-R135 VanDerWaalsContact O-NH2 3.16Å; D110-R135 IonicContact OD1-CZ 3.61Å; D110-R135 IonicContact OD1-NE 3.63Å; D110-R135 PolarHBondContact OD1-NE 3.22Å; D110-R135 IonicContact OD1-NH2 3.21Å; D110-R135 PolarHBondContact OD1-NH2 2.94Å; F113-R135 VanDerWaalsContact CB-NH2 3.33Å; F113-R135 HydrophobicContact CD1-CG 4.25Å; F113-R135 HydrophobicContact CD2-CG 4.31Å; F113-R135 HydrophobicContact CE1-CG 3.91Å; F113-R135 HydrophobicContact CE2-CG 3.97Å; F113-R135 HydrophobicContact CG-CG 4.45Å; F113-R135 HydrophobicContact CZ-CG 3.78Å; R135-Y225 CarbonylContact C-O 3.46Å; R135-Y225 WeakPolarHBondContact CA-O 3.43Å
136	S	88.4	Confident	78.7	Confident	6 Å²	6	54 Å²	54	4%	0.042	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.4	144.4	169.3	71.8	0	0	0	0	112.2	G224 Y225 E361	S136-G224 CarbonylContact O-C 3.58Å; S136-G224 VanDerWaalsContact O-CA 3.23Å; S136-G224 WeakPolarHBondContact O-CA 3.25Å; S136-Y225 PolarHBondContact N-O 3.37Å; S136-Y225 PolarHBondContact O-N 3.48Å; S136-E361 VanDerWaalsContact CB-OE1 3.24Å; S136-E361 WeakPolarHBondContact CB-OE1 3.24Å; S136-E361 PolarHBondContact OG-OE1 2.72Å
137	P	87.5	Confident	76.5	Confident	86 Å²	86	53 Å²	53	56%	0.558	31%	0.305	S	S	*	.	P	Polyproline II helix	trans	-70.8	164.1	-178.6	30	-36	0	0	0	111.7	S139 A140	P137-S139 PolarHBondContact O-N 3.28Å; P137-A140 HydrophobicContact CG-CB 4.32Å; P137-A140 WeakPolarHBondContact O-CB 3.14Å; P137-A140 PolarHBondContact O-N 2.79Å; P137-A140 VanDerWaalsContact O-N 3.1Å
138	R	81.4	Confident	74	Confident	109 Å²	109	54.1 Å²	54.1	41%	0.411	32%	0.317	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.4	-36.4	178.5	-172.1	-176.1	-74.6	147.8	-4.9	112.9	A140 T216 S217 D219 F222	R138-A140 VanDerWaalsContact C-N 3.31Å; R138-A140 PolarHBondContact O-N 2.87Å; R138-T216 PolarHBondContact NE-O 2.88Å; R138-T216 PolarHBondContact NH2-O 3.16Å; R138-T216 VanDerWaalsContact NH2-O 3.15Å; R138-S217 PolarHBondContact NE-O 3.08Å; R138-S217 PolarHBondContact NH1-O 2.82Å; R138-S217 PolarHBondContact NH2-O 2.93Å; R138-D219 PolarHBondContact NH2-O 3.41Å; R138-F222 HydrophobicContact CB-CD1 4.35Å; R138-F222 HydrophobicContact CB-CE1 3.69Å; R138-F222 HydrophobicContact CB-CZ 3.85Å
139	S	74.2	Confident	71.6	Confident	114 Å²	114	57.9 Å²	57.9	80%	0.797	34%	0.344	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.9	8.8	-177.2	-167.7	0	0	0	0	113.9	P137 A141	P137-S139 PolarHBondContact O-N 3.28Å; S139-A141 PolarHBondContact O-N 3.02Å
140	A	70.9	Confident	69.3	Low	17 Å²	17	65.1 Å²	65.1	14%	0.14	38%	0.382	C	S	.	.			trans	-55.5	127.8	179.8	0	0	0	0	0	110.7	P137 R138 G142 R277 E361	P137-A140 HydrophobicContact CG-CB 4.32Å; P137-A140 WeakPolarHBondContact O-CB 3.14Å; P137-A140 PolarHBondContact O-N 2.79Å; P137-A140 VanDerWaalsContact O-N 3.1Å; R138-A140 VanDerWaalsContact C-N 3.31Å; R138-A140 PolarHBondContact O-N 2.87Å; A140-G142 PolarHBondContact O-N 3.36Å; A140-R277 PolarHBondContact O-NH1 3.21Å; A140-R277 PolarHBondContact O-NH2 3.15Å; A140-E361 WeakPolarHBondContact CB-OE1 3.37Å
141	A	60.7	Low	67.3	Low	74 Å²	74	67.9 Å²	67.9	61%	0.612	40%	0.397	S	S	*	.			trans	-68.3	-0.6	-173.5	0	0	0	0	0	114.1	S139 C143 P311	S139-A141 PolarHBondContact O-N 3.02Å; A141-C143 VanDerWaalsContact C-N 3.26Å; A141-C143 PolarHBondContact O-N 3.38Å; A141-C143 VanDerWaalsContact O-N 3.1Å; A141-P311 WeakPolarHBondContact O-CB 3.29Å
142	G	58.4	Low	65.1	Low	3 Å²	3	69.8 Å²	69.8	3%	0.031	41%	0.41	C	S	.	.	S	Bend	trans	86.3	-23.7	159.2	0	0	0	0	0	117.6	A140 R277	A140-G142 PolarHBondContact O-N 3.36Å; G142-R277 WeakPolarHBondContact O-CB 3.5Å
143	C	55	Low	63.1	Low	47 Å²	47	70.7 Å²	70.7	32%	0.318	42%	0.416	S	S	.	.	S	Bend	trans	-94.2	125.3	147.5	-51.5	0	0	0	0	103.7	A141 N145 G310	A141-C143 VanDerWaalsContact C-N 3.26Å; A141-C143 PolarHBondContact O-N 3.38Å; A141-C143 VanDerWaalsContact O-N 3.1Å; C143-N145 PolarHBondContact O-N 3.41Å; C143-G310 WeakPolarHBondContact SG-CA 3.1Å; C143-G310 PolarHBondContact SG-O 2.9Å; C143-G310 VanDerWaalsContact SG-O 3.4Å
144	A	50	Low	60.9	Low	33 Å²	33	75.4 Å²	75.4	27%	0.273	43%	0.434	S	S	.	.	P	Polyproline II helix	trans	-54.6	123.5	151.4	0	0	0	0	0	104.4	A146 S359	A144-A146 PolarHBondContact O-N 3.4Å; A144-S359 WeakPolarHBondContact CB-OG 3.4Å
145	N	46.4	Very low	58.9	Low	132 Å²	132	76.7 Å²	76.7	71%	0.706	44%	0.443	S	S	*	.	P	Polyproline II helix	trans	-46	122.2	163.6	-73.9	-17.6	0	0	0	104.7	C143 F147	C143-N145 PolarHBondContact O-N 3.41Å; N145-F147 VanDerWaalsContact C-N 3.28Å; N145-F147 PolarHBondContact O-N 2.92Å
146	A	44.5	Very low	56.7	Low	74 Å²	74	81.5 Å²	81.5	61%	0.612	47%	0.467	S	S	*	.			trans	-49.6	113.6	158.8	0	0	0	0	0	103	A144 G148 P357	A144-A146 PolarHBondContact O-N 3.4Å; A146-G148 PolarHBondContact O-N 3.14Å; A146-P357 HydrophobicContact CB-CG 3.91Å
147	F	46.6	Very low	54.2	Low	54 Å²	54	86.1 Å²	86.1	24%	0.237	50%	0.5	C	S	.	.			trans	-35.5	123	-177.1	-86.5	-85.4	0	0	0	107.5	N145 E151	N145-F147 VanDerWaalsContact C-N 3.28Å; N145-F147 PolarHBondContact O-N 2.92Å; F147-E151 HydrophobicContact CB-CB 4.38Å; F147-E151 HydrophobicContact CD1-CB 3.73Å; F147-E151 HydrophobicContact CD1-CG 3.44Å; F147-E151 VanDerWaalsContact CD1-CG 3.44Å; F147-E151 WeakPolarHBondContact CD1-OE2 3.41Å; F147-E151 HydrophobicContact CE1-CG 3.81Å
148	G	38.7	Very low	51.5	Low	30 Å²	30	86.9 Å²	86.9	31%	0.309	51%	0.513	S	S	.	.			trans	-51.9	151.1	178.9	0	0	0	0	0	108.3	A146 N150 E151	A146-G148 PolarHBondContact O-N 3.14Å; G148-N150 PolarHBondContact O-N 2.92Å; G148-E151 PolarHBondContact O-N 2.87Å
149	L	45.2	Very low	48.8	Very low	196 Å²	196	86.8 Å²	86.8	100%	1.026	53%	0.525	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.4	-14.1	-179.7	-72.6	169.5	0	0	0	113.9
150	N	45.7	Very low	46.5	Very low	154 Å²	154	88 Å²	88	82%	0.824	53%	0.528	S	S	*	.	T	Hydrogen-bonded Turn	trans	-101.8	-0.7	179.5	61.9	-28.1	0	0	0	115.5	G148	G148-N150 PolarHBondContact O-N 2.92Å
151	E	52.5	Low	44.5	Very low	109 Å²	109	92.5 Å²	92.5	51%	0.509	56%	0.558	S	S	.	*	S	Bend	trans	-103.2	130.4	-179.5	-161.4	173.9	-176.3	0	0	109.6	F147 G148 I153	F147-E151 HydrophobicContact CB-CB 4.38Å; F147-E151 HydrophobicContact CD1-CB 3.73Å; F147-E151 HydrophobicContact CD1-CG 3.44Å; F147-E151 VanDerWaalsContact CD1-CG 3.44Å; F147-E151 WeakPolarHBondContact CD1-OE2 3.41Å; F147-E151 HydrophobicContact CE1-CG 3.81Å; G148-E151 PolarHBondContact O-N 2.87Å; E151-I153 PolarHBondContact O-N 3.22Å
152	S	47.8	Very low	42.7	Very low	55 Å²	55	96.8 Å²	96.8	39%	0.385	57%	0.566	S	S	.	*			trans	-64.8	127.1	-170.1	61.7	0	0	0	0	111.4	Y154	S152-Y154 PolarHBondContact O-N 2.88Å; S152-Y154 PolarHBondContact OG-O 2.64Å
153	I	53.4	Low	41.2	Very low	65 Å²	65	104 Å²	104	33%	0.333	60%	0.603	S	S	.	*	S	Bend	trans	-60	-26.7	178.1	-68.6	164.2	0	0	0	112.3	E151 F231	E151-I153 PolarHBondContact O-N 3.22Å; I153-F231 HydrophobicContact CD1-CD2 4.14Å; I153-F231 HydrophobicContact CD1-CE2 3.81Å; I153-F231 HydrophobicContact CD1-CZ 4.13Å; I153-F231 HydrophobicContact CG1-CD2 4.05Å; I153-F231 HydrophobicContact CG1-CE2 4.18Å; I153-F231 HydrophobicContact CG2-CB 3.51Å; I153-F231 HydrophobicContact CG2-CD1 3.95Å; I153-F231 HydrophobicContact CG2-CD2 3.69Å; I153-F231 HydrophobicContact CG2-CE2 4.38Å; I153-F231 HydrophobicContact CG2-CG 3.44Å; I153-F231 VanDerWaalsContact CG2-CG 3.44Å
154	Y	47.9	Very low	39.9	Very low	126 Å²	126	106 Å²	106	49%	0.494	62%	0.618	S	S	.	*	S	Bend	trans	-103.5	144.5	177.6	-62.1	-75.6	0	0	0	109.4	W130 S152 E156	W130-Y154 HydrophobicContact CB-CD1 4.46Å; W130-Y154 HydrophobicContact CB-CE1 4.24Å; S152-Y154 PolarHBondContact O-N 2.88Å; S152-Y154 PolarHBondContact OG-O 2.64Å; Y154-E156 PolarHBondContact O-N 3.45Å; Y154-E156 VanDerWaalsContact O-N 3.11Å
155	P	51.5	Low	39	Very low	76 Å²	76	112.4 Å²	112.4	49%	0.494	65%	0.648	S	S	.	*	P	Polyproline II helix	trans	-55.3	123.7	170.9	23.4	-31.3	0	0	0	107.8	W130 S157	W130-P155 HydrophobicContact CZ2-CG 4Å; P155-S157 PolarHBondContact O-N 3.34Å
156	E	44	Very low	38.2	Very low	151 Å²	151	114.8 Å²	114.8	71%	0.706	66%	0.655	S	S	*	*	P	Polyproline II helix	trans	-50.4	120.7	173.2	-71.1	-177.4	160.5	0	0	107.6	Y154 A158	Y154-E156 PolarHBondContact O-N 3.45Å; Y154-E156 VanDerWaalsContact O-N 3.11Å; E156-A158 PolarHBondContact O-N 3.27Å
157	S	36.2	Very low	37.5	Very low	103 Å²	103	117.6 Å²	117.6	72%	0.72	66%	0.664	S	S	*	*			trans	-56.2	108.4	170.7	52	0	0	0	0	106.6	P155 T159	P155-S157 PolarHBondContact O-N 3.34Å; S157-T159 PolarHBondContact O-N 3.49Å
158	A	31.1	Very low	36.6	Very low	102 Å²	102	119.1 Å²	119.1	84%	0.843	70%	0.695	S	S	*	*			trans	-30.8	95.4	-172.1	0	0	0	0	0	112.3	E156	E156-A158 PolarHBondContact O-N 3.27Å
159	T	25.1	Very low	36.1	Very low	108 Å²	108	126.3 Å²	126.3	66%	0.663	72%	0.721	S	S	*	*			trans	-94.8	114.5	167	30.5	0	0	0	0	105.7	S157 S161	S157-T159 PolarHBondContact O-N 3.49Å; T159-S161 PolarHBondContact O-N 3.39Å
160	T	24.1	Very low	35.2	Very low	138 Å²	138	126.7 Å²	126.7	85%	0.847	71%	0.714	S	S	*	*			trans	-41.8	108.5	174.6	-51.6	0	0	0	0	110.5
161	S	29.1	Very low	34.7	Very low	112 Å²	112	125.9 Å²	125.9	78%	0.783	71%	0.709	S	S	*	*			trans	-132.6	115.9	157.4	53.5	0	0	0	0	109	T159	T159-S161 PolarHBondContact O-N 3.39Å
162	E	24.3	Very low	33.6	Very low	164 Å²	164	130.1 Å²	130.1	77%	0.766	73%	0.725	S	S	*	*			trans	-60.9	131.5	161.9	-60.5	166.5	160.8	0	0	107.7
163	N	27.3	Very low	32.7	Very low	154 Å²	154	133 Å²	133	82%	0.824	74%	0.741	S	S	*	*				178.5	146	120.3	-84.4	-31.5	0	0	0	112.6
164	S	27.1	Very low	31.8	Very low	90 Å²	90	134 Å²	134	63%	0.629	75%	0.753	S	S	*	*			trans	-40.1	140.1	177.7	50.1	0	0	0	0	117.2
165	D	30.5	Very low	31.3	Very low	167 Å²	167	136.1 Å²	136.1	89%	0.893	77%	0.772	S	S	*	*			trans	-131.5	111.2	134.7	-98.5	-25.3	0	0	0	109.8	T167	D165-T167 PolarHBondContact O-N 3.07Å
166	E	30.8	Very low	30.7	Very low	183 Å²	183	137 Å²	137	86%	0.855	77%	0.771	S	S	*	*			trans	-84.2	89	173.2	-67.9	-175.8	156.3	0	0	109.4
167	T	29.2	Very low	30.4	Very low	132 Å²	132	132.5 Å²	132.5	81%	0.81	76%	0.756	S	S	*	*			trans	-140.9	105.5	153.4	41.5	0	0	0	0	109.2	D165 E169	D165-T167 PolarHBondContact O-N 3.07Å; T167-E169 PolarHBondContact O-N 3.13Å
168	G	28	Very low	30.9	Very low	86 Å²	86	132.7 Å²	132.7	89%	0.887	76%	0.758	S	S	*	*			trans	-67.4	114.7	-175.8	0	0	0	0	0	112.4
169	E	28.6	Very low	31.8	Very low	181 Å²	181	134.8 Å²	134.8	85%	0.846	75%	0.748	S	S	*	*			trans	-104.9	111.3	143	-134.9	177.9	-170.8	0	0	107.6	T167 I171	T167-E169 PolarHBondContact O-N 3.13Å; E169-I171 PolarHBondContact O-N 3.25Å
170	K	26.3	Very low	33.2	Very low	204 Å²	204	134.2 Å²	134.2	89%	0.887	74%	0.741	S	S	*	*			trans	-69.2	81.2	-178.1	-143.9	177.7	-166.3	174.3	0	107.7	K172	K170-K172 PolarHBondContact O-N 3.22Å
171	I	34.7	Very low	34.8	Very low	138 Å²	138	129.7 Å²	129.7	71%	0.708	71%	0.712	S	S	*	*			trans	-59.3	106.9	169.7	-60.7	175.3	0	0	0	105.3	E169 T173	E169-I171 PolarHBondContact O-N 3.25Å; I171-T173 HydrophobicContact CG2-CG2 4.19Å; I171-T173 PolarHBondContact O-N 2.97Å
172	K	28.5	Very low	36.3	Very low	197 Å²	197	128 Å²	128	86%	0.857	70%	0.698	S	S	*	*			trans	-64.1	82.9	167.1	-71.7	178.4	179.9	175.9	0	106.3	K170 S174	K170-K172 PolarHBondContact O-N 3.22Å; K172-S174 PolarHBondContact O-N 2.78Å
173	T	30.3	Very low	38	Very low	117 Å²	117	120.6 Å²	120.6	72%	0.718	66%	0.664	S	S	*	*			trans	-64	90.7	158.7	45.4	0	0	0	0	105.1	I171 I175	I171-T173 HydrophobicContact CG2-CG2 4.19Å; I171-T173 PolarHBondContact O-N 2.97Å; T173-I175 PolarHBondContact O-N 2.81Å
174	S	33.9	Very low	39.7	Very low	85 Å²	85	120 Å²	120	59%	0.594	65%	0.654	S	S	*	*			trans	-47.6	132.5	151.6	45.2	0	0	0	0	105.7	K172 I176	K172-S174 PolarHBondContact O-N 2.78Å; S174-I176 PolarHBondContact O-N 3.42Å
175	I	37.3	Very low	41.5	Very low	171 Å²	171	122.7 Å²	122.7	88%	0.877	66%	0.661	S	S	*	*			trans	-62.7	89.5	171.1	-63	166.2	0	0	0	104.5	T173 S177	T173-I175 PolarHBondContact O-N 2.81Å; I175-S177 PolarHBondContact O-N 3.38Å
176	I	38.6	Very low	43.3	Very low	95 Å²	95	115.6 Å²	115.6	49%	0.487	62%	0.622	S	S	.	*			trans	-66.6	105.5	173.5	-67.3	165.7	0	0	0	103.2	S174 S178 D180 P182	S174-I176 PolarHBondContact O-N 3.42Å; I176-S178 PolarHBondContact O-N 2.97Å; I176-D180 HydrophobicContact CG2-CB 4.48Å; I176-D180 WeakPolarHBondContact CG2-O 3.05Å; I176-P182 HydrophobicContact CD1-CB 4.28Å
177	S	36.8	Very low	45.1	Very low	55 Å²	55	110.3 Å²	110.3	39%	0.385	60%	0.598	S	S	.	*			trans	-48.2	139.4	165	83.6	0	0	0	0	106.3	I175 F179 D180	I175-S177 PolarHBondContact O-N 3.38Å; S177-F179 PolarHBondContact O-N 3Å; S177-D180 PolarHBondContact O-N 2.92Å; S177-D180 VanDerWaalsContact O-N 3.11Å; S177-D180 PolarHBondContact OG-OD2 3.21Å
178	S	46.8	Very low	47	Very low	108 Å²	108	104.9 Å²	104.9	76%	0.755	56%	0.563	S	S	*	*	T	Hydrogen-bonded Turn	trans	-60.9	11.4	-170.9	61.8	0	0	0	0	115.4	I176	I176-S178 PolarHBondContact O-N 2.97Å
179	F	51.2	Low	48.7	Very low	145 Å²	145	100.8 Å²	100.8	64%	0.636	52%	0.521	S	S	*	.	T	Hydrogen-bonded Turn	trans	-134.4	-4.2	-173.4	-70.4	-78.3	0	0	0	114.9	S177	S177-F179 PolarHBondContact O-N 3Å
180	D	53.5	Low	50.5	Low	97 Å²	97	93.2 Å²	93.2	52%	0.519	49%	0.485	S	S	.	.	S	Bend	trans	-89.8	115	172.2	-70.6	-48	0	0	0	109.8	I176 S177	I176-D180 HydrophobicContact CG2-CB 4.48Å; I176-D180 WeakPolarHBondContact CG2-O 3.05Å; S177-D180 PolarHBondContact O-N 2.92Å; S177-D180 VanDerWaalsContact O-N 3.11Å; S177-D180 PolarHBondContact OG-OD2 3.21Å
181	D	57.7	Low	52	Low	43 Å²	43	84.1 Å²	84.1	23%	0.23	45%	0.446	C	S	.	.			trans	-58.4	117.4	174.5	178	-16.8	0	0	0	109.2	R82 N183 K184 Y190	R82-D181 IonicContact CZ-OD2 3.03Å; R82-D181 IonicContact NH2-OD2 3.9Å; R82-D181 PolarHBondContact NH2-OD2 3.2Å; D181-N183 PolarHBondContact O-N 2.85Å; D181-N183 PolarHBondContact OD1-N 2.88Å; D181-K184 HydrophobicContact CB-CB 4.11Å; D181-K184 WeakPolarHBondContact O-CB 3.25Å; D181-K184 PolarHBondContact O-N 2.95Å; D181-K184 VanDerWaalsContact O-N 3.09Å; D181-K184 PolarHBondContact OD1-N 2.83Å; D181-Y190 VanDerWaalsContact CG-OH 3.27Å; D181-Y190 WeakPolarHBondContact OD2-CE1 3.22Å; D181-Y190 VanDerWaalsContact OD2-CZ 3.25Å; D181-Y190 PolarHBondContact OD2-OH 2.94Å
182	P	60.7	Low	53.4	Low	76 Å²	76	79.5 Å²	79.5	49%	0.494	42%	0.421	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.6	-19.8	-172.6	25.1	-35.1	0	0	0	112.6	T109 I176	T109-P182 HydrophobicContact CG2-CG 4.16Å; I176-P182 HydrophobicContact CD1-CB 4.28Å
183	N	60.8	Low	54.7	Low	9 Å²	9	70.1 Å²	70.1	5%	0.048	38%	0.38	C	S	.	.	T	Hydrogen-bonded Turn	trans	-114.5	9.6	-173.9	-91.2	0.9	0	0	0	113.1	F107 T109 D181 D185 H186 G189	F107-N183 PolarHBondContact O-ND2 2.75Å; T109-N183 HydrophobicContact CG2-CB 3.74Å; T109-N183 WeakPolarHBondContact CG2-ND2 3.36Å; D181-N183 PolarHBondContact O-N 2.85Å; D181-N183 PolarHBondContact OD1-N 2.88Å; N183-D185 PolarHBondContact O-N 2.84Å; N183-D185 VanDerWaalsContact O-N 3.1Å; N183-H186 HydrophobicContact CB-CB 4.38Å; N183-H186 WeakPolarHBondContact O-CB 3.4Å; N183-H186 PolarHBondContact O-N 2.9Å; N183-G189 VanDerWaalsContact ND2-CA 3.29Å; N183-G189 WeakPolarHBondContact ND2-CA 3.38Å; N183-G189 PolarHBondContact ND2-O 2.84Å; N183-G189 VanDerWaalsContact ND2-O 3.08Å
184	K	62.2	Low	55.6	Low	142 Å²	142	66.5 Å²	66.5	62%	0.617	36%	0.358	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.5	-38.1	179.8	-170.9	-179.8	172.9	-169.6	0	113.4	D181	D181-K184 HydrophobicContact CB-CB 4.11Å; D181-K184 WeakPolarHBondContact O-CB 3.25Å; D181-K184 PolarHBondContact O-N 2.95Å; D181-K184 VanDerWaalsContact O-N 3.09Å; D181-K184 PolarHBondContact OD1-N 2.83Å
185	D	65.3	Low	56.7	Low	146 Å²	146	62.7 Å²	62.7	78%	0.781	33%	0.332	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.3	3.4	-178.8	-54.4	-32.7	0	0	0	112.6	N183	N183-D185 PolarHBondContact O-N 2.84Å; N183-D185 VanDerWaalsContact O-N 3.1Å
186	H	69	Low	58.1	Low	18 Å²	18	60.5 Å²	60.5	8%	0.083	31%	0.313	C	S	.	.			trans	-100.5	120.3	179.4	-164.6	-109.7	0	0	0	111.5	F107 N183 F188 G189 D219 K221	F107-H186 AromaticContact CD1-CE1 3.5Å; F107-H186 VanDerWaalsContact CD1-CE1 3.5Å; F107-H186 WeakPolarHBondContact CD1-CE1 3.46Å; F107-H186 AromaticContact CG-CE1 3.44Å; F107-H186 VanDerWaalsContact CG-CE1 3.44Å; F107-H186 WeakPolarHBondContact CG-CE1 3.38Å; N183-H186 HydrophobicContact CB-CB 4.38Å; N183-H186 WeakPolarHBondContact O-CB 3.4Å; N183-H186 PolarHBondContact O-N 2.9Å; H186-F188 AromaticContact CE1-CD2 3.85Å; H186-F188 PolarHBondContact ND1-N 2.98Å; H186-F188 PolarHBondContact O-N 3.02Å; H186-F188 VanDerWaalsContact O-N 3.07Å; H186-G189 PolarHBondContact ND1-N 3.42Å; H186-G189 PolarHBondContact O-N 2.94Å; H186-G189 VanDerWaalsContact O-N 3.12Å; H186-D219 IonicContact NE2-OD2 2.73Å; H186-K221 HydrophobicContact CB-CD 4.07Å; H186-K221 WeakPolarHBondContact CD2-CD 3.15Å
187	E	67.9	Low	59.8	Low	71 Å²	71	56.6 Å²	56.6	33%	0.332	29%	0.294	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54.4	-33.3	-177.2	179.3	171.7	-161.1	0	0	113.3	S195 K198	E187-S195 WeakPolarHBondContact OE1-CB 3.25Å; E187-K198 WeakPolarHBondContact OE1-CE 3.26Å; E187-K198 IonicContact OE1-NZ 3.68Å; E187-K198 PolarHBondContact OE1-NZ 2.83Å; E187-K198 IonicContact OE2-NZ 2.94Å; E187-K198 PolarHBondContact OE2-NZ 3.31Å
188	F	69.3	Low	61.6	Low	18 Å²	18	56.5 Å²	56.5	8%	0.079	29%	0.287	C	S	.	.	T	Hydrogen-bonded Turn	trans	-110.1	15.9	-175.5	-48.9	-65.9	0	0	0	114	Y101 F107 H186 Y190 P193	Y101-F188 HydrophobicContact CD2-CE1 4.22Å; F107-F188 HydrophobicContact CB-CB 4.02Å; F107-F188 HydrophobicContact CD2-CB 3.94Å; F107-F188 HydrophobicContact CD2-CD2 4.28Å; F107-F188 HydrophobicContact CD2-CG 4.4Å; F107-F188 HydrophobicContact CE2-CD2 4.45Å; F107-F188 HydrophobicContact CG-CB 4.26Å; H186-F188 AromaticContact CE1-CD2 3.85Å; H186-F188 PolarHBondContact ND1-N 2.98Å; H186-F188 PolarHBondContact O-N 3.02Å; H186-F188 VanDerWaalsContact O-N 3.07Å; F188-Y190 PolarHBondContact O-N 3.12Å; F188-P193 HydrophobicContact CD1-CB 4.44Å
189	G	62.7	Low	63.2	Low	0 Å²	0	58 Å²	58	0%	0	28%	0.28	C	S	.	.			trans	-68.7	3.1	-170.1	0	0	0	0	0	116.8	N183 H186	N183-G189 VanDerWaalsContact ND2-CA 3.29Å; N183-G189 WeakPolarHBondContact ND2-CA 3.38Å; N183-G189 PolarHBondContact ND2-O 2.84Å; N183-G189 VanDerWaalsContact ND2-O 3.08Å; H186-G189 PolarHBondContact ND1-N 3.42Å; H186-G189 PolarHBondContact O-N 2.94Å; H186-G189 VanDerWaalsContact O-N 3.12Å
190	Y	66.3	Low	64.5	Low	23 Å²	23	53.5 Å²	53.5	9%	0.09	26%	0.262	C	S	.	.	S	Bend	trans	-135.3	159.8	-170.4	-53.8	-77.7	0	0	0	114.2	R82 E112 D181 F188 H192 V194	R82-Y190 PolarHBondContact NE-OH 2.77Å; R82-Y190 VanDerWaalsContact NE-OH 3.12Å; R82-Y190 PolarHBondContact NH2-OH 2.91Å; E112-Y190 WeakPolarHBondContact OE1-CA 3.31Å; E112-Y190 WeakPolarHBondContact OE1-CB 3.4Å; E112-Y190 VanDerWaalsContact OE1-CD1 3.28Å; E112-Y190 WeakPolarHBondContact OE1-CD1 3.38Å; E112-Y190 WeakPolarHBondContact OE2-CA 2.98Å; D181-Y190 VanDerWaalsContact CG-OH 3.27Å; D181-Y190 WeakPolarHBondContact OD2-CE1 3.22Å; D181-Y190 VanDerWaalsContact OD2-CZ 3.25Å; D181-Y190 PolarHBondContact OD2-OH 2.94Å; F188-Y190 PolarHBondContact O-N 3.12Å; Y190-H192 PolarHBondContact O-N 3.02Å; Y190-V194 HydrophobicContact CD2-CG2 4.28Å; Y190-V194 HydrophobicContact CE2-CG2 4.38Å
191	T	59.4	Low	66	Low	13 Å²	13	55.4 Å²	55.4	8%	0.08	26%	0.263	C	S	.	.	S	Bend	trans	-67.4	-12.2	172.6	55.6	0	0	0	0	114.4	F102 V103 L108 E112 P253	F102-T191 CarbonylContact C-O 3.47Å; F102-T191 CarbonylContact O-C 3.59Å; V103-T191 HydrophobicContact CG2-CG2 4.31Å; V103-T191 VanDerWaalsContact CG2-O 3.29Å; V103-T191 WeakPolarHBondContact CG2-O 3.16Å; L108-T191 HydrophobicContact CD1-CG2 3.52Å; L108-T191 HydrophobicContact CD2-CG2 4.07Å; L108-T191 HydrophobicContact CG-CG2 4.4Å; E112-T191 HydrophobicContact CB-CG2 4.16Å; E112-T191 PolarHBondContact OE1-N 2.78Å; E112-T191 VanDerWaalsContact OE1-N 3.16Å; T191-P253 HydrophobicContact CG2-CG 3.9Å
192	H	62.7	Low	67.3	Low	40 Å²	40	61.6 Å²	61.6	19%	0.185	28%	0.283	C	S	.	.	S	Bend	trans	-134.8	64.2	175.3	-52.9	-47	0	0	0	108.9	R86 F102 Y190 V194 Y264	R86-H192 PolarHBondContact NH1-O 2.83Å; R86-H192 PolarHBondContact NH2-O 3.11Å; F102-H192 AromaticContact CE2-CE1 3.89Å; F102-H192 AromaticContact CE2-ND1 3.89Å; Y190-H192 PolarHBondContact O-N 3.02Å; H192-V194 PolarHBondContact O-N 3.42Å; H192-Y264 AromaticContact CE1-CD1 3.55Å; H192-Y264 AromaticContact CE1-CE1 2.87Å; H192-Y264 WeakPolarHBondContact CE1-CE1 3.45Å; H192-Y264 AromaticContact CE1-CZ 3.53Å; H192-Y264 AromaticContact ND1-CD1 3.61Å; H192-Y264 AromaticContact ND1-CE1 3.43Å; H192-Y264 WeakPolarHBondContact ND1-CE1 3.22Å; H192-Y264 AromaticContact NE2-CE1 3.33Å; H192-Y264 VanDerWaalsContact NE2-CE1 3.33Å; H192-Y264 WeakPolarHBondContact NE2-CE1 3.16Å
193	P	56.4	Low	68.5	Low	0 Å²	0	58.5 Å²	58.5	0%	0	26%	0.263	C	S	.	.			trans	-53.1	137.7	-161	24.7	-35.4	0	0	0	111.3	R86 Y101 F102 F188 S195	R86-P193 PolarHBondContact NH2-O 3.16Å; Y101-P193 WeakPolarHBondContact O-CD 3.31Å; Y101-P193 WeakPolarHBondContact O-CG 3.4Å; F102-P193 WeakPolarHBondContact O-CD 3.4Å; F188-P193 HydrophobicContact CD1-CB 4.44Å; P193-S195 PolarHBondContact O-N 3.28Å
194	V	49.7	Very low	69.5	Low	41 Å²	41	60.6 Å²	60.6	25%	0.248	29%	0.287	C	S	.	.	S	Bend	trans	-58.3	-19.7	179.5	-172.1	0	0	0	0	111	R82 Y190 H192 Y196	R82-V194 HydrophobicContact CB-CG2 4.22Å; R82-V194 HydrophobicContact CG-CG2 4.25Å; Y190-V194 HydrophobicContact CD2-CG2 4.28Å; Y190-V194 HydrophobicContact CE2-CG2 4.38Å; H192-V194 PolarHBondContact O-N 3.42Å; V194-Y196 PolarHBondContact O-N 3.17Å; V194-Y196 VanDerWaalsContact O-N 3.14Å
195	S	56.1	Low	70.5	Confident	6 Å²	6	54.9 Å²	54.9	4%	0.042	27%	0.269	C	S	.	.	P	Polyproline II helix	trans	-48.2	118.6	176.7	71.3	0	0	0	0	112.5	E187 P193	E187-S195 WeakPolarHBondContact OE1-CB 3.25Å; P193-S195 PolarHBondContact O-N 3.28Å
196	Y	67.1	Low	71.6	Confident	124 Å²	124	56.5 Å²	56.5	49%	0.486	27%	0.269	S	S	.	.	P	Polyproline II helix	trans	-55.1	155	167.6	62.5	-85.4	0	0	0	110.5	V194 K198	V194-Y196 PolarHBondContact O-N 3.17Å; V194-Y196 VanDerWaalsContact O-N 3.14Å; Y196-K198 HydrophobicContact CD2-CG 4Å; Y196-K198 HydrophobicContact CE2-CD 4.37Å; Y196-K198 HydrophobicContact CE2-CG 3.49Å; Y196-K198 VanDerWaalsContact CE2-CG 3.49Å; Y196-K198 PolarHBondContact O-N 2.9Å; Y196-K198 WeakPolarHBondContact OH-CE 3.16Å
197	P	73.5	Confident	72.5	Confident	14 Å²	14	61.3 Å²	61.3	9%	0.091	29%	0.291	C	S	.	.	P	Polyproline II helix	trans	-65	127.2	176.3	16.5	-16	0	0	0	109.4	R98 T99 R100	R98-P197 HydrophobicContact CG-CB 3.74Å; R98-P197 VanDerWaalsContact CZ-CG 3.5Å; R98-P197 VanDerWaalsContact CZ-O 3.32Å; R98-P197 PolarHBondContact NE-O 3.43Å; R98-P197 PolarHBondContact NH2-O 2.8Å; T99-P197 WeakPolarHBondContact O-CA 3.22Å; R100-P197 HydrophobicContact CB-CB 4.23Å
198	K	75.5	Confident	73.3	Confident	53 Å²	53	58.4 Å²	58.4	23%	0.23	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	148.5	-176.1	-71.5	-178.8	-176.6	-178	0	110.3	T99 E187 Y196 L200	T99-K198 PolarHBondContact N-O 2.94Å; T99-K198 PolarHBondContact O-N 3.45Å; T99-K198 PolarHBondContact OG1-O 3.46Å; E187-K198 WeakPolarHBondContact OE1-CE 3.26Å; E187-K198 IonicContact OE1-NZ 3.68Å; E187-K198 PolarHBondContact OE1-NZ 2.83Å; E187-K198 IonicContact OE2-NZ 2.94Å; E187-K198 PolarHBondContact OE2-NZ 3.31Å; Y196-K198 HydrophobicContact CD2-CG 4Å; Y196-K198 HydrophobicContact CE2-CD 4.37Å; Y196-K198 HydrophobicContact CE2-CG 3.49Å; Y196-K198 VanDerWaalsContact CE2-CG 3.49Å; Y196-K198 PolarHBondContact O-N 2.9Å; Y196-K198 WeakPolarHBondContact OH-CE 3.16Å; K198-L200 HydrophobicContact CB-CD2 4.1Å; K198-L200 HydrophobicContact CB-CG 4.16Å; K198-L200 PolarHBondContact O-N 2.78Å
199	F	79.4	Confident	74.1	Confident	138 Å²	138	59.1 Å²	59.1	61%	0.605	29%	0.286	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-67	112.2	159.9	-72.3	-74.7	0	0	0	107.4	I95 H96 S97	I95-F199 HydrophobicContact CG2-CE1 3.84Å; I95-F199 HydrophobicContact CG2-CZ 3.66Å; H96-F199 WeakPolarHBondContact O-CE1 3.46Å; S97-F199 WeakPolarHBondContact OG-CD1 3.49Å
200	L	79.5	Confident	75.3	Confident	51 Å²	51	62.3 Å²	62.3	27%	0.267	31%	0.309	S	S	.	.			trans	-118.5	167	175.5	-66.8	-171.4	0	0	0	109.9	T99 Y101 K198	T99-L200 HydrophobicContact CG2-CB 4.06Å; T99-L200 HydrophobicContact CG2-CD1 4.36Å; T99-L200 WeakPolarHBondContact OG1-CB 3.36Å; T99-L200 WeakPolarHBondContact OG1-CD1 3.41Å; T99-L200 WeakPolarHBondContact OG1-CG 3.23Å; Y101-L200 HydrophobicContact CE2-CD1 3.64Å; Y101-L200 WeakPolarHBondContact OH-CD1 3.35Å; K198-L200 HydrophobicContact CB-CD2 4.1Å; K198-L200 HydrophobicContact CB-CG 4.16Å; K198-L200 PolarHBondContact O-N 2.78Å
201	Y	84.6	Confident	76.2	Confident	137 Å²	137	62.6 Å²	62.6	54%	0.537	32%	0.316	S	S	.	.	P	Polyproline II helix	trans	-54	147.2	172.1	-54.3	-69.3	0	0	0	111.2	Q207 A211	Y201-Q207 HydrophobicContact CD1-CB 3.6Å; Y201-Q207 HydrophobicContact CD1-CG 4.33Å; Y201-Q207 HydrophobicContact CD2-CB 4.34Å; Y201-Q207 HydrophobicContact CE1-CB 4.1Å; Y201-Q207 HydrophobicContact CG-CB 3.73Å; Y201-A211 HydrophobicContact CD2-CB 3.71Å; Y201-A211 HydrophobicContact CE2-CB 3.52Å
202	R	86	Confident	77.3	Confident	174 Å²	174	62.2 Å²	62.2	66%	0.657	31%	0.314	S	S	*	.	P	Polyproline II helix	trans	-52.5	125.8	177.9	-174.5	174.8	175.8	169	1.4	110.2	G204 G205 A208	R202-G204 PolarHBondContact O-N 2.79Å; R202-G205 PolarHBondContact O-N 3.16Å; R202-A208 WeakPolarHBondContact O-CB 3.2Å
203	P	84.9	Confident	78.3	Confident	10 Å²	10	64.2 Å²	64.2	7%	0.065	33%	0.325	C	S	.	.	T	Hydrogen-bonded Turn	trans	-56.9	134.2	177.9	-21.6	30.4	0	0	0	111.1	G205 I273 K317 Y368	P203-G205 VanDerWaalsContact C-N 3.26Å; P203-G205 PolarHBondContact O-N 2.79Å; P203-I273 HydrophobicContact CB-CD1 3.59Å; P203-I273 HydrophobicContact CB-CG1 3.9Å; P203-I273 HydrophobicContact CB-CG2 4.23Å; P203-I273 HydrophobicContact CG-CD1 3.21Å; P203-I273 HydrophobicContact CG-CG1 3.98Å; P203-K317 HydrophobicContact CB-CB 4.38Å; P203-K317 HydrophobicContact CB-CD 4.5Å; P203-K317 HydrophobicContact CB-CG 4.38Å; P203-Y368 HydrophobicContact CG-CD1 4.07Å; P203-Y368 HydrophobicContact CG-CD2 3.68Å; P203-Y368 HydrophobicContact CG-CE1 4.25Å; P203-Y368 HydrophobicContact CG-CE2 3.79Å; P203-Y368 HydrophobicContact CG-CG 3.79Å
204	G	81.4	Confident	79.6	Confident	54 Å²	54	68.4 Å²	68.4	56%	0.557	35%	0.351	S	S	*	.	T	Hydrogen-bonded Turn	trans	82.6	-8.7	-174.7	0	0	0	0	0	115	R202	R202-G204 PolarHBondContact O-N 2.79Å
205	G	84.6	Confident	81.1	Confident	22 Å²	22	70.9 Å²	70.9	23%	0.227	36%	0.361	C	S	.	.	S	Bend	trans	-70.9	156	172.1	0	0	0	0	0	112.6	R202 P203 Q207 A208 S209	R202-G205 PolarHBondContact O-N 3.16Å; P203-G205 VanDerWaalsContact C-N 3.26Å; P203-G205 PolarHBondContact O-N 2.79Å; G205-Q207 VanDerWaalsContact C-N 3.26Å; G205-Q207 PolarHBondContact O-N 3.21Å; G205-A208 PolarHBondContact O-N 3.25Å; G205-S209 PolarHBondContact O-N 3.28Å
206	K	87.8	Confident	82.4	Confident	179 Å²	179	70.6 Å²	70.6	78%	0.778	36%	0.359	S	S	*	.	H	α-helix	trans	-56.4	-42.2	177.1	-65.9	-176.9	-178.9	-179.9	0	111.3	A208 S209 S210	K206-A208 PolarHBondContact O-N 3.02Å; K206-S209 PolarHBondContact O-N 3.26Å; K206-S210 PolarHBondContact O-N 2.67Å; K206-S210 PolarHBondContact O-OG 3.41Å; K206-S210 VanDerWaalsContact O-OG 3.09Å
207	Q	87.8	Confident	83.1	Confident	120 Å²	120	67.4 Å²	67.4	56%	0.561	36%	0.355	S	S	*	.	H	α-helix	trans	-63.1	-39.8	179	-62.2	87.1	-20.5	0	0	112.7	Y201 G205 S209 S210 A211	Y201-Q207 HydrophobicContact CD1-CB 3.6Å; Y201-Q207 HydrophobicContact CD1-CG 4.33Å; Y201-Q207 HydrophobicContact CD2-CB 4.34Å; Y201-Q207 HydrophobicContact CE1-CB 4.1Å; Y201-Q207 HydrophobicContact CG-CB 3.73Å; G205-Q207 VanDerWaalsContact C-N 3.26Å; G205-Q207 PolarHBondContact O-N 3.21Å; Q207-S209 VanDerWaalsContact C-N 3.34Å; Q207-S210 PolarHBondContact O-N 3.33Å; Q207-A211 VanDerWaalsContact O-CB 3.22Å; Q207-A211 WeakPolarHBondContact O-CB 3.46Å; Q207-A211 PolarHBondContact O-N 3.03Å
208	A	85.2	Confident	83.5	Confident	10 Å²	10	70.9 Å²	70.9	8%	0.083	38%	0.379	C	S	.	.	H	α-helix	trans	-63.9	-42.3	177.4	0	0	0	0	0	111.2	R202 G205 K206 A212 I315	R202-A208 WeakPolarHBondContact O-CB 3.2Å; G205-A208 PolarHBondContact O-N 3.25Å; K206-A208 PolarHBondContact O-N 3.02Å; A208-A212 VanDerWaalsContact O-CB 3.31Å; A208-A212 WeakPolarHBondContact O-CB 2.94Å; A208-A212 PolarHBondContact O-N 3.07Å; A208-I315 HydrophobicContact CB-CD1 4.21Å
209	S	85.6	Confident	83.9	Confident	32 Å²	32	69.9 Å²	69.9	22%	0.224	38%	0.376	C	S	.	.	H	α-helix	trans	-63.9	-49.5	175.2	-169.8	0	0	0	0	111.6	G205 K206 Q207 A211 A212 I213	G205-S209 PolarHBondContact O-N 3.28Å; K206-S209 PolarHBondContact O-N 3.26Å; Q207-S209 VanDerWaalsContact C-N 3.34Å; S209-A211 PolarHBondContact O-N 3.18Å; S209-A212 PolarHBondContact O-N 2.79Å; S209-I213 VanDerWaalsContact O-CG1 3.3Å; S209-I213 WeakPolarHBondContact O-CG1 3.21Å; S209-I213 PolarHBondContact O-N 2.87Å
210	S	87.7	Confident	84.2	Confident	67 Å²	67	69.4 Å²	69.4	47%	0.469	39%	0.387	S	S	.	.	H	α-helix	trans	-59.6	-46.4	177.8	-60.1	0	0	0	0	112.4	K206 Q207 A212 I213 V214	K206-S210 PolarHBondContact O-N 2.67Å; K206-S210 PolarHBondContact O-OG 3.41Å; K206-S210 VanDerWaalsContact O-OG 3.09Å; Q207-S210 PolarHBondContact O-N 3.33Å; S210-A212 VanDerWaalsContact C-N 3.32Å; S210-A212 PolarHBondContact O-N 2.82Å; S210-I213 PolarHBondContact O-N 3.05Å; S210-V214 VanDerWaalsContact O-CG2 3.28Å; S210-V214 WeakPolarHBondContact O-CG2 3.36Å; S210-V214 PolarHBondContact O-N 3.06Å
211	A	85.7	Confident	84.3	Confident	30 Å²	30	71 Å²	71	25%	0.248	39%	0.392	C	S	.	.	H	α-helix	trans	-62.6	-40.5	179.4	0	0	0	0	0	112	Y201 Q207 S209 V214 M215	Y201-A211 HydrophobicContact CD2-CB 3.71Å; Y201-A211 HydrophobicContact CE2-CB 3.52Å; Q207-A211 VanDerWaalsContact O-CB 3.22Å; Q207-A211 WeakPolarHBondContact O-CB 3.46Å; Q207-A211 PolarHBondContact O-N 3.03Å; S209-A211 PolarHBondContact O-N 3.18Å; A211-V214 PolarHBondContact O-N 3.04Å; A211-M215 WeakPolarHBondContact O-CB 3.01Å; A211-M215 WeakPolarHBondContact O-CG 3.33Å; A211-M215 PolarHBondContact O-N 3.41Å
212	A	82.4	Confident	84.5	Confident	4 Å²	4	66.2 Å²	66.2	3%	0.033	37%	0.374	C	S	.	.	H	α-helix	trans	-70.9	-32.4	177.7	0	0	0	0	0	112.3	A208 S209 S210 T216 R275 Y364	A208-A212 VanDerWaalsContact O-CB 3.31Å; A208-A212 WeakPolarHBondContact O-CB 2.94Å; A208-A212 PolarHBondContact O-N 3.07Å; S209-A212 PolarHBondContact O-N 2.79Å; S210-A212 VanDerWaalsContact C-N 3.32Å; S210-A212 PolarHBondContact O-N 2.82Å; A212-T216 PolarHBondContact O-N 3.33Å; A212-T216 PolarHBondContact O-OG1 3.09Å; A212-R275 PolarHBondContact O-NH1 3.06Å; A212-R275 VanDerWaalsContact O-NH1 3.13Å; A212-Y364 HydrophobicContact CB-CE1 3.95Å
213	I	83.5	Confident	84.6	Confident	83 Å²	83	61.5 Å²	61.5	43%	0.426	36%	0.358	S	S	.	.	H	α-helix	trans	-66.2	-50.3	170.9	-66.9	165.7	0	0	0	110.2	S209 S210 M215 T216 S217	S209-I213 VanDerWaalsContact O-CG1 3.3Å; S209-I213 WeakPolarHBondContact O-CG1 3.21Å; S209-I213 PolarHBondContact O-N 2.87Å; S210-I213 PolarHBondContact O-N 3.05Å; I213-M215 PolarHBondContact O-N 3.11Å; I213-T216 PolarHBondContact O-N 2.73Å; I213-S217 VanDerWaalsContact O-CB 3.23Å; I213-S217 WeakPolarHBondContact O-CB 3.39Å; I213-S217 PolarHBondContact O-N 3.14Å; I213-S217 PolarHBondContact O-OG 3.31Å
214	V	84.8	Confident	84.8	Confident	88 Å²	88	61 Å²	61	53%	0.533	36%	0.355	S	S	.	.	H	α-helix	trans	-58.1	-51.9	-178.4	171.4	0	0	0	0	110.4	S210 A211 T216 S217 S218	S210-V214 VanDerWaalsContact O-CG2 3.28Å; S210-V214 WeakPolarHBondContact O-CG2 3.36Å; S210-V214 PolarHBondContact O-N 3.06Å; A211-V214 PolarHBondContact O-N 3.04Å; V214-T216 VanDerWaalsContact C-N 3.33Å; V214-T216 PolarHBondContact O-N 2.76Å; V214-S217 WeakPolarHBondContact CA-OG 3.1Å; V214-S217 PolarHBondContact O-N 2.93Å; V214-S217 VanDerWaalsContact O-N 3.12Å; V214-S217 PolarHBondContact O-OG 3.43Å; V214-S218 PolarHBondContact O-N 3.09Å; V214-S218 PolarHBondContact O-OG 2.89Å; V214-S218 VanDerWaalsContact O-OG 3.05Å
215	M	80.3	Confident	85.3	Confident	93 Å²	93	59 Å²	59	46%	0.458	33%	0.331	S	S	.	.	H	α-helix	trans	-51	-50.6	177	-77	-100.3	-176.7	0	0	112	A211 I213 S217 D219	A211-M215 WeakPolarHBondContact O-CB 3.01Å; A211-M215 WeakPolarHBondContact O-CG 3.33Å; A211-M215 PolarHBondContact O-N 3.41Å; I213-M215 PolarHBondContact O-N 3.11Å; M215-S217 VanDerWaalsContact C-N 3.34Å; M215-S217 PolarHBondContact O-N 2.88Å; M215-D219 VanDerWaalsContact O-CB 3.31Å; M215-D219 WeakPolarHBondContact O-CB 3.21Å; M215-D219 PolarHBondContact O-N 3.4Å
216	T	82.5	Confident	85.7	Confident	0 Å²	0	57.9 Å²	57.9	0%	0	32%	0.32	C	S	.	.	H	α-helix	trans	-75.8	-24.8	-176	-51.5	0	0	0	0	112.9	P106 R138 A212 I213 V214 F222 Y225	P106-T216 HydrophobicContact CB-CG2 4.1Å; P106-T216 HydrophobicContact CG-CG2 3.92Å; R138-T216 PolarHBondContact NE-O 2.88Å; R138-T216 PolarHBondContact NH2-O 3.16Å; R138-T216 VanDerWaalsContact NH2-O 3.15Å; A212-T216 PolarHBondContact O-N 3.33Å; A212-T216 PolarHBondContact O-OG1 3.09Å; I213-T216 PolarHBondContact O-N 2.73Å; V214-T216 VanDerWaalsContact C-N 3.33Å; V214-T216 PolarHBondContact O-N 2.76Å; T216-F222 HydrophobicContact CG2-CD2 3.34Å; T216-F222 HydrophobicContact CG2-CE2 3.2Å; T216-F222 HydrophobicContact CG2-CZ 4.37Å; T216-Y225 HydrophobicContact CG2-CE1 3.53Å; T216-Y225 WeakPolarHBondContact CG2-OH 3.47Å
217	S	82.2	Confident	86	Confident	57 Å²	57	50.1 Å²	50.1	40%	0.399	29%	0.286	S	S	.	.	H	α-helix	trans	-77.4	-35.6	179.2	69.8	0	0	0	0	114	R138 I213 V214 M215	R138-S217 PolarHBondContact NE-O 3.08Å; R138-S217 PolarHBondContact NH1-O 2.82Å; R138-S217 PolarHBondContact NH2-O 2.93Å; I213-S217 VanDerWaalsContact O-CB 3.23Å; I213-S217 WeakPolarHBondContact O-CB 3.39Å; I213-S217 PolarHBondContact O-N 3.14Å; I213-S217 PolarHBondContact O-OG 3.31Å; V214-S217 WeakPolarHBondContact CA-OG 3.1Å; V214-S217 PolarHBondContact O-N 2.93Å; V214-S217 VanDerWaalsContact O-N 3.12Å; V214-S217 PolarHBondContact O-OG 3.43Å; M215-S217 VanDerWaalsContact C-N 3.34Å; M215-S217 PolarHBondContact O-N 2.88Å
218	S	82.2	Confident	86.3	Confident	86 Å²	86	44.4 Å²	44.4	60%	0.601	26%	0.259	S	S	*	.	H	α-helix	trans	-98.5	-20.5	-172.2	62.3	0	0	0	0	114.5	V214	V214-S218 PolarHBondContact O-N 3.09Å; V214-S218 PolarHBondContact O-OG 2.89Å; V214-S218 VanDerWaalsContact O-OG 3.05Å
219	D	84.2	Confident	86.7	Confident	32 Å²	32	47.5 Å²	47.5	17%	0.171	27%	0.269	C	S	.	.			trans	-74.5	126.3	-171.5	-164	-37.3	0	0	0	112.3	F107 R138 H186 M215 K221 F222	F107-D219 HydrophobicContact CE1-CB 3.81Å; F107-D219 WeakPolarHBondContact CE1-OD2 3.5Å; F107-D219 HydrophobicContact CZ-CB 4.1Å; R138-D219 PolarHBondContact NH2-O 3.41Å; H186-D219 IonicContact NE2-OD2 2.73Å; M215-D219 VanDerWaalsContact O-CB 3.31Å; M215-D219 WeakPolarHBondContact O-CB 3.21Å; M215-D219 PolarHBondContact O-N 3.4Å; D219-K221 VanDerWaalsContact C-N 3.27Å; D219-K221 PolarHBondContact O-N 3.14Å; D219-K221 WeakPolarHBondContact OD1-CB 3.28Å; D219-K221 PolarHBondContact OD1-N 2.88Å; D219-F222 WeakPolarHBondContact O-CB 3.33Å; D219-F222 PolarHBondContact O-N 3.22Å
220	P	84.5	Confident	87	Confident	128 Å²	128	46 Å²	46	83%	0.831	26%	0.259	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.7	-18.6	177.4	29.1	-36.8	0	0	0	114	F222	P220-F222 PolarHBondContact O-N 2.75Å
221	K	83.4	Confident	87.3	Confident	84 Å²	84	44.5 Å²	44.5	37%	0.365	24%	0.244	S	C	.	.	T	Hydrogen-bonded Turn	trans	-87.4	9.5	178.7	-65.4	175.5	177.4	-172	0	113	H186 D219 K223	H186-K221 HydrophobicContact CB-CD 4.07Å; H186-K221 WeakPolarHBondContact CD2-CD 3.15Å; D219-K221 VanDerWaalsContact C-N 3.27Å; D219-K221 PolarHBondContact O-N 3.14Å; D219-K221 WeakPolarHBondContact OD1-CB 3.28Å; D219-K221 PolarHBondContact OD1-N 2.88Å; K221-K223 PolarHBondContact O-N 2.85Å
222	F	87.1	Confident	87.7	Confident	38 Å²	38	43 Å²	43	17%	0.167	23%	0.232	C	C	.	.			trans	-61	121.7	174.4	178.5	-93.1	0	0	0	111.3	P106 R138 T216 D219 P220 G224 Y225	P106-F222 HydrophobicContact CB-CD2 3.68Å; P106-F222 HydrophobicContact CB-CE2 3.76Å; P106-F222 HydrophobicContact CG-CD2 4.44Å; P106-F222 HydrophobicContact CG-CE2 4.08Å; R138-F222 HydrophobicContact CB-CD1 4.35Å; R138-F222 HydrophobicContact CB-CE1 3.69Å; R138-F222 HydrophobicContact CB-CZ 3.85Å; T216-F222 HydrophobicContact CG2-CD2 3.34Å; T216-F222 HydrophobicContact CG2-CE2 3.2Å; T216-F222 HydrophobicContact CG2-CZ 4.37Å; D219-F222 WeakPolarHBondContact O-CB 3.33Å; D219-F222 PolarHBondContact O-N 3.22Å; P220-F222 PolarHBondContact O-N 2.75Å; F222-G224 VanDerWaalsContact CZ-CA 3.47Å; F222-Y225 HydrophobicContact CE2-CD2 4.44Å; F222-Y225 HydrophobicContact CE2-CE1 4.25Å; F222-Y225 HydrophobicContact CE2-CE2 4.15Å; F222-Y225 HydrophobicContact CZ-CD2 4.08Å; F222-Y225 AromaticContact CZ-CE2 3.95Å; F222-Y225 HydrophobicContact CZ-CE2 3.95Å
223	K	88.2	Confident	88.3	Confident	74 Å²	74	43.1 Å²	43.1	32%	0.322	23%	0.233	S	C	.	.			trans	-105.2	-29.4	176.8	-70	-172.2	166.6	-154.9	0	114.2	P106 L108 D110 K221	P106-K223 PolarHBondContact O-N 2.78Å; L108-K223 VanDerWaalsContact O-CD 3.32Å; L108-K223 WeakPolarHBondContact O-CD 3.36Å; D110-K223 IonicContact OD1-NZ 2.76Å; D110-K223 IonicContact OD2-NZ 2.9Å; D110-K223 PolarHBondContact OD2-NZ 3.38Å; K221-K223 PolarHBondContact O-N 2.85Å
224	G	90.5	Very high	88.8	Confident	1 Å²	1	41.7 Å²	41.7	1%	0.01	23%	0.228	C	C	.	.			trans	140.4	150.8	-177.8	0	0	0	0	0	113.5	F105 P106 S136 F222	F105-G224 CarbonylContact C-O 3.56Å; F105-G224 VanDerWaalsContact C-O 3.29Å; P106-G224 VanDerWaalsContact CA-O 3.22Å; P106-G224 WeakPolarHBondContact CA-O 3.25Å; S136-G224 CarbonylContact O-C 3.58Å; S136-G224 VanDerWaalsContact O-CA 3.23Å; S136-G224 WeakPolarHBondContact O-CA 3.25Å; F222-G224 VanDerWaalsContact CZ-CA 3.47Å
225	Y	91.8	Very high	89.2	Confident	10 Å²	10	45.3 Å²	45.3	4%	0.039	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.3	160.2	174.4	-56.6	-73.5	0	0	0	111	P106 R135 S136 T216 F222 W313 D363	P106-Y225 HydrophobicContact CG-CD1 3.69Å; P106-Y225 HydrophobicContact CG-CE1 3.88Å; R135-Y225 CarbonylContact C-O 3.46Å; R135-Y225 WeakPolarHBondContact CA-O 3.43Å; S136-Y225 PolarHBondContact N-O 3.37Å; S136-Y225 PolarHBondContact O-N 3.48Å; T216-Y225 HydrophobicContact CG2-CE1 3.53Å; T216-Y225 WeakPolarHBondContact CG2-OH 3.47Å; F222-Y225 HydrophobicContact CE2-CD2 4.44Å; F222-Y225 HydrophobicContact CE2-CE1 4.25Å; F222-Y225 HydrophobicContact CE2-CE2 4.15Å; F222-Y225 HydrophobicContact CZ-CD2 4.08Å; F222-Y225 AromaticContact CZ-CE2 3.95Å; F222-Y225 HydrophobicContact CZ-CE2 3.95Å; Y225-W313 AromaticContact CD1-CH2 3.66Å; Y225-W313 HydrophobicContact CD1-CH2 3.66Å; Y225-W313 AromaticContact CD1-CZ2 3.63Å; Y225-W313 HydrophobicContact CD1-CZ2 3.63Å; Y225-W313 HydrophobicContact CD2-CH2 4.29Å; Y225-W313 AromaticContact CD2-CZ2 3.76Å; Y225-W313 HydrophobicContact CD2-CZ2 3.76Å; Y225-W313 HydrophobicContact CE1-CH2 4.06Å; Y225-W313 AromaticContact CE1-CZ2 3.63Å; Y225-W313 HydrophobicContact CE1-CZ2 3.63Å; Y225-W313 AromaticContact CE2-CZ2 3.77Å; Y225-W313 HydrophobicContact CE2-CZ2 3.77Å; Y225-W313 AromaticContact CG-CH2 3.78Å; Y225-W313 HydrophobicContact CG-CH2 3.78Å; Y225-W313 AromaticContact CG-CZ2 3.68Å; Y225-W313 HydrophobicContact CG-CZ2 3.68Å; Y225-W313 AromaticContact CZ-CZ2 3.71Å; Y225-D363 HydrophobicContact CD1-CB 3.95Å; Y225-D363 HydrophobicContact CE1-CB 4.08Å
226	G	93.2	Very high	89.9	Confident	0 Å²	0	43.1 Å²	43.1	0%	0	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.1	115.8	174.1	0	0	0	0	0	110.3	E361 L362	G226-E361 CarbonylContact O-C 3.48Å; G226-E361 WeakPolarHBondContact O-CA 2.88Å; G226-L362 PolarHBondContact N-O 3.12Å; G226-L362 PolarHBondContact O-N 3.42Å
227	H	93.7	Very high	90.3	Very high	15 Å²	15	44.1 Å²	44.1	7%	0.069	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	108.4	-178.8	-175.2	-160.5	0	0	0	110.3	F133 V134 S359	F133-H227 WeakPolarHBondContact CA-O 3.49Å; V134-H227 PolarHBondContact N-O 3.08Å; V134-H227 WeakPolarHBondContact O-CA 3.38Å; V134-H227 VanDerWaalsContact O-CB 3.31Å; V134-H227 WeakPolarHBondContact O-CB 3.4Å; V134-H227 PolarHBondContact O-N 3.07Å; H227-S359 PolarHBondContact NE2-OG 3.37Å
228	F	94.7	Very high	90.6	Very high	0 Å²	0	52 Å²	52	0%	0	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.7	106.3	173.2	179.7	-133.8	0	0	0	109.2	V118 A131 F133 A248 L250 Y283 I350 F358 S359 L360	V118-F228 HydrophobicContact CG1-CE2 4.1Å; V118-F228 HydrophobicContact CG2-CE2 4.5Å; A131-F228 HydrophobicContact CB-CE2 3.93Å; A131-F228 HydrophobicContact CB-CZ 4.5Å; F133-F228 HydrophobicContact CD2-CB 3.98Å; F133-F228 HydrophobicContact CE2-CB 4.39Å; F228-A248 HydrophobicContact CZ-CB 3.88Å; F228-L250 HydrophobicContact CB-CD2 4.06Å; F228-L250 HydrophobicContact CD1-CB 4.27Å; F228-L250 HydrophobicContact CD2-CB 4.02Å; F228-L250 HydrophobicContact CE1-CB 4.26Å; F228-L250 HydrophobicContact CE2-CB 4.02Å; F228-L250 HydrophobicContact CG-CB 4.15Å; F228-L250 HydrophobicContact CG-CD2 4.2Å; F228-L250 HydrophobicContact CZ-CB 4.14Å; F228-Y283 AromaticContact CD1-CE1 4Å; F228-Y283 HydrophobicContact CD1-CE1 4Å; F228-Y283 HydrophobicContact CE1-CD1 4.48Å; F228-Y283 AromaticContact CE1-CE1 3.93Å; F228-Y283 HydrophobicContact CE1-CE1 3.93Å; F228-I350 HydrophobicContact CE1-CG2 4.22Å; F228-I350 HydrophobicContact CZ-CG2 4.43Å; F228-F358 HydrophobicContact CD1-CD2 4.39Å; F228-F358 AromaticContact CD1-CE2 3.82Å; F228-F358 HydrophobicContact CD1-CE2 3.82Å; F228-F358 HydrophobicContact CD2-CE2 4.17Å; F228-F358 HydrophobicContact CE1-CD2 4.26Å; F228-F358 AromaticContact CE1-CE2 3.5Å; F228-F358 HydrophobicContact CE1-CE2 3.5Å; F228-F358 HydrophobicContact CE1-CZ 4.25Å; F228-F358 AromaticContact CE2-CE2 3.87Å; F228-F358 HydrophobicContact CE2-CE2 3.87Å; F228-F358 HydrophobicContact CE2-CZ 4.15Å; F228-F358 HydrophobicContact CG-CE2 4.15Å; F228-F358 AromaticContact CZ-CE2 3.53Å; F228-F358 HydrophobicContact CZ-CE2 3.53Å; F228-F358 AromaticContact CZ-CZ 3.85Å; F228-F358 HydrophobicContact CZ-CZ 3.85Å; F228-S359 CarbonylContact O-C 3.53Å; F228-S359 WeakPolarHBondContact O-CA 3.45Å; F228-L360 HydrophobicContact CB-CB 4.32Å; F228-L360 HydrophobicContact CD1-CB 4.36Å; F228-L360 PolarHBondContact N-O 2.91Å; F228-L360 PolarHBondContact O-N 2.82Å
229	R	92.2	Very high	90.9	Very high	75 Å²	75	57.1 Å²	57.1	28%	0.283	26%	0.263	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131	159.3	-178.4	67.8	176.8	-177.4	-178.4	0.8	111.4	A131 E132 F358	A131-R229 WeakPolarHBondContact CA-O 3.39Å; E132-R229 HydrophobicContact CG-CG 3.94Å; E132-R229 PolarHBondContact N-O 2.78Å; E132-R229 PolarHBondContact O-N 3.27Å; E132-R229 VanDerWaalsContact O-N 3.1Å; E132-R229 IonicContact OE1-CZ 2.59Å; E132-R229 IonicContact OE1-NE 2.72Å; E132-R229 PolarHBondContact OE1-NE 2.89Å; E132-R229 IonicContact OE1-NH2 3.15Å; E132-R229 PolarHBondContact OE1-NH2 3.18Å; R229-F358 VanDerWaalsContact CA-O 3.29Å; R229-F358 WeakPolarHBondContact CA-O 3.07Å
230	G	92.9	Very high	91	Very high	2 Å²	2	59.2 Å²	59.2	2%	0.021	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	174.7	-167.5	178	0	0	0	0	0	112.5	W130 P357 F358	W130-G230 CarbonylContact O-C 3.55Å; W130-G230 WeakPolarHBondContact O-CA 3.35Å; G230-P357 CarbonylContact O-C 3.48Å; G230-P357 VanDerWaalsContact O-CA 3.29Å; G230-P357 WeakPolarHBondContact O-CA 3.4Å; G230-F358 VanDerWaalsContact C-CE1 3.46Å; G230-F358 PolarHBondContact N-O 3.29Å; G230-F358 VanDerWaalsContact N-O 3.09Å; G230-F358 WeakPolarHBondContact O-CD1 3.31Å; G230-F358 PolarHBondContact O-N 3.48Å
231	F	94.1	Very high	91.3	Very high	34 Å²	34	56.8 Å²	56.8	15%	0.149	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.2	121.4	174.1	-170.6	-83.4	0	0	0	108.6	S129 W130 I153 E355 G356 P357	S129-F231 WeakPolarHBondContact CA-O 3.17Å; S129-F231 WeakPolarHBondContact CB-O 3.44Å; W130-F231 PolarHBondContact N-O 3.45Å; W130-F231 PolarHBondContact O-N 3.4Å; I153-F231 HydrophobicContact CD1-CD2 4.14Å; I153-F231 HydrophobicContact CD1-CE2 3.81Å; I153-F231 HydrophobicContact CD1-CZ 4.13Å; I153-F231 HydrophobicContact CG1-CD2 4.05Å; I153-F231 HydrophobicContact CG1-CE2 4.18Å; I153-F231 HydrophobicContact CG2-CB 3.51Å; I153-F231 HydrophobicContact CG2-CD1 3.95Å; I153-F231 HydrophobicContact CG2-CD2 3.69Å; I153-F231 HydrophobicContact CG2-CE2 4.38Å; I153-F231 HydrophobicContact CG2-CG 3.44Å; I153-F231 VanDerWaalsContact CG2-CG 3.44Å; F231-E355 HydrophobicContact CE1-CG 3.84Å; F231-E355 HydrophobicContact CZ-CG 3.92Å; F231-G356 WeakPolarHBondContact CA-O 3.48Å; F231-G356 VanDerWaalsContact CD2-C 3.48Å; F231-P357 HydrophobicContact CD2-CB 4.39Å
232	I	94.5	Very high	91.7	Very high	0 Å²	0	55 Å²	55	0%	0	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.1	128.4	172.2	-65.6	-54.2	0	0	0	108.2	A248 I350 E355 G356 F358	I232-A248 HydrophobicContact CD1-CB 3.82Å; I232-I350 HydrophobicContact CD1-CG2 4.02Å; I232-I350 HydrophobicContact CG1-CD1 4.24Å; I232-I350 HydrophobicContact CG1-CG1 4.43Å; I232-I350 HydrophobicContact CG1-CG2 4.43Å; I232-E355 WeakPolarHBondContact O-CA 3.36Å; I232-E355 WeakPolarHBondContact O-CG 3.12Å; I232-G356 PolarHBondContact N-O 3.41Å; I232-G356 PolarHBondContact O-N 2.9Å; I232-F358 HydrophobicContact CD1-CD1 4.04Å; I232-F358 HydrophobicContact CD1-CE1 3.61Å; I232-F358 HydrophobicContact CD1-CZ 4.46Å; I232-F358 HydrophobicContact CG1-CD1 3.62Å; I232-F358 HydrophobicContact CG1-CE1 3.75Å
233	S	94.7	Very high	91.9	Very high	6 Å²	6	58.8 Å²	58.8	4%	0.042	29%	0.293	C	S	.	.			trans	-116.4	129.7	167.2	-167.9	0	0	0	0	109.4	S129 R235 G246 E355	S129-S233 PolarHBondContact OG-N 3.49Å; S129-S233 PolarHBondContact OG-O 3.24Å; S233-R235 PolarHBondContact O-N 3.17Å; S233-R235 WeakPolarHBondContact OG-CG 3.44Å; S233-G246 VanDerWaalsContact O-CA 3.27Å; S233-G246 WeakPolarHBondContact O-CA 3.43Å; S233-G246 PolarHBondContact O-N 2.65Å; S233-E355 PolarHBondContact OG-OE1 3.2Å
234	T	93.8	Very high	92.1	Very high	52 Å²	52	62 Å²	62	32%	0.319	31%	0.309	S	S	.	.			trans	-84	6	177	53.4	0	0	0	0	112.5	V236 A245 E355	T234-V236 PolarHBondContact O-N 3.48Å; T234-A245 WeakPolarHBondContact CA-O 3.44Å; T234-E355 HydrophobicContact CG2-CB 4.44Å
235	R	93.3	Very high	92.2	Very high	164 Å²	164	62.5 Å²	62.5	62%	0.619	31%	0.312	S	S	*	.	P	Polyproline II helix	trans	-71.9	118.7	-179.4	-64.3	179.1	-168.8	-168.3	0.4	110.6	Y128 S233 E355	Y128-R235 HydrophobicContact CD2-CB 3.85Å; Y128-R235 WeakPolarHBondContact CD2-O 3.49Å; Y128-R235 HydrophobicContact CE2-CB 4.41Å; S233-R235 PolarHBondContact O-N 3.17Å; S233-R235 WeakPolarHBondContact OG-CG 3.44Å; R235-E355 IonicContact NE-OE1 3.73Å
236	V	93.3	Very high	92.3	Very high	48 Å²	48	62.1 Å²	62.1	29%	0.291	31%	0.311	S	S	.	.	P	Polyproline II helix	trans	-84.7	139.9	176.6	-177.4	0	0	0	0	110.2	T234 L242 A245	T234-V236 PolarHBondContact O-N 3.48Å; V236-L242 HydrophobicContact CG1-CB 3.57Å; V236-L242 WeakPolarHBondContact CG1-O 3.38Å; V236-A245 HydrophobicContact CG2-CB 3.91Å
237	P	91.7	Very high	92.4	Very high	21 Å²	21	64.4 Å²	64.4	14%	0.136	32%	0.321	C	S	.	.	P	Polyproline II helix	trans	-63	151.1	172.9	26.9	-35.5	0	0	0	111.8	E126 R239 L242	E126-P237 VanDerWaalsContact O-CD 3.31Å; E126-P237 WeakPolarHBondContact O-CD 3.43Å; P237-R239 PolarHBondContact O-N 3.23Å; P237-L242 HydrophobicContact CG-CD1 3.76Å
238	K	89	Confident	92.5	Very high	221 Å²	221	63.7 Å²	63.7	96%	0.961	32%	0.318	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.9	33	-178.8	-61	-176.9	179.7	179.9	0	114.5
239	R	87.4	Confident	92.6	Very high	195 Å²	195	64.7 Å²	64.7	74%	0.736	32%	0.323	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.8	-26.9	178.8	-175.8	176	174.9	-159.1	0.1	112.3	P237 D241	P237-R239 PolarHBondContact O-N 3.23Å; R239-D241 VanDerWaalsContact C-N 3.3Å; R239-D241 VanDerWaalsContact CB-OD1 3.28Å; R239-D241 WeakPolarHBondContact CB-OD1 3.38Å; R239-D241 VanDerWaalsContact CD-CG 3.46Å; R239-D241 WeakPolarHBondContact CD-OD1 3.24Å; R239-D241 WeakPolarHBondContact CD-OD2 3.14Å; R239-D241 HydrophobicContact CG-CB 4.45Å; R239-D241 VanDerWaalsContact CG-OD1 3.24Å; R239-D241 WeakPolarHBondContact CG-OD1 3.37Å; R239-D241 IonicContact CZ-OD2 2.68Å; R239-D241 IonicContact NE-OD2 3.75Å; R239-D241 PolarHBondContact NE-OD2 3.48Å; R239-D241 IonicContact NH1-OD2 2.77Å; R239-D241 PolarHBondContact NH1-OD2 3.5Å; R239-D241 IonicContact NH2-OD2 3.65Å; R239-D241 PolarHBondContact O-N 2.96Å
240	G	87.3	Confident	92.8	Very high	75 Å²	75	61.1 Å²	61.1	77%	0.773	31%	0.31	S	S	*	.	S	Bend	trans	78.2	5.4	175.8	0	0	0	0	0	115.5
241	D	90.2	Very high	92.9	Very high	78 Å²	78	64.9 Å²	64.9	42%	0.417	32%	0.323	S	S	.	.	S	Bend	trans	-90.8	-32.6	175.4	58.6	-23.1	0	0	0	113	R239	R239-D241 VanDerWaalsContact C-N 3.3Å; R239-D241 VanDerWaalsContact CB-OD1 3.28Å; R239-D241 WeakPolarHBondContact CB-OD1 3.38Å; R239-D241 VanDerWaalsContact CD-CG 3.46Å; R239-D241 WeakPolarHBondContact CD-OD1 3.24Å; R239-D241 WeakPolarHBondContact CD-OD2 3.14Å; R239-D241 HydrophobicContact CG-CB 4.45Å; R239-D241 VanDerWaalsContact CG-OD1 3.24Å; R239-D241 WeakPolarHBondContact CG-OD1 3.37Å; R239-D241 IonicContact CZ-OD2 2.68Å; R239-D241 IonicContact NE-OD2 3.75Å; R239-D241 PolarHBondContact NE-OD2 3.48Å; R239-D241 IonicContact NH1-OD2 2.77Å; R239-D241 PolarHBondContact NH1-OD2 3.5Å; R239-D241 IonicContact NH2-OD2 3.65Å; R239-D241 PolarHBondContact O-N 2.96Å
242	L	91.6	Very high	92.9	Very high	46 Å²	46	63.4 Å²	63.4	24%	0.241	32%	0.317	C	S	.	.			trans	-92.4	139.7	-177.9	-68.5	157.9	0	0	0	110.7	E126 V236 P237	E126-L242 HydrophobicContact CB-CD1 3.88Å; E126-L242 HydrophobicContact CB-CD2 4.48Å; E126-L242 HydrophobicContact CG-CD1 4.09Å; E126-L242 HydrophobicContact CG-CD2 4.42Å; V236-L242 HydrophobicContact CG1-CB 3.57Å; V236-L242 WeakPolarHBondContact CG1-O 3.38Å; P237-L242 HydrophobicContact CG-CD1 3.76Å
243	V	92.1	Very high	92.7	Very high	118 Å²	118	64.1 Å²	64.1	72%	0.715	32%	0.322	S	S	*	.	S	Bend	trans	-101.2	-36.4	176.9	-175	0	0	0	0	111.2
244	H	92.4	Very high	92.3	Very high	142 Å²	142	67 Å²	67	66%	0.657	33%	0.334	S	S	*	.			trans	-132.7	146.3	-179.2	-58.4	97.9	0	0	0	109.9
245	A	93.3	Very high	91.7	Very high	11 Å²	11	64.9 Å²	64.9	9%	0.091	32%	0.322	C	S	.	.			trans	-137.4	168	173.9	0	0	0	0	0	108.4	E126 T234 V236	E126-A245 WeakPolarHBondContact O-CB 3.33Å; T234-A245 WeakPolarHBondContact CA-O 3.44Å; V236-A245 HydrophobicContact CG2-CB 3.91Å
246	G	93.4	Very high	91.2	Very high	1 Å²	1	61.5 Å²	61.5	1%	0.01	31%	0.312	C	S	.	.			trans	111	65.4	179.8	0	0	0	0	0	114	D121 S129 S233	D121-G246 WeakPolarHBondContact OD2-CA 3.32Å; D121-G246 PolarHBondContact OD2-N 2.98Å; S129-G246 WeakPolarHBondContact OG-CA 3.27Å; S233-G246 VanDerWaalsContact O-CA 3.27Å; S233-G246 WeakPolarHBondContact O-CA 3.43Å; S233-G246 PolarHBondContact O-N 2.65Å
247	F	95.1	Very high	90.6	Very high	48 Å²	48	60.5 Å²	60.5	21%	0.211	31%	0.305	C	S	.	.			trans	-133.9	148.4	170.1	76	-94.3	0	0	0	112.7	T120 D121 I350 M351	T120-F247 WeakPolarHBondContact CA-O 3.44Å; D121-F247 HydrophobicContact CB-CD1 3.73Å; D121-F247 HydrophobicContact CB-CE1 3.55Å; D121-F247 HydrophobicContact CB-CG 4.45Å; D121-F247 HydrophobicContact CB-CZ 4.14Å; D121-F247 PolarHBondContact N-O 3.16Å; F247-I350 VanDerWaalsContact CA-O 3.31Å; F247-I350 WeakPolarHBondContact CA-O 3.46Å; F247-M351 HydrophobicContact CB-CB 4.26Å; F247-M351 HydrophobicContact CB-CG 4.26Å
248	A	96.2	Very high	90.1	Very high	0 Å²	0	64.4 Å²	64.4	0%	0	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.8	144	167.1	0	0	0	0	0	109.9	T120 A131 F228 I232 T349 I350 F358	T120-A248 HydrophobicContact CG2-CB 3.99Å; A131-A248 HydrophobicContact CB-CB 3.76Å; F228-A248 HydrophobicContact CZ-CB 3.88Å; I232-A248 HydrophobicContact CD1-CB 3.82Å; A248-T349 CarbonylContact O-C 3.54Å; A248-T349 WeakPolarHBondContact O-CA 3.39Å; A248-I350 HydrophobicContact CB-CG2 3.69Å; A248-I350 PolarHBondContact N-O 3.06Å; A248-I350 VanDerWaalsContact N-O 3.09Å; A248-I350 WeakPolarHBondContact O-CG2 3.34Å; A248-I350 PolarHBondContact O-N 2.76Å; A248-F358 HydrophobicContact CB-CE1 4.06Å; A248-F358 HydrophobicContact CB-CZ 3.62Å
249	N	96.5	Very high	89.5	Confident	21 Å²	21	56.7 Å²	56.7	11%	0.112	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.1	128.1	-175.2	179.9	14.1	0	0	0	110.2	V118 T119 S347 F348 T349	V118-N249 CarbonylContact C-O 3.55Å; V118-N249 WeakPolarHBondContact CA-O 3.4Å; T119-N249 PolarHBondContact N-O 3.46Å; T119-N249 PolarHBondContact O-N 3.22Å; T119-N249 WeakPolarHBondContact OG1-CB 3.5Å; N249-S347 VanDerWaalsContact OD1-CB 3.28Å; N249-S347 WeakPolarHBondContact OD1-CB 3.44Å; N249-S347 PolarHBondContact OD1-OG 3.25Å; N249-F348 CarbonylContact C-O 3.55Å; N249-F348 WeakPolarHBondContact CA-O 3.49Å; N249-F348 PolarHBondContact OD1-O 3.45Å; N249-T349 HydrophobicContact CB-CG2 4.49Å; N249-T349 PolarHBondContact OD1-OG1 3.14Å
250	L	97.1	Very high	89.3	Confident	0 Å²	0	50.1 Å²	50.1	0%	0	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	118.7	171	173.4	67.4	0	0	0	109.1	W116 V118 F133 F228 S347 F348 L362	W116-L250 HydrophobicContact CB-CD1 4.26Å; W116-L250 HydrophobicContact CE3-CD1 3.8Å; W116-L250 HydrophobicContact CE3-CD2 4.13Å; W116-L250 HydrophobicContact CE3-CG 3.82Å; W116-L250 HydrophobicContact CZ3-CD2 4.22Å; W116-L250 HydrophobicContact CZ3-CG 4.15Å; V118-L250 HydrophobicContact CG2-CD1 3.87Å; F133-L250 HydrophobicContact CB-CD1 3.94Å; F133-L250 HydrophobicContact CD1-CD1 4Å; F133-L250 HydrophobicContact CD2-CD1 3.81Å; F133-L250 HydrophobicContact CD2-CD2 3.77Å; F133-L250 HydrophobicContact CD2-CG 4.46Å; F133-L250 HydrophobicContact CE1-CD1 4.45Å; F133-L250 HydrophobicContact CE2-CD1 4.3Å; F133-L250 HydrophobicContact CE2-CD2 3.65Å; F133-L250 HydrophobicContact CG-CD1 3.65Å; F133-L250 HydrophobicContact CG-CD2 4.45Å; F133-L250 HydrophobicContact CZ-CD2 4.22Å; F228-L250 HydrophobicContact CB-CD2 4.06Å; F228-L250 HydrophobicContact CD1-CB 4.27Å; F228-L250 HydrophobicContact CD2-CB 4.02Å; F228-L250 HydrophobicContact CE1-CB 4.26Å; F228-L250 HydrophobicContact CE2-CB 4.02Å; F228-L250 HydrophobicContact CG-CB 4.15Å; F228-L250 HydrophobicContact CG-CD2 4.2Å; F228-L250 HydrophobicContact CZ-CB 4.14Å; L250-S347 CarbonylContact O-C 3.47Å; L250-S347 WeakPolarHBondContact O-CA 3.3Å; L250-S347 WeakPolarHBondContact O-CB 3.42Å; L250-F348 HydrophobicContact CB-CB 4.43Å; L250-F348 HydrophobicContact CD2-CD2 4.21Å; L250-F348 PolarHBondContact N-O 3.19Å; L250-F348 PolarHBondContact O-N 3.05Å; L250-L362 HydrophobicContact CD2-CD1 4.02Å
251	R	94.8	Very high	89.2	Confident	81 Å²	81	48.3 Å²	48.3	31%	0.306	26%	0.26	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	133.7	-176.4	-171.2	-169.9	-65.6	174.6	2.7	111.5	L117 L345	L117-R251 HydrophobicContact CB-CB 4.43Å; L117-R251 PolarHBondContact N-O 2.81Å; L117-R251 PolarHBondContact O-N 2.77Å; R251-L345 HydrophobicContact CG-CD1 4.48Å; R251-L345 HydrophobicContact CG-CD2 4.25Å
252	S	93.2	Very high	88.9	Confident	3 Å²	3	47.4 Å²	47.4	2%	0.021	25%	0.254	C	S	.	.	P	Polyproline II helix	trans	-61	153.4	169.5	71.5	0	0	0	0	111.2	L345 L346	S252-L345 WeakPolarHBondContact O-CD2 3.46Å; S252-L346 WeakPolarHBondContact CB-O 3.46Å; S252-L346 PolarHBondContact N-O 3.22Å; S252-L346 PolarHBondContact OG-N 2.99Å; S252-L346 PolarHBondContact OG-O 3.37Å; S252-L346 VanDerWaalsContact OG-O 3.09Å
253	P	90.4	Very high	88.6	Confident	16 Å²	16	47 Å²	47	10%	0.104	25%	0.254	C	S	.	.	P	Polyproline II helix	trans	-59.3	163	169.2	23.3	-31.6	0	0	0	111.9	N115 T191 Y264 L345	N115-P253 HydrophobicContact CB-CB 3.89Å; N115-P253 HydrophobicContact CB-CG 4.46Å; T191-P253 HydrophobicContact CG2-CG 3.9Å; P253-Y264 PolarHBondContact O-OH 3.17Å; P253-L345 WeakPolarHBondContact O-CD2 3.21Å
254	E	85.9	Confident	88.1	Confident	65 Å²	65	42.2 Å²	42.2	30%	0.304	22%	0.224	S	C	.	.	P	Polyproline II helix	trans	-92.9	130.4	170.9	-68.8	178.2	169.3	0	0	109.5	K256 R344 L345	E254-K256 HydrophobicContact CB-CG 4.4Å; E254-K256 PolarHBondContact O-N 2.64Å; E254-K256 WeakPolarHBondContact OE2-CE 3.11Å; E254-K256 IonicContact OE2-NZ 3.35Å; E254-K256 PolarHBondContact OE2-NZ 3.29Å; E254-R344 IonicContact OE1-CZ 2.87Å; E254-R344 IonicContact OE1-NH1 2.67Å; E254-R344 PolarHBondContact OE1-NH1 3.17Å; E254-L345 HydrophobicContact CB-CD2 4.43Å; E254-L345 HydrophobicContact CG-CD1 4.23Å; E254-L345 HydrophobicContact CG-CD2 3.52Å; E254-L345 HydrophobicContact CG-CG 4.08Å
255	S	82.8	Confident	87.5	Confident	9 Å²	9	37 Å²	37	6%	0.063	21%	0.208	C	C	.	.			trans	-71	111.9	166.9	178	0	0	0	0	109.4	R83 M262	R83-S255 PolarHBondContact NH1-OG 3.44Å; R83-S255 PolarHBondContact NH2-OG 2.96Å; S255-M262 PolarHBondContact O-N 3.11Å
256	K	81.9	Confident	87.1	Confident	93 Å²	93	36.4 Å²	36.4	40%	0.404	20%	0.203	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	145.6	173.2	-68.1	176.9	-178.8	166.9	0	109.3	R83 E254 C260 V261	R83-K256 PolarHBondContact NH2-O 2.84Å; E254-K256 HydrophobicContact CB-CG 4.4Å; E254-K256 PolarHBondContact O-N 2.64Å; E254-K256 WeakPolarHBondContact OE2-CE 3.11Å; E254-K256 IonicContact OE2-NZ 3.35Å; E254-K256 PolarHBondContact OE2-NZ 3.29Å; K256-C260 CarbonylContact C-O 3.53Å; K256-C260 VanDerWaalsContact CA-O 3.29Å; K256-C260 WeakPolarHBondContact CA-O 3.37Å; K256-V261 HydrophobicContact CG-CG2 4.37Å
257	L	80	Confident	86.7	Confident	26 Å²	26	42.4 Å²	42.4	14%	0.136	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.4	116	171.3	178.2	63.5	0	0	0	108	E76 L80 G259 C260 M262	E76-L257 VanDerWaalsContact OE2-CA 3.26Å; E76-L257 WeakPolarHBondContact OE2-CA 3.39Å; L80-L257 HydrophobicContact CB-CD1 3.97Å; L80-L257 HydrophobicContact CD1-CD1 4.03Å; L80-L257 HydrophobicContact CD1-CD2 3.82Å; L257-G259 PolarHBondContact O-N 2.61Å; L257-G259 VanDerWaalsContact O-N 3.16Å; L257-C260 PolarHBondContact N-O 3.22Å; L257-C260 WeakPolarHBondContact O-CA 3.29Å; L257-C260 VanDerWaalsContact O-CB 3.28Å; L257-C260 WeakPolarHBondContact O-CB 3.21Å; L257-C260 PolarHBondContact O-N 2.67Å; L257-M262 HydrophobicContact CB-CG 3.84Å
258	F	81.2	Confident	86.3	Confident	103 Å²	103	40.5 Å²	40.5	45%	0.452	22%	0.224	S	C	.	.	T	Hydrogen-bonded Turn	trans	50.8	36.6	-174.5	-57.9	-67.9	0	0	0	113.3	L73 E76 L77 L80 C260	L73-F258 HydrophobicContact CD2-CD1 3.68Å; L73-F258 HydrophobicContact CD2-CE1 3.82Å; E76-F258 HydrophobicContact CB-CD1 4.13Å; E76-F258 HydrophobicContact CB-CE1 4.04Å; E76-F258 PolarHBondContact OE2-N 3.17Å; L77-F258 HydrophobicContact CD2-CZ 4.02Å; L77-F258 HydrophobicContact CG-CE1 4.47Å; L77-F258 HydrophobicContact CG-CZ 4.4Å; L80-F258 HydrophobicContact CD1-CE2 4.49Å; L80-F258 HydrophobicContact CD2-CE2 3.94Å; L80-F258 HydrophobicContact CD2-CZ 4.03Å; F258-C260 PolarHBondContact O-N 2.94Å
259	G	77.2	Confident	86	Confident	60 Å²	60	40.9 Å²	40.9	62%	0.619	23%	0.226	S	C	*	.	T	Hydrogen-bonded Turn	trans	77.9	-7.2	-176.2	0	0	0	0	0	115.1	L257	L257-G259 PolarHBondContact O-N 2.61Å; L257-G259 VanDerWaalsContact O-N 3.16Å
260	C	82.2	Confident	85.8	Confident	57 Å²	57	40.9 Å²	40.9	39%	0.385	23%	0.227	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.4	132	171.3	-173.3	0	0	0	0	110.2	K256 L257 F258	K256-C260 CarbonylContact C-O 3.53Å; K256-C260 VanDerWaalsContact CA-O 3.29Å; K256-C260 WeakPolarHBondContact CA-O 3.37Å; L257-C260 PolarHBondContact N-O 3.22Å; L257-C260 WeakPolarHBondContact O-CA 3.29Å; L257-C260 VanDerWaalsContact O-CB 3.28Å; L257-C260 WeakPolarHBondContact O-CB 3.21Å; L257-C260 PolarHBondContact O-N 2.67Å; F258-C260 PolarHBondContact O-N 2.94Å
261	V	85.1	Confident	85.7	Confident	36 Å²	36	41.1 Å²	41.1	22%	0.218	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.2	125.4	176.4	-175.6	0	0	0	0	109.9	K256 R290 R344	K256-V261 HydrophobicContact CG-CG2 4.37Å; V261-R290 PolarHBondContact O-NE 3.04Å; V261-R344 HydrophobicContact CG1-CG 3.65Å
262	M	84.1	Confident	85.6	Confident	60 Å²	60	37.4 Å²	37.4	30%	0.296	21%	0.214	S	C	.	.			trans	-109.1	139.2	-176.4	-68.5	-62	-61.7	0	0	110.7	S255 L257	S255-M262 PolarHBondContact O-N 3.11Å; L257-M262 HydrophobicContact CB-CG 3.84Å
263	P	85.3	Confident	85.6	Confident	37 Å²	37	37.5 Å²	37.5	24%	0.24	22%	0.215	C	C	.	.			trans	-71.7	159.8	170.6	32.3	-35	0	0	0	110.9	G265 G341 M343	P263-G265 VanDerWaalsContact C-N 3.33Å; P263-G341 VanDerWaalsContact CB-O 3.23Å; P263-G341 WeakPolarHBondContact CB-O 3.19Å; P263-G341 WeakPolarHBondContact CG-O 3.37Å; P263-M343 CarbonylContact C-O 3.59Å; P263-M343 VanDerWaalsContact CA-O 3.25Å; P263-M343 WeakPolarHBondContact CA-O 3.26Å
264	Y	83	Confident	85.9	Confident	18 Å²	18	36.7 Å²	36.7	7%	0.071	21%	0.21	C	C	.	.			trans	-75.8	-19.2	178.4	-70.6	-50.9	0	0	0	114.5	R100 F102 H192 P253 M343 R344	R100-Y264 PolarHBondContact NH1-O 2.94Å; F102-Y264 HydrophobicContact CD2-CG 4.48Å; F102-Y264 AromaticContact CE2-CD1 3.66Å; F102-Y264 HydrophobicContact CE2-CD1 3.66Å; F102-Y264 AromaticContact CE2-CD2 3.56Å; F102-Y264 HydrophobicContact CE2-CD2 3.56Å; F102-Y264 AromaticContact CE2-CE1 3.79Å; F102-Y264 HydrophobicContact CE2-CE1 3.79Å; F102-Y264 AromaticContact CE2-CE2 3.6Å; F102-Y264 HydrophobicContact CE2-CE2 3.6Å; F102-Y264 AromaticContact CE2-CG 3.56Å; F102-Y264 HydrophobicContact CE2-CG 3.56Å; F102-Y264 AromaticContact CE2-CZ 3.7Å; F102-Y264 HydrophobicContact CZ-CD1 4.4Å; F102-Y264 AromaticContact CZ-CD2 3.9Å; F102-Y264 HydrophobicContact CZ-CD2 3.9Å; F102-Y264 HydrophobicContact CZ-CE1 4.12Å; F102-Y264 AromaticContact CZ-CE2 3.47Å; F102-Y264 HydrophobicContact CZ-CE2 3.47Å; F102-Y264 VanDerWaalsContact CZ-CE2 3.47Å; F102-Y264 HydrophobicContact CZ-CG 4.32Å; F102-Y264 AromaticContact CZ-CZ 3.59Å; H192-Y264 AromaticContact CE1-CD1 3.55Å; H192-Y264 AromaticContact CE1-CE1 2.87Å; H192-Y264 WeakPolarHBondContact CE1-CE1 3.45Å; H192-Y264 AromaticContact CE1-CZ 3.53Å; H192-Y264 AromaticContact ND1-CD1 3.61Å; H192-Y264 AromaticContact ND1-CE1 3.43Å; H192-Y264 WeakPolarHBondContact ND1-CE1 3.22Å; H192-Y264 AromaticContact NE2-CE1 3.33Å; H192-Y264 VanDerWaalsContact NE2-CE1 3.33Å; H192-Y264 WeakPolarHBondContact NE2-CE1 3.16Å; P253-Y264 PolarHBondContact O-OH 3.17Å; Y264-M343 HydrophobicContact CD2-CE 3.88Å; Y264-M343 HydrophobicContact CG-CE 4.45Å; Y264-M343 PolarHBondContact N-O 3.11Å; Y264-R344 WeakPolarHBondContact CE2-O 3.44Å
265	G	79.7	Confident	86.2	Confident	31 Å²	31	33.6 Å²	33.6	32%	0.32	20%	0.195	S	C	.	.			trans	66.8	73	-178.6	0	0	0	0	0	111.3	R100 P263	R100-G265 PolarHBondContact NH1-O 3.42Å; R100-G265 VanDerWaalsContact NH1-O 3.17Å; P263-G265 VanDerWaalsContact C-N 3.33Å
266	C	84.3	Confident	86.7	Confident	0 Å²	0	33.8 Å²	33.8	0%	0	20%	0.195	C	C	.	.			trans	-104.2	8	-177.4	-56.5	0	0	0	0	113.2	A268 Y269 L340 M343 L367	C266-A268 PolarHBondContact O-N 3.35Å; C266-A268 VanDerWaalsContact O-N 3.14Å; C266-Y269 PolarHBondContact O-N 2.63Å; C266-Y269 VanDerWaalsContact O-N 3.11Å; C266-L340 PolarHBondContact N-O 3.42Å; C266-M343 WeakPolarHBondContact SG-CE 3.37Å; C266-L367 HydrophobicContact CB-CD1 3.93Å; C266-L367 WeakPolarHBondContact SG-CD1 3.5Å
267	E	85.2	Confident	87.1	Confident	127 Å²	127	30.7 Å²	30.7	59%	0.593	18%	0.18	S	C	*	.	T	Hydrogen-bonded Turn	trans	-58.1	-27.8	-173.8	-171.3	179.4	177.5	0	0	114.5	K94 Y269 L340	K94-E267 WeakPolarHBondContact CE-O 3.39Å; E267-Y269 VanDerWaalsContact C-N 3.28Å; E267-Y269 PolarHBondContact O-N 3.03Å; E267-L340 HydrophobicContact CB-CB 4.39Å
268	A	87.1	Confident	87.6	Confident	8 Å²	8	29.5 Å²	29.5	7%	0.066	18%	0.175	C	C	.	.	T	Hydrogen-bonded Turn	trans	-79.4	-4.6	-179.4	0	0	0	0	0	114.3	E92 K94 C266 F369	E92-A268 HydrophobicContact CB-CB 3.65Å; E92-A268 WeakPolarHBondContact O-CB 3.44Å; K94-A268 HydrophobicContact CG-CB 4.49Å; C266-A268 PolarHBondContact O-N 3.35Å; C266-A268 VanDerWaalsContact O-N 3.14Å; A268-F369 WeakPolarHBondContact O-CD2 3.48Å
269	Y	90	Very high	88	Confident	8 Å²	8	27 Å²	27	3%	0.031	17%	0.166	C	C	.	.			trans	-121	150.6	-173	-52.3	-78.8	0	0	0	112.4	E92 R100 C266 E267 L340 L367 F369	E92-Y269 WeakPolarHBondContact OE2-CE2 3.18Å; E92-Y269 PolarHBondContact OE2-OH 3.03Å; R100-Y269 HydrophobicContact CB-CE1 3.97Å; R100-Y269 HydrophobicContact CB-CE2 4.18Å; R100-Y269 WeakPolarHBondContact CB-OH 3.41Å; R100-Y269 WeakPolarHBondContact CD-OH 3.04Å; C266-Y269 PolarHBondContact O-N 2.63Å; C266-Y269 VanDerWaalsContact O-N 3.11Å; E267-Y269 VanDerWaalsContact C-N 3.28Å; E267-Y269 PolarHBondContact O-N 3.03Å; Y269-L340 WeakPolarHBondContact O-CD1 3.28Å; Y269-L367 HydrophobicContact CD1-CB 3.91Å; Y269-L367 HydrophobicContact CD2-CB 3.55Å; Y269-L367 HydrophobicContact CD2-CD1 3.71Å; Y269-L367 HydrophobicContact CD2-CG 4.22Å; Y269-L367 HydrophobicContact CE1-CB 4.42Å; Y269-L367 HydrophobicContact CE2-CB 4.1Å; Y269-L367 HydrophobicContact CE2-CD1 4.04Å; Y269-L367 HydrophobicContact CG-CB 3.47Å; Y269-L367 VanDerWaalsContact CG-CB 3.47Å; Y269-L367 HydrophobicContact CG-CD1 4.45Å; Y269-L367 HydrophobicContact CG-CG 4.5Å; Y269-F369 HydrophobicContact CD1-CB 4.24Å
270	S	91.9	Very high	88.6	Confident	21 Å²	21	26.2 Å²	26.2	15%	0.147	16%	0.158	C	C	.	.	S	Bend	trans	-106.5	-21.5	179.4	51.8	0	0	0	0	113.2	L320 Y368 D370	S270-L320 WeakPolarHBondContact O-CB 2.86Å; S270-L320 PolarHBondContact O-N 3.26Å; S270-Y368 PolarHBondContact N-O 2.86Å; S270-D370 PolarHBondContact OG-N 3.05Å; S270-D370 PolarHBondContact OG-O 3.45Å
271	H	93.7	Very high	89.1	Confident	4 Å²	4	25 Å²	25	2%	0.019	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	142.6	-174.2	-63	73.9	0	0	0	112.5	K317 I318 L367 Y368 D370	H271-K317 HydrophobicContact CB-CG 4.33Å; H271-K317 VanDerWaalsContact CD2-CE 3.43Å; H271-K317 WeakPolarHBondContact CD2-CE 3.44Å; H271-K317 WeakPolarHBondContact NE2-CE 3.22Å; H271-I318 CarbonylContact C-O 3.57Å; H271-I318 VanDerWaalsContact CA-O 3.24Å; H271-I318 WeakPolarHBondContact CA-O 3.35Å; H271-L367 CarbonylContact O-C 3.53Å; H271-L367 WeakPolarHBondContact O-CA 3.28Å; H271-Y368 HydrophobicContact CB-CD1 4.31Å; H271-Y368 PolarHBondContact N-O 3.4Å; H271-Y368 PolarHBondContact O-N 3.25Å; H271-D370 WeakPolarHBondContact CE1-CB 3.47Å
272	L	94.1	Very high	89.6	Confident	3 Å²	3	27.6 Å²	27.6	2%	0.016	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.1	129.9	162.7	-175.8	68.9	0	0	0	109.1	I274 I285 I318 L320 F323 L346 I365 L367	L272-I274 HydrophobicContact CD2-CD1 3.92Å; L272-I274 HydrophobicContact CD2-CG1 4.35Å; L272-I274 HydrophobicContact CG-CD1 4.26Å; L272-I274 HydrophobicContact CG-CG1 4.14Å; L272-I285 HydrophobicContact CD2-CD1 4.36Å; L272-I285 HydrophobicContact CD2-CG2 4.11Å; L272-I318 HydrophobicContact CB-CB 4.44Å; L272-I318 PolarHBondContact N-O 3.25Å; L272-I318 PolarHBondContact O-N 2.84Å; L272-L320 HydrophobicContact CB-CD2 4.09Å; L272-F323 HydrophobicContact CD2-CZ 3.97Å; L272-L346 HydrophobicContact CD1-CD1 4.01Å; L272-L346 HydrophobicContact CD2-CD1 4.02Å; L272-I365 HydrophobicContact CD1-CG2 3.79Å; L272-L367 HydrophobicContact CD1-CD2 4.02Å
273	I	93.6	Very high	90.2	Very high	5 Å²	5	24.7 Å²	24.7	3%	0.026	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113	130.9	174.9	-56.5	163.4	0	0	0	109	T99 P203 I315 A316 Y364 I365 G366 Y368	T99-I273 HydrophobicContact CG2-CD1 4.05Å; P203-I273 HydrophobicContact CB-CD1 3.59Å; P203-I273 HydrophobicContact CB-CG1 3.9Å; P203-I273 HydrophobicContact CB-CG2 4.23Å; P203-I273 HydrophobicContact CG-CD1 3.21Å; P203-I273 HydrophobicContact CG-CG1 3.98Å; I273-I315 HydrophobicContact CG2-CG2 3.59Å; I273-A316 VanDerWaalsContact CA-O 3.27Å; I273-A316 WeakPolarHBondContact CA-O 3.29Å; I273-Y364 HydrophobicContact CG2-CE2 3.93Å; I273-I365 CarbonylContact O-C 3.47Å; I273-I365 WeakPolarHBondContact O-CA 3.33Å; I273-G366 PolarHBondContact N-O 3.29Å; I273-G366 PolarHBondContact O-N 3.2Å; I273-Y368 HydrophobicContact CD1-CD2 4.32Å; I273-Y368 HydrophobicContact CD1-CG 3.96Å
274	I	94.9	Very high	90.8	Very high	0 Å²	0	24.8 Å²	24.8	0%	0	14%	0.136	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.9	126.6	175.1	-54.9	173.7	0	0	0	108	L272 Y276 I285 I315 A316 I318 F348 L362 I365	L272-I274 HydrophobicContact CD2-CD1 3.92Å; L272-I274 HydrophobicContact CD2-CG1 4.35Å; L272-I274 HydrophobicContact CG-CD1 4.26Å; L272-I274 HydrophobicContact CG-CG1 4.14Å; I274-Y276 HydrophobicContact CB-CD1 4.47Å; I274-Y276 HydrophobicContact CG2-CD1 4.15Å; I274-I285 HydrophobicContact CD1-CD1 3.52Å; I274-I315 CarbonylContact O-C 3.29Å; I274-I315 WeakPolarHBondContact O-CA 3.38Å; I274-A316 PolarHBondContact N-O 2.78Å; I274-A316 PolarHBondContact O-N 3.41Å; I274-I318 HydrophobicContact CD1-CD1 4.35Å; I274-F348 HydrophobicContact CD1-CE1 3.79Å; I274-F348 HydrophobicContact CD1-CZ 3.87Å; I274-L362 HydrophobicContact CG2-CD2 4.04Å; I274-I365 HydrophobicContact CG1-CG2 4.38Å; I274-I365 HydrophobicContact CG2-CG1 4.5Å
275	R	92.7	Very high	91.4	Very high	0 Å²	0	23.9 Å²	23.9	0%	0	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.7	115.7	165.7	-177.1	171.7	173.4	-143.5	2.4	109	A212 W313 Q314 I315 D363 Y364	A212-R275 PolarHBondContact O-NH1 3.06Å; A212-R275 VanDerWaalsContact O-NH1 3.13Å; R275-W313 HydrophobicContact CG-CB 4.45Å; R275-W313 HydrophobicContact CG-CE3 3.94Å; R275-Q314 CarbonylContact C-O 3.43Å; R275-Q314 VanDerWaalsContact CA-O 3.24Å; R275-Q314 WeakPolarHBondContact CA-O 3.28Å; R275-I315 HydrophobicContact CB-CG1 4.15Å; R275-I315 HydrophobicContact CG-CG1 4Å; R275-D363 HydrophobicContact CB-CB 4.21Å; R275-D363 VanDerWaalsContact CD-OD2 3.28Å; R275-D363 WeakPolarHBondContact CD-OD2 3.26Å; R275-D363 HydrophobicContact CG-CB 4.07Å; R275-D363 IonicContact CZ-OD2 3.54Å; R275-D363 IonicContact NE-OD2 3.35Å; R275-D363 IonicContact NH1-OD2 2.73Å; R275-D363 PolarHBondContact NH1-OD2 3.16Å; R275-D363 PolarHBondContact O-N 2.95Å; R275-Y364 HydrophobicContact CB-CD1 3.83Å; R275-Y364 HydrophobicContact CB-CD2 4.34Å; R275-Y364 HydrophobicContact CB-CE1 3.45Å; R275-Y364 VanDerWaalsContact CB-CE1 3.45Å; R275-Y364 HydrophobicContact CB-CE2 4Å; R275-Y364 HydrophobicContact CB-CG 4.25Å; R275-Y364 HydrophobicContact CG-CE1 4.1Å; R275-Y364 PolarHBondContact N-O 3.46Å
276	Y	93.3	Very high	92.2	Very high	13 Å²	13	23 Å²	23	5%	0.051	12%	0.121	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.2	163.1	-172.6	69.6	-85.3	0	0	0	111.8	I274 L305 Y306 T307 W313 Q314 A316 L360 E361	I274-Y276 HydrophobicContact CB-CD1 4.47Å; I274-Y276 HydrophobicContact CG2-CD1 4.15Å; Y276-L305 HydrophobicContact CD1-CD2 4.46Å; Y276-L305 HydrophobicContact CE1-CD1 3.88Å; Y276-Y306 PolarHBondContact OH-O 3.48Å; Y276-T307 HydrophobicContact CD2-CG2 4.04Å; Y276-T307 HydrophobicContact CE2-CG2 3.72Å; Y276-W313 VanDerWaalsContact C-CE3 3.49Å; Y276-Q314 HydrophobicContact CE1-CB 4.24Å; Y276-Q314 HydrophobicContact CE2-CB 4.36Å; Y276-Q314 PolarHBondContact N-O 3.46Å; Y276-Q314 PolarHBondContact O-N 3.4Å; Y276-A316 HydrophobicContact CD1-CB 4.4Å; Y276-A316 HydrophobicContact CE1-CB 3.69Å; Y276-L360 HydrophobicContact CD2-CD1 4.1Å; Y276-L360 HydrophobicContact CG-CD1 4.46Å; Y276-E361 CarbonylContact C-O 3.59Å; Y276-E361 WeakPolarHBondContact CA-O 3.33Å; Y276-E361 WeakPolarHBondContact CB-O 3.47Å
277	R	90.9	Very high	92.7	Very high	27 Å²	27	23.1 Å²	23.1	10%	0.102	12%	0.122	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	136.5	159	-72.9	165.5	138.1	175.9	-6.8	107.5	A140 G142 P311 W313 E361	A140-R277 PolarHBondContact O-NH1 3.21Å; A140-R277 PolarHBondContact O-NH2 3.15Å; G142-R277 WeakPolarHBondContact O-CB 3.5Å; R277-P311 PolarHBondContact NE-O 3.36Å; R277-P311 PolarHBondContact NH2-O 3.45Å; R277-W313 HydrophobicContact CB-CE3 4.43Å; R277-W313 HydrophobicContact CG-CB 4.31Å; R277-W313 HydrophobicContact CG-CD2 3.61Å; R277-W313 HydrophobicContact CG-CE3 3.69Å; R277-W313 HydrophobicContact CG-CG 3.89Å; R277-W313 HydrophobicContact CG-CZ2 4.5Å; R277-W313 HydrophobicContact CG-CZ3 4.16Å; R277-E361 HydrophobicContact CB-CB 4.18Å; R277-E361 VanDerWaalsContact CD-OE2 3.23Å; R277-E361 WeakPolarHBondContact CD-OE2 3.38Å; R277-E361 PolarHBondContact N-O 3.1Å; R277-E361 IonicContact NH1-OE2 3.06Å; R277-E361 PolarHBondContact NH1-OE2 3.27Å; R277-E361 PolarHBondContact O-N 3.12Å
278	G	89.4	Confident	93	Very high	2 Å²	2	18.7 Å²	18.7	2%	0.021	10%	0.102	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.7	172.2	-179.9	0	0	0	0	0	112.5
279	D	89.5	Confident	93.2	Very high	49 Å²	49	19.5 Å²	19.5	26%	0.262	11%	0.107	S	C	.	.			trans	-92.1	-5.2	-175.7	56.3	-3.7	0	0	0	113.7	R281 F358 S359	D279-R281 WeakPolarHBondContact OD1-CB 3.19Å; D279-R281 PolarHBondContact OD1-N 2.73Å; D279-R281 WeakPolarHBondContact OD2-CD 3.31Å; D279-R281 WeakPolarHBondContact OD2-CG 3.45Å; D279-R281 IonicContact OD2-NE 3.14Å; D279-F358 WeakPolarHBondContact OD2-CA 3.15Å; D279-F358 WeakPolarHBondContact OD2-CB 3.29Å; D279-S359 PolarHBondContact N-O 3.09Å; D279-S359 PolarHBondContact OD2-N 3.14Å
280	G	91.1	Very high	93.1	Very high	44 Å²	44	23.9 Å²	23.9	45%	0.454	12%	0.123	S	C	.	.	S	Bend	trans	99	1.1	-174.6	0	0	0	0	0	113.9	T307	G280-T307 WeakPolarHBondContact CA-O 3.49Å; G280-T307 VanDerWaalsContact CA-OG1 3.29Å; G280-T307 WeakPolarHBondContact CA-OG1 3.16Å; G280-T307 PolarHBondContact N-OG1 3.07Å
281	R	93	Very high	92.7	Very high	33 Å²	33	24.7 Å²	24.7	13%	0.125	13%	0.132	C	C	.	.			trans	-84.2	165.5	175.9	-62.2	-171.7	177.6	-129.3	6	112.7	D279 Y283 T307 I350 D352 I354 G356 P357	D279-R281 WeakPolarHBondContact OD1-CB 3.19Å; D279-R281 PolarHBondContact OD1-N 2.73Å; D279-R281 WeakPolarHBondContact OD2-CD 3.31Å; D279-R281 WeakPolarHBondContact OD2-CG 3.45Å; D279-R281 IonicContact OD2-NE 3.14Å; R281-Y283 HydrophobicContact CB-CE2 4.16Å; R281-T307 PolarHBondContact N-OG1 3.11Å; R281-T307 VanDerWaalsContact N-OG1 3.1Å; R281-T307 PolarHBondContact O-N 2.98Å; R281-T307 PolarHBondContact O-OG1 2.62Å; R281-I350 HydrophobicContact CB-CD1 4.3Å; R281-I350 VanDerWaalsContact CD-CD1 3.48Å; R281-D352 WeakPolarHBondContact CD-OD2 3.47Å; R281-D352 IonicContact CZ-OD2 3.8Å; R281-D352 IonicContact NE-OD2 3.85Å; R281-D352 IonicContact NH1-OD1 3.97Å; R281-D352 PolarHBondContact NH1-OD1 2.68Å; R281-D352 IonicContact NH1-OD2 3.26Å; R281-D352 PolarHBondContact NH1-OD2 2.77Å; R281-I354 PolarHBondContact NH1-O 3.04Å; R281-G356 VanDerWaalsContact NH2-CA 3.35Å; R281-G356 PolarHBondContact NH2-O 2.86Å; R281-G356 VanDerWaalsContact NH2-O 3.12Å; R281-P357 PolarHBondContact NE-O 3.46Å; R281-P357 VanDerWaalsContact NE-O 3.14Å; R281-P357 PolarHBondContact NH2-O 3.21Å
282	K	95.2	Very high	92	Very high	89 Å²	89	30 Å²	30	39%	0.387	16%	0.156	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.3	125.4	175.6	64.1	-177.9	-178.2	-177.6	0	110.2	T304 Y306 D352	K282-T304 HydrophobicContact CB-CG2 4.01Å; K282-Y306 HydrophobicContact CB-CD1 4.48Å; K282-D352 HydrophobicContact CD-CB 4.24Å; K282-D352 VanDerWaalsContact CE-CA 3.43Å; K282-D352 HydrophobicContact CG-CB 3.83Å
283	Y	96.9	Very high	91.5	Very high	0 Å²	0	37.8 Å²	37.8	0%	0	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	134.2	174.8	-69.5	-92.8	0	0	0	109.6	F228 R281 T304 L305 T307 T349 I350 F358 L360	F228-Y283 AromaticContact CD1-CE1 4Å; F228-Y283 HydrophobicContact CD1-CE1 4Å; F228-Y283 HydrophobicContact CE1-CD1 4.48Å; F228-Y283 AromaticContact CE1-CE1 3.93Å; F228-Y283 HydrophobicContact CE1-CE1 3.93Å; R281-Y283 HydrophobicContact CB-CE2 4.16Å; Y283-T304 CarbonylContact O-C 3.56Å; Y283-L305 PolarHBondContact N-O 3.39Å; Y283-L305 WeakPolarHBondContact O-CA 3.49Å; Y283-L305 WeakPolarHBondContact O-CB 3.05Å; Y283-L305 PolarHBondContact O-N 3.46Å; Y283-T307 HydrophobicContact CD2-CG2 3.72Å; Y283-T307 HydrophobicContact CE2-CG2 3.98Å; Y283-T349 CarbonylContact C-O 3.59Å; Y283-I350 HydrophobicContact CD1-CB 3.89Å; Y283-I350 HydrophobicContact CE1-CB 3.78Å; Y283-I350 HydrophobicContact CE1-CD1 4.17Å; Y283-I350 HydrophobicContact CE1-CG1 4.45Å; Y283-I350 HydrophobicContact CE1-CG2 4.25Å; Y283-F358 HydrophobicContact CE1-CD2 4.39Å; Y283-F358 WeakPolarHBondContact OH-CD2 3.22Å; Y283-L360 HydrophobicContact CD1-CD2 4.01Å; Y283-L360 HydrophobicContact CD2-CD1 4.43Å; Y283-L360 HydrophobicContact CD2-CD2 4.36Å; Y283-L360 HydrophobicContact CE1-CB 4.1Å; Y283-L360 HydrophobicContact CE1-CD2 4.09Å; Y283-L360 HydrophobicContact CE2-CB 4.1Å; Y283-L360 HydrophobicContact CE2-CD1 4.27Å; Y283-L360 HydrophobicContact CE2-CD2 4.43Å; Y283-L360 HydrophobicContact CG-CD2 4.15Å
284	Q	96.9	Very high	91	Very high	38 Å²	38	41.8 Å²	41.8	18%	0.178	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.1	118.3	169.4	-59.3	-57.4	-25.2	0	0	109.4	V286 T304 F348 T349	Q284-V286 HydrophobicContact CB-CG2 4.35Å; Q284-T304 VanDerWaalsContact CD-OG1 3.23Å; Q284-T304 PolarHBondContact NE2-OG1 3.29Å; Q284-T304 PolarHBondContact OE1-OG1 2.84Å; Q284-F348 WeakPolarHBondContact O-CA 3.28Å; Q284-T349 PolarHBondContact N-O 3.32Å; Q284-T349 PolarHBondContact O-N 3.19Å
285	I	96.6	Very high	90.5	Very high	0 Å²	0	50.2 Å²	50.2	0%	0	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.2	116.2	166.3	-55.9	176	0	0	0	106.6	L272 I274 Q302 F303 L305 I318 F323 L346 S347 F348	L272-I285 HydrophobicContact CD2-CD1 4.36Å; L272-I285 HydrophobicContact CD2-CG2 4.11Å; I274-I285 HydrophobicContact CD1-CD1 3.52Å; I285-Q302 CarbonylContact O-C 3.57Å; I285-Q302 VanDerWaalsContact O-CA 3.29Å; I285-Q302 WeakPolarHBondContact O-CA 2.97Å; I285-F303 HydrophobicContact CD1-CD1 4.31Å; I285-F303 PolarHBondContact N-O 2.71Å; I285-F303 PolarHBondContact O-N 3.23Å; I285-L305 HydrophobicContact CD1-CB 3.9Å; I285-L305 HydrophobicContact CD1-CD2 4.33Å; I285-L305 HydrophobicContact CD1-CG 4.49Å; I285-L305 HydrophobicContact CG1-CB 3.96Å; I285-I318 HydrophobicContact CD1-CD1 3.53Å; I285-F323 HydrophobicContact CB-CE1 4.14Å; I285-F323 HydrophobicContact CB-CZ 4.4Å; I285-F323 HydrophobicContact CG2-CE1 3.85Å; I285-F323 HydrophobicContact CG2-CZ 4.05Å; I285-L346 HydrophobicContact CG2-CD1 4.49Å; I285-L346 HydrophobicContact CG2-CG 4.35Å; I285-S347 CarbonylContact C-O 3.55Å; I285-S347 WeakPolarHBondContact CA-O 3.29Å; I285-F348 HydrophobicContact CD1-CE1 4.24Å; I285-F348 HydrophobicContact CG1-CD1 3.98Å; I285-F348 HydrophobicContact CG1-CE1 3.86Å
286	V	95.5	Very high	90.1	Very high	12 Å²	12	56.6 Å²	56.6	7%	0.073	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	125.7	178.4	-172.9	0	0	0	0	108.8	Q284 L288 T300 H301 Q302 L346 S347	Q284-V286 HydrophobicContact CB-CG2 4.35Å; V286-L288 HydrophobicContact CB-CD1 4.39Å; V286-L288 HydrophobicContact CG1-CD1 3.75Å; V286-L288 HydrophobicContact CG1-CG 4.33Å; V286-T300 HydrophobicContact CG1-CG2 4.18Å; V286-H301 WeakPolarHBondContact CA-O 2.87Å; V286-Q302 HydrophobicContact CB-CG 4.46Å; V286-Q302 HydrophobicContact CG1-CG 4.14Å; V286-Q302 HydrophobicContact CG2-CG 4.08Å; V286-L346 CarbonylContact O-C 3.59Å; V286-L346 WeakPolarHBondContact O-CA 3.14Å; V286-S347 WeakPolarHBondContact CB-OG 3.41Å; V286-S347 PolarHBondContact N-O 2.84Å; V286-S347 PolarHBondContact O-N 2.9Å
287	V	94.3	Very high	89.7	Confident	2 Å²	2	63.5 Å²	63.5	1%	0.012	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	118.8	174.1	180	0	0	0	0	107.9	H301 F323 V338 M343	V287-H301 HydrophobicContact CB-CB 4.46Å; V287-H301 PolarHBondContact N-O 3.18Å; V287-H301 PolarHBondContact O-N 3.29Å; V287-F323 HydrophobicContact CG2-CD1 4.03Å; V287-F323 HydrophobicContact CG2-CE1 3.65Å; V287-F323 HydrophobicContact CG2-CZ 4.36Å; V287-V338 HydrophobicContact CG1-CG1 4.19Å; V287-M343 HydrophobicContact CG1-CG 3.53Å; V287-M343 HydrophobicContact CG1-SD 3.68Å
288	L	92	Very high	89.6	Confident	34 Å²	34	68.2 Å²	68.2	18%	0.178	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	121.1	177.3	-58.2	79.8	0	0	0	109	V286 T300 R344 L345	V286-L288 HydrophobicContact CB-CD1 4.39Å; V286-L288 HydrophobicContact CG1-CD1 3.75Å; V286-L288 HydrophobicContact CG1-CG 4.33Å; L288-T300 HydrophobicContact CD2-CG2 4.34Å; L288-T300 HydrophobicContact CG-CG2 3.94Å; L288-R344 WeakPolarHBondContact O-CA 3.36Å; L288-R344 WeakPolarHBondContact O-CB 3.36Å; L288-R344 PolarHBondContact O-N 3.28Å; L288-L345 HydrophobicContact CB-CB 4.12Å; L288-L345 HydrophobicContact CD1-CB 4.05Å; L288-L345 HydrophobicContact CD2-CD1 4.42Å; L288-L345 PolarHBondContact N-O 3.26Å; L288-L345 PolarHBondContact O-N 3.47Å; L288-L345 VanDerWaalsContact O-N 3.09Å
289	P	91.1	Very high	89.7	Confident	25 Å²	25	69.2 Å²	69.2	16%	0.162	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.9	165.2	169.5	31.8	-33.4	0	0	0	111.3	A291 N299 R342	P289-A291 PolarHBondContact O-N 2.99Å; P289-N299 WeakPolarHBondContact CD-O 3.34Å; P289-R342 CarbonylContact C-O 3.59Å; P289-R342 WeakPolarHBondContact CA-O 3Å; P289-R342 HydrophobicContact CB-CB 4.45Å
290	R	88	Confident	90	Very high	100 Å²	100	67.7 Å²	67.7	38%	0.377	31%	0.314	S	S	.	.	P	Polyproline II helix	trans	-75.5	117	166.9	-178.7	-177.4	175	-159.3	1	109	V261 E292 R342 R344	V261-R290 PolarHBondContact O-NE 3.04Å; R290-E292 PolarHBondContact O-N 2.97Å; R290-R342 PolarHBondContact N-O 3.16Å; R290-R344 HydrophobicContact CB-CB 4.24Å
291	A	83.4	Confident	90.1	Very high	39 Å²	39	65.7 Å²	65.7	32%	0.322	29%	0.292	S	S	.	.	P	Polyproline II helix	trans	-75.7	120.2	173.2	0	0	0	0	0	110.4	P289 R297	P289-A291 PolarHBondContact O-N 2.99Å; A291-R297 HydrophobicContact CB-CB 4.41Å; A291-R297 HydrophobicContact CB-CG 3.88Å
292	E	78.8	Confident	90.2	Very high	115 Å²	115	65.1 Å²	65.1	54%	0.537	29%	0.291	S	S	.	.	S	Bend	trans	-83.3	-38.6	169.5	-69.2	174.4	-174.2	0	0	111	R290 R342	R290-E292 PolarHBondContact O-N 2.97Å; E292-R342 IonicContact OE1-CZ 2.75Å; E292-R342 IonicContact OE1-NE 2.94Å; E292-R342 PolarHBondContact OE1-NE 2.74Å; E292-R342 IonicContact OE1-NH2 3.89Å; E292-R342 PolarHBondContact OE1-NH2 3.19Å; E292-R342 IonicContact OE2-NH2 3.02Å
293	W	84.1	Confident	90.3	Very high	166 Å²	166	63 Å²	63	63%	0.629	28%	0.282	S	S	*	.	S	Bend	trans	-111	148.8	-179.2	-62.2	91.4	0	0	0	110.7	F295 Y296	W293-F295 PolarHBondContact O-N 3.09Å; W293-Y296 HydrophobicContact CB-CD2 3.92Å; W293-Y296 HydrophobicContact CB-CE2 4.29Å; W293-Y296 HydrophobicContact CG-CD2 4.45Å; W293-Y296 HydrophobicContact CG-CE2 4.47Å; W293-Y296 PolarHBondContact O-N 2.85Å; W293-Y296 VanDerWaalsContact O-N 3.1Å
294	D	82.4	Confident	90.3	Very high	89 Å²	89	64 Å²	64	48%	0.476	29%	0.288	S	S	.	.	G	3₁₀ helix	trans	-56.2	-39.7	179.7	-157.2	-15.6	0	0	0	111.9	Y296 R297	D294-Y296 PolarHBondContact O-N 3.1Å; D294-Y296 VanDerWaalsContact O-N 3.07Å; D294-R297 WeakPolarHBondContact O-CB 3.1Å; D294-R297 VanDerWaalsContact O-CG 3.28Å; D294-R297 WeakPolarHBondContact O-CG 3.28Å; D294-R297 PolarHBondContact O-N 3.12Å; D294-R297 VanDerWaalsContact O-N 3.09Å; D294-R297 WeakPolarHBondContact OD1-CD 3.42Å; D294-R297 IonicContact OD1-CZ 3.48Å; D294-R297 IonicContact OD1-NE 3.67Å; D294-R297 PolarHBondContact OD1-NE 3.49Å; D294-R297 VanDerWaalsContact OD1-NE 3.14Å; D294-R297 IonicContact OD1-NH1 3.1Å; D294-R297 PolarHBondContact OD1-NH1 2.49Å; D294-R297 IonicContact OD1-NH2 3.68Å; D294-R297 IonicContact OD2-CZ 3.81Å; D294-R297 IonicContact OD2-NH1 3.79Å; D294-R297 PolarHBondContact OD2-NH1 2.73Å; D294-R297 VanDerWaalsContact OD2-NH1 3.1Å; D294-R297 IonicContact OD2-NH2 2.63Å
295	F	84.6	Confident	90.2	Very high	177 Å²	177	62.4 Å²	62.4	78%	0.776	28%	0.281	S	S	*	.	G	3₁₀ helix	trans	-56.8	-28.1	178.8	-58.5	-67.4	0	0	0	114.3	W293	W293-F295 PolarHBondContact O-N 3.09Å
296	Y	84.6	Confident	90.2	Very high	134 Å²	134	70.2 Å²	70.2	53%	0.525	31%	0.312	S	S	.	.	G	3₁₀ helix	trans	-97	4.1	-176.7	-57.9	-45.9	0	0	0	113.7	W293 D294 F298 N299	W293-Y296 HydrophobicContact CB-CD2 3.92Å; W293-Y296 HydrophobicContact CB-CE2 4.29Å; W293-Y296 HydrophobicContact CG-CD2 4.45Å; W293-Y296 HydrophobicContact CG-CE2 4.47Å; W293-Y296 PolarHBondContact O-N 2.85Å; W293-Y296 VanDerWaalsContact O-N 3.1Å; D294-Y296 PolarHBondContact O-N 3.1Å; D294-Y296 VanDerWaalsContact O-N 3.07Å; Y296-F298 PolarHBondContact O-N 3.36Å; Y296-N299 VanDerWaalsContact CD1-ND2 3.31Å; Y296-N299 WeakPolarHBondContact CD1-ND2 3.33Å; Y296-N299 WeakPolarHBondContact O-CB 3.43Å; Y296-N299 PolarHBondContact O-N 2.86Å; Y296-N299 VanDerWaalsContact O-N 3.14Å
297	R	86.2	Confident	90	Very high	159 Å²	159	70 Å²	70	60%	0.6	31%	0.311	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.5	-31.9	-177.1	-74.1	-177.7	-175.7	163.7	-2.8	114.1	A291 D294	A291-R297 HydrophobicContact CB-CB 4.41Å; A291-R297 HydrophobicContact CB-CG 3.88Å; D294-R297 WeakPolarHBondContact O-CB 3.1Å; D294-R297 VanDerWaalsContact O-CG 3.28Å; D294-R297 WeakPolarHBondContact O-CG 3.28Å; D294-R297 PolarHBondContact O-N 3.12Å; D294-R297 VanDerWaalsContact O-N 3.09Å; D294-R297 WeakPolarHBondContact OD1-CD 3.42Å; D294-R297 IonicContact OD1-CZ 3.48Å; D294-R297 IonicContact OD1-NE 3.67Å; D294-R297 PolarHBondContact OD1-NE 3.49Å; D294-R297 VanDerWaalsContact OD1-NE 3.14Å; D294-R297 IonicContact OD1-NH1 3.1Å; D294-R297 PolarHBondContact OD1-NH1 2.49Å; D294-R297 IonicContact OD1-NH2 3.68Å; D294-R297 IonicContact OD2-CZ 3.81Å; D294-R297 IonicContact OD2-NH1 3.79Å; D294-R297 PolarHBondContact OD2-NH1 2.73Å; D294-R297 VanDerWaalsContact OD2-NH1 3.1Å; D294-R297 IonicContact OD2-NH2 2.63Å
298	F	89.1	Confident	89.5	Confident	126 Å²	126	78.4 Å²	78.4	55%	0.553	34%	0.342	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.6	0.6	-178.5	-57.2	-69.9	0	0	0	113.9	Y296 T300 S327 S328	Y296-F298 PolarHBondContact O-N 3.36Å; F298-T300 PolarHBondContact O-N 3.03Å; F298-S327 WeakPolarHBondContact O-CA 3.45Å; F298-S328 WeakPolarHBondContact CB-OG 3.38Å; F298-S328 PolarHBondContact O-N 3.09Å
299	N	91.3	Very high	89	Confident	23 Å²	23	79.2 Å²	79.2	12%	0.123	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.9	124.2	179.9	-74.7	0.8	0	0	0	110.2	P289 Y296 H325 S327	P289-N299 WeakPolarHBondContact CD-O 3.34Å; Y296-N299 VanDerWaalsContact CD1-ND2 3.31Å; Y296-N299 WeakPolarHBondContact CD1-ND2 3.33Å; Y296-N299 WeakPolarHBondContact O-CB 3.43Å; Y296-N299 PolarHBondContact O-N 2.86Å; Y296-N299 VanDerWaalsContact O-N 3.14Å; N299-H325 PolarHBondContact OD1-CE1 2.84Å; N299-S327 PolarHBondContact OD1-OG 3.44Å
300	T	94.1	Very high	88.4	Confident	16 Å²	16	78.8 Å²	78.8	10%	0.098	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.3	161.9	179.2	65	0	0	0	0	109.4	V286 L288 F298 Q302 H325 T326	V286-T300 HydrophobicContact CG1-CG2 4.18Å; L288-T300 HydrophobicContact CD2-CG2 4.34Å; L288-T300 HydrophobicContact CG-CG2 3.94Å; F298-T300 PolarHBondContact O-N 3.03Å; T300-Q302 PolarHBondContact OG1-NE2 3.35Å; T300-H325 WeakPolarHBondContact O-CA 3.47Å; T300-H325 PolarHBondContact O-ND1 2.76Å; T300-H325 VanDerWaalsContact O-ND1 3.16Å; T300-T326 PolarHBondContact N-O 2.86Å; T300-T326 PolarHBondContact O-N 3.2Å; T300-T326 PolarHBondContact OG1-O 2.84Å
301	H	94.8	Very high	88.1	Confident	2 Å²	2	76.5 Å²	76.5	1%	0.009	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	136	169.4	-61.2	81.7	0	0	0	108.8	V286 V287 F323 Y324 F336 V338	V286-H301 WeakPolarHBondContact CA-O 2.87Å; V287-H301 HydrophobicContact CB-CB 4.46Å; V287-H301 PolarHBondContact N-O 3.18Å; V287-H301 PolarHBondContact O-N 3.29Å; H301-F323 HydrophobicContact CB-CB 4.08Å; H301-F323 HydrophobicContact CB-CD1 4.47Å; H301-Y324 CarbonylContact C-O 3.52Å; H301-Y324 VanDerWaalsContact CA-O 3.25Å; H301-Y324 WeakPolarHBondContact CA-O 3.29Å; H301-F336 AromaticContact CE1-CE2 3.72Å; H301-F336 AromaticContact NE2-CD2 3.74Å; H301-F336 AromaticContact NE2-CE2 3.44Å; H301-F336 WeakPolarHBondContact NE2-CE2 3.42Å; H301-V338 HydrophobicContact CB-CG2 3.72Å
302	Q	95.4	Very high	88.2	Confident	22 Å²	22	83.1 Å²	83.1	10%	0.103	38%	0.375	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	149.7	-170.1	-58.5	-172	-4	0	0	111.3	I285 V286 T300 F323 Y324	I285-Q302 CarbonylContact O-C 3.57Å; I285-Q302 VanDerWaalsContact O-CA 3.29Å; I285-Q302 WeakPolarHBondContact O-CA 2.97Å; V286-Q302 HydrophobicContact CB-CG 4.46Å; V286-Q302 HydrophobicContact CG1-CG 4.14Å; V286-Q302 HydrophobicContact CG2-CG 4.08Å; T300-Q302 PolarHBondContact OG1-NE2 3.35Å; Q302-F323 WeakPolarHBondContact O-CA 3.25Å; Q302-Y324 HydrophobicContact CB-CE1 4.24Å; Q302-Y324 HydrophobicContact CB-CE2 3.87Å; Q302-Y324 PolarHBondContact N-O 2.87Å; Q302-Y324 WeakPolarHBondContact O-CD1 3.23Å; Q302-Y324 VanDerWaalsContact O-CE1 3.25Å; Q302-Y324 WeakPolarHBondContact O-CE1 3.15Å; Q302-Y324 PolarHBondContact O-N 3.09Å
303	F	96.3	Very high	88.7	Confident	43 Å²	43	79.4 Å²	79.4	19%	0.189	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.4	135.2	172	176.8	-95.3	0	0	0	109.9	I285 L305 I318 K322 F323	I285-F303 HydrophobicContact CD1-CD1 4.31Å; I285-F303 PolarHBondContact N-O 2.71Å; I285-F303 PolarHBondContact O-N 3.23Å; F303-L305 PolarHBondContact O-N 3.1Å; F303-I318 HydrophobicContact CD1-CD1 4.01Å; F303-I318 HydrophobicContact CD1-CG2 3.65Å; F303-I318 HydrophobicContact CD2-CG2 4.2Å; F303-I318 HydrophobicContact CE1-CB 4.49Å; F303-I318 HydrophobicContact CE1-CD1 3.84Å; F303-I318 HydrophobicContact CE1-CG1 4.07Å; F303-I318 HydrophobicContact CE1-CG2 3.61Å; F303-I318 HydrophobicContact CE2-CG2 4.17Å; F303-I318 HydrophobicContact CG-CG2 3.95Å; F303-I318 HydrophobicContact CZ-CG2 3.88Å; F303-K322 HydrophobicContact CD2-CB 4.1Å; F303-K322 HydrophobicContact CE2-CB 4.12Å; F303-F323 HydrophobicContact CB-CD1 3.63Å; F303-F323 HydrophobicContact CB-CD2 4.04Å; F303-F323 HydrophobicContact CB-CE1 3.49Å; F303-F323 VanDerWaalsContact CB-CE1 3.49Å; F303-F323 HydrophobicContact CB-CE2 3.94Å; F303-F323 HydrophobicContact CB-CG 3.9Å; F303-F323 HydrophobicContact CB-CZ 3.66Å; F303-F323 HydrophobicContact CG-CE2 4.36Å; F303-F323 HydrophobicContact CG-CZ 4.36Å
304	T	96.5	Very high	88.9	Confident	22 Å²	22	73.7 Å²	73.7	14%	0.135	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.7	112.3	178.1	-50	0	0	0	0	111.3	K282 Y283 Q284 Y306	K282-T304 HydrophobicContact CB-CG2 4.01Å; Y283-T304 CarbonylContact O-C 3.56Å; Q284-T304 VanDerWaalsContact CD-OG1 3.23Å; Q284-T304 PolarHBondContact NE2-OG1 3.29Å; Q284-T304 PolarHBondContact OE1-OG1 2.84Å; T304-Y306 HydrophobicContact CG2-CD1 4.41Å; T304-Y306 HydrophobicContact CG2-CD2 4.4Å; T304-Y306 HydrophobicContact CG2-CE1 3.95Å; T304-Y306 HydrophobicContact CG2-CE2 3.93Å; T304-Y306 PolarHBondContact O-N 3.03Å
305	L	96.2	Very high	89.4	Confident	5 Å²	5	70.8 Å²	70.8	3%	0.026	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.5	108.9	167.8	-178.5	66.3	0	0	0	110.3	Y276 Y283 I285 F303 T307 A316 I318 F348	Y276-L305 HydrophobicContact CD1-CD2 4.46Å; Y276-L305 HydrophobicContact CE1-CD1 3.88Å; Y283-L305 PolarHBondContact N-O 3.39Å; Y283-L305 WeakPolarHBondContact O-CA 3.49Å; Y283-L305 WeakPolarHBondContact O-CB 3.05Å; Y283-L305 PolarHBondContact O-N 3.46Å; I285-L305 HydrophobicContact CD1-CB 3.9Å; I285-L305 HydrophobicContact CD1-CD2 4.33Å; I285-L305 HydrophobicContact CD1-CG 4.49Å; I285-L305 HydrophobicContact CG1-CB 3.96Å; F303-L305 PolarHBondContact O-N 3.1Å; L305-T307 HydrophobicContact CG-CG2 4.5Å; L305-A316 HydrophobicContact CD1-CB 4.06Å; L305-I318 HydrophobicContact CD1-CD1 4.2Å; L305-F348 HydrophobicContact CD2-CE1 4.4Å
306	Y	94.6	Very high	89.9	Confident	163 Å²	163	63.2 Å²	63.2	64%	0.639	29%	0.29	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-83.9	113.7	170.5	-63	-80.1	0	0	0	109.8	Y276 K282 T304	Y276-Y306 PolarHBondContact OH-O 3.48Å; K282-Y306 HydrophobicContact CB-CD1 4.48Å; T304-Y306 HydrophobicContact CG2-CD1 4.41Å; T304-Y306 HydrophobicContact CG2-CD2 4.4Å; T304-Y306 HydrophobicContact CG2-CE1 3.95Å; T304-Y306 HydrophobicContact CG2-CE2 3.93Å; T304-Y306 PolarHBondContact O-N 3.03Å
307	T	91.5	Very high	90.3	Very high	9 Å²	9	59.8 Å²	59.8	6%	0.055	28%	0.278	C	S	.	.	P	Polyproline II helix	trans	-85.1	143.2	174.3	68.8	0	0	0	0	110.1	Y276 G280 R281 Y283 L305 L360	Y276-T307 HydrophobicContact CD2-CG2 4.04Å; Y276-T307 HydrophobicContact CE2-CG2 3.72Å; G280-T307 WeakPolarHBondContact CA-O 3.49Å; G280-T307 VanDerWaalsContact CA-OG1 3.29Å; G280-T307 WeakPolarHBondContact CA-OG1 3.16Å; G280-T307 PolarHBondContact N-OG1 3.07Å; R281-T307 PolarHBondContact N-OG1 3.11Å; R281-T307 VanDerWaalsContact N-OG1 3.1Å; R281-T307 PolarHBondContact O-N 2.98Å; R281-T307 PolarHBondContact O-OG1 2.62Å; Y283-T307 HydrophobicContact CD2-CG2 3.72Å; Y283-T307 HydrophobicContact CE2-CG2 3.98Å; L305-T307 HydrophobicContact CG-CG2 4.5Å; T307-L360 HydrophobicContact CG2-CD1 3.96Å
308	R	85.6	Confident	90.7	Very high	178 Å²	178	52.5 Å²	52.5	67%	0.672	25%	0.251	S	S	*	.	P	Polyproline II helix	trans	-92.3	120.9	166.4	-49.5	-66.7	-167.3	83.8	-1.5	107.3	G310 Q314	R308-G310 PolarHBondContact O-N 3.39Å; R308-Q314 PolarHBondContact O-NE2 3.5Å; R308-Q314 VanDerWaalsContact O-NE2 3.17Å
309	G	80.9	Confident	91.1	Very high	50 Å²	50	47.1 Å²	47.1	52%	0.515	23%	0.229	S	C	.	.	B	Isolated β-bridge	trans	-56.5	136.4	169.9	0	0	0	0	0	109.4
310	G	77.3	Confident	91.2	Very high	17 Å²	17	46.5 Å²	46.5	18%	0.175	23%	0.225	C	C	.	.	S	Bend	trans	145.6	163	177.7	0	0	0	0	0	113.3	C143 R308 Y312	C143-G310 WeakPolarHBondContact SG-CA 3.1Å; C143-G310 PolarHBondContact SG-O 2.9Å; C143-G310 VanDerWaalsContact SG-O 3.4Å; R308-G310 PolarHBondContact O-N 3.39Å; G310-Y312 PolarHBondContact O-N 3.46Å; G310-Y312 VanDerWaalsContact O-N 3.09Å
311	P	81.8	Confident	91.2	Very high	52 Å²	52	46 Å²	46	34%	0.338	22%	0.223	S	C	.	.	S	Bend	trans	-78.7	7.8	-169.6	32.7	-37.5	0	0	0	113	A141 R277	A141-P311 WeakPolarHBondContact O-CB 3.29Å; R277-P311 PolarHBondContact NE-O 3.36Å; R277-P311 PolarHBondContact NH2-O 3.45Å
312	Y	85.9	Confident	91.2	Very high	178 Å²	178	50 Å²	50	70%	0.698	24%	0.24	S	C	*	.	S	Bend	trans	-109.5	137	-168.9	-58	-66.4	0	0	0	112.8	G310 Q314	G310-Y312 PolarHBondContact O-N 3.46Å; G310-Y312 VanDerWaalsContact O-N 3.09Å; Y312-Q314 PolarHBondContact O-N 3.26Å; Y312-Q314 PolarHBondContact O-NE2 3.45Å
313	W	89.3	Confident	91.2	Very high	36 Å²	36	49 Å²	49	14%	0.136	24%	0.235	C	C	.	.			trans	-61.8	132.3	170.4	-70.8	100.1	0	0	0	111.1	Y225 R275 Y276 R277 E361 D363	Y225-W313 AromaticContact CD1-CH2 3.66Å; Y225-W313 HydrophobicContact CD1-CH2 3.66Å; Y225-W313 AromaticContact CD1-CZ2 3.63Å; Y225-W313 HydrophobicContact CD1-CZ2 3.63Å; Y225-W313 HydrophobicContact CD2-CH2 4.29Å; Y225-W313 AromaticContact CD2-CZ2 3.76Å; Y225-W313 HydrophobicContact CD2-CZ2 3.76Å; Y225-W313 HydrophobicContact CE1-CH2 4.06Å; Y225-W313 AromaticContact CE1-CZ2 3.63Å; Y225-W313 HydrophobicContact CE1-CZ2 3.63Å; Y225-W313 AromaticContact CE2-CZ2 3.77Å; Y225-W313 HydrophobicContact CE2-CZ2 3.77Å; Y225-W313 AromaticContact CG-CH2 3.78Å; Y225-W313 HydrophobicContact CG-CH2 3.78Å; Y225-W313 AromaticContact CG-CZ2 3.68Å; Y225-W313 HydrophobicContact CG-CZ2 3.68Å; Y225-W313 AromaticContact CZ-CZ2 3.71Å; R275-W313 HydrophobicContact CG-CB 4.45Å; R275-W313 HydrophobicContact CG-CE3 3.94Å; Y276-W313 VanDerWaalsContact C-CE3 3.49Å; R277-W313 HydrophobicContact CB-CE3 4.43Å; R277-W313 HydrophobicContact CG-CB 4.31Å; R277-W313 HydrophobicContact CG-CD2 3.61Å; R277-W313 HydrophobicContact CG-CE3 3.69Å; R277-W313 HydrophobicContact CG-CG 3.89Å; R277-W313 HydrophobicContact CG-CZ2 4.5Å; R277-W313 HydrophobicContact CG-CZ3 4.16Å; W313-E361 HydrophobicContact CH2-CB 3.88Å; W313-E361 HydrophobicContact CZ3-CB 4.3Å; W313-D363 HydrophobicContact CE3-CB 4.06Å; W313-D363 HydrophobicContact CH2-CB 3.92Å; W313-D363 HydrophobicContact CZ3-CB 3.62Å
314	Q	89.2	Confident	91.1	Very high	46 Å²	46	48.8 Å²	48.8	22%	0.215	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	148.2	178.2	-70.7	162.7	58.8	0	0	109.6	R275 Y276 R308 Y312	R275-Q314 CarbonylContact C-O 3.43Å; R275-Q314 VanDerWaalsContact CA-O 3.24Å; R275-Q314 WeakPolarHBondContact CA-O 3.28Å; Y276-Q314 HydrophobicContact CE1-CB 4.24Å; Y276-Q314 HydrophobicContact CE2-CB 4.36Å; Y276-Q314 PolarHBondContact N-O 3.46Å; Y276-Q314 PolarHBondContact O-N 3.4Å; R308-Q314 PolarHBondContact O-NE2 3.5Å; R308-Q314 VanDerWaalsContact O-NE2 3.17Å; Y312-Q314 PolarHBondContact O-N 3.26Å; Y312-Q314 PolarHBondContact O-NE2 3.45Å
315	I	92.6	Very high	91	Very high	29 Å²	29	48.1 Å²	48.1	15%	0.149	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	109.6	176.2	-58.4	172.7	0	0	0	107.4	A208 I273 I274 R275	A208-I315 HydrophobicContact CB-CD1 4.21Å; I273-I315 HydrophobicContact CG2-CG2 3.59Å; I274-I315 CarbonylContact O-C 3.29Å; I274-I315 WeakPolarHBondContact O-CA 3.38Å; R275-I315 HydrophobicContact CB-CG1 4.15Å; R275-I315 HydrophobicContact CG-CG1 4Å
316	A	94	Very high	90.8	Very high	17 Å²	17	47.9 Å²	47.9	14%	0.14	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.9	129.3	169.2	0	0	0	0	0	109.7	I273 I274 Y276 L305 I318	I273-A316 VanDerWaalsContact CA-O 3.27Å; I273-A316 WeakPolarHBondContact CA-O 3.29Å; I274-A316 PolarHBondContact N-O 2.78Å; I274-A316 PolarHBondContact O-N 3.41Å; Y276-A316 HydrophobicContact CD1-CB 4.4Å; Y276-A316 HydrophobicContact CE1-CB 3.69Å; L305-A316 HydrophobicContact CD1-CB 4.06Å; A316-I318 HydrophobicContact CB-CD1 4.08Å; A316-I318 HydrophobicContact CB-CG1 3.94Å
317	K	94.3	Very high	90.7	Very high	62 Å²	62	41.2 Å²	41.2	27%	0.27	21%	0.205	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	103.6	168.1	-178.2	-167.2	174.9	-156	0	107.3	P203 H271 D370	P203-K317 HydrophobicContact CB-CB 4.38Å; P203-K317 HydrophobicContact CB-CD 4.5Å; P203-K317 HydrophobicContact CB-CG 4.38Å; H271-K317 HydrophobicContact CB-CG 4.33Å; H271-K317 VanDerWaalsContact CD2-CE 3.43Å; H271-K317 WeakPolarHBondContact CD2-CE 3.44Å; H271-K317 WeakPolarHBondContact NE2-CE 3.22Å; K317-D370 IonicContact NZ-OD2 3.29Å; K317-D370 PolarHBondContact NZ-OD2 2.86Å
318	I	95.2	Very high	90.5	Very high	6 Å²	6	44 Å²	44	3%	0.031	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	115	-170.7	-52.4	171.1	0	0	0	108.5	H271 L272 I274 I285 F303 L305 A316 F323	H271-I318 CarbonylContact C-O 3.57Å; H271-I318 VanDerWaalsContact CA-O 3.24Å; H271-I318 WeakPolarHBondContact CA-O 3.35Å; L272-I318 HydrophobicContact CB-CB 4.44Å; L272-I318 PolarHBondContact N-O 3.25Å; L272-I318 PolarHBondContact O-N 2.84Å; I274-I318 HydrophobicContact CD1-CD1 4.35Å; I285-I318 HydrophobicContact CD1-CD1 3.53Å; F303-I318 HydrophobicContact CD1-CD1 4.01Å; F303-I318 HydrophobicContact CD1-CG2 3.65Å; F303-I318 HydrophobicContact CD2-CG2 4.2Å; F303-I318 HydrophobicContact CE1-CB 4.49Å; F303-I318 HydrophobicContact CE1-CD1 3.84Å; F303-I318 HydrophobicContact CE1-CG1 4.07Å; F303-I318 HydrophobicContact CE1-CG2 3.61Å; F303-I318 HydrophobicContact CE2-CG2 4.17Å; F303-I318 HydrophobicContact CG-CG2 3.95Å; F303-I318 HydrophobicContact CZ-CG2 3.88Å; L305-I318 HydrophobicContact CD1-CD1 4.2Å; A316-I318 HydrophobicContact CB-CD1 4.08Å; A316-I318 HydrophobicContact CB-CG1 3.94Å; I318-F323 HydrophobicContact CG2-CD2 4.49Å; I318-F323 HydrophobicContact CG2-CE2 3.66Å; I318-F323 HydrophobicContact CG2-CZ 4.29Å
319	P	95.5	Very high	90.4	Very high	14 Å²	14	40 Å²	40	9%	0.091	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-61.9	136	171.4	-18.8	30.1	0	0	0	111.1	S321 K322	P319-S321 PolarHBondContact O-N 2.94Å; P319-K322 HydrophobicContact CB-CD 4.47Å; P319-K322 HydrophobicContact CB-CG 4.19Å; P319-K322 HydrophobicContact CG-CD 4.06Å; P319-K322 HydrophobicContact CG-CG 4.31Å; P319-K322 PolarHBondContact O-N 3.5Å
320	L	93.8	Very high	90.8	Very high	9 Å²	9	42.8 Å²	42.8	5%	0.047	23%	0.226	C	C	.	.	G	3₁₀ helix	trans	-70.7	-18.9	175.9	-67.3	167.4	0	0	0	111.9	S270 L272 K322 F323 L340	S270-L320 WeakPolarHBondContact O-CB 2.86Å; S270-L320 PolarHBondContact O-N 3.26Å; L272-L320 HydrophobicContact CB-CD2 4.09Å; L320-K322 PolarHBondContact O-N 3.4Å; L320-F323 HydrophobicContact CD2-CD2 4.19Å; L320-F323 HydrophobicContact CD2-CE2 3.91Å; L320-F323 PolarHBondContact O-N 3.37Å; L320-L340 HydrophobicContact CB-CD2 4.09Å; L320-L340 HydrophobicContact CD1-CD2 3.37Å; L320-L340 HydrophobicContact CG-CD2 4.2Å
321	S	94	Very high	91.4	Very high	7 Å²	7	48.3 Å²	48.3	5%	0.049	25%	0.249	C	C	.	.	G	3₁₀ helix	trans	-66.7	-20.5	172.1	64.8	0	0	0	0	113.8	P319 E375 V376 D378	P319-S321 PolarHBondContact O-N 2.94Å; S321-E375 WeakPolarHBondContact CB-O 3.35Å; S321-V376 WeakPolarHBondContact CB-O 3.49Å; S321-D378 WeakPolarHBondContact CB-OD1 3.47Å; S321-D378 PolarHBondContact O-N 2.97Å; S321-D378 VanDerWaalsContact O-N 3.13Å; S321-D378 PolarHBondContact OG-OD1 3.46Å
322	K	95.4	Very high	91.6	Very high	85 Å²	85	49.1 Å²	49.1	37%	0.37	25%	0.248	S	C	.	.	G	3₁₀ helix	trans	-84.9	-3.4	177.7	-71.3	-170.1	-178.8	-170.5	0	114.8	F303 P319 L320 D378 Y379	F303-K322 HydrophobicContact CD2-CB 4.1Å; F303-K322 HydrophobicContact CE2-CB 4.12Å; P319-K322 HydrophobicContact CB-CD 4.47Å; P319-K322 HydrophobicContact CB-CG 4.19Å; P319-K322 HydrophobicContact CG-CD 4.06Å; P319-K322 HydrophobicContact CG-CG 4.31Å; P319-K322 PolarHBondContact O-N 3.5Å; L320-K322 PolarHBondContact O-N 3.4Å; K322-D378 WeakPolarHBondContact CE-OD2 3.23Å; K322-D378 HydrophobicContact CG-CB 4.45Å; K322-D378 WeakPolarHBondContact CG-OD2 3.21Å; K322-Y379 WeakPolarHBondContact O-CE2 3.3Å; K322-Y379 PolarHBondContact O-OH 3.48Å; K322-Y379 VanDerWaalsContact O-OH 3.08Å
323	F	95.4	Very high	91.5	Very high	0 Å²	0	48.6 Å²	48.6	0%	0	25%	0.246	C	C	.	.	P	Polyproline II helix	trans	-82.8	124.6	177.8	-79.9	-107.1	0	0	0	109.3	L272 I285 V287 H301 Q302 F303 I318 L320 V338	L272-F323 HydrophobicContact CD2-CZ 3.97Å; I285-F323 HydrophobicContact CB-CE1 4.14Å; I285-F323 HydrophobicContact CB-CZ 4.4Å; I285-F323 HydrophobicContact CG2-CE1 3.85Å; I285-F323 HydrophobicContact CG2-CZ 4.05Å; V287-F323 HydrophobicContact CG2-CD1 4.03Å; V287-F323 HydrophobicContact CG2-CE1 3.65Å; V287-F323 HydrophobicContact CG2-CZ 4.36Å; H301-F323 HydrophobicContact CB-CB 4.08Å; H301-F323 HydrophobicContact CB-CD1 4.47Å; Q302-F323 WeakPolarHBondContact O-CA 3.25Å; F303-F323 HydrophobicContact CB-CD1 3.63Å; F303-F323 HydrophobicContact CB-CD2 4.04Å; F303-F323 HydrophobicContact CB-CE1 3.49Å; F303-F323 VanDerWaalsContact CB-CE1 3.49Å; F303-F323 HydrophobicContact CB-CE2 3.94Å; F303-F323 HydrophobicContact CB-CG 3.9Å; F303-F323 HydrophobicContact CB-CZ 3.66Å; F303-F323 HydrophobicContact CG-CE2 4.36Å; F303-F323 HydrophobicContact CG-CZ 4.36Å; I318-F323 HydrophobicContact CG2-CD2 4.49Å; I318-F323 HydrophobicContact CG2-CE2 3.66Å; I318-F323 HydrophobicContact CG2-CZ 4.29Å; L320-F323 HydrophobicContact CD2-CD2 4.19Å; L320-F323 HydrophobicContact CD2-CE2 3.91Å; L320-F323 PolarHBondContact O-N 3.37Å; F323-V338 HydrophobicContact CB-CG2 3.41Å; F323-V338 VanDerWaalsContact CB-CG2 3.41Å; F323-V338 HydrophobicContact CG-CG2 4.14Å
324	Y	94.5	Very high	91.5	Very high	39 Å²	39	54.3 Å²	54.3	15%	0.153	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.6	144.7	178.8	59.4	-88.9	0	0	0	111	H301 Q302 T326 M331	H301-Y324 CarbonylContact C-O 3.52Å; H301-Y324 VanDerWaalsContact CA-O 3.25Å; H301-Y324 WeakPolarHBondContact CA-O 3.29Å; Q302-Y324 HydrophobicContact CB-CE1 4.24Å; Q302-Y324 HydrophobicContact CB-CE2 3.87Å; Q302-Y324 PolarHBondContact N-O 2.87Å; Q302-Y324 WeakPolarHBondContact O-CD1 3.23Å; Q302-Y324 VanDerWaalsContact O-CE1 3.25Å; Q302-Y324 WeakPolarHBondContact O-CE1 3.15Å; Q302-Y324 PolarHBondContact O-N 3.09Å; Y324-T326 WeakPolarHBondContact CD2-OG1 3.32Å; Y324-T326 VanDerWaalsContact CE2-OG1 3.22Å; Y324-T326 WeakPolarHBondContact CE2-OG1 3.26Å; Y324-M331 HydrophobicContact CD2-CG 4.33Å; Y324-M331 HydrophobicContact CD2-SD 4.16Å
325	H	93.9	Very high	91.6	Very high	8 Å²	8	53 Å²	53	4%	0.037	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.8	134.6	176.4	174.8	55.3	0	0	0	111.6	N299 T300 Q335 F336	N299-H325 PolarHBondContact OD1-CE1 2.84Å; T300-H325 WeakPolarHBondContact O-CA 3.47Å; T300-H325 PolarHBondContact O-ND1 2.76Å; T300-H325 VanDerWaalsContact O-ND1 3.16Å; H325-Q335 PolarHBondContact O-NE2 3.31Å; H325-Q335 PolarHBondContact O-OE1 2.78Å; H325-F336 HydrophobicContact CB-CD1 4.21Å; H325-F336 HydrophobicContact CB-CE1 4.06Å; H325-F336 HydrophobicContact CB-CZ 4.26Å; H325-F336 AromaticContact CD2-CD1 3.94Å; H325-F336 AromaticContact CD2-CE1 3.24Å; H325-F336 WeakPolarHBondContact CD2-CE1 3.32Å; H325-F336 AromaticContact CD2-CZ 3.8Å; H325-F336 AromaticContact CE1-CE1 3.8Å; H325-F336 AromaticContact CE1-CZ 3.6Å; H325-F336 AromaticContact CG-CD1 3.96Å; H325-F336 AromaticContact CG-CE1 3.34Å; H325-F336 AromaticContact CG-CZ 3.5Å; H325-F336 AromaticContact ND1-CE1 3.68Å; H325-F336 AromaticContact ND1-CZ 3.37Å; H325-F336 WeakPolarHBondContact ND1-CZ 3.41Å; H325-F336 AromaticContact NE2-CE1 3.56Å; H325-F336 AromaticContact NE2-CZ 3.86Å
326	T	92.9	Very high	91.5	Very high	1 Å²	1	55.4 Å²	55.4	1%	0.006	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.6	130.6	179.2	-62.3	0	0	0	0	108.9	T300 Y324 I330	T300-T326 PolarHBondContact N-O 2.86Å; T300-T326 PolarHBondContact O-N 3.2Å; T300-T326 PolarHBondContact OG1-O 2.84Å; Y324-T326 WeakPolarHBondContact CD2-OG1 3.32Å; Y324-T326 VanDerWaalsContact CE2-OG1 3.22Å; Y324-T326 WeakPolarHBondContact CE2-OG1 3.26Å; T326-I330 CarbonylContact C-O 3.55Å; T326-I330 WeakPolarHBondContact CA-O 3.41Å; T326-I330 WeakPolarHBondContact CG2-O 3.36Å
327	S	91.3	Very high	91.5	Very high	22 Å²	22	56.9 Å²	56.9	15%	0.154	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	125.2	172	-155.2	0	0	0	0	109	F298 N299 S329 I330 H332	F298-S327 WeakPolarHBondContact O-CA 3.45Å; N299-S327 PolarHBondContact OD1-OG 3.44Å; S327-S329 VanDerWaalsContact C-N 3.26Å; S327-S329 PolarHBondContact O-N 3.41Å; S327-I330 PolarHBondContact N-O 3.36Å; S327-I330 WeakPolarHBondContact O-CB 3.46Å; S327-I330 PolarHBondContact O-N 2.77Å; S327-H332 WeakPolarHBondContact CB-NE2 3.49Å
328	S	86.9	Confident	91.3	Very high	68 Å²	68	54.7 Å²	54.7	48%	0.476	27%	0.271	S	S	.	.	T	Hydrogen-bonded Turn	trans	51.3	43.4	-175.6	-58.2	0	0	0	0	113.5	F298 I330	F298-S328 WeakPolarHBondContact CB-OG 3.38Å; F298-S328 PolarHBondContact O-N 3.09Å; S328-I330 PolarHBondContact O-N 2.75Å; S328-I330 VanDerWaalsContact O-N 3.08Å
329	S	83.9	Confident	91	Very high	94 Å²	94	56.8 Å²	56.8	66%	0.657	28%	0.282	S	S	*	.	T	Hydrogen-bonded Turn	trans	63.8	5.7	-175.9	-55.2	0	0	0	0	115.7	S327	S327-S329 VanDerWaalsContact C-N 3.26Å; S327-S329 PolarHBondContact O-N 3.41Å
330	I	89.8	Confident	90.7	Very high	109 Å²	109	58 Å²	58	56%	0.559	29%	0.288	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-98.8	127.7	173.8	-58.3	168.6	0	0	0	109.4	T326 S327 S328 H332	T326-I330 CarbonylContact C-O 3.55Å; T326-I330 WeakPolarHBondContact CA-O 3.41Å; T326-I330 WeakPolarHBondContact CG2-O 3.36Å; S327-I330 PolarHBondContact N-O 3.36Å; S327-I330 WeakPolarHBondContact O-CB 3.46Å; S327-I330 PolarHBondContact O-N 2.77Å; S328-I330 PolarHBondContact O-N 2.75Å; S328-I330 VanDerWaalsContact O-N 3.08Å; I330-H332 PolarHBondContact O-CD2 2.77Å; I330-H332 PolarHBondContact O-NE2 2.8Å
331	M	90.5	Very high	90.3	Very high	132 Å²	132	58.8 Å²	58.8	65%	0.65	30%	0.298	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-75.4	125.8	173.7	-176.1	171.5	63.9	0	0	109.9	Y324	Y324-M331 HydrophobicContact CD2-CG 4.33Å; Y324-M331 HydrophobicContact CD2-SD 4.16Å
332	H	84.9	Confident	90.1	Very high	70 Å²	70	63.4 Å²	63.4	32%	0.324	31%	0.314	S	S	.	.	P	Polyproline II helix	trans	-93.2	154.1	179	-70.8	-81.9	0	0	0	111.3	S327 I330 R334 Q335	S327-H332 WeakPolarHBondContact CB-NE2 3.49Å; I330-H332 PolarHBondContact O-CD2 2.77Å; I330-H332 PolarHBondContact O-NE2 2.8Å; H332-R334 VanDerWaalsContact C-N 3.32Å; H332-Q335 PolarHBondContact O-NE2 3.35Å
333	Y	84.5	Confident	89.8	Confident	166 Å²	166	59.5 Å²	59.5	65%	0.651	30%	0.297	S	S	*	.	S	Bend	trans	-68.7	-32.4	173	68.3	-79.9	0	0	0	112.2	Q335	Y333-Q335 PolarHBondContact O-N 3.26Å; Y333-Q335 VanDerWaalsContact O-N 3.16Å
334	R	88	Confident	89.5	Confident	156 Å²	156	62 Å²	62	59%	0.589	31%	0.307	S	S	*	.	S	Bend	trans	-82.3	92.1	173.3	-67	-175.1	171.7	171.5	-4.5	109.5	H332	H332-R334 VanDerWaalsContact C-N 3.32Å
335	Q	91.9	Very high	89.3	Confident	18 Å²	18	60.2 Å²	60.2	8%	0.084	30%	0.3	C	S	.	.			trans	-87.1	151.1	175.8	-71.7	-62.8	-38.5	0	0	111	H325 H332 Y333 F377 Q381	H325-Q335 PolarHBondContact O-NE2 3.31Å; H325-Q335 PolarHBondContact O-OE1 2.78Å; H332-Q335 PolarHBondContact O-NE2 3.35Å; Y333-Q335 PolarHBondContact O-N 3.26Å; Y333-Q335 VanDerWaalsContact O-N 3.16Å; Q335-F377 HydrophobicContact CB-CE1 3.57Å; Q335-F377 HydrophobicContact CB-CZ 3.53Å; Q335-F377 HydrophobicContact CG-CZ 4.33Å; Q335-Q381 PolarHBondContact O-NE2 3.45Å
336	F	91.4	Very high	89.3	Confident	80 Å²	80	59.8 Å²	59.8	35%	0.351	30%	0.298	S	S	.	.			trans	-153.9	156.6	175.9	59	-94.5	0	0	0	110	H301 H325	H301-F336 AromaticContact CE1-CE2 3.72Å; H301-F336 AromaticContact NE2-CD2 3.74Å; H301-F336 AromaticContact NE2-CE2 3.44Å; H301-F336 WeakPolarHBondContact NE2-CE2 3.42Å; H325-F336 HydrophobicContact CB-CD1 4.21Å; H325-F336 HydrophobicContact CB-CE1 4.06Å; H325-F336 HydrophobicContact CB-CZ 4.26Å; H325-F336 AromaticContact CD2-CD1 3.94Å; H325-F336 AromaticContact CD2-CE1 3.24Å; H325-F336 WeakPolarHBondContact CD2-CE1 3.32Å; H325-F336 AromaticContact CD2-CZ 3.8Å; H325-F336 AromaticContact CE1-CE1 3.8Å; H325-F336 AromaticContact CE1-CZ 3.6Å; H325-F336 AromaticContact CG-CD1 3.96Å; H325-F336 AromaticContact CG-CE1 3.34Å; H325-F336 AromaticContact CG-CZ 3.5Å; H325-F336 AromaticContact ND1-CE1 3.68Å; H325-F336 AromaticContact ND1-CZ 3.37Å; H325-F336 WeakPolarHBondContact ND1-CZ 3.41Å; H325-F336 AromaticContact NE2-CE1 3.56Å; H325-F336 AromaticContact NE2-CZ 3.86Å
337	P	92.6	Very high	89.4	Confident	49 Å²	49	60 Å²	60	32%	0.318	30%	0.299	S	S	.	.			trans	-67.8	156.7	-177.7	26	-35.5	0	0	0	113.3	D339 V376 F377	P337-D339 PolarHBondContact O-N 3.44Å; P337-V376 HydrophobicContact CB-CG1 4.01Å; P337-V376 HydrophobicContact CG-CG1 3.99Å; P337-F377 HydrophobicContact CB-CB 4.12Å; P337-F377 HydrophobicContact CB-CD2 4.18Å; P337-F377 HydrophobicContact CB-CG 4.43Å
338	V	91.9	Very high	89.7	Confident	15 Å²	15	58.9 Å²	58.9	9%	0.091	29%	0.291	C	S	.	.			trans	-60.3	130	174.2	-172.9	0	0	0	0	110.9	V287 H301 F323 L340	V287-V338 HydrophobicContact CG1-CG1 4.19Å; H301-V338 HydrophobicContact CB-CG2 3.72Å; F323-V338 HydrophobicContact CB-CG2 3.41Å; F323-V338 VanDerWaalsContact CB-CG2 3.41Å; F323-V338 HydrophobicContact CG-CG2 4.14Å; V338-L340 HydrophobicContact CG1-CD2 4.39Å; V338-L340 PolarHBondContact O-N 2.83Å; V338-L340 VanDerWaalsContact O-N 3.08Å
339	D	88.3	Confident	90.1	Very high	51 Å²	51	56.9 Å²	56.9	27%	0.273	28%	0.276	S	S	.	.			trans	-76.6	96.1	169.3	-171.6	-17.6	0	0	0	111.2	P337 G341 R342 M343	P337-D339 PolarHBondContact O-N 3.44Å; D339-G341 VanDerWaalsContact C-N 3.31Å; D339-G341 PolarHBondContact O-N 3.11Å; D339-G341 PolarHBondContact OD1-N 2.87Å; D339-R342 HydrophobicContact CB-CB 4.29Å; D339-R342 PolarHBondContact O-N 2.84Å; D339-R342 PolarHBondContact OD1-N 3.28Å; D339-R342 VanDerWaalsContact OD1-N 3.16Å; D339-R342 WeakPolarHBondContact OD2-CB 3.29Å; D339-R342 WeakPolarHBondContact OD2-CD 3.38Å; D339-R342 WeakPolarHBondContact OD2-CG 3.43Å; D339-R342 IonicContact OD2-CZ 2.78Å; D339-R342 IonicContact OD2-NE 2.67Å; D339-R342 IonicContact OD2-NH1 3.52Å; D339-R342 PolarHBondContact OD2-NH1 3.39Å; D339-M343 PolarHBondContact O-N 2.8Å
340	L	88	Confident	90.7	Very high	40 Å²	40	52.4 Å²	52.4	21%	0.209	25%	0.245	C	C	.	.	S	Bend	trans	-65.9	-30.2	-179.1	-58.8	178.6	0	0	0	113.6	C266 E267 Y269 L320 V338 R342	C266-L340 PolarHBondContact N-O 3.42Å; E267-L340 HydrophobicContact CB-CB 4.39Å; Y269-L340 WeakPolarHBondContact O-CD1 3.28Å; L320-L340 HydrophobicContact CB-CD2 4.09Å; L320-L340 HydrophobicContact CD1-CD2 3.37Å; L320-L340 HydrophobicContact CG-CD2 4.2Å; V338-L340 HydrophobicContact CG1-CD2 4.39Å; V338-L340 PolarHBondContact O-N 2.83Å; V338-L340 VanDerWaalsContact O-N 3.08Å; L340-R342 VanDerWaalsContact C-N 3.31Å
341	G	87.4	Confident	90.9	Very high	24 Å²	24	52.5 Å²	52.5	25%	0.247	24%	0.244	C	C	.	.	S	Bend	trans	-73.9	-26.2	179.1	0	0	0	0	0	112.2	P263 D339	P263-G341 VanDerWaalsContact CB-O 3.23Å; P263-G341 WeakPolarHBondContact CB-O 3.19Å; P263-G341 WeakPolarHBondContact CG-O 3.37Å; D339-G341 VanDerWaalsContact C-N 3.31Å; D339-G341 PolarHBondContact O-N 3.11Å; D339-G341 PolarHBondContact OD1-N 2.87Å
342	R	88	Confident	91	Very high	104 Å²	104	46.6 Å²	46.6	39%	0.392	22%	0.216	S	C	.	.	S	Bend	trans	-107.6	7.7	-175.9	-61.7	-170.1	178.5	97.5	-8.7	114.8	P289 R290 E292 D339 L340 R344	P289-R342 CarbonylContact C-O 3.59Å; P289-R342 WeakPolarHBondContact CA-O 3Å; P289-R342 HydrophobicContact CB-CB 4.45Å; R290-R342 PolarHBondContact N-O 3.16Å; E292-R342 IonicContact OE1-CZ 2.75Å; E292-R342 IonicContact OE1-NE 2.94Å; E292-R342 PolarHBondContact OE1-NE 2.74Å; E292-R342 IonicContact OE1-NH2 3.89Å; E292-R342 PolarHBondContact OE1-NH2 3.19Å; E292-R342 IonicContact OE2-NH2 3.02Å; D339-R342 HydrophobicContact CB-CB 4.29Å; D339-R342 PolarHBondContact O-N 2.84Å; D339-R342 PolarHBondContact OD1-N 3.28Å; D339-R342 VanDerWaalsContact OD1-N 3.16Å; D339-R342 WeakPolarHBondContact OD2-CB 3.29Å; D339-R342 WeakPolarHBondContact OD2-CD 3.38Å; D339-R342 WeakPolarHBondContact OD2-CG 3.43Å; D339-R342 IonicContact OD2-CZ 2.78Å; D339-R342 IonicContact OD2-NE 2.67Å; D339-R342 IonicContact OD2-NH1 3.52Å; D339-R342 PolarHBondContact OD2-NH1 3.39Å; L340-R342 VanDerWaalsContact C-N 3.31Å; R342-R344 PolarHBondContact O-N 3.18Å
343	M	89.3	Confident	91.4	Very high	4 Å²	4	48 Å²	48	2%	0.02	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-57.4	121.7	179.4	-171.4	173.9	99.3	0	0	111.8	P263 Y264 C266 V287 D339	P263-M343 CarbonylContact C-O 3.59Å; P263-M343 VanDerWaalsContact CA-O 3.25Å; P263-M343 WeakPolarHBondContact CA-O 3.26Å; Y264-M343 HydrophobicContact CD2-CE 3.88Å; Y264-M343 HydrophobicContact CG-CE 4.45Å; Y264-M343 PolarHBondContact N-O 3.11Å; C266-M343 WeakPolarHBondContact SG-CE 3.37Å; V287-M343 HydrophobicContact CG1-CG 3.53Å; V287-M343 HydrophobicContact CG1-SD 3.68Å; D339-M343 PolarHBondContact O-N 2.8Å
344	R	89.4	Confident	91.8	Very high	52 Å²	52	44.7 Å²	44.7	20%	0.196	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	-41	-172.7	-176.6	-177.9	72.9	98.3	-5.1	113.5	E254 V261 Y264 L288 R290 R342	E254-R344 IonicContact OE1-CZ 2.87Å; E254-R344 IonicContact OE1-NH1 2.67Å; E254-R344 PolarHBondContact OE1-NH1 3.17Å; V261-R344 HydrophobicContact CG1-CG 3.65Å; Y264-R344 WeakPolarHBondContact CE2-O 3.44Å; L288-R344 WeakPolarHBondContact O-CA 3.36Å; L288-R344 WeakPolarHBondContact O-CB 3.36Å; L288-R344 PolarHBondContact O-N 3.28Å; R290-R344 HydrophobicContact CB-CB 4.24Å; R342-R344 PolarHBondContact O-N 3.18Å
345	L	91.2	Very high	92.1	Very high	1 Å²	1	41.2 Å²	41.2	1%	0.005	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.4	150.3	-176.6	-72.5	169.8	0	0	0	110.5	R251 S252 P253 E254 L288	R251-L345 HydrophobicContact CG-CD1 4.48Å; R251-L345 HydrophobicContact CG-CD2 4.25Å; S252-L345 WeakPolarHBondContact O-CD2 3.46Å; P253-L345 WeakPolarHBondContact O-CD2 3.21Å; E254-L345 HydrophobicContact CB-CD2 4.43Å; E254-L345 HydrophobicContact CG-CD1 4.23Å; E254-L345 HydrophobicContact CG-CD2 3.52Å; E254-L345 HydrophobicContact CG-CG 4.08Å; L288-L345 HydrophobicContact CB-CB 4.12Å; L288-L345 HydrophobicContact CD1-CB 4.05Å; L288-L345 HydrophobicContact CD2-CD1 4.42Å; L288-L345 PolarHBondContact N-O 3.26Å; L288-L345 PolarHBondContact O-N 3.47Å; L288-L345 VanDerWaalsContact O-N 3.09Å
346	L	93.3	Very high	92.1	Very high	0 Å²	0	40.8 Å²	40.8	0%	0	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	133.6	168.5	-177.7	150.6	0	0	0	108.1	S252 L272 I285 V286 F348 I365	S252-L346 WeakPolarHBondContact CB-O 3.46Å; S252-L346 PolarHBondContact N-O 3.22Å; S252-L346 PolarHBondContact OG-N 2.99Å; S252-L346 PolarHBondContact OG-O 3.37Å; S252-L346 VanDerWaalsContact OG-O 3.09Å; L272-L346 HydrophobicContact CD1-CD1 4.01Å; L272-L346 HydrophobicContact CD2-CD1 4.02Å; I285-L346 HydrophobicContact CG2-CD1 4.49Å; I285-L346 HydrophobicContact CG2-CG 4.35Å; V286-L346 CarbonylContact O-C 3.59Å; V286-L346 WeakPolarHBondContact O-CA 3.14Å; L346-F348 HydrophobicContact CD2-CD2 4.17Å; L346-F348 HydrophobicContact CD2-CE2 3.53Å; L346-F348 HydrophobicContact CD2-CZ 3.79Å; L346-I365 HydrophobicContact CD1-CG2 4.33Å; L346-I365 HydrophobicContact CD2-CD1 4.1Å
347	S	95.4	Very high	92.2	Very high	4 Å²	4	39 Å²	39	3%	0.028	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.3	155.3	176.8	72.9	0	0	0	0	112.6	N249 L250 I285 V286	N249-S347 VanDerWaalsContact OD1-CB 3.28Å; N249-S347 WeakPolarHBondContact OD1-CB 3.44Å; N249-S347 PolarHBondContact OD1-OG 3.25Å; L250-S347 CarbonylContact O-C 3.47Å; L250-S347 WeakPolarHBondContact O-CA 3.3Å; L250-S347 WeakPolarHBondContact O-CB 3.42Å; I285-S347 CarbonylContact C-O 3.55Å; I285-S347 WeakPolarHBondContact CA-O 3.29Å; V286-S347 WeakPolarHBondContact CB-OG 3.41Å; V286-S347 PolarHBondContact N-O 2.84Å; V286-S347 PolarHBondContact O-N 2.9Å
348	F	96.7	Very high	92.2	Very high	0 Å²	0	37 Å²	37	0%	0	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	114.7	174.2	-61.6	-85.8	0	0	0	108.3	N249 L250 I274 Q284 I285 L305 L346 L360 L362 I365	N249-F348 CarbonylContact C-O 3.55Å; N249-F348 WeakPolarHBondContact CA-O 3.49Å; N249-F348 PolarHBondContact OD1-O 3.45Å; L250-F348 HydrophobicContact CB-CB 4.43Å; L250-F348 HydrophobicContact CD2-CD2 4.21Å; L250-F348 PolarHBondContact N-O 3.19Å; L250-F348 PolarHBondContact O-N 3.05Å; I274-F348 HydrophobicContact CD1-CE1 3.79Å; I274-F348 HydrophobicContact CD1-CZ 3.87Å; Q284-F348 WeakPolarHBondContact O-CA 3.28Å; I285-F348 HydrophobicContact CD1-CE1 4.24Å; I285-F348 HydrophobicContact CG1-CD1 3.98Å; I285-F348 HydrophobicContact CG1-CE1 3.86Å; L305-F348 HydrophobicContact CD2-CE1 4.4Å; L346-F348 HydrophobicContact CD2-CD2 4.17Å; L346-F348 HydrophobicContact CD2-CE2 3.53Å; L346-F348 HydrophobicContact CD2-CZ 3.79Å; F348-L360 HydrophobicContact CB-CD2 4.48Å; F348-L360 HydrophobicContact CD1-CD2 4.23Å; F348-L360 HydrophobicContact CG-CD2 4.34Å; F348-L362 HydrophobicContact CD2-CD1 4.17Å; F348-L362 HydrophobicContact CE2-CD1 3.79Å; F348-L362 HydrophobicContact CZ-CD1 4.3Å; F348-L362 HydrophobicContact CZ-CD2 4.32Å; F348-I365 HydrophobicContact CE2-CD1 3.79Å; F348-I365 HydrophobicContact CZ-CD1 3.93Å
349	T	96.3	Very high	92.2	Very high	25 Å²	25	36.7 Å²	36.7	15%	0.153	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	129.7	179	-55.5	0	0	0	0	109.6	A248 N249 Y283 Q284 M351	A248-T349 CarbonylContact O-C 3.54Å; A248-T349 WeakPolarHBondContact O-CA 3.39Å; N249-T349 HydrophobicContact CB-CG2 4.49Å; N249-T349 PolarHBondContact OD1-OG1 3.14Å; Y283-T349 CarbonylContact C-O 3.59Å; Q284-T349 PolarHBondContact N-O 3.32Å; Q284-T349 PolarHBondContact O-N 3.19Å; T349-M351 HydrophobicContact CG2-CB 4.49Å
350	I	95.8	Very high	92.5	Very high	0 Å²	0	34.3 Å²	34.3	0%	0	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	128	166.8	179.3	170.1	0	0	0	108.4	F228 I232 F247 A248 R281 Y283 F358	F228-I350 HydrophobicContact CE1-CG2 4.22Å; F228-I350 HydrophobicContact CZ-CG2 4.43Å; I232-I350 HydrophobicContact CD1-CG2 4.02Å; I232-I350 HydrophobicContact CG1-CD1 4.24Å; I232-I350 HydrophobicContact CG1-CG1 4.43Å; I232-I350 HydrophobicContact CG1-CG2 4.43Å; F247-I350 VanDerWaalsContact CA-O 3.31Å; F247-I350 WeakPolarHBondContact CA-O 3.46Å; A248-I350 HydrophobicContact CB-CG2 3.69Å; A248-I350 PolarHBondContact N-O 3.06Å; A248-I350 VanDerWaalsContact N-O 3.09Å; A248-I350 WeakPolarHBondContact O-CG2 3.34Å; A248-I350 PolarHBondContact O-N 2.76Å; R281-I350 HydrophobicContact CB-CD1 4.3Å; R281-I350 VanDerWaalsContact CD-CD1 3.48Å; Y283-I350 HydrophobicContact CD1-CB 3.89Å; Y283-I350 HydrophobicContact CE1-CB 3.78Å; Y283-I350 HydrophobicContact CE1-CD1 4.17Å; Y283-I350 HydrophobicContact CE1-CG1 4.45Å; Y283-I350 HydrophobicContact CE1-CG2 4.25Å; I350-F358 HydrophobicContact CD1-CB 3.62Å; I350-F358 HydrophobicContact CD1-CD1 4.18Å; I350-F358 HydrophobicContact CD1-CD2 4.3Å; I350-F358 HydrophobicContact CD1-CG 3.78Å; I350-F358 HydrophobicContact CG2-CD2 4.39Å; I350-F358 HydrophobicContact CG2-CE1 4.33Å; I350-F358 HydrophobicContact CG2-CE2 4.2Å; I350-F358 HydrophobicContact CG2-CZ 4.13Å
351	M	94.5	Very high	92.7	Very high	111 Å²	111	32.6 Å²	32.6	55%	0.547	17%	0.168	S	C	.	.			trans	-161.4	68.2	-178.5	-172.7	178.6	72.5	0	0	106.8	F247 T349	F247-M351 HydrophobicContact CB-CB 4.26Å; F247-M351 HydrophobicContact CB-CG 4.26Å; T349-M351 HydrophobicContact CG2-CB 4.49Å
352	D	93.2	Very high	93	Very high	9 Å²	9	31.5 Å²	31.5	5%	0.048	16%	0.156	C	C	.	.			trans	-102.7	0.5	-173.3	61.8	-8.8	0	0	0	114.2	R281 K282 I354	R281-D352 WeakPolarHBondContact CD-OD2 3.47Å; R281-D352 IonicContact CZ-OD2 3.8Å; R281-D352 IonicContact NE-OD2 3.85Å; R281-D352 IonicContact NH1-OD1 3.97Å; R281-D352 PolarHBondContact NH1-OD1 2.68Å; R281-D352 IonicContact NH1-OD2 3.26Å; R281-D352 PolarHBondContact NH1-OD2 2.77Å; K282-D352 HydrophobicContact CD-CB 4.24Å; K282-D352 VanDerWaalsContact CE-CA 3.43Å; K282-D352 HydrophobicContact CG-CB 3.83Å; D352-I354 HydrophobicContact CB-CD1 4.41Å; D352-I354 PolarHBondContact O-N 2.83Å; D352-I354 PolarHBondContact OD1-N 3.28Å
353	D	92.6	Very high	93.2	Very high	98 Å²	98	26.5 Å²	26.5	52%	0.524	14%	0.138	S	C	.	.	S	Bend	trans	57.4	21.9	-174.2	-54.2	-42.5	0	0	0	113.6
354	I	93.3	Very high	93.3	Very high	98 Å²	98	26.9 Å²	26.9	50%	0.503	14%	0.139	S	C	.	.			trans	-109.1	110.7	178.6	-62.6	167.1	0	0	0	108.7	R281 D352 G356	R281-I354 PolarHBondContact NH1-O 3.04Å; D352-I354 HydrophobicContact CB-CD1 4.41Å; D352-I354 PolarHBondContact O-N 2.83Å; D352-I354 PolarHBondContact OD1-N 3.28Å; I354-G356 PolarHBondContact O-N 3.22Å
355	E	94.2	Very high	93.5	Very high	83 Å²	83	24.4 Å²	24.4	39%	0.388	13%	0.129	S	C	.	.			trans	-64.3	133.6	172.3	-177.4	163.5	-137.5	0	0	110.2	F231 I232 S233 T234 R235	F231-E355 HydrophobicContact CE1-CG 3.84Å; F231-E355 HydrophobicContact CZ-CG 3.92Å; I232-E355 WeakPolarHBondContact O-CA 3.36Å; I232-E355 WeakPolarHBondContact O-CG 3.12Å; S233-E355 PolarHBondContact OG-OE1 3.2Å; T234-E355 HydrophobicContact CG2-CB 4.44Å; R235-E355 IonicContact NE-OE1 3.73Å
356	G	92.3	Very high	93.4	Very high	8 Å²	8	24.4 Å²	24.4	8%	0.082	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	147	-180	175.1	0	0	0	0	0	114.1	F231 I232 R281 I354	F231-G356 WeakPolarHBondContact CA-O 3.48Å; F231-G356 VanDerWaalsContact CD2-C 3.48Å; I232-G356 PolarHBondContact N-O 3.41Å; I232-G356 PolarHBondContact O-N 2.9Å; R281-G356 VanDerWaalsContact NH2-CA 3.35Å; R281-G356 PolarHBondContact NH2-O 2.86Å; R281-G356 VanDerWaalsContact NH2-O 3.12Å; I354-G356 PolarHBondContact O-N 3.22Å
357	P	92.6	Very high	93.3	Very high	44 Å²	44	24.5 Å²	24.5	29%	0.286	13%	0.13	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.2	146.2	176.5	30.1	-34	0	0	0	110.9	A146 G230 F231 R281	A146-P357 HydrophobicContact CB-CG 3.91Å; G230-P357 CarbonylContact O-C 3.48Å; G230-P357 VanDerWaalsContact O-CA 3.29Å; G230-P357 WeakPolarHBondContact O-CA 3.4Å; F231-P357 HydrophobicContact CD2-CB 4.39Å; R281-P357 PolarHBondContact NE-O 3.46Å; R281-P357 VanDerWaalsContact NE-O 3.14Å; R281-P357 PolarHBondContact NH2-O 3.21Å
358	F	92.8	Very high	93.1	Very high	7 Å²	7	24.5 Å²	24.5	3%	0.031	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.1	154.5	170.4	69.9	-91.1	0	0	0	111.3	A131 F228 R229 G230 I232 A248 D279 Y283 I350	A131-F358 HydrophobicContact CB-CE1 4.46Å; A131-F358 HydrophobicContact CB-CZ 3.7Å; F228-F358 HydrophobicContact CD1-CD2 4.39Å; F228-F358 AromaticContact CD1-CE2 3.82Å; F228-F358 HydrophobicContact CD1-CE2 3.82Å; F228-F358 HydrophobicContact CD2-CE2 4.17Å; F228-F358 HydrophobicContact CE1-CD2 4.26Å; F228-F358 AromaticContact CE1-CE2 3.5Å; F228-F358 HydrophobicContact CE1-CE2 3.5Å; F228-F358 HydrophobicContact CE1-CZ 4.25Å; F228-F358 AromaticContact CE2-CE2 3.87Å; F228-F358 HydrophobicContact CE2-CE2 3.87Å; F228-F358 HydrophobicContact CE2-CZ 4.15Å; F228-F358 HydrophobicContact CG-CE2 4.15Å; F228-F358 AromaticContact CZ-CE2 3.53Å; F228-F358 HydrophobicContact CZ-CE2 3.53Å; F228-F358 AromaticContact CZ-CZ 3.85Å; F228-F358 HydrophobicContact CZ-CZ 3.85Å; R229-F358 VanDerWaalsContact CA-O 3.29Å; R229-F358 WeakPolarHBondContact CA-O 3.07Å; G230-F358 VanDerWaalsContact C-CE1 3.46Å; G230-F358 PolarHBondContact N-O 3.29Å; G230-F358 VanDerWaalsContact N-O 3.09Å; G230-F358 WeakPolarHBondContact O-CD1 3.31Å; G230-F358 PolarHBondContact O-N 3.48Å; I232-F358 HydrophobicContact CD1-CD1 4.04Å; I232-F358 HydrophobicContact CD1-CE1 3.61Å; I232-F358 HydrophobicContact CD1-CZ 4.46Å; I232-F358 HydrophobicContact CG1-CD1 3.62Å; I232-F358 HydrophobicContact CG1-CE1 3.75Å; A248-F358 HydrophobicContact CB-CE1 4.06Å; A248-F358 HydrophobicContact CB-CZ 3.62Å; D279-F358 WeakPolarHBondContact OD2-CA 3.15Å; D279-F358 WeakPolarHBondContact OD2-CB 3.29Å; Y283-F358 HydrophobicContact CE1-CD2 4.39Å; Y283-F358 WeakPolarHBondContact OH-CD2 3.22Å; I350-F358 HydrophobicContact CD1-CB 3.62Å; I350-F358 HydrophobicContact CD1-CD1 4.18Å; I350-F358 HydrophobicContact CD1-CD2 4.3Å; I350-F358 HydrophobicContact CD1-CG 3.78Å; I350-F358 HydrophobicContact CG2-CD2 4.39Å; I350-F358 HydrophobicContact CG2-CE1 4.33Å; I350-F358 HydrophobicContact CG2-CE2 4.2Å; I350-F358 HydrophobicContact CG2-CZ 4.13Å
359	S	92.2	Very high	92.8	Very high	8 Å²	8	26 Å²	26	6%	0.056	14%	0.136	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-157.2	119.4	-179.2	166.7	0	0	0	0	112.6	A144 H227 F228 D279	A144-S359 WeakPolarHBondContact CB-OG 3.4Å; H227-S359 PolarHBondContact NE2-OG 3.37Å; F228-S359 CarbonylContact O-C 3.53Å; F228-S359 WeakPolarHBondContact O-CA 3.45Å; D279-S359 PolarHBondContact N-O 3.09Å; D279-S359 PolarHBondContact OD2-N 3.14Å
360	L	93.3	Very high	92.5	Very high	0 Å²	0	25.2 Å²	25.2	0%	0	13%	0.131	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	112.6	173.3	-179.7	69	0	0	0	109.6	F228 Y276 Y283 T307 F348 L362	F228-L360 HydrophobicContact CB-CB 4.32Å; F228-L360 HydrophobicContact CD1-CB 4.36Å; F228-L360 PolarHBondContact N-O 2.91Å; F228-L360 PolarHBondContact O-N 2.82Å; Y276-L360 HydrophobicContact CD2-CD1 4.1Å; Y276-L360 HydrophobicContact CG-CD1 4.46Å; Y283-L360 HydrophobicContact CD1-CD2 4.01Å; Y283-L360 HydrophobicContact CD2-CD1 4.43Å; Y283-L360 HydrophobicContact CD2-CD2 4.36Å; Y283-L360 HydrophobicContact CE1-CB 4.1Å; Y283-L360 HydrophobicContact CE1-CD2 4.09Å; Y283-L360 HydrophobicContact CE2-CB 4.1Å; Y283-L360 HydrophobicContact CE2-CD1 4.27Å; Y283-L360 HydrophobicContact CE2-CD2 4.43Å; Y283-L360 HydrophobicContact CG-CD2 4.15Å; T307-L360 HydrophobicContact CG2-CD1 3.96Å; F348-L360 HydrophobicContact CB-CD2 4.48Å; F348-L360 HydrophobicContact CD1-CD2 4.23Å; F348-L360 HydrophobicContact CG-CD2 4.34Å; L360-L362 HydrophobicContact CD1-CD2 4.38Å; L360-L362 HydrophobicContact CD2-CD2 4.07Å; L360-L362 HydrophobicContact CD2-CG 4.47Å; L360-L362 HydrophobicContact CG-CD2 3.98Å; L360-L362 HydrophobicContact CG-CG 4.29Å
361	E	93.1	Very high	92.2	Very high	5 Å²	5	31.1 Å²	31.1	2%	0.023	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.8	137	168.8	-54.6	-170.1	134.3	0	0	110.4	S136 A140 G226 Y276 R277 W313	S136-E361 VanDerWaalsContact CB-OE1 3.24Å; S136-E361 WeakPolarHBondContact CB-OE1 3.24Å; S136-E361 PolarHBondContact OG-OE1 2.72Å; A140-E361 WeakPolarHBondContact CB-OE1 3.37Å; G226-E361 CarbonylContact O-C 3.48Å; G226-E361 WeakPolarHBondContact O-CA 2.88Å; Y276-E361 CarbonylContact C-O 3.59Å; Y276-E361 WeakPolarHBondContact CA-O 3.33Å; Y276-E361 WeakPolarHBondContact CB-O 3.47Å; R277-E361 HydrophobicContact CB-CB 4.18Å; R277-E361 VanDerWaalsContact CD-OE2 3.23Å; R277-E361 WeakPolarHBondContact CD-OE2 3.38Å; R277-E361 PolarHBondContact N-O 3.1Å; R277-E361 IonicContact NH1-OE2 3.06Å; R277-E361 PolarHBondContact NH1-OE2 3.27Å; R277-E361 PolarHBondContact O-N 3.12Å; W313-E361 HydrophobicContact CH2-CB 3.88Å; W313-E361 HydrophobicContact CZ3-CB 4.3Å
362	L	93.9	Very high	92	Very high	0 Å²	0	33 Å²	33	0%	0	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	127.2	-177.9	-60.4	175.1	0	0	0	109.4	F105 G226 L250 I274 F348 L360	F105-L362 HydrophobicContact CD2-CB 3.62Å; F105-L362 WeakPolarHBondContact CD2-O 3.38Å; F105-L362 HydrophobicContact CE2-CB 3.42Å; F105-L362 VanDerWaalsContact CE2-CB 3.42Å; F105-L362 HydrophobicContact CE2-CD1 3.88Å; F105-L362 HydrophobicContact CE2-CG 4.29Å; F105-L362 HydrophobicContact CZ-CB 4.24Å; F105-L362 HydrophobicContact CZ-CD1 3.97Å; G226-L362 PolarHBondContact N-O 3.12Å; G226-L362 PolarHBondContact O-N 3.42Å; L250-L362 HydrophobicContact CD2-CD1 4.02Å; I274-L362 HydrophobicContact CG2-CD2 4.04Å; F348-L362 HydrophobicContact CD2-CD1 4.17Å; F348-L362 HydrophobicContact CE2-CD1 3.79Å; F348-L362 HydrophobicContact CZ-CD1 4.3Å; F348-L362 HydrophobicContact CZ-CD2 4.32Å; L360-L362 HydrophobicContact CD1-CD2 4.38Å; L360-L362 HydrophobicContact CD2-CD2 4.07Å; L360-L362 HydrophobicContact CD2-CG 4.47Å; L360-L362 HydrophobicContact CG-CD2 3.98Å; L360-L362 HydrophobicContact CG-CG 4.29Å
363	D	91.7	Very high	91.7	Very high	0 Å²	0	35 Å²	35	0%	0	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.8	-60.4	173.3	175.8	23.1	0	0	0	110.5	F105 P106 Y225 R275 W313	F105-D363 WeakPolarHBondContact CD2-O 3.21Å; F105-D363 PolarHBondContact N-O 2.92Å; P106-D363 WeakPolarHBondContact CD-O 3.39Å; P106-D363 WeakPolarHBondContact CD-OD1 3.3Å; P106-D363 WeakPolarHBondContact CG-OD1 3.4Å; Y225-D363 HydrophobicContact CD1-CB 3.95Å; Y225-D363 HydrophobicContact CE1-CB 4.08Å; R275-D363 HydrophobicContact CB-CB 4.21Å; R275-D363 VanDerWaalsContact CD-OD2 3.28Å; R275-D363 WeakPolarHBondContact CD-OD2 3.26Å; R275-D363 HydrophobicContact CG-CB 4.07Å; R275-D363 IonicContact CZ-OD2 3.54Å; R275-D363 IonicContact NE-OD2 3.35Å; R275-D363 IonicContact NH1-OD2 2.73Å; R275-D363 PolarHBondContact NH1-OD2 3.16Å; R275-D363 PolarHBondContact O-N 2.95Å; W313-D363 HydrophobicContact CE3-CB 4.06Å; W313-D363 HydrophobicContact CH2-CB 3.92Å; W313-D363 HydrophobicContact CZ3-CB 3.62Å
364	Y	91.1	Very high	91.4	Very high	11 Å²	11	35.5 Å²	35.5	4%	0.043	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.9	155	176.6	66.4	-102.5	0	0	0	112	Y101 V103 A212 I273 R275	Y101-Y364 AromaticContact CD1-CD2 3.73Å; Y101-Y364 HydrophobicContact CD1-CD2 3.73Å; Y101-Y364 HydrophobicContact CD1-CE2 4.37Å; Y101-Y364 AromaticContact CD1-CG 3.95Å; Y101-Y364 HydrophobicContact CD1-CG 3.95Å; Y101-Y364 HydrophobicContact CE1-CD1 4.11Å; Y101-Y364 AromaticContact CE1-CD2 3.48Å; Y101-Y364 HydrophobicContact CE1-CD2 3.48Å; Y101-Y364 VanDerWaalsContact CE1-CD2 3.48Å; Y101-Y364 HydrophobicContact CE1-CE1 4.31Å; Y101-Y364 AromaticContact CE1-CE2 3.74Å; Y101-Y364 HydrophobicContact CE1-CE2 3.74Å; Y101-Y364 AromaticContact CE1-CG 3.7Å; Y101-Y364 HydrophobicContact CE1-CG 3.7Å; V103-Y364 CarbonylContact O-C 3.55Å; V103-Y364 VanDerWaalsContact O-CA 3.23Å; V103-Y364 WeakPolarHBondContact O-CA 3.41Å; V103-Y364 WeakPolarHBondContact O-CB 3.21Å; A212-Y364 HydrophobicContact CB-CE1 3.95Å; I273-Y364 HydrophobicContact CG2-CE2 3.93Å; R275-Y364 HydrophobicContact CB-CD1 3.83Å; R275-Y364 HydrophobicContact CB-CD2 4.34Å; R275-Y364 HydrophobicContact CB-CE1 3.45Å; R275-Y364 VanDerWaalsContact CB-CE1 3.45Å; R275-Y364 HydrophobicContact CB-CE2 4Å; R275-Y364 HydrophobicContact CB-CG 4.25Å; R275-Y364 HydrophobicContact CG-CE1 4.1Å; R275-Y364 PolarHBondContact N-O 3.46Å
365	I	93.4	Very high	91.2	Very high	0 Å²	0	36 Å²	36	0%	0	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	132.6	167.6	-56.9	170.6	0	0	0	105.9	F102 V103 F105 W116 L272 I273 I274 L346 F348	F102-I365 WeakPolarHBondContact CA-O 3.49Å; F102-I365 HydrophobicContact CB-CB 4.31Å; F102-I365 HydrophobicContact CB-CG2 4.04Å; F102-I365 WeakPolarHBondContact CB-O 3.32Å; F102-I365 HydrophobicContact CD1-CB 4.08Å; F102-I365 HydrophobicContact CD1-CG2 3.84Å; F102-I365 HydrophobicContact CG-CG2 4.34Å; F102-I365 PolarHBondContact N-O 3.19Å; V103-I365 PolarHBondContact N-O 2.95Å; V103-I365 PolarHBondContact O-N 2.99Å; F105-I365 HydrophobicContact CE2-CD1 4.17Å; F105-I365 HydrophobicContact CE2-CG1 4.29Å; F105-I365 HydrophobicContact CZ-CD1 4.29Å; W116-I365 HydrophobicContact CH2-CD1 3.98Å; L272-I365 HydrophobicContact CD1-CG2 3.79Å; I273-I365 CarbonylContact O-C 3.47Å; I273-I365 WeakPolarHBondContact O-CA 3.33Å; I274-I365 HydrophobicContact CG1-CG2 4.38Å; I274-I365 HydrophobicContact CG2-CG1 4.5Å; L346-I365 HydrophobicContact CD1-CG2 4.33Å; L346-I365 HydrophobicContact CD2-CD1 4.1Å; F348-I365 HydrophobicContact CE2-CD1 3.79Å; F348-I365 HydrophobicContact CZ-CD1 3.93Å
366	G	90.6	Very high	90.9	Very high	1 Å²	1	37.3 Å²	37.3	1%	0.01	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.7	166.1	-177.9	0	0	0	0	0	111.8	R100 I273	R100-G366 CarbonylContact O-C 3.35Å; R100-G366 WeakPolarHBondContact O-CA 3.31Å; I273-G366 PolarHBondContact N-O 3.29Å; I273-G366 PolarHBondContact O-N 3.2Å
367	L	90.1	Very high	90.9	Very high	2 Å²	2	38.8 Å²	38.8	1%	0.01	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	145.2	174.9	-61	166.9	0	0	0	108.1	T99 R100 C266 Y269 H271 L272	T99-L367 CarbonylContact C-O 3.54Å; T99-L367 VanDerWaalsContact CA-O 3.25Å; T99-L367 WeakPolarHBondContact CA-O 3.34Å; R100-L367 PolarHBondContact N-O 2.78Å; R100-L367 PolarHBondContact O-N 3.35Å; C266-L367 HydrophobicContact CB-CD1 3.93Å; C266-L367 WeakPolarHBondContact SG-CD1 3.5Å; Y269-L367 HydrophobicContact CD1-CB 3.91Å; Y269-L367 HydrophobicContact CD2-CB 3.55Å; Y269-L367 HydrophobicContact CD2-CD1 3.71Å; Y269-L367 HydrophobicContact CD2-CG 4.22Å; Y269-L367 HydrophobicContact CE1-CB 4.42Å; Y269-L367 HydrophobicContact CE2-CB 4.1Å; Y269-L367 HydrophobicContact CE2-CD1 4.04Å; Y269-L367 HydrophobicContact CG-CB 3.47Å; Y269-L367 VanDerWaalsContact CG-CB 3.47Å; Y269-L367 HydrophobicContact CG-CD1 4.45Å; Y269-L367 HydrophobicContact CG-CG 4.5Å; H271-L367 CarbonylContact O-C 3.53Å; H271-L367 WeakPolarHBondContact O-CA 3.28Å; L272-L367 HydrophobicContact CD1-CD2 4.02Å
368	Y	90.8	Very high	90.8	Very high	4 Å²	4	39.2 Å²	39.2	2%	0.016	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.3	140.8	-177.9	174.1	-99.6	0	0	0	111.9	S97 R98 T99 P203 S270 H271 I273 D370	S97-Y368 VanDerWaalsContact CA-CE2 3.49Å; R98-Y368 WeakPolarHBondContact O-CA 3.15Å; T99-Y368 HydrophobicContact CG2-CD2 3.48Å; T99-Y368 VanDerWaalsContact CG2-CD2 3.48Å; T99-Y368 HydrophobicContact CG2-CE2 4.22Å; T99-Y368 HydrophobicContact CG2-CG 4.37Å; P203-Y368 HydrophobicContact CG-CD1 4.07Å; P203-Y368 HydrophobicContact CG-CD2 3.68Å; P203-Y368 HydrophobicContact CG-CE1 4.25Å; P203-Y368 HydrophobicContact CG-CE2 3.79Å; P203-Y368 HydrophobicContact CG-CG 3.79Å; S270-Y368 PolarHBondContact N-O 2.86Å; H271-Y368 HydrophobicContact CB-CD1 4.31Å; H271-Y368 PolarHBondContact N-O 3.4Å; H271-Y368 PolarHBondContact O-N 3.25Å; I273-Y368 HydrophobicContact CD1-CD2 4.32Å; I273-Y368 HydrophobicContact CD1-CG 3.96Å; Y368-D370 HydrophobicContact CD1-CB 4.14Å; Y368-D370 HydrophobicContact CE1-CB 3.67Å
369	F	90.6	Very high	90.6	Very high	32 Å²	32	43.6 Å²	43.6	14%	0.14	22%	0.221	C	C	.	.			trans	-102.1	111.2	173.3	-173.1	-103.1	0	0	0	109.4	K94 I95 S97 R98 A268 Y269 E371	K94-F369 HydrophobicContact CB-CD1 4.48Å; K94-F369 HydrophobicContact CB-CD2 4.37Å; K94-F369 HydrophobicContact CB-CE1 4.04Å; K94-F369 HydrophobicContact CB-CE2 3.94Å; K94-F369 HydrophobicContact CB-CZ 3.76Å; K94-F369 HydrophobicContact CD-CE2 4.14Å; K94-F369 HydrophobicContact CD-CZ 4.43Å; K94-F369 HydrophobicContact CG-CD2 4.43Å; K94-F369 HydrophobicContact CG-CE2 4.05Å; K94-F369 HydrophobicContact CG-CZ 4.35Å; I95-F369 VanDerWaalsContact O-CD1 3.31Å; I95-F369 WeakPolarHBondContact O-CD1 3.42Å; S97-F369 PolarHBondContact N-O 2.72Å; R98-F369 PolarHBondContact O-N 3.48Å; A268-F369 WeakPolarHBondContact O-CD2 3.48Å; Y269-F369 HydrophobicContact CD1-CB 4.24Å; F369-E371 HydrophobicContact CE1-CB 4.17Å
370	D	90.9	Very high	90.4	Very high	8 Å²	8	49 Å²	49	4%	0.043	25%	0.246	C	C	.	.			trans	-98.1	134.6	161.9	-153.9	-21.8	0	0	0	109	H96 S270 H271 K317 Y368 Q372 Q373	H96-D370 IonicContact CE1-OD1 2.66Å; H96-D370 PolarHBondContact CE1-OD1 2.93Å; H96-D370 IonicContact ND1-OD1 3.4Å; S270-D370 PolarHBondContact OG-N 3.05Å; S270-D370 PolarHBondContact OG-O 3.45Å; H271-D370 WeakPolarHBondContact CE1-CB 3.47Å; K317-D370 IonicContact NZ-OD2 3.29Å; K317-D370 PolarHBondContact NZ-OD2 2.86Å; Y368-D370 HydrophobicContact CD1-CB 4.14Å; Y368-D370 HydrophobicContact CE1-CB 3.67Å; D370-Q372 WeakPolarHBondContact OD1-CB 3.42Å; D370-Q372 WeakPolarHBondContact OD1-CG 3.26Å; D370-Q372 PolarHBondContact OD1-N 3.24Å; D370-Q373 HydrophobicContact CB-CB 4.4Å
371	E	89.3	Confident	89.9	Confident	124 Å²	124	52.6 Å²	52.6	58%	0.579	26%	0.262	S	S	*	.	S	Bend	trans	-89.7	-24.7	177.1	-176.5	177.5	-174.9	0	0	110.5	H96 F369 Q373	H96-E371 HydrophobicContact CB-CB 4.11Å; H96-E371 WeakPolarHBondContact ND1-CB 3.32Å; H96-E371 PolarHBondContact ND1-N 2.96Å; F369-E371 HydrophobicContact CE1-CB 4.17Å; E371-Q373 PolarHBondContact O-N 2.86Å
372	Q	89.5	Confident	89.2	Confident	152 Å²	152	59.3 Å²	59.3	71%	0.71	29%	0.288	S	S	*	.	S	Bend	trans	-69.3	-16.1	178.7	-54	-58.5	-47.2	0	0	112.3	D370	D370-Q372 WeakPolarHBondContact OD1-CB 3.42Å; D370-Q372 WeakPolarHBondContact OD1-CG 3.26Å; D370-Q372 PolarHBondContact OD1-N 3.24Å
373	Q	87.2	Confident	88.3	Confident	51 Å²	51	61.1 Å²	61.1	24%	0.238	30%	0.301	C	S	.	.			trans	-100.9	99.4	175.7	-172.6	71.1	20.5	0	0	109	D370 E371 E375	D370-Q373 HydrophobicContact CB-CB 4.4Å; E371-Q373 PolarHBondContact O-N 2.86Å; Q373-E375 PolarHBondContact NE2-OE2 2.81Å
374	S	86.7	Confident	87.5	Confident	108 Å²	108	70.2 Å²	70.2	76%	0.755	34%	0.34	S	S	*	.			trans	-94.2	-8.5	177.2	57.5	0	0	0	0	113.6	V376	S374-V376 PolarHBondContact O-N 3.44Å
375	E	90.1	Very high	87.1	Confident	109 Å²	109	73.8 Å²	73.8	51%	0.509	37%	0.367	S	S	.	.			trans	-67.3	125.5	-178.1	-60.7	172.1	160.4	0	0	110.4	S321 Q373	S321-E375 WeakPolarHBondContact CB-O 3.35Å; Q373-E375 PolarHBondContact NE2-OE2 2.81Å
376	V	87.1	Confident	86	Confident	110 Å²	110	76.6 Å²	76.6	67%	0.667	40%	0.396	S	S	*	.	S	Bend	trans	-82.3	-35.9	175.2	-179.9	0	0	0	0	110.2	S321 P337 S374	S321-V376 WeakPolarHBondContact CB-O 3.49Å; P337-V376 HydrophobicContact CB-CG1 4.01Å; P337-V376 HydrophobicContact CG-CG1 3.99Å; S374-V376 PolarHBondContact O-N 3.44Å
377	F	91.3	Very high	85.1	Confident	39 Å²	39	80.7 Å²	80.7	17%	0.171	42%	0.421	C	S	.	.			trans	-154.2	129.1	-178.2	-169.7	-118.5	0	0	0	110.4	Q335 P337 Y379	Q335-F377 HydrophobicContact CB-CE1 3.57Å; Q335-F377 HydrophobicContact CB-CZ 3.53Å; Q335-F377 HydrophobicContact CG-CZ 4.33Å; P337-F377 HydrophobicContact CB-CB 4.12Å; P337-F377 HydrophobicContact CB-CD2 4.18Å; P337-F377 HydrophobicContact CB-CG 4.43Å; F377-Y379 VanDerWaalsContact CD1-O 3.26Å; F377-Y379 WeakPolarHBondContact CD1-O 3.29Å; F377-Y379 HydrophobicContact CD2-CD2 4.46Å; F377-Y379 HydrophobicContact CE1-CD2 4.13Å; F377-Y379 HydrophobicContact CE1-CG 4.31Å; F377-Y379 VanDerWaalsContact CE1-O 3.25Å; F377-Y379 WeakPolarHBondContact CE1-O 3.49Å; F377-Y379 AromaticContact CE2-CD2 3.65Å; F377-Y379 HydrophobicContact CE2-CD2 3.65Å; F377-Y379 HydrophobicContact CE2-CE2 4.4Å; F377-Y379 AromaticContact CZ-CD2 3.41Å; F377-Y379 HydrophobicContact CZ-CD2 3.41Å; F377-Y379 VanDerWaalsContact CZ-CD2 3.41Å; F377-Y379 HydrophobicContact CZ-CE2 4.46Å; F377-Y379 AromaticContact CZ-CG 3.93Å; F377-Y379 HydrophobicContact CZ-CG 3.93Å
378	D	90.3	Very high	84.1	Confident	53 Å²	53	84.5 Å²	84.5	28%	0.283	45%	0.445	S	S	.	.			trans	-88.6	-16.7	-171.1	-68.5	20.1	0	0	0	113.4	S321 K322	S321-D378 WeakPolarHBondContact CB-OD1 3.47Å; S321-D378 PolarHBondContact O-N 2.97Å; S321-D378 VanDerWaalsContact O-N 3.13Å; S321-D378 PolarHBondContact OG-OD1 3.46Å; K322-D378 WeakPolarHBondContact CE-OD2 3.23Å; K322-D378 HydrophobicContact CG-CB 4.45Å; K322-D378 WeakPolarHBondContact CG-OD2 3.21Å
379	Y	90.6	Very high	82.7	Confident	99 Å²	99	92.2 Å²	92.2	39%	0.388	49%	0.485	S	S	.	.	S	Bend	trans	-93.2	137.3	-174.3	-55.5	-93	0	0	0	112.3	K322 F377	K322-Y379 WeakPolarHBondContact O-CE2 3.3Å; K322-Y379 PolarHBondContact O-OH 3.48Å; K322-Y379 VanDerWaalsContact O-OH 3.08Å; F377-Y379 VanDerWaalsContact CD1-O 3.26Å; F377-Y379 WeakPolarHBondContact CD1-O 3.29Å; F377-Y379 HydrophobicContact CD2-CD2 4.46Å; F377-Y379 HydrophobicContact CE1-CD2 4.13Å; F377-Y379 HydrophobicContact CE1-CG 4.31Å; F377-Y379 VanDerWaalsContact CE1-O 3.25Å; F377-Y379 WeakPolarHBondContact CE1-O 3.49Å; F377-Y379 AromaticContact CE2-CD2 3.65Å; F377-Y379 HydrophobicContact CE2-CD2 3.65Å; F377-Y379 HydrophobicContact CE2-CE2 4.4Å; F377-Y379 AromaticContact CZ-CD2 3.41Å; F377-Y379 HydrophobicContact CZ-CD2 3.41Å; F377-Y379 VanDerWaalsContact CZ-CD2 3.41Å; F377-Y379 HydrophobicContact CZ-CE2 4.46Å; F377-Y379 AromaticContact CZ-CG 3.93Å; F377-Y379 HydrophobicContact CZ-CG 3.93Å
380	E	86.3	Confident	82.3	Confident	122 Å²	122	95.2 Å²	95.2	57%	0.57	50%	0.502	S	S	*	.			trans	-65	142.1	178	-64	-179.7	179.7	0	0	112.1	Y382	E380-Y382 HydrophobicContact CB-CE2 4.5Å; E380-Y382 PolarHBondContact OE2-OH 3.01Å
381	Q	83.6	Confident	81.8	Confident	74 Å²	74	99.8 Å²	99.8	35%	0.346	53%	0.526	S	S	.	.			trans	-108.3	131.1	170.3	-64.6	-174.1	10.4	0	0	109.5	Q335 L389	Q335-Q381 PolarHBondContact O-NE2 3.45Å; Q381-L389 HydrophobicContact CB-CB 4.34Å; Q381-L389 HydrophobicContact CB-CD1 4.4Å; Q381-L389 PolarHBondContact O-N 3.34Å
382	Y	78	Confident	81.4	Confident	146 Å²	146	98.4 Å²	98.4	57%	0.573	52%	0.523	S	S	*	.	B	Isolated β-bridge	trans	-99.9	129.8	174.1	-59.3	-76.6	0	0	0	110.2	E380 V388	E380-Y382 HydrophobicContact CB-CE2 4.5Å; E380-Y382 PolarHBondContact OE2-OH 3.01Å; Y382-V388 HydrophobicContact CD1-CG2 4.11Å; Y382-V388 HydrophobicContact CE1-CG2 3.83Å
383	S	74.9	Confident	81	Confident	38 Å²	38	95.3 Å²	95.3	27%	0.266	51%	0.512	S	S	.	.			trans	-64.8	154.4	161.6	176.1	0	0	0	0	109.9	S385 G386 T387	S383-S385 WeakPolarHBondContact CB-OG 3.47Å; S383-S385 PolarHBondContact O-N 2.89Å; S383-S385 VanDerWaalsContact O-N 3.07Å; S383-S385 PolarHBondContact OG-N 2.99Å; S383-S385 PolarHBondContact OG-OG 3.47Å; S383-G386 PolarHBondContact O-N 3.48Å; S383-T387 WeakPolarHBondContact CB-O 3.48Å; S383-T387 PolarHBondContact N-O 3.19Å
384	K	75.6	Confident	80.6	Confident	191 Å²	191	98.1 Å²	98.1	83%	0.83	53%	0.53	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.1	-23.4	170.6	-71.9	-174.4	176.7	-175.7	0	112.7	G386	K384-G386 PolarHBondContact O-N 3.11Å
385	S	81.7	Confident	80.2	Confident	86 Å²	86	97.4 Å²	97.4	60%	0.601	52%	0.515	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.7	-4	174	59	0	0	0	0	114.1	S383 T387	S383-S385 WeakPolarHBondContact CB-OG 3.47Å; S383-S385 PolarHBondContact O-N 2.89Å; S383-S385 VanDerWaalsContact O-N 3.07Å; S383-S385 PolarHBondContact OG-N 2.99Å; S383-S385 PolarHBondContact OG-OG 3.47Å; S385-T387 VanDerWaalsContact C-N 3.28Å; S385-T387 PolarHBondContact OG-OG1 3.34Å
386	G	70.1	Confident	79.4	Confident	60 Å²	60	96.6 Å²	96.6	62%	0.619	52%	0.515	S	S	*	.	S	Bend	trans	80.3	3.6	-174.5	0	0	0	0	0	114.3	S383 K384	S383-G386 PolarHBondContact O-N 3.48Å; K384-G386 PolarHBondContact O-N 3.11Å
387	T	72.6	Confident	78.9	Confident	87 Å²	87	95.5 Å²	95.5	53%	0.534	50%	0.503	S	S	.	.			trans	-85.1	134.2	176.1	-37.8	0	0	0	0	109.9	S383 S385	S383-T387 WeakPolarHBondContact CB-O 3.48Å; S383-T387 PolarHBondContact N-O 3.19Å; S385-T387 VanDerWaalsContact C-N 3.28Å; S385-T387 PolarHBondContact OG-OG1 3.34Å
388	V	69.3	Low	77.8	Confident	82 Å²	82	100.3 Å²	100.3	50%	0.497	53%	0.531	S	S	.	.	B	Isolated β-bridge	trans	-64.5	132.5	169.5	-177.6	0	0	0	0	108.6	Y382	Y382-V388 HydrophobicContact CD1-CG2 4.11Å; Y382-V388 HydrophobicContact CE1-CG2 3.83Å
389	L	61	Low	76.7	Confident	165 Å²	165	104.5 Å²	104.5	86%	0.864	55%	0.553	S	S	*	*			trans	-83.7	0	179.6	-74.1	175.2	0	0	0	113.1	Q381	Q381-L389 HydrophobicContact CB-CB 4.34Å; Q381-L389 HydrophobicContact CB-CD1 4.4Å; Q381-L389 PolarHBondContact O-N 3.34Å

Retrieved 389 of 389 residues in 417.5 ms (Link to these results)

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