A0A087XE22_POEFO Loading...

receptor protein serine/threonine kinase

AlphaFold DB , UniProt , Accession A0A087XE22, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 444 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	41.1	Very low	44.7	Very low	197 Å²	197	139.5 Å²	139.5	97%	0.97	74%	0.735	S	S	*	*				0	131.6	0	-142.2	175	-173.2	0	0	105.3
2	L	39.9	Very low	44.7	Very low	123 Å²	123	136.1 Å²	136.1	64%	0.644	73%	0.731	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-84.3	117.9	177	-82.5	148.8	0	0	0	108.5	E7	L2-E7 HydrophobicContact CD2-CB 4.45Å
3	I	46.8	Very low	44.9	Very low	105 Å²	105	134.2 Å²	134.2	54%	0.538	73%	0.732	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-118.6	124.3	168.4	-56.6	178.6	0	0	0	105.2	G5	I3-G5 VanDerWaalsContact C-N 3.32Å; I3-G5 PolarHBondContact O-N 3Å
4	D	42.1	Very low	45.3	Very low	164 Å²	164	132.6 Å²	132.6	88%	0.877	72%	0.719	S	S	*	*	T	Hydrogen-bonded Turn	trans	53	39.1	-178.4	-60.9	-24	0	0	0	116.1	K6	D4-K6 VanDerWaalsContact C-N 3.29Å; D4-K6 PolarHBondContact O-N 3.06Å
5	G	51.7	Low	45.6	Very low	69 Å²	69	126.7 Å²	126.7	71%	0.711	69%	0.692	S	S	*	*	T	Hydrogen-bonded Turn	trans	74.2	8.4	165.3	0	0	0	0	0	116.3	I3	I3-G5 VanDerWaalsContact C-N 3.32Å; I3-G5 PolarHBondContact O-N 3Å
6	K	44.9	Very low	46	Very low	171 Å²	171	126.3 Å²	126.3	74%	0.743	70%	0.697	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-116.6	140.6	167	-80.3	-178.9	176.6	176.3	0	110.9	D4 E8	D4-K6 VanDerWaalsContact C-N 3.29Å; D4-K6 PolarHBondContact O-N 3.06Å; K6-E8 PolarHBondContact O-N 3.19Å; K6-E8 VanDerWaalsContact O-N 3.16Å
7	E	45.1	Very low	46.3	Very low	152 Å²	152	125.2 Å²	125.2	71%	0.71	70%	0.701	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-75.8	102.9	-177.6	-155.3	176.1	-153.5	0	0	109.6	L2	L2-E7 HydrophobicContact CD2-CB 4.45Å
8	E	42.6	Very low	46.4	Very low	125 Å²	125	124.6 Å²	124.6	58%	0.584	69%	0.692	S	S	*	*			trans	-91.8	125.4	173.7	-96.1	-166.2	162.2	0	0	111.5	K6	K6-E8 PolarHBondContact O-N 3.19Å; K6-E8 VanDerWaalsContact O-N 3.16Å
9	T	46.9	Very low	46.8	Very low	129 Å²	129	123.5 Å²	123.5	79%	0.791	68%	0.682	S	S	*	*			trans	-93.7	100.5	171.6	-0.5	0	0	0	0	109.2
10	V	45	Very low	46.8	Very low	122 Å²	122	128.2 Å²	128.2	74%	0.739	70%	0.695	S	S	*	*			trans	-88.9	116.9	173.4	-177.4	0	0	0	0	108.8
11	K	45.6	Very low	47	Very low	178 Å²	178	124.7 Å²	124.7	77%	0.774	69%	0.689	S	S	*	*			trans	-90.6	122.5	173.3	-63.8	-177.9	-177.6	179.1	0	109
12	S	44.9	Very low	47.1	Very low	98 Å²	98	123.3 Å²	123.3	69%	0.685	68%	0.68	S	S	*	*			trans	-135.3	138.6	178	178.9	0	0	0	0	109.8
13	C	47.7	Very low	47.4	Very low	111 Å²	111	122.2 Å²	122.2	75%	0.75	68%	0.678	S	S	*	*			trans	-86.2	130.5	168.7	-60.1	0	0	0	0	108.7
14	M	50.1	Low	47.3	Very low	112 Å²	112	125 Å²	125	55%	0.552	69%	0.687	S	S	*	*			trans	-110	140.3	175.9	-70.3	-174.3	73.8	0	0	110.3	Q18	M14-Q18 HydrophobicContact CE-CB 3.59Å; M14-Q18 VanDerWaalsContact CE-O 3.23Å; M14-Q18 WeakPolarHBondContact CE-O 3.31Å
15	S	48.9	Very low	47.4	Very low	45 Å²	45	122.8 Å²	122.8	32%	0.315	68%	0.683	S	S	.	*			trans	-74.8	151	170.2	61.9	0	0	0	0	110.7	S17 Q18	S15-S17 PolarHBondContact O-N 3.06Å; S15-S17 VanDerWaalsContact O-N 3.09Å; S15-S17 PolarHBondContact OG-OG 3.3Å; S15-S17 VanDerWaalsContact OG-OG 3.07Å; S15-Q18 VanDerWaalsContact N-OE1 3.14Å; S15-Q18 WeakPolarHBondContact O-CB 3.4Å; S15-Q18 PolarHBondContact O-N 3.17Å; S15-Q18 WeakPolarHBondContact OG-CG 3.24Å; S15-Q18 PolarHBondContact OG-OE1 2.85Å
16	P	52.1	Low	46.7	Very low	119 Å²	119	130.5 Å²	130.5	77%	0.773	69%	0.692	S	S	*	*	G	3₁₀ helix	trans	-55.2	-30.9	-179.3	-27.3	34.8	0	0	0	114.1	Q18 M19	P16-Q18 PolarHBondContact O-N 2.83Å; P16-M19 PolarHBondContact O-N 3.27Å
17	S	51.5	Low	46.5	Very low	108 Å²	108	127.6 Å²	127.6	76%	0.755	69%	0.693	S	S	*	*	G	3₁₀ helix	trans	-66.4	-19.6	175.6	39.4	0	0	0	0	114.4	S15	S15-S17 PolarHBondContact O-N 3.06Å; S15-S17 VanDerWaalsContact O-N 3.09Å; S15-S17 PolarHBondContact OG-OG 3.3Å; S15-S17 VanDerWaalsContact OG-OG 3.07Å
18	Q	48.1	Very low	46.1	Very low	115 Å²	115	125.2 Å²	125.2	54%	0.537	69%	0.694	S	S	.	*	G	3₁₀ helix	trans	-96.3	-9.2	-178.6	-66.9	169.4	-47.6	0	0	112.8	M14 S15 P16 K20	M14-Q18 HydrophobicContact CE-CB 3.59Å; M14-Q18 VanDerWaalsContact CE-O 3.23Å; M14-Q18 WeakPolarHBondContact CE-O 3.31Å; S15-Q18 VanDerWaalsContact N-OE1 3.14Å; S15-Q18 WeakPolarHBondContact O-CB 3.4Å; S15-Q18 PolarHBondContact O-N 3.17Å; S15-Q18 WeakPolarHBondContact OG-CG 3.24Å; S15-Q18 PolarHBondContact OG-OE1 2.85Å; P16-Q18 PolarHBondContact O-N 2.83Å; Q18-K20 PolarHBondContact O-N 3.47Å
19	M	53.7	Low	45.9	Very low	103 Å²	103	128.6 Å²	128.6	51%	0.507	71%	0.706	S	S	.	*			trans	-81.1	99.5	175.6	-78.1	-171.7	143.3	0	0	110.8	P16 G21 V23	P16-M19 PolarHBondContact O-N 3.27Å; M19-G21 PolarHBondContact O-N 2.91Å; M19-V23 HydrophobicContact CE-CG2 3.79Å; M19-V23 HydrophobicContact SD-CG2 4.32Å
20	K	47.2	Very low	45.4	Very low	218 Å²	218	130 Å²	130	95%	0.948	71%	0.709	S	S	*	*			trans	-92	74.7	168.1	-72.6	-172.1	177.8	-178.1	0	110.2	Q18	Q18-K20 PolarHBondContact O-N 3.47Å
21	G	50.1	Low	45.7	Very low	54 Å²	54	131.1 Å²	131.1	56%	0.557	72%	0.716	S	S	*	*	S	Bend	trans	164.4	151.1	175.3	0	0	0	0	0	112.4	M19	M19-G21 PolarHBondContact O-N 2.91Å
22	Q	44	Very low	45.5	Very low	168 Å²	168	128.1 Å²	128.1	79%	0.785	72%	0.717	S	S	*	*	P	Polyproline II helix	trans	-77.4	119.9	171.6	-80.5	-179.8	-6.6	0	0	109.5	F24	Q22-F24 HydrophobicContact CB-CE2 3.99Å; Q22-F24 HydrophobicContact CB-CZ 4.18Å
23	V	47.3	Very low	45	Very low	101 Å²	101	132.3 Å²	132.3	61%	0.612	72%	0.723	S	S	*	*	P	Polyproline II helix	trans	-101.7	127.2	172.2	-172.7	0	0	0	0	108.5	M19	M19-V23 HydrophobicContact CE-CG2 3.79Å; M19-V23 HydrophobicContact SD-CG2 4.32Å
24	F	43.6	Very low	44.8	Very low	163 Å²	163	139 Å²	139	72%	0.715	73%	0.733	S	S	*	*	P	Polyproline II helix	trans	-103.9	120.3	177.1	-63	-84.6	0	0	0	109.8	Q22	Q22-F24 HydrophobicContact CB-CE2 3.99Å; Q22-F24 HydrophobicContact CB-CZ 4.18Å
25	C	44.3	Very low	44.3	Very low	117 Å²	117	140.2 Å²	140.2	79%	0.791	74%	0.741	S	S	*	*	P	Polyproline II helix	trans	-85.9	119	169.1	-65.9	0	0	0	0	109.3	S27	C25-S27 PolarHBondContact O-N 3.12Å
26	Y	36	Very low	44.1	Very low	231 Å²	231	143 Å²	143	91%	0.906	76%	0.759	S	S	*	*			trans	-75	112.7	168.8	-119.2	-96.5	0	0	0	108.6
27	S	40.8	Very low	43.8	Very low	111 Å²	111	143.1 Å²	143.1	78%	0.776	76%	0.762	S	S	*	*			trans	-121.8	130	162.5	-179.6	0	0	0	0	109.4	C25 K29	C25-S27 PolarHBondContact O-N 3.12Å; S27-K29 PolarHBondContact O-N 3.36Å
28	S	37	Very low	43.4	Very low	102 Å²	102	147 Å²	147	71%	0.713	77%	0.766	S	S	*	*	S	Bend	trans	-53.9	120.8	-174.1	146.4	0	0	0	0	112.9
29	K	38.4	Very low	43.1	Very low	195 Å²	195	146.4 Å²	146.4	85%	0.848	77%	0.77	S	S	*	*	S	Bend	trans	51.1	74.5	153.3	-62.1	-174.7	178.1	-179.5	0	117.5	S27	S27-K29 PolarHBondContact O-N 3.36Å
30	N	37.7	Very low	42.7	Very low	159 Å²	159	148.6 Å²	148.6	85%	0.85	78%	0.783	S	S	*	*				170.9	128.8	123	-111.8	-25.8	0	0	0	109.7	S32	N30-S32 PolarHBondContact O-N 2.86Å
31	V	50.4	Low	42.4	Very low	145 Å²	145	146.7 Å²	146.7	88%	0.879	78%	0.775	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.4	106	-175.6	-178.2	0	0	0	0	109.2
32	S	41.1	Very low	42.1	Very low	115 Å²	115	149.1 Å²	149.1	80%	0.804	78%	0.783	S	S	*	*	T	Hydrogen-bonded Turn	trans	173.3	1.7	153.2	41.3	0	0	0	0	116.7	N30	N30-S32 PolarHBondContact O-N 2.86Å
33	K	35.9	Very low	42	Very low	186 Å²	186	147.8 Å²	147.8	81%	0.809	78%	0.781	S	S	*	*			trans	-123.5	111	172.7	-83.3	-176.9	176.1	177.7	0	112.5
34	R	42.1	Very low	41.6	Very low	253 Å²	253	150.4 Å²	150.4	96%	0.955	79%	0.792	S	S	*	*			trans	-89.8	103.7	166.8	-76.4	-179.7	-81.5	-162.4	-5	107.9
35	N	40.5	Very low	41.6	Very low	137 Å²	137	150.8 Å²	150.8	73%	0.733	80%	0.796	S	S	*	*			trans	-113.4	127.5	167.2	-73.4	-12.9	0	0	0	108.1
36	C	45	Very low	41.4	Very low	102 Å²	102	149.6 Å²	149.6	69%	0.689	79%	0.785	S	S	*	*			trans	-67.4	134.7	165.3	-65.8	0	0	0	0	108.6	F38	C36-F38 HydrophobicContact CB-CE2 4.07Å; C36-F38 HydrophobicContact CB-CZ 4.29Å; C36-F38 WeakPolarHBondContact O-CD2 3.49Å; C36-F38 WeakPolarHBondContact O-CE2 3.25Å; C36-F38 PolarHBondContact O-N 2.8Å
37	C	44.6	Very low	41.6	Very low	123 Å²	123	146.1 Å²	146.1	83%	0.831	78%	0.781	S	S	*	*			trans	-69.2	126.9	170.7	-65.6	0	0	0	0	109
38	F	43.2	Very low	41.5	Very low	190 Å²	190	148 Å²	148	83%	0.833	78%	0.778	S	S	*	*			trans	-105.5	15.2	-178.5	-76.2	-80.7	0	0	0	113.6	C36	C36-F38 HydrophobicContact CB-CE2 4.07Å; C36-F38 HydrophobicContact CB-CZ 4.29Å; C36-F38 WeakPolarHBondContact O-CD2 3.49Å; C36-F38 WeakPolarHBondContact O-CE2 3.25Å; C36-F38 PolarHBondContact O-N 2.8Å
39	T	41.3	Very low	41.5	Very low	101 Å²	101	151.2 Å²	151.2	62%	0.62	79%	0.786	S	S	*	*	S	Bend	trans	-147.1	146.3	176.6	54	0	0	0	0	112.1	F41	T39-F41 PolarHBondContact O-N 3.44Å
40	D	46.9	Very low	41.2	Very low	149 Å²	149	150.7 Å²	150.7	80%	0.797	79%	0.786	S	S	*	*			trans	-68.4	85.2	-171.4	-62.8	-38.3	0	0	0	113.7
41	F	40.3	Very low	41	Very low	178 Å²	178	154.6 Å²	154.6	78%	0.781	79%	0.789	S	S	*	*			trans	-122.9	100.8	162.8	-69.2	-77.3	0	0	0	109.5	T39 N43	T39-F41 PolarHBondContact O-N 3.44Å; F41-N43 PolarHBondContact O-N 2.78Å
42	C	44.2	Very low	40.2	Very low	105 Å²	105	156.3 Å²	156.3	71%	0.709	79%	0.787	S	S	*	*			trans	-62.2	122.6	165.9	-76.2	0	0	0	0	109.4	N44	C42-N44 PolarHBondContact O-N 2.81Å
43	N	41.3	Very low	39.7	Very low	140 Å²	140	162 Å²	162	75%	0.749	79%	0.791	S	S	*	*			trans	-72.6	125.2	159.8	-71.2	-22.8	0	0	0	108.3	F41 E45	F41-N43 PolarHBondContact O-N 2.78Å; N43-E45 VanDerWaalsContact C-N 3.27Å; N43-E45 PolarHBondContact O-N 3.45Å
44	N	39.7	Very low	39.6	Very low	157 Å²	157	158.9 Å²	158.9	84%	0.84	79%	0.79	S	S	*	*			trans	-76.5	67.5	-176	-175.1	43	0	0	0	111.5	C42	C42-N44 PolarHBondContact O-N 2.81Å
45	E	42.2	Very low	39.2	Very low	170 Å²	170	151.6 Å²	151.6	79%	0.794	78%	0.777	S	S	*	*			trans	-132	115.1	174.8	-77.9	-72.5	160.4	0	0	109.6	N43 L47	N43-E45 VanDerWaalsContact C-N 3.27Å; N43-E45 PolarHBondContact O-N 3.45Å; E45-L47 PolarHBondContact O-N 3.32Å
46	T	41	Very low	39.2	Very low	92 Å²	92	154.7 Å²	154.7	56%	0.564	79%	0.787	S	S	*	*			trans	-74	104.7	-179.1	-48.5	0	0	0	0	109.5	H48	T46-H48 PolarHBondContact O-CD2 3.36Å; T46-H48 PolarHBondContact O-N 2.8Å
47	L	39.4	Very low	39.3	Very low	159 Å²	159	157.6 Å²	157.6	83%	0.832	79%	0.791	S	S	*	*			trans	-69.7	101.7	174.3	-87.8	156.4	0	0	0	110.6	E45 L49	E45-L47 PolarHBondContact O-N 3.32Å; L47-L49 PolarHBondContact O-N 3.4Å; L47-L49 VanDerWaalsContact O-N 3.14Å
48	H	39.4	Very low	39.3	Very low	151 Å²	151	157.3 Å²	157.3	70%	0.699	79%	0.787	S	S	*	*			trans	-74.2	96.2	169.3	-71.2	-79.1	0	0	0	110.3	T46 H50	T46-H48 PolarHBondContact O-CD2 3.36Å; T46-H48 PolarHBondContact O-N 2.8Å; H48-H50 PolarHBondContact O-N 2.78Å; H48-H50 VanDerWaalsContact O-N 3.14Å
49	L	36.3	Very low	39.7	Very low	169 Å²	169	151.7 Å²	151.7	89%	0.885	78%	0.784	S	S	*	*			trans	-67.5	108.6	169.7	-76.3	162.1	0	0	0	109.5	L47 R51	L47-L49 PolarHBondContact O-N 3.4Å; L47-L49 VanDerWaalsContact O-N 3.14Å; L49-R51 PolarHBondContact O-N 2.84Å
50	H	33.5	Very low	40.6	Very low	184 Å²	184	154.9 Å²	154.9	85%	0.852	78%	0.784	S	S	*	*			trans	-63.6	112.9	167.7	-93.4	43.1	0	0	0	109.2	H48 E52	H48-H50 PolarHBondContact O-N 2.78Å; H48-H50 VanDerWaalsContact O-N 3.14Å; H50-E52 PolarHBondContact O-N 3.48Å
51	R	33.6	Very low	41.3	Very low	241 Å²	241	151.1 Å²	151.1	91%	0.909	77%	0.769	S	S	*	*			trans	-85.2	102.2	170.1	-170	177.4	-168.4	172.6	3.2	107.6	L49 R53	L49-R51 PolarHBondContact O-N 2.84Å; R51-R53 PolarHBondContact O-N 2.99Å
52	E	32.4	Very low	42.4	Very low	181 Å²	181	153.4 Å²	153.4	85%	0.846	77%	0.773	S	S	*	*	P	Polyproline II helix	trans	-57.8	132	165.2	-76.7	-176.7	162.4	0	0	109.2	H50	H50-E52 PolarHBondContact O-N 3.48Å
53	R	30.1	Very low	43.3	Very low	234 Å²	234	154.6 Å²	154.6	88%	0.883	77%	0.772	S	S	*	*	P	Polyproline II helix	trans	-65.8	136.4	172.2	-74	179.2	-170.4	171.3	3.3	108.1	R51 S55	R51-R53 PolarHBondContact O-N 2.99Å; R53-S55 PolarHBondContact O-N 2.82Å
54	P	35.3	Very low	44.5	Very low	120 Å²	120	152.7 Å²	152.7	78%	0.779	76%	0.758	S	S	*	*	P	Polyproline II helix	trans	-67.4	120.7	167	12.5	-2.1	0	0	0	108.2
55	S	33.7	Very low	46	Very low	100 Å²	100	149.8 Å²	149.8	70%	0.699	74%	0.742	S	S	*	*	P	Polyproline II helix	trans	-57.2	130.2	159.1	46.8	0	0	0	0	108.8	R53 E57	R53-S55 PolarHBondContact O-N 2.82Å; S55-E57 PolarHBondContact O-N 2.84Å
56	E	40.5	Very low	47.4	Very low	202 Å²	202	147.2 Å²	147.2	94%	0.944	73%	0.731	S	S	*	*			trans	-61.2	102.4	171.2	-70.3	-179.5	154.7	0	0	109.5
57	E	46.4	Very low	49	Very low	164 Å²	164	146.9 Å²	146.9	77%	0.766	73%	0.729	S	S	*	*			trans	-100.3	141.4	159.4	-73.3	-133.6	160.1	0	0	109.2	S55 G59	S55-E57 PolarHBondContact O-N 2.84Å; E57-G59 PolarHBondContact O-N 2.84Å
58	P	45.2	Very low	50.8	Low	116 Å²	116	143 Å²	143	75%	0.753	71%	0.712	S	S	*	*			trans	-63.5	109.3	-177.7	24.9	-31.2	0	0	0	109.8	W60	P58-W60 PolarHBondContact O-N 2.89Å
59	G	51.6	Low	52.8	Low	73 Å²	73	141 Å²	141	75%	0.753	71%	0.705	S	S	*	*	P	Polyproline II helix	trans	-57.8	123.8	179.6	0	0	0	0	0	111.2	E57 S61	E57-G59 PolarHBondContact O-N 2.84Å; G59-S61 PolarHBondContact O-N 3.5Å
60	W	59	Low	54.8	Low	168 Å²	168	137.3 Å²	137.3	64%	0.636	69%	0.686	S	S	*	*	P	Polyproline II helix	trans	-58.1	130.8	175.1	-70.9	42.4	0	0	0	108.7	P58 Q64 V68	P58-W60 PolarHBondContact O-N 2.89Å; W60-Q64 HydrophobicContact CB-CB 4.25Å; W60-Q64 HydrophobicContact CE3-CB 3.75Å; W60-Q64 HydrophobicContact CZ3-CB 4.49Å; W60-V68 HydrophobicContact CE3-CG2 4.21Å; W60-V68 HydrophobicContact CH2-CG2 4.45Å; W60-V68 HydrophobicContact CZ3-CG2 3.56Å
61	S	63.1	Low	57.2	Low	69 Å²	69	132.1 Å²	132.1	48%	0.483	67%	0.667	S	S	.	*	P	Polyproline II helix	trans	-54	144.2	174.2	158.3	0	0	0	0	109.5	G59 L63 Q64 L65	G59-S61 PolarHBondContact O-N 3.5Å; S61-L63 PolarHBondContact O-N 3.27Å; S61-L63 PolarHBondContact OG-N 2.95Å; S61-Q64 WeakPolarHBondContact O-CA 3.46Å; S61-Q64 WeakPolarHBondContact O-CB 3.16Å; S61-Q64 PolarHBondContact O-N 3.14Å; S61-L65 PolarHBondContact O-N 2.79Å
62	R	62.8	Low	59.6	Low	226 Å²	226	124.1 Å²	124.1	85%	0.853	65%	0.646	S	S	*	*	H	α-helix	trans	-50.6	-28.6	177.9	-62.8	-174	-146.2	-171.5	6.2	112.4	M66	R62-M66 WeakPolarHBondContact O-CG 3.48Å; R62-M66 PolarHBondContact O-N 2.99Å; R62-M66 VanDerWaalsContact O-N 3.16Å
63	L	62.5	Low	62	Low	131 Å²	131	117.9 Å²	117.9	69%	0.686	62%	0.623	S	S	*	*	H	α-helix	trans	-67.7	-40.2	175.3	-142.3	84.4	0	0	0	112.5	S61 M66 V67	S61-L63 PolarHBondContact O-N 3.27Å; S61-L63 PolarHBondContact OG-N 2.95Å; L63-M66 PolarHBondContact O-N 2.99Å; L63-V67 VanDerWaalsContact O-CG2 3.31Å; L63-V67 WeakPolarHBondContact O-CG2 3.19Å; L63-V67 PolarHBondContact O-N 2.91Å
64	Q	66.8	Low	64.8	Low	99 Å²	99	110.2 Å²	110.2	46%	0.463	60%	0.604	S	S	.	*	H	α-helix	trans	-69.7	-39.1	179.4	-64.9	175.3	-48.9	0	0	111.4	W60 S61 V67 V68	W60-Q64 HydrophobicContact CB-CB 4.25Å; W60-Q64 HydrophobicContact CE3-CB 3.75Å; W60-Q64 HydrophobicContact CZ3-CB 4.49Å; S61-Q64 WeakPolarHBondContact O-CA 3.46Å; S61-Q64 WeakPolarHBondContact O-CB 3.16Å; S61-Q64 PolarHBondContact O-N 3.14Å; Q64-V67 PolarHBondContact O-N 3.07Å; Q64-V68 VanDerWaalsContact O-CG2 3.32Å; Q64-V68 WeakPolarHBondContact O-CG2 3.41Å; Q64-V68 PolarHBondContact O-N 3.27Å
65	L	70.9	Confident	67.3	Low	97 Å²	97	110 Å²	110	51%	0.508	60%	0.596	S	S	.	*	H	α-helix	trans	-65	-40.1	175	-161.5	81.7	0	0	0	111.7	S61 V68 I69	S61-L65 PolarHBondContact O-N 2.79Å; L65-V68 PolarHBondContact O-N 2.97Å; L65-I69 HydrophobicContact CD2-CD1 4.46Å; L65-I69 HydrophobicContact CG-CD1 4.09Å; L65-I69 WeakPolarHBondContact O-CG1 3.46Å; L65-I69 PolarHBondContact O-N 3.15Å
66	M	71.1	Confident	70.1	Confident	115 Å²	115	110.8 Å²	110.8	57%	0.567	59%	0.592	S	S	*	*	H	α-helix	trans	-61.4	-45	175	-74.4	-69.2	159.4	0	0	111.3	R62 L63 I69 L70	R62-M66 WeakPolarHBondContact O-CG 3.48Å; R62-M66 PolarHBondContact O-N 2.99Å; R62-M66 VanDerWaalsContact O-N 3.16Å; L63-M66 PolarHBondContact O-N 2.99Å; M66-I69 PolarHBondContact O-N 2.92Å; M66-L70 HydrophobicContact CB-CD1 4.24Å; M66-L70 VanDerWaalsContact O-CB 3.22Å; M66-L70 WeakPolarHBondContact O-CB 3.08Å; M66-L70 PolarHBondContact O-N 3.3Å; M66-L70 HydrophobicContact SD-CD1 4.03Å
67	V	75.9	Confident	72.4	Confident	85 Å²	85	104.7 Å²	104.7	52%	0.515	57%	0.57	S	S	.	*	H	α-helix	trans	-63.4	-43.6	178.2	172.3	0	0	0	0	111.6	L63 Q64 I69 V71	L63-V67 VanDerWaalsContact O-CG2 3.31Å; L63-V67 WeakPolarHBondContact O-CG2 3.19Å; L63-V67 PolarHBondContact O-N 2.91Å; Q64-V67 PolarHBondContact O-N 3.07Å; V67-I69 VanDerWaalsContact C-N 3.26Å; V67-I69 PolarHBondContact O-N 3.31Å; V67-V71 HydrophobicContact CG1-CG2 3.9Å; V67-V71 VanDerWaalsContact O-CB 3.26Å; V67-V71 WeakPolarHBondContact O-CB 3.46Å; V67-V71 VanDerWaalsContact O-CG2 3.26Å; V67-V71 WeakPolarHBondContact O-CG2 3.48Å; V67-V71 PolarHBondContact O-N 2.86Å
68	V	77.5	Confident	74.6	Confident	78 Å²	78	100.6 Å²	100.6	47%	0.473	56%	0.556	S	S	.	*	H	α-helix	trans	-66	-26.4	-179.2	172.8	0	0	0	0	113	W60 Q64 L65 P72	W60-V68 HydrophobicContact CE3-CG2 4.21Å; W60-V68 HydrophobicContact CH2-CG2 4.45Å; W60-V68 HydrophobicContact CZ3-CG2 3.56Å; Q64-V68 VanDerWaalsContact O-CG2 3.32Å; Q64-V68 WeakPolarHBondContact O-CG2 3.41Å; Q64-V68 PolarHBondContact O-N 3.27Å; L65-V68 PolarHBondContact O-N 2.97Å; V68-P72 WeakPolarHBondContact O-CD 3.39Å; V68-P72 WeakPolarHBondContact O-CG 3.4Å
69	I	80	Confident	76.8	Confident	108 Å²	108	97 Å²	97	55%	0.554	54%	0.541	S	S	*	.	H	α-helix	trans	-95.3	-43.4	179.7	-61.4	171	0	0	0	111.5	L65 M66 V67 S73	L65-I69 HydrophobicContact CD2-CD1 4.46Å; L65-I69 HydrophobicContact CG-CD1 4.09Å; L65-I69 WeakPolarHBondContact O-CG1 3.46Å; L65-I69 PolarHBondContact O-N 3.15Å; M66-I69 PolarHBondContact O-N 2.92Å; V67-I69 VanDerWaalsContact C-N 3.26Å; V67-I69 PolarHBondContact O-N 3.31Å; I69-S73 WeakPolarHBondContact O-CB 3.41Å; I69-S73 PolarHBondContact O-N 3.48Å; I69-S73 PolarHBondContact O-OG 3.38Å
70	L	79.6	Confident	78.7	Confident	93 Å²	93	98.3 Å²	98.3	49%	0.487	53%	0.53	S	S	.	.	H	α-helix	trans	-73	-36.8	-176.7	-85.8	147.8	0	0	0	112.6	M66 S73 C74	M66-L70 HydrophobicContact CB-CD1 4.24Å; M66-L70 VanDerWaalsContact O-CB 3.22Å; M66-L70 WeakPolarHBondContact O-CB 3.08Å; M66-L70 PolarHBondContact O-N 3.3Å; M66-L70 HydrophobicContact SD-CD1 4.03Å; L70-S73 WeakPolarHBondContact CA-OG 3.49Å; L70-S73 PolarHBondContact O-OG 3.28Å; L70-S73 VanDerWaalsContact O-OG 3.05Å; L70-C74 VanDerWaalsContact O-CB 3.26Å; L70-C74 WeakPolarHBondContact O-CB 3.01Å; L70-C74 PolarHBondContact O-N 2.88Å; L70-C74 PolarHBondContact O-SG 3.33Å
71	V	83.1	Confident	80.2	Confident	75 Å²	75	95.8 Å²	95.8	46%	0.455	53%	0.528	S	S	.	.	H	α-helix	trans	-67.7	-48.8	-177.2	175.3	0	0	0	0	111.6	V67 S73 C74 L75	V67-V71 HydrophobicContact CG1-CG2 3.9Å; V67-V71 VanDerWaalsContact O-CB 3.26Å; V67-V71 WeakPolarHBondContact O-CB 3.46Å; V67-V71 VanDerWaalsContact O-CG2 3.26Å; V67-V71 WeakPolarHBondContact O-CG2 3.48Å; V67-V71 PolarHBondContact O-N 2.86Å; V71-S73 PolarHBondContact O-N 2.8Å; V71-C74 PolarHBondContact O-N 3.34Å; V71-L75 HydrophobicContact CG1-CD1 4.01Å; V71-L75 HydrophobicContact CG1-CG 4.5Å; V71-L75 VanDerWaalsContact O-CG 3.28Å; V71-L75 WeakPolarHBondContact O-CG 3.45Å; V71-L75 PolarHBondContact O-N 2.88Å
72	P	84.8	Confident	81.5	Confident	72 Å²	72	97.6 Å²	97.6	47%	0.468	53%	0.531	S	S	.	.	H	α-helix	trans	-66.9	-35.6	177.9	-22.3	35.6	0	0	0	113.1	V68 L75 L76	V68-P72 WeakPolarHBondContact O-CD 3.39Å; V68-P72 WeakPolarHBondContact O-CG 3.4Å; P72-L75 PolarHBondContact O-N 3.48Å; P72-L76 WeakPolarHBondContact O-CB 3.17Å; P72-L76 PolarHBondContact O-N 3.48Å
73	S	83.2	Confident	82.8	Confident	51 Å²	51	88.5 Å²	88.5	36%	0.357	51%	0.508	S	S	.	.	H	α-helix	trans	-68.9	-39.6	177.2	54.8	0	0	0	0	112.3	I69 L70 V71 L76 C77	I69-S73 WeakPolarHBondContact O-CB 3.41Å; I69-S73 PolarHBondContact O-N 3.48Å; I69-S73 PolarHBondContact O-OG 3.38Å; L70-S73 WeakPolarHBondContact CA-OG 3.49Å; L70-S73 PolarHBondContact O-OG 3.28Å; L70-S73 VanDerWaalsContact O-OG 3.05Å; V71-S73 PolarHBondContact O-N 2.8Å; S73-L76 PolarHBondContact O-N 2.86Å; S73-C77 WeakPolarHBondContact O-CB 3.47Å; S73-C77 PolarHBondContact O-N 3.31Å; S73-C77 PolarHBondContact O-SG 3.3Å
74	C	87.3	Confident	84	Confident	72 Å²	72	85.4 Å²	85.4	49%	0.486	50%	0.495	S	S	.	.	H	α-helix	trans	-62.9	-43.4	171.3	-83.4	0	0	0	0	112	L70 V71 L76 C77 V78	L70-C74 VanDerWaalsContact O-CB 3.26Å; L70-C74 WeakPolarHBondContact O-CB 3.01Å; L70-C74 PolarHBondContact O-N 2.88Å; L70-C74 PolarHBondContact O-SG 3.33Å; V71-C74 PolarHBondContact O-N 3.34Å; C74-L76 VanDerWaalsContact C-N 3.33Å; C74-L76 PolarHBondContact O-N 3.48Å; C74-C77 PolarHBondContact O-N 3.47Å; C74-V78 VanDerWaalsContact O-CG2 3.31Å; C74-V78 WeakPolarHBondContact O-CG2 3.3Å; C74-V78 PolarHBondContact O-N 2.97Å
75	L	89.6	Confident	85	Confident	117 Å²	117	84.4 Å²	84.4	61%	0.613	50%	0.498	S	S	*	.	H	α-helix	trans	-63.5	-38.6	177	-70.4	172.3	0	0	0	112	V71 P72 V78 G79	V71-L75 HydrophobicContact CG1-CD1 4.01Å; V71-L75 HydrophobicContact CG1-CG 4.5Å; V71-L75 VanDerWaalsContact O-CG 3.28Å; V71-L75 WeakPolarHBondContact O-CG 3.45Å; V71-L75 PolarHBondContact O-N 2.88Å; P72-L75 PolarHBondContact O-N 3.48Å; L75-V78 PolarHBondContact O-N 3.16Å; L75-G79 PolarHBondContact O-N 3.08Å
76	L	91.3	Very high	85.9	Confident	116 Å²	116	84 Å²	84	61%	0.607	50%	0.499	S	S	*	.	H	α-helix	trans	-63.9	-45.6	174.2	-173.2	73.6	0	0	0	111.4	P72 S73 C74 V78 G79 I80	P72-L76 WeakPolarHBondContact O-CB 3.17Å; P72-L76 PolarHBondContact O-N 3.48Å; S73-L76 PolarHBondContact O-N 2.86Å; C74-L76 VanDerWaalsContact C-N 3.33Å; C74-L76 PolarHBondContact O-N 3.48Å; L76-V78 PolarHBondContact O-N 3.07Å; L76-G79 PolarHBondContact O-N 2.93Å; L76-I80 HydrophobicContact CG-CD1 4.14Å; L76-I80 WeakPolarHBondContact O-CG1 3.28Å; L76-I80 PolarHBondContact O-N 2.91Å
77	C	89.7	Confident	86.6	Confident	73 Å²	73	82.7 Å²	82.7	49%	0.493	50%	0.497	S	S	.	.	H	α-helix	trans	-61.5	-42.5	177	-74.1	0	0	0	0	112.1	S73 C74 I80 L81	S73-C77 WeakPolarHBondContact O-CB 3.47Å; S73-C77 PolarHBondContact O-N 3.31Å; S73-C77 PolarHBondContact O-SG 3.3Å; C74-C77 PolarHBondContact O-N 3.47Å; C77-I80 PolarHBondContact O-N 2.93Å; C77-L81 WeakPolarHBondContact O-CB 3.3Å; C77-L81 WeakPolarHBondContact O-CG 3.43Å; C77-L81 PolarHBondContact O-N 2.77Å
78	V	91.9	Very high	86.8	Confident	78 Å²	78	84.4 Å²	84.4	47%	0.473	50%	0.5	S	S	.	.	H	α-helix	trans	-64.3	-41.6	175	172.7	0	0	0	0	110.8	C74 L75 L76 I80 L81 L82	C74-V78 VanDerWaalsContact O-CG2 3.31Å; C74-V78 WeakPolarHBondContact O-CG2 3.3Å; C74-V78 PolarHBondContact O-N 2.97Å; L75-V78 PolarHBondContact O-N 3.16Å; L76-V78 PolarHBondContact O-N 3.07Å; V78-I80 PolarHBondContact O-N 2.77Å; V78-L81 PolarHBondContact O-N 3.1Å; V78-L82 HydrophobicContact CG1-CD1 3.91Å; V78-L82 HydrophobicContact CG1-CG 4.32Å; V78-L82 WeakPolarHBondContact O-CB 3.29Å; V78-L82 VanDerWaalsContact O-CG 3.3Å; V78-L82 WeakPolarHBondContact O-CG 3.43Å; V78-L82 PolarHBondContact O-N 2.82Å
79	G	91.1	Very high	86.9	Confident	42 Å²	42	82.5 Å²	82.5	43%	0.433	50%	0.496	S	S	.	.	H	α-helix	trans	-60.4	-42.5	174.9	0	0	0	0	0	113.1	L75 L76 L82 G83	L75-G79 PolarHBondContact O-N 3.08Å; L76-G79 PolarHBondContact O-N 2.93Å; G79-L82 PolarHBondContact O-N 3.46Å; G79-G83 PolarHBondContact O-N 3.29Å
80	I	91.1	Very high	86.7	Confident	100 Å²	100	84 Å²	84	51%	0.513	50%	0.5	S	S	.	.	H	α-helix	trans	-65.2	-45.3	176	-67.5	166.6	0	0	0	110.6	L76 C77 V78 L82 G83 V84	L76-I80 HydrophobicContact CG-CD1 4.14Å; L76-I80 WeakPolarHBondContact O-CG1 3.28Å; L76-I80 PolarHBondContact O-N 2.91Å; C77-I80 PolarHBondContact O-N 2.93Å; V78-I80 PolarHBondContact O-N 2.77Å; I80-L82 PolarHBondContact O-N 3.06Å; I80-G83 PolarHBondContact O-N 2.96Å; I80-V84 HydrophobicContact CG2-CG2 4.47Å; I80-V84 WeakPolarHBondContact O-CG2 3.31Å; I80-V84 PolarHBondContact O-N 2.82Å
81	L	90.4	Very high	86.3	Confident	114 Å²	114	88.9 Å²	88.9	60%	0.597	51%	0.512	S	S	*	.	H	α-helix	trans	-62	-43.1	177.9	-74.5	169.1	0	0	0	111.7	C77 V78 V84 C85	C77-L81 WeakPolarHBondContact O-CB 3.3Å; C77-L81 WeakPolarHBondContact O-CG 3.43Å; C77-L81 PolarHBondContact O-N 2.77Å; V78-L81 PolarHBondContact O-N 3.1Å; L81-V84 PolarHBondContact O-N 3.45Å; L81-C85 WeakPolarHBondContact O-CB 3.29Å; L81-C85 PolarHBondContact O-N 2.83Å; L81-C85 PolarHBondContact O-SG 2.84Å
82	L	90.1	Very high	85.7	Confident	107 Å²	107	88.9 Å²	88.9	56%	0.56	52%	0.515	S	S	*	.	H	α-helix	trans	-63.7	-41.7	174.8	-71.7	172.6	0	0	0	111.5	V78 G79 I80 V84 C85 V86	V78-L82 HydrophobicContact CG1-CD1 3.91Å; V78-L82 HydrophobicContact CG1-CG 4.32Å; V78-L82 WeakPolarHBondContact O-CB 3.29Å; V78-L82 VanDerWaalsContact O-CG 3.3Å; V78-L82 WeakPolarHBondContact O-CG 3.43Å; V78-L82 PolarHBondContact O-N 2.82Å; G79-L82 PolarHBondContact O-N 3.46Å; I80-L82 PolarHBondContact O-N 3.06Å; L82-V84 PolarHBondContact O-N 2.94Å; L82-C85 PolarHBondContact O-N 2.88Å; L82-V86 VanDerWaalsContact O-CG2 3.29Å; L82-V86 WeakPolarHBondContact O-CG2 3.3Å; L82-V86 PolarHBondContact O-N 3.18Å
83	G	90.3	Very high	84.9	Confident	36 Å²	36	88.2 Å²	88.2	37%	0.371	52%	0.516	S	S	.	.	H	α-helix	trans	-60	-43.8	174.2	0	0	0	0	0	112.6	G79 I80 V86 V87	G79-G83 PolarHBondContact O-N 3.29Å; I80-G83 PolarHBondContact O-N 2.96Å; G83-V86 PolarHBondContact O-N 2.88Å; G83-V87 WeakPolarHBondContact O-CB 3.49Å; G83-V87 VanDerWaalsContact O-CG2 3.29Å; G83-V87 WeakPolarHBondContact O-CG2 3.49Å; G83-V87 PolarHBondContact O-N 3.23Å
84	V	89.2	Confident	83.9	Confident	65 Å²	65	94.4 Å²	94.4	39%	0.394	53%	0.532	S	S	.	.	H	α-helix	trans	-64.2	-43.6	175.2	173	0	0	0	0	111	I80 L81 L82 V86 V87 Q88	I80-V84 HydrophobicContact CG2-CG2 4.47Å; I80-V84 WeakPolarHBondContact O-CG2 3.31Å; I80-V84 PolarHBondContact O-N 2.82Å; L81-V84 PolarHBondContact O-N 3.45Å; L82-V84 PolarHBondContact O-N 2.94Å; V84-V86 PolarHBondContact O-N 2.85Å; V84-V87 PolarHBondContact O-N 3.48Å; V84-Q88 HydrophobicContact CG1-CG 4.23Å; V84-Q88 VanDerWaalsContact O-CB 3.3Å; V84-Q88 WeakPolarHBondContact O-CB 3.22Å; V84-Q88 VanDerWaalsContact O-CG 3.3Å; V84-Q88 WeakPolarHBondContact O-CG 3.36Å; V84-Q88 PolarHBondContact O-N 2.94Å
85	C	87.5	Confident	82.4	Confident	78 Å²	78	92.8 Å²	92.8	53%	0.527	53%	0.528	S	S	.	.	H	α-helix	trans	-63	-39.4	176.5	-73.1	0	0	0	0	112.4	L81 L82 G89	L81-C85 WeakPolarHBondContact O-CB 3.29Å; L81-C85 PolarHBondContact O-N 2.83Å; L81-C85 PolarHBondContact O-SG 2.84Å; L82-C85 PolarHBondContact O-N 2.88Å; C85-G89 WeakPolarHBondContact O-CA 3.33Å; C85-G89 PolarHBondContact O-N 3.36Å
86	V	88.9	Confident	80.8	Confident	89 Å²	89	96.1 Å²	96.1	54%	0.539	53%	0.532	S	S	.	.	H	α-helix	trans	-67.7	-43.5	175.9	170.8	0	0	0	0	110.8	L82 G83 V84 G89 H90	L82-V86 VanDerWaalsContact O-CG2 3.29Å; L82-V86 WeakPolarHBondContact O-CG2 3.3Å; L82-V86 PolarHBondContact O-N 3.18Å; G83-V86 PolarHBondContact O-N 2.88Å; V84-V86 PolarHBondContact O-N 2.85Å; V86-G89 PolarHBondContact O-N 3.22Å; V86-H90 WeakPolarHBondContact O-CB 3.37Å; V86-H90 PolarHBondContact O-N 2.9Å
87	V	86.2	Confident	78.9	Confident	87 Å²	87	94.4 Å²	94.4	53%	0.527	54%	0.535	S	S	.	.	H	α-helix	trans	-65.4	-43.6	176.9	171	0	0	0	0	111.1	G83 V84 H90 R91	G83-V87 WeakPolarHBondContact O-CB 3.49Å; G83-V87 VanDerWaalsContact O-CG2 3.29Å; G83-V87 WeakPolarHBondContact O-CG2 3.49Å; G83-V87 PolarHBondContact O-N 3.23Å; V84-V87 PolarHBondContact O-N 3.48Å; V87-H90 PolarHBondContact O-N 2.91Å; V87-R91 WeakPolarHBondContact O-CB 3.46Å; V87-R91 VanDerWaalsContact O-CG 3.28Å; V87-R91 WeakPolarHBondContact O-CG 3.33Å; V87-R91 PolarHBondContact O-N 3.47Å
88	Q	80.9	Confident	77.1	Confident	122 Å²	122	98.4 Å²	98.4	57%	0.57	55%	0.546	S	S	*	.	H	α-helix	trans	-66.1	-39.5	175.5	-74.5	179.8	-4.3	0	0	111.6	V84 R91 C92	V84-Q88 HydrophobicContact CG1-CG 4.23Å; V84-Q88 VanDerWaalsContact O-CB 3.3Å; V84-Q88 WeakPolarHBondContact O-CB 3.22Å; V84-Q88 VanDerWaalsContact O-CG 3.3Å; V84-Q88 WeakPolarHBondContact O-CG 3.36Å; V84-Q88 PolarHBondContact O-N 2.94Å; Q88-R91 PolarHBondContact O-N 3.46Å; Q88-C92 VanDerWaalsContact O-CB 3.25Å; Q88-C92 WeakPolarHBondContact O-CB 3.44Å; Q88-C92 PolarHBondContact O-N 3.29Å
89	G	79	Confident	75	Confident	38 Å²	38	103.4 Å²	103.4	39%	0.392	56%	0.561	S	S	.	*	H	α-helix	trans	-61.3	-44.8	173.3	0	0	0	0	0	112	C85 V86 C92 A93	C85-G89 WeakPolarHBondContact O-CA 3.33Å; C85-G89 PolarHBondContact O-N 3.36Å; V86-G89 PolarHBondContact O-N 3.22Å; G89-C92 PolarHBondContact O-N 2.95Å; G89-A93 VanDerWaalsContact O-CB 3.24Å; G89-A93 WeakPolarHBondContact O-CB 3.46Å; G89-A93 PolarHBondContact O-N 2.98Å
90	H	74.9	Confident	72.4	Confident	139 Å²	139	109 Å²	109	64%	0.644	58%	0.576	S	S	*	*	H	α-helix	trans	-63.9	-42.6	173.1	-97.9	-84.9	0	0	0	112.1	V86 V87 C92 A93 Y94	V86-H90 WeakPolarHBondContact O-CB 3.37Å; V86-H90 PolarHBondContact O-N 2.9Å; V87-H90 PolarHBondContact O-N 2.91Å; H90-C92 VanDerWaalsContact C-N 3.31Å; H90-C92 PolarHBondContact O-N 3.46Å; H90-A93 PolarHBondContact O-N 3.4Å; H90-Y94 WeakPolarHBondContact O-CB 3.35Å; H90-Y94 PolarHBondContact O-N 3.42Å
91	R	71.4	Confident	69.9	Low	195 Å²	195	111.2 Å²	111.2	74%	0.736	59%	0.589	S	S	*	*	H	α-helix	trans	-65.2	-35.3	175.9	-71.3	-178.8	91.5	168.3	7.6	112	V87 Q88 G95	V87-R91 WeakPolarHBondContact O-CB 3.46Å; V87-R91 VanDerWaalsContact O-CG 3.28Å; V87-R91 WeakPolarHBondContact O-CG 3.33Å; V87-R91 PolarHBondContact O-N 3.47Å; Q88-R91 PolarHBondContact O-N 3.46Å; R91-G95 PolarHBondContact O-N 3.45Å
92	C	71	Confident	67.8	Low	75 Å²	75	111 Å²	111	51%	0.507	59%	0.594	S	S	.	*	H	α-helix	trans	-76.4	-37.5	178	-154.9	0	0	0	0	111.9	Q88 G89 H90 G95 R96	Q88-C92 VanDerWaalsContact O-CB 3.25Å; Q88-C92 WeakPolarHBondContact O-CB 3.44Å; Q88-C92 PolarHBondContact O-N 3.29Å; G89-C92 PolarHBondContact O-N 2.95Å; H90-C92 VanDerWaalsContact C-N 3.31Å; H90-C92 PolarHBondContact O-N 3.46Å; C92-G95 CarbonylContact O-C 3.51Å; C92-G95 PolarHBondContact O-N 2.81Å; C92-R96 WeakPolarHBondContact O-CB 3.49Å; C92-R96 PolarHBondContact O-N 2.9Å
93	A	68.8	Low	65.5	Low	59 Å²	59	115.2 Å²	115.2	49%	0.488	61%	0.611	S	S	.	*	H	α-helix	trans	-66.8	-41.7	171.9	0	0	0	0	0	111.4	G89 H90 G95 R96 A97	G89-A93 VanDerWaalsContact O-CB 3.24Å; G89-A93 WeakPolarHBondContact O-CB 3.46Å; G89-A93 PolarHBondContact O-N 2.98Å; H90-A93 PolarHBondContact O-N 3.4Å; A93-G95 VanDerWaalsContact C-N 3.34Å; A93-R96 PolarHBondContact O-N 2.9Å; A93-A97 VanDerWaalsContact O-CB 3.31Å; A93-A97 WeakPolarHBondContact O-CB 3.34Å; A93-A97 PolarHBondContact O-N 3.01Å
94	Y	60.5	Low	62.5	Low	180 Å²	180	121.2 Å²	121.2	71%	0.706	63%	0.629	S	S	*	*	H	α-helix	trans	-63.7	-40.7	172.1	-157	-93.2	0	0	0	111	H90 R96 H98	H90-Y94 WeakPolarHBondContact O-CB 3.35Å; H90-Y94 PolarHBondContact O-N 3.42Å; Y94-R96 VanDerWaalsContact C-N 3.34Å; Y94-R96 PolarHBondContact O-N 3.08Å; Y94-H98 WeakPolarHBondContact O-CB 3.49Å; Y94-H98 PolarHBondContact O-N 2.67Å; Y94-H98 VanDerWaalsContact O-N 3.17Å
95	G	56.8	Low	59.9	Low	38 Å²	38	124.1 Å²	124.1	39%	0.392	65%	0.65	S	S	.	*	H	α-helix	trans	-69.6	-24.6	174.9	0	0	0	0	0	114.8	R91 C92 A93	R91-G95 PolarHBondContact O-N 3.45Å; C92-G95 CarbonylContact O-C 3.51Å; C92-G95 PolarHBondContact O-N 2.81Å; A93-G95 VanDerWaalsContact C-N 3.34Å
96	R	54.9	Low	57.4	Low	188 Å²	188	127.9 Å²	127.9	71%	0.709	66%	0.664	S	S	*	*	H	α-helix	trans	-86.2	-37.9	174	-84.8	-178.8	173.4	164.9	-1.4	112.6	C92 A93 Y94 H98 K99	C92-R96 WeakPolarHBondContact O-CB 3.49Å; C92-R96 PolarHBondContact O-N 2.9Å; A93-R96 PolarHBondContact O-N 2.9Å; Y94-R96 VanDerWaalsContact C-N 3.34Å; Y94-R96 PolarHBondContact O-N 3.08Å; R96-H98 PolarHBondContact O-N 2.82Å; R96-K99 PolarHBondContact O-N 3.37Å
97	A	52.7	Low	54.8	Low	80 Å²	80	130.8 Å²	130.8	66%	0.661	68%	0.676	S	S	*	*	H	α-helix	trans	-64.5	-22.9	172.9	0	0	0	0	0	112.4	A93	A93-A97 VanDerWaalsContact O-CB 3.31Å; A93-A97 WeakPolarHBondContact O-CB 3.34Å; A93-A97 PolarHBondContact O-N 3.01Å
98	H	51.9	Low	52.5	Low	157 Å²	157	134.9 Å²	134.9	73%	0.727	70%	0.695	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90.3	6	174	-138.4	-40.4	0	0	0	114.1	Y94 R96	Y94-H98 WeakPolarHBondContact O-CB 3.49Å; Y94-H98 PolarHBondContact O-N 2.67Å; Y94-H98 VanDerWaalsContact O-N 3.17Å; R96-H98 PolarHBondContact O-N 2.82Å
99	K	46.8	Very low	50.5	Low	183 Å²	183	137 Å²	137	80%	0.796	71%	0.705	S	S	*	*	S	Bend	trans	-117.4	7.3	-174.2	-115.8	-177.6	179.9	-175.8	0	115.5	R96	R96-K99 PolarHBondContact O-N 3.37Å
100	Q	36	Very low	48.5	Very low	158 Å²	158	143.7 Å²	143.7	74%	0.738	73%	0.729	S	S	*	*	S	Bend	trans	-137.2	94.9	171	-77.5	176.2	-50.8	0	0	105.8
101	D	40.1	Very low	46.9	Very low	148 Å²	148	144.1 Å²	144.1	79%	0.791	74%	0.735	S	S	*	*				133.7	171.1	85.7	-94.5	-29.3	0	0	0	104.4
102	P	44.9	Very low	45.4	Very low	108 Å²	108	139.1 Å²	139.1	70%	0.701	72%	0.721	S	S	*	*				-115.3	178.4	-52.5	30.1	-11.7	0	0	0	110.3	E104	P102-E104 PolarHBondContact O-N 3.21Å
103	E	41.8	Very low	44	Very low	196 Å²	196	138.5 Å²	138.5	92%	0.916	72%	0.717	S	S	*	*			trans	-54	107	164.8	-64.1	179.7	144.4	0	0	110.8
104	E	28.2	Very low	42.9	Very low	162 Å²	162	141.9 Å²	141.9	76%	0.757	73%	0.734	S	S	*	*			trans	-98.7	125.9	155.4	-90.3	-169.2	156.8	0	0	108	P102 L106	P102-E104 PolarHBondContact O-N 3.21Å; E104-L106 PolarHBondContact O-N 3.46Å
105	P	35.4	Very low	42.4	Very low	126 Å²	126	140.3 Å²	140.3	82%	0.818	74%	0.738	S	S	*	*			trans	-69.3	102.9	168.1	28.7	-27.6	0	0	0	106.8	D107	P105-D107 PolarHBondContact O-N 3Å
106	L	35.1	Very low	41.9	Very low	157 Å²	157	143.1 Å²	143.1	82%	0.822	74%	0.74	S	S	*	*			trans	-60.4	119.9	171.2	-80.4	157.6	0	0	0	108.2	E104 D108	E104-L106 PolarHBondContact O-N 3.46Å; L106-D108 PolarHBondContact O-N 3.16Å; L106-D108 VanDerWaalsContact O-N 3.12Å
107	D	32.8	Very low	42.3	Very low	151 Å²	151	136.7 Å²	136.7	81%	0.807	72%	0.723	S	S	*	*			trans	-45.7	114.9	171.9	-109.3	-26	0	0	0	110.2	P105 Q109	P105-D107 PolarHBondContact O-N 3Å; D107-Q109 PolarHBondContact O-N 3.31Å
108	D	39.2	Very low	42.7	Very low	173 Å²	173	134 Å²	134	93%	0.925	70%	0.697	S	S	*	*	S	Bend	trans	-75.7	24.3	-173.7	-128.7	-6.1	0	0	0	112.5	L106	L106-D108 PolarHBondContact O-N 3.16Å; L106-D108 VanDerWaalsContact O-N 3.12Å
109	Q	39	Very low	43.1	Very low	166 Å²	166	133.4 Å²	133.4	78%	0.776	69%	0.692	S	S	*	*			trans	-130.9	33	-158.8	-147.2	158.6	19.7	0	0	116	D107	D107-Q109 PolarHBondContact O-N 3.31Å
110	M	35.9	Very low	43.6	Very low	179 Å²	179	127.9 Å²	127.9	88%	0.882	67%	0.671	S	S	*	*	S	Bend	trans	-143.7	77.6	162	-74.6	-162.8	94.6	0	0	112.2
111	L	42	Very low	44.8	Very low	147 Å²	147	122.2 Å²	122.2	77%	0.77	65%	0.646	S	S	*	*	S	Bend	trans	-158.4	-6.6	154.1	-114.3	137.6	0	0	0	115.9
112	M	39.2	Very low	45.8	Very low	91 Å²	91	116.6 Å²	116.6	45%	0.448	62%	0.616	S	S	.	*			trans	-115.4	126.9	178.8	-65.9	-73.2	103.6	0	0	110.9	L121	M112-L121 HydrophobicContact CE-CD1 3.41Å; M112-L121 VanDerWaalsContact CE-CD1 3.41Å; M112-L121 HydrophobicContact CE-CD2 3.66Å; M112-L121 HydrophobicContact CE-CG 4.12Å; M112-L121 HydrophobicContact SD-CD1 3.86Å
113	S	42.8	Very low	46.4	Very low	62 Å²	62	118.2 Å²	118.2	43%	0.434	61%	0.609	S	S	.	*			trans	-71	141.8	146.9	38.9	0	0	0	0	106.7	D115	S113-D115 PolarHBondContact O-N 3.37Å
114	P	44.5	Very low	46.9	Very low	129 Å²	129	112.5 Å²	112.5	84%	0.838	59%	0.585	S	S	*	*	T	Hydrogen-bonded Turn	trans	-57.3	-8.6	-175.3	-24.4	32.8	0	0	0	115.9
115	D	49.4	Very low	47.8	Very low	148 Å²	148	109.6 Å²	109.6	79%	0.791	57%	0.572	S	S	*	*	T	Hydrogen-bonded Turn	trans	-111.1	5.1	-165.9	-60.7	-39.9	0	0	0	114.9	S113	S113-D115 PolarHBondContact O-N 3.37Å
116	K	47.3	Very low	48.5	Very low	97 Å²	97	105.1 Å²	105.1	42%	0.422	54%	0.544	S	S	.	.			trans	-112.7	127.1	-177.5	-69.3	-164.2	173.2	-161.8	0	113.2	D124	K116-D124 IonicContact NZ-OD2 2.79Å; K116-D124 PolarHBondContact NZ-OD2 2.79Å
117	C	62.4	Low	48.9	Very low	53 Å²	53	101.7 Å²	101.7	36%	0.358	53%	0.53	S	S	.	.			trans	-84.5	157.4	174	179.9	0	0	0	0	110.8	K119 D120 L121	C117-K119 PolarHBondContact O-N 2.82Å; C117-K119 VanDerWaalsContact O-N 3.08Å; C117-D120 WeakPolarHBondContact CB-OD2 3.26Å; C117-D120 PolarHBondContact N-OD2 2.72Å; C117-D120 WeakPolarHBondContact O-CA 3.28Å; C117-D120 WeakPolarHBondContact O-CB 3.26Å; C117-D120 PolarHBondContact O-N 3.17Å; C117-L121 PolarHBondContact O-N 3.14Å
118	L	62.8	Low	49.5	Very low	22 Å²	22	98.1 Å²	98.1	12%	0.115	52%	0.516	C	S	.	.	H	α-helix	trans	-50.1	-35.8	172.9	175.3	61	0	0	0	112.7	D120 L121 I122 W165 E168 V170 I204	L118-D120 VanDerWaalsContact C-N 3.27Å; L118-D120 PolarHBondContact O-N 3.09Å; L118-L121 PolarHBondContact O-N 2.8Å; L118-I122 HydrophobicContact CD1-CD1 4.04Å; L118-I122 HydrophobicContact CD1-CG1 4.17Å; L118-I122 HydrophobicContact CD2-CD1 4.49Å; L118-I122 HydrophobicContact CG-CD1 3.88Å; L118-I122 HydrophobicContact CG-CG1 4.45Å; L118-I122 VanDerWaalsContact O-CG1 3.29Å; L118-I122 WeakPolarHBondContact O-CG1 3.33Å; L118-I122 PolarHBondContact O-N 2.84Å; L118-W165 HydrophobicContact CD1-CE3 3.83Å; L118-W165 HydrophobicContact CD1-CH2 4.06Å; L118-W165 HydrophobicContact CD1-CZ3 3.33Å; L118-W165 HydrophobicContact CD2-CE3 3.89Å; L118-W165 HydrophobicContact CD2-CZ3 4.14Å; L118-W165 HydrophobicContact CG-CZ3 4.36Å; L118-E168 HydrophobicContact CB-CB 4.31Å; L118-E168 HydrophobicContact CB-CG 3.85Å; L118-E168 HydrophobicContact CD2-CB 3.92Å; L118-E168 HydrophobicContact CD2-CG 4.41Å; L118-V170 HydrophobicContact CD2-CG1 4.37Å; L118-I204 HydrophobicContact CD2-CD1 4.49Å
119	K	58.7	Low	49.6	Very low	145 Å²	145	93.4 Å²	93.4	63%	0.63	51%	0.509	S	S	*	.	H	α-helix	trans	-59.2	-37.9	175.1	-171.1	-179.2	176	-169.7	0	112.4	C117 Y123	C117-K119 PolarHBondContact O-N 2.82Å; C117-K119 VanDerWaalsContact O-N 3.08Å; K119-Y123 VanDerWaalsContact O-CB 3.28Å; K119-Y123 WeakPolarHBondContact O-CB 3.26Å; K119-Y123 PolarHBondContact O-N 2.79Å
120	D	58.6	Low	49.9	Very low	67 Å²	67	89 Å²	89	36%	0.358	50%	0.497	S	S	.	.	H	α-helix	trans	-74.6	-37.1	-179.8	-54.3	-39.9	0	0	0	110.9	C117 L118 Y123 D124	C117-D120 WeakPolarHBondContact CB-OD2 3.26Å; C117-D120 PolarHBondContact N-OD2 2.72Å; C117-D120 WeakPolarHBondContact O-CA 3.28Å; C117-D120 WeakPolarHBondContact O-CB 3.26Å; C117-D120 PolarHBondContact O-N 3.17Å; L118-D120 VanDerWaalsContact C-N 3.27Å; L118-D120 PolarHBondContact O-N 3.09Å; D120-Y123 PolarHBondContact O-N 3.23Å; D120-D124 VanDerWaalsContact O-CB 3.26Å; D120-D124 WeakPolarHBondContact O-CB 3.44Å; D120-D124 VanDerWaalsContact O-CG 3.24Å; D120-D124 PolarHBondContact O-N 2.79Å
121	L	60.4	Low	50.2	Low	40 Å²	40	81.3 Å²	81.3	21%	0.209	46%	0.463	C	S	.	.	H	α-helix	trans	-63	-44.8	172.7	-74.5	131.2	0	0	0	112	M112 C117 L118 Y123 M125	M112-L121 HydrophobicContact CE-CD1 3.41Å; M112-L121 VanDerWaalsContact CE-CD1 3.41Å; M112-L121 HydrophobicContact CE-CD2 3.66Å; M112-L121 HydrophobicContact CE-CG 4.12Å; M112-L121 HydrophobicContact SD-CD1 3.86Å; C117-L121 PolarHBondContact O-N 3.14Å; L118-L121 PolarHBondContact O-N 2.8Å; L121-Y123 VanDerWaalsContact C-N 3.29Å; L121-Y123 PolarHBondContact O-N 2.83Å; L121-M125 WeakPolarHBondContact O-CB 3.22Å; L121-M125 WeakPolarHBondContact O-CG 3.1Å; L121-M125 PolarHBondContact O-N 2.88Å; L121-M125 VanDerWaalsContact O-N 3.16Å
122	I	62.3	Low	50.6	Low	29 Å²	29	76.8 Å²	76.8	15%	0.149	44%	0.443	C	S	.	.	H	α-helix	trans	-65.2	-37.6	177	-62.7	166.3	0	0	0	110.3	L118 S126 R196 I204	L118-I122 HydrophobicContact CD1-CD1 4.04Å; L118-I122 HydrophobicContact CD1-CG1 4.17Å; L118-I122 HydrophobicContact CD2-CD1 4.49Å; L118-I122 HydrophobicContact CG-CD1 3.88Å; L118-I122 HydrophobicContact CG-CG1 4.45Å; L118-I122 VanDerWaalsContact O-CG1 3.29Å; L118-I122 WeakPolarHBondContact O-CG1 3.33Å; L118-I122 PolarHBondContact O-N 2.84Å; I122-S126 PolarHBondContact O-N 2.81Å; I122-S126 PolarHBondContact O-OG 3.44Å; I122-R196 VanDerWaalsContact CG2-NH2 3.34Å; I122-I204 HydrophobicContact CD1-CD1 4.37Å; I122-I204 HydrophobicContact CD1-CG1 4.05Å
123	Y	56.5	Low	50.6	Low	143 Å²	143	73.9 Å²	73.9	56%	0.561	44%	0.437	S	S	*	.	H	α-helix	trans	-71.7	-45.9	179.7	-165.5	-96.5	0	0	0	112.8	K119 D120 L121 M125 S126 T127	K119-Y123 VanDerWaalsContact O-CB 3.28Å; K119-Y123 WeakPolarHBondContact O-CB 3.26Å; K119-Y123 PolarHBondContact O-N 2.79Å; D120-Y123 PolarHBondContact O-N 3.23Å; L121-Y123 VanDerWaalsContact C-N 3.29Å; L121-Y123 PolarHBondContact O-N 2.83Å; Y123-M125 PolarHBondContact O-N 3.33Å; Y123-S126 WeakPolarHBondContact CA-OG 3.49Å; Y123-S126 PolarHBondContact O-N 2.99Å; Y123-S126 PolarHBondContact O-OG 2.87Å; Y123-T127 HydrophobicContact CD1-CG2 3.89Å; Y123-T127 HydrophobicContact CE1-CG2 3.55Å; Y123-T127 WeakPolarHBondContact O-CG2 3.35Å; Y123-T127 PolarHBondContact O-N 2.88Å; Y123-T127 VanDerWaalsContact O-N 3.09Å; Y123-T127 PolarHBondContact O-OG1 2.78Å
124	D	51.6	Low	50.3	Low	76 Å²	76	75.7 Å²	75.7	41%	0.406	44%	0.441	S	S	.	.	H	α-helix	trans	-61.7	-32.3	177.6	-75.2	-10.3	0	0	0	111.5	K116 D120 T127	K116-D124 IonicContact NZ-OD2 2.79Å; K116-D124 PolarHBondContact NZ-OD2 2.79Å; D120-D124 VanDerWaalsContact O-CB 3.26Å; D120-D124 WeakPolarHBondContact O-CB 3.44Å; D120-D124 VanDerWaalsContact O-CG 3.24Å; D120-D124 PolarHBondContact O-N 2.79Å; D124-T127 PolarHBondContact O-OG1 2.97Å
125	M	48.4	Very low	50.4	Low	100 Å²	100	75.3 Å²	75.3	49%	0.493	44%	0.439	S	S	.	.	H	α-helix	trans	-80.1	-15.2	174.9	-68.9	-155.4	-176.8	0	0	114.7	L121 Y123 L136	L121-M125 WeakPolarHBondContact O-CB 3.22Å; L121-M125 WeakPolarHBondContact O-CG 3.1Å; L121-M125 PolarHBondContact O-N 2.88Å; L121-M125 VanDerWaalsContact O-N 3.16Å; Y123-M125 PolarHBondContact O-N 3.33Å; M125-L136 HydrophobicContact CE-CD1 3.92Å; M125-L136 HydrophobicContact SD-CD1 3.7Å
126	S	49	Very low	49.9	Very low	33 Å²	33	73.1 Å²	73.1	23%	0.231	43%	0.426	C	S	.	.	H	α-helix	trans	-104.4	-11	-178.9	45.5	0	0	0	0	114.5	I122 Y123	I122-S126 PolarHBondContact O-N 2.81Å; I122-S126 PolarHBondContact O-OG 3.44Å; Y123-S126 WeakPolarHBondContact CA-OG 3.49Å; Y123-S126 PolarHBondContact O-N 2.99Å; Y123-S126 PolarHBondContact O-OG 2.87Å
127	T	43.7	Very low	49.5	Very low	85 Å²	85	76.6 Å²	76.6	52%	0.521	45%	0.449	S	S	.	.	S	Bend	trans	-83.5	-15	174.4	50.8	0	0	0	0	114.1	Y123 D124 G129	Y123-T127 HydrophobicContact CD1-CG2 3.89Å; Y123-T127 HydrophobicContact CE1-CG2 3.55Å; Y123-T127 WeakPolarHBondContact O-CG2 3.35Å; Y123-T127 PolarHBondContact O-N 2.88Å; Y123-T127 VanDerWaalsContact O-N 3.09Å; Y123-T127 PolarHBondContact O-OG1 2.78Å; D124-T127 PolarHBondContact O-OG1 2.97Å; T127-G129 PolarHBondContact O-N 2.96Å
128	S	45.5	Very low	48.6	Very low	75 Å²	75	77.9 Å²	77.9	52%	0.524	46%	0.455	S	S	.	.	S	Bend	trans	-78.9	66.1	174.2	-173.8	0	0	0	0	111.8	S130	S128-S130 PolarHBondContact O-N 2.73Å
129	G	40.6	Very low	47.8	Very low	75 Å²	75	85.5 Å²	85.5	77%	0.773	49%	0.49	S	S	*	.	S	Bend	trans	50.2	1.2	151.5	0	0	0	0	0	121.9	T127	T127-G129 PolarHBondContact O-N 2.96Å
130	S	45.2	Very low	47.3	Very low	74 Å²	74	88.6 Å²	88.6	52%	0.517	50%	0.497	S	S	.	.	S	Bend	trans	-122.9	14.2	-168.7	-67.8	0	0	0	0	114.5	S128	S128-S130 PolarHBondContact O-N 2.73Å
131	G	42.3	Very low	47.6	Very low	17 Å²	17	86.6 Å²	86.6	18%	0.175	49%	0.488	C	S	.	.	S	Bend	trans	85.8	126.8	173.5	0	0	0	0	0	113.2	G133	G131-G133 CarbonylContact O-C 3.58Å; G131-G133 PolarHBondContact O-N 3.31Å
132	S	50.4	Low	48.6	Very low	51 Å²	51	86.3 Å²	86.3	36%	0.357	49%	0.486	S	S	.	.	S	Bend	trans	50	13.9	158.3	40.5	0	0	0	0	120.1
133	G	40.3	Very low	49.5	Very low	30 Å²	30	85 Å²	85	31%	0.309	48%	0.479	S	S	.	.	S	Bend	trans	98.2	125.5	-171.3	0	0	0	0	0	109.5	G131	G131-G133 CarbonylContact O-C 3.58Å; G131-G133 PolarHBondContact O-N 3.31Å
134	L	37.1	Very low	50.8	Low	101 Å²	101	87.2 Å²	87.2	53%	0.529	49%	0.487	S	S	.	.			trans	-58	143.7	174	-86	160.7	0	0	0	110.2	L136	L134-L136 PolarHBondContact O-N 3.38Å
135	P	46.3	Very low	52.6	Low	120 Å²	120	87.5 Å²	87.5	78%	0.779	49%	0.491	S	S	*	.			trans	-70.5	82.4	164.1	31	-29.8	0	0	0	107.1	L137	P135-L137 PolarHBondContact O-N 2.91Å
136	L	38.5	Very low	54.8	Low	102 Å²	102	82.8 Å²	82.8	53%	0.534	47%	0.468	S	S	.	.			trans	-66.2	131.3	168.7	-93.3	157	0	0	0	106.9	M125 L134 V138	M125-L136 HydrophobicContact CE-CD1 3.92Å; M125-L136 HydrophobicContact SD-CD1 3.7Å; L134-L136 PolarHBondContact O-N 3.38Å; L136-V138 HydrophobicContact CB-CG2 4.23Å; L136-V138 PolarHBondContact O-N 3.05Å
137	L	39.1	Very low	57	Low	171 Å²	171	86 Å²	86	90%	0.895	49%	0.486	S	S	*	.	S	Bend	trans	-56	36	161.5	-82.6	151.7	0	0	0	113	P135	P135-L137 PolarHBondContact O-N 2.91Å
138	V	43.4	Very low	59.5	Low	79 Å²	79	84.4 Å²	84.4	48%	0.479	47%	0.474	S	S	.	.			trans	-107.8	51.7	162.5	-164.9	0	0	0	0	107.2	L136 R140	L136-V138 HydrophobicContact CB-CG2 4.23Å; L136-V138 PolarHBondContact O-N 3.05Å; V138-R140 HydrophobicContact CG1-CB 3.85Å; V138-R140 HydrophobicContact CG1-CG 4.43Å; V138-R140 PolarHBondContact O-N 2.72Å
139	Q	45.3	Very low	61.9	Low	183 Å²	183	85.3 Å²	85.3	86%	0.855	47%	0.47	S	S	*	.			trans	-66.5	33.7	139.9	-81.2	-177.9	-25.4	0	0	110.5	T141	Q139-T141 PolarHBondContact O-N 3.05Å; Q139-T141 VanDerWaalsContact O-N 3.08Å
140	R	48.4	Very low	64.4	Low	209 Å²	209	86.2 Å²	86.2	79%	0.789	45%	0.454	S	S	*	.	S	Bend	trans	-82.2	76.6	159.2	-68	-174.4	175.8	-177	-1.6	105.4	V138 I142	V138-R140 HydrophobicContact CG1-CB 3.85Å; V138-R140 HydrophobicContact CG1-CG 4.43Å; V138-R140 PolarHBondContact O-N 2.72Å; R140-I142 PolarHBondContact O-N 3.36Å; R140-I142 VanDerWaalsContact O-N 3.1Å
141	T	64.7	Low	66.8	Low	25 Å²	25	85.8 Å²	85.8	15%	0.153	45%	0.449	C	S	.	.			trans	9.8	83.8	173.2	51.8	0	0	0	0	115.2	Q139 A143 R144 D207	Q139-T141 PolarHBondContact O-N 3.05Å; Q139-T141 VanDerWaalsContact O-N 3.08Å; T141-A143 PolarHBondContact O-N 2.85Å; T141-R144 HydrophobicContact CG2-CG 4.32Å; T141-R144 WeakPolarHBondContact O-CB 3.34Å; T141-R144 PolarHBondContact O-N 3.37Å; T141-R144 WeakPolarHBondContact OG1-CB 3.26Å; T141-R144 WeakPolarHBondContact OG1-CD 3.35Å; T141-R144 WeakPolarHBondContact OG1-CG 3.13Å; T141-R144 PolarHBondContact OG1-NE 3.01Å; T141-D207 WeakPolarHBondContact CA-OD2 3.49Å
142	I	81.4	Confident	69.2	Low	35 Å²	35	88.4 Å²	88.4	18%	0.179	46%	0.458	C	S	.	.	H	α-helix	trans	-50.9	-38.2	170	-68.8	169.4	0	0	0	109.2	R140 R144 T145 I146 W165 A205 D207	R140-I142 PolarHBondContact O-N 3.36Å; R140-I142 VanDerWaalsContact O-N 3.1Å; I142-R144 PolarHBondContact O-N 3.19Å; I142-R144 VanDerWaalsContact O-N 3.15Å; I142-T145 PolarHBondContact O-N 3.41Å; I142-T145 PolarHBondContact O-OG1 3.34Å; I142-I146 HydrophobicContact CG2-CD1 3.76Å; I142-I146 HydrophobicContact CG2-CG1 4.28Å; I142-I146 WeakPolarHBondContact O-CG1 3.12Å; I142-I146 PolarHBondContact O-N 3.06Å; I142-W165 HydrophobicContact CG2-CD2 4.44Å; I142-W165 HydrophobicContact CG2-CZ2 4.25Å; I142-A205 HydrophobicContact CD1-CB 3.5Å; I142-A205 VanDerWaalsContact CD1-CB 3.5Å; I142-D207 PolarHBondContact N-OD2 3.28Å
143	A	82.1	Confident	70.9	Confident	0 Å²	0	87.3 Å²	87.3	0%	0	45%	0.454	C	S	.	.	H	α-helix	trans	-58.8	-25.7	177	0	0	0	0	0	114.4	T141 D207 K209 W218	T141-A143 PolarHBondContact O-N 2.85Å; A143-D207 HydrophobicContact CB-CB 4.1Å; A143-D207 WeakPolarHBondContact CB-OD2 3.49Å; A143-D207 PolarHBondContact N-OD2 3.3Å; A143-K209 HydrophobicContact CB-CB 4.09Å; A143-K209 HydrophobicContact CB-CD 4.35Å; A143-K209 HydrophobicContact CB-CG 4.5Å; A143-K209 WeakPolarHBondContact O-CE 3.31Å; A143-K209 PolarHBondContact O-NZ 3.43Å; A143-W218 HydrophobicContact CB-CD2 3.89Å; A143-W218 HydrophobicContact CB-CE3 3.59Å; A143-W218 HydrophobicContact CB-CG 4.38Å; A143-W218 HydrophobicContact CB-CZ3 4.07Å
144	R	84.1	Confident	72.9	Confident	190 Å²	190	93.7 Å²	93.7	72%	0.717	47%	0.473	S	S	*	.	H	α-helix	trans	-72.6	-31.9	174.2	-74	-173.3	-165	157.8	-2.7	112.2	T141 I142	T141-R144 HydrophobicContact CG2-CG 4.32Å; T141-R144 WeakPolarHBondContact O-CB 3.34Å; T141-R144 PolarHBondContact O-N 3.37Å; T141-R144 WeakPolarHBondContact OG1-CB 3.26Å; T141-R144 WeakPolarHBondContact OG1-CD 3.35Å; T141-R144 WeakPolarHBondContact OG1-CG 3.13Å; T141-R144 PolarHBondContact OG1-NE 3.01Å; I142-R144 PolarHBondContact O-N 3.19Å; I142-R144 VanDerWaalsContact O-N 3.15Å
145	T	89.6	Confident	74.5	Confident	82 Å²	82	90.9 Å²	90.9	50%	0.503	47%	0.469	S	S	.	.	H	α-helix	trans	-87.1	-6.3	-180	63.5	0	0	0	0	113.6	I142 W165	I142-T145 PolarHBondContact O-N 3.41Å; I142-T145 PolarHBondContact O-OG1 3.34Å; T145-W165 VanDerWaalsContact OG1-CD1 3.27Å; T145-W165 PolarHBondContact OG1-NE1 3.18Å
146	I	93.9	Very high	75.7	Confident	2 Å²	2	92.6 Å²	92.6	1%	0.01	46%	0.46	C	S	.	.	P	Polyproline II helix	trans	-92.7	128.8	177	-65.1	172.7	0	0	0	110.4	I142 K164 W165 V170 V172 K209 W218 V220	I142-I146 HydrophobicContact CG2-CD1 3.76Å; I142-I146 HydrophobicContact CG2-CG1 4.28Å; I142-I146 WeakPolarHBondContact O-CG1 3.12Å; I142-I146 PolarHBondContact O-N 3.06Å; I146-K164 WeakPolarHBondContact CA-O 3.22Å; I146-W165 HydrophobicContact CG1-CB 3.89Å; I146-W165 HydrophobicContact CG1-CG 3.92Å; I146-V170 HydrophobicContact CD1-CG2 4.33Å; I146-V170 HydrophobicContact CG2-CG2 4.28Å; I146-V172 HydrophobicContact CD1-CG2 4.45Å; I146-V172 HydrophobicContact CG2-CG2 4.04Å; I146-K209 PolarHBondContact O-NZ 2.81Å; I146-W218 HydrophobicContact CB-CZ3 3.8Å; I146-W218 HydrophobicContact CD1-CE3 4.47Å; I146-W218 HydrophobicContact CD1-CZ3 4.3Å; I146-W218 HydrophobicContact CG2-CH2 4.4Å; I146-W218 HydrophobicContact CG2-CZ3 3.76Å; I146-V220 HydrophobicContact CD1-CB 4.48Å; I146-V220 HydrophobicContact CD1-CG1 3.85Å; I146-V220 HydrophobicContact CD1-CG2 3.75Å
147	V	94.8	Very high	77.4	Confident	100 Å²	100	89.3 Å²	89.3	61%	0.606	44%	0.441	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-100.3	117.2	171.2	-176.3	0	0	0	0	108.9	G163 K164	V147-G163 CarbonylContact O-C 3.57Å; V147-G163 WeakPolarHBondContact O-CA 3.43Å; V147-K164 PolarHBondContact N-O 3.03Å; V147-K164 VanDerWaalsContact N-O 3.07Å; V147-K164 PolarHBondContact O-N 3.43Å
148	L	95.6	Very high	79.3	Confident	52 Å²	52	82 Å²	82	27%	0.272	41%	0.407	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.8	136.7	174.1	-60.7	177.4	0	0	0	109.7	W161 V172 I174 W218	L148-W161 HydrophobicContact CB-CD2 4.45Å; L148-W161 HydrophobicContact CB-CE3 3.88Å; L148-W161 HydrophobicContact CB-CZ3 4.38Å; L148-W161 HydrophobicContact CD1-CD2 4.26Å; L148-W161 HydrophobicContact CD1-CE3 4.4Å; L148-W161 HydrophobicContact CD1-CG 4.49Å; L148-W161 HydrophobicContact CD2-CB 3.8Å; L148-W161 HydrophobicContact CD2-CG 4.22Å; L148-V172 HydrophobicContact CD2-CB 4.06Å; L148-V172 HydrophobicContact CD2-CG1 4.21Å; L148-V172 HydrophobicContact CD2-CG2 4.12Å; L148-I174 HydrophobicContact CD1-CD1 3.65Å; L148-I174 HydrophobicContact CD2-CD1 4.23Å; L148-W218 HydrophobicContact CD1-CH2 3.93Å; L148-W218 HydrophobicContact CD1-CZ2 3.83Å; L148-W218 HydrophobicContact CD2-CH2 3.57Å; L148-W218 HydrophobicContact CD2-CZ2 4.14Å; L148-W218 HydrophobicContact CD2-CZ3 4.03Å; L148-W218 HydrophobicContact CG-CH2 3.67Å; L148-W218 HydrophobicContact CG-CZ2 4.11Å
149	Q	95.9	Very high	81.5	Confident	94 Å²	94	81.5 Å²	81.5	44%	0.439	40%	0.4	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.4	-67.6	-179.7	-61.2	-169.4	-55.9	0	0	111.4	R162 K164	Q149-R162 PolarHBondContact N-O 2.78Å; Q149-K164 HydrophobicContact CG-CG 4.23Å
150	E	95	Very high	83.9	Confident	94 Å²	94	74.5 Å²	74.5	44%	0.439	37%	0.369	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.2	148	-174	62.8	-174.8	165.9	0	0	111.3	I152 W161 R162	E150-I152 HydrophobicContact CG-CG2 4.04Å; E150-I152 PolarHBondContact O-N 3.48Å; E150-W161 CarbonylContact O-C 3.49Å; E150-W161 WeakPolarHBondContact O-CA 3.41Å; E150-R162 HydrophobicContact CG-CB 3.92Å; E150-R162 PolarHBondContact N-O 3.42Å; E150-R162 PolarHBondContact O-N 2.88Å; E150-R162 WeakPolarHBondContact OE1-CD 3.34Å; E150-R162 IonicContact OE1-NH1 3.33Å; E150-R162 PolarHBondContact OE1-NH1 3.37Å
151	T	94.8	Very high	86.2	Confident	65 Å²	65	67.4 Å²	67.4	40%	0.399	34%	0.342	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.8	119.7	171.7	-45.3	0	0	0	0	109.1	E159 W161	T151-E159 HydrophobicContact CG2-CB 4.4Å; T151-W161 WeakPolarHBondContact OG1-CH2 3.46Å; T151-W161 WeakPolarHBondContact OG1-CZ2 3.46Å
152	I	92.4	Very high	87.7	Confident	72 Å²	72	69 Å²	69	37%	0.369	35%	0.346	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	-14.3	-178.3	59.8	175.7	0	0	0	113.1	E150 V160 R162 Y223	E150-I152 HydrophobicContact CG-CG2 4.04Å; E150-I152 PolarHBondContact O-N 3.48Å; I152-V160 HydrophobicContact CD1-CG1 3.82Å; I152-V160 HydrophobicContact CG1-CB 4.06Å; I152-V160 HydrophobicContact CG1-CG1 3.76Å; I152-V160 WeakPolarHBondContact CG1-O 3.48Å; I152-V160 PolarHBondContact N-O 3.18Å; I152-R162 HydrophobicContact CG2-CB 3.74Å; I152-Y223 HydrophobicContact CD1-CD2 4.03Å; I152-Y223 HydrophobicContact CD1-CE2 3.8Å; I152-Y223 HydrophobicContact CG2-CE2 4.45Å
153	G	86.2	Confident	88.5	Confident	27 Å²	27	67.4 Å²	67.4	28%	0.278	34%	0.337	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-170.4	159.6	175.8	0	0	0	0	0	113.6	V160	G153-V160 PolarHBondContact N-O 2.89Å; G153-V160 VanDerWaalsContact N-O 3.14Å; G153-V160 PolarHBondContact O-N 2.67Å
154	K	83.3	Confident	89.1	Confident	164 Å²	164	70.2 Å²	70.2	71%	0.713	35%	0.349	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-117.6	115	168.5	-62.2	-166.2	179.4	-149.7	0	108.2	E159	K154-E159 WeakPolarHBondContact CE-OE1 3.48Å; K154-E159 HydrophobicContact CG-CG 4.23Å; K154-E159 IonicContact NZ-OE1 3.29Å; K154-E159 PolarHBondContact NZ-OE1 3.26Å
155	G	70.5	Confident	89.5	Confident	42 Å²	42	62.8 Å²	62.8	43%	0.433	32%	0.321	S	S	.	.			trans	-93.3	-175.6	178.2	0	0	0	0	0	112.2	F157 G158	G155-F157 VanDerWaalsContact C-N 3.31Å; G155-F157 PolarHBondContact O-N 3.29Å; G155-G158 WeakPolarHBondContact CA-O 3.4Å; G155-G158 PolarHBondContact N-O 3Å
156	R	71.2	Confident	89.4	Confident	157 Å²	157	64.5 Å²	64.5	59%	0.592	32%	0.324	S	S	*	.	S	Bend	trans	-63.7	-34.4	178.9	-179.1	175.9	175.9	-174.8	0.3	113.5
157	F	73.4	Confident	89.1	Confident	33 Å²	33	67.1 Å²	67.1	15%	0.145	35%	0.351	C	S	.	.	S	Bend	trans	-122.1	6.1	-169.1	-54.3	-67.2	0	0	0	113.5	G155 F175 S182 L295	G155-F157 VanDerWaalsContact C-N 3.31Å; G155-F157 PolarHBondContact O-N 3.29Å; F157-F175 HydrophobicContact CB-CD1 3.72Å; F157-F175 HydrophobicContact CB-CE1 3.62Å; F157-F175 WeakPolarHBondContact O-CD1 3.49Å; F157-S182 WeakPolarHBondContact CD1-OG 3.17Å; F157-S182 WeakPolarHBondContact CE1-OG 3.38Å; F157-L295 HydrophobicContact CE2-CD2 4.47Å; F157-L295 HydrophobicContact CZ-CD2 4.37Å
158	G	78.7	Confident	89	Confident	17 Å²	17	66.4 Å²	66.4	18%	0.175	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	172.2	172.2	-172.9	0	0	0	0	0	114.2	G155 I174	G155-G158 WeakPolarHBondContact CA-O 3.4Å; G155-G158 PolarHBondContact N-O 3Å; G158-I174 WeakPolarHBondContact CA-O 3.39Å
159	E	90.7	Very high	89	Confident	69 Å²	69	66 Å²	66	32%	0.322	34%	0.339	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.8	139.7	175.4	-58.7	-171.7	149.3	0	0	109.5	T151 K154 K173 I174	T151-E159 HydrophobicContact CG2-CB 4.4Å; K154-E159 WeakPolarHBondContact CE-OE1 3.48Å; K154-E159 HydrophobicContact CG-CG 4.23Å; K154-E159 IonicContact NZ-OE1 3.29Å; K154-E159 PolarHBondContact NZ-OE1 3.26Å; E159-K173 WeakPolarHBondContact O-CA 3.45Å; E159-I174 PolarHBondContact N-O 2.93Å; E159-I174 VanDerWaalsContact N-O 3.17Å; E159-I174 PolarHBondContact O-N 3.35Å
160	V	94.9	Very high	89	Confident	35 Å²	35	61.5 Å²	61.5	21%	0.212	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	127.2	175.6	-168.6	0	0	0	0	108.1	I152 G153 A171 V172 K173	I152-V160 HydrophobicContact CD1-CG1 3.82Å; I152-V160 HydrophobicContact CG1-CB 4.06Å; I152-V160 HydrophobicContact CG1-CG1 3.76Å; I152-V160 WeakPolarHBondContact CG1-O 3.48Å; I152-V160 PolarHBondContact N-O 3.18Å; G153-V160 PolarHBondContact N-O 2.89Å; G153-V160 VanDerWaalsContact N-O 3.14Å; G153-V160 PolarHBondContact O-N 2.67Å; V160-A171 HydrophobicContact CG1-CB 4.49Å; V160-V172 CarbonylContact C-O 3.53Å; V160-V172 WeakPolarHBondContact CA-O 3.37Å; V160-K173 HydrophobicContact CG2-CB 4.35Å; V160-K173 HydrophobicContact CG2-CG 4.1Å
161	W	96.4	Very high	89.1	Confident	60 Å²	60	57.6 Å²	57.6	23%	0.227	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115	145.5	-179.6	-70.8	72.8	0	0	0	110.3	L148 E150 T151 A171 V172 I174	L148-W161 HydrophobicContact CB-CD2 4.45Å; L148-W161 HydrophobicContact CB-CE3 3.88Å; L148-W161 HydrophobicContact CB-CZ3 4.38Å; L148-W161 HydrophobicContact CD1-CD2 4.26Å; L148-W161 HydrophobicContact CD1-CE3 4.4Å; L148-W161 HydrophobicContact CD1-CG 4.49Å; L148-W161 HydrophobicContact CD2-CB 3.8Å; L148-W161 HydrophobicContact CD2-CG 4.22Å; E150-W161 CarbonylContact O-C 3.49Å; E150-W161 WeakPolarHBondContact O-CA 3.41Å; T151-W161 WeakPolarHBondContact OG1-CH2 3.46Å; T151-W161 WeakPolarHBondContact OG1-CZ2 3.46Å; W161-A171 CarbonylContact O-C 3.54Å; W161-A171 WeakPolarHBondContact O-CA 3.34Å; W161-V172 HydrophobicContact CB-CB 4.42Å; W161-V172 PolarHBondContact N-O 3.32Å; W161-V172 PolarHBondContact O-N 2.83Å; W161-I174 HydrophobicContact CG-CD1 4.24Å
162	R	97.3	Very high	89.2	Confident	60 Å²	60	54.5 Å²	54.5	23%	0.226	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.7	130	156.9	179.8	-175.7	176.5	-177.7	2.6	107.8	Q149 E150 I152 D169 Y223	Q149-R162 PolarHBondContact N-O 2.78Å; E150-R162 HydrophobicContact CG-CB 3.92Å; E150-R162 PolarHBondContact N-O 3.42Å; E150-R162 PolarHBondContact O-N 2.88Å; E150-R162 WeakPolarHBondContact OE1-CD 3.34Å; E150-R162 IonicContact OE1-NH1 3.33Å; E150-R162 PolarHBondContact OE1-NH1 3.37Å; I152-R162 HydrophobicContact CG2-CB 3.74Å; R162-D169 IonicContact CZ-OD1 3.86Å; R162-D169 IonicContact CZ-OD2 2.99Å; R162-D169 IonicContact NE-OD1 3.72Å; R162-D169 PolarHBondContact NE-OD1 3.1Å; R162-D169 IonicContact NE-OD2 2.99Å; R162-D169 VanDerWaalsContact NH2-CG 3.26Å; R162-D169 IonicContact NH2-OD1 2.99Å; R162-D169 PolarHBondContact NH2-OD1 3.37Å; R162-D169 IonicContact NH2-OD2 2.95Å; R162-D169 PolarHBondContact NH2-OD2 3.09Å; R162-Y223 HydrophobicContact CB-CE2 4.25Å; R162-Y223 HydrophobicContact CG-CD2 4.33Å; R162-Y223 HydrophobicContact CG-CE2 4.15Å
163	G	96.9	Very high	89.3	Confident	0 Å²	0	52 Å²	52	0%	0	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127	164.4	174.2	0	0	0	0	0	111.4	V147 V170	V147-G163 CarbonylContact O-C 3.57Å; V147-G163 WeakPolarHBondContact O-CA 3.43Å; G163-V170 PolarHBondContact N-O 3.44Å; G163-V170 WeakPolarHBondContact O-CG2 3.25Å; G163-V170 PolarHBondContact O-N 3.47Å
164	K	96	Very high	89.7	Confident	59 Å²	59	51.6 Å²	51.6	26%	0.257	26%	0.261	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	128.5	169.7	-78.2	-66.3	-167.4	-178.1	0	110.2	I146 V147 Q149 G167 E168 D169	I146-K164 WeakPolarHBondContact CA-O 3.22Å; V147-K164 PolarHBondContact N-O 3.03Å; V147-K164 VanDerWaalsContact N-O 3.07Å; V147-K164 PolarHBondContact O-N 3.43Å; Q149-K164 HydrophobicContact CG-CG 4.23Å; K164-G167 WeakPolarHBondContact CD-O 3.31Å; K164-G167 PolarHBondContact NZ-O 3.3Å; K164-E168 WeakPolarHBondContact CA-O 3.4Å; K164-E168 WeakPolarHBondContact CD-O 3.32Å; K164-D169 WeakPolarHBondContact CD-OD1 3.42Å; K164-D169 WeakPolarHBondContact CE-OD1 3.47Å; K164-D169 IonicContact NZ-OD1 2.76Å; K164-D169 PolarHBondContact NZ-OD1 2.85Å; K164-D169 VanDerWaalsContact NZ-OD1 3.14Å; K164-D169 IonicContact NZ-OD2 3.14Å; K164-D169 PolarHBondContact NZ-OD2 3.18Å
165	W	92.6	Very high	90.2	Very high	34 Å²	34	43.9 Å²	43.9	13%	0.129	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.2	116.9	172.9	-172.4	42.8	0	0	0	109.1	L118 I142 T145 I146 G167 E168 V170 I204	L118-W165 HydrophobicContact CD1-CE3 3.83Å; L118-W165 HydrophobicContact CD1-CH2 4.06Å; L118-W165 HydrophobicContact CD1-CZ3 3.33Å; L118-W165 HydrophobicContact CD2-CE3 3.89Å; L118-W165 HydrophobicContact CD2-CZ3 4.14Å; L118-W165 HydrophobicContact CG-CZ3 4.36Å; I142-W165 HydrophobicContact CG2-CD2 4.44Å; I142-W165 HydrophobicContact CG2-CZ2 4.25Å; T145-W165 VanDerWaalsContact OG1-CD1 3.27Å; T145-W165 PolarHBondContact OG1-NE1 3.18Å; I146-W165 HydrophobicContact CG1-CB 3.89Å; I146-W165 HydrophobicContact CG1-CG 3.92Å; W165-G167 PolarHBondContact O-N 2.81Å; W165-G167 VanDerWaalsContact O-N 3.16Å; W165-E168 PolarHBondContact N-O 3.22Å; W165-E168 PolarHBondContact O-N 2.66Å; W165-V170 HydrophobicContact CB-CG1 3.93Å; W165-V170 HydrophobicContact CB-CG2 4.07Å; W165-V170 HydrophobicContact CE3-CG1 4.37Å; W165-I204 HydrophobicContact CE3-CG2 4.32Å; W165-I204 HydrophobicContact CH2-CG2 4.29Å; W165-I204 HydrophobicContact CZ3-CG2 3.67Å
166	Q	87.8	Confident	91.2	Very high	119 Å²	119	44.1 Å²	44.1	56%	0.556	22%	0.222	S	C	*	.	T	Hydrogen-bonded Turn	trans	50.7	39.8	-177.7	-59.4	-176.7	-14.8	0	0	113.3	E168	Q166-E168 VanDerWaalsContact C-N 3.26Å; Q166-E168 PolarHBondContact O-N 2.94Å
167	G	87.3	Confident	92	Very high	57 Å²	57	39.9 Å²	39.9	59%	0.588	22%	0.216	S	C	*	.	T	Hydrogen-bonded Turn	trans	83.7	-17.3	-178.7	0	0	0	0	0	115.5	K164 W165	K164-G167 WeakPolarHBondContact CD-O 3.31Å; K164-G167 PolarHBondContact NZ-O 3.3Å; W165-G167 PolarHBondContact O-N 2.81Å; W165-G167 VanDerWaalsContact O-N 3.16Å
168	E	91.3	Very high	92.7	Very high	85 Å²	85	49.3 Å²	49.3	40%	0.397	25%	0.251	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.6	148.5	-178.5	-68.1	-66.8	164.1	0	0	112.3	L118 K164 W165 Q166	L118-E168 HydrophobicContact CB-CB 4.31Å; L118-E168 HydrophobicContact CB-CG 3.85Å; L118-E168 HydrophobicContact CD2-CB 3.92Å; L118-E168 HydrophobicContact CD2-CG 4.41Å; K164-E168 WeakPolarHBondContact CA-O 3.4Å; K164-E168 WeakPolarHBondContact CD-O 3.32Å; W165-E168 PolarHBondContact N-O 3.22Å; W165-E168 PolarHBondContact O-N 2.66Å; Q166-E168 VanDerWaalsContact C-N 3.26Å; Q166-E168 PolarHBondContact O-N 2.94Å
169	D	96.3	Very high	93.3	Very high	43 Å²	43	51 Å²	51	23%	0.23	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.1	129.4	176.1	-73.9	-58.1	0	0	0	111.2	R162 K164 Y223	R162-D169 IonicContact CZ-OD1 3.86Å; R162-D169 IonicContact CZ-OD2 2.99Å; R162-D169 IonicContact NE-OD1 3.72Å; R162-D169 PolarHBondContact NE-OD1 3.1Å; R162-D169 IonicContact NE-OD2 2.99Å; R162-D169 VanDerWaalsContact NH2-CG 3.26Å; R162-D169 IonicContact NH2-OD1 2.99Å; R162-D169 PolarHBondContact NH2-OD1 3.37Å; R162-D169 IonicContact NH2-OD2 2.95Å; R162-D169 PolarHBondContact NH2-OD2 3.09Å; K164-D169 WeakPolarHBondContact CD-OD1 3.42Å; K164-D169 WeakPolarHBondContact CE-OD1 3.47Å; K164-D169 IonicContact NZ-OD1 2.76Å; K164-D169 PolarHBondContact NZ-OD1 2.85Å; K164-D169 VanDerWaalsContact NZ-OD1 3.14Å; K164-D169 IonicContact NZ-OD2 3.14Å; K164-D169 PolarHBondContact NZ-OD2 3.18Å; D169-Y223 HydrophobicContact CB-CD1 3.57Å; D169-Y223 HydrophobicContact CB-CE1 4.39Å; D169-Y223 HydrophobicContact CB-CG 4Å; D169-Y223 WeakPolarHBondContact O-CB 3.21Å
170	V	96.9	Very high	93.3	Very high	0 Å²	0	53.3 Å²	53.3	0%	0	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	151.1	175.6	-64.3	0	0	0	0	110.7	L118 I146 G163 W165 V172 I204 V220	L118-V170 HydrophobicContact CD2-CG1 4.37Å; I146-V170 HydrophobicContact CD1-CG2 4.33Å; I146-V170 HydrophobicContact CG2-CG2 4.28Å; G163-V170 PolarHBondContact N-O 3.44Å; G163-V170 WeakPolarHBondContact O-CG2 3.25Å; G163-V170 PolarHBondContact O-N 3.47Å; W165-V170 HydrophobicContact CB-CG1 3.93Å; W165-V170 HydrophobicContact CB-CG2 4.07Å; W165-V170 HydrophobicContact CE3-CG1 4.37Å; V170-V172 HydrophobicContact CG2-CG2 4.11Å; V170-I204 HydrophobicContact CG1-CD1 3.88Å; V170-V220 HydrophobicContact CB-CG1 4.03Å; V170-V220 HydrophobicContact CG1-CG1 4.39Å; V170-V220 HydrophobicContact CG2-CG1 4.23Å
171	A	97	Very high	93.1	Very high	11 Å²	11	62.3 Å²	62.3	9%	0.091	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.4	131.7	169.2	0	0	0	0	0	109.2	V160 W161 V220 S221	V160-A171 HydrophobicContact CG1-CB 4.49Å; W161-A171 CarbonylContact O-C 3.54Å; W161-A171 WeakPolarHBondContact O-CA 3.34Å; A171-V220 CarbonylContact O-C 3.58Å; A171-V220 WeakPolarHBondContact O-CA 3.24Å; A171-S221 PolarHBondContact N-O 2.88Å; A171-S221 PolarHBondContact O-N 3.36Å
172	V	96.3	Very high	92.8	Very high	0 Å²	0	60.7 Å²	60.7	0%	0	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	108.4	-179	-174.3	0	0	0	0	109	I146 L148 V160 W161 V170 I174 W218 L219	I146-V172 HydrophobicContact CD1-CG2 4.45Å; I146-V172 HydrophobicContact CG2-CG2 4.04Å; L148-V172 HydrophobicContact CD2-CB 4.06Å; L148-V172 HydrophobicContact CD2-CG1 4.21Å; L148-V172 HydrophobicContact CD2-CG2 4.12Å; V160-V172 CarbonylContact C-O 3.53Å; V160-V172 WeakPolarHBondContact CA-O 3.37Å; W161-V172 HydrophobicContact CB-CB 4.42Å; W161-V172 PolarHBondContact N-O 3.32Å; W161-V172 PolarHBondContact O-N 2.83Å; V170-V172 HydrophobicContact CG2-CG2 4.11Å; V172-I174 HydrophobicContact CG1-CD1 4.3Å; V172-I174 HydrophobicContact CG1-CG1 3.77Å; V172-W218 HydrophobicContact CB-CE3 4.47Å; V172-W218 HydrophobicContact CG1-CB 4.26Å; V172-W218 HydrophobicContact CG1-CD2 3.54Å; V172-W218 HydrophobicContact CG1-CE3 3.28Å; V172-W218 HydrophobicContact CG1-CG 4Å; V172-W218 HydrophobicContact CG1-CH2 4.4Å; V172-W218 HydrophobicContact CG1-CZ3 3.74Å; V172-W218 HydrophobicContact CG2-CE3 4.4Å; V172-W218 HydrophobicContact CG2-CZ3 4.29Å; V172-L219 WeakPolarHBondContact CA-O 3.15Å
173	K	95.4	Very high	92.6	Very high	21 Å²	21	59.3 Å²	59.3	9%	0.091	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.7	117	171.4	-170	176.2	-172.8	-175.8	0	108.7	E159 V160 F175 E186 L219 D292	E159-K173 WeakPolarHBondContact O-CA 3.45Å; V160-K173 HydrophobicContact CG2-CB 4.35Å; V160-K173 HydrophobicContact CG2-CG 4.1Å; K173-F175 HydrophobicContact CB-CE2 4.06Å; K173-F175 HydrophobicContact CD-CE1 4.46Å; K173-F175 HydrophobicContact CD-CE2 3.79Å; K173-F175 HydrophobicContact CD-CZ 3.52Å; K173-F175 HydrophobicContact CG-CD2 4.33Å; K173-F175 HydrophobicContact CG-CE2 3.58Å; K173-F175 HydrophobicContact CG-CZ 3.78Å; K173-E186 IonicContact NZ-OE1 3.74Å; K173-E186 PolarHBondContact NZ-OE1 3.16Å; K173-E186 IonicContact NZ-OE2 3.9Å; K173-E186 PolarHBondContact NZ-OE2 3.24Å; K173-L219 HydrophobicContact CB-CB 4.33Å; K173-L219 PolarHBondContact N-O 2.62Å; K173-L219 PolarHBondContact O-N 2.98Å; K173-D292 IonicContact NZ-OD1 2.62Å; K173-D292 PolarHBondContact NZ-OD1 3.09Å
174	I	94.1	Very high	92.4	Very high	17 Å²	17	65.4 Å²	65.4	9%	0.087	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	122.4	-175.7	-55.2	179.5	0	0	0	109.2	L148 G158 E159 W161 V172 Q216 L217 W218	L148-I174 HydrophobicContact CD1-CD1 3.65Å; L148-I174 HydrophobicContact CD2-CD1 4.23Å; G158-I174 WeakPolarHBondContact CA-O 3.39Å; E159-I174 PolarHBondContact N-O 2.93Å; E159-I174 VanDerWaalsContact N-O 3.17Å; E159-I174 PolarHBondContact O-N 3.35Å; W161-I174 HydrophobicContact CG-CD1 4.24Å; V172-I174 HydrophobicContact CG1-CD1 4.3Å; V172-I174 HydrophobicContact CG1-CG1 3.77Å; I174-Q216 HydrophobicContact CG2-CB 3.84Å; I174-Q216 HydrophobicContact CG2-CG 4.05Å; I174-L217 WeakPolarHBondContact CA-O 3.3Å; I174-W218 HydrophobicContact CD1-CZ2 3.99Å; I174-W218 HydrophobicContact CG1-CD2 4.44Å; I174-W218 HydrophobicContact CG1-CG 4.39Å
175	F	93.2	Very high	92.2	Very high	3 Å²	3	64.7 Å²	64.7	1%	0.013	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	150	177.9	-57.7	-108.1	0	0	0	110.3	F157 K173 D179 W183 E186 L217 L219	F157-F175 HydrophobicContact CB-CD1 3.72Å; F157-F175 HydrophobicContact CB-CE1 3.62Å; F157-F175 WeakPolarHBondContact O-CD1 3.49Å; K173-F175 HydrophobicContact CB-CE2 4.06Å; K173-F175 HydrophobicContact CD-CE1 4.46Å; K173-F175 HydrophobicContact CD-CE2 3.79Å; K173-F175 HydrophobicContact CD-CZ 3.52Å; K173-F175 HydrophobicContact CG-CD2 4.33Å; K173-F175 HydrophobicContact CG-CE2 3.58Å; K173-F175 HydrophobicContact CG-CZ 3.78Å; F175-D179 HydrophobicContact CB-CB 4.37Å; F175-D179 HydrophobicContact CD1-CB 4.34Å; F175-W183 HydrophobicContact CB-CB 4.13Å; F175-W183 HydrophobicContact CD1-CB 4.02Å; F175-W183 HydrophobicContact CD2-CB 3.93Å; F175-W183 AromaticContact CD2-CD1 3.59Å; F175-W183 HydrophobicContact CD2-CG 4.14Å; F175-W183 HydrophobicContact CE1-CB 4.36Å; F175-W183 HydrophobicContact CE2-CB 4.29Å; F175-W183 AromaticContact CE2-CD1 3.82Å; F175-W183 HydrophobicContact CE2-CG 4.47Å; F175-W183 HydrophobicContact CG-CB 3.79Å; F175-W183 HydrophobicContact CG-CG 4.43Å; F175-W183 HydrophobicContact CZ-CB 4.47Å; F175-E186 WeakPolarHBondContact CZ-OE2 3.01Å; F175-L217 HydrophobicContact CB-CB 4.21Å; F175-L217 PolarHBondContact N-O 2.9Å; F175-L217 PolarHBondContact O-N 3.36Å; F175-L217 VanDerWaalsContact O-N 3.09Å; F175-L219 HydrophobicContact CE2-CB 4.06Å
176	S	91.3	Very high	92.3	Very high	46 Å²	46	63.2 Å²	63.2	32%	0.322	31%	0.307	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.5	157	168.8	86.4	0	0	0	0	110.3	R178 D179	S176-R178 PolarHBondContact O-N 2.78Å; S176-R178 VanDerWaalsContact O-N 3.1Å; S176-R178 WeakPolarHBondContact OG-CB 3.13Å; S176-R178 PolarHBondContact OG-N 3.25Å; S176-D179 PolarHBondContact O-N 3.36Å; S176-D179 PolarHBondContact OG-OD2 2.92Å
177	S	88.1	Confident	92.6	Very high	68 Å²	68	57.8 Å²	57.8	48%	0.476	28%	0.282	S	S	.	.	G	3₁₀ helix	trans	-59.7	-19.4	172.3	56.9	0	0	0	0	113.6	D179	S177-D179 VanDerWaalsContact C-N 3.28Å
178	R	89.2	Confident	92.9	Very high	231 Å²	231	58.2 Å²	58.2	87%	0.872	27%	0.269	S	S	*	.	G	3₁₀ helix	trans	-74	-22.1	174.5	-57.8	179.2	179.2	175.4	-0.1	112.4	S176	S176-R178 PolarHBondContact O-N 2.78Å; S176-R178 VanDerWaalsContact O-N 3.1Å; S176-R178 WeakPolarHBondContact OG-CB 3.13Å; S176-R178 PolarHBondContact OG-N 3.25Å
179	D	89.9	Confident	93.1	Very high	54 Å²	54	54.2 Å²	54.2	29%	0.289	25%	0.25	S	C	.	.	G	3₁₀ helix	trans	-101.6	19.4	-177.5	-57.9	-64.6	0	0	0	112.4	F175 S176 S177 R181 S182 W183	F175-D179 HydrophobicContact CB-CB 4.37Å; F175-D179 HydrophobicContact CD1-CB 4.34Å; S176-D179 PolarHBondContact O-N 3.36Å; S176-D179 PolarHBondContact OG-OD2 2.92Å; S177-D179 VanDerWaalsContact C-N 3.28Å; D179-R181 PolarHBondContact O-N 3.04Å; D179-R181 VanDerWaalsContact O-N 3.16Å; D179-S182 WeakPolarHBondContact O-CB 3.46Å; D179-S182 PolarHBondContact O-N 2.97Å; D179-W183 PolarHBondContact O-N 3.19Å
180	E	90.8	Very high	93.1	Very high	117 Å²	117	52.6 Å²	52.6	55%	0.547	24%	0.241	S	C	.	.	H	α-helix	trans	-52.1	-39.7	-178.4	-176.4	-178	-166.2	0	0	112.8	S182 W183 F184 L217	E180-S182 VanDerWaalsContact C-N 3.33Å; E180-S182 PolarHBondContact O-N 3.27Å; E180-W183 PolarHBondContact O-N 2.77Å; E180-F184 WeakPolarHBondContact O-CB 3.29Å; E180-F184 PolarHBondContact O-N 3.13Å; E180-L217 HydrophobicContact CB-CD1 3.8Å; E180-L217 HydrophobicContact CG-CD1 3.98Å
181	R	90.4	Very high	93	Very high	224 Å²	224	57.9 Å²	57.9	85%	0.845	27%	0.266	S	S	*	.	H	α-helix	trans	-62.7	-38.7	177.4	-66.2	-177.5	-176.5	175.5	1	112.6	D179 R185	D179-R181 PolarHBondContact O-N 3.04Å; D179-R181 VanDerWaalsContact O-N 3.16Å; R181-R185 VanDerWaalsContact O-CB 3.26Å; R181-R185 WeakPolarHBondContact O-CB 3.28Å; R181-R185 PolarHBondContact O-N 3.25Å
182	S	90.9	Very high	92.8	Very high	26 Å²	26	58 Å²	58	18%	0.182	27%	0.265	C	S	.	.	H	α-helix	trans	-71	-44.3	177.5	-62.3	0	0	0	0	111.1	F157 D179 E180 R185 E186	F157-S182 WeakPolarHBondContact CD1-OG 3.17Å; F157-S182 WeakPolarHBondContact CE1-OG 3.38Å; D179-S182 WeakPolarHBondContact O-CB 3.46Å; D179-S182 PolarHBondContact O-N 2.97Å; E180-S182 VanDerWaalsContact C-N 3.33Å; E180-S182 PolarHBondContact O-N 3.27Å; S182-R185 PolarHBondContact O-N 3Å; S182-E186 WeakPolarHBondContact O-CB 3.48Å; S182-E186 PolarHBondContact O-N 2.9Å
183	W	93.5	Very high	92.5	Very high	31 Å²	31	60.8 Å²	60.8	12%	0.117	28%	0.279	C	S	.	.	H	α-helix	trans	-59.8	-49.6	175	168.8	81.8	0	0	0	111.4	F175 D179 E180 R185 E186 A187 A206 L217 W218	F175-W183 HydrophobicContact CB-CB 4.13Å; F175-W183 HydrophobicContact CD1-CB 4.02Å; F175-W183 HydrophobicContact CD2-CB 3.93Å; F175-W183 AromaticContact CD2-CD1 3.59Å; F175-W183 HydrophobicContact CD2-CG 4.14Å; F175-W183 HydrophobicContact CE1-CB 4.36Å; F175-W183 HydrophobicContact CE2-CB 4.29Å; F175-W183 AromaticContact CE2-CD1 3.82Å; F175-W183 HydrophobicContact CE2-CG 4.47Å; F175-W183 HydrophobicContact CG-CB 3.79Å; F175-W183 HydrophobicContact CG-CG 4.43Å; F175-W183 HydrophobicContact CZ-CB 4.47Å; D179-W183 PolarHBondContact O-N 3.19Å; E180-W183 PolarHBondContact O-N 2.77Å; W183-R185 VanDerWaalsContact C-N 3.34Å; W183-R185 PolarHBondContact O-N 2.91Å; W183-E186 PolarHBondContact O-N 2.92Å; W183-A187 VanDerWaalsContact O-CB 3.29Å; W183-A187 WeakPolarHBondContact O-CB 3.35Å; W183-A187 PolarHBondContact O-N 3.26Å; W183-A206 HydrophobicContact CZ2-CB 3.82Å; W183-L217 HydrophobicContact CB-CB 4.27Å; W183-L217 HydrophobicContact CB-CD1 4.12Å; W183-L217 HydrophobicContact CD2-CB 3.82Å; W183-L217 HydrophobicContact CD2-CD1 4.1Å; W183-L217 HydrophobicContact CD2-CG 4.42Å; W183-L217 HydrophobicContact CE3-CB 4.47Å; W183-L217 HydrophobicContact CE3-CD1 4.04Å; W183-L217 HydrophobicContact CG-CB 3.68Å; W183-L217 HydrophobicContact CG-CD1 4.15Å; W183-W218 PolarHBondContact NE1-O 2.94Å
184	F	92.4	Very high	92.4	Very high	127 Å²	127	63.9 Å²	63.9	56%	0.557	30%	0.295	S	S	*	.	H	α-helix	trans	-59.8	-45.7	179.7	-178.6	-91.8	0	0	0	110.9	E180 E186 A187 E188	E180-F184 WeakPolarHBondContact O-CB 3.29Å; E180-F184 PolarHBondContact O-N 3.13Å; F184-E186 PolarHBondContact O-N 3.47Å; F184-A187 PolarHBondContact O-N 3.13Å; F184-E188 WeakPolarHBondContact O-CB 3.44Å; F184-E188 PolarHBondContact O-N 2.66Å
185	R	92.1	Very high	92.5	Very high	44 Å²	44	63.2 Å²	63.2	17%	0.166	29%	0.292	C	S	.	.	H	α-helix	trans	-59.8	-48.5	177.5	179.2	55.5	173.1	-171.7	-5.6	111.9	R181 S182 W183 E188 I189 G294 A296 D307	R181-R185 VanDerWaalsContact O-CB 3.26Å; R181-R185 WeakPolarHBondContact O-CB 3.28Å; R181-R185 PolarHBondContact O-N 3.25Å; S182-R185 PolarHBondContact O-N 3Å; W183-R185 VanDerWaalsContact C-N 3.34Å; W183-R185 PolarHBondContact O-N 2.91Å; R185-E188 IonicContact NH1-OE2 3.46Å; R185-E188 PolarHBondContact NH1-OE2 3.39Å; R185-E188 PolarHBondContact O-N 3.25Å; R185-I189 WeakPolarHBondContact O-CG1 3.19Å; R185-I189 PolarHBondContact O-N 2.78Å; R185-G294 WeakPolarHBondContact CG-O 3.45Å; R185-A296 PolarHBondContact NE-O 3.14Å; R185-A296 PolarHBondContact NH2-O 2.7Å; R185-D307 IonicContact CZ-OD1 2.69Å; R185-D307 IonicContact CZ-OD2 2.81Å; R185-D307 VanDerWaalsContact CZ-OD2 3.24Å; R185-D307 IonicContact NH1-OD1 2.84Å; R185-D307 IonicContact NH1-OD2 2.81Å; R185-D307 PolarHBondContact NH1-OD2 3.46Å; R185-D307 PolarHBondContact NH2-O 3.13Å; R185-D307 IonicContact NH2-OD1 3.24Å; R185-D307 PolarHBondContact NH2-OD1 3.41Å; R185-D307 IonicContact NH2-OD2 2.73Å; R185-D307 PolarHBondContact NH2-OD2 3.31Å
186	E	94.4	Very high	92.5	Very high	4 Å²	4	67.3 Å²	67.3	2%	0.019	31%	0.307	C	S	.	.	H	α-helix	trans	-65.4	-43.6	-178.9	-165.4	167.7	168.2	0	0	111.4	K173 F175 S182 W183 F184 E188 I189 Y190 L219	K173-E186 IonicContact NZ-OE1 3.74Å; K173-E186 PolarHBondContact NZ-OE1 3.16Å; K173-E186 IonicContact NZ-OE2 3.9Å; K173-E186 PolarHBondContact NZ-OE2 3.24Å; F175-E186 WeakPolarHBondContact CZ-OE2 3.01Å; S182-E186 WeakPolarHBondContact O-CB 3.48Å; S182-E186 PolarHBondContact O-N 2.9Å; W183-E186 PolarHBondContact O-N 2.92Å; F184-E186 PolarHBondContact O-N 3.47Å; E186-E188 PolarHBondContact O-N 2.9Å; E186-I189 PolarHBondContact O-N 3.07Å; E186-Y190 HydrophobicContact CG-CD2 3.87Å; E186-Y190 HydrophobicContact CG-CE2 3.68Å; E186-Y190 WeakPolarHBondContact O-CD2 3.39Å; E186-Y190 PolarHBondContact O-N 2.81Å; E186-L219 HydrophobicContact CB-CD1 3.98Å; E186-L219 HydrophobicContact CG-CD1 3.65Å
187	A	94.1	Very high	92.8	Very high	4 Å²	4	67.3 Å²	67.3	3%	0.033	30%	0.302	C	S	.	.	H	α-helix	trans	-62.3	-41.1	174.9	0	0	0	0	0	112.4	W183 F184 Y190 Q191 A206	W183-A187 VanDerWaalsContact O-CB 3.29Å; W183-A187 WeakPolarHBondContact O-CB 3.35Å; W183-A187 PolarHBondContact O-N 3.26Å; F184-A187 PolarHBondContact O-N 3.13Å; A187-Y190 PolarHBondContact O-N 3.36Å; A187-Q191 WeakPolarHBondContact O-CB 3.46Å; A187-Q191 VanDerWaalsContact O-CG 3.3Å; A187-Q191 WeakPolarHBondContact O-CG 3.34Å; A187-Q191 PolarHBondContact O-N 3.03Å; A187-Q191 PolarHBondContact O-NE2 3.44Å; A187-A206 HydrophobicContact CB-CB 3.81Å
188	E	94.4	Very high	93.2	Very high	67 Å²	67	70.1 Å²	70.1	31%	0.313	31%	0.307	S	S	.	.	H	α-helix	trans	-61.2	-45.5	176.1	-174.5	-154.4	-178.1	0	0	111	F184 R185 E186 Q191 T192 K298	F184-E188 WeakPolarHBondContact O-CB 3.44Å; F184-E188 PolarHBondContact O-N 2.66Å; R185-E188 IonicContact NH1-OE2 3.46Å; R185-E188 PolarHBondContact NH1-OE2 3.39Å; R185-E188 PolarHBondContact O-N 3.25Å; E186-E188 PolarHBondContact O-N 2.9Å; E188-Q191 PolarHBondContact O-N 3.28Å; E188-T192 PolarHBondContact O-N 2.73Å; E188-T192 PolarHBondContact O-OG1 3.46Å; E188-K298 IonicContact OE1-NZ 2.67Å; E188-K298 PolarHBondContact OE1-NZ 2.9Å
189	I	95.3	Very high	93.6	Very high	0 Å²	0	59.3 Å²	59.3	0%	0	27%	0.267	C	S	.	.	H	α-helix	trans	-63.1	-50	177.5	-64.5	-66.5	0	0	0	109.8	R185 E186 Q191 T192 L195 L293 A296 K298	R185-I189 WeakPolarHBondContact O-CG1 3.19Å; R185-I189 PolarHBondContact O-N 2.78Å; E186-I189 PolarHBondContact O-N 3.07Å; I189-Q191 PolarHBondContact O-N 2.96Å; I189-T192 WeakPolarHBondContact O-CB 3.49Å; I189-T192 PolarHBondContact O-N 2.81Å; I189-T192 PolarHBondContact O-OG1 2.69Å; I189-L195 WeakPolarHBondContact O-CD2 3.45Å; I189-L293 HydrophobicContact CB-CB 4.35Å; I189-L293 HydrophobicContact CG2-CB 3.68Å; I189-L293 HydrophobicContact CG2-CD1 3.83Å; I189-L293 HydrophobicContact CG2-CG 4.38Å; I189-A296 HydrophobicContact CD1-CB 4.39Å; I189-A296 HydrophobicContact CG1-CB 4.32Å; I189-A296 HydrophobicContact CG2-CB 4.17Å; I189-K298 HydrophobicContact CD1-CD 3.96Å; I189-K298 HydrophobicContact CD1-CG 3.75Å
190	Y	95.6	Very high	94.1	Very high	10 Å²	10	57 Å²	57	4%	0.039	26%	0.255	C	S	.	.	H	α-helix	trans	-61	-29.6	-179.2	-84.6	-63.9	0	0	0	114.3	E186 A187 T192 L195 L201 F203 L219 D292 L293	E186-Y190 HydrophobicContact CG-CD2 3.87Å; E186-Y190 HydrophobicContact CG-CE2 3.68Å; E186-Y190 WeakPolarHBondContact O-CD2 3.39Å; E186-Y190 PolarHBondContact O-N 2.81Å; A187-Y190 PolarHBondContact O-N 3.36Å; Y190-T192 PolarHBondContact O-N 3.02Å; Y190-L195 HydrophobicContact CD1-CD2 4.38Å; Y190-L201 HydrophobicContact CE1-CB 4.34Å; Y190-F203 HydrophobicContact CD1-CB 3.79Å; Y190-F203 HydrophobicContact CD1-CG 4.48Å; Y190-F203 HydrophobicContact CD2-CD2 4.33Å; Y190-F203 HydrophobicContact CG-CB 3.96Å; Y190-F203 AromaticContact CG-CD2 3.95Å; Y190-F203 HydrophobicContact CG-CD2 3.95Å; Y190-F203 HydrophobicContact CG-CG 4.15Å; Y190-L219 HydrophobicContact CD2-CD1 4.04Å; Y190-L219 HydrophobicContact CD2-CD2 4.41Å; Y190-L219 HydrophobicContact CE2-CD1 4.33Å; Y190-L219 HydrophobicContact CE2-CD2 4.4Å; Y190-D292 PolarHBondContact OH-N 2.88Å; Y190-D292 VanDerWaalsContact OH-N 3.15Å; Y190-L293 HydrophobicContact CD1-CD1 3.94Å; Y190-L293 HydrophobicContact CE1-CD1 3.64Å; Y190-L293 HydrophobicContact CE1-CG 4.02Å; Y190-L293 HydrophobicContact CE2-CB 4.26Å; Y190-L293 HydrophobicContact CE2-CG 4.38Å
191	Q	93.8	Very high	94.4	Very high	111 Å²	111	52.1 Å²	52.1	52%	0.519	23%	0.232	S	C	.	.	T	Hydrogen-bonded Turn	trans	-82	4.1	175.8	-73.2	170.6	77.5	0	0	113.8	A187 E188 I189 I193 F203	A187-Q191 WeakPolarHBondContact O-CB 3.46Å; A187-Q191 VanDerWaalsContact O-CG 3.3Å; A187-Q191 WeakPolarHBondContact O-CG 3.34Å; A187-Q191 PolarHBondContact O-N 3.03Å; A187-Q191 PolarHBondContact O-NE2 3.44Å; E188-Q191 PolarHBondContact O-N 3.28Å; I189-Q191 PolarHBondContact O-N 2.96Å; Q191-I193 PolarHBondContact O-N 2.99Å; Q191-F203 HydrophobicContact CG-CD1 4.46Å; Q191-F203 HydrophobicContact CG-CE1 3.68Å; Q191-F203 HydrophobicContact CG-CZ 4.04Å
192	T	93.3	Very high	94.6	Very high	12 Å²	12	41.7 Å²	41.7	7%	0.074	20%	0.195	C	C	.	.			trans	-60.5	132.1	177.2	-60.7	0	0	0	0	110.7	E188 I189 Y190 M194 L195 K267 P268 I270	E188-T192 PolarHBondContact O-N 2.73Å; E188-T192 PolarHBondContact O-OG1 3.46Å; I189-T192 WeakPolarHBondContact O-CB 3.49Å; I189-T192 PolarHBondContact O-N 2.81Å; I189-T192 PolarHBondContact O-OG1 2.69Å; Y190-T192 PolarHBondContact O-N 3.02Å; T192-M194 PolarHBondContact O-N 3.41Å; T192-L195 WeakPolarHBondContact O-CB 3.47Å; T192-L195 PolarHBondContact O-N 2.94Å; T192-L195 VanDerWaalsContact O-N 3.07Å; T192-K267 HydrophobicContact CG2-CG 4.27Å; T192-P268 HydrophobicContact CG2-CG 3.94Å; T192-I270 HydrophobicContact CG2-CD1 4.26Å
193	I	91.1	Very high	94.8	Very high	60 Å²	60	42.3 Å²	42.3	31%	0.308	19%	0.194	S	C	.	.	T	Hydrogen-bonded Turn	trans	-54.7	137.2	178.5	-66.2	157.6	0	0	0	110.5	Q191 L195 Q265 K267	Q191-I193 PolarHBondContact O-N 2.99Å; I193-L195 PolarHBondContact O-N 3.03Å; I193-L195 VanDerWaalsContact O-N 3.08Å; I193-Q265 VanDerWaalsContact CD1-OE1 3.3Å; I193-Q265 HydrophobicContact CG2-CB 3.88Å; I193-Q265 VanDerWaalsContact CG2-O 3.31Å; I193-Q265 WeakPolarHBondContact CG2-O 3.21Å; I193-K267 WeakPolarHBondContact O-CB 3.48Å; I193-K267 WeakPolarHBondContact O-CG 3.44Å
194	M	92.6	Very high	94.7	Very high	85 Å²	85	42.4 Å²	42.4	42%	0.419	20%	0.196	S	C	.	.	T	Hydrogen-bonded Turn	trans	56	19.6	-177.3	-60.5	179.9	77.5	0	0	114.8	T192 H256 I261 K267	T192-M194 PolarHBondContact O-N 3.41Å; M194-H256 PolarHBondContact O-CE1 2.88Å; M194-H256 PolarHBondContact O-NE2 3.09Å; M194-H256 VanDerWaalsContact O-NE2 3.09Å; M194-I261 HydrophobicContact CB-CD1 4.23Å; M194-I261 HydrophobicContact CE-CD1 3.92Å; M194-I261 HydrophobicContact CE-CG2 3.85Å; M194-I261 HydrophobicContact SD-CB 4.49Å; M194-I261 HydrophobicContact SD-CD1 4.38Å; M194-I261 HydrophobicContact SD-CG2 3.86Å; M194-K267 HydrophobicContact CB-CB 4.16Å
195	L	95.4	Very high	94.6	Very high	4 Å²	4	36.8 Å²	36.8	2%	0.021	17%	0.174	C	C	.	.			trans	-69.8	-34.7	174.7	-177.2	65.7	0	0	0	112.8	I189 Y190 T192 I193 H197 I200 H256 L257 I270 L293	I189-L195 WeakPolarHBondContact O-CD2 3.45Å; Y190-L195 HydrophobicContact CD1-CD2 4.38Å; T192-L195 WeakPolarHBondContact O-CB 3.47Å; T192-L195 PolarHBondContact O-N 2.94Å; T192-L195 VanDerWaalsContact O-N 3.07Å; I193-L195 PolarHBondContact O-N 3.03Å; I193-L195 VanDerWaalsContact O-N 3.08Å; L195-H197 PolarHBondContact O-N 3.16Å; L195-I200 HydrophobicContact CG-CG2 4.41Å; L195-H256 PolarHBondContact O-CD2 2.8Å; L195-H256 PolarHBondContact O-NE2 2.79Å; L195-L257 HydrophobicContact CD1-CD2 3.68Å; L195-I270 HydrophobicContact CD1-CD1 3.83Å; L195-L293 HydrophobicContact CD2-CD1 4.02Å
196	R	93.9	Very high	94.7	Very high	88 Å²	88	36.2 Å²	36.2	33%	0.332	18%	0.178	S	C	.	.			trans	-54.4	125.7	-176.6	-169.5	173.8	-177.6	83.7	8.5	110.7	I122 E222	I122-R196 VanDerWaalsContact CG2-NH2 3.34Å; R196-E222 IonicContact NH2-OE1 2.99Å; R196-E222 PolarHBondContact NH2-OE1 3.43Å
197	H	97.1	Very high	94.5	Very high	46 Å²	46	37 Å²	37	21%	0.213	18%	0.183	C	C	.	.			trans	-155	151.1	-177.6	179.8	-91.4	0	0	0	109.2	L195 N199 I200 H256	L195-H197 PolarHBondContact O-N 3.16Å; H197-N199 PolarHBondContact CE1-OD1 3.15Å; H197-N199 PolarHBondContact ND1-N 2.86Å; H197-N199 VanDerWaalsContact ND1-N 3.14Å; H197-N199 PolarHBondContact O-N 2.84Å; H197-I200 HydrophobicContact CB-CB 4.28Å; H197-I200 HydrophobicContact CB-CG1 3.94Å; H197-I200 PolarHBondContact O-N 3.44Å; H197-I200 VanDerWaalsContact O-O 3.08Å; H197-H256 HydrophobicContact CB-CB 4.48Å; H197-H256 VanDerWaalsContact CB-CD2 3.42Å; H197-H256 WeakPolarHBondContact CB-CD2 3.31Å; H197-H256 AromaticContact CD2-CG 3.72Å; H197-H256 AromaticContact CD2-ND1 3.84Å; H197-H256 AromaticContact CG-CD2 3.86Å; H197-H256 AromaticContact CG-CG 3.77Å
198	E	97	Very high	94.2	Very high	127 Å²	127	40.5 Å²	40.5	59%	0.593	20%	0.201	S	C	*	.	T	Hydrogen-bonded Turn	trans	-58.9	-24.4	-174.7	59.4	169.6	154.1	0	0	114.8	K283 V289	E198-K283 PolarHBondContact O-NZ 2.81Å; E198-V289 WeakPolarHBondContact O-CG1 3.46Å
199	N	98.7	Very high	93.8	Very high	4 Å²	4	40 Å²	40	2%	0.021	20%	0.197	C	C	.	.	T	Hydrogen-bonded Turn	trans	-110.9	18.8	179.2	-49.9	124	0	0	0	114	H197 S249 S252 A288 V289 I290	H197-N199 PolarHBondContact CE1-OD1 3.15Å; H197-N199 PolarHBondContact ND1-N 2.86Å; H197-N199 VanDerWaalsContact ND1-N 3.14Å; H197-N199 PolarHBondContact O-N 2.84Å; N199-S249 WeakPolarHBondContact CB-O 3.4Å; N199-S249 VanDerWaalsContact CG-O 3.24Å; N199-S249 WeakPolarHBondContact ND2-CB 3.4Å; N199-S249 PolarHBondContact OD1-O 3.04Å; N199-S252 VanDerWaalsContact OD1-CB 3.29Å; N199-S252 WeakPolarHBondContact OD1-CB 3.41Å; N199-A288 WeakPolarHBondContact CA-O 3.21Å; N199-A288 WeakPolarHBondContact CB-O 3.46Å; N199-A288 PolarHBondContact ND2-O 3.35Å; N199-V289 CarbonylContact O-C 3.23Å; N199-V289 WeakPolarHBondContact O-CA 3.22Å; N199-I290 PolarHBondContact O-N 3.32Å
200	I	98.6	Very high	93.3	Very high	7 Å²	7	45.3 Å²	45.3	4%	0.036	23%	0.226	C	C	.	.	B	Isolated β-bridge	trans	-119	137.7	167.5	-59.7	-61.3	0	0	0	107.3	L195 H197 G202 L257 I290 L293	L195-I200 HydrophobicContact CG-CG2 4.41Å; H197-I200 HydrophobicContact CB-CB 4.28Å; H197-I200 HydrophobicContact CB-CG1 3.94Å; H197-I200 PolarHBondContact O-N 3.44Å; H197-I200 VanDerWaalsContact O-O 3.08Å; I200-G202 PolarHBondContact O-N 2.87Å; I200-L257 HydrophobicContact CD1-CD1 3.84Å; I200-L257 HydrophobicContact CD1-CD2 4.09Å; I200-L257 HydrophobicContact CD1-CG 3.66Å; I200-I290 HydrophobicContact CD1-CB 4Å; I200-I290 HydrophobicContact CD1-CD1 4.43Å; I200-L293 HydrophobicContact CG2-CD1 4.41Å
201	L	98	Very high	92.6	Very high	14 Å²	14	48.2 Å²	48.2	7%	0.073	24%	0.242	C	C	.	.			trans	-54	127.5	-177.6	178.8	59.3	0	0	0	110.9	Y190 F203 E222 L281 V289 I290 A291	Y190-L201 HydrophobicContact CE1-CB 4.34Å; L201-F203 PolarHBondContact O-N 3.5Å; L201-E222 HydrophobicContact CD1-CB 4.42Å; L201-L281 HydrophobicContact CD1-CD1 4.01Å; L201-L281 HydrophobicContact CD2-CD1 4.29Å; L201-V289 HydrophobicContact CB-CG2 4.31Å; L201-V289 HydrophobicContact CD1-CG2 4.28Å; L201-I290 WeakPolarHBondContact CB-O 3.24Å; L201-I290 PolarHBondContact N-O 2.85Å; L201-A291 HydrophobicContact CB-CB 4.14Å; L201-A291 HydrophobicContact CD2-CB 3.76Å
202	G	95.3	Very high	92	Very high	5 Å²	5	46.3 Å²	46.3	5%	0.052	25%	0.252	C	S	.	.			trans	-67.7	102.5	178.9	0	0	0	0	0	111.1	I200 S221 E222	I200-G202 PolarHBondContact O-N 2.87Å; G202-S221 CarbonylContact O-C 3.53Å; G202-S221 VanDerWaalsContact O-CA 3.24Å; G202-S221 WeakPolarHBondContact O-CA 3.45Å; G202-S221 VanDerWaalsContact O-CB 3.31Å; G202-S221 WeakPolarHBondContact O-CB 3.48Å; G202-E222 PolarHBondContact O-N 2.99Å
203	F	94.4	Very high	91.5	Very high	39 Å²	39	50.2 Å²	50.2	17%	0.171	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.9	138.9	169	174.5	-101.9	0	0	0	110.3	Y190 Q191 L201 A205 A206 L219	Y190-F203 HydrophobicContact CD1-CB 3.79Å; Y190-F203 HydrophobicContact CD1-CG 4.48Å; Y190-F203 HydrophobicContact CD2-CD2 4.33Å; Y190-F203 HydrophobicContact CG-CB 3.96Å; Y190-F203 AromaticContact CG-CD2 3.95Å; Y190-F203 HydrophobicContact CG-CD2 3.95Å; Y190-F203 HydrophobicContact CG-CG 4.15Å; Q191-F203 HydrophobicContact CG-CD1 4.46Å; Q191-F203 HydrophobicContact CG-CE1 3.68Å; Q191-F203 HydrophobicContact CG-CZ 4.04Å; L201-F203 PolarHBondContact O-N 3.5Å; F203-A205 VanDerWaalsContact CE2-C 3.43Å; F203-A205 VanDerWaalsContact CE2-O 3.3Å; F203-A205 WeakPolarHBondContact CE2-O 3.49Å; F203-A206 HydrophobicContact CE2-CB 4.23Å; F203-A206 HydrophobicContact CZ-CB 3.98Å; F203-L219 HydrophobicContact CD2-CD2 4.07Å; F203-L219 HydrophobicContact CD2-CG 4.31Å; F203-L219 HydrophobicContact CE2-CD2 4.29Å; F203-L219 HydrophobicContact CE2-CG 4.04Å
204	I	92.2	Very high	91.2	Very high	32 Å²	32	54.5 Å²	54.5	16%	0.164	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	-56.6	178.4	-60.5	174	0	0	0	109.5	L118 I122 W165 V170 V220	L118-I204 HydrophobicContact CD2-CD1 4.49Å; I122-I204 HydrophobicContact CD1-CD1 4.37Å; I122-I204 HydrophobicContact CD1-CG1 4.05Å; W165-I204 HydrophobicContact CE3-CG2 4.32Å; W165-I204 HydrophobicContact CH2-CG2 4.29Å; W165-I204 HydrophobicContact CZ3-CG2 3.67Å; V170-I204 HydrophobicContact CG1-CD1 3.88Å; I204-V220 HydrophobicContact CB-CB 4.35Å; I204-V220 HydrophobicContact CB-CG1 4.17Å; I204-V220 WeakPolarHBondContact CB-O 3.27Å; I204-V220 HydrophobicContact CD1-CG1 4.26Å; I204-V220 HydrophobicContact CG2-CG1 4.39Å; I204-V220 PolarHBondContact N-O 2.89Å
205	A	90.3	Very high	91.1	Very high	10 Å²	10	53.3 Å²	53.3	8%	0.083	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-159.5	159	-174.7	0	0	0	0	0	113.1	I142 F203 V220	I142-A205 HydrophobicContact CD1-CB 3.5Å; I142-A205 VanDerWaalsContact CD1-CB 3.5Å; F203-A205 VanDerWaalsContact CE2-C 3.43Å; F203-A205 VanDerWaalsContact CE2-O 3.3Å; F203-A205 WeakPolarHBondContact CE2-O 3.49Å; A205-V220 HydrophobicContact CB-CB 4.41Å; A205-V220 PolarHBondContact N-O 2.91Å; A205-V220 PolarHBondContact O-N 2.95Å
206	A	92.4	Very high	90.9	Very high	31 Å²	31	54.9 Å²	54.9	26%	0.256	30%	0.297	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121	132.4	163.3	0	0	0	0	0	107.9	W183 A187 F203 W218	W183-A206 HydrophobicContact CZ2-CB 3.82Å; A187-A206 HydrophobicContact CB-CB 3.81Å; F203-A206 HydrophobicContact CE2-CB 4.23Å; F203-A206 HydrophobicContact CZ-CB 3.98Å; A206-W218 WeakPolarHBondContact CA-O 3.39Å
207	D	90.9	Very high	90.9	Very high	22 Å²	22	51.1 Å²	51.1	12%	0.118	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.7	166.7	-170	-161.1	2.6	0	0	0	111.3	T141 I142 A143 W218	T141-D207 WeakPolarHBondContact CA-OD2 3.49Å; I142-D207 PolarHBondContact N-OD2 3.28Å; A143-D207 HydrophobicContact CB-CB 4.1Å; A143-D207 WeakPolarHBondContact CB-OD2 3.49Å; A143-D207 PolarHBondContact N-OD2 3.3Å; D207-W218 PolarHBondContact N-O 2.88Å; D207-W218 WeakPolarHBondContact O-CA 3.35Å; D207-W218 WeakPolarHBondContact O-CB 3.39Å; D207-W218 PolarHBondContact O-N 2.73Å
208	N	88.8	Confident	90.8	Very high	77 Å²	77	48.9 Å²	48.9	41%	0.412	27%	0.273	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	134.6	-179.8	-57.1	-19.6	0	0	0	109.7	T215 Q216 L217	N208-T215 HydrophobicContact CB-CG2 4.25Å; N208-Q216 CarbonylContact C-O 3.56Å; N208-Q216 WeakPolarHBondContact CA-O 3.1Å; N208-L217 HydrophobicContact CB-CD2 4.45Å; N208-L217 WeakPolarHBondContact OD1-CD2 3.18Å
209	K	85.6	Confident	90.6	Very high	55 Å²	55	43 Å²	43	24%	0.239	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	119.1	175.9	-164.3	174.1	-172.6	160.6	0	110.2	A143 I146 Q216 W218	A143-K209 HydrophobicContact CB-CB 4.09Å; A143-K209 HydrophobicContact CB-CD 4.35Å; A143-K209 HydrophobicContact CB-CG 4.5Å; A143-K209 WeakPolarHBondContact O-CE 3.31Å; A143-K209 PolarHBondContact O-NZ 3.43Å; I146-K209 PolarHBondContact O-NZ 2.81Å; K209-Q216 PolarHBondContact N-O 3Å; K209-Q216 WeakPolarHBondContact O-CB 3.09Å; K209-Q216 PolarHBondContact O-N 3.38Å; K209-W218 HydrophobicContact CB-CZ2 4.36Å; K209-W218 HydrophobicContact CD-CH2 3.77Å; K209-W218 HydrophobicContact CD-CZ2 3.36Å; K209-W218 HydrophobicContact CG-CZ2 4.48Å
210	D	84.3	Confident	90.5	Very high	112 Å²	112	42.8 Å²	42.8	60%	0.599	25%	0.245	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-88.1	126	168.9	-167.8	-11.7	0	0	0	108.7	G212	D210-G212 WeakPolarHBondContact OD1-CA 3.44Å; D210-G212 PolarHBondContact OD1-N 3.06Å
211	N	82	Confident	90.4	Very high	71 Å²	71	42.9 Å²	42.9	38%	0.38	25%	0.246	S	C	.	.			trans	-99.7	10.7	176	68.1	10.1	0	0	0	112.7	S213 W214	N211-S213 VanDerWaalsContact C-N 3.29Å; N211-S213 PolarHBondContact O-N 3.23Å; N211-S213 PolarHBondContact OD1-N 3.45Å; N211-W214 VanDerWaalsContact ND2-CE2 3.34Å; N211-W214 WeakPolarHBondContact ND2-CZ2 3.31Å; N211-W214 PolarHBondContact OD1-N 3.48Å; N211-W214 PolarHBondContact OD1-O 2.97Å; N211-W214 VanDerWaalsContact OD1-O 3.06Å
212	G	80.6	Confident	90.2	Very high	71 Å²	71	44 Å²	44	73%	0.732	25%	0.251	S	S	*	.	S	Bend	trans	86.4	-9.5	-177.8	0	0	0	0	0	114.2	D210	D210-G212 WeakPolarHBondContact OD1-CA 3.44Å; D210-G212 PolarHBondContact OD1-N 3.06Å
213	S	82.9	Confident	90.3	Very high	94 Å²	94	46.3 Å²	46.3	66%	0.657	26%	0.259	S	S	*	.	S	Bend	trans	-119.5	-39.2	178.4	-61.1	0	0	0	0	112.8	N211	N211-S213 VanDerWaalsContact C-N 3.29Å; N211-S213 PolarHBondContact O-N 3.23Å; N211-S213 PolarHBondContact OD1-N 3.45Å
214	W	85.2	Confident	90.5	Very high	151 Å²	151	45.5 Å²	45.5	57%	0.572	26%	0.255	S	S	*	.	S	Bend	trans	-155.2	154.2	173.9	58.5	88.1	0	0	0	111.5	N211	N211-W214 VanDerWaalsContact ND2-CE2 3.34Å; N211-W214 WeakPolarHBondContact ND2-CZ2 3.31Å; N211-W214 PolarHBondContact OD1-N 3.48Å; N211-W214 PolarHBondContact OD1-O 2.97Å; N211-W214 VanDerWaalsContact OD1-O 3.06Å
215	T	89.2	Confident	90.6	Very high	60 Å²	60	48.8 Å²	48.8	37%	0.368	27%	0.27	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.3	127.2	174.1	-48.7	0	0	0	0	110.7	N208 L217	N208-T215 HydrophobicContact CB-CG2 4.25Å; T215-L217 HydrophobicContact CG2-CD2 4.31Å
216	Q	92.2	Very high	90.9	Very high	37 Å²	37	50.7 Å²	50.7	17%	0.173	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.6	134.1	169.2	-64.5	-178.6	-23.1	0	0	109.5	I174 N208 K209	I174-Q216 HydrophobicContact CG2-CB 3.84Å; I174-Q216 HydrophobicContact CG2-CG 4.05Å; N208-Q216 CarbonylContact C-O 3.56Å; N208-Q216 WeakPolarHBondContact CA-O 3.1Å; K209-Q216 PolarHBondContact N-O 3Å; K209-Q216 WeakPolarHBondContact O-CB 3.09Å; K209-Q216 PolarHBondContact O-N 3.38Å
217	L	93.2	Very high	91.1	Very high	8 Å²	8	50.3 Å²	50.3	4%	0.042	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.7	121.9	174.1	-50.3	171.7	0	0	0	108	I174 F175 E180 W183 N208 T215	I174-L217 WeakPolarHBondContact CA-O 3.3Å; F175-L217 HydrophobicContact CB-CB 4.21Å; F175-L217 PolarHBondContact N-O 2.9Å; F175-L217 PolarHBondContact O-N 3.36Å; F175-L217 VanDerWaalsContact O-N 3.09Å; E180-L217 HydrophobicContact CB-CD1 3.8Å; E180-L217 HydrophobicContact CG-CD1 3.98Å; W183-L217 HydrophobicContact CB-CB 4.27Å; W183-L217 HydrophobicContact CB-CD1 4.12Å; W183-L217 HydrophobicContact CD2-CB 3.82Å; W183-L217 HydrophobicContact CD2-CD1 4.1Å; W183-L217 HydrophobicContact CD2-CG 4.42Å; W183-L217 HydrophobicContact CE3-CB 4.47Å; W183-L217 HydrophobicContact CE3-CD1 4.04Å; W183-L217 HydrophobicContact CG-CB 3.68Å; W183-L217 HydrophobicContact CG-CD1 4.15Å; N208-L217 HydrophobicContact CB-CD2 4.45Å; N208-L217 WeakPolarHBondContact OD1-CD2 3.18Å; T215-L217 HydrophobicContact CG2-CD2 4.31Å
218	W	94.8	Very high	91.5	Very high	0 Å²	0	49.7 Å²	49.7	0%	0	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	139	-171.9	-73.6	31.7	0	0	0	110.1	A143 I146 L148 V172 I174 W183 A206 D207 K209	A143-W218 HydrophobicContact CB-CD2 3.89Å; A143-W218 HydrophobicContact CB-CE3 3.59Å; A143-W218 HydrophobicContact CB-CG 4.38Å; A143-W218 HydrophobicContact CB-CZ3 4.07Å; I146-W218 HydrophobicContact CB-CZ3 3.8Å; I146-W218 HydrophobicContact CD1-CE3 4.47Å; I146-W218 HydrophobicContact CD1-CZ3 4.3Å; I146-W218 HydrophobicContact CG2-CH2 4.4Å; I146-W218 HydrophobicContact CG2-CZ3 3.76Å; L148-W218 HydrophobicContact CD1-CH2 3.93Å; L148-W218 HydrophobicContact CD1-CZ2 3.83Å; L148-W218 HydrophobicContact CD2-CH2 3.57Å; L148-W218 HydrophobicContact CD2-CZ2 4.14Å; L148-W218 HydrophobicContact CD2-CZ3 4.03Å; L148-W218 HydrophobicContact CG-CH2 3.67Å; L148-W218 HydrophobicContact CG-CZ2 4.11Å; V172-W218 HydrophobicContact CB-CE3 4.47Å; V172-W218 HydrophobicContact CG1-CB 4.26Å; V172-W218 HydrophobicContact CG1-CD2 3.54Å; V172-W218 HydrophobicContact CG1-CE3 3.28Å; V172-W218 HydrophobicContact CG1-CG 4Å; V172-W218 HydrophobicContact CG1-CH2 4.4Å; V172-W218 HydrophobicContact CG1-CZ3 3.74Å; V172-W218 HydrophobicContact CG2-CE3 4.4Å; V172-W218 HydrophobicContact CG2-CZ3 4.29Å; I174-W218 HydrophobicContact CD1-CZ2 3.99Å; I174-W218 HydrophobicContact CG1-CD2 4.44Å; I174-W218 HydrophobicContact CG1-CG 4.39Å; W183-W218 PolarHBondContact NE1-O 2.94Å; A206-W218 WeakPolarHBondContact CA-O 3.39Å; D207-W218 PolarHBondContact N-O 2.88Å; D207-W218 WeakPolarHBondContact O-CA 3.35Å; D207-W218 WeakPolarHBondContact O-CB 3.39Å; D207-W218 PolarHBondContact O-N 2.73Å; K209-W218 HydrophobicContact CB-CZ2 4.36Å; K209-W218 HydrophobicContact CD-CH2 3.77Å; K209-W218 HydrophobicContact CD-CZ2 3.36Å; K209-W218 HydrophobicContact CG-CZ2 4.48Å
219	L	94.4	Very high	92	Very high	3 Å²	3	46 Å²	46	2%	0.016	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	116.5	166.8	-170.2	160.8	0	0	0	107.4	V172 K173 F175 E186 Y190 F203	V172-L219 WeakPolarHBondContact CA-O 3.15Å; K173-L219 HydrophobicContact CB-CB 4.33Å; K173-L219 PolarHBondContact N-O 2.62Å; K173-L219 PolarHBondContact O-N 2.98Å; F175-L219 HydrophobicContact CE2-CB 4.06Å; E186-L219 HydrophobicContact CB-CD1 3.98Å; E186-L219 HydrophobicContact CG-CD1 3.65Å; Y190-L219 HydrophobicContact CD2-CD1 4.04Å; Y190-L219 HydrophobicContact CD2-CD2 4.41Å; Y190-L219 HydrophobicContact CE2-CD1 4.33Å; Y190-L219 HydrophobicContact CE2-CD2 4.4Å; F203-L219 HydrophobicContact CD2-CD2 4.07Å; F203-L219 HydrophobicContact CD2-CG 4.31Å; F203-L219 HydrophobicContact CE2-CD2 4.29Å; F203-L219 HydrophobicContact CE2-CG 4.04Å
220	V	95.6	Very high	92.6	Very high	0 Å²	0	46 Å²	46	0%	0	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	131.2	-174.2	-170.6	0	0	0	0	109.6	I146 V170 A171 I204 A205	I146-V220 HydrophobicContact CD1-CB 4.48Å; I146-V220 HydrophobicContact CD1-CG1 3.85Å; I146-V220 HydrophobicContact CD1-CG2 3.75Å; V170-V220 HydrophobicContact CB-CG1 4.03Å; V170-V220 HydrophobicContact CG1-CG1 4.39Å; V170-V220 HydrophobicContact CG2-CG1 4.23Å; A171-V220 CarbonylContact O-C 3.58Å; A171-V220 WeakPolarHBondContact O-CA 3.24Å; I204-V220 HydrophobicContact CB-CB 4.35Å; I204-V220 HydrophobicContact CB-CG1 4.17Å; I204-V220 WeakPolarHBondContact CB-O 3.27Å; I204-V220 HydrophobicContact CD1-CG1 4.26Å; I204-V220 HydrophobicContact CG2-CG1 4.39Å; I204-V220 PolarHBondContact N-O 2.89Å; A205-V220 HydrophobicContact CB-CB 4.41Å; A205-V220 PolarHBondContact N-O 2.91Å; A205-V220 PolarHBondContact O-N 2.95Å
221	S	95.6	Very high	93.2	Very high	9 Å²	9	43.5 Å²	43.5	6%	0.063	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.1	170.6	-179.6	59	0	0	0	0	112.5	A171 G202 Y223	A171-S221 PolarHBondContact N-O 2.88Å; A171-S221 PolarHBondContact O-N 3.36Å; G202-S221 CarbonylContact O-C 3.53Å; G202-S221 VanDerWaalsContact O-CA 3.24Å; G202-S221 WeakPolarHBondContact O-CA 3.45Å; G202-S221 VanDerWaalsContact O-CB 3.31Å; G202-S221 WeakPolarHBondContact O-CB 3.48Å; S221-Y223 PolarHBondContact O-N 2.77Å
222	E	95.4	Very high	94	Very high	38 Å²	38	42.1 Å²	42.1	18%	0.178	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-57	134	172.5	-69.7	177.3	-176.9	0	0	111	R196 L201 G202 H224	R196-E222 IonicContact NH2-OE1 2.99Å; R196-E222 PolarHBondContact NH2-OE1 3.43Å; L201-E222 HydrophobicContact CD1-CB 4.42Å; G202-E222 PolarHBondContact O-N 2.99Å; E222-H224 IonicContact OE2-CE1 3.85Å
223	Y	97.1	Very high	94.9	Very high	53 Å²	53	38.7 Å²	38.7	21%	0.208	19%	0.194	C	C	.	.			trans	-84.1	139.8	172.2	178.7	-109.3	0	0	0	111.1	I152 R162 D169 S221 E225	I152-Y223 HydrophobicContact CD1-CD2 4.03Å; I152-Y223 HydrophobicContact CD1-CE2 3.8Å; I152-Y223 HydrophobicContact CG2-CE2 4.45Å; R162-Y223 HydrophobicContact CB-CE2 4.25Å; R162-Y223 HydrophobicContact CG-CD2 4.33Å; R162-Y223 HydrophobicContact CG-CE2 4.15Å; D169-Y223 HydrophobicContact CB-CD1 3.57Å; D169-Y223 HydrophobicContact CB-CE1 4.39Å; D169-Y223 HydrophobicContact CB-CG 4Å; D169-Y223 WeakPolarHBondContact O-CB 3.21Å; S221-Y223 PolarHBondContact O-N 2.77Å; Y223-E225 HydrophobicContact CE1-CB 3.98Å
224	H	97.3	Very high	95.6	Very high	22 Å²	22	37.9 Å²	37.9	10%	0.102	18%	0.182	C	C	.	.			trans	-127.4	110	176	-66.9	-28.3	0	0	0	110	E222 H226 G227 L281 V289	E222-H224 IonicContact OE2-CE1 3.85Å; H224-H226 VanDerWaalsContact C-N 3.27Å; H224-H226 PolarHBondContact O-N 3.34Å; H224-G227 PolarHBondContact O-N 2.97Å; H224-L281 HydrophobicContact CB-CB 4.32Å; H224-V289 VanDerWaalsContact CD2-CG2 3.49Å; H224-V289 WeakPolarHBondContact CD2-CG2 3.21Å; H224-V289 WeakPolarHBondContact NE2-CG2 3.41Å
225	E	95.6	Very high	96.2	Very high	101 Å²	101	38.6 Å²	38.6	47%	0.472	18%	0.184	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.2	-27	-170	67.1	-175.4	145.5	0	0	114.9	Y223 G227 R284	Y223-E225 HydrophobicContact CE1-CB 3.98Å; E225-G227 PolarHBondContact O-N 3.23Å; E225-R284 WeakPolarHBondContact OE1-CD 3.44Å; E225-R284 VanDerWaalsContact OE1-CG 3.25Å; E225-R284 WeakPolarHBondContact OE1-CG 3.36Å; E225-R284 IonicContact OE1-NE 2.77Å
226	H	96.9	Very high	96.6	Very high	50 Å²	50	40.9 Å²	40.9	23%	0.231	19%	0.187	C	C	.	.	T	Hydrogen-bonded Turn	trans	-76.7	-5.2	176.7	-68.2	-42.3	0	0	0	113	H224 Y232 V282 K283	H224-H226 VanDerWaalsContact C-N 3.27Å; H224-H226 PolarHBondContact O-N 3.34Å; H226-Y232 HydrophobicContact CB-CD2 3.91Å; H226-Y232 HydrophobicContact CB-CE2 4.33Å; H226-V282 HydrophobicContact CB-CB 3.87Å; H226-V282 HydrophobicContact CB-CG1 4.12Å; H226-V282 WeakPolarHBondContact CB-O 3.25Å; H226-K283 PolarHBondContact CD2-O 3.5Å
227	G	96.7	Very high	96.8	Very high	22 Å²	22	42.1 Å²	42.1	23%	0.227	20%	0.197	C	C	.	.			trans	65.4	-149.4	178	0	0	0	0	0	112.3	H224 E225 L281 V282	H224-G227 PolarHBondContact O-N 2.97Å; E225-G227 PolarHBondContact O-N 3.23Å; G227-L281 VanDerWaalsContact O-CA 3.31Å; G227-L281 WeakPolarHBondContact O-CA 3.45Å; G227-V282 PolarHBondContact O-N 3.39Å
228	S	98.1	Very high	97	Very high	9 Å²	9	42.1 Å²	42.1	6%	0.063	20%	0.197	C	C	.	.	B	Isolated β-bridge	trans	-74.9	156.5	-179.3	72.8	0	0	0	0	112.4	Y230 D231 Y232 V280	S228-Y230 PolarHBondContact O-N 3.46Å; S228-Y230 WeakPolarHBondContact OG-CB 3.26Å; S228-D231 PolarHBondContact N-OD2 2.97Å; S228-D231 PolarHBondContact O-N 3.43Å; S228-D231 PolarHBondContact OG-N 3.03Å; S228-D231 VanDerWaalsContact OG-N 3.13Å; S228-D231 PolarHBondContact OG-OD2 2.84Å; S228-Y232 WeakPolarHBondContact O-CB 3.22Å; S228-Y232 PolarHBondContact O-N 3.41Å; S228-V280 CarbonylContact C-O 3.56Å; S228-V280 WeakPolarHBondContact CA-O 3.43Å
229	L	98.8	Very high	97.1	Very high	1 Å²	1	45.3 Å²	45.3	1%	0.005	22%	0.22	C	C	.	.	H	α-helix	trans	-58.7	-34	172	-179.1	65.1	0	0	0	110.4	Y232 L233 L246 S277 V280 V282 V348	L229-Y232 PolarHBondContact O-N 3.39Å; L229-L233 HydrophobicContact CD1-CD1 3.9Å; L229-L233 HydrophobicContact CD1-CD2 4.17Å; L229-L233 HydrophobicContact CD1-CG 3.79Å; L229-L233 HydrophobicContact CD2-CD1 4.35Å; L229-L233 HydrophobicContact CG-CD1 3.75Å; L229-L233 HydrophobicContact CG-CG 4.06Å; L229-L233 VanDerWaalsContact O-CB 3.27Å; L229-L233 WeakPolarHBondContact O-CB 3.31Å; L229-L233 WeakPolarHBondContact O-CG 3.36Å; L229-L233 PolarHBondContact O-N 3.14Å; L229-L246 HydrophobicContact CD1-CD1 4.25Å; L229-L246 HydrophobicContact CD1-CD2 4.42Å; L229-S277 WeakPolarHBondContact CB-O 3.35Å; L229-S277 PolarHBondContact N-O 3.44Å; L229-V280 HydrophobicContact CB-CB 3.99Å; L229-V280 HydrophobicContact CB-CG1 3.97Å; L229-V280 HydrophobicContact CD2-CB 4.39Å; L229-V280 HydrophobicContact CD2-CG1 4.13Å; L229-V280 PolarHBondContact N-O 3.5Å; L229-V282 HydrophobicContact CB-CG2 4.25Å; L229-V282 HydrophobicContact CD1-CG2 3.92Å; L229-V348 HydrophobicContact CD2-CG1 3.73Å
230	Y	98.4	Very high	97.2	Very high	54 Å²	54	47.2 Å²	47.2	21%	0.212	23%	0.231	C	C	.	.	H	α-helix	trans	-55.9	-52.7	170.1	174.2	-87.2	0	0	0	111.6	S228 Y232 L233 N234 S277 K278 F365 L367	S228-Y230 PolarHBondContact O-N 3.46Å; S228-Y230 WeakPolarHBondContact OG-CB 3.26Å; Y230-Y232 VanDerWaalsContact C-N 3.34Å; Y230-Y232 PolarHBondContact O-N 3.02Å; Y230-L233 PolarHBondContact O-N 3.04Å; Y230-N234 PolarHBondContact O-N 3.37Å; Y230-N234 VanDerWaalsContact O-N 3.14Å; Y230-N234 PolarHBondContact O-ND2 3.07Å; Y230-S277 PolarHBondContact N-O 2.99Å; Y230-K278 HydrophobicContact CD1-CG 4.16Å; Y230-K278 HydrophobicContact CD2-CG 4.09Å; Y230-K278 HydrophobicContact CG-CD 4.44Å; Y230-K278 HydrophobicContact CG-CG 3.69Å; Y230-F365 AromaticContact CD2-CE1 3.81Å; Y230-F365 HydrophobicContact CD2-CE1 3.81Å; Y230-F365 AromaticContact CD2-CZ 3.5Å; Y230-F365 HydrophobicContact CD2-CZ 3.5Å; Y230-F365 AromaticContact CE2-CE1 3.5Å; Y230-F365 HydrophobicContact CE2-CE1 3.5Å; Y230-F365 AromaticContact CE2-CZ 3.71Å; Y230-F365 HydrophobicContact CE2-CZ 3.71Å; Y230-F365 HydrophobicContact CG-CZ 4.35Å; Y230-L367 HydrophobicContact CD2-CD2 3.91Å; Y230-L367 HydrophobicContact CE2-CD1 4.33Å; Y230-L367 HydrophobicContact CE2-CD2 3.78Å; Y230-L367 HydrophobicContact CE2-CG 4.1Å
231	D	97.5	Very high	97.2	Very high	59 Å²	59	52.4 Å²	52.4	32%	0.316	26%	0.256	S	S	.	.	H	α-helix	trans	-65.3	-40.6	-179.6	-58	-50	0	0	0	111.5	S228 N234 R235	S228-D231 PolarHBondContact N-OD2 2.97Å; S228-D231 PolarHBondContact O-N 3.43Å; S228-D231 PolarHBondContact OG-N 3.03Å; S228-D231 VanDerWaalsContact OG-N 3.13Å; S228-D231 PolarHBondContact OG-OD2 2.84Å; D231-N234 PolarHBondContact O-N 3.01Å; D231-R235 WeakPolarHBondContact O-CG 3.36Å; D231-R235 PolarHBondContact O-N 3.47Å
232	Y	98.6	Very high	97.3	Very high	42 Å²	42	53 Å²	53	17%	0.165	26%	0.263	C	S	.	.	H	α-helix	trans	-61	-47.6	178.7	-170	-94.3	0	0	0	111.9	H226 S228 L229 Y230 N234 R235 Y236 V238 L246 V282	H226-Y232 HydrophobicContact CB-CD2 3.91Å; H226-Y232 HydrophobicContact CB-CE2 4.33Å; S228-Y232 WeakPolarHBondContact O-CB 3.22Å; S228-Y232 PolarHBondContact O-N 3.41Å; L229-Y232 PolarHBondContact O-N 3.39Å; Y230-Y232 VanDerWaalsContact C-N 3.34Å; Y230-Y232 PolarHBondContact O-N 3.02Å; Y232-N234 VanDerWaalsContact C-N 3.33Å; Y232-N234 PolarHBondContact O-N 3.26Å; Y232-R235 PolarHBondContact O-N 3.42Å; Y232-Y236 HydrophobicContact CD1-CD2 4.37Å; Y232-Y236 AromaticContact CD2-CD2 3.57Å; Y232-Y236 HydrophobicContact CD2-CD2 3.57Å; Y232-Y236 AromaticContact CD2-CE2 3.92Å; Y232-Y236 HydrophobicContact CD2-CE2 3.92Å; Y232-Y236 HydrophobicContact CE1-CD2 4.38Å; Y232-Y236 AromaticContact CE2-CD2 3.6Å; Y232-Y236 HydrophobicContact CE2-CD2 3.6Å; Y232-Y236 AromaticContact CE2-CE2 3.97Å; Y232-Y236 HydrophobicContact CE2-CE2 3.97Å; Y232-Y236 HydrophobicContact CE2-CG 4.45Å; Y232-Y236 AromaticContact CG-CD2 3.99Å; Y232-Y236 HydrophobicContact CG-CD2 3.99Å; Y232-Y236 WeakPolarHBondContact O-CB 3.31Å; Y232-Y236 WeakPolarHBondContact O-CD2 3.2Å; Y232-Y236 PolarHBondContact O-N 3.36Å; Y232-V238 HydrophobicContact CE1-CG1 3.85Å; Y232-L246 HydrophobicContact CE1-CD1 4.3Å; Y232-V282 HydrophobicContact CD1-CG2 4.29Å; Y232-V282 HydrophobicContact CD2-CB 4.18Å; Y232-V282 HydrophobicContact CD2-CG1 3.99Å; Y232-V282 HydrophobicContact CD2-CG2 4.27Å; Y232-V282 HydrophobicContact CE2-CG1 4Å; Y232-V282 HydrophobicContact CG-CB 4.31Å; Y232-V282 HydrophobicContact CG-CG1 4.32Å; Y232-V282 HydrophobicContact CG-CG2 3.89Å
233	L	98.6	Very high	97.5	Very high	0 Å²	0	51.2 Å²	51.2	0%	0	26%	0.255	C	S	.	.	H	α-helix	trans	-72.1	-25	-178.7	-68.4	-179.8	0	0	0	113.4	L229 Y230 V238 E351 L352 R355 F365	L229-L233 HydrophobicContact CD1-CD1 3.9Å; L229-L233 HydrophobicContact CD1-CD2 4.17Å; L229-L233 HydrophobicContact CD1-CG 3.79Å; L229-L233 HydrophobicContact CD2-CD1 4.35Å; L229-L233 HydrophobicContact CG-CD1 3.75Å; L229-L233 HydrophobicContact CG-CG 4.06Å; L229-L233 VanDerWaalsContact O-CB 3.27Å; L229-L233 WeakPolarHBondContact O-CB 3.31Å; L229-L233 WeakPolarHBondContact O-CG 3.36Å; L229-L233 PolarHBondContact O-N 3.14Å; Y230-L233 PolarHBondContact O-N 3.04Å; L233-V238 HydrophobicContact CD2-CG1 4.45Å; L233-E351 HydrophobicContact CD1-CB 4.17Å; L233-L352 HydrophobicContact CD1-CB 4.33Å; L233-L352 HydrophobicContact CD2-CD1 3.76Å; L233-R355 HydrophobicContact CB-CG 3.96Å; L233-R355 HydrophobicContact CD2-CB 3.82Å; L233-R355 HydrophobicContact CD2-CG 3.89Å; L233-R355 HydrophobicContact CG-CG 4.37Å; L233-R355 PolarHBondContact O-NE 2.94Å; L233-F365 HydrophobicContact CB-CD2 3.55Å; L233-F365 HydrophobicContact CB-CE2 3.78Å; L233-F365 HydrophobicContact CD1-CE2 4.26Å
234	N	98	Very high	97.5	Very high	76 Å²	76	49 Å²	49	41%	0.406	25%	0.247	S	C	.	.	H	α-helix	trans	-69.2	-35.6	169.3	-85.8	-81.6	0	0	0	112.2	Y230 D231 Y232 F365	Y230-N234 PolarHBondContact O-N 3.37Å; Y230-N234 VanDerWaalsContact O-N 3.14Å; Y230-N234 PolarHBondContact O-ND2 3.07Å; D231-N234 PolarHBondContact O-N 3.01Å; Y232-N234 VanDerWaalsContact C-N 3.33Å; Y232-N234 PolarHBondContact O-N 3.26Å; N234-F365 WeakPolarHBondContact ND2-CD1 3.33Å; N234-F365 WeakPolarHBondContact ND2-CE1 3.19Å; N234-F365 WeakPolarHBondContact OD1-CD1 3.29Å
235	R	97.6	Very high	97.6	Very high	166 Å²	166	50.4 Å²	50.4	63%	0.626	26%	0.257	S	S	*	.	H	α-helix	trans	-88	-35	-176	-67.6	175.3	-166.9	179.6	5.9	113.1	D231 Y232	D231-R235 WeakPolarHBondContact O-CG 3.36Å; D231-R235 PolarHBondContact O-N 3.47Å; Y232-R235 PolarHBondContact O-N 3.42Å
236	Y	97.6	Very high	97.7	Very high	109 Å²	109	45.8 Å²	45.8	43%	0.427	24%	0.236	S	C	.	.			trans	-124.8	154.3	-167.8	-54	-68.1	0	0	0	112.1	Y232 R355	Y232-Y236 HydrophobicContact CD1-CD2 4.37Å; Y232-Y236 AromaticContact CD2-CD2 3.57Å; Y232-Y236 HydrophobicContact CD2-CD2 3.57Å; Y232-Y236 AromaticContact CD2-CE2 3.92Å; Y232-Y236 HydrophobicContact CD2-CE2 3.92Å; Y232-Y236 HydrophobicContact CE1-CD2 4.38Å; Y232-Y236 AromaticContact CE2-CD2 3.6Å; Y232-Y236 HydrophobicContact CE2-CD2 3.6Å; Y232-Y236 AromaticContact CE2-CE2 3.97Å; Y232-Y236 HydrophobicContact CE2-CE2 3.97Å; Y232-Y236 HydrophobicContact CE2-CG 4.45Å; Y232-Y236 AromaticContact CG-CD2 3.99Å; Y232-Y236 HydrophobicContact CG-CD2 3.99Å; Y232-Y236 WeakPolarHBondContact O-CB 3.31Å; Y232-Y236 WeakPolarHBondContact O-CD2 3.2Å; Y232-Y236 PolarHBondContact O-N 3.36Å; Y236-R355 PolarHBondContact O-NE 3.49Å; Y236-R355 PolarHBondContact O-NH2 3.27Å
237	T	97.9	Very high	97.8	Very high	62 Å²	62	43.4 Å²	43.4	38%	0.38	23%	0.225	S	C	.	.			trans	-95.6	154.8	156.9	53.8	0	0	0	0	108.9	R355 H362	T237-R355 CarbonylContact C-O 3.6Å; T237-R355 WeakPolarHBondContact CA-O 3.38Å; T237-R355 VanDerWaalsContact CG2-NH2 3.33Å; T237-H362 HydrophobicContact CG2-CB 4.46Å
238	V	97.4	Very high	97.9	Very high	8 Å²	8	44.1 Å²	44.1	5%	0.048	22%	0.223	C	C	.	.	B	Isolated β-bridge	trans	-113.7	149.2	176.7	-61.9	0	0	0	0	110.8	Y232 L233 M243 L246 L352 R355 C356 S357	Y232-V238 HydrophobicContact CE1-CG1 3.85Å; L233-V238 HydrophobicContact CD2-CG1 4.45Å; V238-M243 HydrophobicContact CG2-CB 3.98Å; V238-L246 HydrophobicContact CG1-CD1 4.02Å; V238-L352 HydrophobicContact CG2-CD1 4.07Å; V238-R355 PolarHBondContact N-O 2.88Å; V238-C356 HydrophobicContact CG2-CB 4.39Å; V238-C356 CarbonylContact O-C 3.58Å; V238-C356 VanDerWaalsContact O-CA 3.31Å; V238-C356 WeakPolarHBondContact O-CA 3.46Å; V238-S357 PolarHBondContact O-N 3Å
239	S	96.9	Very high	97.9	Very high	67 Å²	67	44 Å²	44	47%	0.469	22%	0.222	S	C	.	.			trans	-71.6	169.8	166.4	68	0	0	0	0	110.2	E241 G242 M243	S239-E241 PolarHBondContact O-N 3.35Å; S239-E241 PolarHBondContact OG-N 2.71Å; S239-G242 PolarHBondContact O-N 3.07Å; S239-G242 PolarHBondContact OG-N 2.98Å; S239-M243 WeakPolarHBondContact O-CB 3.45Å; S239-M243 PolarHBondContact O-N 3.08Å
240	V	96.3	Very high	97.9	Very high	43 Å²	43	44 Å²	44	26%	0.261	22%	0.223	S	C	.	.	H	α-helix	trans	-54.6	-40.2	171.2	175.1	0	0	0	0	111.4	M243 V244 V358 A404	V240-M243 HydrophobicContact CG1-CE 4.47Å; V240-M243 WeakPolarHBondContact O-CB 3.46Å; V240-M243 PolarHBondContact O-N 2.99Å; V240-V244 WeakPolarHBondContact O-CG2 3.22Å; V240-V244 PolarHBondContact O-N 3.12Å; V240-V358 HydrophobicContact CG2-CG2 3.84Å; V240-A404 HydrophobicContact CG1-CB 3.46Å; V240-A404 VanDerWaalsContact CG1-CB 3.46Å
241	E	95.7	Very high	97.9	Very high	109 Å²	109	41.5 Å²	41.5	51%	0.509	21%	0.212	S	C	.	.	H	α-helix	trans	-67.9	-46.9	178.4	-174.7	177.7	153	0	0	111.8	S239 M243 V244 V245 K440	S239-E241 PolarHBondContact O-N 3.35Å; S239-E241 PolarHBondContact OG-N 2.71Å; E241-M243 VanDerWaalsContact C-N 3.27Å; E241-M243 PolarHBondContact O-N 2.77Å; E241-V244 PolarHBondContact O-N 3.46Å; E241-V244 VanDerWaalsContact O-N 3.09Å; E241-V245 WeakPolarHBondContact O-CG2 3.42Å; E241-V245 PolarHBondContact O-N 2.83Å; E241-K440 IonicContact OE2-NZ 2.72Å; E241-K440 PolarHBondContact OE2-NZ 3.48Å
242	G	97.6	Very high	98	Very high	22 Å²	22	39 Å²	39	23%	0.227	20%	0.2	C	C	.	.	H	α-helix	trans	-58.7	-39.8	175.1	0	0	0	0	0	112.3	S239 V245 L246	S239-G242 PolarHBondContact O-N 3.07Å; S239-G242 PolarHBondContact OG-N 2.98Å; G242-V245 PolarHBondContact O-N 3.24Å; G242-L246 WeakPolarHBondContact O-CB 3.35Å; G242-L246 VanDerWaalsContact O-CG 3.31Å; G242-L246 WeakPolarHBondContact O-CG 3.22Å; G242-L246 PolarHBondContact O-N 3.41Å
243	M	98.3	Very high	98	Very high	0 Å²	0	37 Å²	37	0%	0	19%	0.192	C	C	.	.	H	α-helix	trans	-59.3	-48.8	172.6	177.4	-172.1	71.4	0	0	111.5	V238 S239 V240 E241 A247 L352 A353 C356 A404 L405 M408	V238-M243 HydrophobicContact CG2-CB 3.98Å; S239-M243 WeakPolarHBondContact O-CB 3.45Å; S239-M243 PolarHBondContact O-N 3.08Å; V240-M243 HydrophobicContact CG1-CE 4.47Å; V240-M243 WeakPolarHBondContact O-CB 3.46Å; V240-M243 PolarHBondContact O-N 2.99Å; E241-M243 VanDerWaalsContact C-N 3.27Å; E241-M243 PolarHBondContact O-N 2.77Å; M243-A247 VanDerWaalsContact O-CB 3.23Å; M243-A247 WeakPolarHBondContact O-CB 3.18Å; M243-A247 PolarHBondContact O-N 2.66Å; M243-L352 HydrophobicContact CG-CD2 4.24Å; M243-L352 HydrophobicContact CG-CG 4.03Å; M243-A353 HydrophobicContact SD-CB 4.27Å; M243-C356 HydrophobicContact CB-CB 4.37Å; M243-C356 HydrophobicContact CG-CB 4.47Å; M243-C356 HydrophobicContact SD-CB 3.71Å; M243-A404 HydrophobicContact CE-CB 3.78Å; M243-L405 HydrophobicContact CE-CD2 4.22Å; M243-L405 HydrophobicContact CE-CG 4.49Å; M243-L405 HydrophobicContact SD-CD2 3.65Å; M243-L405 HydrophobicContact SD-CG 4.49Å; M243-M408 HydrophobicContact CE-CG 3.87Å; M243-M408 HydrophobicContact SD-CG 4.13Å
244	V	97.9	Very high	98	Very high	8 Å²	8	37 Å²	37	5%	0.048	19%	0.192	C	C	.	.	H	α-helix	trans	-64.9	-42.5	-179.4	171.4	0	0	0	0	111.1	V240 E241 A247 L248 V433 L436	V240-V244 WeakPolarHBondContact O-CG2 3.22Å; V240-V244 PolarHBondContact O-N 3.12Å; E241-V244 PolarHBondContact O-N 3.46Å; E241-V244 VanDerWaalsContact O-N 3.09Å; V244-A247 PolarHBondContact O-N 2.99Å; V244-L248 WeakPolarHBondContact O-CB 3.18Å; V244-L248 PolarHBondContact O-N 2.73Å; V244-V433 HydrophobicContact CG1-CG1 4.06Å; V244-L436 HydrophobicContact CG1-CB 4.28Å; V244-L436 HydrophobicContact CG2-CB 4.12Å; V244-L436 HydrophobicContact CG2-CD1 4.43Å
245	V	98.3	Very high	98.1	Very high	51 Å²	51	33.6 Å²	33.6	31%	0.309	17%	0.174	S	C	.	.	H	α-helix	trans	-62.4	-47.1	178	170.5	0	0	0	0	111.5	E241 G242 L248 S249 T287	E241-V245 WeakPolarHBondContact O-CG2 3.42Å; E241-V245 PolarHBondContact O-N 2.83Å; G242-V245 PolarHBondContact O-N 3.24Å; V245-L248 PolarHBondContact O-N 3.24Å; V245-S249 WeakPolarHBondContact O-CB 3.29Å; V245-S249 PolarHBondContact O-N 2.81Å; V245-S249 PolarHBondContact O-OG 3.25Å; V245-T287 HydrophobicContact CG1-CG2 3.81Å
246	L	98.8	Very high	98.1	Very high	3 Å²	3	26.6 Å²	26.6	2%	0.016	15%	0.148	C	C	.	.	H	α-helix	trans	-64.5	-46.1	176.6	-73.1	168.3	0	0	0	111.4	L229 Y232 V238 G242 L248 S249 V250 V282 G286 A288 L352	L229-L246 HydrophobicContact CD1-CD1 4.25Å; L229-L246 HydrophobicContact CD1-CD2 4.42Å; Y232-L246 HydrophobicContact CE1-CD1 4.3Å; V238-L246 HydrophobicContact CG1-CD1 4.02Å; G242-L246 WeakPolarHBondContact O-CB 3.35Å; G242-L246 VanDerWaalsContact O-CG 3.31Å; G242-L246 WeakPolarHBondContact O-CG 3.22Å; G242-L246 PolarHBondContact O-N 3.41Å; L246-L248 PolarHBondContact O-N 3.3Å; L246-S249 WeakPolarHBondContact CA-OG 3.17Å; L246-S249 PolarHBondContact O-N 3.31Å; L246-S249 PolarHBondContact O-OG 3.43Å; L246-V250 VanDerWaalsContact O-CG2 3.32Å; L246-V250 WeakPolarHBondContact O-CG2 3.39Å; L246-V250 PolarHBondContact O-N 3.24Å; L246-V250 VanDerWaalsContact O-N 3.08Å; L246-V282 HydrophobicContact CD2-CG1 4.13Å; L246-V282 HydrophobicContact CD2-CG2 4.12Å; L246-G286 WeakPolarHBondContact CD2-O 3.32Å; L246-A288 HydrophobicContact CD2-CB 4.07Å; L246-L352 HydrophobicContact CB-CD1 4.15Å; L246-L352 HydrophobicContact CB-CD2 3.83Å; L246-L352 HydrophobicContact CD1-CD1 3.74Å
247	A	98.8	Very high	98.2	Very high	0 Å²	0	21.4 Å²	21.4	0%	0	13%	0.128	C	C	.	.	H	α-helix	trans	-62.4	-42.7	178.1	0	0	0	0	0	112.1	M243 V244 A251 F349 L352 M408 V433	M243-A247 VanDerWaalsContact O-CB 3.23Å; M243-A247 WeakPolarHBondContact O-CB 3.18Å; M243-A247 PolarHBondContact O-N 2.66Å; V244-A247 PolarHBondContact O-N 2.99Å; A247-A251 WeakPolarHBondContact O-CB 3.3Å; A247-A251 PolarHBondContact O-N 3.09Å; A247-F349 HydrophobicContact CB-CD1 4.4Å; A247-F349 HydrophobicContact CB-CE1 3.85Å; A247-F349 HydrophobicContact CB-CE2 4.41Å; A247-F349 HydrophobicContact CB-CZ 3.85Å; A247-F349 WeakPolarHBondContact O-CZ 3.17Å; A247-L352 HydrophobicContact CB-CD2 3.98Å; A247-M408 HydrophobicContact CB-CE 3.91Å; A247-M408 HydrophobicContact CB-SD 4.37Å; A247-V433 HydrophobicContact CB-CG1 4.01Å
248	L	98.7	Very high	98.2	Very high	38 Å²	38	19 Å²	19	20%	0.199	11%	0.113	C	C	.	.	H	α-helix	trans	-66.2	-42.4	-179.4	-179	57.8	0	0	0	111.7	V244 V245 L246 A251 S252 K430 V433	V244-L248 WeakPolarHBondContact O-CB 3.18Å; V244-L248 PolarHBondContact O-N 2.73Å; V245-L248 PolarHBondContact O-N 3.24Å; L246-L248 PolarHBondContact O-N 3.3Å; L248-A251 PolarHBondContact O-N 3.31Å; L248-S252 WeakPolarHBondContact O-CB 3.31Å; L248-S252 PolarHBondContact O-N 3.37Å; L248-S252 PolarHBondContact O-OG 3.44Å; L248-K430 HydrophobicContact CD1-CG 3.99Å; L248-V433 HydrophobicContact CB-CG1 3.81Å; L248-V433 HydrophobicContact CD1-CB 4.36Å; L248-V433 HydrophobicContact CD1-CG1 4.46Å
249	S	98.8	Very high	98.2	Very high	6 Å²	6	22.4 Å²	22.4	4%	0.042	13%	0.129	C	C	.	.	H	α-helix	trans	-64.8	-46	177.8	45.5	0	0	0	0	111.8	N199 V245 L246 A251 S252 G253 A288	N199-S249 WeakPolarHBondContact CB-O 3.4Å; N199-S249 VanDerWaalsContact CG-O 3.24Å; N199-S249 WeakPolarHBondContact ND2-CB 3.4Å; N199-S249 PolarHBondContact OD1-O 3.04Å; V245-S249 WeakPolarHBondContact O-CB 3.29Å; V245-S249 PolarHBondContact O-N 2.81Å; V245-S249 PolarHBondContact O-OG 3.25Å; L246-S249 WeakPolarHBondContact CA-OG 3.17Å; L246-S249 PolarHBondContact O-N 3.31Å; L246-S249 PolarHBondContact O-OG 3.43Å; S249-A251 PolarHBondContact O-N 3.46Å; S249-S252 PolarHBondContact O-N 3.14Å; S249-G253 PolarHBondContact O-N 3.13Å; S249-A288 WeakPolarHBondContact OG-CB 3.42Å; S249-A288 PolarHBondContact OG-N 3.07Å
250	V	98.9	Very high	98.2	Very high	2 Å²	2	22.9 Å²	22.9	1%	0.012	12%	0.124	C	C	.	.	H	α-helix	trans	-62.1	-46.3	175.5	-178.8	0	0	0	0	111.2	L246 S252 G253 L254 V280 A288 L345	L246-V250 VanDerWaalsContact O-CG2 3.32Å; L246-V250 WeakPolarHBondContact O-CG2 3.39Å; L246-V250 PolarHBondContact O-N 3.24Å; L246-V250 VanDerWaalsContact O-N 3.08Å; V250-S252 VanDerWaalsContact C-N 3.27Å; V250-S252 PolarHBondContact O-N 3.41Å; V250-G253 PolarHBondContact O-N 2.63Å; V250-L254 PolarHBondContact O-N 3.14Å; V250-V280 HydrophobicContact CG1-CG2 4.31Å; V250-V280 HydrophobicContact CG2-CG1 3.61Å; V250-V280 HydrophobicContact CG2-CG2 4.38Å; V250-A288 HydrophobicContact CG2-CB 3.71Å; V250-L345 HydrophobicContact CB-CD1 4.44Å; V250-L345 HydrophobicContact CG1-CD1 3.52Å
251	A	98.8	Very high	98.1	Very high	0 Å²	0	22.6 Å²	22.6	0%	0	12%	0.121	C	C	.	.	H	α-helix	trans	-61.8	-36	176.8	0	0	0	0	0	112.4	A247 L248 S249 A255 F349 V429 K430	A247-A251 WeakPolarHBondContact O-CB 3.3Å; A247-A251 PolarHBondContact O-N 3.09Å; L248-A251 PolarHBondContact O-N 3.31Å; S249-A251 PolarHBondContact O-N 3.46Å; A251-A255 WeakPolarHBondContact O-CB 3.1Å; A251-A255 PolarHBondContact O-N 3.39Å; A251-F349 HydrophobicContact CB-CZ 4.25Å; A251-V429 HydrophobicContact CB-CG1 3.99Å; A251-K430 HydrophobicContact CB-CB 4.24Å
252	S	98.8	Very high	97.8	Very high	7 Å²	7	24.8 Å²	24.8	5%	0.049	13%	0.134	C	C	.	.	H	α-helix	trans	-69.3	-43	178	-64.1	0	0	0	0	112.2	N199 L248 S249 V250 A255 H256 K430	N199-S252 VanDerWaalsContact OD1-CB 3.29Å; N199-S252 WeakPolarHBondContact OD1-CB 3.41Å; L248-S252 WeakPolarHBondContact O-CB 3.31Å; L248-S252 PolarHBondContact O-N 3.37Å; L248-S252 PolarHBondContact O-OG 3.44Å; S249-S252 PolarHBondContact O-N 3.14Å; V250-S252 VanDerWaalsContact C-N 3.27Å; V250-S252 PolarHBondContact O-N 3.41Å; S252-A255 PolarHBondContact O-N 3.24Å; S252-H256 PolarHBondContact O-N 3.49Å; S252-K430 WeakPolarHBondContact OG-CD 3.38Å; S252-K430 WeakPolarHBondContact OG-CE 3.48Å
253	G	98.8	Very high	97.3	Very high	0 Å²	0	26.3 Å²	26.3	0%	0	15%	0.15	C	C	.	.	H	α-helix	trans	-60	-47.6	172.4	0	0	0	0	0	111.8	S249 V250 A255 H256 L257	S249-G253 PolarHBondContact O-N 3.13Å; V250-G253 PolarHBondContact O-N 2.63Å; G253-A255 VanDerWaalsContact C-N 3.35Å; G253-A255 PolarHBondContact O-N 3.33Å; G253-H256 WeakPolarHBondContact O-CB 3.39Å; G253-H256 PolarHBondContact O-N 3.08Å; G253-L257 PolarHBondContact O-N 3.03Å
254	L	98.9	Very high	96.3	Very high	0 Å²	0	33.3 Å²	33.3	0%	0	19%	0.193	C	C	.	.	H	α-helix	trans	-66	-39.6	-179.6	-169.5	65.7	0	0	0	111.8	V250 H256 L257 H258 L275 I290 D341 I342 L345 A426	V250-L254 PolarHBondContact O-N 3.14Å; L254-H256 VanDerWaalsContact C-N 3.29Å; L254-H256 PolarHBondContact O-N 3.03Å; L254-L257 HydrophobicContact CD1-CD1 4.42Å; L254-L257 PolarHBondContact O-N 3.14Å; L254-H258 VanDerWaalsContact O-CB 3.32Å; L254-H258 WeakPolarHBondContact O-CB 3.44Å; L254-H258 PolarHBondContact O-CD2 2.95Å; L254-H258 PolarHBondContact O-N 3.29Å; L254-L275 HydrophobicContact CD1-CD2 4.3Å; L254-L275 HydrophobicContact CD2-CD2 3.96Å; L254-I290 HydrophobicContact CB-CD1 3.88Å; L254-I290 HydrophobicContact CD1-CD1 4.42Å; L254-I290 VanDerWaalsContact N-CD1 3.29Å; L254-D341 HydrophobicContact CD1-CB 4.09Å; L254-D341 HydrophobicContact CD2-CB 4.25Å; L254-I342 HydrophobicContact CD2-CD1 4.04Å; L254-L345 HydrophobicContact CD2-CB 4.18Å; L254-L345 HydrophobicContact CD2-CD2 3.92Å; L254-L345 HydrophobicContact CD2-CG 4.44Å; L254-A426 HydrophobicContact CB-CB 4.26Å; L254-A426 HydrophobicContact CD2-CB 4.17Å; L254-A426 HydrophobicContact CG-CB 4.06Å
255	A	98.8	Very high	95.6	Very high	4 Å²	4	36.8 Å²	36.8	3%	0.033	21%	0.208	C	C	.	.	H	α-helix	trans	-61	-39.2	174.9	0	0	0	0	0	112	A251 S252 G253 M259 A426 M427 K430	A251-A255 WeakPolarHBondContact O-CB 3.1Å; A251-A255 PolarHBondContact O-N 3.39Å; S252-A255 PolarHBondContact O-N 3.24Å; G253-A255 VanDerWaalsContact C-N 3.35Å; G253-A255 PolarHBondContact O-N 3.33Å; A255-M259 VanDerWaalsContact O-CB 3.25Å; A255-M259 WeakPolarHBondContact O-CB 3.1Å; A255-M259 PolarHBondContact O-N 3.28Å; A255-M259 VanDerWaalsContact O-N 3.1Å; A255-A426 HydrophobicContact CB-CB 3.93Å; A255-M427 HydrophobicContact CB-CE 3.8Å; A255-K430 HydrophobicContact CB-CD 4.46Å
256	H	98.8	Very high	95	Very high	19 Å²	19	35.6 Å²	35.6	9%	0.088	21%	0.206	C	C	.	.	H	α-helix	trans	-65.7	-44.1	174.5	-176.8	69.1	0	0	0	112.4	M194 L195 H197 S252 G253 L254 H258 M259 K267	M194-H256 PolarHBondContact O-CE1 2.88Å; M194-H256 PolarHBondContact O-NE2 3.09Å; M194-H256 VanDerWaalsContact O-NE2 3.09Å; L195-H256 PolarHBondContact O-CD2 2.8Å; L195-H256 PolarHBondContact O-NE2 2.79Å; H197-H256 HydrophobicContact CB-CB 4.48Å; H197-H256 VanDerWaalsContact CB-CD2 3.42Å; H197-H256 WeakPolarHBondContact CB-CD2 3.31Å; H197-H256 AromaticContact CD2-CG 3.72Å; H197-H256 AromaticContact CD2-ND1 3.84Å; H197-H256 AromaticContact CG-CD2 3.86Å; H197-H256 AromaticContact CG-CG 3.77Å; S252-H256 PolarHBondContact O-N 3.49Å; G253-H256 WeakPolarHBondContact O-CB 3.39Å; G253-H256 PolarHBondContact O-N 3.08Å; L254-H256 VanDerWaalsContact C-N 3.29Å; L254-H256 PolarHBondContact O-N 3.03Å; H256-H258 VanDerWaalsContact C-N 3.35Å; H256-H258 PolarHBondContact O-N 2.87Å; H256-M259 PolarHBondContact O-N 3.43Å; H256-K267 WeakPolarHBondContact O-CE 3.43Å; H256-K267 PolarHBondContact O-NZ 3.47Å; H256-K267 VanDerWaalsContact O-NZ 3.17Å
257	L	98.6	Very high	94.9	Very high	0 Å²	0	35.6 Å²	35.6	0%	0	21%	0.206	C	C	.	.	H	α-helix	trans	-56.8	-50.4	174.2	-74.7	171.9	0	0	0	111	L195 I200 G253 L254 M259 K267 I270 I290 L293	L195-L257 HydrophobicContact CD1-CD2 3.68Å; I200-L257 HydrophobicContact CD1-CD1 3.84Å; I200-L257 HydrophobicContact CD1-CD2 4.09Å; I200-L257 HydrophobicContact CD1-CG 3.66Å; G253-L257 PolarHBondContact O-N 3.03Å; L254-L257 HydrophobicContact CD1-CD1 4.42Å; L254-L257 PolarHBondContact O-N 3.14Å; L257-M259 VanDerWaalsContact C-N 3.26Å; L257-M259 PolarHBondContact O-N 3.44Å; L257-K267 PolarHBondContact O-NZ 2.89Å; L257-I270 CarbonylContact C-O 3.53Å; L257-I270 VanDerWaalsContact C-O 3.23Å; L257-I270 HydrophobicContact CB-CB 4.42Å; L257-I270 HydrophobicContact CD2-CB 4.2Å; L257-I270 HydrophobicContact CD2-CD1 4.4Å; L257-I270 HydrophobicContact CD2-CG2 4.09Å; L257-I270 PolarHBondContact O-N 3.33Å; L257-I290 HydrophobicContact CD1-CD1 4.27Å; L257-I290 HydrophobicContact CD1-CG2 4.29Å; L257-L293 HydrophobicContact CD1-CD2 4.23Å; L257-L293 HydrophobicContact CD2-CD1 4.45Å; L257-L293 HydrophobicContact CD2-CD2 4.46Å
258	H	98.6	Very high	94.7	Very high	13 Å²	13	37.2 Å²	37.2	6%	0.06	22%	0.217	C	C	.	.	H	α-helix	trans	-68.7	-18.6	-175.8	-79.6	-161.8	0	0	0	114.8	L254 H256 I270 K338 D341	L254-H258 VanDerWaalsContact O-CB 3.32Å; L254-H258 WeakPolarHBondContact O-CB 3.44Å; L254-H258 PolarHBondContact O-CD2 2.95Å; L254-H258 PolarHBondContact O-N 3.29Å; H256-H258 VanDerWaalsContact C-N 3.35Å; H256-H258 PolarHBondContact O-N 2.87Å; H258-I270 PolarHBondContact CD2-O 2.73Å; H258-I270 VanDerWaalsContact CD2-O 3.26Å; H258-I270 PolarHBondContact N-O 3.34Å; H258-K338 HydrophobicContact CB-CD 4.45Å; H258-K338 PolarHBondContact CE1-O 3.11Å; H258-D341 IonicContact CD2-OD2 3.5Å; H258-D341 IonicContact CE1-OD2 2.7Å; H258-D341 IonicContact NE2-OD2 3.25Å; H258-D341 PolarHBondContact NE2-OD2 3.03Å
259	M	97.8	Very high	94.7	Very high	78 Å²	78	35.6 Å²	35.6	38%	0.384	21%	0.209	S	C	.	.			trans	-85.2	127	-176.9	-179.2	170.9	63.5	0	0	110.8	A255 H256 L257 I261 K267	A255-M259 VanDerWaalsContact O-CB 3.25Å; A255-M259 WeakPolarHBondContact O-CB 3.1Å; A255-M259 PolarHBondContact O-N 3.28Å; A255-M259 VanDerWaalsContact O-N 3.1Å; H256-M259 PolarHBondContact O-N 3.43Å; L257-M259 VanDerWaalsContact C-N 3.26Å; L257-M259 PolarHBondContact O-N 3.44Å; M259-I261 HydrophobicContact CE-CD1 4.34Å; M259-I261 HydrophobicContact CE-CG1 4.27Å; M259-K267 PolarHBondContact O-NZ 3.36Å
260	E	96	Very high	94.6	Very high	77 Å²	77	35.3 Å²	35.3	36%	0.36	21%	0.207	S	C	.	.			trans	-78.4	136	164	-172.9	178.9	-172.9	0	0	109.3	K267 A269 S301	E260-K267 WeakPolarHBondContact CA-O 3.27Å; E260-A269 HydrophobicContact CB-CB 4.24Å; E260-S301 WeakPolarHBondContact OE1-CB 3.25Å; E260-S301 PolarHBondContact OE1-OG 3.3Å
261	I	93.8	Very high	94.6	Very high	38 Å²	38	35.2 Å²	35.2	20%	0.195	21%	0.207	C	C	.	.	B	Isolated β-bridge	trans	-113.1	115.3	173.3	-54.7	176.2	0	0	0	107.2	M194 M259 G266 K267	M194-I261 HydrophobicContact CB-CD1 4.23Å; M194-I261 HydrophobicContact CE-CD1 3.92Å; M194-I261 HydrophobicContact CE-CG2 3.85Å; M194-I261 HydrophobicContact SD-CB 4.49Å; M194-I261 HydrophobicContact SD-CD1 4.38Å; M194-I261 HydrophobicContact SD-CG2 3.86Å; M259-I261 HydrophobicContact CE-CD1 4.34Å; M259-I261 HydrophobicContact CE-CG1 4.27Å; I261-G266 CarbonylContact O-C 3.58Å; I261-G266 WeakPolarHBondContact O-CA 3.35Å; I261-K267 HydrophobicContact CB-CB 3.85Å; I261-K267 HydrophobicContact CD1-CB 3.98Å; I261-K267 HydrophobicContact CD1-CD 4.01Å; I261-K267 HydrophobicContact CG1-CB 3.97Å; I261-K267 HydrophobicContact CG1-CD 4.41Å; I261-K267 PolarHBondContact N-O 3.49Å; I261-K267 PolarHBondContact O-N 3.5Å
262	I	90.9	Very high	94.6	Very high	155 Å²	155	35.2 Å²	35.2	80%	0.795	21%	0.207	S	C	*	.			trans	-84.5	134.2	-178.1	-55.6	171.9	0	0	0	109.2
263	G	86.1	Confident	94.4	Very high	54 Å²	54	36.7 Å²	36.7	56%	0.557	21%	0.211	S	C	*	.	S	Bend	trans	161.8	176.2	176.4	0	0	0	0	0	112.4	Q265 G266	G263-Q265 PolarHBondContact O-N 3.44Å; G263-G266 PolarHBondContact O-N 3.08Å; G263-G266 VanDerWaalsContact O-N 3.08Å
264	T	78.4	Confident	94.4	Very high	146 Å²	146	37.2 Å²	37.2	90%	0.896	21%	0.214	S	C	*	.	T	Hydrogen-bonded Turn	trans	-59.9	-29.2	175	49.1	0	0	0	0	112.7
265	Q	82.4	Confident	94.4	Very high	82 Å²	82	37.2 Å²	37.2	38%	0.383	21%	0.214	S	C	.	.	T	Hydrogen-bonded Turn	trans	-116.5	50.4	173.1	-67.6	-63.5	-40.8	0	0	109	I193 G263	I193-Q265 VanDerWaalsContact CD1-OE1 3.3Å; I193-Q265 HydrophobicContact CG2-CB 3.88Å; I193-Q265 VanDerWaalsContact CG2-O 3.31Å; I193-Q265 WeakPolarHBondContact CG2-O 3.21Å; G263-Q265 PolarHBondContact O-N 3.44Å
266	G	86.6	Confident	94.3	Very high	26 Å²	26	38.3 Å²	38.3	27%	0.268	22%	0.218	S	C	.	.			trans	-67.4	156.3	-176.9	0	0	0	0	0	113.4	I261 G263	I261-G266 CarbonylContact O-C 3.58Å; I261-G266 WeakPolarHBondContact O-CA 3.35Å; G263-G266 PolarHBondContact O-N 3.08Å; G263-G266 VanDerWaalsContact O-N 3.08Å
267	K	94.8	Very high	94.3	Very high	2 Å²	2	37.4 Å²	37.4	1%	0.009	21%	0.214	C	C	.	.	B	Isolated β-bridge	trans	-107.2	122.7	172.6	-174.5	-164.4	148.7	-62.4	0	108.7	T192 I193 M194 H256 L257 M259 E260 I261	T192-K267 HydrophobicContact CG2-CG 4.27Å; I193-K267 WeakPolarHBondContact O-CB 3.48Å; I193-K267 WeakPolarHBondContact O-CG 3.44Å; M194-K267 HydrophobicContact CB-CB 4.16Å; H256-K267 WeakPolarHBondContact O-CE 3.43Å; H256-K267 PolarHBondContact O-NZ 3.47Å; H256-K267 VanDerWaalsContact O-NZ 3.17Å; L257-K267 PolarHBondContact O-NZ 2.89Å; M259-K267 PolarHBondContact O-NZ 3.36Å; E260-K267 WeakPolarHBondContact CA-O 3.27Å; I261-K267 HydrophobicContact CB-CB 3.85Å; I261-K267 HydrophobicContact CD1-CB 3.98Å; I261-K267 HydrophobicContact CD1-CD 4.01Å; I261-K267 HydrophobicContact CG1-CB 3.97Å; I261-K267 HydrophobicContact CG1-CD 4.41Å; I261-K267 PolarHBondContact N-O 3.49Å; I261-K267 PolarHBondContact O-N 3.5Å
268	P	96.1	Very high	94.3	Very high	34 Å²	34	42.8 Å²	42.8	22%	0.221	24%	0.237	C	C	.	.			trans	-64.3	153.7	171.6	27.8	-33.7	0	0	0	110.6	T192 K298 H299	T192-P268 HydrophobicContact CG2-CG 3.94Å; P268-K298 HydrophobicContact CB-CB 4.28Å; P268-K298 HydrophobicContact CG-CB 4.25Å; P268-K298 HydrophobicContact CG-CD 3.94Å; P268-K298 HydrophobicContact CG-CG 4.14Å; P268-H299 VanDerWaalsContact CB-O 3.25Å; P268-H299 WeakPolarHBondContact CB-O 3.29Å
269	A	97.3	Very high	94.3	Very high	5 Å²	5	42.9 Å²	42.9	4%	0.041	24%	0.238	C	C	.	.			trans	-66.8	139.5	169	0	0	0	0	0	109.7	E260 K298 H299 F334	E260-A269 HydrophobicContact CB-CB 4.24Å; A269-K298 WeakPolarHBondContact O-CA 3.46Å; A269-H299 HydrophobicContact CB-CB 4.31Å; A269-H299 PolarHBondContact O-N 2.97Å; A269-F334 VanDerWaalsContact C-CZ 3.48Å; A269-F334 HydrophobicContact CB-CD1 4.26Å; A269-F334 HydrophobicContact CB-CE1 3.47Å; A269-F334 VanDerWaalsContact CB-CE1 3.47Å; A269-F334 HydrophobicContact CB-CZ 4.07Å; A269-F334 WeakPolarHBondContact O-CZ 3.41Å
270	I	98.1	Very high	94.3	Very high	0 Å²	0	39.1 Å²	39.1	0%	0	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	131.9	-175.7	-58.4	174.1	0	0	0	109.3	T192 L195 L257 H258 A296 V297 K298	T192-I270 HydrophobicContact CG2-CD1 4.26Å; L195-I270 HydrophobicContact CD1-CD1 3.83Å; L257-I270 CarbonylContact C-O 3.53Å; L257-I270 VanDerWaalsContact C-O 3.23Å; L257-I270 HydrophobicContact CB-CB 4.42Å; L257-I270 HydrophobicContact CD2-CB 4.2Å; L257-I270 HydrophobicContact CD2-CD1 4.4Å; L257-I270 HydrophobicContact CD2-CG2 4.09Å; L257-I270 PolarHBondContact O-N 3.33Å; H258-I270 PolarHBondContact CD2-O 2.73Å; H258-I270 VanDerWaalsContact CD2-O 3.26Å; H258-I270 PolarHBondContact N-O 3.34Å; I270-A296 HydrophobicContact CG2-CB 3.82Å; I270-V297 VanDerWaalsContact CA-O 3.27Å; I270-V297 WeakPolarHBondContact CA-O 3.28Å; I270-K298 HydrophobicContact CG1-CG 4.15Å
271	A	97.9	Very high	94.4	Very high	0 Å²	0	37.1 Å²	37.1	0%	0	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	137.7	169.3	0	0	0	0	0	109.8	A296 V297 F334 F337 K338 D341	A271-A296 CarbonylContact O-C 3.57Å; A271-A296 WeakPolarHBondContact O-CA 3.39Å; A271-A296 WeakPolarHBondContact O-CB 3.32Å; A271-V297 HydrophobicContact CB-CG2 3.96Å; A271-V297 PolarHBondContact N-O 3.07Å; A271-V297 PolarHBondContact O-N 2.94Å; A271-F334 HydrophobicContact CB-CE2 4.16Å; A271-F334 HydrophobicContact CB-CZ 3.98Å; A271-F337 HydrophobicContact CB-CB 3.42Å; A271-F337 VanDerWaalsContact CB-CB 3.42Å; A271-K338 HydrophobicContact CB-CG 4.43Å; A271-D341 WeakPolarHBondContact CA-OD2 3.48Å
272	H	98.2	Very high	94.7	Very high	0 Å²	0	35.3 Å²	35.3	0%	0	20%	0.202	C	C	.	.			trans	-79.1	-42.5	-168.9	-172.7	-76.8	0	0	0	113.2	D274 L275 I290 A291 L293 D341	H272-D274 PolarHBondContact CE1-O 2.74Å; H272-D274 VanDerWaalsContact CE1-O 3.24Å; H272-D274 PolarHBondContact ND1-N 2.99Å; H272-D274 VanDerWaalsContact ND1-N 3.19Å; H272-D274 PolarHBondContact ND1-O 3.49Å; H272-D274 PolarHBondContact O-N 2.83Å; H272-L275 PolarHBondContact ND1-N 3.03Å; H272-I290 VanDerWaalsContact CD2-CG2 3.43Å; H272-I290 WeakPolarHBondContact CD2-CG2 3.48Å; H272-I290 WeakPolarHBondContact NE2-CG2 3.43Å; H272-A291 PolarHBondContact NE2-O 3.4Å; H272-L293 VanDerWaalsContact CD2-CD2 3.43Å; H272-L293 WeakPolarHBondContact CD2-CD2 3.43Å; H272-D341 PolarHBondContact N-OD1 3.05Å; H272-D341 PolarHBondContact N-OD2 3.34Å
273	R	96.6	Very high	95	Very high	37 Å²	37	30 Å²	30	14%	0.14	17%	0.173	C	C	.	.	S	Bend	trans	65.7	-10.4	178.3	-58.5	179.8	63.2	-164.3	7.3	117.4	L295 V297 N311 H312 F337 D341	R273-L295 WeakPolarHBondContact CD-O 2.97Å; R273-V297 HydrophobicContact CG-CG2 4.29Å; R273-N311 PolarHBondContact NH2-O 2.74Å; R273-H312 PolarHBondContact NH2-O 2.82Å; R273-F337 HydrophobicContact CG-CD1 4.15Å; R273-D341 PolarHBondContact N-OD1 3.14Å
274	D	97.1	Very high	95.5	Very high	11 Å²	11	37.4 Å²	37.4	6%	0.059	18%	0.184	C	C	.	.			trans	-137.3	43.1	172.1	-165.1	30.3	0	0	0	113.7	H272 K276 N279 L295 G315 T316	H272-D274 PolarHBondContact CE1-O 2.74Å; H272-D274 VanDerWaalsContact CE1-O 3.24Å; H272-D274 PolarHBondContact ND1-N 2.99Å; H272-D274 VanDerWaalsContact ND1-N 3.19Å; H272-D274 PolarHBondContact ND1-O 3.49Å; H272-D274 PolarHBondContact O-N 2.83Å; D274-K276 PolarHBondContact O-N 3.22Å; D274-K276 IonicContact OD1-NZ 3.26Å; D274-K276 PolarHBondContact OD1-NZ 2.93Å; D274-K276 IonicContact OD2-NZ 3.76Å; D274-K276 PolarHBondContact OD2-NZ 3.19Å; D274-N279 PolarHBondContact O-ND2 2.97Å; D274-N279 VanDerWaalsContact O-ND2 3.14Å; D274-N279 PolarHBondContact OD2-ND2 3.03Å; D274-L295 HydrophobicContact CB-CD1 3.83Å; D274-G315 WeakPolarHBondContact OD1-CA 3.48Å; D274-T316 VanDerWaalsContact OD1-CB 3.29Å; D274-T316 WeakPolarHBondContact OD1-CB 3.37Å; D274-T316 PolarHBondContact OD1-N 2.76Å; D274-T316 PolarHBondContact OD1-OG1 2.83Å
275	L	98.7	Very high	96.2	Very high	0 Å²	0	35.9 Å²	35.9	0%	0	17%	0.17	C	C	.	.			trans	-72.2	123.3	-179.5	-176	67.8	0	0	0	109.9	L254 H272 V280 I290 S344 L345	L254-L275 HydrophobicContact CD1-CD2 4.3Å; L254-L275 HydrophobicContact CD2-CD2 3.96Å; H272-L275 PolarHBondContact ND1-N 3.03Å; L275-V280 HydrophobicContact CD1-CG2 4.16Å; L275-I290 HydrophobicContact CD1-CD1 4.35Å; L275-I290 HydrophobicContact CD1-CG2 4.26Å; L275-S344 WeakPolarHBondContact O-CB 3.22Å; L275-L345 HydrophobicContact CD2-CB 3.87Å; L275-L345 HydrophobicContact CD2-CD1 4.13Å
276	K	98.6	Very high	96.9	Very high	27 Å²	27	33 Å²	33	12%	0.117	16%	0.163	C	C	.	.			trans	-160.4	163.7	179.9	65.5	-159.3	-175.4	-150.6	0	110	D274 K278 N279 V280 T316 Y319	D274-K276 PolarHBondContact O-N 3.22Å; D274-K276 IonicContact OD1-NZ 3.26Å; D274-K276 PolarHBondContact OD1-NZ 2.93Å; D274-K276 IonicContact OD2-NZ 3.76Å; D274-K276 PolarHBondContact OD2-NZ 3.19Å; K276-K278 HydrophobicContact CG-CB 4.21Å; K276-K278 PolarHBondContact O-N 3.44Å; K276-K278 VanDerWaalsContact O-N 3.14Å; K276-N279 VanDerWaalsContact CE-CG 3.47Å; K276-N279 WeakPolarHBondContact CE-ND2 3.36Å; K276-N279 VanDerWaalsContact CE-OD1 3.25Å; K276-N279 WeakPolarHBondContact CE-OD1 3.48Å; K276-N279 HydrophobicContact CG-CB 4.06Å; K276-N279 PolarHBondContact O-N 3.47Å; K276-V280 PolarHBondContact O-N 2.84Å; K276-T316 HydrophobicContact CD-CG2 4.19Å; K276-T316 WeakPolarHBondContact CD-OG1 3.33Å; K276-T316 WeakPolarHBondContact CE-OG1 3.5Å; K276-T316 PolarHBondContact NZ-OG1 3.48Å; K276-Y319 HydrophobicContact CB-CD1 3.95Å; K276-Y319 HydrophobicContact CB-CD2 3.8Å; K276-Y319 HydrophobicContact CB-CE1 3.88Å; K276-Y319 HydrophobicContact CB-CE2 3.72Å; K276-Y319 HydrophobicContact CB-CG 3.92Å
277	S	98.6	Very high	97.4	Very high	0 Å²	0	33 Å²	33	0%	0	16%	0.158	C	C	.	.	G	3₁₀ helix	trans	-58.3	-28.1	-179.4	54.2	0	0	0	0	114.2	L229 Y230 N279 Y319 E351	L229-S277 WeakPolarHBondContact CB-O 3.35Å; L229-S277 PolarHBondContact N-O 3.44Å; Y230-S277 PolarHBondContact N-O 2.99Å; S277-N279 VanDerWaalsContact C-N 3.33Å; S277-Y319 PolarHBondContact OG-OH 3.48Å; S277-E351 WeakPolarHBondContact CB-OE1 3.47Å; S277-E351 VanDerWaalsContact CB-OE2 3.27Å; S277-E351 WeakPolarHBondContact CB-OE2 3.46Å; S277-E351 PolarHBondContact OG-OE1 3Å; S277-E351 PolarHBondContact OG-OE2 3.42Å
278	K	97.5	Very high	97.6	Very high	114 Å²	114	32.9 Å²	32.9	50%	0.496	16%	0.157	S	C	.	.	G	3₁₀ helix	trans	-71.5	-21.9	173.2	-69.3	-173.2	175.7	-173.8	0	114.5	Y230 K276	Y230-K278 HydrophobicContact CD1-CG 4.16Å; Y230-K278 HydrophobicContact CD2-CG 4.09Å; Y230-K278 HydrophobicContact CG-CD 4.44Å; Y230-K278 HydrophobicContact CG-CG 3.69Å; K276-K278 HydrophobicContact CG-CB 4.21Å; K276-K278 PolarHBondContact O-N 3.44Å; K276-K278 VanDerWaalsContact O-N 3.14Å
279	N	98.1	Very high	97.8	Very high	14 Å²	14	31.2 Å²	31.2	8%	0.075	15%	0.147	C	C	.	.	G	3₁₀ helix	trans	-103.9	15.9	-179.5	-70.7	7.6	0	0	0	112.1	D274 K276 S277 A291 D292	D274-N279 PolarHBondContact O-ND2 2.97Å; D274-N279 VanDerWaalsContact O-ND2 3.14Å; D274-N279 PolarHBondContact OD2-ND2 3.03Å; K276-N279 VanDerWaalsContact CE-CG 3.47Å; K276-N279 WeakPolarHBondContact CE-ND2 3.36Å; K276-N279 VanDerWaalsContact CE-OD1 3.25Å; K276-N279 WeakPolarHBondContact CE-OD1 3.48Å; K276-N279 HydrophobicContact CG-CB 4.06Å; K276-N279 PolarHBondContact O-N 3.47Å; S277-N279 VanDerWaalsContact C-N 3.33Å; N279-A291 PolarHBondContact O-N 2.79Å; N279-D292 HydrophobicContact CB-CB 4.21Å; N279-D292 PolarHBondContact ND2-OD2 3.37Å; N279-D292 PolarHBondContact OD1-OD2 3.48Å
280	V	98.8	Very high	97.8	Very high	0 Å²	0	31 Å²	31	0%	0	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	130.5	169.7	174.9	0	0	0	0	106.4	S228 L229 V250 L275 K276 A288 V289	S228-V280 CarbonylContact C-O 3.56Å; S228-V280 WeakPolarHBondContact CA-O 3.43Å; L229-V280 HydrophobicContact CB-CB 3.99Å; L229-V280 HydrophobicContact CB-CG1 3.97Å; L229-V280 HydrophobicContact CD2-CB 4.39Å; L229-V280 HydrophobicContact CD2-CG1 4.13Å; L229-V280 PolarHBondContact N-O 3.5Å; V250-V280 HydrophobicContact CG1-CG2 4.31Å; V250-V280 HydrophobicContact CG2-CG1 3.61Å; V250-V280 HydrophobicContact CG2-CG2 4.38Å; L275-V280 HydrophobicContact CD1-CG2 4.16Å; K276-V280 PolarHBondContact O-N 2.84Å; V280-A288 HydrophobicContact CG1-CB 3.73Å; V280-V289 CarbonylContact C-O 3.39Å; V280-V289 WeakPolarHBondContact CA-O 3.49Å
281	L	98.6	Very high	97.8	Very high	35 Å²	35	31.3 Å²	31.3	18%	0.183	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108	146	178	-54.7	178.9	0	0	0	110.4	L201 H224 G227 A288 V289 A291	L201-L281 HydrophobicContact CD1-CD1 4.01Å; L201-L281 HydrophobicContact CD2-CD1 4.29Å; H224-L281 HydrophobicContact CB-CB 4.32Å; G227-L281 VanDerWaalsContact O-CA 3.31Å; G227-L281 WeakPolarHBondContact O-CA 3.45Å; L281-A288 CarbonylContact O-C 3.53Å; L281-A288 VanDerWaalsContact O-CA 3.22Å; L281-A288 WeakPolarHBondContact O-CA 3.15Å; L281-V289 HydrophobicContact CB-CG2 3.78Å; L281-V289 HydrophobicContact CD1-CG2 4.47Å; L281-V289 HydrophobicContact CG-CG2 4.44Å; L281-V289 PolarHBondContact N-O 3.29Å; L281-V289 PolarHBondContact O-N 3.14Å; L281-A291 HydrophobicContact CD1-CB 4.09Å; L281-A291 HydrophobicContact CG-CB 4.04Å
282	V	98.8	Very high	97.6	Very high	0 Å²	0	33 Å²	33	0%	0	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.7	127.9	178.1	-177.3	0	0	0	0	109.7	H226 G227 L229 Y232 L246	H226-V282 HydrophobicContact CB-CB 3.87Å; H226-V282 HydrophobicContact CB-CG1 4.12Å; H226-V282 WeakPolarHBondContact CB-O 3.25Å; G227-V282 PolarHBondContact O-N 3.39Å; L229-V282 HydrophobicContact CB-CG2 4.25Å; L229-V282 HydrophobicContact CD1-CG2 3.92Å; Y232-V282 HydrophobicContact CD1-CG2 4.29Å; Y232-V282 HydrophobicContact CD2-CB 4.18Å; Y232-V282 HydrophobicContact CD2-CG1 3.99Å; Y232-V282 HydrophobicContact CD2-CG2 4.27Å; Y232-V282 HydrophobicContact CE2-CG1 4Å; Y232-V282 HydrophobicContact CG-CB 4.31Å; Y232-V282 HydrophobicContact CG-CG1 4.32Å; Y232-V282 HydrophobicContact CG-CG2 3.89Å; L246-V282 HydrophobicContact CD2-CG1 4.13Å; L246-V282 HydrophobicContact CD2-CG2 4.12Å
283	K	98.1	Very high	97.5	Very high	43 Å²	43	33 Å²	33	19%	0.187	16%	0.156	C	C	.	.			trans	-83.9	159	177.3	-58.9	-177.6	111.6	166.3	0	110.4	E198 H226 N285 G286 T287 V289	E198-K283 PolarHBondContact O-NZ 2.81Å; H226-K283 PolarHBondContact CD2-O 3.5Å; K283-N285 VanDerWaalsContact CB-OD1 3.24Å; K283-N285 WeakPolarHBondContact CB-OD1 3.23Å; K283-N285 PolarHBondContact O-N 3.35Å; K283-N285 VanDerWaalsContact O-N 3.13Å; K283-G286 PolarHBondContact O-N 3.2Å; K283-T287 WeakPolarHBondContact CB-O 3.32Å; K283-T287 VanDerWaalsContact CD-OG1 3.31Å; K283-T287 WeakPolarHBondContact CD-OG1 3.1Å; K283-T287 PolarHBondContact N-O 2.69Å; K283-V289 HydrophobicContact CD-CG1 3.66Å; K283-V289 HydrophobicContact CG-CG1 3.93Å
284	R	96	Very high	97.3	Very high	209 Å²	209	31.6 Å²	31.6	79%	0.789	15%	0.153	S	C	*	.	T	Hydrogen-bonded Turn	trans	-56.1	-28.7	177.1	-172.5	176.3	-178.5	-171.5	0.1	114.3	E225 G286	E225-R284 WeakPolarHBondContact OE1-CD 3.44Å; E225-R284 VanDerWaalsContact OE1-CG 3.25Å; E225-R284 WeakPolarHBondContact OE1-CG 3.36Å; E225-R284 IonicContact OE1-NE 2.77Å; R284-G286 PolarHBondContact O-N 3.09Å
285	N	94.4	Very high	97.2	Very high	114 Å²	114	32.3 Å²	32.3	61%	0.61	16%	0.157	S	C	*	.	T	Hydrogen-bonded Turn	trans	-84.6	9.2	176.9	70.2	-14.1	0	0	0	113.6	K283 T287	K283-N285 VanDerWaalsContact CB-OD1 3.24Å; K283-N285 WeakPolarHBondContact CB-OD1 3.23Å; K283-N285 PolarHBondContact O-N 3.35Å; K283-N285 VanDerWaalsContact O-N 3.13Å; N285-T287 VanDerWaalsContact C-N 3.29Å; N285-T287 PolarHBondContact O-N 3.08Å; N285-T287 PolarHBondContact OD1-N 3.26Å; N285-T287 PolarHBondContact OD1-OG1 2.89Å
286	G	95.6	Very high	97	Very high	23 Å²	23	32.3 Å²	32.3	24%	0.237	16%	0.157	C	C	.	.	S	Bend	trans	79.7	-0	178.6	0	0	0	0	0	115.3	L246 K283 R284	L246-G286 WeakPolarHBondContact CD2-O 3.32Å; K283-G286 PolarHBondContact O-N 3.2Å; R284-G286 PolarHBondContact O-N 3.09Å
287	T	98.4	Very high	96.9	Very high	24 Å²	24	31.1 Å²	31.1	15%	0.147	15%	0.152	C	C	.	.			trans	-85.5	168.8	170.5	74.3	0	0	0	0	111.1	V245 K283 N285	V245-T287 HydrophobicContact CG1-CG2 3.81Å; K283-T287 WeakPolarHBondContact CB-O 3.32Å; K283-T287 VanDerWaalsContact CD-OG1 3.31Å; K283-T287 WeakPolarHBondContact CD-OG1 3.1Å; K283-T287 PolarHBondContact N-O 2.69Å; N285-T287 VanDerWaalsContact C-N 3.29Å; N285-T287 PolarHBondContact O-N 3.08Å; N285-T287 PolarHBondContact OD1-N 3.26Å; N285-T287 PolarHBondContact OD1-OG1 2.89Å
288	A	98.7	Very high	96.7	Very high	0 Å²	0	32.9 Å²	32.9	0%	0	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	158.2	179.5	0	0	0	0	0	113.2	N199 L246 S249 V250 V280 L281	N199-A288 WeakPolarHBondContact CA-O 3.21Å; N199-A288 WeakPolarHBondContact CB-O 3.46Å; N199-A288 PolarHBondContact ND2-O 3.35Å; L246-A288 HydrophobicContact CD2-CB 4.07Å; S249-A288 WeakPolarHBondContact OG-CB 3.42Å; S249-A288 PolarHBondContact OG-N 3.07Å; V250-A288 HydrophobicContact CG2-CB 3.71Å; V280-A288 HydrophobicContact CG1-CB 3.73Å; L281-A288 CarbonylContact O-C 3.53Å; L281-A288 VanDerWaalsContact O-CA 3.22Å; L281-A288 WeakPolarHBondContact O-CA 3.15Å
289	V	98.8	Very high	96.6	Very high	0 Å²	0	28.9 Å²	28.9	0%	0	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.5	146.1	167.6	-55.9	0	0	0	0	110.6	E198 N199 L201 H224 V280 L281 K283	E198-V289 WeakPolarHBondContact O-CG1 3.46Å; N199-V289 CarbonylContact O-C 3.23Å; N199-V289 WeakPolarHBondContact O-CA 3.22Å; L201-V289 HydrophobicContact CB-CG2 4.31Å; L201-V289 HydrophobicContact CD1-CG2 4.28Å; H224-V289 VanDerWaalsContact CD2-CG2 3.49Å; H224-V289 WeakPolarHBondContact CD2-CG2 3.21Å; H224-V289 WeakPolarHBondContact NE2-CG2 3.41Å; V280-V289 CarbonylContact C-O 3.39Å; V280-V289 WeakPolarHBondContact CA-O 3.49Å; L281-V289 HydrophobicContact CB-CG2 3.78Å; L281-V289 HydrophobicContact CD1-CG2 4.47Å; L281-V289 HydrophobicContact CG-CG2 4.44Å; L281-V289 PolarHBondContact N-O 3.29Å; L281-V289 PolarHBondContact O-N 3.14Å; K283-V289 HydrophobicContact CD-CG1 3.66Å; K283-V289 HydrophobicContact CG-CG1 3.93Å
290	I	98.9	Very high	96.2	Very high	0 Å²	0	31.1 Å²	31.1	0%	0	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.2	135.4	171	-57.8	177.3	0	0	0	109.3	N199 I200 L201 L254 L257 H272 L275 L293	N199-I290 PolarHBondContact O-N 3.32Å; I200-I290 HydrophobicContact CD1-CB 4Å; I200-I290 HydrophobicContact CD1-CD1 4.43Å; L201-I290 WeakPolarHBondContact CB-O 3.24Å; L201-I290 PolarHBondContact N-O 2.85Å; L254-I290 HydrophobicContact CB-CD1 3.88Å; L254-I290 HydrophobicContact CD1-CD1 4.42Å; L254-I290 VanDerWaalsContact N-CD1 3.29Å; L257-I290 HydrophobicContact CD1-CD1 4.27Å; L257-I290 HydrophobicContact CD1-CG2 4.29Å; H272-I290 VanDerWaalsContact CD2-CG2 3.43Å; H272-I290 WeakPolarHBondContact CD2-CG2 3.48Å; H272-I290 WeakPolarHBondContact NE2-CG2 3.43Å; L275-I290 HydrophobicContact CD1-CD1 4.35Å; L275-I290 HydrophobicContact CD1-CG2 4.26Å; I290-L293 HydrophobicContact CG2-CD2 4.43Å
291	A	97.4	Very high	95.6	Very high	7 Å²	7	33.4 Å²	33.4	6%	0.058	17%	0.171	C	C	.	.			trans	-128.9	174.4	-177.7	0	0	0	0	0	111.5	L201 H272 N279 L281	L201-A291 HydrophobicContact CB-CB 4.14Å; L201-A291 HydrophobicContact CD2-CB 3.76Å; H272-A291 PolarHBondContact NE2-O 3.4Å; N279-A291 PolarHBondContact O-N 2.79Å; L281-A291 HydrophobicContact CD1-CB 4.09Å; L281-A291 HydrophobicContact CG-CB 4.04Å
292	D	94.7	Very high	95	Very high	34 Å²	34	38.9 Å²	38.9	18%	0.182	20%	0.2	C	C	.	.			trans	61.7	64.7	175.4	-164.2	27.2	0	0	0	113.6	K173 Y190 N279 G294	K173-D292 IonicContact NZ-OD1 2.62Å; K173-D292 PolarHBondContact NZ-OD1 3.09Å; Y190-D292 PolarHBondContact OH-N 2.88Å; Y190-D292 VanDerWaalsContact OH-N 3.15Å; N279-D292 HydrophobicContact CB-CB 4.21Å; N279-D292 PolarHBondContact ND2-OD2 3.37Å; N279-D292 PolarHBondContact OD1-OD2 3.48Å; D292-G294 PolarHBondContact O-N 3.18Å
293	L	95.6	Very high	94.4	Very high	0 Å²	0	42.8 Å²	42.8	0%	0	22%	0.224	C	C	.	.	G	3₁₀ helix	trans	-84.4	12.7	-179.7	-55.3	-177.5	0	0	0	113.7	I189 Y190 L195 I200 L257 H272 I290 L295 A296	I189-L293 HydrophobicContact CB-CB 4.35Å; I189-L293 HydrophobicContact CG2-CB 3.68Å; I189-L293 HydrophobicContact CG2-CD1 3.83Å; I189-L293 HydrophobicContact CG2-CG 4.38Å; Y190-L293 HydrophobicContact CD1-CD1 3.94Å; Y190-L293 HydrophobicContact CE1-CD1 3.64Å; Y190-L293 HydrophobicContact CE1-CG 4.02Å; Y190-L293 HydrophobicContact CE2-CB 4.26Å; Y190-L293 HydrophobicContact CE2-CG 4.38Å; L195-L293 HydrophobicContact CD2-CD1 4.02Å; I200-L293 HydrophobicContact CG2-CD1 4.41Å; L257-L293 HydrophobicContact CD1-CD2 4.23Å; L257-L293 HydrophobicContact CD2-CD1 4.45Å; L257-L293 HydrophobicContact CD2-CD2 4.46Å; H272-L293 VanDerWaalsContact CD2-CD2 3.43Å; H272-L293 WeakPolarHBondContact CD2-CD2 3.43Å; I290-L293 HydrophobicContact CG2-CD2 4.43Å; L293-L295 PolarHBondContact O-N 3.5Å; L293-L295 VanDerWaalsContact O-N 3.14Å; L293-A296 HydrophobicContact CB-CB 4.27Å; L293-A296 WeakPolarHBondContact O-CB 3.38Å; L293-A296 PolarHBondContact O-N 2.73Å
294	G	93	Very high	93.9	Very high	8 Å²	8	45.9 Å²	45.9	8%	0.082	24%	0.243	C	C	.	.	G	3₁₀ helix	trans	-65.8	-17.5	-173.6	0	0	0	0	0	115	R185 D292	R185-G294 WeakPolarHBondContact CG-O 3.45Å; D292-G294 PolarHBondContact O-N 3.18Å
295	L	93.7	Very high	93.5	Very high	26 Å²	26	39.5 Å²	39.5	14%	0.136	23%	0.227	C	C	.	.	G	3₁₀ helix	trans	-105.6	1.3	175.5	-64.6	176.2	0	0	0	113.4	F157 R273 D274 L293 V314	F157-L295 HydrophobicContact CE2-CD2 4.47Å; F157-L295 HydrophobicContact CZ-CD2 4.37Å; R273-L295 WeakPolarHBondContact CD-O 2.97Å; D274-L295 HydrophobicContact CB-CD1 3.83Å; L293-L295 PolarHBondContact O-N 3.5Å; L293-L295 VanDerWaalsContact O-N 3.14Å; L295-V314 HydrophobicContact CB-CG2 4.41Å; L295-V314 HydrophobicContact CD1-CB 4.31Å; L295-V314 HydrophobicContact CD1-CG2 4.32Å; L295-V314 HydrophobicContact CD2-CB 4.19Å; L295-V314 HydrophobicContact CD2-CG2 4.24Å
296	A	95.6	Very high	93.2	Very high	0 Å²	0	35.5 Å²	35.5	0%	0	21%	0.205	C	C	.	.			trans	-66.1	157.8	-176.9	0	0	0	0	0	111.8	R185 I189 I270 A271 L293	R185-A296 PolarHBondContact NE-O 3.14Å; R185-A296 PolarHBondContact NH2-O 2.7Å; I189-A296 HydrophobicContact CD1-CB 4.39Å; I189-A296 HydrophobicContact CG1-CB 4.32Å; I189-A296 HydrophobicContact CG2-CB 4.17Å; I270-A296 HydrophobicContact CG2-CB 3.82Å; A271-A296 CarbonylContact O-C 3.57Å; A271-A296 WeakPolarHBondContact O-CA 3.39Å; A271-A296 WeakPolarHBondContact O-CB 3.32Å; L293-A296 HydrophobicContact CB-CB 4.27Å; L293-A296 WeakPolarHBondContact O-CB 3.38Å; L293-A296 PolarHBondContact O-N 2.73Å
297	V	94.9	Very high	92.7	Very high	2 Å²	2	37 Å²	37	1%	0.012	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.8	139.5	179.8	-64.3	0	0	0	0	110.8	I270 A271 R273 I306 D307 I308 F334 F337	I270-V297 VanDerWaalsContact CA-O 3.27Å; I270-V297 WeakPolarHBondContact CA-O 3.28Å; A271-V297 HydrophobicContact CB-CG2 3.96Å; A271-V297 PolarHBondContact N-O 3.07Å; A271-V297 PolarHBondContact O-N 2.94Å; R273-V297 HydrophobicContact CG-CG2 4.29Å; V297-I306 HydrophobicContact CB-CG2 4.02Å; V297-I306 HydrophobicContact CG2-CG2 4.2Å; V297-D307 VanDerWaalsContact CA-OD1 3.28Å; V297-D307 WeakPolarHBondContact CA-OD1 3.39Å; V297-I308 HydrophobicContact CB-CG1 4.19Å; V297-I308 HydrophobicContact CG1-CG1 3.8Å; V297-F334 HydrophobicContact CG2-CE2 4Å; V297-F337 HydrophobicContact CG2-CB 4.44Å; V297-F337 HydrophobicContact CG2-CD2 4.46Å; V297-F337 HydrophobicContact CG2-CG 4.26Å
298	K	95.1	Very high	91.6	Very high	38 Å²	38	37.8 Å²	37.8	17%	0.165	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.4	139.6	177.7	-62.7	179.6	-72	-175.2	0	110	E188 I189 P268 A269 I270 I306 D307	E188-K298 IonicContact OE1-NZ 2.67Å; E188-K298 PolarHBondContact OE1-NZ 2.9Å; I189-K298 HydrophobicContact CD1-CD 3.96Å; I189-K298 HydrophobicContact CD1-CG 3.75Å; P268-K298 HydrophobicContact CB-CB 4.28Å; P268-K298 HydrophobicContact CG-CB 4.25Å; P268-K298 HydrophobicContact CG-CD 3.94Å; P268-K298 HydrophobicContact CG-CG 4.14Å; A269-K298 WeakPolarHBondContact O-CA 3.46Å; I270-K298 HydrophobicContact CG1-CG 4.15Å; K298-I306 WeakPolarHBondContact O-CG2 3.22Å; K298-D307 WeakPolarHBondContact CB-OD2 3.36Å; K298-D307 WeakPolarHBondContact CE-OD2 3.44Å; K298-D307 PolarHBondContact N-OD1 3.5Å; K298-D307 PolarHBondContact N-OD2 2.9Å; K298-D307 PolarHBondContact O-N 3.21Å
299	H	94.6	Very high	90	Very high	30 Å²	30	41.5 Å²	41.5	14%	0.139	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.5	126.4	168.4	-173.2	-139.7	0	0	0	109.9	P268 A269 N304 T305 F334	P268-H299 VanDerWaalsContact CB-O 3.25Å; P268-H299 WeakPolarHBondContact CB-O 3.29Å; A269-H299 HydrophobicContact CB-CB 4.31Å; A269-H299 PolarHBondContact O-N 2.97Å; H299-N304 PolarHBondContact NE2-OD1 3.09Å; H299-T305 PolarHBondContact CD2-O 3.19Å; H299-F334 HydrophobicContact CB-CB 4.2Å; H299-F334 HydrophobicContact CB-CD1 3.7Å; H299-F334 HydrophobicContact CB-CD2 3.65Å; H299-F334 HydrophobicContact CB-CE1 3.88Å; H299-F334 HydrophobicContact CB-CE2 3.8Å; H299-F334 HydrophobicContact CB-CG 3.57Å; H299-F334 HydrophobicContact CB-CZ 3.92Å; H299-F334 AromaticContact CG-CG 3.78Å
300	D	90.6	Very high	88.1	Confident	60 Å²	60	47.8 Å²	47.8	32%	0.321	29%	0.286	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.5	103.4	162.9	178.2	4.3	0	0	0	108.3	N302 T303 N304 T305	D300-N302 VanDerWaalsContact C-N 3.26Å; D300-N302 PolarHBondContact O-N 3.41Å; D300-N302 WeakPolarHBondContact OD1-CB 3.49Å; D300-N302 PolarHBondContact OD1-N 3.14Å; D300-N302 PolarHBondContact OD1-ND2 3.43Å; D300-T303 WeakPolarHBondContact OD2-CG2 3.43Å; D300-T303 PolarHBondContact OD2-OG1 3.21Å; D300-N304 WeakPolarHBondContact O-CA 3.5Å; D300-N304 PolarHBondContact O-N 3.38Å; D300-T305 PolarHBondContact N-O 2.92Å; D300-T305 PolarHBondContact O-N 3.13Å
301	S	86.3	Confident	86.7	Confident	48 Å²	48	52.3 Å²	52.3	34%	0.336	31%	0.31	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.8	-24.5	-179.4	53.4	0	0	0	0	113.2	E260	E260-S301 WeakPolarHBondContact OE1-CB 3.25Å; E260-S301 PolarHBondContact OE1-OG 3.3Å
302	N	85.1	Confident	85.3	Confident	151 Å²	151	54.3 Å²	54.3	81%	0.807	32%	0.318	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.7	-42	-179.7	-60	-59.8	0	0	0	111.8	D300	D300-N302 VanDerWaalsContact C-N 3.26Å; D300-N302 PolarHBondContact O-N 3.41Å; D300-N302 WeakPolarHBondContact OD1-CB 3.49Å; D300-N302 PolarHBondContact OD1-N 3.14Å; D300-N302 PolarHBondContact OD1-ND2 3.43Å
303	T	87.3	Confident	84.6	Confident	82 Å²	82	56.9 Å²	56.9	50%	0.503	33%	0.325	S	S	.	.	T	Hydrogen-bonded Turn	trans	-95.9	-7.4	179.2	61.1	0	0	0	0	112.8	D300 T305	D300-T303 WeakPolarHBondContact OD2-CG2 3.43Å; D300-T303 PolarHBondContact OD2-OG1 3.21Å; T303-T305 PolarHBondContact O-N 3Å; T303-T305 WeakPolarHBondContact OG1-CG2 3.17Å; T303-T305 PolarHBondContact OG1-OG1 3.44Å
304	N	86.8	Confident	84.3	Confident	107 Å²	107	57.8 Å²	57.8	57%	0.572	33%	0.331	S	S	*	.	T	Hydrogen-bonded Turn	trans	50.3	39.6	-169.2	-166.7	41.4	0	0	0	112.5	H299 D300	H299-N304 PolarHBondContact NE2-OD1 3.09Å; D300-N304 WeakPolarHBondContact O-CA 3.5Å; D300-N304 PolarHBondContact O-N 3.38Å
305	T	88.4	Confident	84.2	Confident	75 Å²	75	58.2 Å²	58.2	46%	0.46	34%	0.335	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	161.6	178.6	65.4	0	0	0	0	111.1	H299 D300 T303	H299-T305 PolarHBondContact CD2-O 3.19Å; D300-T305 PolarHBondContact N-O 2.92Å; D300-T305 PolarHBondContact O-N 3.13Å; T303-T305 PolarHBondContact O-N 3Å; T303-T305 WeakPolarHBondContact OG1-CG2 3.17Å; T303-T305 PolarHBondContact OG1-OG1 3.44Å
306	I	88.6	Confident	84.3	Confident	30 Å²	30	59.1 Å²	59.1	15%	0.154	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	135.3	177.6	-38.4	170.4	0	0	0	107.5	V297 K298 I308 M331 F334 F337	V297-I306 HydrophobicContact CB-CG2 4.02Å; V297-I306 HydrophobicContact CG2-CG2 4.2Å; K298-I306 WeakPolarHBondContact O-CG2 3.22Å; I306-I308 HydrophobicContact CB-CD1 3.62Å; I306-I308 HydrophobicContact CB-CG1 3.78Å; I306-I308 HydrophobicContact CD1-CD1 3.82Å; I306-I308 HydrophobicContact CG1-CD1 4.34Å; I306-I308 HydrophobicContact CG2-CD1 3.55Å; I306-I308 HydrophobicContact CG2-CG1 3.47Å; I306-I308 VanDerWaalsContact CG2-CG1 3.47Å; I306-I308 PolarHBondContact O-N 3.45Å; I306-M331 WeakPolarHBondContact CD1-O 3.29Å; I306-F334 HydrophobicContact CD1-CB 3.88Å; I306-F334 HydrophobicContact CD1-CD2 4.15Å; I306-F334 HydrophobicContact CG1-CB 4.17Å; I306-F334 HydrophobicContact CG1-CD2 4.18Å; I306-F334 HydrophobicContact CG2-CD2 3.7Å; I306-F334 HydrophobicContact CG2-CE2 4.13Å; I306-F337 HydrophobicContact CD1-CD2 4.14Å; I306-F337 HydrophobicContact CD1-CE2 3.66Å
307	D	84.3	Confident	84.4	Confident	54 Å²	54	62.6 Å²	62.6	29%	0.289	36%	0.357	S	S	.	.			trans	-77.8	48	-176.6	68.6	-4.9	0	0	0	113.5	R185 V297 K298	R185-D307 IonicContact CZ-OD1 2.69Å; R185-D307 IonicContact CZ-OD2 2.81Å; R185-D307 VanDerWaalsContact CZ-OD2 3.24Å; R185-D307 IonicContact NH1-OD1 2.84Å; R185-D307 IonicContact NH1-OD2 2.81Å; R185-D307 PolarHBondContact NH1-OD2 3.46Å; R185-D307 PolarHBondContact NH2-O 3.13Å; R185-D307 IonicContact NH2-OD1 3.24Å; R185-D307 PolarHBondContact NH2-OD1 3.41Å; R185-D307 IonicContact NH2-OD2 2.73Å; R185-D307 PolarHBondContact NH2-OD2 3.31Å; V297-D307 VanDerWaalsContact CA-OD1 3.28Å; V297-D307 WeakPolarHBondContact CA-OD1 3.39Å; K298-D307 WeakPolarHBondContact CB-OD2 3.36Å; K298-D307 WeakPolarHBondContact CE-OD2 3.44Å; K298-D307 PolarHBondContact N-OD1 3.5Å; K298-D307 PolarHBondContact N-OD2 2.9Å; K298-D307 PolarHBondContact O-N 3.21Å
308	I	74.4	Confident	84.6	Confident	42 Å²	42	63 Å²	63	22%	0.215	36%	0.358	C	S	.	.			trans	-90.3	128.7	-172.9	-57.3	166.6	0	0	0	110.8	V297 I306 M331 F337	V297-I308 HydrophobicContact CB-CG1 4.19Å; V297-I308 HydrophobicContact CG1-CG1 3.8Å; I306-I308 HydrophobicContact CB-CD1 3.62Å; I306-I308 HydrophobicContact CB-CG1 3.78Å; I306-I308 HydrophobicContact CD1-CD1 3.82Å; I306-I308 HydrophobicContact CG1-CD1 4.34Å; I306-I308 HydrophobicContact CG2-CD1 3.55Å; I306-I308 HydrophobicContact CG2-CG1 3.47Å; I306-I308 VanDerWaalsContact CG2-CG1 3.47Å; I306-I308 PolarHBondContact O-N 3.45Å; I308-M331 HydrophobicContact CD1-CE 3.93Å; I308-M331 HydrophobicContact CG2-CE 3.85Å; I308-F337 HydrophobicContact CD1-CD2 4.32Å; I308-F337 HydrophobicContact CD1-CE1 4.21Å; I308-F337 HydrophobicContact CD1-CE2 3.37Å; I308-F337 HydrophobicContact CD1-CZ 3.3Å
309	A	65.2	Low	84.8	Confident	78 Å²	78	61.8 Å²	61.8	65%	0.645	35%	0.352	S	S	*	.			trans	-66.9	154	163.4	0	0	0	0	0	111.1	N311	A309-N311 PolarHBondContact O-N 3.29Å
310	S	59.7	Low	85	Confident	132 Å²	132	60.9 Å²	60.9	92%	0.923	35%	0.348	S	S	*	.	S	Bend	trans	-53.6	-15.5	-172	53.3	0	0	0	0	117.1
311	N	69.1	Low	85.3	Confident	95 Å²	95	58 Å²	58	51%	0.508	33%	0.334	S	S	.	.			trans	-97.8	117.6	178.1	-166.1	-5.6	0	0	0	112.5	R273 A309 R313	R273-N311 PolarHBondContact NH2-O 2.74Å; A309-N311 PolarHBondContact O-N 3.29Å; N311-R313 PolarHBondContact OD1-N 3.42Å
312	H	69	Low	85.9	Confident	48 Å²	48	56 Å²	56	22%	0.222	32%	0.319	C	S	.	.			trans	-93.1	-27.7	-178	57.5	87.3	0	0	0	114.6	R273 V314 E327 M331	R273-H312 PolarHBondContact NH2-O 2.82Å; H312-V314 VanDerWaalsContact C-N 3.28Å; H312-V314 PolarHBondContact O-N 3.4Å; H312-E327 IonicContact CE1-OE1 3.54Å; H312-E327 PolarHBondContact CE1-OE1 3.37Å; H312-E327 VanDerWaalsContact CE1-OE1 3.25Å; H312-E327 IonicContact NE2-OE1 2.69Å; H312-M331 HydrophobicContact CB-CE 3.29Å; H312-M331 HydrophobicContact CB-CG 4.36Å; H312-M331 HydrophobicContact CB-SD 3.33Å; H312-M331 WeakPolarHBondContact CB-SD 3.5Å
313	R	80.3	Confident	86.5	Confident	88 Å²	88	49.6 Å²	49.6	33%	0.332	28%	0.284	S	S	.	.			trans	-81.4	73.4	176.5	-69.8	-159.7	-117.2	171.6	-4.1	110.6	N311 E327	N311-R313 PolarHBondContact OD1-N 3.42Å; R313-E327 IonicContact CZ-OE1 3.03Å; R313-E327 IonicContact CZ-OE2 3.96Å; R313-E327 VanDerWaalsContact NE-CD 3.31Å; R313-E327 IonicContact NE-OE1 3.47Å; R313-E327 PolarHBondContact NE-OE1 3.45Å; R313-E327 IonicContact NH2-OE1 3.62Å; R313-E327 PolarHBondContact NH2-OE1 2.81Å; R313-E327 IonicContact NH2-OE2 2.74Å; R313-E327 PolarHBondContact NH2-OE2 3.44Å
314	V	88.2	Confident	87	Confident	20 Å²	20	46.3 Å²	46.3	12%	0.121	26%	0.263	C	S	.	.			trans	-118.2	162.2	173.6	-52.5	0	0	0	0	110.6	L295 H312 M320	L295-V314 HydrophobicContact CB-CG2 4.41Å; L295-V314 HydrophobicContact CD1-CB 4.31Å; L295-V314 HydrophobicContact CD1-CG2 4.32Å; L295-V314 HydrophobicContact CD2-CB 4.19Å; L295-V314 HydrophobicContact CD2-CG2 4.24Å; H312-V314 VanDerWaalsContact C-N 3.28Å; H312-V314 PolarHBondContact O-N 3.4Å; V314-M320 VanDerWaalsContact O-CE 3.3Å; V314-M320 WeakPolarHBondContact O-CE 3.12Å
315	G	91.9	Very high	87.4	Confident	17 Å²	17	41.2 Å²	41.2	18%	0.175	24%	0.236	C	C	.	.	S	Bend	trans	98.7	-175.6	-177.9	0	0	0	0	0	112.2	D274 K317 M320	D274-G315 WeakPolarHBondContact OD1-CA 3.48Å; G315-K317 PolarHBondContact O-N 3.22Å; G315-M320 WeakPolarHBondContact O-CE 3.38Å
316	T	96.1	Very high	87.8	Confident	45 Å²	45	40.6 Å²	40.6	28%	0.276	23%	0.23	S	C	.	.			trans	-85	116.1	-173.6	-55.1	0	0	0	0	110.1	D274 K276 R318 Y319 M320	D274-T316 VanDerWaalsContact OD1-CB 3.29Å; D274-T316 WeakPolarHBondContact OD1-CB 3.37Å; D274-T316 PolarHBondContact OD1-N 2.76Å; D274-T316 PolarHBondContact OD1-OG1 2.83Å; K276-T316 HydrophobicContact CD-CG2 4.19Å; K276-T316 WeakPolarHBondContact CD-OG1 3.33Å; K276-T316 WeakPolarHBondContact CE-OG1 3.5Å; K276-T316 PolarHBondContact NZ-OG1 3.48Å; T316-R318 PolarHBondContact O-N 3.32Å; T316-R318 VanDerWaalsContact O-N 3.09Å; T316-Y319 HydrophobicContact CG2-CD2 3.87Å; T316-Y319 HydrophobicContact CG2-CE2 4.36Å; T316-Y319 PolarHBondContact O-N 3.26Å; T316-M320 PolarHBondContact O-N 2.92Å
317	K	97.6	Very high	88	Confident	73 Å²	73	43.6 Å²	43.6	32%	0.317	24%	0.244	S	C	.	.	G	3₁₀ helix	trans	-49.2	-42.3	-172.3	-50	-176	-157.6	103.8	0	113.6	G315 Y319 M320 D376 P377 I379 M382	G315-K317 PolarHBondContact O-N 3.22Å; K317-Y319 PolarHBondContact O-N 3.48Å; K317-M320 WeakPolarHBondContact O-CB 3.26Å; K317-M320 PolarHBondContact O-N 3.49Å; K317-M320 VanDerWaalsContact O-N 3.17Å; K317-D376 IonicContact NZ-OD1 3.8Å; K317-P377 VanDerWaalsContact CD-O 3.28Å; K317-P377 WeakPolarHBondContact CD-O 3.17Å; K317-I379 HydrophobicContact CB-CD1 4.03Å; K317-I379 HydrophobicContact CD-CD1 3.8Å; K317-I379 HydrophobicContact CD-CG1 3.99Å; K317-I379 HydrophobicContact CG-CD1 3.66Å; K317-I379 HydrophobicContact CG-CG1 4.41Å; K317-M382 HydrophobicContact CB-CG 4.45Å
318	R	98.6	Very high	88.4	Confident	11 Å²	11	44.9 Å²	44.9	4%	0.042	26%	0.257	C	S	.	.	G	3₁₀ helix	trans	-57.5	-28	177.9	-175.9	-179.3	-66.9	-75.2	-3.1	114.5	T316 P368 Y369 P374 S375 P377 M382	T316-R318 PolarHBondContact O-N 3.32Å; T316-R318 VanDerWaalsContact O-N 3.09Å; R318-P368 VanDerWaalsContact CD-O 3.22Å; R318-P368 WeakPolarHBondContact CD-O 3.38Å; R318-P368 WeakPolarHBondContact CG-O 3.34Å; R318-P368 PolarHBondContact NH1-O 2.77Å; R318-Y369 HydrophobicContact CG-CD2 4.49Å; R318-P374 PolarHBondContact NH2-O 3.48Å; R318-S375 PolarHBondContact NH2-O 2.85Å; R318-P377 HydrophobicContact CB-CG 4.2Å; R318-M382 WeakPolarHBondContact O-CE 3.39Å
319	Y	98.7	Very high	89.3	Confident	11 Å²	11	43.6 Å²	43.6	4%	0.043	25%	0.251	C	S	.	.	G	3₁₀ helix	trans	-104.6	-1.4	-176.9	-65.3	-98.1	0	0	0	112.7	K276 S277 T316 K317 A321 Y343 S344 L347 V348 E351 L367 P368	K276-Y319 HydrophobicContact CB-CD1 3.95Å; K276-Y319 HydrophobicContact CB-CD2 3.8Å; K276-Y319 HydrophobicContact CB-CE1 3.88Å; K276-Y319 HydrophobicContact CB-CE2 3.72Å; K276-Y319 HydrophobicContact CB-CG 3.92Å; S277-Y319 PolarHBondContact OG-OH 3.48Å; T316-Y319 HydrophobicContact CG2-CD2 3.87Å; T316-Y319 HydrophobicContact CG2-CE2 4.36Å; T316-Y319 PolarHBondContact O-N 3.26Å; K317-Y319 PolarHBondContact O-N 3.48Å; Y319-A321 PolarHBondContact O-N 2.72Å; Y319-Y343 WeakPolarHBondContact O-CD1 3.34Å; Y319-Y343 WeakPolarHBondContact O-CE1 3.32Å; Y319-S344 PolarHBondContact O-OG 2.65Å; Y319-S344 VanDerWaalsContact O-OG 3.09Å; Y319-L347 HydrophobicContact CD1-CB 3.98Å; Y319-L347 HydrophobicContact CD1-CD1 3.96Å; Y319-L347 HydrophobicContact CE1-CB 4.15Å; Y319-L347 HydrophobicContact CG-CD1 4.4Å; Y319-V348 HydrophobicContact CE1-CG2 4.27Å; Y319-E351 WeakPolarHBondContact CE1-OE1 3.46Å; Y319-E351 VanDerWaalsContact OH-CD 3.32Å; Y319-E351 PolarHBondContact OH-OE1 2.98Å; Y319-E351 PolarHBondContact OH-OE2 2.95Å; Y319-L367 WeakPolarHBondContact OH-CD2 3.36Å; Y319-P368 HydrophobicContact CE1-CG 3.85Å; Y319-P368 WeakPolarHBondContact OH-CD 3.46Å
320	M	98.5	Very high	90.5	Very high	11 Å²	11	44 Å²	44	5%	0.054	24%	0.242	C	C	.	.			trans	-65.1	133.1	-179	-74	180	172	0	0	111.3	V314 G315 T316 K317 I324 L325 Y343 I379	V314-M320 VanDerWaalsContact O-CE 3.3Å; V314-M320 WeakPolarHBondContact O-CE 3.12Å; G315-M320 WeakPolarHBondContact O-CE 3.38Å; T316-M320 PolarHBondContact O-N 2.92Å; K317-M320 WeakPolarHBondContact O-CB 3.26Å; K317-M320 PolarHBondContact O-N 3.49Å; K317-M320 VanDerWaalsContact O-N 3.17Å; M320-I324 HydrophobicContact CB-CB 4.32Å; M320-I324 HydrophobicContact CB-CG2 4.24Å; M320-I324 HydrophobicContact CE-CG2 4.49Å; M320-I324 HydrophobicContact CG-CG2 4.05Å; M320-I324 HydrophobicContact SD-CG2 3.98Å; M320-L325 HydrophobicContact CB-CD1 4.48Å; M320-L325 HydrophobicContact CB-CD2 3.77Å; M320-L325 HydrophobicContact CB-CG 3.82Å; M320-L325 HydrophobicContact SD-CD2 4.05Å; M320-Y343 VanDerWaalsContact O-CE1 3.23Å; M320-Y343 WeakPolarHBondContact O-CE1 3.41Å; M320-I379 HydrophobicContact CE-CD1 4.1Å; M320-I379 HydrophobicContact SD-CD1 3.48Å; M320-I379 WeakPolarHBondContact SD-CD1 3.33Å
321	A	98.4	Very high	91.8	Very high	1 Å²	1	40 Å²	40	1%	0.008	21%	0.21	C	C	.	.			trans	-66.1	154.9	174.4	0	0	0	0	0	111.6	Y319 E323 I324 L325 A340 Y343	Y319-A321 PolarHBondContact O-N 2.72Å; A321-E323 VanDerWaalsContact C-N 3.27Å; A321-E323 WeakPolarHBondContact CB-OE1 3.45Å; A321-E323 WeakPolarHBondContact CB-OE2 3.24Å; A321-E323 PolarHBondContact O-N 3.01Å; A321-I324 HydrophobicContact CB-CG1 4.24Å; A321-I324 WeakPolarHBondContact O-CB 3.27Å; A321-I324 PolarHBondContact O-N 3.4Å; A321-L325 PolarHBondContact O-N 2.86Å; A321-L325 VanDerWaalsContact O-N 3.12Å; A321-A340 HydrophobicContact CB-CB 3.99Å; A321-Y343 VanDerWaalsContact CA-CD1 3.44Å; A321-Y343 HydrophobicContact CB-CD1 3.77Å; A321-Y343 HydrophobicContact CB-CD2 4.41Å; A321-Y343 HydrophobicContact CB-CE1 4.45Å; A321-Y343 HydrophobicContact CB-CG 3.75Å
322	P	98.3	Very high	92.6	Very high	6 Å²	6	42 Å²	42	4%	0.039	22%	0.22	C	C	.	.	H	α-helix	trans	-49.4	-45.1	-179	-24.9	28.4	0	0	0	113.9	I324 L325 D326 Y343 V386 C387	P322-I324 PolarHBondContact O-N 3.28Å; P322-L325 PolarHBondContact O-N 2.89Å; P322-L325 VanDerWaalsContact O-N 3.12Å; P322-D326 PolarHBondContact O-N 3.43Å; P322-Y343 HydrophobicContact CG-CE2 4.25Å; P322-V386 HydrophobicContact CB-CG1 4.23Å; P322-V386 HydrophobicContact CG-CG1 3.71Å; P322-C387 PolarHBondContact O-SG 3.41Å
323	E	97.5	Very high	93.7	Very high	15 Å²	15	42.6 Å²	42.6	7%	0.07	23%	0.225	C	C	.	.	H	α-helix	trans	-67.8	-20.6	-179.1	68.7	-83.5	-162.1	0	0	114.2	A321 D326 E327 S328 V329 R423	A321-E323 VanDerWaalsContact C-N 3.27Å; A321-E323 WeakPolarHBondContact CB-OE1 3.45Å; A321-E323 WeakPolarHBondContact CB-OE2 3.24Å; A321-E323 PolarHBondContact O-N 3.01Å; E323-D326 VanDerWaalsContact CA-OD1 3.28Å; E323-D326 WeakPolarHBondContact CA-OD1 3.41Å; E323-E327 CarbonylContact O-C 3.49Å; E323-E327 PolarHBondContact O-N 3.28Å; E323-S328 WeakPolarHBondContact CA-OG 3.34Å; E323-S328 WeakPolarHBondContact CB-OG 3.43Å; E323-S328 PolarHBondContact O-N 3.31Å; E323-S328 VanDerWaalsContact O-N 3.13Å; E323-V329 HydrophobicContact CB-CB 4.27Å; E323-V329 HydrophobicContact CG-CB 4.04Å; E323-V329 HydrophobicContact CG-CG2 4.2Å; E323-V329 WeakPolarHBondContact O-CB 3.4Å; E323-V329 PolarHBondContact O-N 3.45Å; E323-R423 IonicContact OE1-CZ 2.92Å; E323-R423 IonicContact OE1-NH1 2.85Å; E323-R423 PolarHBondContact OE1-NH1 3.09Å; E323-R423 IonicContact OE1-NH2 2.83Å; E323-R423 PolarHBondContact OE1-NH2 3.35Å; E323-R423 IonicContact OE2-CZ 3.17Å; E323-R423 IonicContact OE2-NH1 2.9Å; E323-R423 PolarHBondContact OE2-NH1 2.91Å; E323-R423 IonicContact OE2-NH2 3.94Å; E323-R423 PolarHBondContact OE2-NH2 2.95Å
324	I	96.6	Very high	94.4	Very high	13 Å²	13	38.8 Å²	38.8	7%	0.067	21%	0.211	C	C	.	.	H	α-helix	trans	-83.2	-37.2	173.6	-55.4	-61.5	0	0	0	110	M320 A321 P322 V329 A340	M320-I324 HydrophobicContact CB-CB 4.32Å; M320-I324 HydrophobicContact CB-CG2 4.24Å; M320-I324 HydrophobicContact CE-CG2 4.49Å; M320-I324 HydrophobicContact CG-CG2 4.05Å; M320-I324 HydrophobicContact SD-CG2 3.98Å; A321-I324 HydrophobicContact CB-CG1 4.24Å; A321-I324 WeakPolarHBondContact O-CB 3.27Å; A321-I324 PolarHBondContact O-N 3.4Å; P322-I324 PolarHBondContact O-N 3.28Å; I324-V329 HydrophobicContact CD1-CB 3.91Å; I324-V329 HydrophobicContact CD1-CG1 3.95Å; I324-V329 HydrophobicContact CD1-CG2 3.81Å; I324-A340 HydrophobicContact CD1-CB 4.41Å; I324-A340 HydrophobicContact CG1-CB 4.17Å
325	L	97.1	Very high	94.7	Very high	1 Å²	1	40.3 Å²	40.3	1%	0.005	22%	0.217	C	C	.	.	H	α-helix	trans	-71.7	-39.1	-180	-69.9	169.9	0	0	0	112.6	M320 A321 P322 I379 M382 K383 V386	M320-L325 HydrophobicContact CB-CD1 4.48Å; M320-L325 HydrophobicContact CB-CD2 3.77Å; M320-L325 HydrophobicContact CB-CG 3.82Å; M320-L325 HydrophobicContact SD-CD2 4.05Å; A321-L325 PolarHBondContact O-N 2.86Å; A321-L325 VanDerWaalsContact O-N 3.12Å; P322-L325 PolarHBondContact O-N 2.89Å; P322-L325 VanDerWaalsContact O-N 3.12Å; L325-I379 HydrophobicContact CD2-CD1 4.29Å; L325-I379 HydrophobicContact CD2-CG2 4.23Å; L325-M382 HydrophobicContact CD1-CB 3.95Å; L325-M382 HydrophobicContact CD2-CB 3.64Å; L325-M382 HydrophobicContact CG-CB 4.47Å; L325-K383 HydrophobicContact CB-CB 4.39Å; L325-V386 HydrophobicContact CD1-CB 3.81Å; L325-V386 HydrophobicContact CD1-CG1 3.9Å; L325-V386 HydrophobicContact CD1-CG2 4.24Å
326	D	94.9	Very high	94.9	Very high	62 Å²	62	40 Å²	40	33%	0.332	21%	0.212	S	C	.	.	S	Bend	trans	-95.7	0.5	179.8	71.2	12.7	0	0	0	114.4	P322 E323 S328	P322-D326 PolarHBondContact O-N 3.43Å; E323-D326 VanDerWaalsContact CA-OD1 3.28Å; E323-D326 WeakPolarHBondContact CA-OD1 3.41Å; D326-S328 PolarHBondContact O-N 3.1Å; D326-S328 WeakPolarHBondContact OD1-CB 3.28Å; D326-S328 PolarHBondContact OD1-N 2.95Å; D326-S328 PolarHBondContact OD1-OG 3.28Å
327	E	92.9	Very high	94.9	Very high	92 Å²	92	38 Å²	38	43%	0.43	20%	0.199	S	C	.	.	S	Bend	trans	63.4	19.5	-179.7	-47.4	-168.8	116.1	0	0	115.6	H312 R313 E323 V329	H312-E327 IonicContact CE1-OE1 3.54Å; H312-E327 PolarHBondContact CE1-OE1 3.37Å; H312-E327 VanDerWaalsContact CE1-OE1 3.25Å; H312-E327 IonicContact NE2-OE1 2.69Å; R313-E327 IonicContact CZ-OE1 3.03Å; R313-E327 IonicContact CZ-OE2 3.96Å; R313-E327 VanDerWaalsContact NE-CD 3.31Å; R313-E327 IonicContact NE-OE1 3.47Å; R313-E327 PolarHBondContact NE-OE1 3.45Å; R313-E327 IonicContact NH2-OE1 3.62Å; R313-E327 PolarHBondContact NH2-OE1 2.81Å; R313-E327 IonicContact NH2-OE2 2.74Å; R313-E327 PolarHBondContact NH2-OE2 3.44Å; E323-E327 CarbonylContact O-C 3.49Å; E323-E327 PolarHBondContact O-N 3.28Å; E327-V329 PolarHBondContact O-N 2.86Å
328	S	93.9	Very high	95	Very high	81 Å²	81	36.3 Å²	36.3	57%	0.566	19%	0.192	S	C	*	.			trans	-79.5	-2.1	175	65	0	0	0	0	114.2	E323 D326 N330	E323-S328 WeakPolarHBondContact CA-OG 3.34Å; E323-S328 WeakPolarHBondContact CB-OG 3.43Å; E323-S328 PolarHBondContact O-N 3.31Å; E323-S328 VanDerWaalsContact O-N 3.13Å; D326-S328 PolarHBondContact O-N 3.1Å; D326-S328 WeakPolarHBondContact OD1-CB 3.28Å; D326-S328 PolarHBondContact OD1-N 2.95Å; D326-S328 PolarHBondContact OD1-OG 3.28Å; S328-N330 PolarHBondContact O-N 2.81Å
329	V	92.1	Very high	95	Very high	15 Å²	15	39 Å²	39	9%	0.091	20%	0.202	C	C	.	.			trans	-60.4	130.1	-179.3	66.4	0	0	0	0	112.4	E323 I324 E327 M331	E323-V329 HydrophobicContact CB-CB 4.27Å; E323-V329 HydrophobicContact CG-CB 4.04Å; E323-V329 HydrophobicContact CG-CG2 4.2Å; E323-V329 WeakPolarHBondContact O-CB 3.4Å; E323-V329 PolarHBondContact O-N 3.45Å; I324-V329 HydrophobicContact CD1-CB 3.91Å; I324-V329 HydrophobicContact CD1-CG1 3.95Å; I324-V329 HydrophobicContact CD1-CG2 3.81Å; E327-V329 PolarHBondContact O-N 2.86Å; V329-M331 HydrophobicContact CG1-CG 4.34Å; V329-M331 HydrophobicContact CG1-SD 3.7Å; V329-M331 PolarHBondContact O-N 3.17Å
330	N	90.3	Very high	95	Very high	86 Å²	86	39 Å²	39	46%	0.46	21%	0.205	S	C	.	.			trans	-79.9	101.8	171.5	-176.8	-9.5	0	0	0	110.2	S328 N332 N333 S336	S328-N330 PolarHBondContact O-N 2.81Å; N330-N332 VanDerWaalsContact C-N 3.25Å; N330-N332 PolarHBondContact O-N 2.94Å; N330-N332 PolarHBondContact OD1-N 3.28Å; N330-N333 HydrophobicContact CB-CB 4.23Å; N330-N333 PolarHBondContact O-N 2.75Å; N330-S336 WeakPolarHBondContact O-CB 3.15Å; N330-S336 PolarHBondContact O-OG 3.4Å
331	M	87	Confident	95	Very high	49 Å²	49	38.6 Å²	38.6	24%	0.241	20%	0.202	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67	-20.5	-178.8	-65.7	-58.9	-61.7	0	0	114.6	I306 I308 H312 V329 N333 F337	I306-M331 WeakPolarHBondContact CD1-O 3.29Å; I308-M331 HydrophobicContact CD1-CE 3.93Å; I308-M331 HydrophobicContact CG2-CE 3.85Å; H312-M331 HydrophobicContact CB-CE 3.29Å; H312-M331 HydrophobicContact CB-CG 4.36Å; H312-M331 HydrophobicContact CB-SD 3.33Å; H312-M331 WeakPolarHBondContact CB-SD 3.5Å; V329-M331 HydrophobicContact CG1-CG 4.34Å; V329-M331 HydrophobicContact CG1-SD 3.7Å; V329-M331 PolarHBondContact O-N 3.17Å; M331-N333 VanDerWaalsContact C-N 3.3Å; M331-F337 HydrophobicContact CE-CE1 3.96Å; M331-F337 HydrophobicContact CE-CZ 3.49Å; M331-F337 VanDerWaalsContact CE-CZ 3.49Å; M331-F337 HydrophobicContact SD-CE1 3.95Å; M331-F337 HydrophobicContact SD-CZ 3.59Å; M331-F337 VanDerWaalsContact SD-CZ 3.59Å
332	N	87.2	Confident	95	Very high	136 Å²	136	38.6 Å²	38.6	73%	0.727	20%	0.203	S	C	*	.	T	Hydrogen-bonded Turn	trans	-87.8	-4.2	177.9	-60.9	-30.6	0	0	0	112.1	N330	N330-N332 VanDerWaalsContact C-N 3.25Å; N330-N332 PolarHBondContact O-N 2.94Å; N330-N332 PolarHBondContact OD1-N 3.28Å
333	N	91.7	Very high	95	Very high	61 Å²	61	38.3 Å²	38.3	33%	0.326	20%	0.201	S	C	.	.			trans	-112.1	110.3	178.7	-177.8	2	0	0	0	110.1	N330 M331 E335 S336	N330-N333 HydrophobicContact CB-CB 4.23Å; N330-N333 PolarHBondContact O-N 2.75Å; M331-N333 VanDerWaalsContact C-N 3.3Å; N333-E335 PolarHBondContact O-N 3.44Å; N333-E335 VanDerWaalsContact OD1-CB 3.31Å; N333-E335 WeakPolarHBondContact OD1-CB 3.45Å; N333-E335 PolarHBondContact OD1-N 3.4Å; N333-S336 WeakPolarHBondContact O-CB 3.25Å; N333-S336 PolarHBondContact O-N 3.14Å; N333-S336 PolarHBondContact O-OG 3.08Å; N333-S336 VanDerWaalsContact O-OG 3.1Å
334	F	94.3	Very high	95.1	Very high	9 Å²	9	38 Å²	38	4%	0.039	20%	0.2	C	C	.	.	H	α-helix	trans	-58.6	-33.1	179.9	-174.8	-106	0	0	0	113.4	A269 A271 V297 H299 I306 S336 F337 K338	A269-F334 VanDerWaalsContact C-CZ 3.48Å; A269-F334 HydrophobicContact CB-CD1 4.26Å; A269-F334 HydrophobicContact CB-CE1 3.47Å; A269-F334 VanDerWaalsContact CB-CE1 3.47Å; A269-F334 HydrophobicContact CB-CZ 4.07Å; A269-F334 WeakPolarHBondContact O-CZ 3.41Å; A271-F334 HydrophobicContact CB-CE2 4.16Å; A271-F334 HydrophobicContact CB-CZ 3.98Å; V297-F334 HydrophobicContact CG2-CE2 4Å; H299-F334 HydrophobicContact CB-CB 4.2Å; H299-F334 HydrophobicContact CB-CD1 3.7Å; H299-F334 HydrophobicContact CB-CD2 3.65Å; H299-F334 HydrophobicContact CB-CE1 3.88Å; H299-F334 HydrophobicContact CB-CE2 3.8Å; H299-F334 HydrophobicContact CB-CG 3.57Å; H299-F334 HydrophobicContact CB-CZ 3.92Å; H299-F334 AromaticContact CG-CG 3.78Å; I306-F334 HydrophobicContact CD1-CB 3.88Å; I306-F334 HydrophobicContact CD1-CD2 4.15Å; I306-F334 HydrophobicContact CG1-CB 4.17Å; I306-F334 HydrophobicContact CG1-CD2 4.18Å; I306-F334 HydrophobicContact CG2-CD2 3.7Å; I306-F334 HydrophobicContact CG2-CE2 4.13Å; F334-S336 PolarHBondContact O-N 3.18Å; F334-S336 VanDerWaalsContact O-N 3.15Å; F334-F337 HydrophobicContact CD2-CD2 4.41Å; F334-F337 PolarHBondContact O-N 2.84Å; F334-K338 HydrophobicContact CD1-CD 3.83Å; F334-K338 HydrophobicContact CD1-CG 4.23Å; F334-K338 HydrophobicContact CE1-CD 3.62Å; F334-K338 HydrophobicContact CE1-CG 3.85Å; F334-K338 PolarHBondContact O-N 3.06Å
335	E	96.1	Very high	95.2	Very high	51 Å²	51	37.4 Å²	37.4	24%	0.238	20%	0.197	C	C	.	.	H	α-helix	trans	-62.7	-24.3	179.8	-166.3	59.6	-150	0	0	112.1	N333 F337 K338 R339	N333-E335 PolarHBondContact O-N 3.44Å; N333-E335 VanDerWaalsContact OD1-CB 3.31Å; N333-E335 WeakPolarHBondContact OD1-CB 3.45Å; N333-E335 PolarHBondContact OD1-N 3.4Å; E335-F337 VanDerWaalsContact C-N 3.32Å; E335-F337 PolarHBondContact O-N 2.68Å; E335-K338 PolarHBondContact O-N 3.02Å; E335-K338 IonicContact OE1-NZ 2.73Å; E335-K338 WeakPolarHBondContact OE2-CD 3.32Å; E335-K338 VanDerWaalsContact OE2-CE 3.32Å; E335-K338 WeakPolarHBondContact OE2-CE 3.25Å; E335-K338 IonicContact OE2-NZ 3.83Å; E335-K338 PolarHBondContact OE2-NZ 3.32Å; E335-R339 HydrophobicContact CG-CG 4.44Å; E335-R339 WeakPolarHBondContact O-CB 3.38Å; E335-R339 WeakPolarHBondContact O-CD 3.4Å; E335-R339 VanDerWaalsContact O-CG 3.23Å; E335-R339 WeakPolarHBondContact O-CG 3.24Å; E335-R339 PolarHBondContact O-N 2.8Å
336	S	95.6	Very high	95.3	Very high	12 Å²	12	37.4 Å²	37.4	8%	0.084	20%	0.197	C	C	.	.	H	α-helix	trans	-58.9	-42.5	173	-54.4	0	0	0	0	111.8	N330 N333 F334 R339 A340	N330-S336 WeakPolarHBondContact O-CB 3.15Å; N330-S336 PolarHBondContact O-OG 3.4Å; N333-S336 WeakPolarHBondContact O-CB 3.25Å; N333-S336 PolarHBondContact O-N 3.14Å; N333-S336 PolarHBondContact O-OG 3.08Å; N333-S336 VanDerWaalsContact O-OG 3.1Å; F334-S336 PolarHBondContact O-N 3.18Å; F334-S336 VanDerWaalsContact O-N 3.15Å; S336-R339 PolarHBondContact O-N 2.88Å; S336-A340 PolarHBondContact O-N 3.41Å
337	F	96.4	Very high	95.5	Very high	2 Å²	2	34.4 Å²	34.4	1%	0.009	18%	0.181	C	C	.	.	H	α-helix	trans	-70.8	-39.7	179.6	-58.3	-75.3	0	0	0	111.8	A271 R273 V297 I306 I308 M331 F334 E335 R339 A340 D341	A271-F337 HydrophobicContact CB-CB 3.42Å; A271-F337 VanDerWaalsContact CB-CB 3.42Å; R273-F337 HydrophobicContact CG-CD1 4.15Å; V297-F337 HydrophobicContact CG2-CB 4.44Å; V297-F337 HydrophobicContact CG2-CD2 4.46Å; V297-F337 HydrophobicContact CG2-CG 4.26Å; I306-F337 HydrophobicContact CD1-CD2 4.14Å; I306-F337 HydrophobicContact CD1-CE2 3.66Å; I308-F337 HydrophobicContact CD1-CD2 4.32Å; I308-F337 HydrophobicContact CD1-CE1 4.21Å; I308-F337 HydrophobicContact CD1-CE2 3.37Å; I308-F337 HydrophobicContact CD1-CZ 3.3Å; M331-F337 HydrophobicContact CE-CE1 3.96Å; M331-F337 HydrophobicContact CE-CZ 3.49Å; M331-F337 VanDerWaalsContact CE-CZ 3.49Å; M331-F337 HydrophobicContact SD-CE1 3.95Å; M331-F337 HydrophobicContact SD-CZ 3.59Å; M331-F337 VanDerWaalsContact SD-CZ 3.59Å; F334-F337 HydrophobicContact CD2-CD2 4.41Å; F334-F337 PolarHBondContact O-N 2.84Å; E335-F337 VanDerWaalsContact C-N 3.32Å; E335-F337 PolarHBondContact O-N 2.68Å; F337-R339 VanDerWaalsContact C-N 3.31Å; F337-R339 PolarHBondContact O-N 3.49Å; F337-A340 PolarHBondContact O-N 3.17Å; F337-D341 PolarHBondContact O-N 3.28Å
338	K	98.4	Very high	95.8	Very high	38 Å²	38	30.1 Å²	30.1	17%	0.165	16%	0.161	C	C	.	.	H	α-helix	trans	-59.1	-44.5	173.6	-69.9	172.7	58.8	-167.6	0	111	H258 A271 F334 E335 A340 D341 I342	H258-K338 HydrophobicContact CB-CD 4.45Å; H258-K338 PolarHBondContact CE1-O 3.11Å; A271-K338 HydrophobicContact CB-CG 4.43Å; F334-K338 HydrophobicContact CD1-CD 3.83Å; F334-K338 HydrophobicContact CD1-CG 4.23Å; F334-K338 HydrophobicContact CE1-CD 3.62Å; F334-K338 HydrophobicContact CE1-CG 3.85Å; F334-K338 PolarHBondContact O-N 3.06Å; E335-K338 PolarHBondContact O-N 3.02Å; E335-K338 IonicContact OE1-NZ 2.73Å; E335-K338 WeakPolarHBondContact OE2-CD 3.32Å; E335-K338 VanDerWaalsContact OE2-CE 3.32Å; E335-K338 WeakPolarHBondContact OE2-CE 3.25Å; E335-K338 IonicContact OE2-NZ 3.83Å; E335-K338 PolarHBondContact OE2-NZ 3.32Å; K338-A340 VanDerWaalsContact C-N 3.32Å; K338-A340 PolarHBondContact O-N 2.99Å; K338-D341 WeakPolarHBondContact O-CB 3.43Å; K338-D341 PolarHBondContact O-N 3.18Å; K338-I342 WeakPolarHBondContact O-CG1 3.34Å; K338-I342 PolarHBondContact O-N 3.36Å; K338-I342 VanDerWaalsContact O-N 3.14Å
339	R	98.6	Very high	96	Very high	68 Å²	68	26.3 Å²	26.3	26%	0.257	13%	0.134	S	C	.	.	H	α-helix	trans	-65.6	-33.3	177.6	-69.6	161.6	175.4	177.8	3.4	112.7	E335 S336 F337 I342 Y343 A420 R423	E335-R339 HydrophobicContact CG-CG 4.44Å; E335-R339 WeakPolarHBondContact O-CB 3.38Å; E335-R339 WeakPolarHBondContact O-CD 3.4Å; E335-R339 VanDerWaalsContact O-CG 3.23Å; E335-R339 WeakPolarHBondContact O-CG 3.24Å; E335-R339 PolarHBondContact O-N 2.8Å; S336-R339 PolarHBondContact O-N 2.88Å; F337-R339 VanDerWaalsContact C-N 3.31Å; F337-R339 PolarHBondContact O-N 3.49Å; R339-I342 PolarHBondContact O-N 3.15Å; R339-Y343 PolarHBondContact O-N 3.44Å; R339-A420 HydrophobicContact CB-CB 3.94Å; R339-A420 VanDerWaalsContact CD-O 3.23Å; R339-A420 WeakPolarHBondContact CD-O 3.41Å; R339-A420 HydrophobicContact CG-CB 4.49Å; R339-A420 WeakPolarHBondContact CG-O 3.33Å; R339-R423 VanDerWaalsContact C-NH1 3.34Å; R339-R423 WeakPolarHBondContact O-CD 3.38Å; R339-R423 PolarHBondContact O-NH1 3.27Å
340	A	98.4	Very high	96.3	Very high	11 Å²	11	25.7 Å²	25.7	9%	0.091	13%	0.13	C	C	.	.	H	α-helix	trans	-67.6	-38.3	173.7	0	0	0	0	0	112.2	A321 I324 S336 F337 K338 I342 Y343 S344	A321-A340 HydrophobicContact CB-CB 3.99Å; I324-A340 HydrophobicContact CD1-CB 4.41Å; I324-A340 HydrophobicContact CG1-CB 4.17Å; S336-A340 PolarHBondContact O-N 3.41Å; F337-A340 PolarHBondContact O-N 3.17Å; K338-A340 VanDerWaalsContact C-N 3.32Å; K338-A340 PolarHBondContact O-N 2.99Å; A340-I342 VanDerWaalsContact C-N 3.29Å; A340-I342 PolarHBondContact O-N 3.09Å; A340-Y343 WeakPolarHBondContact O-CB 3.3Å; A340-Y343 PolarHBondContact O-N 3.01Å; A340-S344 PolarHBondContact O-N 2.82Å; A340-S344 VanDerWaalsContact O-N 3.16Å; A340-S344 PolarHBondContact O-OG 3.07Å; A340-S344 VanDerWaalsContact O-OG 3.05Å
341	D	98.8	Very high	96.7	Very high	1 Å²	1	21.6 Å²	21.6	1%	0.005	11%	0.108	C	C	.	.	H	α-helix	trans	-62.1	-37.8	172.4	-70.1	-22.2	0	0	0	111.8	L254 H258 A271 H272 R273 F337 K338 Y343 S344 L345	L254-D341 HydrophobicContact CD1-CB 4.09Å; L254-D341 HydrophobicContact CD2-CB 4.25Å; H258-D341 IonicContact CD2-OD2 3.5Å; H258-D341 IonicContact CE1-OD2 2.7Å; H258-D341 IonicContact NE2-OD2 3.25Å; H258-D341 PolarHBondContact NE2-OD2 3.03Å; A271-D341 WeakPolarHBondContact CA-OD2 3.48Å; H272-D341 PolarHBondContact N-OD1 3.05Å; H272-D341 PolarHBondContact N-OD2 3.34Å; R273-D341 PolarHBondContact N-OD1 3.14Å; F337-D341 PolarHBondContact O-N 3.28Å; K338-D341 WeakPolarHBondContact O-CB 3.43Å; K338-D341 PolarHBondContact O-N 3.18Å; D341-Y343 PolarHBondContact O-N 3.48Å; D341-S344 WeakPolarHBondContact O-CB 3.35Å; D341-S344 PolarHBondContact O-N 3.46Å; D341-L345 PolarHBondContact O-N 3.27Å
342	I	98.9	Very high	97.3	Very high	2 Å²	2	19.4 Å²	19.4	1%	0.01	10%	0.098	C	C	.	.	H	α-helix	trans	-64.7	-40.2	177.9	-62.4	-64.7	0	0	0	111.8	L254 K338 R339 A340 S344 L345 G346 C415 R423 L424 A426	L254-I342 HydrophobicContact CD2-CD1 4.04Å; K338-I342 WeakPolarHBondContact O-CG1 3.34Å; K338-I342 PolarHBondContact O-N 3.36Å; K338-I342 VanDerWaalsContact O-N 3.14Å; R339-I342 PolarHBondContact O-N 3.15Å; A340-I342 VanDerWaalsContact C-N 3.29Å; A340-I342 PolarHBondContact O-N 3.09Å; I342-S344 VanDerWaalsContact C-N 3.28Å; I342-S344 PolarHBondContact O-N 3.05Å; I342-L345 HydrophobicContact CD1-CD2 4.48Å; I342-L345 WeakPolarHBondContact O-CB 3.44Å; I342-L345 PolarHBondContact O-N 3.18Å; I342-G346 PolarHBondContact O-N 2.83Å; I342-C415 HydrophobicContact CG2-CB 3.88Å; I342-C415 WeakPolarHBondContact O-CB 3.31Å; I342-R423 HydrophobicContact CG2-CB 4.08Å; I342-L424 WeakPolarHBondContact CG1-O 3.33Å; I342-L424 WeakPolarHBondContact CG2-O 3.23Å; I342-A426 HydrophobicContact CD1-CB 3.8Å; I342-A426 VanDerWaalsContact CD1-N 3.26Å
343	Y	98.9	Very high	97.8	Very high	0 Å²	0	12.9 Å²	12.9	0%	0	6%	0.063	C	C	.	.	H	α-helix	trans	-57.1	-47.4	172.6	170.9	-85.7	0	0	0	110.7	Y319 M320 A321 P322 R339 A340 D341 L345 G346 L347 Y369 V386 C415 W416	Y319-Y343 WeakPolarHBondContact O-CD1 3.34Å; Y319-Y343 WeakPolarHBondContact O-CE1 3.32Å; M320-Y343 VanDerWaalsContact O-CE1 3.23Å; M320-Y343 WeakPolarHBondContact O-CE1 3.41Å; A321-Y343 VanDerWaalsContact CA-CD1 3.44Å; A321-Y343 HydrophobicContact CB-CD1 3.77Å; A321-Y343 HydrophobicContact CB-CD2 4.41Å; A321-Y343 HydrophobicContact CB-CE1 4.45Å; A321-Y343 HydrophobicContact CB-CG 3.75Å; P322-Y343 HydrophobicContact CG-CE2 4.25Å; R339-Y343 PolarHBondContact O-N 3.44Å; A340-Y343 WeakPolarHBondContact O-CB 3.3Å; A340-Y343 PolarHBondContact O-N 3.01Å; D341-Y343 PolarHBondContact O-N 3.48Å; Y343-L345 VanDerWaalsContact C-N 3.35Å; Y343-L345 PolarHBondContact O-N 3.39Å; Y343-G346 PolarHBondContact O-N 3.35Å; Y343-L347 HydrophobicContact CD1-CD1 4.19Å; Y343-L347 HydrophobicContact CE1-CD1 3.55Å; Y343-L347 HydrophobicContact CE1-CG 4.26Å; Y343-L347 PolarHBondContact O-N 3.45Å; Y343-Y369 PolarHBondContact OH-OH 3.03Å; Y343-V386 WeakPolarHBondContact OH-CG1 3.49Å; Y343-C415 WeakPolarHBondContact CA-O 3.47Å; Y343-W416 HydrophobicContact CD2-CB 3.71Å; Y343-W416 HydrophobicContact CE2-CB 3.83Å
344	S	98.9	Very high	98.1	Very high	9 Å²	9	11 Å²	11	6%	0.063	5%	0.051	C	C	.	.	H	α-helix	trans	-63.2	-39.5	178.9	-51	0	0	0	0	112.2	L275 Y319 A340 D341 I342 G346 L347 V348	L275-S344 WeakPolarHBondContact O-CB 3.22Å; Y319-S344 PolarHBondContact O-OG 2.65Å; Y319-S344 VanDerWaalsContact O-OG 3.09Å; A340-S344 PolarHBondContact O-N 2.82Å; A340-S344 VanDerWaalsContact O-N 3.16Å; A340-S344 PolarHBondContact O-OG 3.07Å; A340-S344 VanDerWaalsContact O-OG 3.05Å; D341-S344 WeakPolarHBondContact O-CB 3.35Å; D341-S344 PolarHBondContact O-N 3.46Å; I342-S344 VanDerWaalsContact C-N 3.28Å; I342-S344 PolarHBondContact O-N 3.05Å; S344-G346 VanDerWaalsContact C-N 3.31Å; S344-G346 PolarHBondContact O-N 3.36Å; S344-L347 WeakPolarHBondContact O-CB 3.43Å; S344-L347 PolarHBondContact O-N 3.46Å; S344-L347 VanDerWaalsContact O-N 3.15Å; S344-V348 PolarHBondContact O-N 3.44Å; S344-V348 VanDerWaalsContact O-N 3.09Å
345	L	98.9	Very high	98.3	Very high	0 Å²	0	11.4 Å²	11.4	0%	0	5%	0.052	C	C	.	.	H	α-helix	trans	-59.6	-41.4	174.5	-178.2	68.7	0	0	0	111.6	V250 L254 L275 D341 I342 Y343 L347 V348 F349 V429	V250-L345 HydrophobicContact CB-CD1 4.44Å; V250-L345 HydrophobicContact CG1-CD1 3.52Å; L254-L345 HydrophobicContact CD2-CB 4.18Å; L254-L345 HydrophobicContact CD2-CD2 3.92Å; L254-L345 HydrophobicContact CD2-CG 4.44Å; L275-L345 HydrophobicContact CD2-CB 3.87Å; L275-L345 HydrophobicContact CD2-CD1 4.13Å; D341-L345 PolarHBondContact O-N 3.27Å; I342-L345 HydrophobicContact CD1-CD2 4.48Å; I342-L345 WeakPolarHBondContact O-CB 3.44Å; I342-L345 PolarHBondContact O-N 3.18Å; Y343-L345 VanDerWaalsContact C-N 3.35Å; Y343-L345 PolarHBondContact O-N 3.39Å; L345-L347 VanDerWaalsContact C-N 3.26Å; L345-L347 PolarHBondContact O-N 3.39Å; L345-V348 PolarHBondContact O-N 3.18Å; L345-F349 HydrophobicContact CD1-CD1 4.04Å; L345-F349 HydrophobicContact CD1-CE1 3.56Å; L345-F349 HydrophobicContact CD1-CZ 3.96Å; L345-F349 HydrophobicContact CD2-CE2 4.46Å; L345-F349 HydrophobicContact CD2-CZ 4.2Å; L345-F349 HydrophobicContact CG-CD1 4.32Å; L345-F349 HydrophobicContact CG-CE1 4.04Å; L345-F349 HydrophobicContact CG-CE2 4.39Å; L345-F349 HydrophobicContact CG-CZ 4.08Å; L345-F349 WeakPolarHBondContact O-CG 3.33Å; L345-F349 PolarHBondContact O-N 3.04Å; L345-V429 HydrophobicContact CD2-CB 4.48Å; L345-V429 HydrophobicContact CD2-CG1 4.03Å; L345-V429 HydrophobicContact CD2-CG2 4.49Å
346	G	98.9	Very high	98.4	Very high	0 Å²	0	9.1 Å²	9.1	0%	0	4%	0.042	C	C	.	.	H	α-helix	trans	-58.9	-37.9	175.9	0	0	0	0	0	112.7	I342 Y343 S344 F349 W350	I342-G346 PolarHBondContact O-N 2.83Å; Y343-G346 PolarHBondContact O-N 3.35Å; S344-G346 VanDerWaalsContact C-N 3.31Å; S344-G346 PolarHBondContact O-N 3.36Å; G346-F349 PolarHBondContact O-N 3.44Å; G346-W350 PolarHBondContact O-N 3.19Å; G346-W350 VanDerWaalsContact O-N 3.13Å
347	L	98.9	Very high	98.4	Very high	0 Å²	0	10 Å²	10	0%	0	5%	0.048	C	C	.	.	H	α-helix	trans	-69.2	-42.1	175.6	-59.4	177.7	0	0	0	112	Y319 Y343 S344 L345 F349 W350 E351 P368 Y369 P393 W416	Y319-L347 HydrophobicContact CD1-CB 3.98Å; Y319-L347 HydrophobicContact CD1-CD1 3.96Å; Y319-L347 HydrophobicContact CE1-CB 4.15Å; Y319-L347 HydrophobicContact CG-CD1 4.4Å; Y343-L347 HydrophobicContact CD1-CD1 4.19Å; Y343-L347 HydrophobicContact CE1-CD1 3.55Å; Y343-L347 HydrophobicContact CE1-CG 4.26Å; Y343-L347 PolarHBondContact O-N 3.45Å; S344-L347 WeakPolarHBondContact O-CB 3.43Å; S344-L347 PolarHBondContact O-N 3.46Å; S344-L347 VanDerWaalsContact O-N 3.15Å; L345-L347 VanDerWaalsContact C-N 3.26Å; L345-L347 PolarHBondContact O-N 3.39Å; L347-F349 VanDerWaalsContact C-N 3.3Å; L347-F349 PolarHBondContact O-N 3.18Å; L347-W350 WeakPolarHBondContact O-CB 3.38Å; L347-W350 PolarHBondContact O-N 2.91Å; L347-W350 VanDerWaalsContact O-N 3.14Å; L347-E351 PolarHBondContact O-N 3.32Å; L347-E351 VanDerWaalsContact O-N 3.13Å; L347-P368 HydrophobicContact CB-CB 4.14Å; L347-P368 HydrophobicContact CB-CG 3.81Å; L347-P368 HydrophobicContact CD1-CB 4.46Å; L347-P368 HydrophobicContact CD2-CB 4.03Å; L347-P368 HydrophobicContact CG-CB 4.44Å; L347-Y369 HydrophobicContact CD1-CE2 4.05Å; L347-Y369 HydrophobicContact CD2-CE2 3.77Å; L347-P393 HydrophobicContact CD2-CG 3.84Å; L347-W416 HydrophobicContact CD2-CE3 3.8Å; L347-W416 HydrophobicContact CD2-CZ3 4.18Å
348	V	98.9	Very high	98.2	Very high	1 Å²	1	11.6 Å²	11.6	1%	0.006	6%	0.058	C	C	.	.	H	α-helix	trans	-62.2	-39.2	175.1	174.5	0	0	0	0	111.4	L229 Y319 S344 L345 W350 E351 L352	L229-V348 HydrophobicContact CD2-CG1 3.73Å; Y319-V348 HydrophobicContact CE1-CG2 4.27Å; S344-V348 PolarHBondContact O-N 3.44Å; S344-V348 VanDerWaalsContact O-N 3.09Å; L345-V348 PolarHBondContact O-N 3.18Å; V348-W350 VanDerWaalsContact C-N 3.29Å; V348-W350 PolarHBondContact O-N 3.16Å; V348-E351 WeakPolarHBondContact CA-OE1 3.3Å; V348-E351 PolarHBondContact O-N 3.21Å; V348-L352 PolarHBondContact O-N 3.36Å; V348-L352 VanDerWaalsContact O-N 3.07Å
349	F	98.9	Very high	97.7	Very high	1 Å²	1	21.4 Å²	21.4	0%	0.004	9%	0.094	C	C	.	.	H	α-helix	trans	-64.7	-34.7	175.5	-79.7	9.5	0	0	0	112.4	A247 A251 L345 G346 L347 L352 A353 M408 M412 V429 V433	A247-F349 HydrophobicContact CB-CD1 4.4Å; A247-F349 HydrophobicContact CB-CE1 3.85Å; A247-F349 HydrophobicContact CB-CE2 4.41Å; A247-F349 HydrophobicContact CB-CZ 3.85Å; A247-F349 WeakPolarHBondContact O-CZ 3.17Å; A251-F349 HydrophobicContact CB-CZ 4.25Å; L345-F349 HydrophobicContact CD1-CD1 4.04Å; L345-F349 HydrophobicContact CD1-CE1 3.56Å; L345-F349 HydrophobicContact CD1-CZ 3.96Å; L345-F349 HydrophobicContact CD2-CE2 4.46Å; L345-F349 HydrophobicContact CD2-CZ 4.2Å; L345-F349 HydrophobicContact CG-CD1 4.32Å; L345-F349 HydrophobicContact CG-CE1 4.04Å; L345-F349 HydrophobicContact CG-CE2 4.39Å; L345-F349 HydrophobicContact CG-CZ 4.08Å; L345-F349 WeakPolarHBondContact O-CG 3.33Å; L345-F349 PolarHBondContact O-N 3.04Å; G346-F349 PolarHBondContact O-N 3.44Å; L347-F349 VanDerWaalsContact C-N 3.3Å; L347-F349 PolarHBondContact O-N 3.18Å; F349-L352 PolarHBondContact O-N 3.14Å; F349-A353 WeakPolarHBondContact O-CB 3.44Å; F349-A353 PolarHBondContact O-N 3.24Å; F349-M408 HydrophobicContact CB-CE 3.79Å; F349-M408 HydrophobicContact CD1-CE 4.33Å; F349-M408 HydrophobicContact CD2-CE 3.5Å; F349-M408 VanDerWaalsContact CD2-CE 3.5Å; F349-M408 HydrophobicContact CD2-SD 4.47Å; F349-M408 HydrophobicContact CE2-CE 4.06Å; F349-M408 HydrophobicContact CG-CE 3.63Å; F349-M412 VanDerWaalsContact C-CE 3.5Å; F349-M412 HydrophobicContact CB-CE 4.15Å; F349-M412 HydrophobicContact CB-CG 4.13Å; F349-M412 VanDerWaalsContact O-CE 3.26Å; F349-M412 WeakPolarHBondContact O-CE 3.44Å; F349-V429 HydrophobicContact CE2-CG1 3.54Å; F349-V429 HydrophobicContact CZ-CG1 3.97Å; F349-V433 HydrophobicContact CE2-CG2 4.3Å
350	W	98.9	Very high	97.2	Very high	3 Å²	3	20.9 Å²	20.9	1%	0.011	11%	0.109	C	C	.	.	H	α-helix	trans	-64.5	-44.4	174	-179.5	89.6	0	0	0	111.8	G346 L347 V348 L352 A353 R354 Q366 P368 Y370 P393 N394 W399 M412	G346-W350 PolarHBondContact O-N 3.19Å; G346-W350 VanDerWaalsContact O-N 3.13Å; L347-W350 WeakPolarHBondContact O-CB 3.38Å; L347-W350 PolarHBondContact O-N 2.91Å; L347-W350 VanDerWaalsContact O-N 3.14Å; V348-W350 VanDerWaalsContact C-N 3.29Å; V348-W350 PolarHBondContact O-N 3.16Å; W350-L352 VanDerWaalsContact C-N 3.31Å; W350-L352 PolarHBondContact O-N 3.01Å; W350-A353 PolarHBondContact O-N 3.5Å; W350-R354 HydrophobicContact CD2-CG 4.42Å; W350-R354 HydrophobicContact CZ2-CG 4.39Å; W350-R354 VanDerWaalsContact CZ3-CD 3.45Å; W350-R354 WeakPolarHBondContact O-CG 3.38Å; W350-R354 PolarHBondContact O-N 3.03Å; W350-Q366 HydrophobicContact CH2-CB 4.26Å; W350-Q366 HydrophobicContact CZ3-CB 4.44Å; W350-Q366 WeakPolarHBondContact CZ3-O 3.49Å; W350-P368 HydrophobicContact CE3-CG 4.41Å; W350-Y370 HydrophobicContact CH2-CD1 4.02Å; W350-Y370 HydrophobicContact CH2-CE1 4.03Å; W350-P393 HydrophobicContact CD2-CB 3.66Å; W350-P393 HydrophobicContact CD2-CG 4.41Å; W350-P393 HydrophobicContact CE3-CB 4.29Å; W350-P393 HydrophobicContact CG-CB 3.89Å; W350-P393 HydrophobicContact CH2-CB 4.4Å; W350-P393 HydrophobicContact CZ2-CB 3.79Å; W350-N394 PolarHBondContact NE1-O 2.81Å; W350-W399 AromaticContact CD1-CH2 3.79Å; W350-W399 HydrophobicContact CG-CH2 4.47Å; W350-M412 HydrophobicContact CB-CE 4.43Å; W350-M412 HydrophobicContact CB-SD 3.71Å; W350-M412 HydrophobicContact CG-SD 4.3Å
351	E	98.8	Very high	96.7	Very high	0 Å²	0	26.2 Å²	26.2	0%	0	14%	0.136	C	C	.	.	H	α-helix	trans	-57.3	-45.7	174.6	-66.1	173.7	-92.6	0	0	111.4	L233 S277 Y319 L347 V348 F365 P368	L233-E351 HydrophobicContact CD1-CB 4.17Å; S277-E351 WeakPolarHBondContact CB-OE1 3.47Å; S277-E351 VanDerWaalsContact CB-OE2 3.27Å; S277-E351 WeakPolarHBondContact CB-OE2 3.46Å; S277-E351 PolarHBondContact OG-OE1 3Å; S277-E351 PolarHBondContact OG-OE2 3.42Å; Y319-E351 WeakPolarHBondContact CE1-OE1 3.46Å; Y319-E351 VanDerWaalsContact OH-CD 3.32Å; Y319-E351 PolarHBondContact OH-OE1 2.98Å; Y319-E351 PolarHBondContact OH-OE2 2.95Å; L347-E351 PolarHBondContact O-N 3.32Å; L347-E351 VanDerWaalsContact O-N 3.13Å; V348-E351 WeakPolarHBondContact CA-OE1 3.3Å; V348-E351 PolarHBondContact O-N 3.21Å; E351-F365 HydrophobicContact CB-CE2 4.27Å; E351-P368 HydrophobicContact CG-CG 3.88Å
352	L	98.6	Very high	96.4	Very high	2 Å²	2	29.7 Å²	29.7	1%	0.01	15%	0.152	C	C	.	.	H	α-helix	trans	-64.9	-45.3	179.9	177.2	60.4	0	0	0	112.4	L233 V238 M243 L246 A247 V348 F349 W350 R354 R355 C356	L233-L352 HydrophobicContact CD1-CB 4.33Å; L233-L352 HydrophobicContact CD2-CD1 3.76Å; V238-L352 HydrophobicContact CG2-CD1 4.07Å; M243-L352 HydrophobicContact CG-CD2 4.24Å; M243-L352 HydrophobicContact CG-CG 4.03Å; L246-L352 HydrophobicContact CB-CD1 4.15Å; L246-L352 HydrophobicContact CB-CD2 3.83Å; L246-L352 HydrophobicContact CD1-CD1 3.74Å; A247-L352 HydrophobicContact CB-CD2 3.98Å; V348-L352 PolarHBondContact O-N 3.36Å; V348-L352 VanDerWaalsContact O-N 3.07Å; F349-L352 PolarHBondContact O-N 3.14Å; W350-L352 VanDerWaalsContact C-N 3.31Å; W350-L352 PolarHBondContact O-N 3.01Å; L352-R354 VanDerWaalsContact C-N 3.33Å; L352-R354 PolarHBondContact O-N 3.43Å; L352-R355 PolarHBondContact O-N 3.43Å; L352-R355 VanDerWaalsContact O-N 3.13Å; L352-C356 PolarHBondContact O-N 2.89Å
353	A	98.3	Very high	96.3	Very high	0 Å²	0	30.9 Å²	30.9	0%	0	16%	0.157	C	C	.	.	H	α-helix	trans	-65.5	-33.7	-177.3	0	0	0	0	0	113.1	M243 F349 W350 R355 C356 W399 L405 M412	M243-A353 HydrophobicContact SD-CB 4.27Å; F349-A353 WeakPolarHBondContact O-CB 3.44Å; F349-A353 PolarHBondContact O-N 3.24Å; W350-A353 PolarHBondContact O-N 3.5Å; A353-R355 PolarHBondContact O-N 2.86Å; A353-C356 WeakPolarHBondContact O-CB 3.48Å; A353-C356 PolarHBondContact O-N 3.19Å; A353-W399 HydrophobicContact CB-CE3 4.44Å; A353-W399 HydrophobicContact CB-CH2 3.47Å; A353-W399 VanDerWaalsContact CB-CH2 3.47Å; A353-W399 HydrophobicContact CB-CZ2 3.77Å; A353-W399 HydrophobicContact CB-CZ3 3.84Å; A353-L405 HydrophobicContact CB-CD2 3.86Å; A353-M412 HydrophobicContact CB-CE 3.53Å
354	R	98.1	Very high	96.2	Very high	20 Å²	20	36.4 Å²	36.4	8%	0.075	19%	0.187	C	C	.	.	H	α-helix	trans	-58.4	-31.7	173.3	-73.1	178	67.2	77.7	2.1	113.4	W350 L352 C356 E363 D364 W399	W350-R354 HydrophobicContact CD2-CG 4.42Å; W350-R354 HydrophobicContact CZ2-CG 4.39Å; W350-R354 VanDerWaalsContact CZ3-CD 3.45Å; W350-R354 WeakPolarHBondContact O-CG 3.38Å; W350-R354 PolarHBondContact O-N 3.03Å; L352-R354 VanDerWaalsContact C-N 3.33Å; L352-R354 PolarHBondContact O-N 3.43Å; R354-C356 VanDerWaalsContact C-N 3.32Å; R354-E363 WeakPolarHBondContact CA-OE2 3.46Å; R354-E363 HydrophobicContact CB-CB 4.22Å; R354-E363 HydrophobicContact CG-CB 4.48Å; R354-E363 PolarHBondContact O-N 2.68Å; R354-E363 VanDerWaalsContact O-OE2 3.04Å; R354-D364 PolarHBondContact NE-O 3.44Å; R354-D364 PolarHBondContact NH2-O 3.27Å; R354-W399 HydrophobicContact CG-CH2 4.48Å; R354-W399 HydrophobicContact CG-CZ2 3.97Å
355	R	98.3	Very high	96.2	Very high	19 Å²	19	37 Å²	37	7%	0.072	19%	0.188	C	C	.	.	T	Hydrogen-bonded Turn	trans	-90.2	-0.1	-179.5	-55.7	-54.2	-67.8	147.6	0.7	112.9	L233 Y236 T237 V238 L352 A353 S357 H362 E363 F365	L233-R355 HydrophobicContact CB-CG 3.96Å; L233-R355 HydrophobicContact CD2-CB 3.82Å; L233-R355 HydrophobicContact CD2-CG 3.89Å; L233-R355 HydrophobicContact CG-CG 4.37Å; L233-R355 PolarHBondContact O-NE 2.94Å; Y236-R355 PolarHBondContact O-NE 3.49Å; Y236-R355 PolarHBondContact O-NH2 3.27Å; T237-R355 CarbonylContact C-O 3.6Å; T237-R355 WeakPolarHBondContact CA-O 3.38Å; T237-R355 VanDerWaalsContact CG2-NH2 3.33Å; V238-R355 PolarHBondContact N-O 2.88Å; L352-R355 PolarHBondContact O-N 3.43Å; L352-R355 VanDerWaalsContact O-N 3.13Å; A353-R355 PolarHBondContact O-N 2.86Å; R355-S357 PolarHBondContact O-N 3.35Å; R355-H362 PolarHBondContact NH1-CD2 3.43Å; R355-E363 PolarHBondContact NH1-O 2.7Å; R355-F365 HydrophobicContact CG-CD2 4.38Å
356	C	97.6	Very high	96.1	Very high	2 Å²	2	40 Å²	40	1%	0.014	20%	0.202	C	C	.	.	B	Isolated β-bridge	trans	-72.8	109.2	174.3	-172.7	0	0	0	0	109.7	V238 M243 L352 A353 R354 L405	V238-C356 HydrophobicContact CG2-CB 4.39Å; V238-C356 CarbonylContact O-C 3.58Å; V238-C356 VanDerWaalsContact O-CA 3.31Å; V238-C356 WeakPolarHBondContact O-CA 3.46Å; M243-C356 HydrophobicContact CB-CB 4.37Å; M243-C356 HydrophobicContact CG-CB 4.47Å; M243-C356 HydrophobicContact SD-CB 3.71Å; L352-C356 PolarHBondContact O-N 2.89Å; A353-C356 WeakPolarHBondContact O-CB 3.48Å; A353-C356 PolarHBondContact O-N 3.19Å; R354-C356 VanDerWaalsContact C-N 3.32Å; C356-L405 HydrophobicContact CB-CD2 3.92Å
357	S	95.8	Very high	96.1	Very high	31 Å²	31	42 Å²	42	22%	0.217	21%	0.212	C	C	.	.			trans	-86	117.7	177.2	-169.3	0	0	0	0	111.1	V238 R355 G360 L361	V238-S357 PolarHBondContact O-N 3Å; R355-S357 PolarHBondContact O-N 3.35Å; S357-G360 WeakPolarHBondContact OG-CA 3.45Å; S357-L361 WeakPolarHBondContact CA-O 3.46Å
358	V	92.9	Very high	96.1	Very high	35 Å²	35	42 Å²	42	21%	0.212	21%	0.212	C	C	.	.	B	Isolated β-bridge	trans	-115.5	113.1	174.6	-177.3	0	0	0	0	107.8	V240 G360 L361 C402 L405	V240-V358 HydrophobicContact CG2-CG2 3.84Å; V358-G360 PolarHBondContact O-N 3.11Å; V358-L361 PolarHBondContact N-O 3.38Å; V358-L361 WeakPolarHBondContact O-CB 3.39Å; V358-L361 PolarHBondContact O-N 3.32Å; V358-L361 VanDerWaalsContact O-N 3.09Å; V358-C402 HydrophobicContact CG1-CB 4.49Å; V358-C402 HydrophobicContact CG2-CB 4.31Å; V358-L405 HydrophobicContact CG2-CD1 3.86Å
359	R	88.1	Confident	96.1	Very high	245 Å²	245	41.9 Å²	41.9	93%	0.925	21%	0.212	S	C	*	.	T	Hydrogen-bonded Turn	trans	55.3	37.9	-176.9	-56.8	176.6	175.8	175.4	-1.9	113	L361	R359-L361 PolarHBondContact O-N 2.89Å
360	G	86.6	Confident	96.1	Very high	56 Å²	56	46.5 Å²	46.5	58%	0.577	23%	0.23	S	C	*	.	T	Hydrogen-bonded Turn	trans	82.4	-13.1	-179.1	0	0	0	0	0	114.7	S357 V358 H362	S357-G360 WeakPolarHBondContact OG-CA 3.45Å; V358-G360 PolarHBondContact O-N 3.11Å; G360-H362 PolarHBondContact O-ND1 3.15Å
361	L	89.1	Confident	96.1	Very high	123 Å²	123	50.3 Å²	50.3	64%	0.644	25%	0.251	S	S	*	.	B	Isolated β-bridge	trans	-84.4	128.7	177.9	-59.7	173.2	0	0	0	110.5	S357 V358 R359	S357-L361 WeakPolarHBondContact CA-O 3.46Å; V358-L361 PolarHBondContact N-O 3.38Å; V358-L361 WeakPolarHBondContact O-CB 3.39Å; V358-L361 PolarHBondContact O-N 3.32Å; V358-L361 VanDerWaalsContact O-N 3.09Å; R359-L361 PolarHBondContact O-N 2.89Å
362	H	93	Very high	96	Very high	75 Å²	75	53.2 Å²	53.2	35%	0.347	27%	0.265	S	S	.	.			trans	-159	161.9	176	60.5	-89.2	0	0	0	109.6	T237 R355 G360	T237-H362 HydrophobicContact CG2-CB 4.46Å; R355-H362 PolarHBondContact NH1-CD2 3.43Å; G360-H362 PolarHBondContact O-ND1 3.15Å
363	E	96.1	Very high	96	Very high	27 Å²	27	53.8 Å²	53.8	13%	0.126	27%	0.269	C	S	.	.	P	Polyproline II helix	trans	-97.4	152.7	173.1	-57.3	92.8	156.9	0	0	111.7	R354 R355 P396 Q398 W399	R354-E363 WeakPolarHBondContact CA-OE2 3.46Å; R354-E363 HydrophobicContact CB-CB 4.22Å; R354-E363 HydrophobicContact CG-CB 4.48Å; R354-E363 PolarHBondContact O-N 2.68Å; R354-E363 VanDerWaalsContact O-OE2 3.04Å; R355-E363 PolarHBondContact NH1-O 2.7Å; E363-P396 WeakPolarHBondContact OE1-CB 3.45Å; E363-P396 VanDerWaalsContact OE1-CG 3.25Å; E363-P396 WeakPolarHBondContact OE1-CG 3.41Å; E363-Q398 PolarHBondContact OE1-NE2 3.02Å; E363-W399 PolarHBondContact OE1-NE1 3.12Å
364	D	96.9	Very high	96	Very high	115 Å²	115	57.2 Å²	57.2	62%	0.615	29%	0.291	S	S	*	.	P	Polyproline II helix	trans	-60.3	149.4	172.1	-66.2	-37.2	0	0	0	111.8	R354 Q366	R354-D364 PolarHBondContact NE-O 3.44Å; R354-D364 PolarHBondContact NH2-O 3.27Å; D364-Q366 PolarHBondContact O-N 3.23Å
365	F	98.1	Very high	95.9	Very high	22 Å²	22	61.8 Å²	61.8	10%	0.096	33%	0.326	C	S	.	.	P	Polyproline II helix	trans	-59.7	131.6	173.4	178.6	-95.4	0	0	0	110.3	Y230 L233 N234 E351 R355 L367	Y230-F365 AromaticContact CD2-CE1 3.81Å; Y230-F365 HydrophobicContact CD2-CE1 3.81Å; Y230-F365 AromaticContact CD2-CZ 3.5Å; Y230-F365 HydrophobicContact CD2-CZ 3.5Å; Y230-F365 AromaticContact CE2-CE1 3.5Å; Y230-F365 HydrophobicContact CE2-CE1 3.5Å; Y230-F365 AromaticContact CE2-CZ 3.71Å; Y230-F365 HydrophobicContact CE2-CZ 3.71Å; Y230-F365 HydrophobicContact CG-CZ 4.35Å; L233-F365 HydrophobicContact CB-CD2 3.55Å; L233-F365 HydrophobicContact CB-CE2 3.78Å; L233-F365 HydrophobicContact CD1-CE2 4.26Å; N234-F365 WeakPolarHBondContact ND2-CD1 3.33Å; N234-F365 WeakPolarHBondContact ND2-CE1 3.19Å; N234-F365 WeakPolarHBondContact OD1-CD1 3.29Å; E351-F365 HydrophobicContact CB-CE2 4.27Å; R355-F365 HydrophobicContact CG-CD2 4.38Å; F365-L367 HydrophobicContact CE1-CG 4.48Å; F365-L367 HydrophobicContact CZ-CD2 4.32Å
366	Q	98.4	Very high	95.8	Very high	64 Å²	64	67.2 Å²	67.2	30%	0.299	36%	0.356	S	S	.	.			trans	-144.9	147	174.5	-68.8	-61.5	-16.7	0	0	109	W350 D364 Y370	W350-Q366 HydrophobicContact CH2-CB 4.26Å; W350-Q366 HydrophobicContact CZ3-CB 4.44Å; W350-Q366 WeakPolarHBondContact CZ3-O 3.49Å; D364-Q366 PolarHBondContact O-N 3.23Å; Q366-Y370 HydrophobicContact CB-CD1 3.54Å; Q366-Y370 HydrophobicContact CB-CD2 4.13Å; Q366-Y370 HydrophobicContact CB-CE1 3.9Å; Q366-Y370 HydrophobicContact CB-CE2 4.42Å; Q366-Y370 HydrophobicContact CB-CG 3.68Å; Q366-Y370 HydrophobicContact CG-CD1 3.93Å; Q366-Y370 HydrophobicContact CG-CD2 3.74Å; Q366-Y370 HydrophobicContact CG-CE1 3.94Å; Q366-Y370 HydrophobicContact CG-CE2 3.72Å; Q366-Y370 HydrophobicContact CG-CG 3.85Å
367	L	98.6	Very high	95.8	Very high	40 Å²	40	67.3 Å²	67.3	21%	0.209	36%	0.357	C	S	.	.			trans	-71.1	153	168.8	-74.9	171.4	0	0	0	110.3	Y230 Y319 F365 Y369 Y370	Y230-L367 HydrophobicContact CD2-CD2 3.91Å; Y230-L367 HydrophobicContact CE2-CD1 4.33Å; Y230-L367 HydrophobicContact CE2-CD2 3.78Å; Y230-L367 HydrophobicContact CE2-CG 4.1Å; Y319-L367 WeakPolarHBondContact OH-CD2 3.36Å; F365-L367 HydrophobicContact CE1-CG 4.48Å; F365-L367 HydrophobicContact CZ-CD2 4.32Å; L367-Y369 PolarHBondContact O-N 3.15Å; L367-Y370 WeakPolarHBondContact O-CB 3.32Å; L367-Y370 PolarHBondContact O-N 3.46Å; L367-Y370 VanDerWaalsContact O-N 3.14Å
368	P	98.8	Very high	95.9	Very high	0 Å²	0	67.7 Å²	67.7	0%	0	36%	0.36	C	S	.	.	T	Hydrogen-bonded Turn	trans	-57	137.9	173.6	-20.5	31.3	0	0	0	110.3	R318 Y319 L347 W350 E351 Y370 P393	R318-P368 VanDerWaalsContact CD-O 3.22Å; R318-P368 WeakPolarHBondContact CD-O 3.38Å; R318-P368 WeakPolarHBondContact CG-O 3.34Å; R318-P368 PolarHBondContact NH1-O 2.77Å; Y319-P368 HydrophobicContact CE1-CG 3.85Å; Y319-P368 WeakPolarHBondContact OH-CD 3.46Å; L347-P368 HydrophobicContact CB-CB 4.14Å; L347-P368 HydrophobicContact CB-CG 3.81Å; L347-P368 HydrophobicContact CD1-CB 4.46Å; L347-P368 HydrophobicContact CD2-CB 4.03Å; L347-P368 HydrophobicContact CG-CB 4.44Å; W350-P368 HydrophobicContact CE3-CG 4.41Å; E351-P368 HydrophobicContact CG-CG 3.88Å; P368-Y370 PolarHBondContact O-N 3.33Å; P368-P393 HydrophobicContact CB-CG 4.05Å
369	Y	98.7	Very high	96.1	Very high	0 Å²	0	67.1 Å²	67.1	0%	0	36%	0.355	C	S	.	.	T	Hydrogen-bonded Turn	trans	65.5	17.1	-178	-49.5	-80.1	0	0	0	115.4	R318 Y343 L347 L367 D371 M372 V373 M382 V385 V386 R392 P393	R318-Y369 HydrophobicContact CG-CD2 4.49Å; Y343-Y369 PolarHBondContact OH-OH 3.03Å; L347-Y369 HydrophobicContact CD1-CE2 4.05Å; L347-Y369 HydrophobicContact CD2-CE2 3.77Å; L367-Y369 PolarHBondContact O-N 3.15Å; Y369-D371 PolarHBondContact O-N 3.3Å; Y369-D371 VanDerWaalsContact O-N 3.11Å; Y369-M372 HydrophobicContact CD1-SD 3.95Å; Y369-M372 PolarHBondContact O-N 3.32Å; Y369-V373 WeakPolarHBondContact O-CG2 3.22Å; Y369-V373 PolarHBondContact O-N 2.98Å; Y369-V373 VanDerWaalsContact O-N 3.08Å; Y369-M382 HydrophobicContact CD2-CE 3.81Å; Y369-M382 HydrophobicContact CE2-CE 4.03Å; Y369-M382 HydrophobicContact CG-CE 4.32Å; Y369-V385 HydrophobicContact CD1-CG1 3.92Å; Y369-V385 HydrophobicContact CE1-CG1 4.17Å; Y369-V386 HydrophobicContact CE1-CG2 3.9Å; Y369-V386 HydrophobicContact CE2-CG2 4.25Å; Y369-R392 WeakPolarHBondContact OH-CD 3.47Å; Y369-P393 HydrophobicContact CD1-CG 4.48Å; Y369-P393 HydrophobicContact CE1-CG 4.31Å; Y369-P393 HydrophobicContact CE2-CG 4.33Å
370	Y	98.5	Very high	96.6	Very high	97 Å²	97	61.3 Å²	61.3	38%	0.38	34%	0.339	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54.7	-28.5	178.5	78.2	-71.9	0	0	0	114	W350 Q366 L367 P368	W350-Y370 HydrophobicContact CH2-CD1 4.02Å; W350-Y370 HydrophobicContact CH2-CE1 4.03Å; Q366-Y370 HydrophobicContact CB-CD1 3.54Å; Q366-Y370 HydrophobicContact CB-CD2 4.13Å; Q366-Y370 HydrophobicContact CB-CE1 3.9Å; Q366-Y370 HydrophobicContact CB-CE2 4.42Å; Q366-Y370 HydrophobicContact CB-CG 3.68Å; Q366-Y370 HydrophobicContact CG-CD1 3.93Å; Q366-Y370 HydrophobicContact CG-CD2 3.74Å; Q366-Y370 HydrophobicContact CG-CE1 3.94Å; Q366-Y370 HydrophobicContact CG-CE2 3.72Å; Q366-Y370 HydrophobicContact CG-CG 3.85Å; L367-Y370 WeakPolarHBondContact O-CB 3.32Å; L367-Y370 PolarHBondContact O-N 3.46Å; L367-Y370 VanDerWaalsContact O-N 3.14Å; P368-Y370 PolarHBondContact O-N 3.33Å
371	D	98.1	Very high	97.1	Very high	84 Å²	84	61.5 Å²	61.5	45%	0.449	33%	0.327	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.5	-3.4	-178.6	56.4	-23.7	0	0	0	113.6	Y369	Y369-D371 PolarHBondContact O-N 3.3Å; Y369-D371 VanDerWaalsContact O-N 3.11Å
372	M	98.4	Very high	97.6	Very high	60 Å²	60	55.7 Å²	55.7	30%	0.296	30%	0.296	S	S	.	.	T	Hydrogen-bonded Turn	trans	-125.5	-23.9	-172.6	-58.1	176.8	-164	0	0	113.8	Y369 V385 L391	Y369-M372 HydrophobicContact CD1-SD 3.95Å; Y369-M372 PolarHBondContact O-N 3.32Å; M372-V385 HydrophobicContact CB-CG1 3.99Å; M372-V385 HydrophobicContact CB-CG2 4.18Å; M372-V385 HydrophobicContact CG-CG1 4.45Å; M372-V385 HydrophobicContact SD-CG1 3.7Å; M372-L391 HydrophobicContact SD-CB 3.88Å; M372-L391 HydrophobicContact SD-CD1 3.98Å
373	V	98.5	Very high	97.8	Very high	14 Å²	14	56 Å²	56	9%	0.085	30%	0.296	C	S	.	.	S	Bend	trans	-139.4	153.6	-176.2	-55	0	0	0	0	111.4	Y369 P377 D381 M382 V385	Y369-V373 WeakPolarHBondContact O-CG2 3.22Å; Y369-V373 PolarHBondContact O-N 2.98Å; Y369-V373 VanDerWaalsContact O-N 3.08Å; V373-P377 HydrophobicContact CB-CB 3.93Å; V373-P377 HydrophobicContact CG2-CB 3.84Å; V373-P377 HydrophobicContact CG2-CG 4.03Å; V373-D381 HydrophobicContact CG1-CB 4.39Å; V373-M382 HydrophobicContact CB-SD 4.39Å; V373-M382 HydrophobicContact CG1-SD 4.01Å; V373-M382 HydrophobicContact CG2-SD 3.86Å; V373-V385 HydrophobicContact CG1-CB 4.31Å; V373-V385 HydrophobicContact CG1-CG2 3.71Å
374	P	97.9	Very high	98	Very high	73 Å²	73	60.5 Å²	60.5	47%	0.474	32%	0.316	S	S	.	.			trans	-64.3	168.8	178.1	28.4	-36.4	0	0	0	112.2	R318 D376 P377	R318-P374 PolarHBondContact NH2-O 3.48Å; P374-D376 PolarHBondContact O-N 2.96Å; P374-P377 HydrophobicContact CG-CB 4.46Å; P374-P377 WeakPolarHBondContact O-CD 3.34Å
375	S	95.6	Very high	98	Very high	116 Å²	116	55.5 Å²	55.5	81%	0.811	29%	0.289	S	S	*	.	S	Bend	trans	-57.1	-43.3	-174.2	-54.7	0	0	0	0	114.1	R318 P377	R318-S375 PolarHBondContact NH2-O 2.85Å; S375-P377 WeakPolarHBondContact O-CD 3.47Å
376	D	95.8	Very high	98.1	Very high	132 Å²	132	54.5 Å²	54.5	71%	0.706	29%	0.285	S	S	*	.	S	Bend	trans	-112.3	84.3	169.4	-176.8	26.4	0	0	0	109.4	K317 P374	K317-D376 IonicContact NZ-OD1 3.8Å; P374-D376 PolarHBondContact O-N 2.96Å
377	P	97.9	Very high	98.1	Very high	4 Å²	4	52.3 Å²	52.3	3%	0.026	28%	0.276	C	S	.	.			trans	-71.2	150.8	-175.1	31.7	-35	0	0	0	110.9	K317 R318 V373 P374 S375 D381 M382	K317-P377 VanDerWaalsContact CD-O 3.28Å; K317-P377 WeakPolarHBondContact CD-O 3.17Å; R318-P377 HydrophobicContact CB-CG 4.2Å; V373-P377 HydrophobicContact CB-CB 3.93Å; V373-P377 HydrophobicContact CG2-CB 3.84Å; V373-P377 HydrophobicContact CG2-CG 4.03Å; P374-P377 HydrophobicContact CG-CB 4.46Å; P374-P377 WeakPolarHBondContact O-CD 3.34Å; S375-P377 WeakPolarHBondContact O-CD 3.47Å; P377-D381 HydrophobicContact CB-CB 4.07Å; P377-M382 HydrophobicContact CB-CG 3.98Å; P377-M382 HydrophobicContact CB-SD 4.01Å; P377-M382 HydrophobicContact CG-CG 3.93Å; P377-M382 HydrophobicContact CG-SD 3.8Å
378	S	98.1	Very high	98	Very high	40 Å²	40	55.6 Å²	55.6	28%	0.28	29%	0.294	S	S	.	.			trans	-75.5	172.5	167.3	66.2	0	0	0	0	111.3	E380 D381 M382	S378-E380 PolarHBondContact OG-N 3.19Å; S378-D381 WeakPolarHBondContact CB-OD2 3.36Å; S378-D381 PolarHBondContact N-OD2 2.85Å; S378-D381 PolarHBondContact OG-N 2.76Å; S378-D381 PolarHBondContact OG-OD2 3.38Å; S378-M382 PolarHBondContact O-N 3.21Å
379	I	97.1	Very high	98	Very high	23 Å²	23	60.4 Å²	60.4	12%	0.118	32%	0.316	C	S	.	.	H	α-helix	trans	-65	-37.8	172.4	-65.3	-66	0	0	0	109.6	K317 M320 L325 M382 K383	K317-I379 HydrophobicContact CB-CD1 4.03Å; K317-I379 HydrophobicContact CD-CD1 3.8Å; K317-I379 HydrophobicContact CD-CG1 3.99Å; K317-I379 HydrophobicContact CG-CD1 3.66Å; K317-I379 HydrophobicContact CG-CG1 4.41Å; M320-I379 HydrophobicContact CE-CD1 4.1Å; M320-I379 HydrophobicContact SD-CD1 3.48Å; M320-I379 WeakPolarHBondContact SD-CD1 3.33Å; L325-I379 HydrophobicContact CD2-CD1 4.29Å; L325-I379 HydrophobicContact CD2-CG2 4.23Å; I379-M382 PolarHBondContact O-N 2.72Å; I379-K383 VanDerWaalsContact O-CB 3.27Å; I379-K383 WeakPolarHBondContact O-CB 3.37Å; I379-K383 PolarHBondContact O-N 2.66Å
380	E	97.8	Very high	98	Very high	123 Å²	123	67.6 Å²	67.6	58%	0.575	35%	0.348	S	S	*	.	H	α-helix	trans	-65.1	-41.9	-179.6	-69.8	65	-146.5	0	0	111.6	S378 M382 K383 K384	S378-E380 PolarHBondContact OG-N 3.19Å; E380-M382 PolarHBondContact O-N 2.93Å; E380-K383 PolarHBondContact O-N 3.36Å; E380-K384 WeakPolarHBondContact O-CB 3.27Å; E380-K384 PolarHBondContact O-N 3.19Å
381	D	98.4	Very high	98	Very high	60 Å²	60	66.3 Å²	66.3	32%	0.321	35%	0.347	S	S	.	.	H	α-helix	trans	-58.9	-48.7	174.5	-63.5	-43	0	0	0	111	V373 P377 S378 K384 V385	V373-D381 HydrophobicContact CG1-CB 4.39Å; P377-D381 HydrophobicContact CB-CB 4.07Å; S378-D381 WeakPolarHBondContact CB-OD2 3.36Å; S378-D381 PolarHBondContact N-OD2 2.85Å; S378-D381 PolarHBondContact OG-N 2.76Å; S378-D381 PolarHBondContact OG-OD2 3.38Å; D381-K384 PolarHBondContact O-N 2.56Å; D381-V385 PolarHBondContact O-N 2.99Å
382	M	98.6	Very high	98	Very high	0 Å²	0	64.1 Å²	64.1	0%	0	33%	0.333	C	S	.	.	H	α-helix	trans	-66.5	-43.4	-180	-69.9	-56.4	-53.7	0	0	111.8	K317 R318 L325 Y369 V373 P377 S378 I379 E380 K384 V385 V386	K317-M382 HydrophobicContact CB-CG 4.45Å; R318-M382 WeakPolarHBondContact O-CE 3.39Å; L325-M382 HydrophobicContact CD1-CB 3.95Å; L325-M382 HydrophobicContact CD2-CB 3.64Å; L325-M382 HydrophobicContact CG-CB 4.47Å; Y369-M382 HydrophobicContact CD2-CE 3.81Å; Y369-M382 HydrophobicContact CE2-CE 4.03Å; Y369-M382 HydrophobicContact CG-CE 4.32Å; V373-M382 HydrophobicContact CB-SD 4.39Å; V373-M382 HydrophobicContact CG1-SD 4.01Å; V373-M382 HydrophobicContact CG2-SD 3.86Å; P377-M382 HydrophobicContact CB-CG 3.98Å; P377-M382 HydrophobicContact CB-SD 4.01Å; P377-M382 HydrophobicContact CG-CG 3.93Å; P377-M382 HydrophobicContact CG-SD 3.8Å; S378-M382 PolarHBondContact O-N 3.21Å; I379-M382 PolarHBondContact O-N 2.72Å; E380-M382 PolarHBondContact O-N 2.93Å; M382-K384 VanDerWaalsContact C-N 3.34Å; M382-K384 PolarHBondContact O-N 3.45Å; M382-V385 PolarHBondContact O-N 3.45Å; M382-V386 HydrophobicContact CE-CG2 3.71Å; M382-V386 WeakPolarHBondContact O-CB 3.41Å; M382-V386 WeakPolarHBondContact O-CG2 3.16Å; M382-V386 PolarHBondContact O-N 2.82Å
383	K	98.3	Very high	98	Very high	82 Å²	82	61.4 Å²	61.4	36%	0.357	32%	0.32	S	S	.	.	H	α-helix	trans	-59.8	-44.5	177.6	-176.8	177.3	177.8	175.4	0	111.3	L325 I379 E380 V385 C387 D388	L325-K383 HydrophobicContact CB-CB 4.39Å; I379-K383 VanDerWaalsContact O-CB 3.27Å; I379-K383 WeakPolarHBondContact O-CB 3.37Å; I379-K383 PolarHBondContact O-N 2.66Å; E380-K383 PolarHBondContact O-N 3.36Å; K383-V385 PolarHBondContact O-N 2.96Å; K383-C387 HydrophobicContact CG-CB 4.1Å; K383-C387 WeakPolarHBondContact O-CA 3.22Å; K383-C387 VanDerWaalsContact O-CB 3.22Å; K383-C387 WeakPolarHBondContact O-CB 3.37Å; K383-C387 PolarHBondContact O-N 3.07Å; K383-D388 PolarHBondContact O-N 3.42Å; K383-D388 VanDerWaalsContact O-N 3.12Å
384	K	98.6	Very high	98	Very high	122 Å²	122	65.8 Å²	65.8	53%	0.53	34%	0.342	S	S	.	.	I	π-helix	trans	-57.5	-47.2	177.2	-176.7	179.9	178.2	-177.8	0	112	E380 D381 M382 D388 Q389	E380-K384 WeakPolarHBondContact O-CB 3.27Å; E380-K384 PolarHBondContact O-N 3.19Å; D381-K384 PolarHBondContact O-N 2.56Å; M382-K384 VanDerWaalsContact C-N 3.34Å; M382-K384 PolarHBondContact O-N 3.45Å; K384-D388 WeakPolarHBondContact CA-OD2 3.38Å; K384-D388 WeakPolarHBondContact O-CB 3.39Å; K384-Q389 WeakPolarHBondContact O-CB 3.11Å; K384-Q389 WeakPolarHBondContact O-CG 3.48Å; K384-Q389 PolarHBondContact O-N 3.31Å
385	V	98.7	Very high	97.9	Very high	9 Å²	9	63.3 Å²	63.3	6%	0.055	33%	0.325	C	S	.	.	I	π-helix	trans	-74.9	-46.8	-177.8	173.5	0	0	0	0	111.8	Y369 M372 V373 D381 M382 K383 K390 L391	Y369-V385 HydrophobicContact CD1-CG1 3.92Å; Y369-V385 HydrophobicContact CE1-CG1 4.17Å; M372-V385 HydrophobicContact CB-CG1 3.99Å; M372-V385 HydrophobicContact CB-CG2 4.18Å; M372-V385 HydrophobicContact CG-CG1 4.45Å; M372-V385 HydrophobicContact SD-CG1 3.7Å; V373-V385 HydrophobicContact CG1-CB 4.31Å; V373-V385 HydrophobicContact CG1-CG2 3.71Å; D381-V385 PolarHBondContact O-N 2.99Å; M382-V385 PolarHBondContact O-N 3.45Å; K383-V385 PolarHBondContact O-N 2.96Å; V385-K390 PolarHBondContact O-N 3.42Å; V385-L391 HydrophobicContact CG1-CB 3.94Å; V385-L391 HydrophobicContact CG1-CD1 4.4Å; V385-L391 PolarHBondContact O-N 3.49Å
386	V	98.6	Very high	97.9	Very high	1 Å²	1	58.7 Å²	58.7	1%	0.006	29%	0.292	C	S	.	.	I	π-helix	trans	-86.8	-36.8	-167.9	175.2	0	0	0	0	113	P322 L325 Y343 Y369 M382 K390 R392	P322-V386 HydrophobicContact CB-CG1 4.23Å; P322-V386 HydrophobicContact CG-CG1 3.71Å; L325-V386 HydrophobicContact CD1-CB 3.81Å; L325-V386 HydrophobicContact CD1-CG1 3.9Å; L325-V386 HydrophobicContact CD1-CG2 4.24Å; Y343-V386 WeakPolarHBondContact OH-CG1 3.49Å; Y369-V386 HydrophobicContact CE1-CG2 3.9Å; Y369-V386 HydrophobicContact CE2-CG2 4.25Å; M382-V386 HydrophobicContact CE-CG2 3.71Å; M382-V386 WeakPolarHBondContact O-CB 3.41Å; M382-V386 WeakPolarHBondContact O-CG2 3.16Å; M382-V386 PolarHBondContact O-N 2.82Å; V386-K390 WeakPolarHBondContact O-CA 3.38Å; V386-R392 PolarHBondContact O-NH1 3.45Å
387	C	98.3	Very high	97.8	Very high	19 Å²	19	59.4 Å²	59.4	13%	0.128	30%	0.296	C	S	.	.	I	π-helix	trans	-98.9	-51.3	-175.9	-53.5	0	0	0	0	111.6	P322 K383 K390	P322-C387 PolarHBondContact O-SG 3.41Å; K383-C387 HydrophobicContact CG-CB 4.1Å; K383-C387 WeakPolarHBondContact O-CA 3.22Å; K383-C387 VanDerWaalsContact O-CB 3.22Å; K383-C387 WeakPolarHBondContact O-CB 3.37Å; K383-C387 PolarHBondContact O-N 3.07Å; C387-K390 VanDerWaalsContact O-CG 3.26Å; C387-K390 WeakPolarHBondContact O-CG 3.4Å
388	D	98	Very high	97.4	Very high	108 Å²	108	63.7 Å²	63.7	58%	0.578	32%	0.316	S	S	*	.	I	π-helix	trans	-78.3	-52	-172.9	-53.4	-20.3	0	0	0	111.1	K383 K384	K383-D388 PolarHBondContact O-N 3.42Å; K383-D388 VanDerWaalsContact O-N 3.12Å; K384-D388 WeakPolarHBondContact CA-OD2 3.38Å; K384-D388 WeakPolarHBondContact O-CB 3.39Å
389	Q	98.4	Very high	97.2	Very high	101 Å²	101	62 Å²	62	47%	0.472	30%	0.303	S	S	.	.	S	Bend	trans	-84.1	-13.6	178.4	-62.2	176.3	-6.9	0	0	113.2	K384 L391	K384-Q389 WeakPolarHBondContact O-CB 3.11Å; K384-Q389 WeakPolarHBondContact O-CG 3.48Å; K384-Q389 PolarHBondContact O-N 3.31Å; Q389-L391 HydrophobicContact CB-CD1 4.07Å; Q389-L391 HydrophobicContact CB-CG 3.83Å; Q389-L391 PolarHBondContact O-N 3.25Å; Q389-L391 VanDerWaalsContact OE1-CD1 3.32Å
390	K	98.3	Very high	97	Very high	151 Å²	151	65.4 Å²	65.4	66%	0.657	32%	0.319	S	S	*	.			trans	55.1	32	179.6	-57.3	-177.6	-178.5	-179	0	113.9	V385 V386 C387	V385-K390 PolarHBondContact O-N 3.42Å; V386-K390 WeakPolarHBondContact O-CA 3.38Å; C387-K390 VanDerWaalsContact O-CG 3.26Å; C387-K390 WeakPolarHBondContact O-CG 3.4Å
391	L	98.5	Very high	96.7	Very high	70 Å²	70	64.4 Å²	64.4	37%	0.366	33%	0.325	S	S	.	.			trans	-80	154.5	179.8	-61.2	178.3	0	0	0	111.7	M372 V385 Q389	M372-L391 HydrophobicContact SD-CB 3.88Å; M372-L391 HydrophobicContact SD-CD1 3.98Å; V385-L391 HydrophobicContact CG1-CB 3.94Å; V385-L391 HydrophobicContact CG1-CD1 4.4Å; V385-L391 PolarHBondContact O-N 3.49Å; Q389-L391 HydrophobicContact CB-CD1 4.07Å; Q389-L391 HydrophobicContact CB-CG 3.83Å; Q389-L391 PolarHBondContact O-N 3.25Å; Q389-L391 VanDerWaalsContact OE1-CD1 3.32Å
392	R	98.6	Very high	96.4	Very high	39 Å²	39	62.4 Å²	62.4	15%	0.147	32%	0.316	C	S	.	.			trans	-137.3	157.6	175.6	-62.7	-63.1	-179.3	-91.7	4.6	108.8	Y369 V386 N394 W416	Y369-R392 WeakPolarHBondContact OH-CD 3.47Å; V386-R392 PolarHBondContact O-NH1 3.45Å; R392-N394 PolarHBondContact O-N 3.47Å; R392-W416 HydrophobicContact CB-CD2 3.89Å; R392-W416 HydrophobicContact CB-CE3 4.1Å; R392-W416 HydrophobicContact CB-CH2 3.95Å; R392-W416 HydrophobicContact CB-CZ2 3.68Å; R392-W416 HydrophobicContact CB-CZ3 4.15Å; R392-W416 HydrophobicContact CG-CD2 3.85Å; R392-W416 HydrophobicContact CG-CE3 4.41Å; R392-W416 HydrophobicContact CG-CG 4.04Å; R392-W416 HydrophobicContact CG-CZ2 4.34Å; R392-W416 PolarHBondContact NE-O 2.96Å; R392-W416 PolarHBondContact NH2-O 3.04Å; R392-W416 VanDerWaalsContact NH2-O 3.12Å
393	P	98.6	Very high	96.2	Very high	3 Å²	3	66.8 Å²	66.8	2%	0.019	34%	0.336	C	S	.	.			trans	-49.7	136.2	172.6	-27.5	32	0	0	0	111.9	L347 W350 P368 Y369 I395 W416	L347-P393 HydrophobicContact CD2-CG 3.84Å; W350-P393 HydrophobicContact CD2-CB 3.66Å; W350-P393 HydrophobicContact CD2-CG 4.41Å; W350-P393 HydrophobicContact CE3-CB 4.29Å; W350-P393 HydrophobicContact CG-CB 3.89Å; W350-P393 HydrophobicContact CH2-CB 4.4Å; W350-P393 HydrophobicContact CZ2-CB 3.79Å; P368-P393 HydrophobicContact CB-CG 4.05Å; Y369-P393 HydrophobicContact CD1-CG 4.48Å; Y369-P393 HydrophobicContact CE1-CG 4.31Å; Y369-P393 HydrophobicContact CE2-CG 4.33Å; P393-I395 PolarHBondContact O-N 3.35Å; P393-W416 HydrophobicContact CB-CH2 4.05Å; P393-W416 HydrophobicContact CB-CZ3 3.83Å; P393-W416 HydrophobicContact CG-CE3 4.41Å; P393-W416 HydrophobicContact CG-CH2 4.33Å; P393-W416 HydrophobicContact CG-CZ3 3.65Å; P393-W416 WeakPolarHBondContact O-CH2 3.23Å
394	N	97.7	Very high	96	Very high	106 Å²	106	63.4 Å²	63.4	57%	0.567	32%	0.323	S	S	*	.			trans	-64.4	134.8	-177.8	-177.4	34.6	0	0	0	110.9	W350 R392 P396	W350-N394 PolarHBondContact NE1-O 2.81Å; R392-N394 PolarHBondContact O-N 3.47Å; N394-P396 WeakPolarHBondContact O-CD 3.43Å
395	I	97.2	Very high	95.9	Very high	21 Å²	21	58 Å²	58	11%	0.108	30%	0.3	C	S	.	.			trans	-96.8	107.7	171.4	-65.7	176.7	0	0	0	107.4	P393 W399 G409 R413 W416	P393-I395 PolarHBondContact O-N 3.35Å; I395-W399 HydrophobicContact CG1-CZ3 4.47Å; I395-W399 HydrophobicContact CG2-CD2 4.42Å; I395-W399 HydrophobicContact CG2-CE3 3.68Å; I395-W399 HydrophobicContact CG2-CZ3 4.09Å; I395-G409 WeakPolarHBondContact CD1-O 3.48Å; I395-R413 HydrophobicContact CD1-CG 3.75Å; I395-W416 HydrophobicContact CD1-CH2 4.31Å; I395-W416 HydrophobicContact CD1-CZ2 3.91Å; I395-W416 HydrophobicContact CG1-CH2 4.18Å; I395-W416 HydrophobicContact CG1-CZ2 4.2Å
396	P	94.7	Very high	95.8	Very high	19 Å²	19	62.3 Å²	62.3	12%	0.123	32%	0.315	C	S	.	.			trans	-61.4	137.6	-175.5	-28	40.8	0	0	0	112.6	E363 N394 Q398 W399	E363-P396 WeakPolarHBondContact OE1-CB 3.45Å; E363-P396 VanDerWaalsContact OE1-CG 3.25Å; E363-P396 WeakPolarHBondContact OE1-CG 3.41Å; N394-P396 WeakPolarHBondContact O-CD 3.43Å; P396-Q398 HydrophobicContact CB-CG 3.86Å; P396-Q398 PolarHBondContact O-N 2.62Å; P396-Q398 VanDerWaalsContact O-N 3.14Å; P396-W399 HydrophobicContact CG-CZ2 4.32Å; P396-W399 WeakPolarHBondContact O-CB 3.48Å; P396-W399 PolarHBondContact O-N 2.73Å
397	N	92.6	Very high	95.7	Very high	146 Å²	146	63.4 Å²	63.4	78%	0.781	32%	0.322	S	S	*	.	G	3₁₀ helix	trans	-58.5	-30.2	180	-71.8	-24	0	0	0	112.6	W399 Q400	N397-W399 PolarHBondContact O-N 2.96Å; N397-Q400 VanDerWaalsContact O-CB 3.32Å; N397-Q400 WeakPolarHBondContact O-CB 3.12Å; N397-Q400 WeakPolarHBondContact O-CG 3.29Å; N397-Q400 PolarHBondContact O-N 2.99Å
398	Q	90.8	Very high	95.7	Very high	95 Å²	95	62.5 Å²	62.5	44%	0.444	32%	0.316	S	S	.	.	G	3₁₀ helix	trans	-60.2	-25.4	177.8	64	-174.7	9.5	0	0	113.5	E363 P396 Q400 S401	E363-Q398 PolarHBondContact OE1-NE2 3.02Å; P396-Q398 HydrophobicContact CB-CG 3.86Å; P396-Q398 PolarHBondContact O-N 2.62Å; P396-Q398 VanDerWaalsContact O-N 3.14Å; Q398-Q400 PolarHBondContact O-N 3.28Å; Q398-S401 WeakPolarHBondContact O-CB 3.33Å; Q398-S401 PolarHBondContact O-N 3.46Å; Q398-S401 PolarHBondContact O-OG 3.25Å
399	W	94.1	Very high	95.6	Very high	3 Å²	3	57.3 Å²	57.3	1%	0.011	29%	0.289	C	S	.	.	G	3₁₀ helix	trans	-63.7	-20.4	175.5	-69.5	9.4	0	0	0	112.9	W350 A353 R354 E363 I395 P396 N397 S401 C402 L405 R406 M412	W350-W399 AromaticContact CD1-CH2 3.79Å; W350-W399 HydrophobicContact CG-CH2 4.47Å; A353-W399 HydrophobicContact CB-CE3 4.44Å; A353-W399 HydrophobicContact CB-CH2 3.47Å; A353-W399 VanDerWaalsContact CB-CH2 3.47Å; A353-W399 HydrophobicContact CB-CZ2 3.77Å; A353-W399 HydrophobicContact CB-CZ3 3.84Å; R354-W399 HydrophobicContact CG-CH2 4.48Å; R354-W399 HydrophobicContact CG-CZ2 3.97Å; E363-W399 PolarHBondContact OE1-NE1 3.12Å; I395-W399 HydrophobicContact CG1-CZ3 4.47Å; I395-W399 HydrophobicContact CG2-CD2 4.42Å; I395-W399 HydrophobicContact CG2-CE3 3.68Å; I395-W399 HydrophobicContact CG2-CZ3 4.09Å; P396-W399 HydrophobicContact CG-CZ2 4.32Å; P396-W399 WeakPolarHBondContact O-CB 3.48Å; P396-W399 PolarHBondContact O-N 2.73Å; N397-W399 PolarHBondContact O-N 2.96Å; W399-S401 PolarHBondContact O-N 2.67Å; W399-C402 PolarHBondContact O-N 3.46Å; W399-C402 VanDerWaalsContact O-O 3.07Å; W399-L405 HydrophobicContact CB-CB 3.83Å; W399-L405 HydrophobicContact CD2-CD2 4.26Å; W399-L405 HydrophobicContact CG-CB 4.07Å; W399-L405 HydrophobicContact CG-CD1 4.27Å; W399-L405 HydrophobicContact CG-CD2 4.37Å; W399-L405 HydrophobicContact CG-CG 4.49Å; W399-R406 PolarHBondContact O-N 3.12Å; W399-M412 HydrophobicContact CH2-CE 4.08Å; W399-M412 HydrophobicContact CH2-SD 4.3Å; W399-M412 HydrophobicContact CZ3-CE 3.63Å; W399-M412 HydrophobicContact CZ3-SD 3.78Å
400	Q	92.9	Very high	95.6	Very high	95 Å²	95	57.9 Å²	57.9	44%	0.444	29%	0.289	S	S	.	.	G	3₁₀ helix	trans	-66	-19.9	174.8	-59.2	-53.3	-53.1	0	0	112.9	N397 Q398 C402	N397-Q400 VanDerWaalsContact O-CB 3.32Å; N397-Q400 WeakPolarHBondContact O-CB 3.12Å; N397-Q400 WeakPolarHBondContact O-CG 3.29Å; N397-Q400 PolarHBondContact O-N 2.99Å; Q398-Q400 PolarHBondContact O-N 3.28Å; Q400-C402 VanDerWaalsContact C-N 3.29Å; Q400-C402 PolarHBondContact O-N 2.88Å
401	S	90.3	Very high	95.6	Very high	103 Å²	103	50.9 Å²	50.9	72%	0.72	26%	0.259	S	S	*	.	G	3₁₀ helix	trans	-77	-12.6	-179.9	69.6	0	0	0	0	114.2	Q398 W399	Q398-S401 WeakPolarHBondContact O-CB 3.33Å; Q398-S401 PolarHBondContact O-N 3.46Å; Q398-S401 PolarHBondContact O-OG 3.25Å; W399-S401 PolarHBondContact O-N 2.67Å
402	C	93.1	Very high	95.6	Very high	18 Å²	18	47.5 Å²	47.5	12%	0.122	24%	0.241	C	C	.	.	S	Bend	trans	-124.5	125.5	179.9	176	0	0	0	0	109.8	V358 W399 Q400 A404 L405 R406	V358-C402 HydrophobicContact CG1-CB 4.49Å; V358-C402 HydrophobicContact CG2-CB 4.31Å; W399-C402 PolarHBondContact O-N 3.46Å; W399-C402 VanDerWaalsContact O-O 3.07Å; Q400-C402 VanDerWaalsContact C-N 3.29Å; Q400-C402 PolarHBondContact O-N 2.88Å; C402-A404 VanDerWaalsContact C-N 3.33Å; C402-A404 PolarHBondContact O-N 3.43Å; C402-L405 HydrophobicContact CB-CB 4.11Å; C402-L405 HydrophobicContact CB-CD1 4.04Å; C402-L405 HydrophobicContact CB-CG 4.31Å; C402-L405 PolarHBondContact O-N 3.13Å; C402-R406 WeakPolarHBondContact O-CB 3.47Å; C402-R406 PolarHBondContact O-N 3.12Å
403	E	93.4	Very high	95.6	Very high	92 Å²	92	50.7 Å²	50.7	43%	0.43	25%	0.253	S	S	.	.	H	α-helix	trans	-57.1	-45.1	-176.8	-179.1	57.5	-161.7	0	0	112.8	L405 R406 V407	E403-L405 PolarHBondContact O-N 3.19Å; E403-R406 WeakPolarHBondContact O-CB 2.83Å; E403-R406 PolarHBondContact O-N 3.25Å; E403-R406 IonicContact OE1-CZ 3.83Å; E403-R406 IonicContact OE1-NE 2.68Å; E403-R406 IonicContact OE1-NH2 3.49Å; E403-R406 PolarHBondContact OE1-NH2 2.94Å; E403-R406 IonicContact OE2-CZ 3.78Å; E403-R406 IonicContact OE2-NE 2.7Å; E403-R406 PolarHBondContact OE2-NE 3.16Å; E403-R406 IonicContact OE2-NH2 3.43Å; E403-R406 PolarHBondContact OE2-NH2 2.7Å; E403-V407 WeakPolarHBondContact O-CG2 3.2Å; E403-V407 PolarHBondContact O-N 3.08Å
404	A	94.8	Very high	95.6	Very high	10 Å²	10	52.8 Å²	52.8	8%	0.083	26%	0.263	C	S	.	.	H	α-helix	trans	-62.1	-45.7	179.8	0	0	0	0	0	111.7	V240 M243 C402 R406 V407 M408	V240-A404 HydrophobicContact CG1-CB 3.46Å; V240-A404 VanDerWaalsContact CG1-CB 3.46Å; M243-A404 HydrophobicContact CE-CB 3.78Å; C402-A404 VanDerWaalsContact C-N 3.33Å; C402-A404 PolarHBondContact O-N 3.43Å; A404-R406 VanDerWaalsContact C-N 3.35Å; A404-R406 PolarHBondContact O-N 3.34Å; A404-V407 PolarHBondContact O-N 3.39Å; A404-M408 WeakPolarHBondContact O-CB 3.36Å; A404-M408 VanDerWaalsContact O-CG 3.24Å; A404-M408 WeakPolarHBondContact O-CG 3.36Å; A404-M408 PolarHBondContact O-N 3.03Å
405	L	96.1	Very high	95.7	Very high	8 Å²	8	47.7 Å²	47.7	4%	0.042	24%	0.236	C	C	.	.	H	α-helix	trans	-67	-35.4	177.2	-74.7	172	0	0	0	112.4	M243 A353 C356 V358 W399 C402 E403 M408 G409	M243-L405 HydrophobicContact CE-CD2 4.22Å; M243-L405 HydrophobicContact CE-CG 4.49Å; M243-L405 HydrophobicContact SD-CD2 3.65Å; M243-L405 HydrophobicContact SD-CG 4.49Å; A353-L405 HydrophobicContact CB-CD2 3.86Å; C356-L405 HydrophobicContact CB-CD2 3.92Å; V358-L405 HydrophobicContact CG2-CD1 3.86Å; W399-L405 HydrophobicContact CB-CB 3.83Å; W399-L405 HydrophobicContact CD2-CD2 4.26Å; W399-L405 HydrophobicContact CG-CB 4.07Å; W399-L405 HydrophobicContact CG-CD1 4.27Å; W399-L405 HydrophobicContact CG-CD2 4.37Å; W399-L405 HydrophobicContact CG-CG 4.49Å; C402-L405 HydrophobicContact CB-CB 4.11Å; C402-L405 HydrophobicContact CB-CD1 4.04Å; C402-L405 HydrophobicContact CB-CG 4.31Å; C402-L405 PolarHBondContact O-N 3.13Å; E403-L405 PolarHBondContact O-N 3.19Å; L405-M408 PolarHBondContact O-N 3.16Å; L405-G409 PolarHBondContact O-N 3.07Å
406	R	96.3	Very high	95.7	Very high	100 Å²	100	47.6 Å²	47.6	38%	0.377	23%	0.234	S	C	.	.	H	α-helix	trans	-62	-45.3	173.7	-174.5	176.8	72.8	81.2	-4.7	111.8	W399 C402 E403 A404 G409 K410	W399-R406 PolarHBondContact O-N 3.12Å; C402-R406 WeakPolarHBondContact O-CB 3.47Å; C402-R406 PolarHBondContact O-N 3.12Å; E403-R406 WeakPolarHBondContact O-CB 2.83Å; E403-R406 PolarHBondContact O-N 3.25Å; E403-R406 IonicContact OE1-CZ 3.83Å; E403-R406 IonicContact OE1-NE 2.68Å; E403-R406 IonicContact OE1-NH2 3.49Å; E403-R406 PolarHBondContact OE1-NH2 2.94Å; E403-R406 IonicContact OE2-CZ 3.78Å; E403-R406 IonicContact OE2-NE 2.7Å; E403-R406 PolarHBondContact OE2-NE 3.16Å; E403-R406 IonicContact OE2-NH2 3.43Å; E403-R406 PolarHBondContact OE2-NH2 2.7Å; A404-R406 VanDerWaalsContact C-N 3.35Å; A404-R406 PolarHBondContact O-N 3.34Å; R406-G409 PolarHBondContact O-N 2.94Å; R406-K410 PolarHBondContact O-N 2.69Å
407	V	96.7	Very high	95.9	Very high	24 Å²	24	51.8 Å²	51.8	15%	0.145	25%	0.248	C	C	.	.	H	α-helix	trans	-66.7	-42.9	175.9	174	0	0	0	0	111	E403 A404 G409 K410 L411 T432 L436	E403-V407 WeakPolarHBondContact O-CG2 3.2Å; E403-V407 PolarHBondContact O-N 3.08Å; A404-V407 PolarHBondContact O-N 3.39Å; V407-G409 VanDerWaalsContact C-N 3.35Å; V407-G409 PolarHBondContact O-N 3.47Å; V407-K410 WeakPolarHBondContact O-CB 3.49Å; V407-K410 PolarHBondContact O-N 2.88Å; V407-K410 VanDerWaalsContact O-N 3.16Å; V407-L411 HydrophobicContact CG1-CD1 4.35Å; V407-L411 PolarHBondContact O-N 3.18Å; V407-T432 HydrophobicContact CG1-CG2 3.96Å; V407-L436 HydrophobicContact CB-CD1 4.04Å; V407-L436 HydrophobicContact CB-CD2 3.85Å; V407-L436 HydrophobicContact CB-CG 4.4Å; V407-L436 HydrophobicContact CG1-CD1 3.76Å; V407-L436 HydrophobicContact CG1-CD2 3.94Å; V407-L436 HydrophobicContact CG1-CG 4.04Å; V407-L436 HydrophobicContact CG2-CD2 3.89Å
408	M	97.8	Very high	96.1	Very high	0 Å²	0	47.5 Å²	47.5	0%	0	23%	0.233	C	C	.	.	H	α-helix	trans	-59.4	-44.2	174.8	-72.1	-61.3	-68.9	0	0	111.7	M243 A247 F349 A404 L405 K410 L411 M412 V433	M243-M408 HydrophobicContact CE-CG 3.87Å; M243-M408 HydrophobicContact SD-CG 4.13Å; A247-M408 HydrophobicContact CB-CE 3.91Å; A247-M408 HydrophobicContact CB-SD 4.37Å; F349-M408 HydrophobicContact CB-CE 3.79Å; F349-M408 HydrophobicContact CD1-CE 4.33Å; F349-M408 HydrophobicContact CD2-CE 3.5Å; F349-M408 VanDerWaalsContact CD2-CE 3.5Å; F349-M408 HydrophobicContact CD2-SD 4.47Å; F349-M408 HydrophobicContact CE2-CE 4.06Å; F349-M408 HydrophobicContact CG-CE 3.63Å; A404-M408 WeakPolarHBondContact O-CB 3.36Å; A404-M408 VanDerWaalsContact O-CG 3.24Å; A404-M408 WeakPolarHBondContact O-CG 3.36Å; A404-M408 PolarHBondContact O-N 3.03Å; L405-M408 PolarHBondContact O-N 3.16Å; M408-K410 VanDerWaalsContact C-N 3.31Å; M408-K410 PolarHBondContact O-N 3.01Å; M408-L411 WeakPolarHBondContact O-CB 3.31Å; M408-L411 PolarHBondContact O-N 3.06Å; M408-L411 HydrophobicContact SD-CD1 4.15Å; M408-M412 HydrophobicContact CB-CE 3.98Å; M408-M412 HydrophobicContact CE-CE 4.5Å; M408-M412 VanDerWaalsContact O-CG 3.3Å; M408-M412 WeakPolarHBondContact O-CG 3.44Å; M408-M412 PolarHBondContact O-N 2.87Å; M408-V433 HydrophobicContact SD-CG2 4.45Å
409	G	97.9	Very high	96.5	Very high	0 Å²	0	48 Å²	48	0%	0	24%	0.239	C	C	.	.	H	α-helix	trans	-62.7	-35.5	175.4	0	0	0	0	0	113.2	I395 L405 R406 V407 R413	I395-G409 WeakPolarHBondContact CD1-O 3.48Å; L405-G409 PolarHBondContact O-N 3.07Å; R406-G409 PolarHBondContact O-N 2.94Å; V407-G409 VanDerWaalsContact C-N 3.35Å; V407-G409 PolarHBondContact O-N 3.47Å; G409-R413 WeakPolarHBondContact O-CG 3.33Å; G409-R413 PolarHBondContact O-N 2.84Å
410	K	97.8	Very high	96.6	Very high	113 Å²	113	48.7 Å²	48.7	49%	0.491	25%	0.245	S	C	.	.	H	α-helix	trans	-65.8	-46.6	171.4	-178.5	179.8	171.7	-178.9	0	111.4	R406 V407 M408 M412 R413 E414	R406-K410 PolarHBondContact O-N 2.69Å; V407-K410 WeakPolarHBondContact O-CB 3.49Å; V407-K410 PolarHBondContact O-N 2.88Å; V407-K410 VanDerWaalsContact O-N 3.16Å; M408-K410 VanDerWaalsContact C-N 3.31Å; M408-K410 PolarHBondContact O-N 3.01Å; K410-M412 VanDerWaalsContact C-N 3.35Å; K410-M412 PolarHBondContact O-N 3.39Å; K410-R413 WeakPolarHBondContact O-CB 3.23Å; K410-R413 PolarHBondContact O-N 2.94Å; K410-E414 WeakPolarHBondContact CE-OE1 3.23Å; K410-E414 IonicContact NZ-OE1 3.87Å; K410-E414 WeakPolarHBondContact O-CG 3.48Å; K410-E414 PolarHBondContact O-N 3.18Å; K410-E414 VanDerWaalsContact O-N 3.08Å
411	L	97.9	Very high	96.9	Very high	3 Å²	3	46.8 Å²	46.8	2%	0.016	25%	0.246	C	C	.	.	H	α-helix	trans	-57.8	-45.5	177.4	-78.5	173.9	0	0	0	111.9	V407 M408 R413 E414 C415 L424 T432 V433	V407-L411 HydrophobicContact CG1-CD1 4.35Å; V407-L411 PolarHBondContact O-N 3.18Å; M408-L411 WeakPolarHBondContact O-CB 3.31Å; M408-L411 PolarHBondContact O-N 3.06Å; M408-L411 HydrophobicContact SD-CD1 4.15Å; L411-R413 VanDerWaalsContact C-N 3.31Å; L411-R413 PolarHBondContact O-N 3.1Å; L411-E414 CarbonylContact O-C 3.4Å; L411-E414 PolarHBondContact O-N 3.34Å; L411-E414 VanDerWaalsContact O-N 3.16Å; L411-C415 WeakPolarHBondContact O-CB 3.35Å; L411-C415 PolarHBondContact O-N 2.9Å; L411-C415 PolarHBondContact O-SG 3.36Å; L411-L424 HydrophobicContact CD2-CD1 3.52Å; L411-T432 HydrophobicContact CD1-CG2 3.98Å; L411-T432 HydrophobicContact CD2-CG2 3.84Å; L411-T432 HydrophobicContact CG-CG2 4.1Å; L411-V433 HydrophobicContact CD1-CG2 3.72Å
412	M	98.6	Very high	97.2	Very high	0 Å²	0	44.2 Å²	44.2	0%	0	23%	0.231	C	C	.	.	H	α-helix	trans	-57.3	-45.8	176.5	-66.7	169.9	-151.3	0	0	111.4	F349 W350 A353 W399 M408 K410 E414 C415 W416	F349-M412 VanDerWaalsContact C-CE 3.5Å; F349-M412 HydrophobicContact CB-CE 4.15Å; F349-M412 HydrophobicContact CB-CG 4.13Å; F349-M412 VanDerWaalsContact O-CE 3.26Å; F349-M412 WeakPolarHBondContact O-CE 3.44Å; W350-M412 HydrophobicContact CB-CE 4.43Å; W350-M412 HydrophobicContact CB-SD 3.71Å; W350-M412 HydrophobicContact CG-SD 4.3Å; A353-M412 HydrophobicContact CB-CE 3.53Å; W399-M412 HydrophobicContact CH2-CE 4.08Å; W399-M412 HydrophobicContact CH2-SD 4.3Å; W399-M412 HydrophobicContact CZ3-CE 3.63Å; W399-M412 HydrophobicContact CZ3-SD 3.78Å; M408-M412 HydrophobicContact CB-CE 3.98Å; M408-M412 HydrophobicContact CE-CE 4.5Å; M408-M412 VanDerWaalsContact O-CG 3.3Å; M408-M412 WeakPolarHBondContact O-CG 3.44Å; M408-M412 PolarHBondContact O-N 2.87Å; K410-M412 VanDerWaalsContact C-N 3.35Å; K410-M412 PolarHBondContact O-N 3.39Å; M412-E414 VanDerWaalsContact C-N 3.28Å; M412-E414 PolarHBondContact O-N 3Å; M412-C415 PolarHBondContact O-N 3.04Å; M412-W416 HydrophobicContact CB-CH2 4.43Å; M412-W416 HydrophobicContact CB-CZ2 4.43Å; M412-W416 PolarHBondContact O-N 3.44Å
413	R	98.6	Very high	97.5	Very high	105 Å²	105	44.1 Å²	44.1	40%	0.396	23%	0.228	S	C	.	.	H	α-helix	trans	-57.2	-41.8	176.5	-74.9	-173.7	-67.8	-112.5	0.1	113.3	I395 G409 K410 L411 C415 W416	I395-R413 HydrophobicContact CD1-CG 3.75Å; G409-R413 WeakPolarHBondContact O-CG 3.33Å; G409-R413 PolarHBondContact O-N 2.84Å; K410-R413 WeakPolarHBondContact O-CB 3.23Å; K410-R413 PolarHBondContact O-N 2.94Å; L411-R413 VanDerWaalsContact C-N 3.31Å; L411-R413 PolarHBondContact O-N 3.1Å; R413-C415 VanDerWaalsContact C-N 3.33Å; R413-W416 VanDerWaalsContact CA-NE1 3.35Å; R413-W416 HydrophobicContact CG-CZ2 4.48Å
414	E	98.6	Very high	97.7	Very high	47 Å²	47	41 Å²	41	22%	0.22	22%	0.215	C	C	.	.	H	α-helix	trans	-78.2	-18.7	178.8	-62.9	174	178.9	0	0	113	K410 L411 M412 Y417 R423 L424	K410-E414 WeakPolarHBondContact CE-OE1 3.23Å; K410-E414 IonicContact NZ-OE1 3.87Å; K410-E414 WeakPolarHBondContact O-CG 3.48Å; K410-E414 PolarHBondContact O-N 3.18Å; K410-E414 VanDerWaalsContact O-N 3.08Å; L411-E414 CarbonylContact O-C 3.4Å; L411-E414 PolarHBondContact O-N 3.34Å; L411-E414 VanDerWaalsContact O-N 3.16Å; M412-E414 VanDerWaalsContact C-N 3.28Å; M412-E414 PolarHBondContact O-N 3Å; E414-Y417 HydrophobicContact CB-CE2 4.14Å; E414-Y417 HydrophobicContact CG-CE2 4.19Å; E414-Y417 WeakPolarHBondContact O-CD2 3.34Å; E414-R423 VanDerWaalsContact O-CA 3.31Å; E414-R423 WeakPolarHBondContact O-CA 3.49Å; E414-L424 HydrophobicContact CB-CD1 3.74Å; E414-L424 HydrophobicContact CB-CD2 4.16Å; E414-L424 HydrophobicContact CB-CG 3.69Å; E414-L424 PolarHBondContact O-N 3.14Å
415	C	98.8	Very high	97.9	Very high	0 Å²	0	43.9 Å²	43.9	0%	0	23%	0.231	C	C	.	.	H	α-helix	trans	-83	-35.9	175.5	-70	0	0	0	0	112.7	I342 Y343 L411 M412 R413 R423	I342-C415 HydrophobicContact CG2-CB 3.88Å; I342-C415 WeakPolarHBondContact O-CB 3.31Å; Y343-C415 WeakPolarHBondContact CA-O 3.47Å; L411-C415 WeakPolarHBondContact O-CB 3.35Å; L411-C415 PolarHBondContact O-N 2.9Å; L411-C415 PolarHBondContact O-SG 3.36Å; M412-C415 PolarHBondContact O-N 3.04Å; R413-C415 VanDerWaalsContact C-N 3.33Å; C415-R423 WeakPolarHBondContact O-CD 3.48Å; C415-R423 VanDerWaalsContact O-CG 3.29Å; C415-R423 WeakPolarHBondContact O-CG 3.49Å
416	W	98.3	Very high	98	Very high	18 Å²	18	43.6 Å²	43.6	7%	0.068	23%	0.23	C	C	.	.	S	Bend	trans	-103.7	23.3	-171.3	66.7	15.4	0	0	0	115.5	Y343 L347 R392 P393 I395 M412 R413	Y343-W416 HydrophobicContact CD2-CB 3.71Å; Y343-W416 HydrophobicContact CE2-CB 3.83Å; L347-W416 HydrophobicContact CD2-CE3 3.8Å; L347-W416 HydrophobicContact CD2-CZ3 4.18Å; R392-W416 HydrophobicContact CB-CD2 3.89Å; R392-W416 HydrophobicContact CB-CE3 4.1Å; R392-W416 HydrophobicContact CB-CH2 3.95Å; R392-W416 HydrophobicContact CB-CZ2 3.68Å; R392-W416 HydrophobicContact CB-CZ3 4.15Å; R392-W416 HydrophobicContact CG-CD2 3.85Å; R392-W416 HydrophobicContact CG-CE3 4.41Å; R392-W416 HydrophobicContact CG-CG 4.04Å; R392-W416 HydrophobicContact CG-CZ2 4.34Å; R392-W416 PolarHBondContact NE-O 2.96Å; R392-W416 PolarHBondContact NH2-O 3.04Å; R392-W416 VanDerWaalsContact NH2-O 3.12Å; P393-W416 HydrophobicContact CB-CH2 4.05Å; P393-W416 HydrophobicContact CB-CZ3 3.83Å; P393-W416 HydrophobicContact CG-CE3 4.41Å; P393-W416 HydrophobicContact CG-CH2 4.33Å; P393-W416 HydrophobicContact CG-CZ3 3.65Å; P393-W416 WeakPolarHBondContact O-CH2 3.23Å; I395-W416 HydrophobicContact CD1-CH2 4.31Å; I395-W416 HydrophobicContact CD1-CZ2 3.91Å; I395-W416 HydrophobicContact CG1-CH2 4.18Å; I395-W416 HydrophobicContact CG1-CZ2 4.2Å; M412-W416 HydrophobicContact CB-CH2 4.43Å; M412-W416 HydrophobicContact CB-CZ2 4.43Å; M412-W416 PolarHBondContact O-N 3.44Å; R413-W416 VanDerWaalsContact CA-NE1 3.35Å; R413-W416 HydrophobicContact CG-CZ2 4.48Å
417	Y	98.6	Very high	98.1	Very high	107 Å²	107	42.2 Å²	42.2	42%	0.42	23%	0.229	S	C	.	.			trans	-53.6	143.5	173.1	-78.9	-55.4	0	0	0	111.6	E414 A422 R423	E414-Y417 HydrophobicContact CB-CE2 4.14Å; E414-Y417 HydrophobicContact CG-CE2 4.19Å; E414-Y417 WeakPolarHBondContact O-CD2 3.34Å; Y417-A422 HydrophobicContact CD2-CB 3.96Å; Y417-A422 WeakPolarHBondContact CD2-O 3.48Å; Y417-A422 HydrophobicContact CG-CB 4.27Å; Y417-R423 PolarHBondContact O-NE 3.32Å; Y417-R423 PolarHBondContact O-NH2 3.18Å
418	A	97.8	Very high	98.2	Very high	57 Å²	57	47.7 Å²	47.7	47%	0.471	25%	0.246	S	C	.	.	S	Bend	trans	-62.3	-46.1	173.4	0	0	0	0	0	111.2	A420 R423	A418-A420 PolarHBondContact O-N 3.04Å; A418-A420 VanDerWaalsContact O-N 3.16Å; A418-R423 PolarHBondContact O-NH2 3.2Å
419	N	97.9	Very high	98.3	Very high	104 Å²	104	47.7 Å²	47.7	56%	0.556	25%	0.246	S	C	*	.	S	Bend	trans	-71.3	109.3	171.3	-178.2	-2.2	0	0	0	110.2	A421 A422	N419-A421 PolarHBondContact O-N 3.05Å; N419-A421 WeakPolarHBondContact OD1-CB 3.42Å; N419-A421 PolarHBondContact OD1-N 3.07Å; N419-A422 HydrophobicContact CB-CB 4.28Å; N419-A422 PolarHBondContact O-N 3.32Å; N419-A422 VanDerWaalsContact O-N 3.11Å
420	A	97.7	Very high	98.3	Very high	18 Å²	18	51 Å²	51	15%	0.149	26%	0.261	C	S	.	.	G	3₁₀ helix	trans	-56.3	-35.1	179.3	0	0	0	0	0	113	R339 A418 A422 R423	R339-A420 HydrophobicContact CB-CB 3.94Å; R339-A420 VanDerWaalsContact CD-O 3.23Å; R339-A420 WeakPolarHBondContact CD-O 3.41Å; R339-A420 HydrophobicContact CG-CB 4.49Å; R339-A420 WeakPolarHBondContact CG-O 3.33Å; A418-A420 PolarHBondContact O-N 3.04Å; A418-A420 VanDerWaalsContact O-N 3.16Å; A420-A422 VanDerWaalsContact C-N 3.25Å; A420-A422 PolarHBondContact O-N 3.38Å; A420-R423 WeakPolarHBondContact O-CB 3.22Å; A420-R423 PolarHBondContact O-N 2.88Å
421	A	97.3	Very high	98.3	Very high	55 Å²	55	51.5 Å²	51.5	46%	0.455	26%	0.263	S	S	.	.	G	3₁₀ helix	trans	-70.9	-19.1	-178.9	0	0	0	0	0	114.2	N419 R423	N419-A421 PolarHBondContact O-N 3.05Å; N419-A421 WeakPolarHBondContact OD1-CB 3.42Å; N419-A421 PolarHBondContact OD1-N 3.07Å; A421-R423 VanDerWaalsContact C-N 3.33Å
422	A	98.1	Very high	98.3	Very high	50 Å²	50	52.5 Å²	52.5	41%	0.413	27%	0.269	S	S	.	.	G	3₁₀ helix	trans	-85.4	-7.5	177.1	0	0	0	0	0	113	Y417 N419 A420	Y417-A422 HydrophobicContact CD2-CB 3.96Å; Y417-A422 WeakPolarHBondContact CD2-O 3.48Å; Y417-A422 HydrophobicContact CG-CB 4.27Å; N419-A422 HydrophobicContact CB-CB 4.28Å; N419-A422 PolarHBondContact O-N 3.32Å; N419-A422 VanDerWaalsContact O-N 3.11Å; A420-A422 VanDerWaalsContact C-N 3.25Å; A420-A422 PolarHBondContact O-N 3.38Å
423	R	98.7	Very high	98.2	Very high	15 Å²	15	52.5 Å²	52.5	6%	0.057	27%	0.269	C	S	.	.	S	Bend	trans	-72.4	150.4	-179	-61.6	177	-170.5	147	14.7	111.1	E323 R339 I342 E414 C415 Y417 A418 A420 A421	E323-R423 IonicContact OE1-CZ 2.92Å; E323-R423 IonicContact OE1-NH1 2.85Å; E323-R423 PolarHBondContact OE1-NH1 3.09Å; E323-R423 IonicContact OE1-NH2 2.83Å; E323-R423 PolarHBondContact OE1-NH2 3.35Å; E323-R423 IonicContact OE2-CZ 3.17Å; E323-R423 IonicContact OE2-NH1 2.9Å; E323-R423 PolarHBondContact OE2-NH1 2.91Å; E323-R423 IonicContact OE2-NH2 3.94Å; E323-R423 PolarHBondContact OE2-NH2 2.95Å; R339-R423 VanDerWaalsContact C-NH1 3.34Å; R339-R423 WeakPolarHBondContact O-CD 3.38Å; R339-R423 PolarHBondContact O-NH1 3.27Å; I342-R423 HydrophobicContact CG2-CB 4.08Å; E414-R423 VanDerWaalsContact O-CA 3.31Å; E414-R423 WeakPolarHBondContact O-CA 3.49Å; C415-R423 WeakPolarHBondContact O-CD 3.48Å; C415-R423 VanDerWaalsContact O-CG 3.29Å; C415-R423 WeakPolarHBondContact O-CG 3.49Å; Y417-R423 PolarHBondContact O-NE 3.32Å; Y417-R423 PolarHBondContact O-NH2 3.18Å; A418-R423 PolarHBondContact O-NH2 3.2Å; A420-R423 WeakPolarHBondContact O-CB 3.22Å; A420-R423 PolarHBondContact O-N 2.88Å; A421-R423 VanDerWaalsContact C-N 3.33Å
424	L	98.5	Very high	98	Very high	28 Å²	28	50.1 Å²	50.1	15%	0.147	27%	0.269	C	S	.	.	P	Polyproline II helix	trans	-61	159.4	172	-60	178.1	0	0	0	111.3	I342 L411 E414 R428 V429	I342-L424 WeakPolarHBondContact CG1-O 3.33Å; I342-L424 WeakPolarHBondContact CG2-O 3.23Å; L411-L424 HydrophobicContact CD2-CD1 3.52Å; E414-L424 HydrophobicContact CB-CD1 3.74Å; E414-L424 HydrophobicContact CB-CD2 4.16Å; E414-L424 HydrophobicContact CB-CG 3.69Å; E414-L424 PolarHBondContact O-N 3.14Å; L424-R428 HydrophobicContact CD2-CG 3.95Å; L424-V429 HydrophobicContact CB-CG2 3.81Å; L424-V429 HydrophobicContact CD1-CG2 3.87Å
425	T	98.7	Very high	97.6	Very high	70 Å²	70	53.3 Å²	53.3	43%	0.429	28%	0.283	S	S	.	.	P	Polyproline II helix	trans	-88.1	155.4	164.7	64.9	0	0	0	0	110	M427 R428 V429	T425-M427 PolarHBondContact O-N 3.2Å; T425-R428 WeakPolarHBondContact O-CB 3.26Å; T425-R428 PolarHBondContact O-N 2.95Å; T425-R428 WeakPolarHBondContact OG1-CB 3.45Å; T425-R428 PolarHBondContact OG1-N 2.91Å; T425-V429 WeakPolarHBondContact O-CG2 3.28Å; T425-V429 PolarHBondContact O-N 2.87Å
426	A	98.6	Very high	97.1	Very high	2 Å²	2	54.2 Å²	54.2	2%	0.017	29%	0.288	C	S	.	.	H	α-helix	trans	-56.9	-36.5	176.7	0	0	0	0	0	111.5	L254 A255 I342 R428 V429 K430	L254-A426 HydrophobicContact CB-CB 4.26Å; L254-A426 HydrophobicContact CD2-CB 4.17Å; L254-A426 HydrophobicContact CG-CB 4.06Å; A255-A426 HydrophobicContact CB-CB 3.93Å; I342-A426 HydrophobicContact CD1-CB 3.8Å; I342-A426 VanDerWaalsContact CD1-N 3.26Å; A426-R428 PolarHBondContact O-N 3.22Å; A426-V429 PolarHBondContact O-N 2.58Å; A426-K430 WeakPolarHBondContact O-CB 3.18Å; A426-K430 PolarHBondContact O-N 3.38Å
427	M	98.4	Very high	96.2	Very high	71 Å²	71	55.5 Å²	55.5	35%	0.35	30%	0.3	S	S	.	.	H	α-helix	trans	-63.8	-38.9	175.2	-166.8	54.4	62.4	0	0	112.7	A255 T425 K430 K431	A255-M427 HydrophobicContact CB-CE 3.8Å; T425-M427 PolarHBondContact O-N 3.2Å; M427-K430 HydrophobicContact SD-CD 4.24Å; M427-K431 WeakPolarHBondContact O-CG 3.5Å; M427-K431 PolarHBondContact O-N 3.33Å; M427-K431 VanDerWaalsContact O-N 3.07Å
428	R	98.4	Very high	94.7	Very high	138 Å²	138	52.8 Å²	52.8	52%	0.521	30%	0.3	S	S	.	.	H	α-helix	trans	-67.9	-43	175.8	-178.4	56.8	177.2	-172.8	1.2	111	L424 T425 A426 K431 T432	L424-R428 HydrophobicContact CD2-CG 3.95Å; T425-R428 WeakPolarHBondContact O-CB 3.26Å; T425-R428 PolarHBondContact O-N 2.95Å; T425-R428 WeakPolarHBondContact OG1-CB 3.45Å; T425-R428 PolarHBondContact OG1-N 2.91Å; A426-R428 PolarHBondContact O-N 3.22Å; R428-K431 PolarHBondContact O-N 3.12Å; R428-T432 PolarHBondContact O-N 3.16Å; R428-T432 PolarHBondContact O-OG1 3.11Å
429	V	98.6	Very high	92.9	Very high	0 Å²	0	54.2 Å²	54.2	0%	0	30%	0.298	C	S	.	.	H	α-helix	trans	-58.3	-50.4	174.7	178.1	0	0	0	0	110.6	A251 L345 F349 L424 T425 A426 K431 T432 V433	A251-V429 HydrophobicContact CB-CG1 3.99Å; L345-V429 HydrophobicContact CD2-CB 4.48Å; L345-V429 HydrophobicContact CD2-CG1 4.03Å; L345-V429 HydrophobicContact CD2-CG2 4.49Å; F349-V429 HydrophobicContact CE2-CG1 3.54Å; F349-V429 HydrophobicContact CZ-CG1 3.97Å; L424-V429 HydrophobicContact CB-CG2 3.81Å; L424-V429 HydrophobicContact CD1-CG2 3.87Å; T425-V429 WeakPolarHBondContact O-CG2 3.28Å; T425-V429 PolarHBondContact O-N 2.87Å; A426-V429 PolarHBondContact O-N 2.58Å; V429-K431 VanDerWaalsContact C-N 3.33Å; V429-K431 PolarHBondContact O-N 2.91Å; V429-T432 PolarHBondContact O-N 3.45Å; V429-T432 VanDerWaalsContact O-N 3.15Å; V429-V433 HydrophobicContact CG1-CG2 4.27Å; V429-V433 WeakPolarHBondContact O-CG2 3.42Å; V429-V433 PolarHBondContact O-N 3.23Å
430	K	98.4	Very high	90.7	Very high	70 Å²	70	53.6 Å²	53.6	30%	0.304	29%	0.291	S	S	.	.	H	α-helix	trans	-51.5	-50.1	175.6	178.6	-176	180	170.3	0	111.7	L248 A251 S252 A255 A426 M427 T432 V433 S434	L248-K430 HydrophobicContact CD1-CG 3.99Å; A251-K430 HydrophobicContact CB-CB 4.24Å; S252-K430 WeakPolarHBondContact OG-CD 3.38Å; S252-K430 WeakPolarHBondContact OG-CE 3.48Å; A255-K430 HydrophobicContact CB-CD 4.46Å; A426-K430 WeakPolarHBondContact O-CB 3.18Å; A426-K430 PolarHBondContact O-N 3.38Å; M427-K430 HydrophobicContact SD-CD 4.24Å; K430-T432 PolarHBondContact O-N 3.18Å; K430-V433 PolarHBondContact O-N 3.25Å; K430-S434 WeakPolarHBondContact O-CB 3.41Å; K430-S434 PolarHBondContact O-N 3.06Å
431	K	97.8	Very high	88.4	Confident	124 Å²	124	58.8 Å²	58.8	54%	0.539	32%	0.316	S	S	.	.	H	α-helix	trans	-60.4	-43.9	179.5	-76.1	-178.5	178.6	-175.2	0	112.3	M427 R428 V429 S434 Q435	M427-K431 WeakPolarHBondContact O-CG 3.5Å; M427-K431 PolarHBondContact O-N 3.33Å; M427-K431 VanDerWaalsContact O-N 3.07Å; R428-K431 PolarHBondContact O-N 3.12Å; V429-K431 VanDerWaalsContact C-N 3.33Å; V429-K431 PolarHBondContact O-N 2.91Å; K431-S434 PolarHBondContact O-N 3.5Å; K431-Q435 WeakPolarHBondContact O-CG 3.44Å; K431-Q435 PolarHBondContact O-N 3Å; K431-Q435 VanDerWaalsContact O-N 3.14Å
432	T	97.1	Very high	85.7	Confident	24 Å²	24	64.2 Å²	64.2	15%	0.147	33%	0.334	C	S	.	.	H	α-helix	trans	-67.6	-41.5	179.8	-59.5	0	0	0	0	112.1	V407 L411 R428 V429 K430 Q435 L436	V407-T432 HydrophobicContact CG1-CG2 3.96Å; L411-T432 HydrophobicContact CD1-CG2 3.98Å; L411-T432 HydrophobicContact CD2-CG2 3.84Å; L411-T432 HydrophobicContact CG-CG2 4.1Å; R428-T432 PolarHBondContact O-N 3.16Å; R428-T432 PolarHBondContact O-OG1 3.11Å; V429-T432 PolarHBondContact O-N 3.45Å; V429-T432 VanDerWaalsContact O-N 3.15Å; K430-T432 PolarHBondContact O-N 3.18Å; T432-Q435 PolarHBondContact O-N 3.41Å; T432-L436 PolarHBondContact O-N 3.43Å
433	V	96.4	Very high	83	Confident	0 Å²	0	70.1 Å²	70.1	0%	0	35%	0.35	C	S	.	.	H	α-helix	trans	-68.1	-37.1	176.8	-176.6	0	0	0	0	111.2	V244 A247 L248 F349 M408 L411 V429 K430 Q435 L436 S437	V244-V433 HydrophobicContact CG1-CG1 4.06Å; A247-V433 HydrophobicContact CB-CG1 4.01Å; L248-V433 HydrophobicContact CB-CG1 3.81Å; L248-V433 HydrophobicContact CD1-CB 4.36Å; L248-V433 HydrophobicContact CD1-CG1 4.46Å; F349-V433 HydrophobicContact CE2-CG2 4.3Å; M408-V433 HydrophobicContact SD-CG2 4.45Å; L411-V433 HydrophobicContact CD1-CG2 3.72Å; V429-V433 HydrophobicContact CG1-CG2 4.27Å; V429-V433 WeakPolarHBondContact O-CG2 3.42Å; V429-V433 PolarHBondContact O-N 3.23Å; K430-V433 PolarHBondContact O-N 3.25Å; V433-Q435 PolarHBondContact O-N 3.34Å; V433-L436 VanDerWaalsContact O-CB 3.29Å; V433-L436 WeakPolarHBondContact O-CB 3.12Å; V433-L436 PolarHBondContact O-N 2.78Å; V433-S437 PolarHBondContact O-N 3.14Å
434	S	94.6	Very high	80	Confident	54 Å²	54	78 Å²	78	38%	0.378	39%	0.393	S	S	.	.	H	α-helix	trans	-64.6	-26.7	174.7	-177.3	0	0	0	0	113.3	K430 K431 L436 S437 A438	K430-S434 WeakPolarHBondContact O-CB 3.41Å; K430-S434 PolarHBondContact O-N 3.06Å; K431-S434 PolarHBondContact O-N 3.5Å; S434-L436 VanDerWaalsContact C-N 3.3Å; S434-S437 PolarHBondContact O-OG 3.16Å; S434-A438 PolarHBondContact O-N 3.24Å
435	Q	91.9	Very high	79.1	Confident	114 Å²	114	80.5 Å²	80.5	53%	0.533	41%	0.406	S	S	.	.	H	α-helix	trans	-71.5	-28.6	172.5	-72.1	169.6	-17.8	0	0	111.6	K431 T432 V433 A438 I439	K431-Q435 WeakPolarHBondContact O-CG 3.44Å; K431-Q435 PolarHBondContact O-N 3Å; K431-Q435 VanDerWaalsContact O-N 3.14Å; T432-Q435 PolarHBondContact O-N 3.41Å; V433-Q435 PolarHBondContact O-N 3.34Å; Q435-A438 PolarHBondContact O-N 3.34Å; Q435-I439 WeakPolarHBondContact O-CD1 3.47Å; Q435-I439 VanDerWaalsContact O-CG1 3.24Å; Q435-I439 WeakPolarHBondContact O-CG1 3.46Å; Q435-I439 PolarHBondContact O-N 3.39Å
436	L	88.3	Confident	78.1	Confident	20 Å²	20	81 Å²	81	11%	0.105	41%	0.405	C	S	.	.	H	α-helix	trans	-68	-33.6	174.7	-68.2	175.8	0	0	0	112.7	V244 V407 T432 V433 S434	V244-L436 HydrophobicContact CG1-CB 4.28Å; V244-L436 HydrophobicContact CG2-CB 4.12Å; V244-L436 HydrophobicContact CG2-CD1 4.43Å; V407-L436 HydrophobicContact CB-CD1 4.04Å; V407-L436 HydrophobicContact CB-CD2 3.85Å; V407-L436 HydrophobicContact CB-CG 4.4Å; V407-L436 HydrophobicContact CG1-CD1 3.76Å; V407-L436 HydrophobicContact CG1-CD2 3.94Å; V407-L436 HydrophobicContact CG1-CG 4.04Å; V407-L436 HydrophobicContact CG2-CD2 3.89Å; T432-L436 PolarHBondContact O-N 3.43Å; V433-L436 VanDerWaalsContact O-CB 3.29Å; V433-L436 WeakPolarHBondContact O-CB 3.12Å; V433-L436 PolarHBondContact O-N 2.78Å; S434-L436 VanDerWaalsContact C-N 3.3Å
437	S	77.6	Confident	77	Confident	44 Å²	44	85.4 Å²	85.4	31%	0.308	43%	0.426	S	S	.	.	H	α-helix	trans	-67.9	-44	174.4	62.3	0	0	0	0	111	V433 S434 I439 K440	V433-S437 PolarHBondContact O-N 3.14Å; S434-S437 PolarHBondContact O-OG 3.16Å; S437-I439 PolarHBondContact O-N 3.25Å; S437-K440 PolarHBondContact O-N 3.21Å
438	A	68.4	Low	75.7	Confident	50 Å²	50	86.2 Å²	86.2	41%	0.413	43%	0.431	S	S	.	.	H	α-helix	trans	-68.3	-28.2	-177.4	0	0	0	0	0	114.7	S434 Q435 K440 D441	S434-A438 PolarHBondContact O-N 3.24Å; Q435-A438 PolarHBondContact O-N 3.34Å; A438-K440 PolarHBondContact O-N 3.3Å; A438-D441 PolarHBondContact O-N 3.39Å
439	I	59.2	Low	74.3	Confident	87 Å²	87	83 Å²	83	45%	0.446	43%	0.425	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.5	-21.6	178.6	-72.2	163.2	0	0	0	112	Q435 S437	Q435-I439 WeakPolarHBondContact O-CD1 3.47Å; Q435-I439 VanDerWaalsContact O-CG1 3.24Å; Q435-I439 WeakPolarHBondContact O-CG1 3.46Å; Q435-I439 PolarHBondContact O-N 3.39Å; S437-I439 PolarHBondContact O-N 3.25Å
440	K	52.1	Low	72.7	Confident	92 Å²	92	88.5 Å²	88.5	40%	0.4	45%	0.453	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.2	-38.2	-179.6	-157.9	-176.5	170.8	-156.6	0	111.9	E241 S437 A438 M442 K443 D444	E241-K440 IonicContact OE2-NZ 2.72Å; E241-K440 PolarHBondContact OE2-NZ 3.48Å; S437-K440 PolarHBondContact O-N 3.21Å; A438-K440 PolarHBondContact O-N 3.3Å; K440-M442 PolarHBondContact O-N 2.97Å; K440-K443 PolarHBondContact O-N 3.47Å; K440-D444 PolarHBondContact O-N 2.98Å
441	D	49.1	Very low	70.8	Confident	127 Å²	127	89.9 Å²	89.9	68%	0.679	46%	0.464	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.9	-10.9	177.7	-61.1	-24.1	0	0	0	114.1	A438	A438-D441 PolarHBondContact O-N 3.39Å
442	M	40.8	Very low	68.7	Low	168 Å²	168	87.2 Å²	87.2	83%	0.828	46%	0.458	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.2	-4.7	174.9	-65.7	-171.6	69.4	0	0	114	K440	K440-M442 PolarHBondContact O-N 2.97Å
443	K	41.4	Very low	66.4	Low	174 Å²	174	92.5 Å²	92.5	76%	0.757	48%	0.484	S	S	*	.	T	Hydrogen-bonded Turn	trans	-115.5	-7.7	-176.2	-77.7	-173.4	176.5	-178.9	0	114.2	K440	K440-K443 PolarHBondContact O-N 3.47Å
444	D	36.8	Very low	63.6	Low	180 Å²	180	100.9 Å²	100.9	96%	0.963	53%	0.528	S	S	*	.			trans	-96.2	0	161.8	-62.3	-30.9	0	0	0	108.4	K440	K440-D444 PolarHBondContact O-N 2.98Å

Retrieved 444 of 444 residues in 802.5 ms (Link to these results)

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