A0A5K4EVN5_SCHMA Loading...

GOLD domain-containing protein

AlphaFold DB , UniProt , Accession A0A5K4EVN5, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 358 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	31.9	Very low	35.1	Very low	254 Å²	254	140 Å²	140	100%	1.251	78%	0.775	S	S	*	*				0	116.2	0	-85.5	-153.4	-101.1	0	0	108.1
2	G	35.8	Very low	34.8	Very low	74 Å²	74	137.8 Å²	137.8	76%	0.763	76%	0.761	S	S	*	*			trans	90.5	69.9	171.6	0	0	0	0	0	116.2	F4	G2-F4 PolarHBondContact O-N 3.01Å
3	E	35	Very low	34.6	Very low	190 Å²	190	142.2 Å²	142.2	89%	0.888	77%	0.768	S	S	*	*			trans	-70.3	114.7	163.2	-70.3	173.8	170.1	0	0	108.7
4	F	36	Very low	34.6	Very low	188 Å²	188	147.1 Å²	147.1	83%	0.825	78%	0.779	S	S	*	*			trans	-108.5	89.6	172.8	-127.4	-87.3	0	0	0	107.6	G2 T6	G2-F4 PolarHBondContact O-N 3.01Å; F4-T6 HydrophobicContact CD1-CG2 4.08Å; F4-T6 PolarHBondContact O-N 3.33Å
5	E	33.6	Very low	34	Very low	173 Å²	173	149.4 Å²	149.4	81%	0.808	78%	0.783	S	S	*	*			trans	-73.1	104.2	168.6	-69.4	-176	152.7	0	0	108.8
6	T	38	Very low	33.7	Very low	107 Å²	107	147.2 Å²	147.2	66%	0.656	78%	0.778	S	S	*	*			trans	-93.5	100.8	169.4	54.2	0	0	0	0	109.5	F4 V8	F4-T6 HydrophobicContact CD1-CG2 4.08Å; F4-T6 PolarHBondContact O-N 3.33Å; T6-V8 PolarHBondContact O-N 3.3Å
7	N	31.5	Very low	33.6	Very low	129 Å²	129	148.3 Å²	148.3	69%	0.69	78%	0.784	S	S	*	*			trans	-66.7	117	167.1	-82.9	-61.1	0	0	0	109.8
8	V	36.6	Very low	33.3	Very low	88 Å²	88	146.1 Å²	146.1	53%	0.533	78%	0.782	S	S	.	*			trans	-108.1	107.1	168.9	-179.5	0	0	0	0	108	T6	T6-V8 PolarHBondContact O-N 3.3Å
9	S	35.6	Very low	33.4	Very low	104 Å²	104	147.1 Å²	147.1	73%	0.727	79%	0.787	S	S	*	*			trans	-76.4	132.1	171.7	-66.9	0	0	0	0	111.2
10	N	33.9	Very low	33.5	Very low	115 Å²	115	147 Å²	147	62%	0.615	79%	0.786	S	S	*	*			trans	-28.7	132	168.5	-170.4	18.6	0	0	0	116	D12	N10-D12 PolarHBondContact ND2-OD2 2.69Å
11	P	38.3	Very low	33.4	Very low	118 Å²	118	147.5 Å²	147.5	77%	0.766	79%	0.789	S	S	*	*			trans	-108	85.4	161.1	35.9	-24.3	0	0	0	111.4	K13	P11-K13 PolarHBondContact O-N 3.1Å
12	D	31.7	Very low	33.9	Very low	114 Å²	114	140.1 Å²	140.1	61%	0.61	76%	0.76	S	S	*	*			trans	-70.6	106.3	154.5	-85.2	-50.1	0	0	0	108.7	N10	N10-D12 PolarHBondContact ND2-OD2 2.69Å
13	K	32.5	Very low	33.9	Very low	195 Å²	195	141.9 Å²	141.9	85%	0.848	76%	0.76	S	S	*	*			trans	-168.8	94.2	160.5	-110.5	168.6	-170	179.3	0	111.3	P11	P11-K13 PolarHBondContact O-N 3.1Å
14	F	33.7	Very low	33.9	Very low	211 Å²	211	140.1 Å²	140.1	93%	0.925	76%	0.757	S	S	*	*			trans	-153.2	81.2	143.6	-120.9	-81.7	0	0	0	110.4
15	E	26.2	Very low	33.9	Very low	181 Å²	181	135 Å²	135	85%	0.846	75%	0.745	S	S	*	*			trans	-88.1	137.2	149.8	-93.5	-175.3	150.9	0	0	108.3
16	T	29.5	Very low	34.2	Very low	114 Å²	114	134.1 Å²	134.1	70%	0.699	75%	0.745	S	S	*	*				139.1	119.8	124.8	-29.2	0	0	0	0	109.7
17	L	31.2	Very low	33.9	Very low	166 Å²	166	136.3 Å²	136.3	87%	0.869	75%	0.748	S	S	*	*				179.8	98.1	116.6	-87.1	178.6	0	0	0	109.5
18	S	28.2	Very low	34.3	Very low	109 Å²	109	138.6 Å²	138.6	76%	0.762	76%	0.759	S	S	*	*			trans	-67.6	148.4	168.7	-57.5	0	0	0	0	112.5
19	L	34.8	Very low	34.1	Very low	165 Å²	165	141.8 Å²	141.8	86%	0.864	77%	0.768	S	S	*	*			trans	-142.6	90.8	161.4	-104.8	148.3	0	0	0	110.4
20	N	36.4	Very low	34	Very low	144 Å²	144	145 Å²	145	77%	0.77	77%	0.771	S	S	*	*			trans	36.6	111.4	140.5	-57.2	-22.9	0	0	0	122.5
21	D	32	Very low	33.8	Very low	158 Å²	158	145.3 Å²	145.3	85%	0.845	78%	0.777	S	S	*	*			trans	-22.1	-179.9	141	-101.7	-20.1	0	0	0	120.9
22	P	41.7	Very low	33.4	Very low	99 Å²	99	144.8 Å²	144.8	64%	0.643	78%	0.776	S	S	*	*			cis	-143.4	-166.9	-27.6	36.5	-16.1	0	0	0	114.5
23	S	34.6	Very low	33.5	Very low	111 Å²	111	146 Å²	146	78%	0.776	79%	0.788	S	S	*	*			trans	89.5	118.6	154.4	61.7	0	0	0	0	119.7
24	D	36.5	Very low	33.5	Very low	154 Å²	154	148.2 Å²	148.2	82%	0.824	79%	0.79	S	S	*	*				-174.2	155.8	90.2	-146.3	-14	0	0	0	112.9
25	S	35.9	Very low	33.6	Very low	81 Å²	81	143.8 Å²	143.8	57%	0.566	78%	0.78	S	S	*	*			trans	-56.4	150.6	-177.4	51.9	0	0	0	0	118.5
26	N	38.5	Very low	33.7	Very low	153 Å²	153	143.2 Å²	143.2	82%	0.818	78%	0.775	S	S	*	*				177.6	140.7	110.8	-91.2	-47.6	0	0	0	114.4
27	E	33.6	Very low	33.7	Very low	154 Å²	154	145.9 Å²	145.9	72%	0.72	78%	0.78	S	S	*	*			trans	-58.8	159.4	173.2	-65.6	169.5	124.1	0	0	113.7
28	I	39.5	Very low	33.6	Very low	176 Å²	176	141.4 Å²	141.4	90%	0.903	77%	0.774	S	S	*	*				-165.3	143.6	117.1	-84.3	144	0	0	0	110.1
29	H	32.7	Very low	33.6	Very low	156 Å²	156	145.8 Å²	145.8	72%	0.722	78%	0.779	S	S	*	*			trans	-67.2	171.2	-170.5	-95.4	-107.3	0	0	0	118.8
30	E	33	Very low	33.5	Very low	171 Å²	171	142.5 Å²	142.5	80%	0.799	77%	0.769	S	S	*	*			trans	89.3	133	147.7	-96.7	-174.6	156.3	0	0	117.2
31	T	30.4	Very low	33.8	Very low	122 Å²	122	143.5 Å²	143.5	75%	0.748	78%	0.775	S	S	*	*			cis	-161.4	150.9	13.3	-27.7	0	0	0	0	109.6
32	S	28.6	Very low	34.5	Very low	107 Å²	107	142.2 Å²	142.2	75%	0.748	77%	0.768	S	S	*	*			trans	-65.1	132.9	176.4	172.5	0	0	0	0	114.6
33	V	33.1	Very low	34.6	Very low	139 Å²	139	145.9 Å²	145.9	84%	0.842	78%	0.776	S	S	*	*			trans	-145.1	124.8	145.4	-177.7	0	0	0	0	109.2
34	R	32.9	Very low	35.4	Very low	241 Å²	241	143.3 Å²	143.3	91%	0.909	77%	0.767	S	S	*	*			trans	-115.6	108.1	177	-163.3	-171.9	-151.9	-170.5	7.8	109
35	V	35.6	Very low	37	Very low	118 Å²	118	139.7 Å²	139.7	72%	0.715	75%	0.748	S	S	*	*			trans	-154.7	97	166.2	-179.1	0	0	0	0	106.9
36	K	29.7	Very low	38.6	Very low	169 Å²	169	139.9 Å²	139.9	74%	0.735	74%	0.742	S	S	*	*				79.1	134.7	108.2	-74.5	-173.6	168.6	-165.5	0	116.4
37	E	29.2	Very low	40.6	Very low	170 Å²	170	134 Å²	134	79%	0.794	72%	0.718	S	S	*	*			trans	82.2	121.3	147.6	-71.4	159.6	-156.2	0	0	117.3
38	G	28.5	Very low	42.9	Very low	72 Å²	72	131.3 Å²	131.3	74%	0.742	71%	0.705	S	S	*	*			trans	-76.3	156.8	-171.9	0	0	0	0	0	114
39	F	28.3	Very low	44.7	Very low	201 Å²	201	124.3 Å²	124.3	88%	0.882	67%	0.668	S	S	*	*			trans	-170.9	115.5	158	-128.7	-102	0	0	0	108.2
40	C	32.4	Very low	47.2	Very low	97 Å²	97	120.6 Å²	120.6	66%	0.655	65%	0.652	S	S	*	*			trans	61.3	98.3	156.9	-59.7	0	0	0	0	121.5
41	D	42.2	Very low	49.7	Very low	165 Å²	165	117.6 Å²	117.6	88%	0.882	64%	0.64	S	S	*	*			trans	-91.5	2.2	159.9	-88.2	-37.2	0	0	0	113.8	Q43	D41-Q43 PolarHBondContact O-N 2.95Å
42	D	48.6	Very low	52.3	Low	130 Å²	130	114.6 Å²	114.6	70%	0.695	62%	0.617	S	S	*	*	H	α-helix	trans	-72.8	-20.5	-170.7	-161.1	33.6	0	0	0	114.5
43	Q	42.8	Very low	54.9	Low	177 Å²	177	109.6 Å²	109.6	83%	0.827	58%	0.582	S	S	*	*	H	α-helix	trans	-79.3	-26.4	-178.2	-75.5	-173.3	4.4	0	0	114	D41	D41-Q43 PolarHBondContact O-N 2.95Å
44	G	51.7	Low	57.6	Low	57 Å²	57	106.5 Å²	106.5	59%	0.588	56%	0.557	S	S	*	*	H	α-helix	trans	-72	-37.4	-178.2	0	0	0	0	0	112.7	Q48	G44-Q48 PolarHBondContact O-N 2.95Å
45	D	69.4	Low	60.1	Low	77 Å²	77	98.4 Å²	98.4	41%	0.412	54%	0.538	S	S	.	.	H	α-helix	trans	-71.4	-43.1	-177.6	-178.3	44.2	0	0	0	112	G47 Q48 K49	D45-G47 VanDerWaalsContact C-N 3.35Å; D45-G47 PolarHBondContact O-N 3.18Å; D45-Q48 PolarHBondContact O-N 3.12Å; D45-K49 WeakPolarHBondContact O-CG 3.42Å; D45-K49 PolarHBondContact O-N 2.73Å; D45-K49 WeakPolarHBondContact OD1-CE 3.35Å; D45-K49 IonicContact OD1-NZ 2.69Å; D45-K49 WeakPolarHBondContact OD2-CE 3.32Å; D45-K49 IonicContact OD2-NZ 3.56Å; D45-K49 PolarHBondContact OD2-NZ 3.39Å
46	L	69.9	Low	62.4	Low	85 Å²	85	93.3 Å²	93.3	45%	0.445	51%	0.508	S	S	.	.	H	α-helix	trans	-63	-41.2	178.9	-166	72.2	0	0	0	112.2	Q48 K49 E50	L46-Q48 VanDerWaalsContact C-N 3.33Å; L46-Q48 PolarHBondContact O-N 3.35Å; L46-K49 PolarHBondContact O-N 3.46Å; L46-E50 WeakPolarHBondContact O-CG 3.41Å; L46-E50 PolarHBondContact O-N 3.05Å
47	G	80.9	Confident	65.1	Low	31 Å²	31	85.4 Å²	85.4	32%	0.32	47%	0.474	S	S	.	.	H	α-helix	trans	-63.4	-38.2	177.8	0	0	0	0	0	112.7	D45 E50 I51	D45-G47 VanDerWaalsContact C-N 3.35Å; D45-G47 PolarHBondContact O-N 3.18Å; G47-E50 PolarHBondContact O-N 3.2Å; G47-I51 VanDerWaalsContact O-CG1 3.31Å; G47-I51 WeakPolarHBondContact O-CG1 3.49Å; G47-I51 PolarHBondContact O-N 2.97Å
48	Q	80.7	Confident	67.9	Low	96 Å²	96	79.7 Å²	79.7	45%	0.449	45%	0.45	S	S	.	.	H	α-helix	trans	-66.6	-43.5	175.5	-176.3	57.1	39.7	0	0	111.4	G44 D45 L46 E50 I51 E52	G44-Q48 PolarHBondContact O-N 2.95Å; D45-Q48 PolarHBondContact O-N 3.12Å; L46-Q48 VanDerWaalsContact C-N 3.33Å; L46-Q48 PolarHBondContact O-N 3.35Å; Q48-E50 VanDerWaalsContact C-N 3.35Å; Q48-E50 PolarHBondContact O-N 2.87Å; Q48-I51 WeakPolarHBondContact O-CB 3.17Å; Q48-I51 PolarHBondContact O-N 2.94Å; Q48-E52 PolarHBondContact NE2-OE1 3.21Å; Q48-E52 PolarHBondContact O-N 3.4Å; Q48-E52 VanDerWaalsContact O-N 3.08Å
49	K	77.9	Confident	70.6	Confident	29 Å²	29	80.4 Å²	80.4	13%	0.126	43%	0.434	C	S	.	.	H	α-helix	trans	-59.2	-43.5	175.7	-70.7	171.8	173.1	169.2	0	112.1	D45 L46 I51 E52 I53 P140	D45-K49 WeakPolarHBondContact O-CG 3.42Å; D45-K49 PolarHBondContact O-N 2.73Å; D45-K49 WeakPolarHBondContact OD1-CE 3.35Å; D45-K49 IonicContact OD1-NZ 2.69Å; D45-K49 WeakPolarHBondContact OD2-CE 3.32Å; D45-K49 IonicContact OD2-NZ 3.56Å; D45-K49 PolarHBondContact OD2-NZ 3.39Å; L46-K49 PolarHBondContact O-N 3.46Å; K49-I51 VanDerWaalsContact C-N 3.32Å; K49-I51 PolarHBondContact O-N 2.83Å; K49-E52 PolarHBondContact O-N 3.37Å; K49-I53 VanDerWaalsContact O-CG1 3.28Å; K49-I53 WeakPolarHBondContact O-CG1 3.5Å; K49-I53 PolarHBondContact O-N 2.88Å; K49-P140 HydrophobicContact CB-CG 4.14Å; K49-P140 HydrophobicContact CD-CG 3.82Å; K49-P140 HydrophobicContact CG-CG 3.79Å
50	E	85.2	Confident	73.1	Confident	79 Å²	79	73.1 Å²	73.1	37%	0.369	40%	0.403	S	S	.	.	H	α-helix	trans	-61.4	-39.2	176.2	-77.3	-178.4	-174.4	0	0	112.5	L46 G47 Q48 K54 F92	L46-E50 WeakPolarHBondContact O-CG 3.41Å; L46-E50 PolarHBondContact O-N 3.05Å; G47-E50 PolarHBondContact O-N 3.2Å; Q48-E50 VanDerWaalsContact C-N 3.35Å; Q48-E50 PolarHBondContact O-N 2.87Å; E50-K54 VanDerWaalsContact O-CB 3.29Å; E50-K54 WeakPolarHBondContact O-CB 3.48Å; E50-K54 PolarHBondContact O-N 3.22Å; E50-F92 HydrophobicContact CB-CZ 4.19Å; E50-F92 WeakPolarHBondContact O-CZ 3.48Å
51	I	86.8	Confident	75.5	Confident	107 Å²	107	68.5 Å²	68.5	55%	0.549	37%	0.372	S	S	.	.	H	α-helix	trans	-63.6	-43.2	176.1	-68.6	164.8	0	0	0	110.9	G47 Q48 K49 K54 S55	G47-I51 VanDerWaalsContact O-CG1 3.31Å; G47-I51 WeakPolarHBondContact O-CG1 3.49Å; G47-I51 PolarHBondContact O-N 2.97Å; Q48-I51 WeakPolarHBondContact O-CB 3.17Å; Q48-I51 PolarHBondContact O-N 2.94Å; K49-I51 VanDerWaalsContact C-N 3.32Å; K49-I51 PolarHBondContact O-N 2.83Å; I51-K54 PolarHBondContact O-N 2.95Å; I51-S55 WeakPolarHBondContact O-CB 3.36Å; I51-S55 PolarHBondContact O-N 3.5Å
52	E	83.7	Confident	77.6	Confident	60 Å²	60	65.6 Å²	65.6	28%	0.28	35%	0.351	S	S	.	.	H	α-helix	trans	-66.1	-45.2	179.3	-70.3	174.1	-162.7	0	0	111.6	Q48 K49 K54 S55 A56 I142 Q327	Q48-E52 PolarHBondContact NE2-OE1 3.21Å; Q48-E52 PolarHBondContact O-N 3.4Å; Q48-E52 VanDerWaalsContact O-N 3.08Å; K49-E52 PolarHBondContact O-N 3.37Å; E52-K54 VanDerWaalsContact C-N 3.33Å; E52-K54 PolarHBondContact O-N 3.42Å; E52-S55 PolarHBondContact O-N 3.22Å; E52-A56 PolarHBondContact O-N 2.88Å; E52-I142 HydrophobicContact CB-CD1 3.54Å; E52-Q327 PolarHBondContact OE2-NE2 2.93Å; E52-Q327 PolarHBondContact OE2-OE1 3.26Å
53	I	84	Confident	79.3	Confident	1 Å²	1	64.3 Å²	64.3	1%	0.005	34%	0.344	C	S	.	.	H	α-helix	trans	-58.3	-47.4	173.6	-67.3	166.7	0	0	0	110	K49 S55 A56 L57 F92 Y95 L96 Y100 P140 I142	K49-I53 VanDerWaalsContact O-CG1 3.28Å; K49-I53 WeakPolarHBondContact O-CG1 3.5Å; K49-I53 PolarHBondContact O-N 2.88Å; I53-S55 VanDerWaalsContact C-N 3.34Å; I53-S55 PolarHBondContact O-N 3.26Å; I53-A56 PolarHBondContact O-N 3.18Å; I53-L57 HydrophobicContact CG2-CD1 3.73Å; I53-L57 HydrophobicContact CG2-CG 4.37Å; I53-L57 VanDerWaalsContact O-CG 3.28Å; I53-L57 WeakPolarHBondContact O-CG 3.38Å; I53-L57 PolarHBondContact O-N 3.45Å; I53-F92 HydrophobicContact CB-CE2 4.28Å; I53-F92 HydrophobicContact CG2-CD2 4.38Å; I53-F92 HydrophobicContact CG2-CE2 3.91Å; I53-Y95 HydrophobicContact CG2-CD1 3.64Å; I53-Y95 HydrophobicContact CG2-CE1 3.48Å; I53-Y95 VanDerWaalsContact CG2-CE1 3.48Å; I53-L96 HydrophobicContact CD1-CD2 4.37Å; I53-L96 HydrophobicContact CG2-CD2 4.43Å; I53-Y100 HydrophobicContact CD1-CD2 3.89Å; I53-Y100 HydrophobicContact CD1-CE2 3.62Å; I53-P140 HydrophobicContact CD1-CB 4.47Å; I53-I142 HydrophobicContact CG1-CD1 4.12Å; I53-I142 HydrophobicContact CG1-CG1 4.03Å
54	K	88.4	Confident	81.3	Confident	75 Å²	75	59.2 Å²	59.2	33%	0.326	32%	0.322	S	S	.	.	H	α-helix	trans	-60	-45.6	179	-169.4	168.5	-175.2	167.3	0	111.3	E50 I51 E52 A56 L57 V58 D89 F92	E50-K54 VanDerWaalsContact O-CB 3.29Å; E50-K54 WeakPolarHBondContact O-CB 3.48Å; E50-K54 PolarHBondContact O-N 3.22Å; I51-K54 PolarHBondContact O-N 2.95Å; E52-K54 VanDerWaalsContact C-N 3.33Å; E52-K54 PolarHBondContact O-N 3.42Å; K54-A56 PolarHBondContact O-N 3.4Å; K54-L57 PolarHBondContact O-N 3.1Å; K54-V58 HydrophobicContact CG-CG2 4.43Å; K54-V58 WeakPolarHBondContact O-CB 3.37Å; K54-V58 WeakPolarHBondContact O-CG2 3.42Å; K54-V58 PolarHBondContact O-N 2.99Å; K54-D89 WeakPolarHBondContact CE-OD1 3.18Å; K54-D89 IonicContact NZ-OD1 3.99Å; K54-D89 PolarHBondContact NZ-OD1 2.94Å; K54-F92 HydrophobicContact CB-CD2 3.81Å; K54-F92 HydrophobicContact CB-CE2 3.54Å; K54-F92 HydrophobicContact CB-CG 4.43Å; K54-F92 HydrophobicContact CB-CZ 3.92Å; K54-F92 HydrophobicContact CD-CD1 4.24Å; K54-F92 HydrophobicContact CD-CE1 4.28Å; K54-F92 HydrophobicContact CD-CG 4.38Å; K54-F92 HydrophobicContact CD-CZ 4.46Å; K54-F92 HydrophobicContact CG-CD2 4.02Å; K54-F92 HydrophobicContact CG-CE2 4.19Å; K54-F92 HydrophobicContact CG-CG 4.19Å; K54-F92 HydrophobicContact CG-CZ 4.48Å
55	S	87.2	Confident	83.1	Confident	71 Å²	71	56.7 Å²	56.7	50%	0.497	30%	0.295	S	S	.	.	H	α-helix	trans	-61.3	-43.2	178.9	-174.1	0	0	0	0	112.2	I51 E52 I53 V58 Q59	I51-S55 WeakPolarHBondContact O-CB 3.36Å; I51-S55 PolarHBondContact O-N 3.5Å; E52-S55 PolarHBondContact O-N 3.22Å; I53-S55 VanDerWaalsContact C-N 3.34Å; I53-S55 PolarHBondContact O-N 3.26Å; S55-V58 PolarHBondContact O-N 3.38Å; S55-Q59 PolarHBondContact O-N 3.36Å
56	A	83.8	Confident	84.2	Confident	10 Å²	10	56.1 Å²	56.1	8%	0.083	29%	0.29	C	S	.	.	H	α-helix	trans	-62.8	-47.1	177.7	0	0	0	0	0	111.8	E52 I53 K54 V58 Q59 Q60 I142	E52-A56 PolarHBondContact O-N 2.88Å; I53-A56 PolarHBondContact O-N 3.18Å; K54-A56 PolarHBondContact O-N 3.4Å; A56-V58 VanDerWaalsContact C-N 3.34Å; A56-V58 PolarHBondContact O-N 2.95Å; A56-Q59 PolarHBondContact O-N 3Å; A56-Q60 WeakPolarHBondContact O-CB 3.33Å; A56-Q60 PolarHBondContact O-N 3.37Å; A56-I142 HydrophobicContact CB-CG2 3.5Å
57	L	85.7	Confident	85.1	Confident	4 Å²	4	57 Å²	57	2%	0.021	29%	0.292	C	S	.	.	H	α-helix	trans	-65.3	-36.2	178.8	-65.5	168.9	0	0	0	112.4	I53 K54 Q60 T61 Y91 F92 Y95 P143	I53-L57 HydrophobicContact CG2-CD1 3.73Å; I53-L57 HydrophobicContact CG2-CG 4.37Å; I53-L57 VanDerWaalsContact O-CG 3.28Å; I53-L57 WeakPolarHBondContact O-CG 3.38Å; I53-L57 PolarHBondContact O-N 3.45Å; K54-L57 PolarHBondContact O-N 3.1Å; L57-Q60 PolarHBondContact O-N 3.06Å; L57-T61 WeakPolarHBondContact O-CB 3.49Å; L57-T61 WeakPolarHBondContact O-CG2 3.4Å; L57-T61 PolarHBondContact O-N 2.91Å; L57-T61 PolarHBondContact O-OG1 2.94Å; L57-Y91 HydrophobicContact CB-CD1 4.12Å; L57-Y91 HydrophobicContact CB-CE1 3.95Å; L57-Y91 HydrophobicContact CD2-CD1 4.31Å; L57-Y91 HydrophobicContact CD2-CE1 3.48Å; L57-Y91 VanDerWaalsContact CD2-CE1 3.48Å; L57-Y91 HydrophobicContact CG-CE1 4.17Å; L57-F92 HydrophobicContact CD1-CD2 3.86Å; L57-Y95 HydrophobicContact CD1-CD1 3.75Å; L57-Y95 HydrophobicContact CD1-CD2 4.21Å; L57-Y95 HydrophobicContact CD1-CE1 4.46Å; L57-Y95 HydrophobicContact CD1-CG 3.63Å; L57-Y95 HydrophobicContact CD2-CD2 3.85Å; L57-Y95 HydrophobicContact CD2-CE2 4.21Å; L57-Y95 HydrophobicContact CD2-CG 4.13Å; L57-P143 HydrophobicContact CD2-CG 4.11Å
58	V	88.2	Confident	85.5	Confident	49 Å²	49	57.9 Å²	57.9	30%	0.297	29%	0.286	S	S	.	.	H	α-helix	trans	-61.5	-46.2	173.1	161.6	0	0	0	0	110.6	K54 S55 A56 T61 K62 Q88	K54-V58 HydrophobicContact CG-CG2 4.43Å; K54-V58 WeakPolarHBondContact O-CB 3.37Å; K54-V58 WeakPolarHBondContact O-CG2 3.42Å; K54-V58 PolarHBondContact O-N 2.99Å; S55-V58 PolarHBondContact O-N 3.38Å; A56-V58 VanDerWaalsContact C-N 3.34Å; A56-V58 PolarHBondContact O-N 2.95Å; V58-T61 PolarHBondContact O-N 3Å; V58-T61 PolarHBondContact O-OG1 3.02Å; V58-K62 PolarHBondContact O-N 3.22Å; V58-K62 VanDerWaalsContact O-N 3.1Å; V58-Q88 HydrophobicContact CG2-CB 4.38Å; V58-Q88 HydrophobicContact CG2-CG 4.28Å
59	Q	84.3	Confident	86.1	Confident	87 Å²	87	53.3 Å²	53.3	41%	0.407	26%	0.264	S	S	.	.	H	α-helix	trans	-67.2	-39.3	-179.9	-170.4	177.8	1.4	0	0	111.6	S55 A56 T61 T145	S55-Q59 PolarHBondContact O-N 3.36Å; A56-Q59 PolarHBondContact O-N 3Å; Q59-T61 VanDerWaalsContact C-N 3.35Å; Q59-T61 PolarHBondContact O-N 2.82Å; Q59-T145 HydrophobicContact CB-CG2 3.67Å; Q59-T145 HydrophobicContact CG-CG2 3.43Å; Q59-T145 VanDerWaalsContact CG-CG2 3.43Å
60	Q	80.4	Confident	86.8	Confident	49 Å²	49	58 Å²	58	23%	0.229	28%	0.281	C	S	.	.	H	α-helix	trans	-64	-37.1	177.3	-168.5	-168.4	-4.8	0	0	112.7	A56 L57 L274	A56-Q60 WeakPolarHBondContact O-CB 3.33Å; A56-Q60 PolarHBondContact O-N 3.37Å; L57-Q60 PolarHBondContact O-N 3.06Å; Q60-L274 PolarHBondContact NE2-O 3.44Å
61	T	83.8	Confident	87.2	Confident	0 Å²	0	60 Å²	60	0%	0	29%	0.291	C	S	.	.	H	α-helix	trans	-92.8	-8.7	-174.6	54.2	0	0	0	0	114.2	L57 V58 Q59 D63 L64 Y65 Y91 L274	L57-T61 WeakPolarHBondContact O-CB 3.49Å; L57-T61 WeakPolarHBondContact O-CG2 3.4Å; L57-T61 PolarHBondContact O-N 2.91Å; L57-T61 PolarHBondContact O-OG1 2.94Å; V58-T61 PolarHBondContact O-N 3Å; V58-T61 PolarHBondContact O-OG1 3.02Å; Q59-T61 VanDerWaalsContact C-N 3.35Å; Q59-T61 PolarHBondContact O-N 2.82Å; T61-D63 PolarHBondContact O-N 3.43Å; T61-L64 PolarHBondContact O-N 3.38Å; T61-Y65 VanDerWaalsContact CB-CE2 3.45Å; T61-Y65 HydrophobicContact CG2-CD2 4.43Å; T61-Y65 HydrophobicContact CG2-CE1 4.23Å; T61-Y65 HydrophobicContact CG2-CE2 3.8Å; T61-Y65 WeakPolarHBondContact O-CB 3.45Å; T61-Y65 PolarHBondContact O-N 3.49Å; T61-Y91 HydrophobicContact CG2-CD1 3.67Å; T61-Y91 HydrophobicContact CG2-CE1 3.58Å; T61-L274 HydrophobicContact CG2-CD1 4.1Å; T61-L274 HydrophobicContact CG2-CD2 3.92Å
62	K	86.1	Confident	87.4	Confident	103 Å²	103	58 Å²	58	45%	0.448	28%	0.279	S	S	.	.	H	α-helix	trans	-49.8	-60.9	-169.1	-175.9	-176	175.2	-172.5	0	113.8	V58 L64 Y65 E66	V58-K62 PolarHBondContact O-N 3.22Å; V58-K62 VanDerWaalsContact O-N 3.1Å; K62-L64 VanDerWaalsContact C-N 3.35Å; K62-L64 PolarHBondContact O-N 2.84Å; K62-Y65 PolarHBondContact O-N 3.21Å; K62-E66 WeakPolarHBondContact CE-OE1 3.06Å; K62-E66 HydrophobicContact CG-CG 4.43Å; K62-E66 WeakPolarHBondContact CG-OE1 3.39Å; K62-E66 VanDerWaalsContact O-CB 3.3Å; K62-E66 WeakPolarHBondContact O-CB 3.5Å; K62-E66 VanDerWaalsContact O-CG 3.29Å; K62-E66 WeakPolarHBondContact O-CG 3.42Å; K62-E66 PolarHBondContact O-N 2.87Å
63	D	83.8	Confident	87.9	Confident	104 Å²	104	58.5 Å²	58.5	56%	0.556	28%	0.28	S	S	*	.	H	α-helix	trans	-65.8	-39.9	-171.7	-67.9	-26.6	0	0	0	111.9	T61 Q67	T61-D63 PolarHBondContact O-N 3.43Å; D63-Q67 WeakPolarHBondContact O-CB 3.46Å; D63-Q67 PolarHBondContact O-N 2.65Å
64	L	85.1	Confident	88.3	Confident	69 Å²	69	62.9 Å²	62.9	36%	0.361	31%	0.309	S	S	.	.	H	α-helix	trans	-63.6	-48.3	177.8	177.5	64	0	0	0	111.3	T61 K62 Q67 Y68 P270 L274	T61-L64 PolarHBondContact O-N 3.38Å; K62-L64 VanDerWaalsContact C-N 3.35Å; K62-L64 PolarHBondContact O-N 2.84Å; L64-Q67 PolarHBondContact O-N 3.34Å; L64-Y68 WeakPolarHBondContact O-CB 3.38Å; L64-Y68 PolarHBondContact O-N 3.48Å; L64-P270 HydrophobicContact CD2-CG 4.43Å; L64-L274 HydrophobicContact CD2-CD1 3.82Å; L64-L274 HydrophobicContact CD2-CD2 3.94Å; L64-L274 HydrophobicContact CD2-CG 4.06Å
65	Y	90.5	Very high	88.5	Confident	5 Å²	5	69.2 Å²	69.2	2%	0.02	34%	0.336	C	S	.	.	H	α-helix	trans	-71.1	-37	-177.9	-72.7	2.7	0	0	0	111.7	T61 K62 Y68 A69 M87 Q88 L274	T61-Y65 VanDerWaalsContact CB-CE2 3.45Å; T61-Y65 HydrophobicContact CG2-CD2 4.43Å; T61-Y65 HydrophobicContact CG2-CE1 4.23Å; T61-Y65 HydrophobicContact CG2-CE2 3.8Å; T61-Y65 WeakPolarHBondContact O-CB 3.45Å; T61-Y65 PolarHBondContact O-N 3.49Å; K62-Y65 PolarHBondContact O-N 3.21Å; Y65-Y68 PolarHBondContact O-N 3.25Å; Y65-A69 WeakPolarHBondContact O-CB 3.49Å; Y65-A69 PolarHBondContact O-N 2.97Å; Y65-M87 HydrophobicContact CD1-CE 4.02Å; Y65-M87 HydrophobicContact CD1-SD 4.45Å; Y65-M87 HydrophobicContact CD2-CB 3.91Å; Y65-M87 HydrophobicContact CD2-CE 4.15Å; Y65-M87 HydrophobicContact CE2-CB 3.75Å; Y65-M87 HydrophobicContact CG-CB 4.41Å; Y65-M87 HydrophobicContact CG-CE 3.67Å; Y65-Q88 HydrophobicContact CD2-CG 3.65Å; Y65-Q88 HydrophobicContact CE2-CG 3.81Å; Y65-L274 HydrophobicContact CE1-CD1 3.82Å
66	E	91.1	Very high	88.9	Confident	65 Å²	65	68.3 Å²	68.3	30%	0.304	33%	0.326	S	S	.	.	H	α-helix	trans	-62.5	-42.6	171.9	-77.6	-175.7	-168.3	0	0	112	K62 R70 I84	K62-E66 WeakPolarHBondContact CE-OE1 3.06Å; K62-E66 HydrophobicContact CG-CG 4.43Å; K62-E66 WeakPolarHBondContact CG-OE1 3.39Å; K62-E66 VanDerWaalsContact O-CB 3.3Å; K62-E66 WeakPolarHBondContact O-CB 3.5Å; K62-E66 VanDerWaalsContact O-CG 3.29Å; K62-E66 WeakPolarHBondContact O-CG 3.42Å; K62-E66 PolarHBondContact O-N 2.87Å; E66-R70 WeakPolarHBondContact O-CB 3.5Å; E66-R70 PolarHBondContact O-N 2.93Å; E66-I84 HydrophobicContact CG-CD1 3.92Å
67	Q	89.3	Confident	89.4	Confident	102 Å²	102	73.4 Å²	73.4	48%	0.477	35%	0.351	S	S	.	.	H	α-helix	trans	-63.2	-51.2	175.9	-179.8	176.8	-13	0	0	111.3	D63 L64 A69 R70 E71	D63-Q67 WeakPolarHBondContact O-CB 3.46Å; D63-Q67 PolarHBondContact O-N 2.65Å; L64-Q67 PolarHBondContact O-N 3.34Å; Q67-A69 VanDerWaalsContact C-N 3.33Å; Q67-A69 PolarHBondContact O-N 3.01Å; Q67-R70 WeakPolarHBondContact O-CB 3.38Å; Q67-R70 PolarHBondContact O-N 3.03Å; Q67-R70 VanDerWaalsContact O-N 3.15Å; Q67-E71 PolarHBondContact NE2-OE1 2.97Å; Q67-E71 PolarHBondContact O-N 3.4Å
68	Y	89.3	Confident	89.9	Confident	51 Å²	51	79.1 Å²	79.1	20%	0.2	38%	0.378	C	S	.	.	H	α-helix	trans	-59	-44.9	179.7	-178.2	-100.6	0	0	0	111.6	L64 Y65 R70 E71 Q72 L83 M87 L269	L64-Y68 WeakPolarHBondContact O-CB 3.38Å; L64-Y68 PolarHBondContact O-N 3.48Å; Y65-Y68 PolarHBondContact O-N 3.25Å; Y68-R70 VanDerWaalsContact C-N 3.31Å; Y68-R70 PolarHBondContact O-N 3.45Å; Y68-E71 PolarHBondContact O-N 2.89Å; Y68-E71 VanDerWaalsContact O-N 3.16Å; Y68-Q72 HydrophobicContact CD1-CG 4.16Å; Y68-Q72 HydrophobicContact CE1-CG 3.76Å; Y68-Q72 HydrophobicContact CE2-CG 4.3Å; Y68-Q72 WeakPolarHBondContact O-CG 3.3Å; Y68-Q72 PolarHBondContact O-N 3.46Å; Y68-L83 HydrophobicContact CD1-CD2 4.11Å; Y68-L83 HydrophobicContact CE1-CD2 4.07Å; Y68-M87 HydrophobicContact CD1-CE 3.97Å; Y68-M87 HydrophobicContact CD1-SD 3.56Å; Y68-M87 VanDerWaalsContact CD1-SD 3.56Å; Y68-M87 HydrophobicContact CE1-SD 3.88Å; Y68-L269 HydrophobicContact CD1-CD2 4.03Å; Y68-L269 HydrophobicContact CD2-CD2 4.29Å; Y68-L269 HydrophobicContact CE1-CD2 3.72Å; Y68-L269 HydrophobicContact CE2-CD2 4Å; Y68-L269 HydrophobicContact CG-CD2 4.29Å
69	A	92.6	Very high	90.2	Very high	0 Å²	0	81.7 Å²	81.7	0%	0	39%	0.385	C	S	.	.	H	α-helix	trans	-61.8	-39.6	177.6	0	0	0	0	0	112.3	Y65 Q67 E71 Q72 F73 Q80 L83 I84	Y65-A69 WeakPolarHBondContact O-CB 3.49Å; Y65-A69 PolarHBondContact O-N 2.97Å; Q67-A69 VanDerWaalsContact C-N 3.33Å; Q67-A69 PolarHBondContact O-N 3.01Å; A69-E71 VanDerWaalsContact C-N 3.32Å; A69-E71 PolarHBondContact O-N 3.25Å; A69-Q72 PolarHBondContact O-N 3.27Å; A69-F73 PolarHBondContact O-N 3.11Å; A69-Q80 HydrophobicContact CB-CB 4.03Å; A69-Q80 HydrophobicContact CB-CG 4.18Å; A69-Q80 WeakPolarHBondContact O-CG 3.36Å; A69-L83 HydrophobicContact CB-CD2 4.16Å; A69-I84 HydrophobicContact CB-CD1 3.98Å; A69-I84 HydrophobicContact CB-CG1 3.71Å
70	R	93.8	Very high	90.7	Very high	128 Å²	128	78.5 Å²	78.5	48%	0.483	37%	0.37	S	S	.	.	H	α-helix	trans	-64.5	-34.5	176	-167.8	-178.4	-59	118	4.5	112.4	E66 Q67 Y68 P74	E66-R70 WeakPolarHBondContact O-CB 3.5Å; E66-R70 PolarHBondContact O-N 2.93Å; Q67-R70 WeakPolarHBondContact O-CB 3.38Å; Q67-R70 PolarHBondContact O-N 3.03Å; Q67-R70 VanDerWaalsContact O-N 3.15Å; Y68-R70 VanDerWaalsContact C-N 3.31Å; Y68-R70 PolarHBondContact O-N 3.45Å; R70-P74 WeakPolarHBondContact O-CA 3.32Å; R70-P74 WeakPolarHBondContact O-CG 3.29Å
71	E	92.7	Very high	91.4	Very high	121 Å²	121	81.8 Å²	81.8	57%	0.565	38%	0.384	S	S	*	.	H	α-helix	trans	-70.6	-42.8	175.6	-70.6	174.7	-168.7	0	0	112	Q67 Y68 A69	Q67-E71 PolarHBondContact NE2-OE1 2.97Å; Q67-E71 PolarHBondContact O-N 3.4Å; Y68-E71 PolarHBondContact O-N 2.89Å; Y68-E71 VanDerWaalsContact O-N 3.16Å; A69-E71 VanDerWaalsContact C-N 3.32Å; A69-E71 PolarHBondContact O-N 3.25Å
72	Q	92.2	Very high	91.9	Very high	63 Å²	63	84.6 Å²	84.6	29%	0.294	41%	0.407	S	S	.	.	H	α-helix	trans	-70.8	-38.6	179	-62.6	-56.3	-40.1	0	0	112.6	Y68 A69 L83	Y68-Q72 HydrophobicContact CD1-CG 4.16Å; Y68-Q72 HydrophobicContact CE1-CG 3.76Å; Y68-Q72 HydrophobicContact CE2-CG 4.3Å; Y68-Q72 WeakPolarHBondContact O-CG 3.3Å; Y68-Q72 PolarHBondContact O-N 3.46Å; A69-Q72 PolarHBondContact O-N 3.27Å; Q72-L83 HydrophobicContact CB-CD2 4.05Å; Q72-L83 HydrophobicContact CG-CD2 4.1Å
73	F	93.4	Very high	92.3	Very high	72 Å²	72	81 Å²	81	32%	0.316	39%	0.393	S	S	.	.			trans	-132.1	65.1	-174.9	-59.1	-64.6	0	0	0	113.4	A69 K75 D76 K79 Q80 L83	A69-F73 PolarHBondContact O-N 3.11Å; F73-K75 PolarHBondContact O-N 3.4Å; F73-D76 HydrophobicContact CB-CB 4.36Å; F73-D76 PolarHBondContact O-N 3.36Å; F73-K79 HydrophobicContact CB-CB 4.06Å; F73-K79 HydrophobicContact CD1-CB 3.95Å; F73-K79 HydrophobicContact CD1-CD 3.63Å; F73-K79 HydrophobicContact CD1-CG 4.46Å; F73-K79 HydrophobicContact CD2-CB 3.76Å; F73-K79 HydrophobicContact CE1-CB 4.33Å; F73-K79 HydrophobicContact CE1-CD 3.65Å; F73-K79 HydrophobicContact CE2-CB 4.14Å; F73-K79 HydrophobicContact CG-CB 3.65Å; F73-K79 HydrophobicContact CG-CD 4.22Å; F73-K79 HydrophobicContact CZ-CB 4.41Å; F73-K79 HydrophobicContact CZ-CD 4.24Å; F73-Q80 HydrophobicContact CB-CG 4.01Å; F73-Q80 PolarHBondContact O-NE2 2.86Å; F73-L83 HydrophobicContact CD2-CB 4.5Å; F73-L83 HydrophobicContact CD2-CD2 3.95Å; F73-L83 HydrophobicContact CE2-CB 4.24Å; F73-L83 HydrophobicContact CE2-CD2 3.75Å
74	P	93.4	Very high	92.7	Very high	93 Å²	93	77.3 Å²	77.3	60%	0.604	37%	0.372	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.2	-21.9	-167.9	-25.5	32.7	0	0	0	117.3	R70	R70-P74 WeakPolarHBondContact O-CA 3.32Å; R70-P74 WeakPolarHBondContact O-CG 3.29Å
75	K	92.5	Very high	93.1	Very high	207 Å²	207	77.5 Å²	77.5	90%	0.9	38%	0.376	S	S	*	.	T	Hydrogen-bonded Turn	trans	-119.5	-2.2	-174.3	-62.3	-177.2	-179.7	178.8	0	114	F73	F73-K75 PolarHBondContact O-N 3.4Å
76	D	94.9	Very high	93.2	Very high	53 Å²	53	82.3 Å²	82.3	28%	0.283	40%	0.399	S	S	.	.			trans	-120.1	88.9	-169.2	-167.4	-25.2	0	0	0	109.9	F73 E78 K79 Q80	F73-D76 HydrophobicContact CB-CB 4.36Å; F73-D76 PolarHBondContact O-N 3.36Å; D76-E78 VanDerWaalsContact C-N 3.26Å; D76-E78 PolarHBondContact O-N 3.11Å; D76-E78 PolarHBondContact OD1-N 3.47Å; D76-K79 HydrophobicContact CB-CB 4.14Å; D76-K79 HydrophobicContact CB-CD 4.32Å; D76-K79 HydrophobicContact CB-CG 4.38Å; D76-K79 PolarHBondContact O-N 2.93Å; D76-K79 PolarHBondContact OD1-N 2.96Å; D76-K79 VanDerWaalsContact OD1-N 3.15Å; D76-K79 WeakPolarHBondContact OD2-CD 3.31Å; D76-K79 WeakPolarHBondContact OD2-CE 3.43Å; D76-K79 WeakPolarHBondContact OD2-CG 3.49Å; D76-K79 IonicContact OD2-NZ 2.7Å; D76-K79 PolarHBondContact OD2-NZ 2.97Å; D76-Q80 WeakPolarHBondContact O-CG 3.44Å; D76-Q80 PolarHBondContact O-N 3.46Å
77	L	95	Very high	93.3	Very high	117 Å²	117	79.4 Å²	79.4	61%	0.613	39%	0.386	S	S	*	.	H	α-helix	trans	-62.4	-32	-176.5	-70.9	172.3	0	0	0	112.8	Q80 K81	L77-Q80 PolarHBondContact O-N 2.53Å; L77-K81 WeakPolarHBondContact O-CG 3.34Å; L77-K81 PolarHBondContact O-N 2.95Å
78	E	95.9	Very high	93.4	Very high	123 Å²	123	76 Å²	76	58%	0.575	37%	0.37	S	S	*	.	H	α-helix	trans	-72.4	-39.6	179.6	-70.1	-60.8	118.1	0	0	110.9	D76 Q80 K81 A82	D76-E78 VanDerWaalsContact C-N 3.26Å; D76-E78 PolarHBondContact O-N 3.11Å; D76-E78 PolarHBondContact OD1-N 3.47Å; E78-Q80 VanDerWaalsContact C-N 3.35Å; E78-K81 PolarHBondContact O-N 3.34Å; E78-K81 IonicContact OE1-NZ 2.85Å; E78-K81 PolarHBondContact OE1-NZ 3.1Å; E78-A82 WeakPolarHBondContact O-CB 3.43Å; E78-A82 PolarHBondContact O-N 3.19Å
79	K	94.5	Very high	93.4	Very high	104 Å²	104	76.3 Å²	76.3	45%	0.452	38%	0.375	S	S	.	.	H	α-helix	trans	-66.8	-35.7	170.7	-72.1	-175.3	-169.1	137.7	0	113	F73 D76 L83	F73-K79 HydrophobicContact CB-CB 4.06Å; F73-K79 HydrophobicContact CD1-CB 3.95Å; F73-K79 HydrophobicContact CD1-CD 3.63Å; F73-K79 HydrophobicContact CD1-CG 4.46Å; F73-K79 HydrophobicContact CD2-CB 3.76Å; F73-K79 HydrophobicContact CE1-CB 4.33Å; F73-K79 HydrophobicContact CE1-CD 3.65Å; F73-K79 HydrophobicContact CE2-CB 4.14Å; F73-K79 HydrophobicContact CG-CB 3.65Å; F73-K79 HydrophobicContact CG-CD 4.22Å; F73-K79 HydrophobicContact CZ-CB 4.41Å; F73-K79 HydrophobicContact CZ-CD 4.24Å; D76-K79 HydrophobicContact CB-CB 4.14Å; D76-K79 HydrophobicContact CB-CD 4.32Å; D76-K79 HydrophobicContact CB-CG 4.38Å; D76-K79 PolarHBondContact O-N 2.93Å; D76-K79 PolarHBondContact OD1-N 2.96Å; D76-K79 VanDerWaalsContact OD1-N 3.15Å; D76-K79 WeakPolarHBondContact OD2-CD 3.31Å; D76-K79 WeakPolarHBondContact OD2-CE 3.43Å; D76-K79 WeakPolarHBondContact OD2-CG 3.49Å; D76-K79 IonicContact OD2-NZ 2.7Å; D76-K79 PolarHBondContact OD2-NZ 2.97Å; K79-L83 VanDerWaalsContact O-CB 3.27Å; K79-L83 WeakPolarHBondContact O-CB 3.45Å; K79-L83 PolarHBondContact O-N 3.32Å
80	Q	94.1	Very high	93.3	Very high	20 Å²	20	80.6 Å²	80.6	9%	0.093	40%	0.395	C	S	.	.	H	α-helix	trans	-59.7	-51	173.8	-71.5	177.7	26.7	0	0	110.9	A69 F73 D76 L77 E78 A82 L83 I84	A69-Q80 HydrophobicContact CB-CB 4.03Å; A69-Q80 HydrophobicContact CB-CG 4.18Å; A69-Q80 WeakPolarHBondContact O-CG 3.36Å; F73-Q80 HydrophobicContact CB-CG 4.01Å; F73-Q80 PolarHBondContact O-NE2 2.86Å; D76-Q80 WeakPolarHBondContact O-CG 3.44Å; D76-Q80 PolarHBondContact O-N 3.46Å; L77-Q80 PolarHBondContact O-N 2.53Å; E78-Q80 VanDerWaalsContact C-N 3.35Å; Q80-A82 PolarHBondContact O-N 2.69Å; Q80-L83 PolarHBondContact O-N 2.81Å; Q80-I84 WeakPolarHBondContact O-CD1 3.49Å; Q80-I84 VanDerWaalsContact O-CG1 3.23Å; Q80-I84 WeakPolarHBondContact O-CG1 3.08Å; Q80-I84 PolarHBondContact O-N 2.81Å
81	K	95.2	Very high	93	Very high	118 Å²	118	74.6 Å²	74.6	51%	0.513	37%	0.372	S	S	.	.	H	α-helix	trans	-59.9	-47.3	177.9	-71.5	174.6	-169.3	165.2	0	112.3	L77 E78 L83 I84 T85	L77-K81 WeakPolarHBondContact O-CG 3.34Å; L77-K81 PolarHBondContact O-N 2.95Å; E78-K81 PolarHBondContact O-N 3.34Å; E78-K81 IonicContact OE1-NZ 2.85Å; E78-K81 PolarHBondContact OE1-NZ 3.1Å; K81-L83 VanDerWaalsContact C-N 3.32Å; K81-L83 PolarHBondContact O-N 3.33Å; K81-I84 PolarHBondContact O-N 3.43Å; K81-T85 PolarHBondContact O-N 3.07Å; K81-T85 PolarHBondContact O-OG1 3.1Å
82	A	94.9	Very high	92.8	Very high	59 Å²	59	70.1 Å²	70.1	49%	0.488	35%	0.351	S	S	.	.	H	α-helix	trans	-59.8	-43.3	179.3	0	0	0	0	0	111.7	E78 Q80 T85 E86	E78-A82 WeakPolarHBondContact O-CB 3.43Å; E78-A82 PolarHBondContact O-N 3.19Å; Q80-A82 PolarHBondContact O-N 2.69Å; A82-T85 PolarHBondContact O-N 2.71Å; A82-E86 WeakPolarHBondContact O-CB 3.46Å; A82-E86 PolarHBondContact O-N 2.88Å
83	L	93.1	Very high	92.6	Very high	28 Å²	28	73.5 Å²	73.5	15%	0.147	37%	0.367	C	S	.	.	H	α-helix	trans	-64.7	-42	176.4	179.1	60.8	0	0	0	112	Y68 A69 Q72 F73 K79 Q80 K81 E86 M87	Y68-L83 HydrophobicContact CD1-CD2 4.11Å; Y68-L83 HydrophobicContact CE1-CD2 4.07Å; A69-L83 HydrophobicContact CB-CD2 4.16Å; Q72-L83 HydrophobicContact CB-CD2 4.05Å; Q72-L83 HydrophobicContact CG-CD2 4.1Å; F73-L83 HydrophobicContact CD2-CB 4.5Å; F73-L83 HydrophobicContact CD2-CD2 3.95Å; F73-L83 HydrophobicContact CE2-CB 4.24Å; F73-L83 HydrophobicContact CE2-CD2 3.75Å; K79-L83 VanDerWaalsContact O-CB 3.27Å; K79-L83 WeakPolarHBondContact O-CB 3.45Å; K79-L83 PolarHBondContact O-N 3.32Å; Q80-L83 PolarHBondContact O-N 2.81Å; K81-L83 VanDerWaalsContact C-N 3.32Å; K81-L83 PolarHBondContact O-N 3.33Å; L83-E86 PolarHBondContact O-N 2.83Å; L83-M87 HydrophobicContact CD1-CG 4.15Å; L83-M87 HydrophobicContact CD1-SD 4.25Å; L83-M87 HydrophobicContact CG-CE 4.07Å; L83-M87 HydrophobicContact CG-SD 4.26Å; L83-M87 WeakPolarHBondContact O-CB 3.24Å; L83-M87 VanDerWaalsContact O-CG 3.28Å; L83-M87 WeakPolarHBondContact O-CG 3.07Å; L83-M87 PolarHBondContact O-N 3.43Å
84	I	92.8	Very high	92.2	Very high	26 Å²	26	73.3 Å²	73.3	13%	0.133	37%	0.366	C	S	.	.	H	α-helix	trans	-61.9	-48.3	176.7	-67.2	162.3	0	0	0	110.4	E66 A69 Q80 K81 E86 M87 Q88	E66-I84 HydrophobicContact CG-CD1 3.92Å; A69-I84 HydrophobicContact CB-CD1 3.98Å; A69-I84 HydrophobicContact CB-CG1 3.71Å; Q80-I84 WeakPolarHBondContact O-CD1 3.49Å; Q80-I84 VanDerWaalsContact O-CG1 3.23Å; Q80-I84 WeakPolarHBondContact O-CG1 3.08Å; Q80-I84 PolarHBondContact O-N 2.81Å; K81-I84 PolarHBondContact O-N 3.43Å; I84-E86 PolarHBondContact O-N 2.74Å; I84-M87 HydrophobicContact CG1-CE 4.46Å; I84-M87 PolarHBondContact O-N 2.91Å; I84-Q88 HydrophobicContact CG2-CG 4.28Å; I84-Q88 WeakPolarHBondContact O-CB 3.5Å; I84-Q88 VanDerWaalsContact O-CG 3.24Å; I84-Q88 WeakPolarHBondContact O-CG 3.25Å; I84-Q88 PolarHBondContact O-N 3.32Å
85	T	93.8	Very high	91.8	Very high	72 Å²	72	69 Å²	69	44%	0.442	34%	0.338	S	S	.	.	H	α-helix	trans	-59.6	-45.5	177.3	-61.7	0	0	0	0	111.5	K81 A82 M87 Q88 D89	K81-T85 PolarHBondContact O-N 3.07Å; K81-T85 PolarHBondContact O-OG1 3.1Å; A82-T85 PolarHBondContact O-N 2.71Å; T85-M87 PolarHBondContact O-N 3.02Å; T85-Q88 PolarHBondContact O-N 2.99Å; T85-D89 WeakPolarHBondContact O-CB 3.39Å; T85-D89 PolarHBondContact O-N 3.13Å
86	E	93.1	Very high	91.4	Very high	107 Å²	107	60.9 Å²	60.9	50%	0.5	31%	0.305	S	S	.	.	H	α-helix	trans	-59.2	-47.4	176.7	-177.2	-179.1	177.3	0	0	112	A82 L83 I84 Q88 D89 Q90	A82-E86 WeakPolarHBondContact O-CB 3.46Å; A82-E86 PolarHBondContact O-N 2.88Å; L83-E86 PolarHBondContact O-N 2.83Å; I84-E86 PolarHBondContact O-N 2.74Å; E86-Q88 VanDerWaalsContact C-N 3.33Å; E86-Q88 PolarHBondContact O-N 3.2Å; E86-D89 PolarHBondContact O-N 2.72Å; E86-Q90 WeakPolarHBondContact O-CB 3.37Å; E86-Q90 WeakPolarHBondContact O-CG 3.15Å; E86-Q90 PolarHBondContact O-N 3.11Å; E86-Q90 PolarHBondContact OE1-NE2 2.93Å
87	M	91.7	Very high	90.8	Very high	4 Å²	4	61.1 Å²	61.1	2%	0.02	31%	0.31	C	S	.	.	H	α-helix	trans	-64.8	-37.2	178.2	-69.9	-174.4	-53.4	0	0	112.2	Y65 Y68 L83 I84 T85 Y91 L269	Y65-M87 HydrophobicContact CD1-CE 4.02Å; Y65-M87 HydrophobicContact CD1-SD 4.45Å; Y65-M87 HydrophobicContact CD2-CB 3.91Å; Y65-M87 HydrophobicContact CD2-CE 4.15Å; Y65-M87 HydrophobicContact CE2-CB 3.75Å; Y65-M87 HydrophobicContact CG-CB 4.41Å; Y65-M87 HydrophobicContact CG-CE 3.67Å; Y68-M87 HydrophobicContact CD1-CE 3.97Å; Y68-M87 HydrophobicContact CD1-SD 3.56Å; Y68-M87 VanDerWaalsContact CD1-SD 3.56Å; Y68-M87 HydrophobicContact CE1-SD 3.88Å; L83-M87 HydrophobicContact CD1-CG 4.15Å; L83-M87 HydrophobicContact CD1-SD 4.25Å; L83-M87 HydrophobicContact CG-CE 4.07Å; L83-M87 HydrophobicContact CG-SD 4.26Å; L83-M87 WeakPolarHBondContact O-CB 3.24Å; L83-M87 VanDerWaalsContact O-CG 3.28Å; L83-M87 WeakPolarHBondContact O-CG 3.07Å; L83-M87 PolarHBondContact O-N 3.43Å; I84-M87 HydrophobicContact CG1-CE 4.46Å; I84-M87 PolarHBondContact O-N 2.91Å; T85-M87 PolarHBondContact O-N 3.02Å; M87-Y91 WeakPolarHBondContact O-CB 3.41Å; M87-Y91 PolarHBondContact O-N 2.95Å; M87-L269 HydrophobicContact CG-CD1 3.92Å; M87-L269 HydrophobicContact SD-CD1 3.84Å; M87-L269 HydrophobicContact SD-CD2 3.94Å
88	Q	91.6	Very high	89.9	Confident	30 Å²	30	60.7 Å²	60.7	14%	0.14	31%	0.305	C	S	.	.	H	α-helix	trans	-68.6	-41.7	177.2	-73.5	175.8	-26.1	0	0	112	V58 Y65 I84 T85 E86 Y91 F92	V58-Q88 HydrophobicContact CG2-CB 4.38Å; V58-Q88 HydrophobicContact CG2-CG 4.28Å; Y65-Q88 HydrophobicContact CD2-CG 3.65Å; Y65-Q88 HydrophobicContact CE2-CG 3.81Å; I84-Q88 HydrophobicContact CG2-CG 4.28Å; I84-Q88 WeakPolarHBondContact O-CB 3.5Å; I84-Q88 VanDerWaalsContact O-CG 3.24Å; I84-Q88 WeakPolarHBondContact O-CG 3.25Å; I84-Q88 PolarHBondContact O-N 3.32Å; T85-Q88 PolarHBondContact O-N 2.99Å; E86-Q88 VanDerWaalsContact C-N 3.33Å; E86-Q88 PolarHBondContact O-N 3.2Å; Q88-Y91 PolarHBondContact O-N 3.1Å; Q88-F92 VanDerWaalsContact O-CB 3.25Å; Q88-F92 WeakPolarHBondContact O-CB 3.45Å; Q88-F92 PolarHBondContact O-N 3.44Å
89	D	91.1	Very high	89	Confident	58 Å²	58	55.6 Å²	55.6	31%	0.31	28%	0.282	S	S	.	.	H	α-helix	trans	-66.7	-44.7	177.3	-72.6	-22.5	0	0	0	111	K54 T85 E86 Y91 F92 E93	K54-D89 WeakPolarHBondContact CE-OD1 3.18Å; K54-D89 IonicContact NZ-OD1 3.99Å; K54-D89 PolarHBondContact NZ-OD1 2.94Å; T85-D89 WeakPolarHBondContact O-CB 3.39Å; T85-D89 PolarHBondContact O-N 3.13Å; E86-D89 PolarHBondContact O-N 2.72Å; D89-Y91 VanDerWaalsContact C-N 3.33Å; D89-Y91 PolarHBondContact O-N 3.25Å; D89-F92 PolarHBondContact O-N 3Å; D89-E93 WeakPolarHBondContact O-CG 3.26Å; D89-E93 PolarHBondContact O-N 3.02Å
90	Q	89.9	Confident	88.4	Confident	90 Å²	90	51.8 Å²	51.8	42%	0.421	27%	0.265	S	S	.	.	H	α-helix	trans	-60.1	-43	174.4	-74.7	177.3	2.1	0	0	112.2	E86 H94	E86-Q90 WeakPolarHBondContact O-CB 3.37Å; E86-Q90 WeakPolarHBondContact O-CG 3.15Å; E86-Q90 PolarHBondContact O-N 3.11Å; E86-Q90 PolarHBondContact OE1-NE2 2.93Å; Q90-H94 WeakPolarHBondContact O-CB 3.26Å; Q90-H94 PolarHBondContact O-N 3.26Å
91	Y	86.5	Confident	87.6	Confident	2 Å²	2	59.4 Å²	59.4	1%	0.008	29%	0.293	C	S	.	.	H	α-helix	trans	-65.7	-41.5	178	-177.4	-123.7	0	0	0	111.9	L57 T61 M87 Q88 D89 H94 Y95 I271 L274 I275	L57-Y91 HydrophobicContact CB-CD1 4.12Å; L57-Y91 HydrophobicContact CB-CE1 3.95Å; L57-Y91 HydrophobicContact CD2-CD1 4.31Å; L57-Y91 HydrophobicContact CD2-CE1 3.48Å; L57-Y91 VanDerWaalsContact CD2-CE1 3.48Å; L57-Y91 HydrophobicContact CG-CE1 4.17Å; T61-Y91 HydrophobicContact CG2-CD1 3.67Å; T61-Y91 HydrophobicContact CG2-CE1 3.58Å; M87-Y91 WeakPolarHBondContact O-CB 3.41Å; M87-Y91 PolarHBondContact O-N 2.95Å; Q88-Y91 PolarHBondContact O-N 3.1Å; D89-Y91 VanDerWaalsContact C-N 3.33Å; D89-Y91 PolarHBondContact O-N 3.25Å; Y91-H94 PolarHBondContact O-N 3.38Å; Y91-Y95 VanDerWaalsContact O-CB 3.31Å; Y91-Y95 WeakPolarHBondContact O-CB 3.35Å; Y91-Y95 PolarHBondContact O-N 2.91Å; Y91-I271 HydrophobicContact CD2-CG2 4.11Å; Y91-I271 HydrophobicContact CE2-CG2 4.35Å; Y91-L274 HydrophobicContact CE2-CB 3.95Å; Y91-L274 PolarHBondContact OH-O 3.5Å; Y91-L274 VanDerWaalsContact OH-O 3.14Å; Y91-I275 HydrophobicContact CE2-CD1 4.09Å; Y91-I275 HydrophobicContact CE2-CG1 3.61Å
92	F	89.4	Confident	86.8	Confident	26 Å²	26	59.2 Å²	59.2	11%	0.114	29%	0.292	C	S	.	.	H	α-helix	trans	-62.5	-46.6	176.7	-179.8	-114.4	0	0	0	112	E50 I53 K54 L57 Q88 D89 H94 Y95 L96	E50-F92 HydrophobicContact CB-CZ 4.19Å; E50-F92 WeakPolarHBondContact O-CZ 3.48Å; I53-F92 HydrophobicContact CB-CE2 4.28Å; I53-F92 HydrophobicContact CG2-CD2 4.38Å; I53-F92 HydrophobicContact CG2-CE2 3.91Å; K54-F92 HydrophobicContact CB-CD2 3.81Å; K54-F92 HydrophobicContact CB-CE2 3.54Å; K54-F92 HydrophobicContact CB-CG 4.43Å; K54-F92 HydrophobicContact CB-CZ 3.92Å; K54-F92 HydrophobicContact CD-CD1 4.24Å; K54-F92 HydrophobicContact CD-CE1 4.28Å; K54-F92 HydrophobicContact CD-CG 4.38Å; K54-F92 HydrophobicContact CD-CZ 4.46Å; K54-F92 HydrophobicContact CG-CD2 4.02Å; K54-F92 HydrophobicContact CG-CE2 4.19Å; K54-F92 HydrophobicContact CG-CG 4.19Å; K54-F92 HydrophobicContact CG-CZ 4.48Å; L57-F92 HydrophobicContact CD1-CD2 3.86Å; Q88-F92 VanDerWaalsContact O-CB 3.25Å; Q88-F92 WeakPolarHBondContact O-CB 3.45Å; Q88-F92 PolarHBondContact O-N 3.44Å; D89-F92 PolarHBondContact O-N 3Å; F92-H94 VanDerWaalsContact C-N 3.35Å; F92-H94 PolarHBondContact O-N 3.39Å; F92-Y95 PolarHBondContact O-N 2.84Å; F92-L96 HydrophobicContact CD1-CD1 4.12Å; F92-L96 HydrophobicContact CD2-CD1 4.49Å; F92-L96 HydrophobicContact CD2-CG 4.38Å; F92-L96 HydrophobicContact CE1-CD1 3.51Å; F92-L96 HydrophobicContact CE1-CG 4.36Å; F92-L96 HydrophobicContact CE2-CD1 3.93Å; F92-L96 HydrophobicContact CE2-CD2 4.28Å; F92-L96 HydrophobicContact CE2-CG 4.02Å; F92-L96 HydrophobicContact CZ-CD1 3.41Å; F92-L96 VanDerWaalsContact CZ-CD1 3.41Å; F92-L96 HydrophobicContact CZ-CD2 4.42Å; F92-L96 HydrophobicContact CZ-CG 4.03Å; F92-L96 WeakPolarHBondContact O-CG 3.41Å; F92-L96 PolarHBondContact O-N 2.71Å
93	E	88.7	Confident	85.8	Confident	134 Å²	134	56.8 Å²	56.8	63%	0.626	27%	0.271	S	S	*	.	H	α-helix	trans	-59.2	-46.5	176.1	-74.1	-177.6	175.2	0	0	111.5	D89 L96 S97	D89-E93 WeakPolarHBondContact O-CG 3.26Å; D89-E93 PolarHBondContact O-N 3.02Å; E93-L96 PolarHBondContact O-N 3.1Å; E93-S97 PolarHBondContact O-N 3.46Å; E93-S97 PolarHBondContact O-OG 2.83Å
94	H	84.6	Confident	85.1	Confident	68 Å²	68	58.8 Å²	58.8	32%	0.315	28%	0.282	S	S	.	.	H	α-helix	trans	-63.3	-42.4	177.7	-177.4	-91.7	0	0	0	112.3	Q90 Y91 F92 S97 E98 I275	Q90-H94 WeakPolarHBondContact O-CB 3.26Å; Q90-H94 PolarHBondContact O-N 3.26Å; Y91-H94 PolarHBondContact O-N 3.38Å; F92-H94 VanDerWaalsContact C-N 3.35Å; F92-H94 PolarHBondContact O-N 3.39Å; H94-S97 PolarHBondContact O-N 3.13Å; H94-S97 PolarHBondContact O-OG 2.82Å; H94-S97 VanDerWaalsContact O-OG 3.1Å; H94-E98 WeakPolarHBondContact O-CB 3.28Å; H94-E98 PolarHBondContact O-N 2.8Å; H94-I275 VanDerWaalsContact CE1-CD1 3.41Å; H94-I275 WeakPolarHBondContact CE1-CD1 3.2Å; H94-I275 WeakPolarHBondContact ND1-CD1 3.24Å
95	Y	84.7	Confident	84.4	Confident	3 Å²	3	61.3 Å²	61.3	1%	0.012	30%	0.298	C	S	.	.	H	α-helix	trans	-60	-48	176.4	179.1	-89.2	0	0	0	111.4	I53 L57 Y91 F92 S97 V99 Y100 Q103 P143	I53-Y95 HydrophobicContact CG2-CD1 3.64Å; I53-Y95 HydrophobicContact CG2-CE1 3.48Å; I53-Y95 VanDerWaalsContact CG2-CE1 3.48Å; L57-Y95 HydrophobicContact CD1-CD1 3.75Å; L57-Y95 HydrophobicContact CD1-CD2 4.21Å; L57-Y95 HydrophobicContact CD1-CE1 4.46Å; L57-Y95 HydrophobicContact CD1-CG 3.63Å; L57-Y95 HydrophobicContact CD2-CD2 3.85Å; L57-Y95 HydrophobicContact CD2-CE2 4.21Å; L57-Y95 HydrophobicContact CD2-CG 4.13Å; Y91-Y95 VanDerWaalsContact O-CB 3.31Å; Y91-Y95 WeakPolarHBondContact O-CB 3.35Å; Y91-Y95 PolarHBondContact O-N 2.91Å; F92-Y95 PolarHBondContact O-N 2.84Å; Y95-S97 VanDerWaalsContact C-N 3.33Å; Y95-S97 PolarHBondContact O-N 2.89Å; Y95-V99 HydrophobicContact CD2-CB 3.74Å; Y95-V99 HydrophobicContact CD2-CG1 3.99Å; Y95-V99 HydrophobicContact CD2-CG2 3.97Å; Y95-V99 HydrophobicContact CE2-CB 3.74Å; Y95-V99 HydrophobicContact CE2-CG1 3.5Å; Y95-V99 HydrophobicContact CE2-CG2 4.35Å; Y95-V99 HydrophobicContact CG-CB 4.28Å; Y95-V99 WeakPolarHBondContact O-CA 3.23Å; Y95-V99 WeakPolarHBondContact O-CB 3.41Å; Y95-V99 PolarHBondContact O-N 2.88Å; Y95-Y100 HydrophobicContact CE1-CD2 4.43Å; Y95-Y100 PolarHBondContact O-N 3.03Å; Y95-Q103 PolarHBondContact OH-OE1 3.49Å; Y95-Q103 VanDerWaalsContact OH-OE1 3.05Å; Y95-P143 HydrophobicContact CD2-CG 4.4Å; Y95-P143 HydrophobicContact CE1-CG 4.41Å; Y95-P143 HydrophobicContact CE2-CG 3.37Å; Y95-P143 WeakPolarHBondContact OH-CD 3.21Å; Y95-P143 WeakPolarHBondContact OH-CG 3.15Å
96	L	85	Confident	83.7	Confident	37 Å²	37	60.2 Å²	60.2	19%	0.194	29%	0.288	C	S	.	.	I	π-helix	trans	-64.6	-36.9	179.5	-72.9	-175.8	0	0	0	112.5	I53 F92 E93 Y100	I53-L96 HydrophobicContact CD1-CD2 4.37Å; I53-L96 HydrophobicContact CG2-CD2 4.43Å; F92-L96 HydrophobicContact CD1-CD1 4.12Å; F92-L96 HydrophobicContact CD2-CD1 4.49Å; F92-L96 HydrophobicContact CD2-CG 4.38Å; F92-L96 HydrophobicContact CE1-CD1 3.51Å; F92-L96 HydrophobicContact CE1-CG 4.36Å; F92-L96 HydrophobicContact CE2-CD1 3.93Å; F92-L96 HydrophobicContact CE2-CD2 4.28Å; F92-L96 HydrophobicContact CE2-CG 4.02Å; F92-L96 HydrophobicContact CZ-CD1 3.41Å; F92-L96 VanDerWaalsContact CZ-CD1 3.41Å; F92-L96 HydrophobicContact CZ-CD2 4.42Å; F92-L96 HydrophobicContact CZ-CG 4.03Å; F92-L96 WeakPolarHBondContact O-CG 3.41Å; F92-L96 PolarHBondContact O-N 2.71Å; E93-L96 PolarHBondContact O-N 3.1Å; L96-Y100 HydrophobicContact CD2-CD1 4.03Å; L96-Y100 HydrophobicContact CD2-CG 4.13Å
97	S	81.1	Confident	83	Confident	57 Å²	57	55.2 Å²	55.2	40%	0.399	26%	0.264	S	S	.	.	I	π-helix	trans	-75.2	-46.6	-179	64.6	0	0	0	0	113.2	E93 H94 Y95	E93-S97 PolarHBondContact O-N 3.46Å; E93-S97 PolarHBondContact O-OG 2.83Å; H94-S97 PolarHBondContact O-N 3.13Å; H94-S97 PolarHBondContact O-OG 2.82Å; H94-S97 VanDerWaalsContact O-OG 3.1Å; Y95-S97 VanDerWaalsContact C-N 3.33Å; Y95-S97 PolarHBondContact O-N 2.89Å
98	E	76.3	Confident	82.4	Confident	109 Å²	109	62.8 Å²	62.8	51%	0.509	29%	0.293	S	S	.	.	I	π-helix	trans	-105.5	-21.6	-167.3	-67	-61.5	114.3	0	0	114.3	H94 F102	H94-E98 WeakPolarHBondContact O-CB 3.28Å; H94-E98 PolarHBondContact O-N 2.8Å; E98-F102 WeakPolarHBondContact O-CD2 3.38Å
99	V	77.4	Confident	81.9	Confident	15 Å²	15	65.6 Å²	65.6	9%	0.091	31%	0.306	C	S	.	.	I	π-helix	trans	-109	-54.1	-174.5	-172.3	0	0	0	0	110.3	Y95 R101 F102 Q103 I275 Y278	Y95-V99 HydrophobicContact CD2-CB 3.74Å; Y95-V99 HydrophobicContact CD2-CG1 3.99Å; Y95-V99 HydrophobicContact CD2-CG2 3.97Å; Y95-V99 HydrophobicContact CE2-CB 3.74Å; Y95-V99 HydrophobicContact CE2-CG1 3.5Å; Y95-V99 HydrophobicContact CE2-CG2 4.35Å; Y95-V99 HydrophobicContact CG-CB 4.28Å; Y95-V99 WeakPolarHBondContact O-CA 3.23Å; Y95-V99 WeakPolarHBondContact O-CB 3.41Å; Y95-V99 PolarHBondContact O-N 2.88Å; V99-R101 VanDerWaalsContact C-N 3.31Å; V99-R101 PolarHBondContact O-N 3.19Å; V99-F102 PolarHBondContact O-N 2.89Å; V99-F102 VanDerWaalsContact O-N 3.1Å; V99-Q103 WeakPolarHBondContact O-CB 3.33Å; V99-Q103 PolarHBondContact O-N 2.92Å; V99-I275 HydrophobicContact CG1-CG2 4.28Å; V99-I275 HydrophobicContact CG2-CD1 3.98Å; V99-I275 HydrophobicContact CG2-CG1 4.45Å; V99-I275 HydrophobicContact CG2-CG2 3.47Å; V99-I275 VanDerWaalsContact CG2-CG2 3.47Å; V99-Y278 HydrophobicContact CG1-CD2 4.21Å; V99-Y278 HydrophobicContact CG1-CE2 4.18Å
100	Y	80.4	Confident	81.4	Confident	24 Å²	24	63 Å²	63	9%	0.094	29%	0.292	C	S	.	.	I	π-helix	trans	-58.8	-40.7	-174	-175	-120.3	0	0	0	112.9	I53 Y95 L96 F102 Q103 L104 P140	I53-Y100 HydrophobicContact CD1-CD2 3.89Å; I53-Y100 HydrophobicContact CD1-CE2 3.62Å; Y95-Y100 HydrophobicContact CE1-CD2 4.43Å; Y95-Y100 PolarHBondContact O-N 3.03Å; L96-Y100 HydrophobicContact CD2-CD1 4.03Å; L96-Y100 HydrophobicContact CD2-CG 4.13Å; Y100-F102 PolarHBondContact O-N 2.84Å; Y100-Q103 WeakPolarHBondContact O-CB 3.41Å; Y100-Q103 PolarHBondContact O-N 2.85Å; Y100-L104 HydrophobicContact CD1-CD1 4.1Å; Y100-L104 HydrophobicContact CE1-CD1 3.7Å; Y100-L104 HydrophobicContact CE1-CG 4.38Å; Y100-L104 HydrophobicContact CE2-CD1 4.48Å; Y100-L104 HydrophobicContact CE2-CD2 4.4Å; Y100-L104 HydrophobicContact CE2-CG 4.3Å; Y100-L104 WeakPolarHBondContact O-CG 3.15Å; Y100-L104 PolarHBondContact O-N 3.38Å; Y100-P140 HydrophobicContact CE2-CB 3.6Å
101	R	78.1	Confident	80.8	Confident	180 Å²	180	59.3 Å²	59.3	68%	0.679	28%	0.275	S	S	*	.	H	α-helix	trans	-63.1	-42.1	177.2	-66.8	-170.9	69.1	154.2	2.8	113	V99 Q103 V105	V99-R101 VanDerWaalsContact C-N 3.31Å; V99-R101 PolarHBondContact O-N 3.19Å; R101-Q103 VanDerWaalsContact C-N 3.33Å; R101-V105 WeakPolarHBondContact O-CG2 3.31Å; R101-V105 PolarHBondContact O-N 2.84Å
102	F	77.8	Confident	80.6	Confident	114 Å²	114	63.7 Å²	63.7	50%	0.5	30%	0.295	S	S	.	.	H	α-helix	trans	-68.3	-38.4	178.1	-81.1	-85.3	0	0	0	111.2	E98 V99 Y100 V105 H106	E98-F102 WeakPolarHBondContact O-CD2 3.38Å; V99-F102 PolarHBondContact O-N 2.89Å; V99-F102 VanDerWaalsContact O-N 3.1Å; Y100-F102 PolarHBondContact O-N 2.84Å; F102-V105 PolarHBondContact O-N 2.85Å; F102-H106 WeakPolarHBondContact O-CB 3.46Å; F102-H106 PolarHBondContact O-N 2.61Å
103	Q	75.5	Confident	80.2	Confident	8 Å²	8	66.5 Å²	66.5	4%	0.037	31%	0.309	C	S	.	.	H	α-helix	trans	-62.2	-44.6	178	-171.8	174.5	46.7	0	0	112.5	Y95 V99 Y100 R101 V105 H106 Q107 L141 Y278	Y95-Q103 PolarHBondContact OH-OE1 3.49Å; Y95-Q103 VanDerWaalsContact OH-OE1 3.05Å; V99-Q103 WeakPolarHBondContact O-CB 3.33Å; V99-Q103 PolarHBondContact O-N 2.92Å; Y100-Q103 WeakPolarHBondContact O-CB 3.41Å; Y100-Q103 PolarHBondContact O-N 2.85Å; R101-Q103 VanDerWaalsContact C-N 3.33Å; Q103-V105 VanDerWaalsContact C-N 3.32Å; Q103-V105 PolarHBondContact O-N 2.88Å; Q103-H106 PolarHBondContact O-N 3.05Å; Q103-Q107 VanDerWaalsContact O-CB 3.31Å; Q103-Q107 WeakPolarHBondContact O-CB 3.49Å; Q103-Q107 PolarHBondContact O-N 3.45Å; Q103-L141 VanDerWaalsContact CD-CB 3.49Å; Q103-L141 HydrophobicContact CG-CB 3.75Å; Q103-L141 HydrophobicContact CG-CD2 4.07Å; Q103-L141 HydrophobicContact CG-CG 4.34Å; Q103-L141 PolarHBondContact NE2-O 2.94Å; Q103-L141 PolarHBondContact OE1-O 3Å; Q103-Y278 PolarHBondContact NE2-OH 3.01Å
104	L	76.6	Confident	79.8	Confident	71 Å²	71	60.4 Å²	60.4	37%	0.372	28%	0.281	S	S	.	.	H	α-helix	trans	-59.4	-41.7	174.4	-73.1	171.8	0	0	0	112.4	Y100 R108	Y100-L104 HydrophobicContact CD1-CD1 4.1Å; Y100-L104 HydrophobicContact CE1-CD1 3.7Å; Y100-L104 HydrophobicContact CE1-CG 4.38Å; Y100-L104 HydrophobicContact CE2-CD1 4.48Å; Y100-L104 HydrophobicContact CE2-CD2 4.4Å; Y100-L104 HydrophobicContact CE2-CG 4.3Å; Y100-L104 WeakPolarHBondContact O-CG 3.15Å; Y100-L104 PolarHBondContact O-N 3.38Å; L104-R108 WeakPolarHBondContact O-CB 3.43Å; L104-R108 PolarHBondContact O-N 3.26Å; L104-R108 VanDerWaalsContact O-N 3.11Å
105	V	79	Confident	79.7	Confident	78 Å²	78	61.7 Å²	61.7	47%	0.473	28%	0.283	S	S	.	.	H	α-helix	trans	-67.3	-43	177.4	174	0	0	0	0	110.9	R101 F102 Q103 R108 Q109	R101-V105 WeakPolarHBondContact O-CG2 3.31Å; R101-V105 PolarHBondContact O-N 2.84Å; F102-V105 PolarHBondContact O-N 2.85Å; Q103-V105 VanDerWaalsContact C-N 3.32Å; Q103-V105 PolarHBondContact O-N 2.88Å; V105-R108 PolarHBondContact O-N 2.94Å; V105-Q109 WeakPolarHBondContact O-CG 3.41Å; V105-Q109 PolarHBondContact O-N 3.4Å; V105-Q109 VanDerWaalsContact O-N 3.11Å
106	H	79.8	Confident	79.5	Confident	50 Å²	50	63.7 Å²	63.7	23%	0.231	30%	0.3	C	S	.	.	H	α-helix	trans	-62.1	-49.9	178.6	-172.8	-109.9	0	0	0	111.7	F102 Q103 R108 Q109 Q110 D307	F102-H106 WeakPolarHBondContact O-CB 3.46Å; F102-H106 PolarHBondContact O-N 2.61Å; Q103-H106 PolarHBondContact O-N 3.05Å; H106-R108 VanDerWaalsContact C-N 3.3Å; H106-R108 PolarHBondContact O-N 3.17Å; H106-Q109 WeakPolarHBondContact O-CB 3.31Å; H106-Q109 PolarHBondContact O-N 3.34Å; H106-Q110 PolarHBondContact CE1-NE2 3.46Å; H106-Q110 WeakPolarHBondContact O-CG 3.08Å; H106-Q110 PolarHBondContact O-N 2.98Å; H106-D307 IonicContact CE1-OD1 3.02Å; H106-D307 PolarHBondContact CE1-OD1 3.24Å; H106-D307 IonicContact ND1-OD1 3.91Å; H106-D307 PolarHBondContact ND1-OD1 3.23Å
107	Q	77	Confident	79.2	Confident	1 Å²	1	63 Å²	63	1%	0.005	30%	0.297	C	S	.	.	H	α-helix	trans	-60.2	-40.7	179.2	-173.1	178.4	46.2	0	0	112	Q103 Q109 Q110 L111 P138 L139 W208	Q103-Q107 VanDerWaalsContact O-CB 3.31Å; Q103-Q107 WeakPolarHBondContact O-CB 3.49Å; Q103-Q107 PolarHBondContact O-N 3.45Å; Q107-Q109 VanDerWaalsContact C-N 3.33Å; Q107-Q109 PolarHBondContact O-N 2.94Å; Q107-Q110 PolarHBondContact O-N 3.38Å; Q107-L111 PolarHBondContact O-N 2.97Å; Q107-P138 HydrophobicContact CG-CB 3.86Å; Q107-L139 PolarHBondContact NE2-O 2.65Å; Q107-L139 PolarHBondContact OE1-O 3.02Å; Q107-L139 VanDerWaalsContact OE1-O 3.13Å; Q107-W208 HydrophobicContact CG-CH2 4.02Å; Q107-W208 HydrophobicContact CG-CZ2 3.82Å
108	R	79	Confident	79	Confident	164 Å²	164	63.5 Å²	63.5	62%	0.619	29%	0.292	S	S	*	.	H	α-helix	trans	-60.7	-42.6	173.8	-178	176.9	174.4	157.6	4.7	112	L104 V105 H106 Q110 L111 E112	L104-R108 WeakPolarHBondContact O-CB 3.43Å; L104-R108 PolarHBondContact O-N 3.26Å; L104-R108 VanDerWaalsContact O-N 3.11Å; V105-R108 PolarHBondContact O-N 2.94Å; H106-R108 VanDerWaalsContact C-N 3.3Å; H106-R108 PolarHBondContact O-N 3.17Å; R108-Q110 VanDerWaalsContact C-N 3.32Å; R108-Q110 PolarHBondContact O-N 3.3Å; R108-L111 PolarHBondContact O-N 3.36Å; R108-E112 IonicContact NE-OE1 3.77Å; R108-E112 PolarHBondContact NE-OE1 2.9Å; R108-E112 WeakPolarHBondContact O-CG 3.28Å; R108-E112 PolarHBondContact O-N 3.12Å
109	Q	82.5	Confident	79.1	Confident	88 Å²	88	61.9 Å²	61.9	41%	0.411	29%	0.293	S	S	.	.	H	α-helix	trans	-63.3	-38.7	177	-71.2	172.4	3.5	0	0	111.7	V105 H106 Q107 E112 Q113	V105-Q109 WeakPolarHBondContact O-CG 3.41Å; V105-Q109 PolarHBondContact O-N 3.4Å; V105-Q109 VanDerWaalsContact O-N 3.11Å; H106-Q109 WeakPolarHBondContact O-CB 3.31Å; H106-Q109 PolarHBondContact O-N 3.34Å; Q107-Q109 VanDerWaalsContact C-N 3.33Å; Q107-Q109 PolarHBondContact O-N 2.94Å; Q109-E112 PolarHBondContact O-N 3.05Å; Q109-Q113 VanDerWaalsContact O-CG 3.32Å; Q109-Q113 WeakPolarHBondContact O-CG 3.4Å; Q109-Q113 PolarHBondContact O-N 3.24Å
110	Q	79.4	Confident	79	Confident	3 Å²	3	64.5 Å²	64.5	1%	0.014	32%	0.316	C	S	.	.	H	α-helix	trans	-67.2	-43.3	176.7	-67.7	173.5	-39.9	0	0	112.1	H106 Q107 R108 E112 Q113 L114 P305 I306 D307	H106-Q110 PolarHBondContact CE1-NE2 3.46Å; H106-Q110 WeakPolarHBondContact O-CG 3.08Å; H106-Q110 PolarHBondContact O-N 2.98Å; Q107-Q110 PolarHBondContact O-N 3.38Å; R108-Q110 VanDerWaalsContact C-N 3.32Å; R108-Q110 PolarHBondContact O-N 3.3Å; Q110-E112 VanDerWaalsContact C-N 3.28Å; Q110-E112 PolarHBondContact O-N 2.85Å; Q110-Q113 CarbonylContact O-C 3.53Å; Q110-Q113 WeakPolarHBondContact O-CA 3.42Å; Q110-Q113 WeakPolarHBondContact O-CB 3.37Å; Q110-Q113 PolarHBondContact O-N 3.05Å; Q110-Q113 VanDerWaalsContact O-N 3.1Å; Q110-L114 WeakPolarHBondContact O-CG 3.49Å; Q110-L114 PolarHBondContact O-N 3.31Å; Q110-P305 HydrophobicContact CB-CB 3.72Å; Q110-P305 HydrophobicContact CB-CG 4.35Å; Q110-P305 HydrophobicContact CG-CB 3.78Å; Q110-I306 PolarHBondContact NE2-O 2.83Å; Q110-D307 PolarHBondContact NE2-OD1 3.41Å; Q110-D307 PolarHBondContact NE2-OD2 3.45Å; Q110-D307 PolarHBondContact OE1-OD1 3.42Å; Q110-D307 PolarHBondContact OE1-OD2 2.94Å
111	L	78.5	Confident	78.6	Confident	14 Å²	14	69.3 Å²	69.3	7%	0.073	35%	0.348	C	S	.	.	H	α-helix	trans	-60.8	-37.9	173.5	-74.8	169	0	0	0	112.1	Q107 R108 L114 R115 P138 W208	Q107-L111 PolarHBondContact O-N 2.97Å; R108-L111 PolarHBondContact O-N 3.36Å; L111-L114 HydrophobicContact CD2-CD1 4.05Å; L111-L114 PolarHBondContact O-N 2.76Å; L111-R115 WeakPolarHBondContact O-CB 3.19Å; L111-R115 PolarHBondContact O-N 2.76Å; L111-P138 HydrophobicContact CD1-CB 3.58Å; L111-P138 HydrophobicContact CD1-CG 3.57Å; L111-W208 HydrophobicContact CD2-CE3 4.4Å; L111-W208 HydrophobicContact CD2-CZ3 4.29Å
112	E	81.8	Confident	77.9	Confident	93 Å²	93	65.1 Å²	65.1	44%	0.435	34%	0.335	S	S	.	.	H	α-helix	trans	-64.6	-40.1	173.2	-73.9	171.7	-170.6	0	0	111.7	R108 Q109 Q110 R115 A116	R108-E112 IonicContact NE-OE1 3.77Å; R108-E112 PolarHBondContact NE-OE1 2.9Å; R108-E112 WeakPolarHBondContact O-CG 3.28Å; R108-E112 PolarHBondContact O-N 3.12Å; Q109-E112 PolarHBondContact O-N 3.05Å; Q110-E112 VanDerWaalsContact C-N 3.28Å; Q110-E112 PolarHBondContact O-N 2.85Å; E112-R115 PolarHBondContact O-N 2.93Å; E112-A116 PolarHBondContact O-N 3.36Å
113	Q	82	Confident	77.2	Confident	85 Å²	85	64.7 Å²	64.7	40%	0.397	34%	0.337	S	S	.	.	H	α-helix	trans	-64.6	-43.5	173.5	-71.3	173.2	23.8	0	0	112.2	Q109 Q110 R115 A116 V117 P305	Q109-Q113 VanDerWaalsContact O-CG 3.32Å; Q109-Q113 WeakPolarHBondContact O-CG 3.4Å; Q109-Q113 PolarHBondContact O-N 3.24Å; Q110-Q113 CarbonylContact O-C 3.53Å; Q110-Q113 WeakPolarHBondContact O-CA 3.42Å; Q110-Q113 WeakPolarHBondContact O-CB 3.37Å; Q110-Q113 PolarHBondContact O-N 3.05Å; Q110-Q113 VanDerWaalsContact O-N 3.1Å; Q113-R115 VanDerWaalsContact C-N 3.32Å; Q113-R115 PolarHBondContact O-N 3.16Å; Q113-A116 WeakPolarHBondContact O-CB 3.42Å; Q113-A116 PolarHBondContact O-N 3.44Å; Q113-V117 WeakPolarHBondContact O-CG2 3.49Å; Q113-V117 PolarHBondContact O-N 3.18Å; Q113-P305 HydrophobicContact CB-CG 3.66Å
114	L	79.9	Confident	76.5	Confident	6 Å²	6	70.3 Å²	70.3	3%	0.031	38%	0.375	C	S	.	.	H	α-helix	trans	-58.2	-44.7	173.6	-74.9	172.7	0	0	0	111.7	Q110 L111 A116 V117 K118 F135 W208 L304 P305	Q110-L114 WeakPolarHBondContact O-CG 3.49Å; Q110-L114 PolarHBondContact O-N 3.31Å; L111-L114 HydrophobicContact CD2-CD1 4.05Å; L111-L114 PolarHBondContact O-N 2.76Å; L114-A116 VanDerWaalsContact C-N 3.29Å; L114-A116 PolarHBondContact O-N 2.88Å; L114-V117 PolarHBondContact O-N 2.87Å; L114-K118 WeakPolarHBondContact O-CB 3.37Å; L114-K118 PolarHBondContact O-N 3.06Å; L114-F135 HydrophobicContact CB-CE1 4.25Å; L114-W208 HydrophobicContact CD1-CB 3.5Å; L114-W208 HydrophobicContact CD1-CD2 4.3Å; L114-W208 HydrophobicContact CD1-CE3 4.08Å; L114-W208 HydrophobicContact CD1-CG 4.11Å; L114-W208 HydrophobicContact CD2-CB 3.82Å; L114-W208 WeakPolarHBondContact CD2-O 3.19Å; L114-W208 HydrophobicContact CG-CB 3.95Å; L114-L304 HydrophobicContact CD2-CD2 4Å; L114-P305 HydrophobicContact CD2-CG 4.13Å; L114-P305 HydrophobicContact CG-CG 4.01Å
115	R	81.4	Confident	75.7	Confident	95 Å²	95	74.8 Å²	74.8	36%	0.358	39%	0.393	S	S	.	.	H	α-helix	trans	-60.9	-41.9	176.9	-169.9	-176.5	-78.8	115.2	2.3	111	L111 E112 Q113 S119 D132 F135	L111-R115 WeakPolarHBondContact O-CB 3.19Å; L111-R115 PolarHBondContact O-N 2.76Å; E112-R115 PolarHBondContact O-N 2.93Å; Q113-R115 VanDerWaalsContact C-N 3.32Å; Q113-R115 PolarHBondContact O-N 3.16Å; R115-S119 WeakPolarHBondContact O-CB 3.31Å; R115-S119 PolarHBondContact O-N 3.31Å; R115-S119 PolarHBondContact O-OG 2.88Å; R115-D132 IonicContact CZ-OD1 2.92Å; R115-D132 IonicContact NE-OD1 3.52Å; R115-D132 PolarHBondContact NE-OD1 3.14Å; R115-F135 VanDerWaalsContact CA-CZ 3.47Å; R115-F135 HydrophobicContact CB-CD1 4.47Å; R115-F135 HydrophobicContact CB-CE1 3.71Å; R115-F135 HydrophobicContact CB-CE2 4.33Å; R115-F135 HydrophobicContact CB-CZ 3.68Å; R115-F135 HydrophobicContact CG-CE1 4.26Å; R115-F135 HydrophobicContact CG-CE2 3.96Å; R115-F135 HydrophobicContact CG-CZ 3.79Å
116	A	82	Confident	74.8	Confident	45 Å²	45	75.7 Å²	75.7	37%	0.372	40%	0.395	S	S	.	.	H	α-helix	trans	-62.5	-46.8	175.2	0	0	0	0	0	111.9	E112 Q113 L114 K118 S119 A120	E112-A116 PolarHBondContact O-N 3.36Å; Q113-A116 WeakPolarHBondContact O-CB 3.42Å; Q113-A116 PolarHBondContact O-N 3.44Å; L114-A116 VanDerWaalsContact C-N 3.29Å; L114-A116 PolarHBondContact O-N 2.88Å; A116-K118 PolarHBondContact O-N 3.16Å; A116-S119 WeakPolarHBondContact CA-OG 3.47Å; A116-S119 PolarHBondContact O-N 2.87Å; A116-S119 PolarHBondContact O-OG 2.81Å; A116-A120 PolarHBondContact O-N 2.86Å
117	V	78.7	Confident	73.6	Confident	23 Å²	23	82.6 Å²	82.6	14%	0.139	43%	0.428	C	S	.	.	H	α-helix	trans	-59.7	-48.4	177.8	176.5	0	0	0	0	110.6	Q113 L114 S119 A120 V121 Q302 L304	Q113-V117 WeakPolarHBondContact O-CG2 3.49Å; Q113-V117 PolarHBondContact O-N 3.18Å; L114-V117 PolarHBondContact O-N 2.87Å; V117-S119 VanDerWaalsContact C-N 3.31Å; V117-S119 PolarHBondContact O-N 3.07Å; V117-A120 PolarHBondContact O-N 2.91Å; V117-V121 PolarHBondContact O-N 2.85Å; V117-Q302 HydrophobicContact CG1-CB 4.38Å; V117-Q302 HydrophobicContact CG2-CB 3.97Å; V117-Q302 HydrophobicContact CG2-CG 3.89Å; V117-L304 HydrophobicContact CG1-CD2 4.43Å
118	K	76.5	Confident	72.6	Confident	67 Å²	67	89.6 Å²	89.6	29%	0.291	47%	0.465	S	S	.	.	H	α-helix	trans	-61.7	-38.6	177.5	-168.5	164.6	-167.8	154.7	0	112	L114 A116 K122 F135 L210 E211	L114-K118 WeakPolarHBondContact O-CB 3.37Å; L114-K118 PolarHBondContact O-N 3.06Å; A116-K118 PolarHBondContact O-N 3.16Å; K118-K122 PolarHBondContact O-N 2.84Å; K118-F135 HydrophobicContact CB-CZ 4.43Å; K118-F135 HydrophobicContact CD-CZ 4.22Å; K118-L210 HydrophobicContact CD-CD1 4.04Å; K118-E211 IonicContact NZ-OE1 2.86Å; K118-E211 PolarHBondContact NZ-OE1 3.33Å
119	S	77.7	Confident	71.3	Confident	76 Å²	76	84 Å²	84	53%	0.531	45%	0.454	S	S	.	.	H	α-helix	trans	-69.6	-30.2	177.7	74.7	0	0	0	0	113.7	R115 A116 V117 V121	R115-S119 WeakPolarHBondContact O-CB 3.31Å; R115-S119 PolarHBondContact O-N 3.31Å; R115-S119 PolarHBondContact O-OG 2.88Å; A116-S119 WeakPolarHBondContact CA-OG 3.47Å; A116-S119 PolarHBondContact O-N 2.87Å; A116-S119 PolarHBondContact O-OG 2.81Å; V117-S119 VanDerWaalsContact C-N 3.31Å; V117-S119 PolarHBondContact O-N 3.07Å; S119-V121 VanDerWaalsContact C-N 3.32Å
120	A	76.4	Confident	69.9	Low	70 Å²	70	87 Å²	87	58%	0.579	47%	0.468	S	S	*	.	H	α-helix	trans	-74.1	-23.9	179.6	0	0	0	0	0	113.1	A116 V117	A116-A120 PolarHBondContact O-N 2.86Å; V117-A120 PolarHBondContact O-N 2.91Å
121	V	70.4	Confident	68.6	Low	124 Å²	124	90.2 Å²	90.2	75%	0.752	49%	0.491	S	S	*	.	H	α-helix	trans	-88.9	-21.9	178.4	-178.3	0	0	0	0	112.1	V117 S119 D123	V117-V121 PolarHBondContact O-N 2.85Å; S119-V121 VanDerWaalsContact C-N 3.32Å; V121-D123 PolarHBondContact O-N 2.8Å
122	K	65.2	Low	67.5	Low	93 Å²	93	95 Å²	95	40%	0.404	52%	0.516	S	S	.	.	S	Bend	trans	-66.6	129.3	178.5	-79.8	-178.1	176.6	-175.1	0	111.4	K118 A129	K118-K122 PolarHBondContact O-N 2.84Å; K122-A129 HydrophobicContact CD-CB 4.24Å
123	D	61.3	Low	66.2	Low	105 Å²	105	99.1 Å²	99.1	56%	0.561	53%	0.533	S	S	*	.			trans	-64.8	127	172.7	-168.9	-33.8	0	0	0	109.2	V121 H125 D126	V121-D123 PolarHBondContact O-N 2.8Å; D123-H125 PolarHBondContact O-N 2.87Å; D123-H125 IonicContact OD1-CD2 3.97Å; D123-H125 PolarHBondContact OD1-N 2.79Å; D123-H125 VanDerWaalsContact OD1-N 3.1Å; D123-D126 PolarHBondContact O-N 2.91Å; D123-D126 VanDerWaalsContact O-N 3.12Å
124	P	61.3	Low	65	Low	126 Å²	126	100.2 Å²	100.2	82%	0.818	54%	0.542	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.8	-8.5	179.9	21.8	-32.9	0	0	0	115
125	H	59.4	Low	64.1	Low	165 Å²	165	101.7 Å²	101.7	76%	0.764	55%	0.548	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.1	0.9	176.6	-76	-65.2	0	0	0	115.8	D123 E127	D123-H125 PolarHBondContact O-N 2.87Å; D123-H125 IonicContact OD1-CD2 3.97Å; D123-H125 PolarHBondContact OD1-N 2.79Å; D123-H125 VanDerWaalsContact OD1-N 3.1Å; H125-E127 PolarHBondContact O-N 3.02Å
126	D	60.5	Low	63.1	Low	96 Å²	96	99.1 Å²	99.1	51%	0.513	54%	0.543	S	S	.	.			trans	-85.2	87.6	176.8	-166.4	4.5	0	0	0	112	D123 N128 A129	D123-D126 PolarHBondContact O-N 2.91Å; D123-D126 VanDerWaalsContact O-N 3.12Å; D126-N128 PolarHBondContact O-N 2.98Å; D126-N128 PolarHBondContact OD1-N 3.41Å; D126-A129 PolarHBondContact O-N 2.82Å
127	E	55.8	Low	62.2	Low	196 Å²	196	104.5 Å²	104.5	92%	0.916	56%	0.561	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69.4	-4.9	176.6	-64.9	-171	169.3	0	0	113.8	H125	H125-E127 PolarHBondContact O-N 3.02Å
128	N	54.8	Low	61.3	Low	147 Å²	147	105.8 Å²	105.8	79%	0.786	57%	0.569	S	S	*	*	T	Hydrogen-bonded Turn	trans	-101.1	9.5	178.1	-86.9	-22.8	0	0	0	113.8	D126 E130	D126-N128 PolarHBondContact O-N 2.98Å; D126-N128 PolarHBondContact OD1-N 3.41Å; N128-E130 PolarHBondContact O-N 3.46Å
129	A	51.6	Low	60.8	Low	47 Å²	47	106.2 Å²	106.2	39%	0.388	57%	0.574	S	S	.	*			trans	-57.6	106	-178.9	0	0	0	0	0	111.6	K122 D126 S131	K122-A129 HydrophobicContact CD-CB 4.24Å; D126-A129 PolarHBondContact O-N 2.82Å; A129-S131 PolarHBondContact O-N 2.96Å
130	E	52.8	Low	60.2	Low	152 Å²	152	102.9 Å²	102.9	71%	0.71	55%	0.551	S	S	*	*			trans	-48.1	132.9	178.6	-86.2	170.2	149.4	0	0	111.3	N128	N128-E130 PolarHBondContact O-N 3.46Å
131	S	53.5	Low	60.1	Low	69 Å²	69	99.6 Å²	99.6	48%	0.483	52%	0.524	S	S	.	.			trans	-53.9	158.6	-171.8	59.8	0	0	0	0	113.2	A129 K133	A129-S131 PolarHBondContact O-N 2.96Å; S131-K133 PolarHBondContact O-N 3.21Å; S131-K133 WeakPolarHBondContact OG-CG 3.34Å
132	D	54.8	Low	60.5	Low	114 Å²	114	94.2 Å²	94.2	61%	0.61	49%	0.491	S	S	*	.	G	3₁₀ helix	trans	-44.4	-2	171.3	-88.3	-46.5	0	0	0	117.2	R115 D134	R115-D132 IonicContact CZ-OD1 2.92Å; R115-D132 IonicContact NE-OD1 3.52Å; R115-D132 PolarHBondContact NE-OD1 3.14Å; D132-D134 VanDerWaalsContact C-N 3.33Å; D132-D134 PolarHBondContact O-N 2.81Å
133	K	54	Low	61.3	Low	181 Å²	181	90 Å²	90	79%	0.787	47%	0.473	S	S	*	.	G	3₁₀ helix	trans	-71	-19.1	-179.8	-65.3	-172.8	178.4	-175.8	0	114.8	S131 F135	S131-K133 PolarHBondContact O-N 3.21Å; S131-K133 WeakPolarHBondContact OG-CG 3.34Å; K133-F135 VanDerWaalsContact C-N 3.35Å
134	D	57.1	Low	62.6	Low	108 Å²	108	85.5 Å²	85.5	58%	0.578	45%	0.45	S	S	*	.	G	3₁₀ helix	trans	-88.5	1.4	-179.2	-66.9	-31.5	0	0	0	114	D132 P136	D132-D134 VanDerWaalsContact C-N 3.33Å; D132-D134 PolarHBondContact O-N 2.81Å; D134-P136 VanDerWaalsContact O-CD 3.32Å; D134-P136 WeakPolarHBondContact O-CD 3.32Å
135	F	61.2	Low	63.9	Low	36 Å²	36	79.8 Å²	79.8	16%	0.158	41%	0.413	C	S	.	.	S	Bend	trans	-77	116.8	171.6	-84.8	-94.4	0	0	0	109.2	L114 R115 K118 K133 E137 L210	L114-F135 HydrophobicContact CB-CE1 4.25Å; R115-F135 VanDerWaalsContact CA-CZ 3.47Å; R115-F135 HydrophobicContact CB-CD1 4.47Å; R115-F135 HydrophobicContact CB-CE1 3.71Å; R115-F135 HydrophobicContact CB-CE2 4.33Å; R115-F135 HydrophobicContact CB-CZ 3.68Å; R115-F135 HydrophobicContact CG-CE1 4.26Å; R115-F135 HydrophobicContact CG-CE2 3.96Å; R115-F135 HydrophobicContact CG-CZ 3.79Å; K118-F135 HydrophobicContact CB-CZ 4.43Å; K118-F135 HydrophobicContact CD-CZ 4.22Å; K133-F135 VanDerWaalsContact C-N 3.35Å; F135-E137 PolarHBondContact O-N 3.32Å; F135-L210 HydrophobicContact CD1-CD1 3.98Å; F135-L210 HydrophobicContact CE1-CD1 3.41Å; F135-L210 VanDerWaalsContact CE1-CD1 3.41Å; F135-L210 HydrophobicContact CE2-CD1 4.42Å; F135-L210 HydrophobicContact CZ-CD1 3.62Å
136	P	60.4	Low	65.3	Low	41 Å²	41	74.1 Å²	74.1	27%	0.266	39%	0.39	S	S	.	.	P	Polyproline II helix	trans	-60.4	137.4	179.6	24.1	-31.7	0	0	0	109.8	D134 L210	D134-P136 VanDerWaalsContact O-CD 3.32Å; D134-P136 WeakPolarHBondContact O-CD 3.32Å; P136-L210 HydrophobicContact CG-CD2 4.04Å
137	E	62.9	Low	66.7	Low	159 Å²	159	73.4 Å²	73.4	74%	0.743	38%	0.38	S	S	*	.	P	Polyproline II helix	trans	-63.1	131.7	173.4	-167.8	169.1	-165.7	0	0	108.7	F135 L139	F135-E137 PolarHBondContact O-N 3.32Å; E137-L139 PolarHBondContact O-N 2.87Å; E137-L139 VanDerWaalsContact O-N 3.11Å
138	P	59.4	Low	68.5	Low	49 Å²	49	66.3 Å²	66.3	32%	0.318	35%	0.35	S	S	.	.	P	Polyproline II helix	trans	-57.9	118.5	-179.9	13.7	-23.2	0	0	0	110.8	Q107 L111	Q107-P138 HydrophobicContact CG-CB 3.86Å; L111-P138 HydrophobicContact CD1-CB 3.58Å; L111-P138 HydrophobicContact CD1-CG 3.57Å
139	L	65.9	Low	70.4	Confident	76 Å²	76	62 Å²	62	40%	0.398	32%	0.323	S	S	.	.	P	Polyproline II helix	trans	-78.6	144.5	167.1	-65.2	175.9	0	0	0	108.8	Q107 E137 L141 Y328 P329	Q107-L139 PolarHBondContact NE2-O 2.65Å; Q107-L139 PolarHBondContact OE1-O 3.02Å; Q107-L139 VanDerWaalsContact OE1-O 3.13Å; E137-L139 PolarHBondContact O-N 2.87Å; E137-L139 VanDerWaalsContact O-N 3.11Å; L139-L141 PolarHBondContact O-N 3.14Å; L139-L141 VanDerWaalsContact O-N 3.17Å; L139-Y328 WeakPolarHBondContact CD1-O 2.86Å; L139-P329 PolarHBondContact N-O 2.71Å
140	P	66.1	Low	72.4	Confident	6 Å²	6	68 Å²	68	4%	0.039	34%	0.34	C	S	.	.	P	Polyproline II helix	trans	-54	128.7	175.7	26.6	-36.2	0	0	0	109.4	K49 I53 Y100 I142	K49-P140 HydrophobicContact CB-CG 4.14Å; K49-P140 HydrophobicContact CD-CG 3.82Å; K49-P140 HydrophobicContact CG-CG 3.79Å; I53-P140 HydrophobicContact CD1-CB 4.47Å; Y100-P140 HydrophobicContact CE2-CB 3.6Å; P140-I142 VanDerWaalsContact C-N 3.3Å; P140-I142 HydrophobicContact CG-CG1 4.42Å; P140-I142 PolarHBondContact O-N 2.83Å
141	L	74	Confident	74.4	Confident	2 Å²	2	63.8 Å²	63.8	1%	0.01	32%	0.322	C	S	.	.			trans	-73.7	89.5	177	178	70.8	0	0	0	108	Q103 L139 Y278 D307 L309 P329	Q103-L141 VanDerWaalsContact CD-CB 3.49Å; Q103-L141 HydrophobicContact CG-CB 3.75Å; Q103-L141 HydrophobicContact CG-CD2 4.07Å; Q103-L141 HydrophobicContact CG-CG 4.34Å; Q103-L141 PolarHBondContact NE2-O 2.94Å; Q103-L141 PolarHBondContact OE1-O 3Å; L139-L141 PolarHBondContact O-N 3.14Å; L139-L141 VanDerWaalsContact O-N 3.17Å; L141-Y278 HydrophobicContact CD2-CD1 4.43Å; L141-Y278 HydrophobicContact CD2-CE1 3.58Å; L141-Y278 HydrophobicContact CG-CE1 4.49Å; L141-D307 HydrophobicContact CD2-CB 4.34Å; L141-L309 HydrophobicContact CD1-CD2 3.65Å; L141-L309 HydrophobicContact CD2-CD2 4.08Å; L141-L309 HydrophobicContact CG-CD2 4.27Å; L141-P329 HydrophobicContact CB-CB 4.42Å; L141-P329 HydrophobicContact CD1-CB 3.46Å; L141-P329 VanDerWaalsContact CD1-CB 3.46Å; L141-P329 HydrophobicContact CD1-CG 3.72Å
142	I	78	Confident	76.5	Confident	10 Å²	10	61.8 Å²	61.8	5%	0.051	31%	0.306	C	S	.	.	P	Polyproline II helix	trans	-70	132.7	-178.8	-57.8	-163.4	0	0	0	108.6	E52 I53 A56 P140 A144 H326	E52-I142 HydrophobicContact CB-CD1 3.54Å; I53-I142 HydrophobicContact CG1-CD1 4.12Å; I53-I142 HydrophobicContact CG1-CG1 4.03Å; A56-I142 HydrophobicContact CB-CG2 3.5Å; P140-I142 VanDerWaalsContact C-N 3.3Å; P140-I142 HydrophobicContact CG-CG1 4.42Å; P140-I142 PolarHBondContact O-N 2.83Å; I142-A144 PolarHBondContact O-N 3.44Å; I142-H326 PolarHBondContact O-CD2 2.92Å; I142-H326 PolarHBondContact O-NE2 3.42Å
143	P	81.9	Confident	78.5	Confident	6 Å²	6	60.1 Å²	60.1	4%	0.039	31%	0.308	C	S	.	.	P	Polyproline II helix	trans	-53	141.5	178	-27.6	37.4	0	0	0	111.8	L57 Y95 T145	L57-P143 HydrophobicContact CD2-CG 4.11Å; Y95-P143 HydrophobicContact CD2-CG 4.4Å; Y95-P143 HydrophobicContact CE1-CG 4.41Å; Y95-P143 HydrophobicContact CE2-CG 3.37Å; Y95-P143 WeakPolarHBondContact OH-CD 3.21Å; Y95-P143 WeakPolarHBondContact OH-CG 3.15Å; P143-T145 PolarHBondContact O-N 3Å
144	A	88.9	Confident	80.6	Confident	9 Å²	9	56.2 Å²	56.2	7%	0.074	29%	0.292	C	S	.	.	P	Polyproline II helix	trans	-64.5	133.5	175.6	0	0	0	0	0	110.4	I142 W191 I310 H326	I142-A144 PolarHBondContact O-N 3.44Å; A144-W191 HydrophobicContact CB-CH2 4.03Å; A144-I310 HydrophobicContact CB-CD1 3.76Å; A144-I310 HydrophobicContact CB-CG1 3.76Å; A144-H326 HydrophobicContact CB-CB 4.18Å
145	T	88.1	Confident	82.5	Confident	6 Å²	6	51.1 Å²	51.1	4%	0.037	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.4	130.8	176	-52.2	0	0	0	0	109.6	Q59 P143 W147 G324 T325	Q59-T145 HydrophobicContact CB-CG2 3.67Å; Q59-T145 HydrophobicContact CG-CG2 3.43Å; Q59-T145 VanDerWaalsContact CG-CG2 3.43Å; P143-T145 PolarHBondContact O-N 3Å; T145-W147 HydrophobicContact CG2-CE3 3.92Å; T145-W147 HydrophobicContact CG2-CZ3 3.92Å; T145-W147 WeakPolarHBondContact O-CZ3 3.39Å; T145-G324 CarbonylContact O-C 3.53Å; T145-G324 WeakPolarHBondContact O-CA 3.47Å; T145-T325 PolarHBondContact N-O 3.18Å; T145-T325 PolarHBondContact O-N 3.28Å
146	V	90.2	Very high	84.3	Confident	47 Å²	47	50.8 Å²	50.8	29%	0.285	26%	0.264	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	138.3	-177.7	-176.6	0	0	0	0	109.7	W191 I310 C323	V146-W191 HydrophobicContact CG2-CZ2 4.24Å; V146-I310 HydrophobicContact CG2-CD1 3.77Å; V146-C323 WeakPolarHBondContact CA-O 3.41Å
147	W	89.4	Confident	86	Confident	81 Å²	81	55.9 Å²	55.9	31%	0.307	28%	0.278	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.9	174.8	175.3	62.1	94.5	0	0	0	110.8	T145 C323 T325	T145-W147 HydrophobicContact CG2-CE3 3.92Å; T145-W147 HydrophobicContact CG2-CZ3 3.92Å; T145-W147 WeakPolarHBondContact O-CZ3 3.39Å; W147-C323 HydrophobicContact CD2-CB 4.01Å; W147-C323 VanDerWaalsContact CE2-CB 3.46Å; W147-C323 HydrophobicContact CG-CB 4.15Å; W147-C323 HydrophobicContact CZ2-CB 3.9Å; W147-C323 PolarHBondContact N-O 3.44Å; W147-C323 PolarHBondContact O-N 2.96Å; W147-C323 VanDerWaalsContact O-O 3.08Å; W147-T325 HydrophobicContact CH2-CG2 3.95Å; W147-T325 HydrophobicContact CZ3-CG2 3.93Å
148	T	93.2	Very high	87.6	Confident	47 Å²	47	52 Å²	52	29%	0.288	26%	0.26	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	157.9	176.8	65.6	0	0	0	0	112.9	E320 V321 Y322	T148-E320 WeakPolarHBondContact CB-OE2 3.36Å; T148-E320 HydrophobicContact CG2-CB 4.48Å; T148-E320 PolarHBondContact OG1-OE2 3.23Å; T148-V321 CarbonylContact C-O 3.58Å; T148-V321 WeakPolarHBondContact CA-O 3.22Å; T148-Y322 HydrophobicContact CG2-CD1 4.11Å; T148-Y322 HydrophobicContact CG2-CD2 4.18Å; T148-Y322 HydrophobicContact CG2-CE1 3.98Å; T148-Y322 HydrophobicContact CG2-CE2 4.08Å; T148-Y322 HydrophobicContact CG2-CG 4.21Å
149	R	94.1	Very high	89.4	Confident	57 Å²	57	49.8 Å²	49.8	22%	0.215	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.5	142.1	172.8	-56.9	-173.2	-66.5	107.2	-7	111.2	N151 E192 V321 C323	R149-N151 WeakPolarHBondContact CB-OD1 3.44Å; R149-N151 PolarHBondContact NH1-ND2 3.43Å; R149-N151 VanDerWaalsContact NH1-ND2 3.11Å; R149-N151 PolarHBondContact NH1-OD1 3.33Å; R149-E192 IonicContact CZ-OE1 2.61Å; R149-E192 IonicContact NE-OE1 2.82Å; R149-E192 PolarHBondContact NE-OE1 2.96Å; R149-E192 VanDerWaalsContact NE-OE1 3.16Å; R149-E192 IonicContact NH2-OE1 3.16Å; R149-E192 PolarHBondContact NH2-OE1 2.91Å; R149-V321 HydrophobicContact CB-CB 4.3Å; R149-V321 PolarHBondContact N-O 3.42Å; R149-V321 PolarHBondContact O-N 2.93Å; R149-C323 PolarHBondContact NE-SG 2.95Å; R149-C323 VanDerWaalsContact NE-SG 3.36Å
150	K	95.1	Very high	90.9	Very high	173 Å²	173	49.8 Å²	49.8	75%	0.752	25%	0.245	S	C	*	.	S	Bend	trans	-82.3	-16.1	-173.8	-65.1	-174.6	178.2	-175.5	0	115.3	I152 E320	K150-I152 PolarHBondContact O-N 3.14Å; K150-E320 WeakPolarHBondContact CE-OE1 3.28Å; K150-E320 WeakPolarHBondContact CG-OE1 3.13Å
151	N	95.2	Very high	92.3	Very high	62 Å²	62	55.4 Å²	55.4	33%	0.332	28%	0.275	S	S	.	.			trans	-83.3	52.6	-176	58.7	-37.2	0	0	0	112.9	R149 A153 E154 F155	R149-N151 WeakPolarHBondContact CB-OD1 3.44Å; R149-N151 PolarHBondContact NH1-ND2 3.43Å; R149-N151 VanDerWaalsContact NH1-ND2 3.11Å; R149-N151 PolarHBondContact NH1-OD1 3.33Å; N151-A153 PolarHBondContact O-N 3.31Å; N151-E154 HydrophobicContact CB-CB 4.3Å; N151-E154 PolarHBondContact ND2-OE2 2.81Å; N151-E154 PolarHBondContact O-N 3.43Å; N151-F155 PolarHBondContact O-N 2.95Å; N151-F155 VanDerWaalsContact O-N 3.13Å
152	I	97.1	Very high	93.2	Very high	28 Å²	28	60.2 Å²	60.2	14%	0.144	30%	0.304	C	S	.	.	H	α-helix	trans	-60.5	-40.1	-178.3	-171.5	172.9	0	0	0	113.5	K150 E154 F155 K156 A194 H318 V321	K150-I152 PolarHBondContact O-N 3.14Å; I152-E154 PolarHBondContact O-N 3.03Å; I152-F155 PolarHBondContact O-N 3.26Å; I152-K156 HydrophobicContact CG1-CD 4.28Å; I152-K156 HydrophobicContact CG1-CG 4.47Å; I152-K156 WeakPolarHBondContact O-CG 3.42Å; I152-K156 PolarHBondContact O-N 3.08Å; I152-A194 HydrophobicContact CD1-CB 4.03Å; I152-A194 HydrophobicContact CG1-CB 3.92Å; I152-H318 VanDerWaalsContact CD1-O 3.26Å; I152-H318 WeakPolarHBondContact CD1-O 3.48Å; I152-V321 HydrophobicContact CB-CG2 4.09Å; I152-V321 HydrophobicContact CG1-CG2 4.32Å
153	A	97.2	Very high	93.8	Very high	78 Å²	78	62.8 Å²	62.8	65%	0.645	32%	0.316	S	S	*	.	H	α-helix	trans	-66.7	-37.6	-179.2	0	0	0	0	0	112.6	N151 R157	N151-A153 PolarHBondContact O-N 3.31Å; A153-R157 WeakPolarHBondContact O-CB 3.44Å; A153-R157 PolarHBondContact O-N 3.29Å
154	E	97.3	Very high	94.4	Very high	99 Å²	99	69.9 Å²	69.9	46%	0.463	35%	0.346	S	S	.	.	H	α-helix	trans	-68	-46.4	176.4	179.7	177.1	-146.1	0	0	111	N151 I152 K156 R157 E158	N151-E154 HydrophobicContact CB-CB 4.3Å; N151-E154 PolarHBondContact ND2-OE2 2.81Å; N151-E154 PolarHBondContact O-N 3.43Å; I152-E154 PolarHBondContact O-N 3.03Å; E154-K156 PolarHBondContact O-N 3.43Å; E154-R157 PolarHBondContact O-N 2.76Å; E154-E158 PolarHBondContact O-N 2.88Å
155	F	97.6	Very high	94.6	Very high	1 Å²	1	74.5 Å²	74.5	0%	0.004	37%	0.366	C	S	.	.	H	α-helix	trans	-56.9	-50.7	176.9	171.2	-108	0	0	0	112	N151 I152 R157 E158 I159 E192 A194 V321 R353	N151-F155 PolarHBondContact O-N 2.95Å; N151-F155 VanDerWaalsContact O-N 3.13Å; I152-F155 PolarHBondContact O-N 3.26Å; F155-R157 VanDerWaalsContact C-N 3.3Å; F155-R157 PolarHBondContact O-N 3.27Å; F155-E158 WeakPolarHBondContact O-CB 3.47Å; F155-E158 PolarHBondContact O-N 3.37Å; F155-I159 HydrophobicContact CD2-CG1 4.28Å; F155-I159 HydrophobicContact CE1-CG1 4.28Å; F155-I159 HydrophobicContact CE2-CD1 3.91Å; F155-I159 HydrophobicContact CE2-CG1 3.86Å; F155-I159 HydrophobicContact CZ-CD1 4.17Å; F155-I159 HydrophobicContact CZ-CG1 3.86Å; F155-I159 WeakPolarHBondContact O-CG1 3.47Å; F155-I159 PolarHBondContact O-N 2.88Å; F155-E192 HydrophobicContact CE2-CB 3.78Å; F155-E192 HydrophobicContact CZ-CB 4.02Å; F155-A194 HydrophobicContact CD1-CB 3.77Å; F155-A194 HydrophobicContact CE1-CB 3.74Å; F155-V321 HydrophobicContact CB-CG2 3.7Å; F155-V321 HydrophobicContact CD1-CG1 3.9Å; F155-V321 HydrophobicContact CD1-CG2 3.84Å; F155-V321 HydrophobicContact CD2-CG1 4.26Å; F155-V321 HydrophobicContact CE1-CG1 4.06Å; F155-V321 HydrophobicContact CE2-CG1 4.4Å; F155-V321 HydrophobicContact CG-CG1 4Å; F155-V321 HydrophobicContact CG-CG2 3.86Å; F155-V321 HydrophobicContact CZ-CG1 4.3Å; F155-R353 HydrophobicContact CE2-CB 4.43Å
156	K	97.6	Very high	94.9	Very high	30 Å²	30	75.1 Å²	75.1	13%	0.13	37%	0.37	C	S	.	.	H	α-helix	trans	-59.3	-41.1	178.8	-70.6	178.2	178.6	-179.1	0	112.6	I152 E154 I159 L160 T195 D196 Y351	I152-K156 HydrophobicContact CG1-CD 4.28Å; I152-K156 HydrophobicContact CG1-CG 4.47Å; I152-K156 WeakPolarHBondContact O-CG 3.42Å; I152-K156 PolarHBondContact O-N 3.08Å; E154-K156 PolarHBondContact O-N 3.43Å; K156-I159 PolarHBondContact O-N 3.19Å; K156-L160 VanDerWaalsContact O-CG 3.27Å; K156-L160 WeakPolarHBondContact O-CG 3.2Å; K156-L160 PolarHBondContact O-N 3.44Å; K156-T195 WeakPolarHBondContact CE-O 3.21Å; K156-T195 PolarHBondContact NZ-O 3.37Å; K156-D196 VanDerWaalsContact NZ-CA 3.31Å; K156-D196 IonicContact NZ-OD1 3.22Å; K156-D196 PolarHBondContact NZ-OD1 2.86Å; K156-Y351 HydrophobicContact CB-CD1 4.1Å; K156-Y351 HydrophobicContact CB-CE1 4.13Å; K156-Y351 HydrophobicContact CB-CG 4.38Å; K156-Y351 HydrophobicContact CD-CD2 4.14Å; K156-Y351 HydrophobicContact CD-CE2 3.96Å; K156-Y351 HydrophobicContact CG-CD1 4.07Å; K156-Y351 HydrophobicContact CG-CD2 3.83Å; K156-Y351 HydrophobicContact CG-CE1 4.28Å; K156-Y351 HydrophobicContact CG-CE2 4.07Å; K156-Y351 HydrophobicContact CG-CG 3.85Å
157	R	97.5	Very high	95.3	Very high	148 Å²	148	73.8 Å²	73.8	56%	0.558	36%	0.363	S	S	*	.	H	α-helix	trans	-63.4	-45.4	176.7	-179.3	-177.2	61.7	-176.1	-1.9	111.2	A153 E154 F155 I159 L160 D161	A153-R157 WeakPolarHBondContact O-CB 3.44Å; A153-R157 PolarHBondContact O-N 3.29Å; E154-R157 PolarHBondContact O-N 2.76Å; F155-R157 VanDerWaalsContact C-N 3.3Å; F155-R157 PolarHBondContact O-N 3.27Å; R157-I159 PolarHBondContact O-N 3.19Å; R157-L160 PolarHBondContact O-N 3.03Å; R157-D161 WeakPolarHBondContact CG-OD2 3.14Å; R157-D161 WeakPolarHBondContact O-CB 3.32Å; R157-D161 VanDerWaalsContact O-CG 3.22Å; R157-D161 PolarHBondContact O-N 3.42Å
158	E	96.5	Very high	95.6	Very high	78 Å²	78	71 Å²	71	36%	0.364	35%	0.354	S	S	.	.	H	α-helix	trans	-59	-45.3	177.6	-172.1	-175	175.6	0	0	111.9	E154 F155 L160 D161 V162 R353	E154-E158 PolarHBondContact O-N 2.88Å; F155-E158 WeakPolarHBondContact O-CB 3.47Å; F155-E158 PolarHBondContact O-N 3.37Å; E158-L160 PolarHBondContact O-N 2.97Å; E158-D161 PolarHBondContact O-N 3.44Å; E158-V162 HydrophobicContact CG-CG2 4.38Å; E158-V162 WeakPolarHBondContact O-CB 3.2Å; E158-V162 WeakPolarHBondContact O-CG2 3.28Å; E158-V162 PolarHBondContact O-N 3.46Å; E158-R353 VanDerWaalsContact CD-NH1 3.27Å; E158-R353 IonicContact OE1-CZ 2.89Å; E158-R353 IonicContact OE1-NH1 3.78Å; E158-R353 PolarHBondContact OE1-NH1 3.48Å; E158-R353 IonicContact OE1-NH2 3.97Å; E158-R353 IonicContact OE2-NH1 3.06Å; E158-R353 IonicContact OE2-NH2 3.75Å
159	I	97.2	Very high	95.8	Very high	1 Å²	1	73.7 Å²	73.7	1%	0.005	36%	0.362	C	S	.	.	H	α-helix	trans	-60	-46.6	175.3	-63	-54.2	0	0	0	110.9	F155 K156 R157 D161 Q163 K164 C166 C167 Y351 Y352 R353	F155-I159 HydrophobicContact CD2-CG1 4.28Å; F155-I159 HydrophobicContact CE1-CG1 4.28Å; F155-I159 HydrophobicContact CE2-CD1 3.91Å; F155-I159 HydrophobicContact CE2-CG1 3.86Å; F155-I159 HydrophobicContact CZ-CD1 4.17Å; F155-I159 HydrophobicContact CZ-CG1 3.86Å; F155-I159 WeakPolarHBondContact O-CG1 3.47Å; F155-I159 PolarHBondContact O-N 2.88Å; K156-I159 PolarHBondContact O-N 3.19Å; R157-I159 PolarHBondContact O-N 3.19Å; I159-D161 VanDerWaalsContact C-N 3.32Å; I159-D161 PolarHBondContact O-N 3.5Å; I159-Q163 CarbonylContact O-C 3.46Å; I159-Q163 WeakPolarHBondContact O-CA 3.28Å; I159-Q163 PolarHBondContact O-N 3.33Å; I159-Q163 VanDerWaalsContact O-O 3.09Å; I159-K164 PolarHBondContact O-N 2.96Å; I159-C166 HydrophobicContact CG2-CB 4.17Å; I159-C167 HydrophobicContact CG2-CB 4.29Å; I159-Y351 HydrophobicContact CB-CD1 4.25Å; I159-Y351 HydrophobicContact CG2-CD1 4.12Å; I159-Y352 WeakPolarHBondContact CD1-O 3.1Å; I159-R353 HydrophobicContact CD1-CB 3.93Å
160	L	96.5	Very high	95.9	Very high	77 Å²	77	71 Å²	71	40%	0.403	35%	0.351	S	S	.	.	H	α-helix	trans	-66.4	-32.6	-179.8	-70.2	172.4	0	0	0	113.6	K156 R157 E158 C167 Y351	K156-L160 VanDerWaalsContact O-CG 3.27Å; K156-L160 WeakPolarHBondContact O-CG 3.2Å; K156-L160 PolarHBondContact O-N 3.44Å; R157-L160 PolarHBondContact O-N 3.03Å; E158-L160 PolarHBondContact O-N 2.97Å; L160-C167 HydrophobicContact CD2-CB 4.24Å; L160-Y351 HydrophobicContact CD1-CE1 3.9Å; L160-Y351 HydrophobicContact CD2-CE1 3.86Å; L160-Y351 HydrophobicContact CG-CD1 4.36Å; L160-Y351 HydrophobicContact CG-CE1 3.74Å
161	D	95.7	Very high	96	Very high	124 Å²	124	64.2 Å²	64.2	66%	0.663	33%	0.326	S	S	*	.	H	α-helix	trans	-83.3	-36.7	-177.1	-71.6	-15.2	0	0	0	112.5	R157 E158 I159	R157-D161 WeakPolarHBondContact CG-OD2 3.14Å; R157-D161 WeakPolarHBondContact O-CB 3.32Å; R157-D161 VanDerWaalsContact O-CG 3.22Å; R157-D161 PolarHBondContact O-N 3.42Å; E158-D161 PolarHBondContact O-N 3.44Å; I159-D161 VanDerWaalsContact C-N 3.32Å; I159-D161 PolarHBondContact O-N 3.5Å
162	V	93.4	Very high	95.9	Very high	103 Å²	103	63.2 Å²	63.2	62%	0.624	32%	0.324	S	S	*	.	H	α-helix	trans	-108.9	-37	-170.3	-171.4	0	0	0	0	113	E158	E158-V162 HydrophobicContact CG-CG2 4.38Å; E158-V162 WeakPolarHBondContact O-CB 3.2Å; E158-V162 WeakPolarHBondContact O-CG2 3.28Å; E158-V162 PolarHBondContact O-N 3.46Å
163	Q	90.8	Very high	95.8	Very high	63 Å²	63	63.8 Å²	63.8	29%	0.294	33%	0.327	S	S	.	.			trans	-140.2	60.5	-168.1	-61.9	-176.8	-39.1	0	0	110.9	I159 E165 C166	I159-Q163 CarbonylContact O-C 3.46Å; I159-Q163 WeakPolarHBondContact O-CA 3.28Å; I159-Q163 PolarHBondContact O-N 3.33Å; I159-Q163 VanDerWaalsContact O-O 3.09Å; Q163-E165 PolarHBondContact O-N 3.4Å; Q163-C166 HydrophobicContact CB-CB 4.29Å; Q163-C166 WeakPolarHBondContact O-CB 3.25Å; Q163-C166 PolarHBondContact O-N 2.88Å
164	K	93.3	Very high	95.7	Very high	155 Å²	155	60.1 Å²	60.1	67%	0.674	30%	0.296	S	S	*	.	G	3₁₀ helix	trans	-60.9	-29.7	-172	-174.6	179.1	176.5	-175.3	0	112.9	I159 C166 C167	I159-K164 PolarHBondContact O-N 2.96Å; K164-C166 PolarHBondContact O-N 3.16Å; K164-C167 WeakPolarHBondContact O-CB 3.29Å; K164-C167 PolarHBondContact O-N 3Å
165	E	93.4	Very high	95.5	Very high	107 Å²	107	56.8 Å²	56.8	50%	0.5	28%	0.283	S	S	.	.	G	3₁₀ helix	trans	-60.1	-24.4	173	64.3	-81.4	-169	0	0	113.1	Q163 C167	Q163-E165 PolarHBondContact O-N 3.4Å; E165-C167 PolarHBondContact O-N 2.66Å
166	C	95.5	Very high	95.5	Very high	18 Å²	18	56.8 Å²	56.8	12%	0.122	28%	0.283	C	S	.	.	G	3₁₀ helix	trans	-85.1	15.4	174.3	-53.6	0	0	0	0	113.1	I159 Q163 K164 Y352	I159-C166 HydrophobicContact CG2-CB 4.17Å; Q163-C166 HydrophobicContact CB-CB 4.29Å; Q163-C166 WeakPolarHBondContact O-CB 3.25Å; Q163-C166 PolarHBondContact O-N 2.88Å; K164-C166 PolarHBondContact O-N 3.16Å; C166-Y352 HydrophobicContact CB-CD1 4.25Å; C166-Y352 HydrophobicContact CB-CE1 4.09Å; C166-Y352 HydrophobicContact CB-CE2 4.44Å; C166-Y352 HydrophobicContact CB-CG 4.49Å; C166-Y352 WeakPolarHBondContact CB-O 3.15Å; C166-Y352 WeakPolarHBondContact O-CD1 3.39Å; C166-Y352 PolarHBondContact O-N 3.49Å
167	C	97.1	Very high	95.5	Very high	20 Å²	20	56.3 Å²	56.3	14%	0.135	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	105.5	168.9	-174	0	0	0	0	109.6	I159 L160 K164 E165 L350 Y351	I159-C167 HydrophobicContact CG2-CB 4.29Å; L160-C167 HydrophobicContact CD2-CB 4.24Å; K164-C167 WeakPolarHBondContact O-CB 3.29Å; K164-C167 PolarHBondContact O-N 3Å; E165-C167 PolarHBondContact O-N 2.66Å; C167-L350 CarbonylContact C-O 3.46Å; C167-L350 VanDerWaalsContact CA-O 3.26Å; C167-L350 WeakPolarHBondContact CA-O 3.48Å; C167-Y351 HydrophobicContact CB-CD1 4.26Å; C167-Y351 HydrophobicContact CB-CE1 4.43Å; C167-Y351 WeakPolarHBondContact SG-CE1 3.31Å
168	I	96.1	Very high	95.5	Very high	23 Å²	23	49.3 Å²	49.3	12%	0.118	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	148.5	-176.4	65.9	173.6	0	0	0	111.6	A176 V218 L350 Y352	I168-A176 HydrophobicContact CD1-CB 3.77Å; I168-V218 HydrophobicContact CD1-CG1 4.1Å; I168-L350 HydrophobicContact CD1-CD2 3.97Å; I168-L350 HydrophobicContact CG1-CB 3.96Å; I168-L350 HydrophobicContact CG1-CD2 3.93Å; I168-L350 HydrophobicContact CG1-CG 4.35Å; I168-L350 PolarHBondContact N-O 2.81Å; I168-L350 PolarHBondContact O-N 3.4Å; I168-Y352 HydrophobicContact CD1-CE1 4.32Å; I168-Y352 HydrophobicContact CG1-CE1 4.34Å; I168-Y352 HydrophobicContact CG2-CE1 4.24Å
169	K	97.1	Very high	95.5	Very high	103 Å²	103	47.9 Å²	47.9	45%	0.448	25%	0.248	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.3	122.8	174	-174.2	-173.6	175.6	-166.9	0	109.4	S347 W349	K169-S347 WeakPolarHBondContact CE-OG 3.34Å; K169-W349 HydrophobicContact CB-CD2 4.12Å; K169-W349 HydrophobicContact CB-CE3 3.98Å; K169-W349 HydrophobicContact CB-CH2 4.05Å; K169-W349 HydrophobicContact CB-CZ2 4.17Å; K169-W349 HydrophobicContact CB-CZ3 3.95Å; K169-W349 HydrophobicContact CD-CZ2 4.24Å; K169-W349 HydrophobicContact CG-CD2 4.44Å; K169-W349 HydrophobicContact CG-CZ2 4.45Å
170	I	96.6	Very high	95.5	Very high	0 Å²	0	48.5 Å²	48.5	0%	0	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.5	114.5	172.9	-48.2	-179.7	0	0	0	107.6	A174 A176 L200 F338 N340 S347 K348 L350	I170-A174 HydrophobicContact CG2-CB 4.1Å; I170-A174 WeakPolarHBondContact CG2-O 3.37Å; I170-A176 HydrophobicContact CD1-CB 3.7Å; I170-A176 HydrophobicContact CG1-CB 3.85Å; I170-L200 HydrophobicContact CD1-CD1 4.18Å; I170-L200 HydrophobicContact CD1-CD2 4.06Å; I170-F338 HydrophobicContact CD1-CB 3.56Å; I170-N340 HydrophobicContact CB-CB 4.37Å; I170-N340 HydrophobicContact CG2-CB 3.6Å; I170-N340 PolarHBondContact O-ND2 2.87Å; I170-S347 CarbonylContact O-C 3.53Å; I170-S347 WeakPolarHBondContact O-CA 3.4Å; I170-S347 WeakPolarHBondContact O-CB 3.07Å; I170-K348 PolarHBondContact N-O 3.38Å; I170-K348 PolarHBondContact O-N 3.48Å; I170-L350 HydrophobicContact CD1-CB 4.18Å; I170-L350 HydrophobicContact CD1-CD2 4.17Å; I170-L350 HydrophobicContact CG1-CB 4.49Å
171	S	96.2	Very high	95.5	Very high	30 Å²	30	45.7 Å²	45.7	21%	0.21	24%	0.238	C	C	.	.			trans	-58	163.3	177.2	-64.4	0	0	0	0	111.9	A174 E222 N340	S171-A174 WeakPolarHBondContact O-CB 3.46Å; S171-A174 PolarHBondContact O-N 3.24Å; S171-E222 VanDerWaalsContact CB-OE1 3.31Å; S171-E222 WeakPolarHBondContact CB-OE1 3.41Å; S171-E222 PolarHBondContact OG-OE1 3.27Å; S171-N340 PolarHBondContact O-ND2 3.42Å
172	S	94.7	Very high	95.5	Very high	42 Å²	42	40.4 Å²	40.4	29%	0.294	21%	0.21	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57.6	146.1	164.2	39.7	0	0	0	0	109.4	A174 S343 L344	S172-A174 PolarHBondContact O-N 3.29Å; S172-A174 VanDerWaalsContact O-N 3.16Å; S172-S343 CarbonylContact C-O 3.5Å; S172-S343 VanDerWaalsContact CA-O 3.28Å; S172-S343 WeakPolarHBondContact CA-O 3.32Å; S172-S343 WeakPolarHBondContact CB-O 3.43Å; S172-L344 WeakPolarHBondContact CB-O 3.4Å
173	L	94	Very high	95.5	Very high	39 Å²	39	38.3 Å²	38.3	20%	0.204	19%	0.193	C	C	.	.	T	Hydrogen-bonded Turn	trans	57.7	25.9	-179.9	-54.8	-178.6	0	0	0	114.2	S223 N340 S341 S343 L344	L173-S223 WeakPolarHBondContact CB-OG 3.45Å; L173-S223 PolarHBondContact O-N 3.14Å; L173-S223 PolarHBondContact O-OG 3.45Å; L173-N340 PolarHBondContact N-O 2.81Å; L173-S341 WeakPolarHBondContact CD2-O 3.46Å; L173-S343 PolarHBondContact N-O 3.05Å; L173-L344 HydrophobicContact CD2-CD2 4.1Å
174	A	94.5	Very high	95.5	Very high	1 Å²	1	41 Å²	41	1%	0.008	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	158.3	-177.5	0	0	0	0	0	112.4	I170 S171 S172 I220 S221 E222 N340 S341	I170-A174 HydrophobicContact CG2-CB 4.1Å; I170-A174 WeakPolarHBondContact CG2-O 3.37Å; S171-A174 WeakPolarHBondContact O-CB 3.46Å; S171-A174 PolarHBondContact O-N 3.24Å; S172-A174 PolarHBondContact O-N 3.29Å; S172-A174 VanDerWaalsContact O-N 3.16Å; A174-I220 HydrophobicContact CB-CG2 4.39Å; A174-S221 CarbonylContact C-O 3.19Å; A174-S221 VanDerWaalsContact CA-O 3.24Å; A174-S221 WeakPolarHBondContact CA-O 3.43Å; A174-S221 WeakPolarHBondContact CB-O 3.47Å; A174-E222 HydrophobicContact CB-CB 4.47Å; A174-E222 HydrophobicContact CB-CG 3.99Å; A174-N340 CarbonylContact O-C 3.54Å; A174-N340 VanDerWaalsContact O-C 3.23Å; A174-N340 WeakPolarHBondContact O-CA 3.23Å; A174-N340 WeakPolarHBondContact O-CB 3.27Å; A174-N340 PolarHBondContact O-N 3.35Å; A174-S341 PolarHBondContact O-N 3.43Å
175	T	94.8	Very high	95.3	Very high	30 Å²	30	38.9 Å²	38.9	18%	0.184	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	131.1	174.3	-54.5	0	0	0	0	108.4	S221 F338 D339	T175-S221 PolarHBondContact N-O 3.48Å; T175-S221 PolarHBondContact O-N 2.96Å; T175-F338 WeakPolarHBondContact CA-O 3.48Å; T175-D339 HydrophobicContact CG2-CB 4.37Å; T175-D339 PolarHBondContact OG1-OD1 2.65Å; T175-D339 VanDerWaalsContact OG1-OD1 3.13Å
176	A	96.5	Very high	95.3	Very high	0 Å²	0	34.4 Å²	34.4	0%	0	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.7	133.3	168.6	0	0	0	0	0	109.9	I168 I170 N219 I220 F338	I168-A176 HydrophobicContact CD1-CB 3.77Å; I170-A176 HydrophobicContact CD1-CB 3.7Å; I170-A176 HydrophobicContact CG1-CB 3.85Å; A176-N219 CarbonylContact C-O 3.52Å; A176-N219 WeakPolarHBondContact CA-O 3.36Å; A176-I220 HydrophobicContact CB-CG1 4.11Å; A176-F338 HydrophobicContact CB-CB 4.25Å; A176-F338 PolarHBondContact N-O 3.41Å; A176-F338 PolarHBondContact O-N 2.95Å
177	T	97.2	Very high	95	Very high	21 Å²	21	41.3 Å²	41.3	13%	0.129	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	119.9	178.4	-57.9	0	0	0	0	108.9	R179 V218 N219 V335 F336	T177-R179 HydrophobicContact CG2-CG 4.14Å; T177-V218 WeakPolarHBondContact O-CA 3.34Å; T177-N219 PolarHBondContact N-O 2.72Å; T177-N219 PolarHBondContact O-N 3.44Å; T177-V335 HydrophobicContact CG2-CG1 3.45Å; T177-V335 VanDerWaalsContact CG2-CG1 3.45Å; T177-F336 CarbonylContact C-O 3.55Å; T177-F336 VanDerWaalsContact CA-O 3.31Å; T177-F336 WeakPolarHBondContact CA-O 3.2Å
178	V	97.3	Very high	94.8	Very high	1 Å²	1	40.9 Å²	40.9	1%	0.006	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	119.2	172.8	-173.8	0	0	0	0	108.1	V180 I216 S217 V218 F336 F338 Y352 I354	V178-V180 HydrophobicContact CG1-CG2 3.88Å; V178-I216 HydrophobicContact CG1-CG2 3.93Å; V178-S217 CarbonylContact C-O 3.55Å; V178-S217 WeakPolarHBondContact CA-O 3.45Å; V178-V218 HydrophobicContact CG1-CG2 4.16Å; V178-V218 HydrophobicContact CG2-CG1 4.28Å; V178-V218 HydrophobicContact CG2-CG2 4.17Å; V178-F336 HydrophobicContact CB-CB 4.15Å; V178-F336 PolarHBondContact N-O 3.03Å; V178-F336 PolarHBondContact O-N 2.74Å; V178-F338 HydrophobicContact CG2-CD2 4.24Å; V178-F338 HydrophobicContact CG2-CE2 3.92Å; V178-Y352 HydrophobicContact CG1-CE2 4.31Å; V178-Y352 HydrophobicContact CG2-CE2 4.3Å; V178-I354 HydrophobicContact CB-CD1 4.39Å; V178-I354 HydrophobicContact CG1-CD1 3.95Å
179	R	97.6	Very high	94.9	Very high	48 Å²	48	39.9 Å²	39.9	18%	0.181	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.3	120	179.3	-65.4	177.5	59.2	88.6	-1	109.1	T177 E207 I216 S217 V333 Y334 V335	T177-R179 HydrophobicContact CG2-CG 4.14Å; R179-E207 IonicContact CZ-OE1 3.16Å; R179-E207 IonicContact CZ-OE2 3.22Å; R179-E207 IonicContact NH1-OE1 3.56Å; R179-E207 IonicContact NH1-OE2 2.93Å; R179-E207 PolarHBondContact NH1-OE2 3Å; R179-E207 IonicContact NH2-OE1 2.71Å; R179-E207 PolarHBondContact NH2-OE1 3.05Å; R179-E207 IonicContact NH2-OE2 2.97Å; R179-I216 WeakPolarHBondContact O-CA 3.16Å; R179-I216 WeakPolarHBondContact O-CG2 2.69Å; R179-S217 WeakPolarHBondContact CB-OG 3.25Å; R179-S217 PolarHBondContact N-O 2.93Å; R179-S217 PolarHBondContact O-N 3.42Å; R179-S217 VanDerWaalsContact O-N 3.07Å; R179-V333 HydrophobicContact CB-CG1 3.81Å; R179-V333 HydrophobicContact CG-CG1 4.48Å; R179-Y334 CarbonylContact C-O 3.43Å; R179-Y334 WeakPolarHBondContact CA-O 2.99Å; R179-V335 HydrophobicContact CG-CG2 4.45Å
180	V	97.3	Very high	94.9	Very high	13 Å²	13	35.8 Å²	35.8	8%	0.079	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	105.2	-174.1	-174.1	0	0	0	0	109.7	V178 I189 I216 Y334 F336 I354	V178-V180 HydrophobicContact CG1-CG2 3.88Å; V180-I189 HydrophobicContact CB-CD1 4.09Å; V180-I189 HydrophobicContact CG1-CD1 3.86Å; V180-I216 HydrophobicContact CG1-CD1 4.27Å; V180-I216 HydrophobicContact CG1-CG1 4.24Å; V180-I216 HydrophobicContact CG2-CG1 4.43Å; V180-I216 HydrophobicContact CG2-CG2 4.18Å; V180-Y334 PolarHBondContact N-O 2.62Å; V180-Y334 PolarHBondContact O-N 2.62Å; V180-F336 HydrophobicContact CB-CE2 4.09Å; V180-F336 HydrophobicContact CG2-CD2 3.98Å; V180-F336 HydrophobicContact CG2-CE2 3.8Å; V180-I354 HydrophobicContact CG1-CG2 4.21Å; V180-I354 HydrophobicContact CG2-CD1 4.02Å; V180-I354 HydrophobicContact CG2-CG2 4.09Å
181	P	96.8	Very high	94.9	Very high	18 Å²	18	36 Å²	36	12%	0.117	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-58.1	147.1	174.1	-25.1	35.2	0	0	0	112.7	H183 P212 P213	P181-H183 PolarHBondContact O-N 2.83Å; P181-P212 HydrophobicContact CB-CB 4.2Å; P181-P213 WeakPolarHBondContact CB-O 3.42Å; P181-P213 HydrophobicContact CG-CG 4.15Å; P181-P213 WeakPolarHBondContact CG-O 3.01Å
182	T	94.7	Very high	95	Very high	14 Å²	14	35.6 Å²	35.6	9%	0.086	19%	0.191	C	C	.	.	P	Polyproline II helix	trans	-67.6	126.3	168.9	51.8	0	0	0	0	110.3	F206 Y328 G330 V331 G332 Y334	T182-F206 HydrophobicContact CG2-CE2 3.71Å; T182-F206 HydrophobicContact CG2-CZ 4.06Å; T182-Y328 HydrophobicContact CG2-CD1 4.42Å; T182-Y328 HydrophobicContact CG2-CD2 4.08Å; T182-Y328 HydrophobicContact CG2-CE1 4.45Å; T182-Y328 HydrophobicContact CG2-CE2 4.15Å; T182-Y328 HydrophobicContact CG2-CG 4.21Å; T182-G330 WeakPolarHBondContact CG2-O 3.44Å; T182-V331 WeakPolarHBondContact OG1-CA 3.3Å; T182-G332 PolarHBondContact N-O 2.85Å; T182-G332 PolarHBondContact OG1-N 2.83Å; T182-G332 PolarHBondContact OG1-O 2.67Å; T182-Y334 HydrophobicContact CG2-CD2 4.33Å; T182-Y334 HydrophobicContact CG2-CE2 4.02Å
183	H	93.3	Very high	95.2	Very high	59 Å²	59	33.7 Å²	33.7	27%	0.273	18%	0.177	S	C	.	.	P	Polyproline II helix	trans	-78.7	135.9	175.9	-170.2	-98.5	0	0	0	111.4	P181 N185 G186 Y356	P181-H183 PolarHBondContact O-N 2.83Å; H183-N185 PolarHBondContact ND1-N 2.79Å; H183-N185 PolarHBondContact O-N 3.25Å; H183-N185 VanDerWaalsContact O-N 3.14Å; H183-G186 PolarHBondContact O-N 2.79Å; H183-Y356 HydrophobicContact CB-CD1 3.76Å; H183-Y356 HydrophobicContact CB-CD2 4.37Å; H183-Y356 HydrophobicContact CB-CE1 3.86Å; H183-Y356 HydrophobicContact CB-CE2 4.49Å; H183-Y356 HydrophobicContact CB-CG 4.03Å; H183-Y356 AromaticContact CD2-CE1 3.99Å; H183-Y356 AromaticContact CE1-CZ 3.89Å; H183-Y356 AromaticContact CG-CE1 3.67Å; H183-Y356 AromaticContact CG-CZ 3.73Å; H183-Y356 AromaticContact ND1-CE2 3.75Å; H183-Y356 AromaticContact ND1-CZ 3.56Å
184	P	90.7	Very high	95.4	Very high	119 Å²	119	31.9 Å²	31.9	77%	0.773	17%	0.168	S	C	*	.	T	Hydrogen-bonded Turn	trans	-57.3	-31.6	-177.4	-27.6	34.9	0	0	0	115
185	N	90.7	Very high	95.6	Very high	111 Å²	111	31.9 Å²	31.9	59%	0.594	17%	0.168	S	C	*	.	T	Hydrogen-bonded Turn	trans	-94	0.4	177.4	-59.6	-23.4	0	0	0	113	H183 H358	H183-N185 PolarHBondContact ND1-N 2.79Å; H183-N185 PolarHBondContact O-N 3.25Å; H183-N185 VanDerWaalsContact O-N 3.14Å; N185-H358 PolarHBondContact O-ND1 2.88Å
186	G	91.7	Very high	95.7	Very high	13 Å²	13	32.9 Å²	32.9	13%	0.134	17%	0.172	C	C	.	.			trans	-87.8	153.1	-179.5	0	0	0	0	0	112.3	H183 Y328 T357	H183-G186 PolarHBondContact O-N 2.79Å; G186-Y328 VanDerWaalsContact C-CE2 3.46Å; G186-Y328 VanDerWaalsContact O-CD2 3.32Å; G186-Y328 WeakPolarHBondContact O-CD2 3.19Å; G186-Y328 WeakPolarHBondContact O-CE2 3.35Å; G186-T357 CarbonylContact C-O 3.57Å; G186-T357 WeakPolarHBondContact CA-O 3.44Å
187	R	90.9	Very high	95.7	Very high	163 Å²	163	38.2 Å²	38.2	62%	0.615	20%	0.201	S	C	*	.	S	Bend	trans	-120	-26.4	175.3	-70.8	-165.2	178.6	134.5	-2.3	113.7	Q327 Y328 T357 H358	R187-Q327 WeakPolarHBondContact O-CG 3.2Å; R187-Y328 PolarHBondContact O-N 2.71Å; R187-T357 PolarHBondContact N-O 2.69Å; R187-H358 WeakPolarHBondContact CD-OXT 3.47Å; R187-H358 VanDerWaalsContact CG-OXT 3.25Å; R187-H358 WeakPolarHBondContact CG-OXT 3.34Å; R187-H358 PolarHBondContact NE-OXT 3.11Å; R187-H358 PolarHBondContact NH1-OXT 2.85Å
188	A	93.1	Very high	95.7	Very high	11 Å²	11	41.4 Å²	41.4	9%	0.091	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.2	154.2	177.8	0	0	0	0	0	110.4	H326 Y356 T357	A188-H326 CarbonylContact C-O 3.49Å; A188-H326 VanDerWaalsContact CA-O 3.24Å; A188-H326 WeakPolarHBondContact CA-O 3.24Å; A188-H326 WeakPolarHBondContact CB-O 3.32Å; A188-Y356 CarbonylContact O-C 3.47Å; A188-Y356 WeakPolarHBondContact O-CA 3.4Å; A188-Y356 WeakPolarHBondContact O-CB 3.34Å; A188-T357 PolarHBondContact N-O 2.89Å; A188-T357 PolarHBondContact O-N 2.91Å
189	I	96.2	Very high	95.7	Very high	1 Å²	1	42.3 Å²	42.3	1%	0.005	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.2	144.5	169	-162	157	0	0	0	108.7	V180 W191 T325 H326 Y328 Y334 F336 I354	V180-I189 HydrophobicContact CB-CD1 4.09Å; V180-I189 HydrophobicContact CG1-CD1 3.86Å; I189-W191 HydrophobicContact CG2-CE3 4.1Å; I189-W191 HydrophobicContact CG2-CZ3 3.91Å; I189-T325 CarbonylContact O-C 3.44Å; I189-T325 WeakPolarHBondContact O-CA 3.39Å; I189-T325 WeakPolarHBondContact O-CB 3.24Å; I189-T325 PolarHBondContact O-OG1 3.22Å; I189-H326 HydrophobicContact CG2-CB 4.06Å; I189-H326 PolarHBondContact N-O 2.75Å; I189-H326 PolarHBondContact O-N 3.43Å; I189-Y328 HydrophobicContact CB-CE1 3.94Å; I189-Y328 VanDerWaalsContact N-CE1 3.33Å; I189-Y334 HydrophobicContact CB-CD2 4.34Å; I189-Y334 HydrophobicContact CB-CE2 4.1Å; I189-Y334 HydrophobicContact CD1-CD1 4.35Å; I189-Y334 HydrophobicContact CD1-CD2 3.64Å; I189-Y334 HydrophobicContact CD1-CE2 4.25Å; I189-Y334 HydrophobicContact CD1-CG 3.69Å; I189-Y334 HydrophobicContact CG2-CD1 3.89Å; I189-Y334 HydrophobicContact CG2-CD2 4.25Å; I189-Y334 HydrophobicContact CG2-CE1 3.51Å; I189-Y334 HydrophobicContact CG2-CE2 3.93Å; I189-Y334 HydrophobicContact CG2-CG 4.22Å; I189-F336 HydrophobicContact CD1-CE2 3.57Å; I189-F336 HydrophobicContact CD1-CZ 3.52Å; I189-F336 HydrophobicContact CG1-CZ 4.01Å; I189-I354 HydrophobicContact CD1-CG2 3.72Å; I189-I354 HydrophobicContact CG1-CG2 3.75Å
190	C	97.2	Very high	95.6	Very high	18 Å²	18	40 Å²	40	12%	0.122	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	143.3	173.1	-67.8	0	0	0	0	108.7	G324 T325 I354 F355	C190-G324 VanDerWaalsContact CA-O 3.32Å; C190-G324 WeakPolarHBondContact CA-O 3.36Å; C190-T325 PolarHBondContact SG-OG1 3.38Å; C190-T325 VanDerWaalsContact SG-OG1 3.37Å; C190-I354 WeakPolarHBondContact O-CA 3.46Å; C190-F355 HydrophobicContact CB-CD1 4.24Å; C190-F355 HydrophobicContact CB-CD2 3.77Å; C190-F355 HydrophobicContact CB-CE1 3.85Å; C190-F355 HydrophobicContact CB-CE2 3.32Å; C190-F355 HydrophobicContact CB-CG 4.21Å; C190-F355 HydrophobicContact CB-CZ 3.37Å; C190-F355 PolarHBondContact N-O 3.5Å; C190-F355 PolarHBondContact O-N 2.97Å
191	W	98.2	Very high	95.6	Very high	4 Å²	4	39.4 Å²	39.4	2%	0.015	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.3	153.5	178.1	64.1	90.4	0	0	0	111.9	A144 V146 I189 F202 L204 I310 C323 G324 T325 H326 F336 R353 I354	A144-W191 HydrophobicContact CB-CH2 4.03Å; V146-W191 HydrophobicContact CG2-CZ2 4.24Å; I189-W191 HydrophobicContact CG2-CE3 4.1Å; I189-W191 HydrophobicContact CG2-CZ3 3.91Å; W191-F202 AromaticContact CD1-CZ 3.92Å; W191-F202 AromaticContact NE1-CE1 3.78Å; W191-F202 AromaticContact NE1-CZ 3.6Å; W191-L204 HydrophobicContact CE3-CD2 4.37Å; W191-L204 HydrophobicContact CH2-CD2 3.69Å; W191-L204 HydrophobicContact CZ2-CD2 4.2Å; W191-L204 HydrophobicContact CZ3-CD2 3.78Å; W191-I310 HydrophobicContact CH2-CD1 4.06Å; W191-I310 HydrophobicContact CZ2-CD1 3.57Å; W191-C323 CarbonylContact O-C 3.57Å; W191-C323 VanDerWaalsContact O-CA 3.24Å; W191-C323 WeakPolarHBondContact O-CA 3.14Å; W191-G324 VanDerWaalsContact CE2-CA 3.43Å; W191-G324 VanDerWaalsContact CZ2-CA 3.47Å; W191-G324 PolarHBondContact N-O 2.75Å; W191-G324 PolarHBondContact O-N 2.89Å; W191-T325 VanDerWaalsContact CZ3-C 3.43Å; W191-T325 VanDerWaalsContact CZ3-CA 3.48Å; W191-H326 HydrophobicContact CH2-CB 4.21Å; W191-H326 HydrophobicContact CZ3-CB 3.98Å; W191-F336 HydrophobicContact CB-CD1 4.49Å; W191-F336 HydrophobicContact CB-CE1 3.65Å; W191-F336 HydrophobicContact CB-CZ 4.3Å; W191-F336 AromaticContact CD2-CE1 3.86Å; W191-F336 HydrophobicContact CD2-CE1 3.86Å; W191-F336 AromaticContact CE3-CE1 3.96Å; W191-F336 HydrophobicContact CE3-CE1 3.96Å; W191-F336 HydrophobicContact CE3-CZ 4.29Å; W191-F336 AromaticContact CG-CE1 3.74Å; W191-F336 HydrophobicContact CG-CE1 3.74Å; W191-R353 CarbonylContact C-O 3.54Å; W191-R353 VanDerWaalsContact CA-O 3.28Å; W191-R353 WeakPolarHBondContact CA-O 3.27Å; W191-I354 HydrophobicContact CB-CG1 4.04Å
192	E	98.1	Very high	95.6	Very high	22 Å²	22	38.7 Å²	38.7	10%	0.103	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.4	138.7	173.5	-55.7	-179.9	104.7	0	0	108.7	R149 F155 V321 Y322 C323 Y352 R353	R149-E192 IonicContact CZ-OE1 2.61Å; R149-E192 IonicContact NE-OE1 2.82Å; R149-E192 PolarHBondContact NE-OE1 2.96Å; R149-E192 VanDerWaalsContact NE-OE1 3.16Å; R149-E192 IonicContact NH2-OE1 3.16Å; R149-E192 PolarHBondContact NH2-OE1 2.91Å; F155-E192 HydrophobicContact CE2-CB 3.78Å; F155-E192 HydrophobicContact CZ-CB 4.02Å; E192-V321 HydrophobicContact CB-CG1 4.18Å; E192-Y322 CarbonylContact C-O 3.52Å; E192-Y322 VanDerWaalsContact CA-O 3.24Å; E192-Y322 WeakPolarHBondContact CA-O 3.37Å; E192-C323 HydrophobicContact CG-CB 4.37Å; E192-Y352 CarbonylContact O-C 3.54Å; E192-Y352 WeakPolarHBondContact O-CA 3.34Å; E192-R353 PolarHBondContact N-O 3.43Å; E192-R353 PolarHBondContact O-N 3.02Å; E192-R353 IonicContact OE1-NH2 2.62Å; E192-R353 IonicContact OE2-CZ 2.65Å; E192-R353 IonicContact OE2-NE 3.03Å; E192-R353 PolarHBondContact OE2-NE 3.13Å; E192-R353 IonicContact OE2-NH2 2.74Å; E192-R353 PolarHBondContact OE2-NH2 3.35Å
193	F	98.5	Very high	95.6	Very high	2 Å²	2	38 Å²	38	1%	0.009	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152	154.6	174.1	68.3	-85.9	0	0	0	114	F202 R315 C317 Y322 F338 L350 Y351	F193-F202 HydrophobicContact CD1-CD2 4.34Å; F193-F202 HydrophobicContact CD1-CE2 4.3Å; F193-F202 HydrophobicContact CE1-CB 4.38Å; F193-F202 AromaticContact CE1-CD1 3.83Å; F193-F202 HydrophobicContact CE1-CD1 3.83Å; F193-F202 AromaticContact CE1-CD2 3.72Å; F193-F202 HydrophobicContact CE1-CD2 3.72Å; F193-F202 AromaticContact CE1-CE1 3.98Å; F193-F202 HydrophobicContact CE1-CE1 3.98Å; F193-F202 AromaticContact CE1-CE2 3.86Å; F193-F202 HydrophobicContact CE1-CE2 3.86Å; F193-F202 AromaticContact CE1-CG 3.69Å; F193-F202 HydrophobicContact CE1-CG 3.69Å; F193-F202 AromaticContact CE1-CZ 3.99Å; F193-F202 HydrophobicContact CE1-CZ 3.99Å; F193-F202 HydrophobicContact CE2-CB 4.17Å; F193-F202 HydrophobicContact CE2-CD2 4.49Å; F193-F202 HydrophobicContact CE2-CG 4.31Å; F193-F202 HydrophobicContact CZ-CB 3.65Å; F193-F202 AromaticContact CZ-CD1 3.81Å; F193-F202 HydrophobicContact CZ-CD1 3.81Å; F193-F202 AromaticContact CZ-CD2 3.81Å; F193-F202 HydrophobicContact CZ-CD2 3.81Å; F193-F202 HydrophobicContact CZ-CE1 4.42Å; F193-F202 HydrophobicContact CZ-CE2 4.41Å; F193-F202 AromaticContact CZ-CG 3.45Å; F193-F202 HydrophobicContact CZ-CG 3.45Å; F193-F202 VanDerWaalsContact CZ-CG 3.45Å; F193-R315 HydrophobicContact CE2-CB 4.45Å; F193-R315 HydrophobicContact CZ-CG 4.3Å; F193-C317 HydrophobicContact CD2-CB 3.86Å; F193-C317 HydrophobicContact CE2-CB 3.64Å; F193-Y322 VanDerWaalsContact CE1-CB 3.48Å; F193-Y322 HydrophobicContact CE1-CG 4.44Å; F193-Y322 HydrophobicContact CE2-CG 4.26Å; F193-Y322 HydrophobicContact CZ-CD1 4.33Å; F193-Y322 AromaticContact CZ-CG 3.93Å; F193-Y322 HydrophobicContact CZ-CG 3.93Å; F193-Y322 PolarHBondContact N-O 3.5Å; F193-Y322 PolarHBondContact O-N 3.2Å; F193-F338 HydrophobicContact CB-CE1 4.03Å; F193-F338 HydrophobicContact CB-CZ 4.48Å; F193-F338 HydrophobicContact CD1-CE1 4.1Å; F193-F338 HydrophobicContact CD2-CE1 4.07Å; F193-F338 AromaticContact CG-CE1 3.81Å; F193-F338 HydrophobicContact CG-CE1 3.81Å; F193-L350 HydrophobicContact CB-CD1 3.89Å; F193-L350 HydrophobicContact CD2-CD1 4.26Å; F193-L350 HydrophobicContact CG-CD1 4.46Å; F193-Y351 CarbonylContact C-O 3.23Å; F193-Y351 WeakPolarHBondContact CA-O 3.34Å; F193-Y351 WeakPolarHBondContact CB-O 3.14Å
194	A	98.5	Very high	95.7	Very high	0 Å²	0	35.2 Å²	35.2	0%	0	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.9	162.5	175.4	0	0	0	0	0	111	I152 F155 C317 Y351	I152-A194 HydrophobicContact CD1-CB 4.03Å; I152-A194 HydrophobicContact CG1-CB 3.92Å; F155-A194 HydrophobicContact CD1-CB 3.77Å; F155-A194 HydrophobicContact CE1-CB 3.74Å; A194-C317 CarbonylContact C-O 3.53Å; A194-C317 VanDerWaalsContact CA-O 3.23Å; A194-C317 WeakPolarHBondContact CA-O 3.48Å; A194-C317 WeakPolarHBondContact CB-O 3.23Å; A194-Y351 PolarHBondContact N-O 3.18Å; A194-Y351 PolarHBondContact O-N 3.01Å
195	T	98.4	Very high	95.9	Very high	1 Å²	1	30.3 Å²	30.3	1%	0.006	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	170	173.7	55.2	0	0	0	0	111.6	K156 Y198 L200 C317 H318 W349	K156-T195 WeakPolarHBondContact CE-O 3.21Å; K156-T195 PolarHBondContact NZ-O 3.37Å; T195-Y198 WeakPolarHBondContact CB-O 3.47Å; T195-Y198 PolarHBondContact OG1-O 3.19Å; T195-L200 HydrophobicContact CG2-CB 4.01Å; T195-L200 HydrophobicContact CG2-CD2 3.87Å; T195-C317 VanDerWaalsContact CG2-SG 3.59Å; T195-C317 PolarHBondContact N-O 3.16Å; T195-C317 PolarHBondContact OG1-SG 2.89Å; T195-C317 VanDerWaalsContact OG1-SG 3.39Å; T195-H318 WeakPolarHBondContact O-CA 3.47Å; T195-H318 WeakPolarHBondContact OG1-CA 3.15Å; T195-H318 WeakPolarHBondContact OG1-CB 3.48Å; T195-H318 PolarHBondContact OG1-N 2.93Å; T195-W349 VanDerWaalsContact CA-O 3.23Å; T195-W349 WeakPolarHBondContact CA-O 2.98Å; T195-W349 WeakPolarHBondContact CB-O 3.32Å
196	D	97.2	Very high	96	Very high	51 Å²	51	25 Å²	25	27%	0.273	12%	0.119	S	C	.	.	S	Bend	trans	-72.8	-63.7	179.9	-78.5	-27.7	0	0	0	115.5	K156 Y351	K156-D196 VanDerWaalsContact NZ-CA 3.31Å; K156-D196 IonicContact NZ-OD1 3.22Å; K156-D196 PolarHBondContact NZ-OD1 2.86Å; D196-Y351 VanDerWaalsContact OD1-CE2 3.32Å; D196-Y351 WeakPolarHBondContact OD1-CE2 3.36Å; D196-Y351 PolarHBondContact OD1-OH 2.94Å; D196-Y351 PolarHBondContact OD2-OH 3.41Å
197	N	96.1	Very high	96	Very high	113 Å²	113	24.6 Å²	24.6	60%	0.604	11%	0.114	S	C	*	.	S	Bend	trans	-128.6	-13	-161.3	-58.3	-59.1	0	0	0	113.8
198	Y	96.9	Very high	95.9	Very high	87 Å²	87	17 Å²	17	34%	0.341	9%	0.085	S	C	.	.	S	Bend	trans	-141.3	152.6	-169.6	-55.6	-68.7	0	0	0	110.3	T195 R346	T195-Y198 WeakPolarHBondContact CB-O 3.47Å; T195-Y198 PolarHBondContact OG1-O 3.19Å; Y198-R346 HydrophobicContact CD2-CB 4.13Å; Y198-R346 HydrophobicContact CD2-CG 4.46Å; Y198-R346 HydrophobicContact CE2-CB 4.03Å; Y198-R346 HydrophobicContact CE2-CG 4Å; Y198-R346 PolarHBondContact OH-NE 2.89Å
199	D	97.3	Very high	95.7	Very high	20 Å²	20	17.8 Å²	17.8	11%	0.107	9%	0.088	C	C	.	.			trans	-61.7	163.1	171.5	70.9	-53.9	0	0	0	111.8	R314 R315 H318 K348	D199-R314 IonicContact OD1-NH2 2.81Å; D199-R314 PolarHBondContact OD1-NH2 2.88Å; D199-R314 IonicContact OD2-CZ 3.53Å; D199-R314 IonicContact OD2-NE 2.67Å; D199-R314 PolarHBondContact OD2-NE 3.4Å; D199-R314 IonicContact OD2-NH2 3.7Å; D199-R314 PolarHBondContact OD2-NH2 2.88Å; D199-R315 CarbonylContact C-O 3.52Å; D199-R315 WeakPolarHBondContact CA-O 3.19Å; D199-R315 WeakPolarHBondContact CB-O 3.41Å; D199-H318 PolarHBondContact N-ND1 2.75Å; D199-K348 WeakPolarHBondContact O-CD 3.35Å; D199-K348 WeakPolarHBondContact O-CE 3.37Å
200	L	96	Very high	95.2	Very high	0 Å²	0	19.6 Å²	19.6	0%	0	10%	0.097	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143	143.9	180	-174.1	69	0	0	0	109.4	I170 T195 R315 F338 D339 N340 K348 L350	I170-L200 HydrophobicContact CD1-CD1 4.18Å; I170-L200 HydrophobicContact CD1-CD2 4.06Å; T195-L200 HydrophobicContact CG2-CB 4.01Å; T195-L200 HydrophobicContact CG2-CD2 3.87Å; L200-R315 PolarHBondContact N-O 3.38Å; L200-R315 PolarHBondContact O-N 2.94Å; L200-F338 HydrophobicContact CD2-CB 4.05Å; L200-F338 HydrophobicContact CD2-CD1 3.97Å; L200-F338 HydrophobicContact CD2-CG 4.45Å; L200-D339 WeakPolarHBondContact CD1-O 3.44Å; L200-N340 HydrophobicContact CD1-CB 3.94Å; L200-K348 HydrophobicContact CB-CD 4.27Å; L200-K348 HydrophobicContact CD1-CB 4.37Å; L200-K348 HydrophobicContact CD1-CD 3.47Å; L200-K348 VanDerWaalsContact CD1-CD 3.47Å; L200-K348 HydrophobicContact CG-CD 4.44Å; L200-L350 HydrophobicContact CD2-CD1 3.91Å
201	G	96.4	Very high	94.7	Very high	1 Å²	1	25.4 Å²	25.4	1%	0.01	12%	0.123	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.9	134.5	171.4	0	0	0	0	0	109.9	F338 D339	G201-F338 CarbonylContact O-C 3.52Å; G201-F338 WeakPolarHBondContact O-CA 3.39Å; G201-D339 WeakPolarHBondContact CA-O 3.48Å; G201-D339 PolarHBondContact N-O 3.15Å; G201-D339 PolarHBondContact O-N 3.3Å
202	F	96.9	Very high	94.3	Very high	3 Å²	3	26.6 Å²	26.6	1%	0.013	13%	0.131	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.2	129.1	176.2	175.4	-103.7	0	0	0	110.8	W191 F193 L204 I310 I312 Y313 R315 F336 K337 F338	W191-F202 AromaticContact CD1-CZ 3.92Å; W191-F202 AromaticContact NE1-CE1 3.78Å; W191-F202 AromaticContact NE1-CZ 3.6Å; F193-F202 HydrophobicContact CD1-CD2 4.34Å; F193-F202 HydrophobicContact CD1-CE2 4.3Å; F193-F202 HydrophobicContact CE1-CB 4.38Å; F193-F202 AromaticContact CE1-CD1 3.83Å; F193-F202 HydrophobicContact CE1-CD1 3.83Å; F193-F202 AromaticContact CE1-CD2 3.72Å; F193-F202 HydrophobicContact CE1-CD2 3.72Å; F193-F202 AromaticContact CE1-CE1 3.98Å; F193-F202 HydrophobicContact CE1-CE1 3.98Å; F193-F202 AromaticContact CE1-CE2 3.86Å; F193-F202 HydrophobicContact CE1-CE2 3.86Å; F193-F202 AromaticContact CE1-CG 3.69Å; F193-F202 HydrophobicContact CE1-CG 3.69Å; F193-F202 AromaticContact CE1-CZ 3.99Å; F193-F202 HydrophobicContact CE1-CZ 3.99Å; F193-F202 HydrophobicContact CE2-CB 4.17Å; F193-F202 HydrophobicContact CE2-CD2 4.49Å; F193-F202 HydrophobicContact CE2-CG 4.31Å; F193-F202 HydrophobicContact CZ-CB 3.65Å; F193-F202 AromaticContact CZ-CD1 3.81Å; F193-F202 HydrophobicContact CZ-CD1 3.81Å; F193-F202 AromaticContact CZ-CD2 3.81Å; F193-F202 HydrophobicContact CZ-CD2 3.81Å; F193-F202 HydrophobicContact CZ-CE1 4.42Å; F193-F202 HydrophobicContact CZ-CE2 4.41Å; F193-F202 AromaticContact CZ-CG 3.45Å; F193-F202 HydrophobicContact CZ-CG 3.45Å; F193-F202 VanDerWaalsContact CZ-CG 3.45Å; F202-L204 HydrophobicContact CZ-CB 4.46Å; F202-I310 HydrophobicContact CE1-CD1 4.02Å; F202-I312 WeakPolarHBondContact O-CA 3.07Å; F202-Y313 PolarHBondContact N-O 3.4Å; F202-Y313 PolarHBondContact O-N 3.15Å; F202-R315 HydrophobicContact CB-CG 3.86Å; F202-F336 AromaticContact CE2-CD1 3.97Å; F202-F336 HydrophobicContact CE2-CD1 3.97Å; F202-F336 HydrophobicContact CZ-CD1 4.11Å; F202-K337 WeakPolarHBondContact CA-O 3.41Å; F202-F338 AromaticContact CD2-CD1 3.9Å; F202-F338 HydrophobicContact CD2-CD1 3.9Å; F202-F338 AromaticContact CD2-CE1 3.61Å; F202-F338 HydrophobicContact CD2-CE1 3.61Å; F202-F338 HydrophobicContact CD2-CZ 4.28Å; F202-F338 AromaticContact CE2-CE1 3.89Å; F202-F338 HydrophobicContact CE2-CE1 3.89Å; F202-F338 HydrophobicContact CE2-CZ 4.12Å
203	G	95.4	Very high	93.9	Very high	0 Å²	0	28.6 Å²	28.6	0%	0	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140	161.9	169.6	0	0	0	0	0	111.8	I310 K337	G203-I310 CarbonylContact C-O 3.54Å; G203-I310 WeakPolarHBondContact CA-O 3.13Å; G203-K337 PolarHBondContact N-O 2.98Å; G203-K337 PolarHBondContact O-N 3.2Å
204	L	96	Very high	93.4	Very high	0 Å²	0	37.5 Å²	37.5	0%	0	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.3	130.3	-178.5	-175.7	63.2	0	0	0	109.5	W191 F202 L309 I310 Y334 F336	W191-L204 HydrophobicContact CE3-CD2 4.37Å; W191-L204 HydrophobicContact CH2-CD2 3.69Å; W191-L204 HydrophobicContact CZ2-CD2 4.2Å; W191-L204 HydrophobicContact CZ3-CD2 3.78Å; F202-L204 HydrophobicContact CZ-CB 4.46Å; L204-L309 HydrophobicContact CB-CB 4.35Å; L204-L309 HydrophobicContact CD2-CB 4.31Å; L204-L309 HydrophobicContact CD2-CD1 3.99Å; L204-L309 HydrophobicContact CG-CB 4.21Å; L204-L309 HydrophobicContact CG-CD1 4.05Å; L204-L309 WeakPolarHBondContact O-CA 2.96Å; L204-L309 WeakPolarHBondContact O-CB 3.48Å; L204-L309 PolarHBondContact O-N 3.48Å; L204-I310 HydrophobicContact CB-CB 3.88Å; L204-I310 HydrophobicContact CB-CD1 3.98Å; L204-I310 HydrophobicContact CB-CG1 4Å; L204-I310 HydrophobicContact CD2-CD1 4.12Å; L204-I310 PolarHBondContact N-O 2.93Å; L204-I310 PolarHBondContact O-N 3.43Å; L204-Y334 HydrophobicContact CD1-CD1 3.96Å; L204-Y334 HydrophobicContact CD2-CD1 4.22Å; L204-Y334 HydrophobicContact CD2-CE1 4.43Å; L204-Y334 HydrophobicContact CG-CD1 4.25Å; L204-F336 HydrophobicContact CD1-CD1 3.62Å; L204-F336 HydrophobicContact CD1-CD2 4.01Å; L204-F336 HydrophobicContact CD1-CE1 3.6Å; L204-F336 HydrophobicContact CD1-CE2 3.99Å; L204-F336 HydrophobicContact CD1-CG 3.82Å; L204-F336 HydrophobicContact CD1-CZ 3.79Å
205	Y	94.2	Very high	93	Very high	15 Å²	15	41.4 Å²	41.4	6%	0.059	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	158.6	176.3	-54.1	-98.2	0	0	0	110	C282 V286 I306 D307 E308 I312 Y334 V335 K337	Y205-C282 WeakPolarHBondContact CE1-SG 3.48Å; Y205-V286 HydrophobicContact CD1-CG2 4.25Å; Y205-V286 HydrophobicContact CE1-CG2 4.28Å; Y205-I306 HydrophobicContact CD1-CG2 4.13Å; Y205-I306 HydrophobicContact CG-CG2 4.44Å; Y205-D307 CarbonylContact C-O 3.52Å; Y205-D307 WeakPolarHBondContact CA-O 3.4Å; Y205-D307 WeakPolarHBondContact CB-O 3.42Å; Y205-E308 HydrophobicContact CD1-CB 3.83Å; Y205-E308 HydrophobicContact CD1-CG 4.06Å; Y205-E308 HydrophobicContact CE1-CB 3.71Å; Y205-E308 HydrophobicContact CE1-CG 3.57Å; Y205-E308 WeakPolarHBondContact CE1-OE2 3.48Å; Y205-E308 PolarHBondContact OH-OE2 3.49Å; Y205-E308 VanDerWaalsContact OH-OE2 3.1Å; Y205-I312 HydrophobicContact CE2-CD1 4.43Å; Y205-I312 HydrophobicContact CE2-CG1 4.38Å; Y205-Y334 CarbonylContact O-C 3.53Å; Y205-Y334 WeakPolarHBondContact O-CA 3.29Å; Y205-V335 PolarHBondContact N-O 2.92Å; Y205-V335 PolarHBondContact O-N 2.75Å; Y205-K337 HydrophobicContact CD2-CD 4.24Å; Y205-K337 HydrophobicContact CD2-CG 4.14Å; Y205-K337 HydrophobicContact CE2-CB 4.38Å; Y205-K337 HydrophobicContact CE2-CD 3.81Å; Y205-K337 HydrophobicContact CE2-CG 4.01Å
206	F	93.1	Very high	92.8	Very high	0 Å²	0	46 Å²	46	0%	0	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121	114.7	170.7	-171.1	-100.3	0	0	0	109.1	T182 W208 I306 D307 L309 P329 Y334	T182-F206 HydrophobicContact CG2-CE2 3.71Å; T182-F206 HydrophobicContact CG2-CZ 4.06Å; F206-W208 HydrophobicContact CD1-CD2 4.03Å; F206-W208 AromaticContact CD1-CE2 3.86Å; F206-W208 HydrophobicContact CD1-CG 4.23Å; F206-W208 HydrophobicContact CD1-CZ2 4.26Å; F206-W208 AromaticContact CD1-NE1 3.96Å; F206-W208 AromaticContact CE1-CD2 3.75Å; F206-W208 HydrophobicContact CE1-CD2 3.75Å; F206-W208 AromaticContact CE1-CE2 3.93Å; F206-W208 AromaticContact CE1-CE3 3.86Å; F206-W208 HydrophobicContact CE1-CE3 3.86Å; F206-W208 HydrophobicContact CE1-CG 4.21Å; F206-W208 HydrophobicContact CE1-CH2 4.31Å; F206-W208 HydrophobicContact CE1-CZ2 4.2Å; F206-W208 HydrophobicContact CE1-CZ3 4.15Å; F206-I306 CarbonylContact O-C 3.6Å; F206-I306 VanDerWaalsContact O-CA 3.3Å; F206-I306 WeakPolarHBondContact O-CA 3.4Å; F206-D307 HydrophobicContact CB-CB 4.4Å; F206-D307 PolarHBondContact N-O 3.21Å; F206-D307 PolarHBondContact O-N 2.96Å; F206-L309 HydrophobicContact CB-CD1 3.91Å; F206-L309 HydrophobicContact CB-CD2 4.2Å; F206-L309 HydrophobicContact CB-CG 4.11Å; F206-P329 HydrophobicContact CD1-CG 3.7Å; F206-P329 HydrophobicContact CD2-CG 4.12Å; F206-P329 HydrophobicContact CE1-CG 3.66Å; F206-P329 HydrophobicContact CE2-CG 4.07Å; F206-P329 HydrophobicContact CG-CG 3.93Å; F206-P329 HydrophobicContact CZ-CG 3.84Å; F206-Y334 HydrophobicContact CD2-CD1 4.1Å; F206-Y334 AromaticContact CD2-CD2 3.94Å; F206-Y334 HydrophobicContact CD2-CD2 3.94Å; F206-Y334 AromaticContact CD2-CE1 3.98Å; F206-Y334 HydrophobicContact CD2-CE1 3.98Å; F206-Y334 AromaticContact CD2-CE2 3.8Å; F206-Y334 HydrophobicContact CD2-CE2 3.8Å; F206-Y334 HydrophobicContact CD2-CG 4.09Å; F206-Y334 AromaticContact CD2-CZ 3.82Å; F206-Y334 AromaticContact CE2-CD2 4Å; F206-Y334 HydrophobicContact CE2-CD2 4Å; F206-Y334 AromaticContact CE2-CE2 3.7Å; F206-Y334 HydrophobicContact CE2-CE2 3.7Å
207	E	91.6	Very high	92.6	Very high	5 Å²	5	45.6 Å²	45.6	2%	0.023	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92	119.3	173.5	-175.2	176.5	111.5	0	0	108.8	R179 D209 Y287 L304 I306 G332 V333 V335	R179-E207 IonicContact CZ-OE1 3.16Å; R179-E207 IonicContact CZ-OE2 3.22Å; R179-E207 IonicContact NH1-OE1 3.56Å; R179-E207 IonicContact NH1-OE2 2.93Å; R179-E207 PolarHBondContact NH1-OE2 3Å; R179-E207 IonicContact NH2-OE1 2.71Å; R179-E207 PolarHBondContact NH2-OE1 3.05Å; R179-E207 IonicContact NH2-OE2 2.97Å; E207-D209 PolarHBondContact O-N 3.19Å; E207-Y287 VanDerWaalsContact CD-OH 3.22Å; E207-Y287 PolarHBondContact OE1-OH 2.87Å; E207-Y287 PolarHBondContact OE2-OH 2.86Å; E207-L304 HydrophobicContact CG-CB 3.88Å; E207-L304 HydrophobicContact CG-CD1 4.27Å; E207-I306 HydrophobicContact CB-CG1 3.93Å; E207-I306 HydrophobicContact CG-CD1 4.36Å; E207-I306 HydrophobicContact CG-CG1 3.85Å; E207-G332 CarbonylContact O-C 3.51Å; E207-G332 VanDerWaalsContact O-CA 3.25Å; E207-G332 WeakPolarHBondContact O-CA 3.17Å; E207-V333 HydrophobicContact CB-CB 4.36Å; E207-V333 PolarHBondContact N-O 3.16Å; E207-V333 PolarHBondContact O-N 2.61Å; E207-V335 HydrophobicContact CB-CG2 4.23Å
208	W	89	Confident	92.4	Very high	2 Å²	2	43.2 Å²	43.2	1%	0.008	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.6	121.1	178.9	-70.5	90	0	0	0	109.7	Q107 L111 L114 F206 L304 P305 D307 P329	Q107-W208 HydrophobicContact CG-CH2 4.02Å; Q107-W208 HydrophobicContact CG-CZ2 3.82Å; L111-W208 HydrophobicContact CD2-CE3 4.4Å; L111-W208 HydrophobicContact CD2-CZ3 4.29Å; L114-W208 HydrophobicContact CD1-CB 3.5Å; L114-W208 HydrophobicContact CD1-CD2 4.3Å; L114-W208 HydrophobicContact CD1-CE3 4.08Å; L114-W208 HydrophobicContact CD1-CG 4.11Å; L114-W208 HydrophobicContact CD2-CB 3.82Å; L114-W208 WeakPolarHBondContact CD2-O 3.19Å; L114-W208 HydrophobicContact CG-CB 3.95Å; F206-W208 HydrophobicContact CD1-CD2 4.03Å; F206-W208 AromaticContact CD1-CE2 3.86Å; F206-W208 HydrophobicContact CD1-CG 4.23Å; F206-W208 HydrophobicContact CD1-CZ2 4.26Å; F206-W208 AromaticContact CD1-NE1 3.96Å; F206-W208 AromaticContact CE1-CD2 3.75Å; F206-W208 HydrophobicContact CE1-CD2 3.75Å; F206-W208 AromaticContact CE1-CE2 3.93Å; F206-W208 AromaticContact CE1-CE3 3.86Å; F206-W208 HydrophobicContact CE1-CE3 3.86Å; F206-W208 HydrophobicContact CE1-CG 4.21Å; F206-W208 HydrophobicContact CE1-CH2 4.31Å; F206-W208 HydrophobicContact CE1-CZ2 4.2Å; F206-W208 HydrophobicContact CE1-CZ3 4.15Å; W208-L304 WeakPolarHBondContact O-CB 3.41Å; W208-P305 HydrophobicContact CB-CB 4.41Å; W208-P305 PolarHBondContact N-O 3.47Å; W208-D307 PolarHBondContact NE1-OD2 2.92Å; W208-P329 HydrophobicContact CH2-CB 4Å; W208-P329 HydrophobicContact CH2-CG 4.36Å; W208-P329 WeakPolarHBondContact CH2-O 3.36Å; W208-P329 HydrophobicContact CZ2-CB 4.18Å; W208-P329 HydrophobicContact CZ2-CG 4.37Å
209	D	88.2	Confident	92.3	Very high	29 Å²	29	42 Å²	42	16%	0.155	22%	0.222	C	C	.	.			trans	-147.2	125.1	178.3	-166.7	-11.3	0	0	0	108.5	E207 E211 P212 L304 V331 G332 V333	E207-D209 PolarHBondContact O-N 3.19Å; D209-E211 VanDerWaalsContact C-N 3.31Å; D209-E211 PolarHBondContact OD1-N 3.1Å; D209-P212 HydrophobicContact CB-CB 4.25Å; D209-P212 WeakPolarHBondContact OD2-CA 3.15Å; D209-L304 HydrophobicContact CB-CD1 3.85Å; D209-V331 CarbonylContact O-C 3.58Å; D209-V331 WeakPolarHBondContact O-CG1 3.24Å; D209-V331 VanDerWaalsContact O-O 3.09Å; D209-G332 WeakPolarHBondContact O-CA 3.5Å; D209-G332 PolarHBondContact O-N 3.04Å; D209-V333 HydrophobicContact CB-CG2 4.41Å
210	L	85.8	Confident	92	Very high	38 Å²	38	44.9 Å²	44.9	20%	0.199	24%	0.236	C	C	.	.	S	Bend	trans	-82.1	-17.4	179.1	-62.7	175.8	0	0	0	112.1	K118 F135 P136 P212	K118-L210 HydrophobicContact CD-CD1 4.04Å; F135-L210 HydrophobicContact CD1-CD1 3.98Å; F135-L210 HydrophobicContact CE1-CD1 3.41Å; F135-L210 VanDerWaalsContact CE1-CD1 3.41Å; F135-L210 HydrophobicContact CE2-CD1 4.42Å; F135-L210 HydrophobicContact CZ-CD1 3.62Å; P136-L210 HydrophobicContact CG-CD2 4.04Å; L210-P212 VanDerWaalsContact C-CD 3.41Å
211	E	87	Confident	91.6	Very high	141 Å²	141	47 Å²	47	66%	0.659	25%	0.251	S	S	*	.	S	Bend	trans	-130.9	56.9	-178.7	-69.2	166.4	-157.4	0	0	108.6	K118 D209	K118-E211 IonicContact NZ-OE1 2.86Å; K118-E211 PolarHBondContact NZ-OE1 3.33Å; D209-E211 VanDerWaalsContact C-N 3.31Å; D209-E211 PolarHBondContact OD1-N 3.1Å
212	P	88.9	Confident	90.9	Very high	28 Å²	28	52.9 Å²	52.9	18%	0.182	28%	0.278	C	S	.	.			trans	-63.1	152	-174.9	30.5	-36.4	0	0	0	110.4	P181 D209 L210 V331 V333	P181-P212 HydrophobicContact CB-CB 4.2Å; D209-P212 HydrophobicContact CB-CB 4.25Å; D209-P212 WeakPolarHBondContact OD2-CA 3.15Å; L210-P212 VanDerWaalsContact C-CD 3.41Å; P212-V331 HydrophobicContact CG-CG1 3.82Å; P212-V333 HydrophobicContact CB-CG2 3.7Å
213	P	90.9	Very high	89.2	Confident	65 Å²	65	56 Å²	56	42%	0.422	30%	0.301	S	S	.	.			trans	-58.6	152.8	176.5	24.4	-32	0	0	0	110.7	P181 N215 V333	P181-P213 WeakPolarHBondContact CB-O 3.42Å; P181-P213 HydrophobicContact CG-CG 4.15Å; P181-P213 WeakPolarHBondContact CG-O 3.01Å; P213-N215 VanDerWaalsContact C-N 3.34Å; P213-V333 HydrophobicContact CG-CG2 4.5Å
214	E	87.9	Confident	87.1	Confident	189 Å²	189	61.7 Å²	61.7	88%	0.883	34%	0.341	S	S	*	.	S	Bend	trans	-76.4	-24.1	179.2	-65.1	-176.5	170.1	0	0	112.8
215	N	89.8	Confident	85.1	Confident	82 Å²	82	69 Å²	69	44%	0.439	38%	0.38	S	S	.	.	S	Bend	trans	-103.8	146.6	-171.4	-63	-41.1	0	0	0	112.2	P213	P213-N215 VanDerWaalsContact C-N 3.34Å
216	I	93.3	Very high	82.7	Confident	98 Å²	98	76.1 Å²	76.1	50%	0.503	41%	0.413	S	S	.	.			trans	-71	134.6	166.5	-63.1	173.2	0	0	0	108.6	V178 R179 V180	V178-I216 HydrophobicContact CG1-CG2 3.93Å; R179-I216 WeakPolarHBondContact O-CA 3.16Å; R179-I216 WeakPolarHBondContact O-CG2 2.69Å; V180-I216 HydrophobicContact CG1-CD1 4.27Å; V180-I216 HydrophobicContact CG1-CG1 4.24Å; V180-I216 HydrophobicContact CG2-CG1 4.43Å; V180-I216 HydrophobicContact CG2-CG2 4.18Å
217	S	93.3	Very high	80.6	Confident	41 Å²	41	85.9 Å²	85.9	29%	0.287	46%	0.459	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	147.8	174	90.2	0	0	0	0	111.3	V178 R179 N219	V178-S217 CarbonylContact C-O 3.55Å; V178-S217 WeakPolarHBondContact CA-O 3.45Å; R179-S217 WeakPolarHBondContact CB-OG 3.25Å; R179-S217 PolarHBondContact N-O 2.93Å; R179-S217 PolarHBondContact O-N 3.42Å; R179-S217 VanDerWaalsContact O-N 3.07Å; S217-N219 PolarHBondContact OG-OD1 3.4Å
218	V	93.6	Very high	78.3	Confident	63 Å²	63	89.6 Å²	89.6	38%	0.382	50%	0.499	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	119.5	174	-176.2	0	0	0	0	108.2	I168 T177 V178	I168-V218 HydrophobicContact CD1-CG1 4.1Å; T177-V218 WeakPolarHBondContact O-CA 3.34Å; V178-V218 HydrophobicContact CG1-CG2 4.16Å; V178-V218 HydrophobicContact CG2-CG1 4.28Å; V178-V218 HydrophobicContact CG2-CG2 4.17Å
219	N	93.5	Very high	75.9	Confident	61 Å²	61	93 Å²	93	33%	0.326	54%	0.535	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121	131.7	-178.1	-63.5	55	0	0	0	108.5	A176 T177 S217	A176-N219 CarbonylContact C-O 3.52Å; A176-N219 WeakPolarHBondContact CA-O 3.36Å; T177-N219 PolarHBondContact N-O 2.72Å; T177-N219 PolarHBondContact O-N 3.44Å; S217-N219 PolarHBondContact OG-OD1 3.4Å
220	I	91	Very high	73.7	Confident	81 Å²	81	100.8 Å²	100.8	42%	0.415	57%	0.57	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-112.9	115.4	173.4	-58	178.2	0	0	0	107.4	A174 A176	A174-I220 HydrophobicContact CB-CG2 4.39Å; A176-I220 HydrophobicContact CB-CG1 4.11Å
221	S	88.2	Confident	71.8	Confident	45 Å²	45	106.7 Å²	106.7	32%	0.315	60%	0.602	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-106	123.4	178.6	-52.2	0	0	0	0	108.5	A174 T175	A174-S221 CarbonylContact C-O 3.19Å; A174-S221 VanDerWaalsContact CA-O 3.24Å; A174-S221 WeakPolarHBondContact CA-O 3.43Å; A174-S221 WeakPolarHBondContact CB-O 3.47Å; T175-S221 PolarHBondContact N-O 3.48Å; T175-S221 PolarHBondContact O-N 2.96Å
222	E	80.8	Confident	69.6	Low	124 Å²	124	108.6 Å²	108.6	58%	0.579	61%	0.611	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-93.7	131.6	171.6	-56.3	-170.7	149	0	0	107.5	S171 A174 S224	S171-E222 VanDerWaalsContact CB-OE1 3.31Å; S171-E222 WeakPolarHBondContact CB-OE1 3.41Å; S171-E222 PolarHBondContact OG-OE1 3.27Å; A174-E222 HydrophobicContact CB-CB 4.47Å; A174-E222 HydrophobicContact CB-CG 3.99Å; E222-S224 PolarHBondContact O-N 2.96Å
223	S	61.9	Low	67.6	Low	68 Å²	68	115.3 Å²	115.3	48%	0.476	65%	0.645	S	S	.	*			trans	-66	106.5	175.2	64.6	0	0	0	0	108.2	L173 D225	L173-S223 WeakPolarHBondContact CB-OG 3.45Å; L173-S223 PolarHBondContact O-N 3.14Å; L173-S223 PolarHBondContact O-OG 3.45Å; S223-D225 PolarHBondContact O-N 2.88Å
224	S	51.6	Low	65.3	Low	121 Å²	121	121.2 Å²	121.2	85%	0.846	67%	0.667	S	S	*	*			trans	-78.3	65.3	-174	176.6	0	0	0	0	111.7	E222	E222-S224 PolarHBondContact O-N 2.96Å
225	D	53	Low	63.2	Low	153 Å²	153	121.7 Å²	121.7	82%	0.818	67%	0.67	S	S	*	*			trans	-130.6	20.9	-177	-116.1	8	0	0	0	115.2	S223	S223-D225 PolarHBondContact O-N 2.88Å
226	E	45.3	Very low	60.8	Low	164 Å²	164	121.2 Å²	121.2	77%	0.766	68%	0.684	S	S	*	*			trans	-121.4	72.8	166.5	-66.8	-158.3	-171.3	0	0	111.8
227	E	48.3	Very low	58.2	Low	205 Å²	205	123 Å²	123	96%	0.958	70%	0.702	S	S	*	*			trans	-100.3	111.9	147.1	-79.1	-147.1	-179.9	0	0	108.7
228	G	43.5	Very low	55.7	Low	84 Å²	84	128.9 Å²	128.9	87%	0.866	73%	0.73	S	S	*	*			trans	125.8	96.5	160.4	0	0	0	0	0	115.2
229	G	39.2	Very low	53.1	Low	74 Å²	74	131.2 Å²	131.2	76%	0.763	75%	0.749	S	S	*	*			trans	171.5	53	168.3	0	0	0	0	0	113.8	D231	G229-D231 PolarHBondContact O-N 2.89Å
230	E	41.1	Very low	50.5	Low	191 Å²	191	131.8 Å²	131.8	89%	0.893	77%	0.769	S	S	*	*			trans	-70.3	110.3	152.1	-69.4	178.4	171.8	0	0	106.4
231	D	45	Very low	48	Very low	162 Å²	162	135.5 Å²	135.5	87%	0.866	79%	0.79	S	S	*	*			trans	-146.9	107.2	155.5	-83.3	-39	0	0	0	108.1	G229	G229-D231 PolarHBondContact O-N 2.89Å
232	E	42.8	Very low	46	Very low	182 Å²	182	138.6 Å²	138.6	85%	0.85	81%	0.812	S	S	*	*			trans	-61.9	138.4	162.7	-57	175.5	156.2	0	0	108.7
233	D	45.3	Very low	44.6	Very low	168 Å²	168	138 Å²	138	90%	0.898	82%	0.817	S	S	*	*			trans	-165.7	112.8	146.5	-90.5	-29.4	0	0	0	110.7
234	E	44	Very low	44	Very low	189 Å²	189	142.1 Å²	142.1	88%	0.883	83%	0.828	S	S	*	*			trans	-72.4	135.9	163.2	-67.8	-164.8	154	0	0	110.3
235	E	42.8	Very low	43.7	Very low	200 Å²	200	142.7 Å²	142.7	94%	0.935	82%	0.818	S	S	*	*			trans	-153.8	132.2	137.4	-80.1	-149.8	158.9	0	0	111.1
236	G	38.9	Very low	43.1	Very low	71 Å²	71	141.3 Å²	141.3	73%	0.732	82%	0.815	S	S	*	*			trans	-81.2	179.8	-175	0	0	0	0	0	116
237	P	39.4	Very low	43.1	Very low	137 Å²	137	139 Å²	139	89%	0.89	82%	0.817	S	S	*	*			trans	-91.4	147.3	-158.3	35.4	-33.2	0	0	0	113.5
238	N	41.5	Very low	42.8	Very low	163 Å²	163	134.4 Å²	134.4	87%	0.872	81%	0.805	S	S	*	*			trans	-119.7	123.2	173.1	-144.7	3.1	0	0	0	112.2
239	S	38.1	Very low	42.5	Very low	112 Å²	112	139 Å²	139	78%	0.783	80%	0.801	S	S	*	*			trans	-78.2	145.8	173.8	61.1	0	0	0	0	111.7
240	G	38.7	Very low	42.5	Very low	73 Å²	73	143.2 Å²	143.2	75%	0.753	81%	0.806	S	S	*	*			trans	-177.5	79.2	172.1	0	0	0	0	0	116.5
241	N	37.9	Very low	42.4	Very low	159 Å²	159	142.1 Å²	142.1	85%	0.85	80%	0.801	S	S	*	*			trans	18.4	150.9	146	-69.2	-15.5	0	0	0	124.1
242	S	46.4	Very low	42.2	Very low	111 Å²	111	142 Å²	142	78%	0.776	80%	0.8	S	S	*	*			trans	95.8	139.8	142.3	-81.5	0	0	0	0	118.3
243	V	52.7	Low	41.9	Very low	111 Å²	111	143 Å²	143	67%	0.673	80%	0.802	S	S	*	*			cis	172.2	150.2	-15.9	128.6	0	0	0	0	105.2
244	E	48.9	Very low	41.5	Very low	155 Å²	155	144 Å²	144	72%	0.724	80%	0.801	S	S	*	*			trans	72.4	148.2	161.7	-74.1	174.7	143.5	0	0	119.3
245	Q	45.1	Very low	40.9	Very low	133 Å²	133	140.6 Å²	140.6	62%	0.621	80%	0.798	S	S	*	*			cis	-168	146.2	11	-123.6	166	43.3	0	0	109.9
246	T	40.7	Very low	40.7	Very low	124 Å²	124	139 Å²	139	76%	0.761	79%	0.79	S	S	*	*			trans	64.9	153.1	141.7	65.8	0	0	0	0	120.5
247	S	44.2	Very low	40.6	Very low	116 Å²	116	141 Å²	141	81%	0.811	78%	0.784	S	S	*	*			cis	-178.9	169.6	-28.6	-103.9	0	0	0	0	106.3
248	P	42.4	Very low	40.4	Very low	108 Å²	108	142.6 Å²	142.6	70%	0.701	78%	0.784	S	S	*	*			trans	-116.9	-176.2	-136.6	43.9	-37.2	0	0	0	117.2
249	K	37.6	Very low	39.9	Very low	180 Å²	180	143.9 Å²	143.9	78%	0.783	79%	0.785	S	S	*	*			trans	75.6	120.9	155.8	-71	-175.4	177.4	-173.3	0	119
250	N	39.2	Very low	39.7	Very low	163 Å²	163	146.6 Å²	146.6	87%	0.872	79%	0.79	S	S	*	*			trans	-144.2	117.9	137.4	-122.6	-1.7	0	0	0	109.9
251	E	37.9	Very low	39.2	Very low	167 Å²	167	145.4 Å²	145.4	78%	0.78	78%	0.778	S	S	*	*			trans	-81.3	132.9	164.2	-68.8	174.8	168.7	0	0	107.5
252	N	40.9	Very low	39.1	Very low	159 Å²	159	148.3 Å²	148.3	85%	0.85	78%	0.783	S	S	*	*			trans	-145.7	115.1	153.4	-99.1	-16.2	0	0	0	109
253	K	36.9	Very low	38.5	Very low	204 Å²	204	151.5 Å²	151.5	89%	0.887	78%	0.782	S	S	*	*			trans	-69.9	128.5	160.5	-79.2	172.3	172.4	172	0	107.8
254	E	36.7	Very low	37.5	Very low	190 Å²	190	150.9 Å²	150.9	89%	0.888	78%	0.783	S	S	*	*			trans	-157.9	120.7	142	-122.1	168.1	179	0	0	110.6
255	S	31.6	Very low	37	Very low	116 Å²	116	148.4 Å²	148.4	81%	0.811	77%	0.774	S	S	*	*			trans	-63.2	124.6	166.7	43.5	0	0	0	0	110.1
256	H	39.5	Very low	36.6	Very low	167 Å²	167	150.7 Å²	150.7	77%	0.773	79%	0.785	S	S	*	*			trans	-140.1	103.8	167.1	-147.1	-80.1	0	0	0	109.8
257	D	36.7	Very low	36.6	Very low	114 Å²	114	151.5 Å²	151.5	61%	0.61	78%	0.78	S	S	*	*			trans	47.9	105.7	135.5	-56.1	-25.3	0	0	0	120.7	E259	D257-E259 PolarHBondContact O-N 3.26Å
258	L	34.2	Very low	36.7	Very low	170 Å²	170	156.2 Å²	156.2	89%	0.89	78%	0.78	S	S	*	*				25.9	79.8	108.9	-75	146.8	0	0	0	117.2
259	E	31.6	Very low	37	Very low	189 Å²	189	152.9 Å²	152.9	88%	0.883	76%	0.756	S	S	*	*			trans	-172	64.2	144.3	-120.8	-179.6	163.3	0	0	112.5	D257 G261	D257-E259 PolarHBondContact O-N 3.26Å; E259-G261 PolarHBondContact O-N 3.31Å
260	L	33.4	Very low	37.7	Very low	170 Å²	170	146.6 Å²	146.6	89%	0.89	73%	0.734	S	S	*	*			trans	-81.9	84.3	162.4	-94.2	154.5	0	0	0	108.3
261	G	29	Very low	38.2	Very low	48 Å²	48	140.9 Å²	140.9	50%	0.495	70%	0.703	S	S	.	*			trans	-43.5	143.7	174.3	0	0	0	0	0	111.9	E259 K263	E259-G261 PolarHBondContact O-N 3.31Å; G261-K263 PolarHBondContact O-N 2.94Å
262	K	35.5	Very low	38.6	Very low	220 Å²	220	138.2 Å²	138.2	96%	0.957	69%	0.694	S	S	*	*			trans	-42	76.8	164.7	-59.3	166.2	-179.3	176.4	0	110.5	S264	K262-S264 PolarHBondContact O-N 3.47Å; K262-S264 VanDerWaalsContact O-N 3.16Å
263	K	34.8	Very low	39.1	Very low	177 Å²	177	138.7 Å²	138.7	77%	0.77	69%	0.691	S	S	*	*			trans	-73.9	104.8	165.7	-76.5	-175	178.3	-178.8	0	104.7	G261 L265	G261-K263 PolarHBondContact O-N 2.94Å; K263-L265 PolarHBondContact O-N 3.47Å
264	S	31.8	Very low	39.9	Very low	99 Å²	99	130 Å²	130	69%	0.692	65%	0.654	S	S	*	*			trans	-36.4	107.9	169.6	53.1	0	0	0	0	110.5	K262 Q266	K262-S264 PolarHBondContact O-N 3.47Å; K262-S264 VanDerWaalsContact O-N 3.16Å; S264-Q266 PolarHBondContact O-N 3.41Å
265	L	38	Very low	40.6	Very low	103 Å²	103	121.8 Å²	121.8	54%	0.539	62%	0.616	S	S	.	*			trans	-67.4	64.2	161.9	-97.3	147.7	0	0	0	108.3	K263 Q267	K263-L265 PolarHBondContact O-N 3.47Å; L265-Q267 HydrophobicContact CD2-CB 3.92Å
266	Q	35.2	Very low	41.5	Very low	181 Å²	181	118 Å²	118	85%	0.846	59%	0.589	S	S	*	*			trans	-92.6	55.6	143.8	-78.3	179.3	-7.7	0	0	106	S264 R268	S264-Q266 PolarHBondContact O-N 3.41Å; Q266-R268 VanDerWaalsContact C-N 3.27Å; Q266-R268 PolarHBondContact O-N 2.7Å; Q266-R268 VanDerWaalsContact O-N 3.12Å
267	Q	42	Very low	41.8	Very low	140 Å²	140	116.3 Å²	116.3	65%	0.654	58%	0.584	S	S	*	*			trans	-79.5	94	166.4	-150.3	164.7	3.9	0	0	103.6	L265 L269	L265-Q267 HydrophobicContact CD2-CB 3.92Å; Q267-L269 PolarHBondContact O-N 2.94Å
268	R	45.3	Very low	42.2	Very low	216 Å²	216	113.1 Å²	113.1	82%	0.815	56%	0.564	S	S	*	*			trans	-49.1	112.2	-178.5	-165.6	-173.7	-81.7	-165.2	-4.2	107.2	Q266	Q266-R268 VanDerWaalsContact C-N 3.27Å; Q266-R268 PolarHBondContact O-N 2.7Å; Q266-R268 VanDerWaalsContact O-N 3.12Å
269	L	49.8	Very low	42.6	Very low	38 Å²	38	113.6 Å²	113.6	20%	0.199	55%	0.554	C	S	.	*			trans	-53	141.5	174.3	-72.7	167.8	0	0	0	108.1	Y68 M87 Q267 I271	Y68-L269 HydrophobicContact CD1-CD2 4.03Å; Y68-L269 HydrophobicContact CD2-CD2 4.29Å; Y68-L269 HydrophobicContact CE1-CD2 3.72Å; Y68-L269 HydrophobicContact CE2-CD2 4Å; Y68-L269 HydrophobicContact CG-CD2 4.29Å; M87-L269 HydrophobicContact CG-CD1 3.92Å; M87-L269 HydrophobicContact SD-CD1 3.84Å; M87-L269 HydrophobicContact SD-CD2 3.94Å; Q267-L269 PolarHBondContact O-N 2.94Å; L269-I271 HydrophobicContact CB-CD1 4.4Å; L269-I271 HydrophobicContact CB-CG1 4.09Å; L269-I271 PolarHBondContact O-N 3Å
270	P	51.9	Low	43	Very low	48 Å²	48	112.8 Å²	112.8	31%	0.312	54%	0.543	S	S	.	.			trans	-76.1	50.1	-178	32.8	-34.4	0	0	0	111.1	L64 D272 E273 L274	L64-P270 HydrophobicContact CD2-CG 4.43Å; P270-D272 PolarHBondContact O-N 3.31Å; P270-E273 HydrophobicContact CB-CB 4.12Å; P270-E273 HydrophobicContact CB-CG 4.01Å; P270-E273 PolarHBondContact O-N 3.05Å; P270-L274 PolarHBondContact O-N 2.89Å
271	I	49.3	Very low	43.3	Very low	42 Å²	42	110.6 Å²	110.6	22%	0.215	53%	0.532	C	S	.	.	H	α-helix	trans	-54.6	-36.2	172.7	-64.5	170.5	0	0	0	109.3	Y91 L269 E273 L274 I275	Y91-I271 HydrophobicContact CD2-CG2 4.11Å; Y91-I271 HydrophobicContact CE2-CG2 4.35Å; L269-I271 HydrophobicContact CB-CD1 4.4Å; L269-I271 HydrophobicContact CB-CG1 4.09Å; L269-I271 PolarHBondContact O-N 3Å; I271-E273 VanDerWaalsContact C-N 3.27Å; I271-E273 PolarHBondContact O-N 3.3Å; I271-L274 PolarHBondContact O-N 2.8Å; I271-I275 HydrophobicContact CG2-CD1 4.19Å; I271-I275 PolarHBondContact O-N 2.91Å
272	D	46.6	Very low	43.9	Very low	111 Å²	111	109.4 Å²	109.4	59%	0.594	52%	0.516	S	S	*	.	H	α-helix	trans	-66.3	-23.3	177.7	-62.3	-26.2	0	0	0	113.6	P270	P270-D272 PolarHBondContact O-N 3.31Å
273	E	51	Low	44.3	Very low	170 Å²	170	103.9 Å²	103.9	79%	0.794	49%	0.493	S	S	*	.	H	α-helix	trans	-88.8	-20.6	176.7	-62.3	-176	169.1	0	0	112.6	P270 I271	P270-E273 HydrophobicContact CB-CB 4.12Å; P270-E273 HydrophobicContact CB-CG 4.01Å; P270-E273 PolarHBondContact O-N 3.05Å; I271-E273 VanDerWaalsContact C-N 3.27Å; I271-E273 PolarHBondContact O-N 3.3Å
274	L	53.2	Low	44.4	Very low	20 Å²	20	101 Å²	101	11%	0.105	49%	0.49	C	S	.	.	H	α-helix	trans	-84	-26.6	-176.2	-81.3	161.5	0	0	0	113.4	Q60 T61 L64 Y65 Y91 P270 I271 P276	Q60-L274 PolarHBondContact NE2-O 3.44Å; T61-L274 HydrophobicContact CG2-CD1 4.1Å; T61-L274 HydrophobicContact CG2-CD2 3.92Å; L64-L274 HydrophobicContact CD2-CD1 3.82Å; L64-L274 HydrophobicContact CD2-CD2 3.94Å; L64-L274 HydrophobicContact CD2-CG 4.06Å; Y65-L274 HydrophobicContact CE1-CD1 3.82Å; Y91-L274 HydrophobicContact CE2-CB 3.95Å; Y91-L274 PolarHBondContact OH-O 3.5Å; Y91-L274 VanDerWaalsContact OH-O 3.14Å; P270-L274 PolarHBondContact O-N 2.89Å; I271-L274 PolarHBondContact O-N 2.8Å; L274-P276 VanDerWaalsContact O-CD 3.28Å; L274-P276 WeakPolarHBondContact O-CD 3.39Å
275	I	51.7	Low	45	Very low	18 Å²	18	104.4 Å²	104.4	9%	0.092	50%	0.495	C	S	.	.	S	Bend	trans	-89.4	111.3	178	-58.3	174.2	0	0	0	107.4	Y91 H94 V99 I271 I277	Y91-I275 HydrophobicContact CE2-CD1 4.09Å; Y91-I275 HydrophobicContact CE2-CG1 3.61Å; H94-I275 VanDerWaalsContact CE1-CD1 3.41Å; H94-I275 WeakPolarHBondContact CE1-CD1 3.2Å; H94-I275 WeakPolarHBondContact ND1-CD1 3.24Å; V99-I275 HydrophobicContact CG1-CG2 4.28Å; V99-I275 HydrophobicContact CG2-CD1 3.98Å; V99-I275 HydrophobicContact CG2-CG1 4.45Å; V99-I275 HydrophobicContact CG2-CG2 3.47Å; V99-I275 VanDerWaalsContact CG2-CG2 3.47Å; I271-I275 HydrophobicContact CG2-CD1 4.19Å; I271-I275 PolarHBondContact O-N 2.91Å; I275-I277 VanDerWaalsContact C-N 3.28Å; I275-I277 PolarHBondContact O-N 2.94Å
276	P	50.7	Low	45.6	Very low	37 Å²	37	100.2 Å²	100.2	24%	0.24	47%	0.474	C	S	.	.			trans	-61.6	102.8	161.1	-9.1	25.9	0	0	0	105.5	L274 Y278	L274-P276 VanDerWaalsContact O-CD 3.28Å; L274-P276 WeakPolarHBondContact O-CD 3.39Å; P276-Y278 VanDerWaalsContact C-N 3.33Å; P276-Y278 PolarHBondContact O-N 2.87Å
277	I	46.5	Very low	45.8	Very low	132 Å²	132	95.4 Å²	95.4	68%	0.677	45%	0.449	S	S	*	.			trans	-62.5	105.8	168.9	-60.8	173.9	0	0	0	103.8	I275 R279	I275-I277 VanDerWaalsContact C-N 3.28Å; I275-I277 PolarHBondContact O-N 2.94Å; I277-R279 PolarHBondContact O-N 2.99Å
278	Y	44.3	Very low	45.3	Very low	47 Å²	47	93.9 Å²	93.9	18%	0.184	45%	0.452	C	S	.	.			trans	-50.6	95.9	169.6	-74	-83.1	0	0	0	107.2	V99 Q103 L141 P276 R280 E308	V99-Y278 HydrophobicContact CG1-CD2 4.21Å; V99-Y278 HydrophobicContact CG1-CE2 4.18Å; Q103-Y278 PolarHBondContact NE2-OH 3.01Å; L141-Y278 HydrophobicContact CD2-CD1 4.43Å; L141-Y278 HydrophobicContact CD2-CE1 3.58Å; L141-Y278 HydrophobicContact CG-CE1 4.49Å; P276-Y278 VanDerWaalsContact C-N 3.33Å; P276-Y278 PolarHBondContact O-N 2.87Å; Y278-R280 PolarHBondContact O-N 3.2Å; Y278-E308 VanDerWaalsContact CD1-O 3.29Å; Y278-E308 WeakPolarHBondContact CD1-O 3.28Å; Y278-E308 VanDerWaalsContact CE1-O 3.26Å; Y278-E308 WeakPolarHBondContact CE1-O 3.26Å
279	R	42.3	Very low	44.9	Very low	179 Å²	179	89 Å²	89	68%	0.675	44%	0.439	S	S	*	.			trans	-74.8	117.6	-170.1	-160.7	179	-166.9	158.7	2.7	106	I277 D281	I277-R279 PolarHBondContact O-N 2.99Å; R279-D281 PolarHBondContact O-N 3.08Å
280	R	40.6	Very low	44.3	Very low	173 Å²	173	92 Å²	92	65%	0.653	46%	0.463	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.5	-4.5	-177.6	-108.2	180	176.7	113.4	0.7	115.7	Y278	Y278-R280 PolarHBondContact O-N 3.2Å
281	D	40	Very low	43.3	Very low	124 Å²	124	98 Å²	98	66%	0.663	49%	0.486	S	S	*	.	T	Hydrogen-bonded Turn	trans	-117.1	15.1	-164	-54.9	-34.6	0	0	0	114.2	R279 H283	R279-D281 PolarHBondContact O-N 3.08Å; D281-H283 PolarHBondContact O-N 2.61Å
282	C	42.5	Very low	42.7	Very low	23 Å²	23	100.9 Å²	100.9	16%	0.155	50%	0.502	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62.8	-8.6	-176.7	-177.6	0	0	0	0	115.2	Y205 T284	Y205-C282 WeakPolarHBondContact CE1-SG 3.48Å; C282-T284 PolarHBondContact O-N 3.39Å
283	H	42.1	Very low	42.7	Very low	104 Å²	104	103.8 Å²	103.8	48%	0.481	52%	0.517	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.1	-10.6	-172.4	-68.3	-66.5	0	0	0	116.4	D281	D281-H283 PolarHBondContact O-N 2.61Å
284	T	38.7	Very low	42.2	Very low	115 Å²	115	104.3 Å²	104.3	71%	0.706	52%	0.519	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.8	-31.1	-170.1	-48.5	0	0	0	0	114.3	C282	C282-T284 PolarHBondContact O-N 3.39Å
285	E	44.4	Very low	41.5	Very low	171 Å²	171	108.4 Å²	108.4	80%	0.799	54%	0.541	S	S	*	.	T	Hydrogen-bonded Turn	trans	-110.1	-2.5	-166.2	-67	-176.4	178.9	0	0	115.2	Y287	E285-Y287 VanDerWaalsContact C-N 3.29Å; E285-Y287 PolarHBondContact O-N 2.87Å
286	V	48.6	Very low	40.4	Very low	16 Å²	16	110.4 Å²	110.4	10%	0.097	57%	0.566	C	S	.	*	S	Bend	trans	-73	-22.3	-173.7	-175.8	0	0	0	0	113.1	Y205 I306 K337	Y205-V286 HydrophobicContact CD1-CG2 4.25Å; Y205-V286 HydrophobicContact CE1-CG2 4.28Å; V286-I306 HydrophobicContact CB-CD1 4.16Å; V286-I306 HydrophobicContact CG1-CD1 3.87Å; V286-I306 HydrophobicContact CG2-CG2 4.48Å; V286-K337 PolarHBondContact O-NZ 3.48Å
287	Y	39.7	Very low	39.8	Very low	80 Å²	80	118.9 Å²	118.9	31%	0.314	60%	0.599	S	S	.	*			trans	-130.5	98.1	175.2	-57.7	-111.9	0	0	0	110.9	E207 E285 E289 I306	E207-Y287 VanDerWaalsContact CD-OH 3.22Å; E207-Y287 PolarHBondContact OE1-OH 2.87Å; E207-Y287 PolarHBondContact OE2-OH 2.86Å; E285-Y287 VanDerWaalsContact C-N 3.29Å; E285-Y287 PolarHBondContact O-N 2.87Å; Y287-E289 VanDerWaalsContact C-N 3.28Å; Y287-I306 HydrophobicContact CE2-CD1 3.7Å
288	C	32.3	Very low	39.3	Very low	107 Å²	107	122 Å²	122	72%	0.723	61%	0.607	S	S	*	*			trans	-94.9	69.9	152.5	-124.1	0	0	0	0	106.8
289	E	37.1	Very low	39	Very low	115 Å²	115	123.4 Å²	123.4	54%	0.537	62%	0.624	S	S	.	*			trans	-116	114.1	162	-84.6	-178.7	169.6	0	0	106.8	Y287	Y287-E289 VanDerWaalsContact C-N 3.28Å
290	S	36.8	Very low	38.7	Very low	101 Å²	101	122.2 Å²	122.2	71%	0.706	63%	0.63	S	S	*	*			trans	68.3	96.8	173.4	68.7	0	0	0	0	117.7	D292	S290-D292 PolarHBondContact O-N 2.83Å
291	H	31.3	Very low	38.8	Very low	172 Å²	172	122.1 Å²	122.1	80%	0.796	64%	0.637	S	S	*	*			trans	-63.9	83.2	143.7	-78.5	81.7	0	0	0	108.1
292	D	37.2	Very low	39.5	Very low	104 Å²	104	120.8 Å²	120.8	56%	0.556	63%	0.627	S	S	*	*			trans	-121.9	90.3	166.8	-133	-7.2	0	0	0	108.2	S290 E294 L295	S290-D292 PolarHBondContact O-N 2.83Å; D292-E294 PolarHBondContact O-N 2.99Å; D292-L295 HydrophobicContact CB-CD1 4.27Å
293	L	45.4	Very low	41	Very low	172 Å²	172	126 Å²	126	90%	0.901	64%	0.644	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69.2	6.6	-179.3	-82.2	160	0	0	0	113.3
294	E	40.5	Very low	43	Very low	181 Å²	181	123 Å²	123	85%	0.846	63%	0.631	S	S	*	*	T	Hydrogen-bonded Turn	trans	-120.5	9.6	-174	-69.4	-124.9	149.9	0	0	115.7	D292 G296	D292-E294 PolarHBondContact O-N 2.99Å; E294-G296 PolarHBondContact O-N 2.71Å
295	L	39.6	Very low	45.3	Very low	106 Å²	106	117.5 Å²	117.5	56%	0.555	60%	0.597	S	S	*	*			trans	-82.4	84.6	173.3	-81.1	159.3	0	0	0	111.9	D292 K297 S299	D292-L295 HydrophobicContact CB-CD1 4.27Å; L295-K297 PolarHBondContact O-N 2.88Å; L295-S299 PolarHBondContact O-OG 3.37Å
296	G	29.1	Very low	47.3	Very low	60 Å²	60	110 Å²	110	62%	0.619	56%	0.563	S	S	*	*	T	Hydrogen-bonded Turn	trans	-53.8	122.3	178	0	0	0	0	0	114.2	E294 K298	E294-G296 PolarHBondContact O-N 2.71Å; G296-K298 PolarHBondContact O-N 2.82Å
297	K	37	Very low	49.1	Very low	215 Å²	215	109.4 Å²	109.4	94%	0.935	56%	0.559	S	S	*	*	T	Hydrogen-bonded Turn	trans	49.7	1.2	157	-66.5	-176	178.7	-179.9	0	119.3	L295	L295-K297 PolarHBondContact O-N 2.88Å
298	K	36.3	Very low	51.4	Low	196 Å²	196	107.2 Å²	107.2	85%	0.852	55%	0.551	S	S	*	*	T	Hydrogen-bonded Turn	trans	-115.9	-6.9	177.9	-71.8	-171.7	175.8	-175.8	0	113.9	G296	G296-K298 PolarHBondContact O-N 2.82Å
299	S	36.5	Very low	54.1	Low	77 Å²	77	102.2 Å²	102.2	54%	0.538	52%	0.517	S	S	.	.			trans	-92.6	10	177	63.8	0	0	0	0	114.6	L295 Q301	L295-S299 PolarHBondContact O-OG 3.37Å; S299-Q301 PolarHBondContact O-N 3.43Å
300	L	36.9	Very low	56.6	Low	154 Å²	154	97.2 Å²	97.2	81%	0.806	49%	0.494	S	S	*	.			trans	-71.4	56.2	152.5	-92	159.7	0	0	0	108.7	Q302	L300-Q302 PolarHBondContact O-N 2.91Å
301	Q	43.5	Very low	59.1	Low	171 Å²	171	93.6 Å²	93.6	80%	0.799	47%	0.469	S	S	*	.			trans	-61.7	101.3	145.1	-94.1	177.6	-11	0	0	103.6	S299 R303	S299-Q301 PolarHBondContact O-N 3.43Å; Q301-R303 VanDerWaalsContact C-N 3.35Å; Q301-R303 PolarHBondContact O-N 2.96Å
302	Q	54.4	Low	61.9	Low	97 Å²	97	88 Å²	88	45%	0.453	44%	0.444	S	S	.	.			trans	-56.5	102.8	-178.3	-154.9	168.4	11.4	0	0	105.9	V117 L300 L304	V117-Q302 HydrophobicContact CG1-CB 4.38Å; V117-Q302 HydrophobicContact CG2-CB 3.97Å; V117-Q302 HydrophobicContact CG2-CG 3.89Å; L300-Q302 PolarHBondContact O-N 2.91Å; Q302-L304 PolarHBondContact O-N 2.93Å
303	R	73.3	Confident	64.5	Low	133 Å²	133	90 Å²	90	50%	0.502	45%	0.445	S	S	.	.	P	Polyproline II helix	trans	-54.5	133.4	-168.2	-70.9	169.2	83.5	162.3	-2.1	109	Q301	Q301-R303 VanDerWaalsContact C-N 3.35Å; Q301-R303 PolarHBondContact O-N 2.96Å
304	L	84.7	Confident	66.8	Low	39 Å²	39	89.2 Å²	89.2	20%	0.204	43%	0.43	C	S	.	.	P	Polyproline II helix	trans	-60.1	143	178.3	-68.9	176.3	0	0	0	110.1	L114 V117 E207 W208 D209 Q302	L114-L304 HydrophobicContact CD2-CD2 4Å; V117-L304 HydrophobicContact CG1-CD2 4.43Å; E207-L304 HydrophobicContact CG-CB 3.88Å; E207-L304 HydrophobicContact CG-CD1 4.27Å; W208-L304 WeakPolarHBondContact O-CB 3.41Å; D209-L304 HydrophobicContact CB-CD1 3.85Å; Q302-L304 PolarHBondContact O-N 2.93Å
305	P	86.8	Confident	69.4	Low	1 Å²	1	83.2 Å²	83.2	1%	0.006	40%	0.399	C	S	.	.	P	Polyproline II helix	trans	-62.4	141.9	176.6	-22.1	35.2	0	0	0	111.6	Q110 Q113 L114 W208	Q110-P305 HydrophobicContact CB-CB 3.72Å; Q110-P305 HydrophobicContact CB-CG 4.35Å; Q110-P305 HydrophobicContact CG-CB 3.78Å; Q113-P305 HydrophobicContact CB-CG 3.66Å; L114-P305 HydrophobicContact CD2-CG 4.13Å; L114-P305 HydrophobicContact CG-CG 4.01Å; W208-P305 HydrophobicContact CB-CB 4.41Å; W208-P305 PolarHBondContact N-O 3.47Å
306	I	86.8	Confident	72.1	Confident	14 Å²	14	82.2 Å²	82.2	7%	0.072	40%	0.395	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	135.8	-177.6	-68.3	161.4	0	0	0	110.2	Q110 Y205 F206 E207 V286 Y287	Q110-I306 PolarHBondContact NE2-O 2.83Å; Y205-I306 HydrophobicContact CD1-CG2 4.13Å; Y205-I306 HydrophobicContact CG-CG2 4.44Å; F206-I306 CarbonylContact O-C 3.6Å; F206-I306 VanDerWaalsContact O-CA 3.3Å; F206-I306 WeakPolarHBondContact O-CA 3.4Å; E207-I306 HydrophobicContact CB-CG1 3.93Å; E207-I306 HydrophobicContact CG-CD1 4.36Å; E207-I306 HydrophobicContact CG-CG1 3.85Å; V286-I306 HydrophobicContact CB-CD1 4.16Å; V286-I306 HydrophobicContact CG1-CD1 3.87Å; V286-I306 HydrophobicContact CG2-CG2 4.48Å; Y287-I306 HydrophobicContact CE2-CD1 3.7Å
307	D	86.6	Confident	75.3	Confident	2 Å²	2	79.4 Å²	79.4	1%	0.011	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.4	137.1	166.1	-76.9	-46.8	0	0	0	111.2	H106 Q110 L141 Y205 F206 W208 L309	H106-D307 IonicContact CE1-OD1 3.02Å; H106-D307 PolarHBondContact CE1-OD1 3.24Å; H106-D307 IonicContact ND1-OD1 3.91Å; H106-D307 PolarHBondContact ND1-OD1 3.23Å; Q110-D307 PolarHBondContact NE2-OD1 3.41Å; Q110-D307 PolarHBondContact NE2-OD2 3.45Å; Q110-D307 PolarHBondContact OE1-OD1 3.42Å; Q110-D307 PolarHBondContact OE1-OD2 2.94Å; L141-D307 HydrophobicContact CD2-CB 4.34Å; Y205-D307 CarbonylContact C-O 3.52Å; Y205-D307 WeakPolarHBondContact CA-O 3.4Å; Y205-D307 WeakPolarHBondContact CB-O 3.42Å; F206-D307 HydrophobicContact CB-CB 4.4Å; F206-D307 PolarHBondContact N-O 3.21Å; F206-D307 PolarHBondContact O-N 2.96Å; W208-D307 PolarHBondContact NE1-OD2 2.92Å; D307-L309 HydrophobicContact CB-CD2 4.06Å
308	E	86.5	Confident	78.1	Confident	34 Å²	34	71.9 Å²	71.9	16%	0.159	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.6	111.3	164.3	-178.2	173.6	86	0	0	109	Y205 Y278	Y205-E308 HydrophobicContact CD1-CB 3.83Å; Y205-E308 HydrophobicContact CD1-CG 4.06Å; Y205-E308 HydrophobicContact CE1-CB 3.71Å; Y205-E308 HydrophobicContact CE1-CG 3.57Å; Y205-E308 WeakPolarHBondContact CE1-OE2 3.48Å; Y205-E308 PolarHBondContact OH-OE2 3.49Å; Y205-E308 VanDerWaalsContact OH-OE2 3.1Å; Y278-E308 VanDerWaalsContact CD1-O 3.29Å; Y278-E308 WeakPolarHBondContact CD1-O 3.28Å; Y278-E308 VanDerWaalsContact CE1-O 3.26Å; Y278-E308 WeakPolarHBondContact CE1-O 3.26Å
309	L	88.8	Confident	81	Confident	2 Å²	2	66 Å²	66	1%	0.01	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.2	-41.9	179.1	-54.5	-173.8	0	0	0	111.4	L141 L204 F206 D307 H326 Y334	L141-L309 HydrophobicContact CD1-CD2 3.65Å; L141-L309 HydrophobicContact CD2-CD2 4.08Å; L141-L309 HydrophobicContact CG-CD2 4.27Å; L204-L309 HydrophobicContact CB-CB 4.35Å; L204-L309 HydrophobicContact CD2-CB 4.31Å; L204-L309 HydrophobicContact CD2-CD1 3.99Å; L204-L309 HydrophobicContact CG-CB 4.21Å; L204-L309 HydrophobicContact CG-CD1 4.05Å; L204-L309 WeakPolarHBondContact O-CA 2.96Å; L204-L309 WeakPolarHBondContact O-CB 3.48Å; L204-L309 PolarHBondContact O-N 3.48Å; F206-L309 HydrophobicContact CB-CD1 3.91Å; F206-L309 HydrophobicContact CB-CD2 4.2Å; F206-L309 HydrophobicContact CB-CG 4.11Å; D307-L309 HydrophobicContact CB-CD2 4.06Å; L309-H326 VanDerWaalsContact CD1-CE1 3.41Å; L309-H326 WeakPolarHBondContact CD1-CE1 3.23Å; L309-Y334 HydrophobicContact CD1-CD1 3.97Å; L309-Y334 HydrophobicContact CD1-CE1 3.53Å
310	I	90.4	Very high	83.9	Confident	11 Å²	11	64.7 Å²	64.7	6%	0.056	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.9	114	176.8	-57	174.2	0	0	0	107.3	A144 V146 W191 F202 G203 L204	A144-I310 HydrophobicContact CB-CD1 3.76Å; A144-I310 HydrophobicContact CB-CG1 3.76Å; V146-I310 HydrophobicContact CG2-CD1 3.77Å; W191-I310 HydrophobicContact CH2-CD1 4.06Å; W191-I310 HydrophobicContact CZ2-CD1 3.57Å; F202-I310 HydrophobicContact CE1-CD1 4.02Å; G203-I310 CarbonylContact C-O 3.54Å; G203-I310 WeakPolarHBondContact CA-O 3.13Å; L204-I310 HydrophobicContact CB-CB 3.88Å; L204-I310 HydrophobicContact CB-CD1 3.98Å; L204-I310 HydrophobicContact CB-CG1 4Å; L204-I310 HydrophobicContact CD2-CD1 4.12Å; L204-I310 PolarHBondContact N-O 2.93Å; L204-I310 PolarHBondContact O-N 3.43Å
311	P	89.3	Confident	86.7	Confident	25 Å²	25	57.4 Å²	57.4	16%	0.162	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-60.9	149.4	173.6	25.1	-35	0	0	0	111.1	Y313	P311-Y313 HydrophobicContact CB-CD2 4.34Å; P311-Y313 HydrophobicContact CB-CE2 3.96Å; P311-Y313 HydrophobicContact CG-CD2 3.92Å; P311-Y313 HydrophobicContact CG-CE2 3.46Å; P311-Y313 VanDerWaalsContact CG-CE2 3.46Å; P311-Y313 PolarHBondContact O-N 3.04Å; P311-Y313 VanDerWaalsContact O-N 3.14Å
312	I	90.7	Very high	89.3	Confident	55 Å²	55	51 Å²	51	28%	0.282	23%	0.23	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-66.4	115.1	177.7	-64.2	173.2	0	0	0	109.7	F202 Y205 K337 D339	F202-I312 WeakPolarHBondContact O-CA 3.07Å; Y205-I312 HydrophobicContact CE2-CD1 4.43Å; Y205-I312 HydrophobicContact CE2-CG1 4.38Å; I312-K337 HydrophobicContact CD1-CB 4.12Å; I312-K337 HydrophobicContact CD1-CD 4.12Å; I312-D339 HydrophobicContact CG2-CB 4.08Å
313	Y	90.8	Very high	91.3	Very high	145 Å²	145	46.4 Å²	46.4	57%	0.569	21%	0.208	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-131.9	150.4	169	-72.2	-62.8	0	0	0	110.6	F202 P311 R315	F202-Y313 PolarHBondContact N-O 3.4Å; F202-Y313 PolarHBondContact O-N 3.15Å; P311-Y313 HydrophobicContact CB-CD2 4.34Å; P311-Y313 HydrophobicContact CB-CE2 3.96Å; P311-Y313 HydrophobicContact CG-CD2 3.92Å; P311-Y313 HydrophobicContact CG-CE2 3.46Å; P311-Y313 VanDerWaalsContact CG-CE2 3.46Å; P311-Y313 PolarHBondContact O-N 3.04Å; P311-Y313 VanDerWaalsContact O-N 3.14Å; Y313-R315 PolarHBondContact O-N 3.36Å
314	R	95.2	Very high	92.3	Very high	156 Å²	156	40.1 Å²	40.1	59%	0.589	19%	0.185	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-65.5	128.3	174.1	-66.6	176.7	67	-175.2	-2	109.6	D199 F342	D199-R314 IonicContact OD1-NH2 2.81Å; D199-R314 PolarHBondContact OD1-NH2 2.88Å; D199-R314 IonicContact OD2-CZ 3.53Å; D199-R314 IonicContact OD2-NE 2.67Å; D199-R314 PolarHBondContact OD2-NE 3.4Å; D199-R314 IonicContact OD2-NH2 3.7Å; D199-R314 PolarHBondContact OD2-NH2 2.88Å; R314-F342 HydrophobicContact CG-CD1 4.48Å; R314-F342 HydrophobicContact CG-CE1 3.98Å; R314-F342 HydrophobicContact CG-CZ 4.05Å
315	R	94.3	Very high	92.7	Very high	55 Å²	55	39.7 Å²	39.7	21%	0.208	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118	132.6	-179.3	-53.9	-54.7	-179.8	171.6	1.5	109.4	F193 D199 L200 F202 Y313 C317 Y322	F193-R315 HydrophobicContact CE2-CB 4.45Å; F193-R315 HydrophobicContact CZ-CG 4.3Å; D199-R315 CarbonylContact C-O 3.52Å; D199-R315 WeakPolarHBondContact CA-O 3.19Å; D199-R315 WeakPolarHBondContact CB-O 3.41Å; L200-R315 PolarHBondContact N-O 3.38Å; L200-R315 PolarHBondContact O-N 2.94Å; F202-R315 HydrophobicContact CB-CG 3.86Å; Y313-R315 PolarHBondContact O-N 3.36Å; R315-C317 HydrophobicContact CB-CB 4.44Å; R315-C317 PolarHBondContact O-N 3.37Å; R315-C317 PolarHBondContact O-SG 3.38Å; R315-Y322 HydrophobicContact CB-CD1 4.14Å; R315-Y322 HydrophobicContact CB-CD2 4.32Å; R315-Y322 HydrophobicContact CB-CE1 3.82Å; R315-Y322 HydrophobicContact CB-CE2 3.99Å; R315-Y322 HydrophobicContact CB-CG 4.37Å; R315-Y322 HydrophobicContact CG-CD1 4.19Å; R315-Y322 HydrophobicContact CG-CE1 4.01Å
316	D	95.5	Very high	93	Very high	85 Å²	85	39.7 Å²	39.7	46%	0.455	18%	0.184	S	C	.	.			trans	-75.8	47.6	176.2	-69.2	-43.9	0	0	0	111.8	H318 T319 Y322	D316-H318 PolarHBondContact O-N 3.45Å; D316-H318 IonicContact OD1-CE1 3.57Å; D316-T319 HydrophobicContact CB-CG2 4.26Å; D316-T319 WeakPolarHBondContact O-CB 3.35Å; D316-T319 PolarHBondContact O-N 3.04Å; D316-T319 PolarHBondContact O-OG1 3.46Å; D316-Y322 PolarHBondContact N-OH 3.39Å
317	C	95.9	Very high	93.2	Very high	0 Å²	0	41.7 Å²	41.7	0%	0	19%	0.193	C	C	.	.	T	Hydrogen-bonded Turn	trans	-71	3.9	-174.9	59.3	0	0	0	0	114.2	F193 A194 T195 R315 E320 Y322	F193-C317 HydrophobicContact CD2-CB 3.86Å; F193-C317 HydrophobicContact CE2-CB 3.64Å; A194-C317 CarbonylContact C-O 3.53Å; A194-C317 VanDerWaalsContact CA-O 3.23Å; A194-C317 WeakPolarHBondContact CA-O 3.48Å; A194-C317 WeakPolarHBondContact CB-O 3.23Å; T195-C317 VanDerWaalsContact CG2-SG 3.59Å; T195-C317 PolarHBondContact N-O 3.16Å; T195-C317 PolarHBondContact OG1-SG 2.89Å; T195-C317 VanDerWaalsContact OG1-SG 3.39Å; R315-C317 HydrophobicContact CB-CB 4.44Å; R315-C317 PolarHBondContact O-N 3.37Å; R315-C317 PolarHBondContact O-SG 3.38Å; C317-E320 CarbonylContact C-O 2.94Å; C317-E320 WeakPolarHBondContact CA-O 3.47Å; C317-Y322 HydrophobicContact CB-CD2 3.53Å; C317-Y322 HydrophobicContact CB-CE2 4.01Å; C317-Y322 HydrophobicContact CB-CG 4.33Å
318	H	97	Very high	93.4	Very high	57 Å²	57	42.5 Å²	42.5	26%	0.264	20%	0.196	S	C	.	.	T	Hydrogen-bonded Turn	trans	-85.2	-14.6	165.2	64.1	-76.2	0	0	0	112.9	I152 T195 D199 D316	I152-H318 VanDerWaalsContact CD1-O 3.26Å; I152-H318 WeakPolarHBondContact CD1-O 3.48Å; T195-H318 WeakPolarHBondContact O-CA 3.47Å; T195-H318 WeakPolarHBondContact OG1-CA 3.15Å; T195-H318 WeakPolarHBondContact OG1-CB 3.48Å; T195-H318 PolarHBondContact OG1-N 2.93Å; D199-H318 PolarHBondContact N-ND1 2.75Å; D316-H318 PolarHBondContact O-N 3.45Å; D316-H318 IonicContact OD1-CE1 3.57Å
319	T	97.1	Very high	93.4	Very high	73 Å²	73	41 Å²	41	45%	0.448	19%	0.189	S	C	.	.	T	Hydrogen-bonded Turn	trans	-99.3	-38.2	-179	68.5	0	0	0	0	112.4	D316	D316-T319 HydrophobicContact CB-CG2 4.26Å; D316-T319 WeakPolarHBondContact O-CB 3.35Å; D316-T319 PolarHBondContact O-N 3.04Å; D316-T319 PolarHBondContact O-OG1 3.46Å
320	E	96.5	Very high	93.3	Very high	50 Å²	50	41.4 Å²	41.4	23%	0.234	19%	0.194	C	C	.	.	S	Bend	trans	-141	156.1	-179.1	-62.6	-171.7	142.1	0	0	110.1	T148 K150 C317 Y322	T148-E320 WeakPolarHBondContact CB-OE2 3.36Å; T148-E320 HydrophobicContact CG2-CB 4.48Å; T148-E320 PolarHBondContact OG1-OE2 3.23Å; K150-E320 WeakPolarHBondContact CE-OE1 3.28Å; K150-E320 WeakPolarHBondContact CG-OE1 3.13Å; C317-E320 CarbonylContact C-O 2.94Å; C317-E320 WeakPolarHBondContact CA-O 3.47Å; E320-Y322 PolarHBondContact O-N 3.34Å
321	V	97.5	Very high	93.3	Very high	0 Å²	0	43.5 Å²	43.5	0%	0	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.5	119.9	171.9	-172.9	0	0	0	0	108.1	T148 R149 I152 F155 E192	T148-V321 CarbonylContact C-O 3.58Å; T148-V321 WeakPolarHBondContact CA-O 3.22Å; R149-V321 HydrophobicContact CB-CB 4.3Å; R149-V321 PolarHBondContact N-O 3.42Å; R149-V321 PolarHBondContact O-N 2.93Å; I152-V321 HydrophobicContact CB-CG2 4.09Å; I152-V321 HydrophobicContact CG1-CG2 4.32Å; F155-V321 HydrophobicContact CB-CG2 3.7Å; F155-V321 HydrophobicContact CD1-CG1 3.9Å; F155-V321 HydrophobicContact CD1-CG2 3.84Å; F155-V321 HydrophobicContact CD2-CG1 4.26Å; F155-V321 HydrophobicContact CE1-CG1 4.06Å; F155-V321 HydrophobicContact CE2-CG1 4.4Å; F155-V321 HydrophobicContact CG-CG1 4Å; F155-V321 HydrophobicContact CG-CG2 3.86Å; F155-V321 HydrophobicContact CZ-CG1 4.3Å; E192-V321 HydrophobicContact CB-CG1 4.18Å
322	Y	97.2	Very high	93.4	Very high	36 Å²	36	42.3 Å²	42.3	14%	0.141	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.3	131.2	172.3	-84.8	-106.5	0	0	0	109.3	T148 E192 F193 R315 D316 C317 E320	T148-Y322 HydrophobicContact CG2-CD1 4.11Å; T148-Y322 HydrophobicContact CG2-CD2 4.18Å; T148-Y322 HydrophobicContact CG2-CE1 3.98Å; T148-Y322 HydrophobicContact CG2-CE2 4.08Å; T148-Y322 HydrophobicContact CG2-CG 4.21Å; E192-Y322 CarbonylContact C-O 3.52Å; E192-Y322 VanDerWaalsContact CA-O 3.24Å; E192-Y322 WeakPolarHBondContact CA-O 3.37Å; F193-Y322 VanDerWaalsContact CE1-CB 3.48Å; F193-Y322 HydrophobicContact CE1-CG 4.44Å; F193-Y322 HydrophobicContact CE2-CG 4.26Å; F193-Y322 HydrophobicContact CZ-CD1 4.33Å; F193-Y322 AromaticContact CZ-CG 3.93Å; F193-Y322 HydrophobicContact CZ-CG 3.93Å; F193-Y322 PolarHBondContact N-O 3.5Å; F193-Y322 PolarHBondContact O-N 3.2Å; R315-Y322 HydrophobicContact CB-CD1 4.14Å; R315-Y322 HydrophobicContact CB-CD2 4.32Å; R315-Y322 HydrophobicContact CB-CE1 3.82Å; R315-Y322 HydrophobicContact CB-CE2 3.99Å; R315-Y322 HydrophobicContact CB-CG 4.37Å; R315-Y322 HydrophobicContact CG-CD1 4.19Å; R315-Y322 HydrophobicContact CG-CE1 4.01Å; D316-Y322 PolarHBondContact N-OH 3.39Å; C317-Y322 HydrophobicContact CB-CD2 3.53Å; C317-Y322 HydrophobicContact CB-CE2 4.01Å; C317-Y322 HydrophobicContact CB-CG 4.33Å; E320-Y322 PolarHBondContact O-N 3.34Å
323	C	96.3	Very high	93.6	Very high	1 Å²	1	39.7 Å²	39.7	1%	0.007	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	156.4	-177.4	-55.1	0	0	0	0	109.6	V146 W147 R149 W191 E192	V146-C323 WeakPolarHBondContact CA-O 3.41Å; W147-C323 HydrophobicContact CD2-CB 4.01Å; W147-C323 VanDerWaalsContact CE2-CB 3.46Å; W147-C323 HydrophobicContact CG-CB 4.15Å; W147-C323 HydrophobicContact CZ2-CB 3.9Å; W147-C323 PolarHBondContact N-O 3.44Å; W147-C323 PolarHBondContact O-N 2.96Å; W147-C323 VanDerWaalsContact O-O 3.08Å; R149-C323 PolarHBondContact NE-SG 2.95Å; R149-C323 VanDerWaalsContact NE-SG 3.36Å; W191-C323 CarbonylContact O-C 3.57Å; W191-C323 VanDerWaalsContact O-CA 3.24Å; W191-C323 WeakPolarHBondContact O-CA 3.14Å; E192-C323 HydrophobicContact CG-CB 4.37Å
324	G	94.4	Very high	93.9	Very high	1 Å²	1	32.8 Å²	32.8	1%	0.01	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-167.7	172.5	168.2	0	0	0	0	0	114.3	T145 C190 W191	T145-G324 CarbonylContact O-C 3.53Å; T145-G324 WeakPolarHBondContact O-CA 3.47Å; C190-G324 VanDerWaalsContact CA-O 3.32Å; C190-G324 WeakPolarHBondContact CA-O 3.36Å; W191-G324 VanDerWaalsContact CE2-CA 3.43Å; W191-G324 VanDerWaalsContact CZ2-CA 3.47Å; W191-G324 PolarHBondContact N-O 2.75Å; W191-G324 PolarHBondContact O-N 2.89Å
325	T	93.9	Very high	94	Very high	30 Å²	30	25.4 Å²	25.4	18%	0.184	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.7	152.6	173.9	-172.1	0	0	0	0	111.5	T145 W147 I189 C190 W191	T145-T325 PolarHBondContact N-O 3.18Å; T145-T325 PolarHBondContact O-N 3.28Å; W147-T325 HydrophobicContact CH2-CG2 3.95Å; W147-T325 HydrophobicContact CZ3-CG2 3.93Å; I189-T325 CarbonylContact O-C 3.44Å; I189-T325 WeakPolarHBondContact O-CA 3.39Å; I189-T325 WeakPolarHBondContact O-CB 3.24Å; I189-T325 PolarHBondContact O-OG1 3.22Å; C190-T325 PolarHBondContact SG-OG1 3.38Å; C190-T325 VanDerWaalsContact SG-OG1 3.37Å; W191-T325 VanDerWaalsContact CZ3-C 3.43Å; W191-T325 VanDerWaalsContact CZ3-CA 3.48Å
326	H	92.5	Very high	94.2	Very high	2 Å²	2	22.8 Å²	22.8	1%	0.009	12%	0.122	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.8	128.9	174.3	-176.9	-101.5	0	0	0	109.7	I142 A144 A188 I189 W191 L309 Y334	I142-H326 PolarHBondContact O-CD2 2.92Å; I142-H326 PolarHBondContact O-NE2 3.42Å; A144-H326 HydrophobicContact CB-CB 4.18Å; A188-H326 CarbonylContact C-O 3.49Å; A188-H326 VanDerWaalsContact CA-O 3.24Å; A188-H326 WeakPolarHBondContact CA-O 3.24Å; A188-H326 WeakPolarHBondContact CB-O 3.32Å; I189-H326 HydrophobicContact CG2-CB 4.06Å; I189-H326 PolarHBondContact N-O 2.75Å; I189-H326 PolarHBondContact O-N 3.43Å; W191-H326 HydrophobicContact CH2-CB 4.21Å; W191-H326 HydrophobicContact CZ3-CB 3.98Å; L309-H326 VanDerWaalsContact CD1-CE1 3.41Å; L309-H326 WeakPolarHBondContact CD1-CE1 3.23Å; H326-Y334 HydrophobicContact CB-CE1 4.27Å; H326-Y334 AromaticContact ND1-CE1 3.42Å; H326-Y334 WeakPolarHBondContact ND1-CE1 3.3Å; H326-Y334 AromaticContact ND1-CZ 3.55Å; H326-Y334 PolarHBondContact ND1-OH 3.36Å
327	Q	90.3	Very high	94.3	Very high	56 Å²	56	19.9 Å²	19.9	26%	0.262	11%	0.105	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-68	142.3	175.7	-166.4	-179.4	41.5	0	0	109.4	E52 R187 P329 Y334	E52-Q327 PolarHBondContact OE2-NE2 2.93Å; E52-Q327 PolarHBondContact OE2-OE1 3.26Å; R187-Q327 WeakPolarHBondContact O-CG 3.2Å; Q327-P329 VanDerWaalsContact O-CD 3.26Å; Q327-P329 WeakPolarHBondContact O-CD 3.41Å; Q327-Y334 PolarHBondContact O-OH 3.03Å
328	Y	90.7	Very high	94.4	Very high	19 Å²	19	20 Å²	20	8%	0.075	11%	0.106	C	C	.	.			trans	-62.6	120.3	178.7	-71.2	2.3	0	0	0	109.8	L139 T182 G186 R187 I189 G330 Y334 Y356	L139-Y328 WeakPolarHBondContact CD1-O 2.86Å; T182-Y328 HydrophobicContact CG2-CD1 4.42Å; T182-Y328 HydrophobicContact CG2-CD2 4.08Å; T182-Y328 HydrophobicContact CG2-CE1 4.45Å; T182-Y328 HydrophobicContact CG2-CE2 4.15Å; T182-Y328 HydrophobicContact CG2-CG 4.21Å; G186-Y328 VanDerWaalsContact C-CE2 3.46Å; G186-Y328 VanDerWaalsContact O-CD2 3.32Å; G186-Y328 WeakPolarHBondContact O-CD2 3.19Å; G186-Y328 WeakPolarHBondContact O-CE2 3.35Å; R187-Y328 PolarHBondContact O-N 2.71Å; I189-Y328 HydrophobicContact CB-CE1 3.94Å; I189-Y328 VanDerWaalsContact N-CE1 3.33Å; Y328-G330 PolarHBondContact O-N 2.86Å; Y328-Y334 AromaticContact CD1-CE2 3.73Å; Y328-Y334 HydrophobicContact CD1-CE2 3.73Å; Y328-Y334 AromaticContact CE1-CE2 3.75Å; Y328-Y334 HydrophobicContact CE1-CE2 3.75Å; Y328-Y356 WeakPolarHBondContact OH-CB 3.49Å
329	P	86.8	Confident	94.3	Very high	1 Å²	1	18.4 Å²	18.4	1%	0.006	10%	0.099	C	C	.	.			trans	-77.7	-14.9	174	32.3	-34	0	0	0	112.2	L139 L141 F206 W208 Q327	L139-P329 PolarHBondContact N-O 2.71Å; L141-P329 HydrophobicContact CB-CB 4.42Å; L141-P329 HydrophobicContact CD1-CB 3.46Å; L141-P329 VanDerWaalsContact CD1-CB 3.46Å; L141-P329 HydrophobicContact CD1-CG 3.72Å; F206-P329 HydrophobicContact CD1-CG 3.7Å; F206-P329 HydrophobicContact CD2-CG 4.12Å; F206-P329 HydrophobicContact CE1-CG 3.66Å; F206-P329 HydrophobicContact CE2-CG 4.07Å; F206-P329 HydrophobicContact CG-CG 3.93Å; F206-P329 HydrophobicContact CZ-CG 3.84Å; W208-P329 HydrophobicContact CH2-CB 4Å; W208-P329 HydrophobicContact CH2-CG 4.36Å; W208-P329 WeakPolarHBondContact CH2-O 3.36Å; W208-P329 HydrophobicContact CZ2-CB 4.18Å; W208-P329 HydrophobicContact CZ2-CG 4.37Å; Q327-P329 VanDerWaalsContact O-CD 3.26Å; Q327-P329 WeakPolarHBondContact O-CD 3.41Å
330	G	87.6	Confident	94.3	Very high	12 Å²	12	15 Å²	15	12%	0.124	8%	0.078	C	C	.	.	S	Bend	trans	168.4	-160.8	-178.6	0	0	0	0	0	110.8	T182 Y328	T182-G330 WeakPolarHBondContact CG2-O 3.44Å; Y328-G330 PolarHBondContact O-N 2.86Å
331	V	89.5	Confident	94	Very high	54 Å²	54	15 Å²	15	33%	0.327	8%	0.083	S	C	.	.	S	Bend	trans	-84.1	135.2	173	-171.9	0	0	0	0	109.2	T182 D209 P212	T182-V331 WeakPolarHBondContact OG1-CA 3.3Å; D209-V331 CarbonylContact O-C 3.58Å; D209-V331 WeakPolarHBondContact O-CG1 3.24Å; D209-V331 VanDerWaalsContact O-O 3.09Å; P212-V331 HydrophobicContact CG-CG1 3.82Å
332	G	92.4	Very high	93.8	Very high	0 Å²	0	18.4 Å²	18.4	0%	0	10%	0.098	C	C	.	.	E	Extended strand (participates in β ladder)	trans	170.4	-155.3	179.6	0	0	0	0	0	113.1	T182 E207 D209	T182-G332 PolarHBondContact N-O 2.85Å; T182-G332 PolarHBondContact OG1-N 2.83Å; T182-G332 PolarHBondContact OG1-O 2.67Å; E207-G332 CarbonylContact O-C 3.51Å; E207-G332 VanDerWaalsContact O-CA 3.25Å; E207-G332 WeakPolarHBondContact O-CA 3.17Å; D209-G332 WeakPolarHBondContact O-CA 3.5Å; D209-G332 PolarHBondContact O-N 3.04Å
333	V	95.2	Very high	93.4	Very high	0 Å²	0	17.4 Å²	17.4	0%	0	10%	0.097	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.6	120.2	-177.1	-175.6	0	0	0	0	109.5	R179 E207 D209 P212 P213	R179-V333 HydrophobicContact CB-CG1 3.81Å; R179-V333 HydrophobicContact CG-CG1 4.48Å; E207-V333 HydrophobicContact CB-CB 4.36Å; E207-V333 PolarHBondContact N-O 3.16Å; E207-V333 PolarHBondContact O-N 2.61Å; D209-V333 HydrophobicContact CB-CG2 4.41Å; P212-V333 HydrophobicContact CB-CG2 3.7Å; P213-V333 HydrophobicContact CG-CG2 4.5Å
334	Y	97	Very high	93.2	Very high	0 Å²	0	22.1 Å²	22.1	0%	0	12%	0.121	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.5	133	166.9	-76.5	-90.6	0	0	0	110	R179 V180 T182 I189 L204 Y205 F206 L309 H326 Q327 Y328 F336	R179-Y334 CarbonylContact C-O 3.43Å; R179-Y334 WeakPolarHBondContact CA-O 2.99Å; V180-Y334 PolarHBondContact N-O 2.62Å; V180-Y334 PolarHBondContact O-N 2.62Å; T182-Y334 HydrophobicContact CG2-CD2 4.33Å; T182-Y334 HydrophobicContact CG2-CE2 4.02Å; I189-Y334 HydrophobicContact CB-CD2 4.34Å; I189-Y334 HydrophobicContact CB-CE2 4.1Å; I189-Y334 HydrophobicContact CD1-CD1 4.35Å; I189-Y334 HydrophobicContact CD1-CD2 3.64Å; I189-Y334 HydrophobicContact CD1-CE2 4.25Å; I189-Y334 HydrophobicContact CD1-CG 3.69Å; I189-Y334 HydrophobicContact CG2-CD1 3.89Å; I189-Y334 HydrophobicContact CG2-CD2 4.25Å; I189-Y334 HydrophobicContact CG2-CE1 3.51Å; I189-Y334 HydrophobicContact CG2-CE2 3.93Å; I189-Y334 HydrophobicContact CG2-CG 4.22Å; L204-Y334 HydrophobicContact CD1-CD1 3.96Å; L204-Y334 HydrophobicContact CD2-CD1 4.22Å; L204-Y334 HydrophobicContact CD2-CE1 4.43Å; L204-Y334 HydrophobicContact CG-CD1 4.25Å; Y205-Y334 CarbonylContact O-C 3.53Å; Y205-Y334 WeakPolarHBondContact O-CA 3.29Å; F206-Y334 HydrophobicContact CD2-CD1 4.1Å; F206-Y334 AromaticContact CD2-CD2 3.94Å; F206-Y334 HydrophobicContact CD2-CD2 3.94Å; F206-Y334 AromaticContact CD2-CE1 3.98Å; F206-Y334 HydrophobicContact CD2-CE1 3.98Å; F206-Y334 AromaticContact CD2-CE2 3.8Å; F206-Y334 HydrophobicContact CD2-CE2 3.8Å; F206-Y334 HydrophobicContact CD2-CG 4.09Å; F206-Y334 AromaticContact CD2-CZ 3.82Å; F206-Y334 AromaticContact CE2-CD2 4Å; F206-Y334 HydrophobicContact CE2-CD2 4Å; F206-Y334 AromaticContact CE2-CE2 3.7Å; F206-Y334 HydrophobicContact CE2-CE2 3.7Å; L309-Y334 HydrophobicContact CD1-CD1 3.97Å; L309-Y334 HydrophobicContact CD1-CE1 3.53Å; H326-Y334 HydrophobicContact CB-CE1 4.27Å; H326-Y334 AromaticContact ND1-CE1 3.42Å; H326-Y334 WeakPolarHBondContact ND1-CE1 3.3Å; H326-Y334 AromaticContact ND1-CZ 3.55Å; H326-Y334 PolarHBondContact ND1-OH 3.36Å; Q327-Y334 PolarHBondContact O-OH 3.03Å; Y328-Y334 AromaticContact CD1-CE2 3.73Å; Y328-Y334 HydrophobicContact CD1-CE2 3.73Å; Y328-Y334 AromaticContact CE1-CE2 3.75Å; Y328-Y334 HydrophobicContact CE1-CE2 3.75Å; Y334-F336 HydrophobicContact CG-CE2 4.49Å
335	V	97.1	Very high	93.2	Very high	2 Å²	2	32.2 Å²	32.2	1%	0.012	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	99.9	178.7	-174.1	0	0	0	0	108.3	T177 R179 Y205 E207 K337	T177-V335 HydrophobicContact CG2-CG1 3.45Å; T177-V335 VanDerWaalsContact CG2-CG1 3.45Å; R179-V335 HydrophobicContact CG-CG2 4.45Å; Y205-V335 PolarHBondContact N-O 2.92Å; Y205-V335 PolarHBondContact O-N 2.75Å; E207-V335 HydrophobicContact CB-CG2 4.23Å; V335-K337 HydrophobicContact CG1-CG 4.32Å
336	F	98.1	Very high	93.2	Very high	0 Å²	0	37.4 Å²	37.4	0%	0	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.7	118.8	175.2	-64.1	-100.2	0	0	0	108.8	T177 V178 V180 I189 W191 F202 L204 Y334 F338 I354	T177-F336 CarbonylContact C-O 3.55Å; T177-F336 VanDerWaalsContact CA-O 3.31Å; T177-F336 WeakPolarHBondContact CA-O 3.2Å; V178-F336 HydrophobicContact CB-CB 4.15Å; V178-F336 PolarHBondContact N-O 3.03Å; V178-F336 PolarHBondContact O-N 2.74Å; V180-F336 HydrophobicContact CB-CE2 4.09Å; V180-F336 HydrophobicContact CG2-CD2 3.98Å; V180-F336 HydrophobicContact CG2-CE2 3.8Å; I189-F336 HydrophobicContact CD1-CE2 3.57Å; I189-F336 HydrophobicContact CD1-CZ 3.52Å; I189-F336 HydrophobicContact CG1-CZ 4.01Å; W191-F336 HydrophobicContact CB-CD1 4.49Å; W191-F336 HydrophobicContact CB-CE1 3.65Å; W191-F336 HydrophobicContact CB-CZ 4.3Å; W191-F336 AromaticContact CD2-CE1 3.86Å; W191-F336 HydrophobicContact CD2-CE1 3.86Å; W191-F336 AromaticContact CE3-CE1 3.96Å; W191-F336 HydrophobicContact CE3-CE1 3.96Å; W191-F336 HydrophobicContact CE3-CZ 4.29Å; W191-F336 AromaticContact CG-CE1 3.74Å; W191-F336 HydrophobicContact CG-CE1 3.74Å; F202-F336 AromaticContact CE2-CD1 3.97Å; F202-F336 HydrophobicContact CE2-CD1 3.97Å; F202-F336 HydrophobicContact CZ-CD1 4.11Å; L204-F336 HydrophobicContact CD1-CD1 3.62Å; L204-F336 HydrophobicContact CD1-CD2 4.01Å; L204-F336 HydrophobicContact CD1-CE1 3.6Å; L204-F336 HydrophobicContact CD1-CE2 3.99Å; L204-F336 HydrophobicContact CD1-CG 3.82Å; L204-F336 HydrophobicContact CD1-CZ 3.79Å; Y334-F336 HydrophobicContact CG-CE2 4.49Å; F336-F338 HydrophobicContact CB-CE2 3.92Å; F336-F338 HydrophobicContact CB-CZ 4.42Å; F336-I354 HydrophobicContact CD1-CD1 4.06Å; F336-I354 HydrophobicContact CD2-CD1 3.72Å; F336-I354 HydrophobicContact CE1-CD1 4.13Å; F336-I354 HydrophobicContact CE1-CG1 4.25Å; F336-I354 HydrophobicContact CE2-CD1 3.79Å; F336-I354 HydrophobicContact CE2-CG1 4.38Å; F336-I354 HydrophobicContact CE2-CG2 4.04Å; F336-I354 HydrophobicContact CG-CD1 3.88Å; F336-I354 HydrophobicContact CZ-CD1 4Å; F336-I354 HydrophobicContact CZ-CG1 4.14Å; F336-I354 HydrophobicContact CZ-CG2 3.89Å
337	K	97.3	Very high	93.4	Very high	24 Å²	24	39.4 Å²	39.4	10%	0.104	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.1	117.5	176.8	-69.4	-158.1	172	-160.3	0	110.5	F202 G203 Y205 V286 I312 V335	F202-K337 WeakPolarHBondContact CA-O 3.41Å; G203-K337 PolarHBondContact N-O 2.98Å; G203-K337 PolarHBondContact O-N 3.2Å; Y205-K337 HydrophobicContact CD2-CD 4.24Å; Y205-K337 HydrophobicContact CD2-CG 4.14Å; Y205-K337 HydrophobicContact CE2-CB 4.38Å; Y205-K337 HydrophobicContact CE2-CD 3.81Å; Y205-K337 HydrophobicContact CE2-CG 4.01Å; V286-K337 PolarHBondContact O-NZ 3.48Å; I312-K337 HydrophobicContact CD1-CB 4.12Å; I312-K337 HydrophobicContact CD1-CD 4.12Å; V335-K337 HydrophobicContact CG1-CG 4.32Å
338	F	97.4	Very high	93.7	Very high	2 Å²	2	37.1 Å²	37.1	1%	0.009	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	99.7	174	-64.2	-76	0	0	0	109.1	I170 T175 A176 V178 F193 L200 G201 F202 F336 L350	I170-F338 HydrophobicContact CD1-CB 3.56Å; T175-F338 WeakPolarHBondContact CA-O 3.48Å; A176-F338 HydrophobicContact CB-CB 4.25Å; A176-F338 PolarHBondContact N-O 3.41Å; A176-F338 PolarHBondContact O-N 2.95Å; V178-F338 HydrophobicContact CG2-CD2 4.24Å; V178-F338 HydrophobicContact CG2-CE2 3.92Å; F193-F338 HydrophobicContact CB-CE1 4.03Å; F193-F338 HydrophobicContact CB-CZ 4.48Å; F193-F338 HydrophobicContact CD1-CE1 4.1Å; F193-F338 HydrophobicContact CD2-CE1 4.07Å; F193-F338 AromaticContact CG-CE1 3.81Å; F193-F338 HydrophobicContact CG-CE1 3.81Å; L200-F338 HydrophobicContact CD2-CB 4.05Å; L200-F338 HydrophobicContact CD2-CD1 3.97Å; L200-F338 HydrophobicContact CD2-CG 4.45Å; G201-F338 CarbonylContact O-C 3.52Å; G201-F338 WeakPolarHBondContact O-CA 3.39Å; F202-F338 AromaticContact CD2-CD1 3.9Å; F202-F338 HydrophobicContact CD2-CD1 3.9Å; F202-F338 AromaticContact CD2-CE1 3.61Å; F202-F338 HydrophobicContact CD2-CE1 3.61Å; F202-F338 HydrophobicContact CD2-CZ 4.28Å; F202-F338 AromaticContact CE2-CE1 3.89Å; F202-F338 HydrophobicContact CE2-CE1 3.89Å; F202-F338 HydrophobicContact CE2-CZ 4.12Å; F336-F338 HydrophobicContact CB-CE2 3.92Å; F336-F338 HydrophobicContact CB-CZ 4.42Å; F338-L350 HydrophobicContact CB-CD2 4.04Å; F338-L350 HydrophobicContact CD1-CD1 3.78Å; F338-L350 HydrophobicContact CD1-CD2 3.63Å; F338-L350 HydrophobicContact CD1-CG 4.38Å; F338-L350 HydrophobicContact CD2-CD2 3.49Å; F338-L350 VanDerWaalsContact CD2-CD2 3.49Å; F338-L350 HydrophobicContact CE1-CD1 3.78Å; F338-L350 HydrophobicContact CE1-CD2 3.85Å; F338-L350 HydrophobicContact CE1-CG 4.46Å; F338-L350 HydrophobicContact CE2-CD2 3.72Å; F338-L350 HydrophobicContact CG-CD1 4.42Å; F338-L350 HydrophobicContact CG-CD2 3.43Å; F338-L350 VanDerWaalsContact CG-CD2 3.43Å; F338-L350 HydrophobicContact CZ-CD1 4.42Å; F338-L350 HydrophobicContact CZ-CD2 3.89Å
339	D	96.2	Very high	94	Very high	24 Å²	24	42 Å²	42	13%	0.128	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100	118.9	-166.3	-174.5	15.5	0	0	0	112.1	T175 L200 G201 I312 S341 F342	T175-D339 HydrophobicContact CG2-CB 4.37Å; T175-D339 PolarHBondContact OG1-OD1 2.65Å; T175-D339 VanDerWaalsContact OG1-OD1 3.13Å; L200-D339 WeakPolarHBondContact CD1-O 3.44Å; G201-D339 WeakPolarHBondContact CA-O 3.48Å; G201-D339 PolarHBondContact N-O 3.15Å; G201-D339 PolarHBondContact O-N 3.3Å; I312-D339 HydrophobicContact CG2-CB 4.08Å; D339-S341 VanDerWaalsContact CG-OG 3.26Å; D339-S341 WeakPolarHBondContact OD1-CB 3.39Å; D339-S341 PolarHBondContact OD1-N 2.99Å; D339-S341 PolarHBondContact OD1-OG 2.82Å; D339-S341 PolarHBondContact OD2-OG 3.33Å; D339-S341 VanDerWaalsContact OD2-OG 3.1Å; D339-F342 WeakPolarHBondContact O-CE1 3.5Å
340	N	95.9	Very high	94.6	Very high	0 Å²	0	41.9 Å²	41.9	0%	0	20%	0.197	C	C	.	.			trans	-117.8	16.2	171.9	-163.9	30.4	0	0	0	112.4	I170 S171 L173 A174 L200 F342 S343 R346 K348	I170-N340 HydrophobicContact CB-CB 4.37Å; I170-N340 HydrophobicContact CG2-CB 3.6Å; I170-N340 PolarHBondContact O-ND2 2.87Å; S171-N340 PolarHBondContact O-ND2 3.42Å; L173-N340 PolarHBondContact N-O 2.81Å; A174-N340 CarbonylContact O-C 3.54Å; A174-N340 VanDerWaalsContact O-C 3.23Å; A174-N340 WeakPolarHBondContact O-CA 3.23Å; A174-N340 WeakPolarHBondContact O-CB 3.27Å; A174-N340 PolarHBondContact O-N 3.35Å; L200-N340 HydrophobicContact CD1-CB 3.94Å; N340-F342 PolarHBondContact O-N 3.26Å; N340-F342 VanDerWaalsContact O-N 3.16Å; N340-S343 PolarHBondContact O-N 3.22Å; N340-S343 WeakPolarHBondContact OD1-CB 3.37Å; N340-R346 PolarHBondContact ND2-O 3.33Å; N340-K348 HydrophobicContact CB-CD 4.48Å; N340-K348 VanDerWaalsContact OD1-CD 3.3Å; N340-K348 WeakPolarHBondContact OD1-CD 3.21Å; N340-K348 WeakPolarHBondContact OD1-CE 3.35Å; N340-K348 PolarHBondContact OD1-NZ 3.22Å
341	S	91.8	Very high	95.1	Very high	50 Å²	50	42.3 Å²	42.3	35%	0.35	20%	0.195	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58.2	-27.1	-179.9	63.6	0	0	0	0	113.2	L173 A174 D339 S343	L173-S341 WeakPolarHBondContact CD2-O 3.46Å; A174-S341 PolarHBondContact O-N 3.43Å; D339-S341 VanDerWaalsContact CG-OG 3.26Å; D339-S341 WeakPolarHBondContact OD1-CB 3.39Å; D339-S341 PolarHBondContact OD1-N 2.99Å; D339-S341 PolarHBondContact OD1-OG 2.82Å; D339-S341 PolarHBondContact OD2-OG 3.33Å; D339-S341 VanDerWaalsContact OD2-OG 3.1Å; S341-S343 VanDerWaalsContact C-N 3.32Å; S341-S343 PolarHBondContact O-N 3.46Å
342	F	91.7	Very high	95.5	Very high	72 Å²	72	40.7 Å²	40.7	32%	0.316	18%	0.183	S	C	.	.	T	Hydrogen-bonded Turn	trans	-80.1	-8.7	179.2	62	-95.2	0	0	0	114.2	R314 D339 N340	R314-F342 HydrophobicContact CG-CD1 4.48Å; R314-F342 HydrophobicContact CG-CE1 3.98Å; R314-F342 HydrophobicContact CG-CZ 4.05Å; D339-F342 WeakPolarHBondContact O-CE1 3.5Å; N340-F342 PolarHBondContact O-N 3.26Å; N340-F342 VanDerWaalsContact O-N 3.16Å
343	S	90.3	Very high	95.8	Very high	15 Å²	15	43 Å²	43	11%	0.105	19%	0.191	C	C	.	.			trans	-100.2	108.3	-175.3	-158.4	0	0	0	0	112	S172 L173 N340 S341 R346 K348	S172-S343 CarbonylContact C-O 3.5Å; S172-S343 VanDerWaalsContact CA-O 3.28Å; S172-S343 WeakPolarHBondContact CA-O 3.32Å; S172-S343 WeakPolarHBondContact CB-O 3.43Å; L173-S343 PolarHBondContact N-O 3.05Å; N340-S343 PolarHBondContact O-N 3.22Å; N340-S343 WeakPolarHBondContact OD1-CB 3.37Å; S341-S343 VanDerWaalsContact C-N 3.32Å; S341-S343 PolarHBondContact O-N 3.46Å; S343-R346 WeakPolarHBondContact OG-CB 3.26Å; S343-R346 PolarHBondContact OG-O 3.49Å; S343-K348 VanDerWaalsContact CB-NZ 3.31Å; S343-K348 PolarHBondContact OG-NZ 2.91Å; S343-K348 VanDerWaalsContact OG-NZ 3.14Å
344	L	91.6	Very high	95.9	Very high	100 Å²	100	44.4 Å²	44.4	52%	0.524	20%	0.199	S	C	.	.	S	Bend	trans	-67.4	-37.7	179.1	-64.2	168.3	0	0	0	113.3	S172 L173	S172-L344 WeakPolarHBondContact CB-O 3.4Å; L173-L344 HydrophobicContact CD2-CD2 4.1Å
345	W	93	Very high	95.8	Very high	214 Å²	214	48.6 Å²	48.6	81%	0.811	22%	0.217	S	C	*	.	S	Bend	trans	-125	-7	-165.9	-43.6	107.1	0	0	0	114.9
346	R	94.4	Very high	95.7	Very high	139 Å²	139	52.1 Å²	52.1	53%	0.525	23%	0.231	S	C	.	.			trans	-122.7	108	-169.3	-55.2	-62.8	-177.3	-170.3	0.2	110.9	Y198 N340 S343 K348	Y198-R346 HydrophobicContact CD2-CB 4.13Å; Y198-R346 HydrophobicContact CD2-CG 4.46Å; Y198-R346 HydrophobicContact CE2-CB 4.03Å; Y198-R346 HydrophobicContact CE2-CG 4Å; Y198-R346 PolarHBondContact OH-NE 2.89Å; N340-R346 PolarHBondContact ND2-O 3.33Å; S343-R346 WeakPolarHBondContact OG-CB 3.26Å; S343-R346 PolarHBondContact OG-O 3.49Å; R346-K348 PolarHBondContact O-NZ 3.46Å
347	S	96.7	Very high	95.5	Very high	44 Å²	44	54.7 Å²	54.7	31%	0.308	25%	0.246	S	C	.	.			trans	-66.4	154.6	160.2	-41.9	0	0	0	0	110.7	K169 I170	K169-S347 WeakPolarHBondContact CE-OG 3.34Å; I170-S347 CarbonylContact O-C 3.53Å; I170-S347 WeakPolarHBondContact O-CA 3.4Å; I170-S347 WeakPolarHBondContact O-CB 3.07Å
348	K	97.2	Very high	95.1	Very high	8 Å²	8	60.2 Å²	60.2	4%	0.035	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	132.6	-179.2	-66.1	171.6	178.5	54.5	0	109.6	I170 D199 L200 N340 S343 R346	I170-K348 PolarHBondContact N-O 3.38Å; I170-K348 PolarHBondContact O-N 3.48Å; D199-K348 WeakPolarHBondContact O-CD 3.35Å; D199-K348 WeakPolarHBondContact O-CE 3.37Å; L200-K348 HydrophobicContact CB-CD 4.27Å; L200-K348 HydrophobicContact CD1-CB 4.37Å; L200-K348 HydrophobicContact CD1-CD 3.47Å; L200-K348 VanDerWaalsContact CD1-CD 3.47Å; L200-K348 HydrophobicContact CG-CD 4.44Å; N340-K348 HydrophobicContact CB-CD 4.48Å; N340-K348 VanDerWaalsContact OD1-CD 3.3Å; N340-K348 WeakPolarHBondContact OD1-CD 3.21Å; N340-K348 WeakPolarHBondContact OD1-CE 3.35Å; N340-K348 PolarHBondContact OD1-NZ 3.22Å; S343-K348 VanDerWaalsContact CB-NZ 3.31Å; S343-K348 PolarHBondContact OG-NZ 2.91Å; S343-K348 VanDerWaalsContact OG-NZ 3.14Å; R346-K348 PolarHBondContact O-NZ 3.46Å
349	W	97.9	Very high	94.9	Very high	120 Å²	120	63.1 Å²	63.1	46%	0.455	29%	0.285	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.5	119.5	166.2	-76.2	102.3	0	0	0	108.2	K169 T195 Y351	K169-W349 HydrophobicContact CB-CD2 4.12Å; K169-W349 HydrophobicContact CB-CE3 3.98Å; K169-W349 HydrophobicContact CB-CH2 4.05Å; K169-W349 HydrophobicContact CB-CZ2 4.17Å; K169-W349 HydrophobicContact CB-CZ3 3.95Å; K169-W349 HydrophobicContact CD-CZ2 4.24Å; K169-W349 HydrophobicContact CG-CD2 4.44Å; K169-W349 HydrophobicContact CG-CZ2 4.45Å; T195-W349 VanDerWaalsContact CA-O 3.23Å; T195-W349 WeakPolarHBondContact CA-O 2.98Å; T195-W349 WeakPolarHBondContact CB-O 3.32Å; W349-Y351 HydrophobicContact CB-CE2 4.15Å
350	L	98.1	Very high	94.9	Very high	0 Å²	0	65.2 Å²	65.2	0%	0	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.4	125.6	174.5	173.7	68.6	0	0	0	108.5	C167 I168 I170 F193 L200 F338 Y352	C167-L350 CarbonylContact C-O 3.46Å; C167-L350 VanDerWaalsContact CA-O 3.26Å; C167-L350 WeakPolarHBondContact CA-O 3.48Å; I168-L350 HydrophobicContact CD1-CD2 3.97Å; I168-L350 HydrophobicContact CG1-CB 3.96Å; I168-L350 HydrophobicContact CG1-CD2 3.93Å; I168-L350 HydrophobicContact CG1-CG 4.35Å; I168-L350 PolarHBondContact N-O 2.81Å; I168-L350 PolarHBondContact O-N 3.4Å; I170-L350 HydrophobicContact CD1-CB 4.18Å; I170-L350 HydrophobicContact CD1-CD2 4.17Å; I170-L350 HydrophobicContact CG1-CB 4.49Å; F193-L350 HydrophobicContact CB-CD1 3.89Å; F193-L350 HydrophobicContact CD2-CD1 4.26Å; F193-L350 HydrophobicContact CG-CD1 4.46Å; L200-L350 HydrophobicContact CD2-CD1 3.91Å; F338-L350 HydrophobicContact CB-CD2 4.04Å; F338-L350 HydrophobicContact CD1-CD1 3.78Å; F338-L350 HydrophobicContact CD1-CD2 3.63Å; F338-L350 HydrophobicContact CD1-CG 4.38Å; F338-L350 HydrophobicContact CD2-CD2 3.49Å; F338-L350 VanDerWaalsContact CD2-CD2 3.49Å; F338-L350 HydrophobicContact CE1-CD1 3.78Å; F338-L350 HydrophobicContact CE1-CD2 3.85Å; F338-L350 HydrophobicContact CE1-CG 4.46Å; F338-L350 HydrophobicContact CE2-CD2 3.72Å; F338-L350 HydrophobicContact CG-CD1 4.42Å; F338-L350 HydrophobicContact CG-CD2 3.43Å; F338-L350 VanDerWaalsContact CG-CD2 3.43Å; F338-L350 HydrophobicContact CZ-CD1 4.42Å; F338-L350 HydrophobicContact CZ-CD2 3.89Å; L350-Y352 HydrophobicContact CD2-CD1 4.01Å; L350-Y352 HydrophobicContact CD2-CG 4.47Å; L350-Y352 HydrophobicContact CG-CD1 4.19Å
351	Y	98.5	Very high	94.8	Very high	21 Å²	21	68.8 Å²	68.8	8%	0.082	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	121	166	-56.9	-98.5	0	0	0	106.2	K156 I159 L160 C167 F193 A194 D196 W349	K156-Y351 HydrophobicContact CB-CD1 4.1Å; K156-Y351 HydrophobicContact CB-CE1 4.13Å; K156-Y351 HydrophobicContact CB-CG 4.38Å; K156-Y351 HydrophobicContact CD-CD2 4.14Å; K156-Y351 HydrophobicContact CD-CE2 3.96Å; K156-Y351 HydrophobicContact CG-CD1 4.07Å; K156-Y351 HydrophobicContact CG-CD2 3.83Å; K156-Y351 HydrophobicContact CG-CE1 4.28Å; K156-Y351 HydrophobicContact CG-CE2 4.07Å; K156-Y351 HydrophobicContact CG-CG 3.85Å; I159-Y351 HydrophobicContact CB-CD1 4.25Å; I159-Y351 HydrophobicContact CG2-CD1 4.12Å; L160-Y351 HydrophobicContact CD1-CE1 3.9Å; L160-Y351 HydrophobicContact CD2-CE1 3.86Å; L160-Y351 HydrophobicContact CG-CD1 4.36Å; L160-Y351 HydrophobicContact CG-CE1 3.74Å; C167-Y351 HydrophobicContact CB-CD1 4.26Å; C167-Y351 HydrophobicContact CB-CE1 4.43Å; C167-Y351 WeakPolarHBondContact SG-CE1 3.31Å; F193-Y351 CarbonylContact C-O 3.23Å; F193-Y351 WeakPolarHBondContact CA-O 3.34Å; F193-Y351 WeakPolarHBondContact CB-O 3.14Å; A194-Y351 PolarHBondContact N-O 3.18Å; A194-Y351 PolarHBondContact O-N 3.01Å; D196-Y351 VanDerWaalsContact OD1-CE2 3.32Å; D196-Y351 WeakPolarHBondContact OD1-CE2 3.36Å; D196-Y351 PolarHBondContact OD1-OH 2.94Å; D196-Y351 PolarHBondContact OD2-OH 3.41Å; W349-Y351 HydrophobicContact CB-CE2 4.15Å
352	Y	98.3	Very high	95	Very high	19 Å²	19	69.9 Å²	69.9	8%	0.075	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.3	162.5	179.9	75.1	-82.8	0	0	0	111.8	I159 C166 I168 V178 E192 L350 I354	I159-Y352 WeakPolarHBondContact CD1-O 3.1Å; C166-Y352 HydrophobicContact CB-CD1 4.25Å; C166-Y352 HydrophobicContact CB-CE1 4.09Å; C166-Y352 HydrophobicContact CB-CE2 4.44Å; C166-Y352 HydrophobicContact CB-CG 4.49Å; C166-Y352 WeakPolarHBondContact CB-O 3.15Å; C166-Y352 WeakPolarHBondContact O-CD1 3.39Å; C166-Y352 PolarHBondContact O-N 3.49Å; I168-Y352 HydrophobicContact CD1-CE1 4.32Å; I168-Y352 HydrophobicContact CG1-CE1 4.34Å; I168-Y352 HydrophobicContact CG2-CE1 4.24Å; V178-Y352 HydrophobicContact CG1-CE2 4.31Å; V178-Y352 HydrophobicContact CG2-CE2 4.3Å; E192-Y352 CarbonylContact O-C 3.54Å; E192-Y352 WeakPolarHBondContact O-CA 3.34Å; L350-Y352 HydrophobicContact CD2-CD1 4.01Å; L350-Y352 HydrophobicContact CD2-CG 4.47Å; L350-Y352 HydrophobicContact CG-CD1 4.19Å; Y352-I354 HydrophobicContact CD2-CD1 3.89Å; Y352-I354 HydrophobicContact CD2-CG1 4.1Å; Y352-I354 HydrophobicContact CE2-CD1 4.1Å
353	R	97.5	Very high	95.2	Very high	48 Å²	48	69.8 Å²	69.8	18%	0.181	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.1	131.5	169.3	175.8	165.3	64.6	-169.1	-1.1	108	F155 E158 I159 W191 E192 F355	F155-R353 HydrophobicContact CE2-CB 4.43Å; E158-R353 VanDerWaalsContact CD-NH1 3.27Å; E158-R353 IonicContact OE1-CZ 2.89Å; E158-R353 IonicContact OE1-NH1 3.78Å; E158-R353 PolarHBondContact OE1-NH1 3.48Å; E158-R353 IonicContact OE1-NH2 3.97Å; E158-R353 IonicContact OE2-NH1 3.06Å; E158-R353 IonicContact OE2-NH2 3.75Å; I159-R353 HydrophobicContact CD1-CB 3.93Å; W191-R353 CarbonylContact C-O 3.54Å; W191-R353 VanDerWaalsContact CA-O 3.28Å; W191-R353 WeakPolarHBondContact CA-O 3.27Å; E192-R353 PolarHBondContact N-O 3.43Å; E192-R353 PolarHBondContact O-N 3.02Å; E192-R353 IonicContact OE1-NH2 2.62Å; E192-R353 IonicContact OE2-CZ 2.65Å; E192-R353 IonicContact OE2-NE 3.03Å; E192-R353 PolarHBondContact OE2-NE 3.13Å; E192-R353 IonicContact OE2-NH2 2.74Å; E192-R353 PolarHBondContact OE2-NH2 3.35Å; R353-F355 HydrophobicContact CG-CD1 4Å; R353-F355 HydrophobicContact CG-CE1 4.39Å
354	I	97.4	Very high	95.5	Very high	31 Å²	31	73.4 Å²	73.4	16%	0.159	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.2	134.7	178.2	-60.4	161.6	0	0	0	107.8	V178 V180 I189 C190 W191 F336 Y352	V178-I354 HydrophobicContact CB-CD1 4.39Å; V178-I354 HydrophobicContact CG1-CD1 3.95Å; V180-I354 HydrophobicContact CG1-CG2 4.21Å; V180-I354 HydrophobicContact CG2-CD1 4.02Å; V180-I354 HydrophobicContact CG2-CG2 4.09Å; I189-I354 HydrophobicContact CD1-CG2 3.72Å; I189-I354 HydrophobicContact CG1-CG2 3.75Å; C190-I354 WeakPolarHBondContact O-CA 3.46Å; W191-I354 HydrophobicContact CB-CG1 4.04Å; F336-I354 HydrophobicContact CD1-CD1 4.06Å; F336-I354 HydrophobicContact CD2-CD1 3.72Å; F336-I354 HydrophobicContact CE1-CD1 4.13Å; F336-I354 HydrophobicContact CE1-CG1 4.25Å; F336-I354 HydrophobicContact CE2-CD1 3.79Å; F336-I354 HydrophobicContact CE2-CG1 4.38Å; F336-I354 HydrophobicContact CE2-CG2 4.04Å; F336-I354 HydrophobicContact CG-CD1 3.88Å; F336-I354 HydrophobicContact CZ-CD1 4Å; F336-I354 HydrophobicContact CZ-CG1 4.14Å; F336-I354 HydrophobicContact CZ-CG2 3.89Å; Y352-I354 HydrophobicContact CD2-CD1 3.89Å; Y352-I354 HydrophobicContact CD2-CG1 4.1Å; Y352-I354 HydrophobicContact CE2-CD1 4.1Å
355	F	95.6	Very high	95.8	Very high	87 Å²	87	71.5 Å²	71.5	38%	0.382	31%	0.306	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.6	160.6	-179.1	55.6	-82.7	0	0	0	110.1	C190 R353 T357	C190-F355 HydrophobicContact CB-CD1 4.24Å; C190-F355 HydrophobicContact CB-CD2 3.77Å; C190-F355 HydrophobicContact CB-CE1 3.85Å; C190-F355 HydrophobicContact CB-CE2 3.32Å; C190-F355 HydrophobicContact CB-CG 4.21Å; C190-F355 HydrophobicContact CB-CZ 3.37Å; C190-F355 PolarHBondContact N-O 3.5Å; C190-F355 PolarHBondContact O-N 2.97Å; R353-F355 HydrophobicContact CG-CD1 4Å; R353-F355 HydrophobicContact CG-CE1 4.39Å; F355-T357 HydrophobicContact CD2-CG2 4.47Å; F355-T357 HydrophobicContact CE2-CG2 4.38Å
356	Y	95.2	Very high	96	Very high	77 Å²	77	60.5 Å²	60.5	30%	0.302	27%	0.267	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	159.7	173.7	65.2	-96.3	0	0	0	111.4	H183 A188 Y328 H358	H183-Y356 HydrophobicContact CB-CD1 3.76Å; H183-Y356 HydrophobicContact CB-CD2 4.37Å; H183-Y356 HydrophobicContact CB-CE1 3.86Å; H183-Y356 HydrophobicContact CB-CE2 4.49Å; H183-Y356 HydrophobicContact CB-CG 4.03Å; H183-Y356 AromaticContact CD2-CE1 3.99Å; H183-Y356 AromaticContact CE1-CZ 3.89Å; H183-Y356 AromaticContact CG-CE1 3.67Å; H183-Y356 AromaticContact CG-CZ 3.73Å; H183-Y356 AromaticContact ND1-CE2 3.75Å; H183-Y356 AromaticContact ND1-CZ 3.56Å; A188-Y356 CarbonylContact O-C 3.47Å; A188-Y356 WeakPolarHBondContact O-CA 3.4Å; A188-Y356 WeakPolarHBondContact O-CB 3.34Å; Y328-Y356 WeakPolarHBondContact OH-CB 3.49Å; Y356-H358 AromaticContact CE2-CE1 3.59Å; Y356-H358 AromaticContact CE2-NE2 3.68Å
357	T	92.9	Very high	96.1	Very high	53 Å²	53	54 Å²	54	33%	0.325	25%	0.246	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	156.7	172.7	64.4	0	0	0	0	110.9	G186 R187 A188 F355	G186-T357 CarbonylContact C-O 3.57Å; G186-T357 WeakPolarHBondContact CA-O 3.44Å; R187-T357 PolarHBondContact N-O 2.69Å; A188-T357 PolarHBondContact N-O 2.89Å; A188-T357 PolarHBondContact O-N 2.91Å; F355-T357 HydrophobicContact CD2-CG2 4.47Å; F355-T357 HydrophobicContact CE2-CG2 4.38Å
358	H	88.5	Confident	96.1	Very high	140 Å²	140	54.9 Å²	54.9	65%	0.648	24%	0.24	S	C	*	.			trans	-95.3	0	-177.5	-66.9	-73.6	0	0	0	114.4	N185 R187 Y356	N185-H358 PolarHBondContact O-ND1 2.88Å; R187-H358 WeakPolarHBondContact CD-OXT 3.47Å; R187-H358 VanDerWaalsContact CG-OXT 3.25Å; R187-H358 WeakPolarHBondContact CG-OXT 3.34Å; R187-H358 PolarHBondContact NE-OXT 3.11Å; R187-H358 PolarHBondContact NH1-OXT 2.85Å; Y356-H358 AromaticContact CE2-CE1 3.59Å; Y356-H358 AromaticContact CE2-NE2 3.68Å

Retrieved 358 of 358 residues in 417.6 ms (Link to these results)

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