A0A087XMU4_POEFO Loading...

ATP-dependent RNA helicase

RNA helicase.

AlphaFold DB , UniProt , Accession A0A087XMU4, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 642 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	34.4	Very low	29.6	Very low	218 Å²	218	134.6 Å²	134.6	100%	1.074	79%	0.789	S	S	*	*				0	55.3	0	-52.1	173.1	-171	0	0	107.7
2	E	29.9	Very low	29.3	Very low	165 Å²	165	136 Å²	136	77%	0.771	79%	0.789	S	S	*	*				71.8	120.5	68.3	-66.5	148.1	124.3	0	0	111.1
3	S	29.5	Very low	29	Very low	119 Å²	119	137 Å²	137	83%	0.832	80%	0.798	S	S	*	*			cis	82.4	143	36.3	82.8	0	0	0	0	114.8
4	G	29.5	Very low	28.6	Very low	65 Å²	65	134.4 Å²	134.4	67%	0.67	79%	0.791	S	S	*	*			trans	114	87.1	-165.7	0	0	0	0	0	110.7
5	T	32	Very low	30	Very low	138 Å²	138	132.2 Å²	132.2	85%	0.847	78%	0.782	S	S	*	*			cis	61.8	109	39.9	64	0	0	0	0	116.5
6	K	29.3	Very low	29.7	Very low	196 Å²	196	138.2 Å²	138.2	85%	0.852	79%	0.787	S	S	*	*			trans	-164.7	107.7	150.6	-101.2	166.6	-176.7	-179.6	0	107.6
7	T	29.3	Very low	29.6	Very low	114 Å²	114	143.3 Å²	143.3	70%	0.699	79%	0.791	S	S	*	*				63.2	106.9	98.6	58.8	0	0	0	0	113.9
8	C	27.1	Very low	29.5	Very low	122 Å²	122	142.3 Å²	142.3	82%	0.824	79%	0.789	S	S	*	*				78.7	143.9	80.6	-71.3	0	0	0	0	112.5
9	E	30	Very low	29.4	Very low	171 Å²	171	141.9 Å²	141.9	80%	0.799	79%	0.785	S	S	*	*			cis	-149.5	172.6	8.2	-104.6	-104.3	80.2	0	0	107.7
10	S	27.7	Very low	29.1	Very low	93 Å²	93	141.8 Å²	141.8	65%	0.65	78%	0.783	S	S	*	*			cis	-145.1	-152.6	7.3	55.3	0	0	0	0	108.6
11	A	26.8	Very low	28.9	Very low	80 Å²	80	140 Å²	140	66%	0.661	78%	0.78	S	S	*	*			cis	-157	151.6	1.5	0	0	0	0	0	106.8
12	L	25.7	Very low	28.4	Very low	151 Å²	151	133.3 Å²	133.3	79%	0.791	77%	0.767	S	S	*	*				87	82.5	51.3	-76.1	178.5	0	0	0	117.2
13	V	25.5	Very low	28.2	Very low	149 Å²	149	131.5 Å²	131.5	90%	0.903	77%	0.767	S	S	*	*				-145	149.3	127.9	-179.4	0	0	0	0	108.3
14	S	24.2	Very low	28.4	Very low	100 Å²	100	134.5 Å²	134.5	70%	0.699	77%	0.768	S	S	*	*			trans	-156.1	-171.3	177.9	73.3	0	0	0	0	109.3
15	P	49	Very low	28.1	Very low	102 Å²	102	143.5 Å²	143.5	66%	0.662	78%	0.782	S	S	*	*			cis	-136.3	179.9	-9.4	37.7	-19.6	0	0	0	114.7
16	R	25.7	Very low	28.2	Very low	228 Å²	228	146.6 Å²	146.6	86%	0.86	78%	0.783	S	S	*	*				180	111.8	116.5	-96.4	170.4	-169.1	-146.3	2.4	115.4
17	R	27.6	Very low	27.9	Very low	225 Å²	225	146.8 Å²	146.8	85%	0.849	79%	0.785	S	S	*	*			trans	55.9	124.1	136.9	-70.2	-171.1	174.4	-172.5	-1.9	122.6
18	V	28.1	Very low	27.6	Very low	125 Å²	125	147.6 Å²	147.6	76%	0.758	79%	0.789	S	S	*	*				66.8	125.7	124.3	177.5	0	0	0	0	116.9
19	N	26.8	Very low	27.6	Very low	135 Å²	135	151 Å²	151	72%	0.722	79%	0.793	S	S	*	*			cis	-153.6	-171.7	9.8	-139	10.8	0	0	0	109.6
20	N	23.9	Very low	27.2	Very low	139 Å²	139	154.5 Å²	154.5	74%	0.743	80%	0.798	S	S	*	*			cis	-151.6	-178.5	4.8	-159.7	0.4	0	0	0	110.5
21	C	25	Very low	27.2	Very low	105 Å²	105	155 Å²	155	71%	0.709	81%	0.807	S	S	*	*			trans	-95.1	160.7	174.7	-168.1	0	0	0	0	113.9
22	G	24.7	Very low	27.1	Very low	78 Å²	78	160 Å²	160	80%	0.804	82%	0.818	S	S	*	*			trans	-174.9	90.9	173.8	0	0	0	0	0	114.3
23	T	25.1	Very low	27.1	Very low	126 Å²	126	163.7 Å²	163.7	77%	0.773	82%	0.821	S	S	*	*			trans	-99.6	154.2	-175	-41.4	0	0	0	0	113.6
24	Q	33.1	Very low	27.3	Very low	183 Å²	183	162.8 Å²	162.8	86%	0.855	82%	0.818	S	S	*	*			trans	-35.3	143.1	-177.1	-57.5	176.2	-4.4	0	0	118.3
25	R	23.6	Very low	27.5	Very low	253 Å²	253	163.1 Å²	163.1	96%	0.955	82%	0.819	S	S	*	*			trans	-152.2	144.8	148.7	-110.6	173.8	-178.5	-173.4	0.1	111.9
26	K	33.7	Very low	26.7	Very low	203 Å²	203	162.2 Å²	162.2	88%	0.883	82%	0.82	S	S	*	*			trans	-75.5	146.2	174.6	-59.8	175.2	178.9	177.5	0	111.2
27	K	23.2	Very low	27.3	Very low	201 Å²	201	157.6 Å²	157.6	87%	0.874	81%	0.812	S	S	*	*			trans	-169.2	135.9	147.9	-111.5	169.4	-177	-174.9	0	114.6
28	V	23.1	Very low	27.7	Very low	131 Å²	131	151.1 Å²	151.1	79%	0.794	80%	0.802	S	S	*	*			trans	37.4	119.8	146.8	-178.2	0	0	0	0	119.7
29	H	26.4	Very low	28.1	Very low	194 Å²	194	150.1 Å²	150.1	90%	0.898	80%	0.796	S	S	*	*			trans	-70.9	134.3	162.3	-74	-63.6	0	0	0	112.4
30	R	23.4	Very low	28.5	Very low	244 Å²	244	146.9 Å²	146.9	92%	0.921	78%	0.784	S	S	*	*			trans	-140.2	150	154.5	-147.6	173.6	-171.6	-177	1.9	107.9
31	A	27.3	Very low	29.4	Very low	102 Å²	102	144.5 Å²	144.5	84%	0.843	77%	0.774	S	S	*	*			trans	-74	142.6	-163.3	0	0	0	0	0	114.3
32	E	25	Very low	30	Very low	187 Å²	187	145 Å²	145	87%	0.874	77%	0.769	S	S	*	*			trans	-117.1	175.1	166.5	-69.2	-153.4	123.2	0	0	111.9
33	R	25.8	Very low	30.6	Very low	228 Å²	228	145.8 Å²	145.8	86%	0.86	75%	0.754	S	S	*	*	P	Polyproline II helix	trans	-88.1	145	-153.7	-49.9	173.7	-163.5	-169.8	2.7	112.7
34	P	29.2	Very low	31.2	Very low	130 Å²	130	144.9 Å²	144.9	84%	0.844	74%	0.744	S	S	*	*	P	Polyproline II helix	trans	-67.3	136.8	172	28.8	-34	0	0	0	111.3
35	C	28.3	Very low	31.5	Very low	106 Å²	106	144.6 Å²	144.6	72%	0.716	74%	0.735	S	S	*	*	P	Polyproline II helix	trans	-73.1	148.7	-173	-65.7	0	0	0	0	113.8	N37	C35-N37 PolarHBondContact O-N 3.04Å
36	A	31.7	Very low	32.1	Very low	83 Å²	83	137 Å²	137	69%	0.686	71%	0.713	S	S	*	*	T	Hydrogen-bonded Turn	trans	-61.8	-14.7	-177.6	0	0	0	0	0	115.5	S38 V39	A36-S38 PolarHBondContact O-N 3.47Å; A36-S38 VanDerWaalsContact O-N 3.16Å; A36-V39 PolarHBondContact O-N 3.42Å
37	N	38.1	Very low	32.1	Very low	131 Å²	131	131.8 Å²	131.8	70%	0.701	70%	0.695	S	S	*	*	H	α-helix	trans	-64.4	-19.9	-175.8	-70.6	1.3	0	0	0	114.4	C35 V41	C35-N37 PolarHBondContact O-N 3.04Å; N37-V41 PolarHBondContact O-N 3.16Å
38	S	35.3	Very low	32.6	Very low	90 Å²	90	131.1 Å²	131.1	63%	0.629	69%	0.687	S	S	*	*	H	α-helix	trans	-64.9	-43.3	176.2	-172.6	0	0	0	0	112.1	A36 S40 V41 L42	A36-S38 PolarHBondContact O-N 3.47Å; A36-S38 VanDerWaalsContact O-N 3.16Å; S38-S40 PolarHBondContact O-N 3.01Å; S38-V41 PolarHBondContact O-N 3.33Å; S38-L42 PolarHBondContact O-N 3.27Å
39	V	36.5	Very low	33.1	Very low	103 Å²	103	130.1 Å²	130.1	62%	0.624	68%	0.676	S	S	*	*	H	α-helix	trans	-64.7	-41	-176.3	-176.6	0	0	0	0	110.9	A36 V41 L42 L43	A36-V39 PolarHBondContact O-N 3.42Å; V39-V41 PolarHBondContact O-N 2.81Å; V39-L42 PolarHBondContact O-N 3.47Å; V39-L43 WeakPolarHBondContact O-CB 3.29Å; V39-L43 PolarHBondContact O-N 3.32Å
40	S	37	Very low	33.3	Very low	67 Å²	67	125.6 Å²	125.6	47%	0.469	66%	0.658	S	S	.	*	H	α-helix	trans	-66.2	-37.5	-179.7	-164	0	0	0	0	112.5	S38 L44	S38-S40 PolarHBondContact O-N 3.01Å; S40-L44 VanDerWaalsContact O-CB 3.29Å; S40-L44 WeakPolarHBondContact O-CB 3.49Å; S40-L44 VanDerWaalsContact O-CG 3.31Å; S40-L44 WeakPolarHBondContact O-CG 3.44Å; S40-L44 PolarHBondContact O-N 2.77Å
41	V	42.5	Very low	33.8	Very low	90 Å²	90	116.2 Å²	116.2	55%	0.545	63%	0.63	S	S	.	*	H	α-helix	trans	-71.2	-37.8	175.2	177.6	0	0	0	0	111.7	N37 S38 V39 R45	N37-V41 PolarHBondContact O-N 3.16Å; S38-V41 PolarHBondContact O-N 3.33Å; V39-V41 PolarHBondContact O-N 2.81Å; V41-R45 WeakPolarHBondContact O-CB 3.22Å; V41-R45 PolarHBondContact O-N 3.24Å
42	L	37.7	Very low	34.4	Very low	115 Å²	115	114.8 Å²	114.8	60%	0.602	61%	0.608	S	S	*	*	H	α-helix	trans	-67.7	-42.1	175.6	-154.5	78.1	0	0	0	111.2	S38 V39 R45 L46	S38-L42 PolarHBondContact O-N 3.27Å; V39-L42 PolarHBondContact O-N 3.47Å; L42-R45 CarbonylContact O-C 3.58Å; L42-R45 WeakPolarHBondContact O-CB 3.31Å; L42-R45 PolarHBondContact O-N 2.98Å; L42-L46 PolarHBondContact O-N 3.45Å
43	L	36.9	Very low	34.9	Very low	94 Å²	94	109.8 Å²	109.8	49%	0.492	59%	0.585	S	S	.	*	H	α-helix	trans	-67.2	-39.7	176.5	-173.3	64.4	0	0	0	111.8	V39 R45 L46 L47	V39-L43 WeakPolarHBondContact O-CB 3.29Å; V39-L43 PolarHBondContact O-N 3.32Å; L43-R45 VanDerWaalsContact C-N 3.31Å; L43-R45 PolarHBondContact O-N 2.87Å; L43-L46 PolarHBondContact O-N 3.46Å; L43-L47 HydrophobicContact CG-CD1 4.07Å; L43-L47 HydrophobicContact CG-CG 4.45Å; L43-L47 WeakPolarHBondContact O-CB 3.29Å; L43-L47 VanDerWaalsContact O-CG 3.29Å; L43-L47 WeakPolarHBondContact O-CG 3.33Å; L43-L47 PolarHBondContact O-N 3.18Å
44	L	38.3	Very low	35.5	Very low	107 Å²	107	105.6 Å²	105.6	56%	0.56	58%	0.576	S	S	*	*	H	α-helix	trans	-66.6	-30.9	172.2	-78.8	166.7	0	0	0	112.7	S40 R48	S40-L44 VanDerWaalsContact O-CB 3.29Å; S40-L44 WeakPolarHBondContact O-CB 3.49Å; S40-L44 VanDerWaalsContact O-CG 3.31Å; S40-L44 WeakPolarHBondContact O-CG 3.44Å; S40-L44 PolarHBondContact O-N 2.77Å; L44-R48 WeakPolarHBondContact O-CB 3.47Å; L44-R48 PolarHBondContact O-N 2.82Å
45	R	38.5	Very low	36.3	Very low	177 Å²	177	103 Å²	103	67%	0.668	56%	0.555	S	S	*	*	H	α-helix	trans	-69.7	-40.4	168.1	-86.5	-177.1	166.9	-179.2	-3.1	112	V41 L42 L43 R48 L49	V41-R45 WeakPolarHBondContact O-CB 3.22Å; V41-R45 PolarHBondContact O-N 3.24Å; L42-R45 CarbonylContact O-C 3.58Å; L42-R45 WeakPolarHBondContact O-CB 3.31Å; L42-R45 PolarHBondContact O-N 2.98Å; L43-R45 VanDerWaalsContact C-N 3.31Å; L43-R45 PolarHBondContact O-N 2.87Å; R45-R48 PolarHBondContact O-N 2.86Å; R45-L49 WeakPolarHBondContact O-CB 3.33Å; R45-L49 VanDerWaalsContact O-CG 3.3Å; R45-L49 WeakPolarHBondContact O-CG 3.4Å; R45-L49 PolarHBondContact O-N 3.02Å
46	L	36.2	Very low	37.5	Very low	94 Å²	94	100.5 Å²	100.5	49%	0.492	53%	0.534	S	S	.	.	H	α-helix	trans	-67	-46.2	178.3	-142.5	79.1	0	0	0	111.2	L42 L43 R48 L49 L50	L42-L46 PolarHBondContact O-N 3.45Å; L43-L46 PolarHBondContact O-N 3.46Å; L46-R48 VanDerWaalsContact C-N 3.33Å; L46-R48 PolarHBondContact O-N 2.88Å; L46-L49 CarbonylContact O-C 3.58Å; L46-L49 WeakPolarHBondContact O-CA 3.48Å; L46-L49 WeakPolarHBondContact O-CB 3.3Å; L46-L49 PolarHBondContact O-N 2.83Å; L46-L50 VanDerWaalsContact O-CG 3.3Å; L46-L50 WeakPolarHBondContact O-CG 3.3Å; L46-L50 PolarHBondContact O-N 3.22Å
47	L	32.8	Very low	38.8	Very low	94 Å²	94	98 Å²	98	49%	0.492	51%	0.51	S	S	.	.	H	α-helix	trans	-60.7	-40.1	173.3	-72.4	168.2	0	0	0	111.5	L43 L50 S51	L43-L47 HydrophobicContact CG-CD1 4.07Å; L43-L47 HydrophobicContact CG-CG 4.45Å; L43-L47 WeakPolarHBondContact O-CB 3.29Å; L43-L47 VanDerWaalsContact O-CG 3.29Å; L43-L47 WeakPolarHBondContact O-CG 3.33Å; L43-L47 PolarHBondContact O-N 3.18Å; L47-L50 PolarHBondContact O-N 3.4Å; L47-S51 WeakPolarHBondContact O-CB 3.48Å; L47-S51 PolarHBondContact O-N 3.23Å; L47-S51 PolarHBondContact O-OG 3.43Å
48	R	34.5	Very low	40.2	Very low	187 Å²	187	95.4 Å²	95.4	71%	0.706	50%	0.496	S	S	*	.	H	α-helix	trans	-64.6	-35.4	170	-92.1	-175.3	165.4	173.8	-2.7	113.3	L44 R45 L46 S51 N52	L44-R48 WeakPolarHBondContact O-CB 3.47Å; L44-R48 PolarHBondContact O-N 2.82Å; R45-R48 PolarHBondContact O-N 2.86Å; L46-R48 VanDerWaalsContact C-N 3.33Å; L46-R48 PolarHBondContact O-N 2.88Å; R48-S51 PolarHBondContact O-OG 3.42Å; R48-N52 WeakPolarHBondContact O-CB 3.34Å; R48-N52 PolarHBondContact O-N 3.05Å; R48-N52 PolarHBondContact O-ND2 3.42Å; R48-N52 PolarHBondContact O-OD1 2.86Å
49	L	33.9	Very low	42.1	Very low	110 Å²	110	92.5 Å²	92.5	58%	0.576	48%	0.481	S	S	*	.	H	α-helix	trans	-70.4	-39.2	176.6	-76.3	163.4	0	0	0	111.4	R45 L46 N52 M53	R45-L49 WeakPolarHBondContact O-CB 3.33Å; R45-L49 VanDerWaalsContact O-CG 3.3Å; R45-L49 WeakPolarHBondContact O-CG 3.4Å; R45-L49 PolarHBondContact O-N 3.02Å; L46-L49 CarbonylContact O-C 3.58Å; L46-L49 WeakPolarHBondContact O-CA 3.48Å; L46-L49 WeakPolarHBondContact O-CB 3.3Å; L46-L49 PolarHBondContact O-N 2.83Å; L49-N52 WeakPolarHBondContact O-CB 3.31Å; L49-N52 PolarHBondContact O-N 3.15Å; L49-M53 PolarHBondContact O-N 3.03Å
50	L	31.1	Very low	44.3	Very low	98 Å²	98	90 Å²	90	51%	0.513	47%	0.466	S	S	.	.	H	α-helix	trans	-66.3	-49.4	174.7	-67.6	164.2	0	0	0	111.2	L46 L47 N52 M53 E54	L46-L50 VanDerWaalsContact O-CG 3.3Å; L46-L50 WeakPolarHBondContact O-CG 3.3Å; L46-L50 PolarHBondContact O-N 3.22Å; L47-L50 PolarHBondContact O-N 3.4Å; L50-N52 PolarHBondContact O-N 2.88Å; L50-M53 WeakPolarHBondContact O-CB 3.49Å; L50-M53 PolarHBondContact O-N 3.18Å; L50-E54 PolarHBondContact O-N 2.96Å
51	S	33.5	Very low	46.7	Very low	47 Å²	47	87.6 Å²	87.6	33%	0.329	45%	0.446	S	S	.	.	H	α-helix	trans	-65.1	-20.4	174.7	74.8	0	0	0	0	113.5	L47 R48 E54 N55	L47-S51 WeakPolarHBondContact O-CB 3.48Å; L47-S51 PolarHBondContact O-N 3.23Å; L47-S51 PolarHBondContact O-OG 3.43Å; R48-S51 PolarHBondContact O-OG 3.42Å; S51-E54 WeakPolarHBondContact CA-OE2 3.47Å; S51-N55 PolarHBondContact O-ND2 2.84Å
52	N	39.2	Very low	48.6	Very low	73 Å²	73	89.4 Å²	89.4	39%	0.39	45%	0.453	S	S	.	.	H	α-helix	trans	-78.3	-17.7	170.8	-77.1	-22.1	0	0	0	113	R48 L49 L50 I56	R48-N52 WeakPolarHBondContact O-CB 3.34Å; R48-N52 PolarHBondContact O-N 3.05Å; R48-N52 PolarHBondContact O-ND2 3.42Å; R48-N52 PolarHBondContact O-OD1 2.86Å; L49-N52 WeakPolarHBondContact O-CB 3.31Å; L49-N52 PolarHBondContact O-N 3.15Å; L50-N52 PolarHBondContact O-N 2.88Å; N52-I56 WeakPolarHBondContact O-CD1 3.46Å
53	M	36.4	Very low	50.8	Low	81 Å²	81	87.5 Å²	87.5	40%	0.399	45%	0.449	S	S	.	.	H	α-helix	trans	-87.2	-38.4	173.6	-67	-150.8	66.4	0	0	112.3	L49 L50 N55 I56 T57 Y83	L49-M53 PolarHBondContact O-N 3.03Å; L50-M53 WeakPolarHBondContact O-CB 3.49Å; L50-M53 PolarHBondContact O-N 3.18Å; M53-N55 PolarHBondContact O-N 3.26Å; M53-I56 PolarHBondContact O-N 3.18Å; M53-T57 HydrophobicContact CE-CG2 4.05Å; M53-T57 PolarHBondContact O-N 3.35Å; M53-T57 PolarHBondContact O-OG1 3.48Å; M53-Y83 HydrophobicContact CE-CD2 3.77Å; M53-Y83 HydrophobicContact CE-CE2 3.8Å; M53-Y83 HydrophobicContact SD-CE2 4.5Å
54	E	38.5	Very low	53.1	Low	141 Å²	141	83.8 Å²	83.8	66%	0.659	43%	0.43	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.7	-20.6	178.8	-67.7	173.6	157.6	0	0	114.9	L50 S51	L50-E54 PolarHBondContact O-N 2.96Å; S51-E54 WeakPolarHBondContact CA-OE2 3.47Å
55	N	46.1	Very low	55.3	Low	76 Å²	76	84 Å²	84	41%	0.406	44%	0.437	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93.9	-6.5	177.9	-68.7	-74.5	0	0	0	114.1	S51 M53 K280	S51-N55 PolarHBondContact O-ND2 2.84Å; M53-N55 PolarHBondContact O-N 3.26Å; N55-K280 PolarHBondContact OD1-O 3.11Å
56	I	53.3	Low	57.5	Low	53 Å²	53	76.5 Å²	76.5	27%	0.272	41%	0.412	S	S	.	.	T	Hydrogen-bonded Turn	trans	-117.8	-29.8	-174.2	-58	173.6	0	0	0	111.2	N52 M53 P86	N52-I56 WeakPolarHBondContact O-CD1 3.46Å; M53-I56 PolarHBondContact O-N 3.18Å; I56-P86 VanDerWaalsContact O-CD 3.26Å; I56-P86 WeakPolarHBondContact O-CD 3.18Å
57	T	58.1	Low	60	Low	30 Å²	30	80.5 Å²	80.5	18%	0.184	43%	0.427	C	S	.	.			trans	-121.8	135.8	-172.6	55.7	0	0	0	0	112.9	M53 Y83 M84	M53-T57 HydrophobicContact CE-CG2 4.05Å; M53-T57 PolarHBondContact O-N 3.35Å; M53-T57 PolarHBondContact O-OG1 3.48Å; T57-Y83 VanDerWaalsContact CG2-CB 3.44Å; T57-Y83 HydrophobicContact CG2-CD2 4.22Å; T57-Y83 HydrophobicContact CG2-CG 4Å; T57-M84 CarbonylContact C-O 3.59Å; T57-M84 WeakPolarHBondContact CA-O 3.36Å
58	D	67.1	Low	62.7	Low	76 Å²	76	77 Å²	77	41%	0.406	41%	0.409	S	S	.	.			trans	-116.5	51.9	-173.8	-155.4	40.9	0	0	0	111	M84 P86 S89	D58-M84 PolarHBondContact N-O 2.94Å; D58-M84 WeakPolarHBondContact O-CE 3.19Å; D58-P86 HydrophobicContact CB-CB 4.29Å; D58-P86 HydrophobicContact CB-CG 4.05Å; D58-S89 VanDerWaalsContact OD2-CB 3.29Å; D58-S89 WeakPolarHBondContact OD2-CB 3.46Å; D58-S89 PolarHBondContact OD2-OG 2.95Å
59	G	75.2	Confident	65.4	Low	30 Å²	30	71.1 Å²	71.1	31%	0.309	39%	0.392	S	S	.	.			trans	97.8	175.8	-178.7	0	0	0	0	0	115.6	M84	G59-M84 PolarHBondContact O-N 3.08Å
60	T	84.1	Confident	68.2	Low	51 Å²	51	72.9 Å²	72.9	31%	0.313	40%	0.397	S	S	.	.			trans	-85.7	164.2	166.7	65.1	0	0	0	0	109.7	D62 S63 Y83 M84	T60-D62 WeakPolarHBondContact CB-OD2 3.25Å; T60-D62 PolarHBondContact O-N 3.33Å; T60-D62 VanDerWaalsContact O-N 3.15Å; T60-D62 PolarHBondContact OG1-OD2 2.99Å; T60-S63 PolarHBondContact O-N 3.26Å; T60-S63 PolarHBondContact O-OG 2.84Å; T60-Y83 HydrophobicContact CG2-CD1 3.86Å; T60-Y83 HydrophobicContact CG2-CE1 3.85Å; T60-M84 VanDerWaalsContact O-CE 3.25Å; T60-M84 WeakPolarHBondContact O-CE 3.26Å
61	W	86.1	Confident	71.1	Confident	16 Å²	16	71.7 Å²	71.7	6%	0.061	39%	0.388	C	S	.	.	G	3₁₀ helix	trans	-60.5	-26.6	-178.6	-59.1	94.4	0	0	0	113.4	S63 L64 L68 L73 L76 F81 M84 Q88 I92 L113 I117	W61-S63 VanDerWaalsContact C-N 3.28Å; W61-S63 PolarHBondContact O-N 3.01Å; W61-L64 HydrophobicContact CE3-CD1 4.33Å; W61-L64 WeakPolarHBondContact O-CB 3.49Å; W61-L64 WeakPolarHBondContact O-CG 3.47Å; W61-L64 PolarHBondContact O-N 2.99Å; W61-L68 HydrophobicContact CE3-CD1 4.08Å; W61-L73 HydrophobicContact CB-CD2 3.64Å; W61-L73 HydrophobicContact CG-CD2 4.33Å; W61-L76 HydrophobicContact CD2-CD1 3.67Å; W61-L76 HydrophobicContact CE3-CD1 3.85Å; W61-L76 HydrophobicContact CG-CD1 4.16Å; W61-L76 HydrophobicContact CH2-CD1 4.25Å; W61-L76 HydrophobicContact CH2-CD2 4.09Å; W61-L76 HydrophobicContact CZ2-CD1 4.08Å; W61-L76 HydrophobicContact CZ2-CD2 3.78Å; W61-L76 HydrophobicContact CZ2-CG 4.46Å; W61-L76 HydrophobicContact CZ3-CD1 4.14Å; W61-F81 PolarHBondContact NE1-O 2.92Å; W61-M84 HydrophobicContact CD2-CG 3.5Å; W61-M84 VanDerWaalsContact CD2-CG 3.5Å; W61-M84 HydrophobicContact CD2-SD 4.19Å; W61-M84 HydrophobicContact CE3-CG 3.43Å; W61-M84 VanDerWaalsContact CE3-CG 3.43Å; W61-M84 HydrophobicContact CE3-SD 3.7Å; W61-M84 HydrophobicContact CG-CG 4.15Å; W61-M84 HydrophobicContact CH2-CG 3.9Å; W61-M84 HydrophobicContact CZ2-CG 3.95Å; W61-M84 HydrophobicContact CZ3-CG 3.65Å; W61-M84 HydrophobicContact CZ3-SD 4.07Å; W61-Q88 HydrophobicContact CH2-CB 4.49Å; W61-I92 HydrophobicContact CZ3-CD1 3.84Å; W61-L113 HydrophobicContact CH2-CD1 4.42Å; W61-I117 HydrophobicContact CE3-CD1 4.21Å; W61-I117 HydrophobicContact CH2-CD1 3.75Å; W61-I117 HydrophobicContact CZ3-CD1 3.39Å
62	D	82.6	Confident	73.9	Confident	128 Å²	128	69.4 Å²	69.4	68%	0.684	37%	0.372	S	S	*	.	G	3₁₀ helix	trans	-70.3	-21.4	178.1	-30.4	-86.6	0	0	0	112.9	T60 L64	T60-D62 WeakPolarHBondContact CB-OD2 3.25Å; T60-D62 PolarHBondContact O-N 3.33Å; T60-D62 VanDerWaalsContact O-N 3.15Å; T60-D62 PolarHBondContact OG1-OD2 2.99Å; D62-L64 PolarHBondContact O-N 3Å
63	S	84.3	Confident	76.4	Confident	75 Å²	75	68.4 Å²	68.4	52%	0.524	37%	0.366	S	S	.	.	G	3₁₀ helix	trans	-85.1	10.6	175.6	72.3	0	0	0	0	113.5	T60 W61	T60-S63 PolarHBondContact O-N 3.26Å; T60-S63 PolarHBondContact O-OG 2.84Å; W61-S63 VanDerWaalsContact C-N 3.28Å; W61-S63 PolarHBondContact O-N 3.01Å
64	L	84.9	Confident	79	Confident	16 Å²	16	68.7 Å²	68.7	8%	0.084	37%	0.367	C	S	.	.	S	Bend	trans	-70.2	140	168.7	-76.8	172.3	0	0	0	110.9	W61 D62 V66 L68 M84 I92 P93	W61-L64 HydrophobicContact CE3-CD1 4.33Å; W61-L64 WeakPolarHBondContact O-CB 3.49Å; W61-L64 WeakPolarHBondContact O-CG 3.47Å; W61-L64 PolarHBondContact O-N 2.99Å; D62-L64 PolarHBondContact O-N 3Å; L64-V66 HydrophobicContact CB-CG2 4.27Å; L64-V66 WeakPolarHBondContact CB-O 3.41Å; L64-V66 PolarHBondContact O-N 2.86Å; L64-L68 HydrophobicContact CD1-CD1 3.67Å; L64-L68 HydrophobicContact CD1-CD2 4.32Å; L64-L68 HydrophobicContact CD1-CG 3.95Å; L64-M84 HydrophobicContact CD1-SD 3.77Å; L64-M84 HydrophobicContact CD2-CE 3.85Å; L64-M84 HydrophobicContact CD2-SD 3.49Å; L64-M84 WeakPolarHBondContact CD2-SD 3.36Å; L64-M84 HydrophobicContact CG-CE 3.86Å; L64-M84 HydrophobicContact CG-SD 3.47Å; L64-M84 WeakPolarHBondContact CG-SD 3.34Å; L64-I92 HydrophobicContact CD1-CG2 4.17Å; L64-P93 HydrophobicContact CD2-CG 3.89Å
65	P	84.8	Confident	81.5	Confident	110 Å²	110	62.1 Å²	62.1	71%	0.714	34%	0.336	S	S	*	.	S	Bend	trans	-73.4	10.5	171.5	33.6	-37.8	0	0	0	113.2	P93	P65-P93 HydrophobicContact CG-CB 3.87Å; P65-P93 HydrophobicContact CG-CG 3.74Å
66	V	85.6	Confident	83.6	Confident	21 Å²	21	58.5 Å²	58.5	13%	0.127	32%	0.317	C	S	.	.	S	Bend	trans	-134.4	129.3	176.7	-68.5	0	0	0	0	108.8	L64 L68 I92 P93 M96	L64-V66 HydrophobicContact CB-CG2 4.27Å; L64-V66 WeakPolarHBondContact CB-O 3.41Å; L64-V66 PolarHBondContact O-N 2.86Å; V66-L68 PolarHBondContact O-N 3.05Å; V66-I92 HydrophobicContact CG2-CG2 4.38Å; V66-P93 HydrophobicContact CG1-CB 4.18Å; V66-P93 HydrophobicContact CG2-CB 4.18Å; V66-P93 HydrophobicContact CG2-CG 4.14Å; V66-M96 HydrophobicContact CB-CE 4.02Å; V66-M96 HydrophobicContact CB-SD 4.37Å; V66-M96 HydrophobicContact CG2-CE 4.01Å; V66-M96 HydrophobicContact CG2-SD 3.73Å
67	Q	87.2	Confident	85.3	Confident	177 Å²	177	63.3 Å²	63.3	83%	0.827	34%	0.338	S	S	*	.	P	Polyproline II helix	trans	-73.2	128.8	175.9	-71.1	179.4	-15.5	0	0	110.7	K125	Q67-K125 PolarHBondContact O-NZ 3.23Å
68	L	89.9	Confident	86.8	Confident	21 Å²	21	67.8 Å²	67.8	11%	0.11	36%	0.357	C	S	.	.	P	Polyproline II helix	trans	-93.6	152.7	171.9	-59.3	-175.9	0	0	0	110.5	W61 L64 V66 L73 I92 M96 I117 E121	W61-L68 HydrophobicContact CE3-CD1 4.08Å; L64-L68 HydrophobicContact CD1-CD1 3.67Å; L64-L68 HydrophobicContact CD1-CD2 4.32Å; L64-L68 HydrophobicContact CD1-CG 3.95Å; V66-L68 PolarHBondContact O-N 3.05Å; L68-L73 HydrophobicContact CB-CD2 4.23Å; L68-L73 HydrophobicContact CB-CG 4.38Å; L68-L73 HydrophobicContact CD1-CD2 4.09Å; L68-I92 HydrophobicContact CD2-CG2 4.29Å; L68-M96 HydrophobicContact CD2-CE 4.03Å; L68-M96 HydrophobicContact CD2-SD 3.75Å; L68-I117 HydrophobicContact CD1-CG2 4.02Å; L68-I117 HydrophobicContact CD2-CG2 3.72Å; L68-E121 HydrophobicContact CD2-CG 4Å
69	N	92.3	Very high	87.7	Confident	63 Å²	63	66 Å²	66	34%	0.337	35%	0.346	S	S	.	.	P	Polyproline II helix	trans	-66.4	136.8	174.4	-171.1	-82.4	0	0	0	111.7	K71 I72 L73 E121 L124	N69-K71 PolarHBondContact O-N 3.5Å; N69-K71 VanDerWaalsContact O-N 3.12Å; N69-K71 WeakPolarHBondContact OD1-CB 3.25Å; N69-K71 PolarHBondContact OD1-N 2.75Å; N69-K71 VanDerWaalsContact OD1-N 3.08Å; N69-I72 HydrophobicContact CB-CD1 4.36Å; N69-I72 HydrophobicContact CB-CG1 4.3Å; N69-I72 WeakPolarHBondContact O-CA 3.35Å; N69-I72 WeakPolarHBondContact O-CB 3.48Å; N69-I72 PolarHBondContact O-N 3.31Å; N69-L73 PolarHBondContact O-N 3.44Å; N69-E121 WeakPolarHBondContact CB-OE1 3.41Å; N69-E121 PolarHBondContact N-OE1 3.3Å; N69-L124 HydrophobicContact CB-CD1 4.37Å
70	E	91.7	Very high	88.3	Confident	147 Å²	147	72.9 Å²	72.9	69%	0.687	37%	0.368	S	S	*	.	H	α-helix	trans	-51.6	-37.8	-178.9	-63.2	176.5	179	0	0	113.5	I72 L73 Q74	E70-I72 VanDerWaalsContact C-N 3.28Å; E70-I72 PolarHBondContact O-N 3.03Å; E70-L73 PolarHBondContact O-N 3.25Å; E70-Q74 VanDerWaalsContact O-CG 3.31Å; E70-Q74 WeakPolarHBondContact O-CG 3.48Å; E70-Q74 PolarHBondContact O-N 3.29Å
71	K	92.9	Very high	88.3	Confident	73 Å²	73	74.4 Å²	74.4	32%	0.317	37%	0.37	S	S	.	.	H	α-helix	trans	-64.8	-30.1	177.9	-67.8	171.2	167.2	-167.7	0	113	N69 T75 K160 F161	N69-K71 PolarHBondContact O-N 3.5Å; N69-K71 VanDerWaalsContact O-N 3.12Å; N69-K71 WeakPolarHBondContact OD1-CB 3.25Å; N69-K71 PolarHBondContact OD1-N 2.75Å; N69-K71 VanDerWaalsContact OD1-N 3.08Å; K71-T75 PolarHBondContact O-N 2.87Å; K71-T75 VanDerWaalsContact O-N 3.13Å; K71-T75 PolarHBondContact O-OG1 3.41Å; K71-K160 HydrophobicContact CB-CB 3.92Å; K71-K160 HydrophobicContact CB-CG 4.44Å; K71-K160 HydrophobicContact CD-CB 4.17Å; K71-K160 WeakPolarHBondContact CD-O 3.35Å; K71-K160 WeakPolarHBondContact CE-O 3.3Å; K71-K160 HydrophobicContact CG-CB 4.27Å; K71-K160 PolarHBondContact NZ-O 3.44Å; K71-F161 HydrophobicContact CB-CE1 4.1Å; K71-F161 HydrophobicContact CB-CE2 3.98Å; K71-F161 HydrophobicContact CB-CZ 3.53Å; K71-F161 HydrophobicContact CD-CD1 3.92Å; K71-F161 HydrophobicContact CD-CE1 3.44Å; K71-F161 VanDerWaalsContact CD-CE1 3.44Å; K71-F161 HydrophobicContact CD-CE2 4.48Å; K71-F161 HydrophobicContact CD-CZ 3.77Å; K71-F161 HydrophobicContact CG-CE1 4.41Å; K71-F161 HydrophobicContact CG-CZ 4.32Å
72	I	92.3	Very high	88.1	Confident	0 Å²	0	78 Å²	78	0%	0	39%	0.394	C	S	.	.	H	α-helix	trans	-72.1	-44.1	174.3	-60.5	-177.3	0	0	0	109.3	N69 E70 T75 L76 I117 I120 E121 F157 F161	N69-I72 HydrophobicContact CB-CD1 4.36Å; N69-I72 HydrophobicContact CB-CG1 4.3Å; N69-I72 WeakPolarHBondContact O-CA 3.35Å; N69-I72 WeakPolarHBondContact O-CB 3.48Å; N69-I72 PolarHBondContact O-N 3.31Å; E70-I72 VanDerWaalsContact C-N 3.28Å; E70-I72 PolarHBondContact O-N 3.03Å; I72-T75 WeakPolarHBondContact O-CB 3.49Å; I72-T75 PolarHBondContact O-N 2.64Å; I72-T75 VanDerWaalsContact O-N 3.16Å; I72-L76 HydrophobicContact CG2-CD1 4.02Å; I72-L76 WeakPolarHBondContact O-CG 3.15Å; I72-L76 PolarHBondContact O-N 3.05Å; I72-I117 HydrophobicContact CG2-CG1 4.07Å; I72-I117 HydrophobicContact CG2-CG2 4.21Å; I72-I120 HydrophobicContact CD1-CB 4.23Å; I72-I120 HydrophobicContact CD1-CG2 4Å; I72-E121 HydrophobicContact CD1-CG 3.91Å; I72-E121 WeakPolarHBondContact CD1-OE1 3.24Å; I72-F157 HydrophobicContact CG2-CD1 4.1Å; I72-F157 HydrophobicContact CG2-CE1 3.83Å; I72-F161 HydrophobicContact CG1-CE2 3.9Å; I72-F161 HydrophobicContact CG1-CZ 3.91Å
73	L	90.9	Very high	88.2	Confident	52 Å²	52	76.8 Å²	76.8	27%	0.272	38%	0.381	S	S	.	.	H	α-helix	trans	-60.6	-45.6	175.9	-60.9	176	0	0	0	111.6	W61 L68 N69 E70 T75 L76 E77	W61-L73 HydrophobicContact CB-CD2 3.64Å; W61-L73 HydrophobicContact CG-CD2 4.33Å; L68-L73 HydrophobicContact CB-CD2 4.23Å; L68-L73 HydrophobicContact CB-CG 4.38Å; L68-L73 HydrophobicContact CD1-CD2 4.09Å; N69-L73 PolarHBondContact O-N 3.44Å; E70-L73 PolarHBondContact O-N 3.25Å; L73-T75 VanDerWaalsContact C-N 3.3Å; L73-T75 PolarHBondContact O-N 2.9Å; L73-L76 WeakPolarHBondContact O-CB 3.34Å; L73-L76 PolarHBondContact O-N 3.38Å; L73-L76 VanDerWaalsContact O-N 3.1Å; L73-E77 PolarHBondContact O-N 3.44Å
74	Q	91.1	Very high	88.4	Confident	87 Å²	87	73.3 Å²	73.3	41%	0.407	36%	0.356	S	S	.	.	H	α-helix	trans	-56.3	-42.4	172.4	-71.5	167.9	10.9	0	0	112.2	E70 L76 E77 E78	E70-Q74 VanDerWaalsContact O-CG 3.31Å; E70-Q74 WeakPolarHBondContact O-CG 3.48Å; E70-Q74 PolarHBondContact O-N 3.29Å; Q74-L76 VanDerWaalsContact C-N 3.34Å; Q74-L76 PolarHBondContact O-N 3.36Å; Q74-E77 PolarHBondContact O-N 3.49Å; Q74-E78 WeakPolarHBondContact O-CB 3.36Å; Q74-E78 WeakPolarHBondContact O-CG 3.49Å; Q74-E78 PolarHBondContact O-N 2.96Å
75	T	91.7	Very high	88.5	Confident	2 Å²	2	73.8 Å²	73.8	1%	0.012	36%	0.36	C	S	.	.	H	α-helix	trans	-66.4	-37	177.6	-52	0	0	0	0	111.4	K71 I72 L73 E78 M79 F157 K160	K71-T75 PolarHBondContact O-N 2.87Å; K71-T75 VanDerWaalsContact O-N 3.13Å; K71-T75 PolarHBondContact O-OG1 3.41Å; I72-T75 WeakPolarHBondContact O-CB 3.49Å; I72-T75 PolarHBondContact O-N 2.64Å; I72-T75 VanDerWaalsContact O-N 3.16Å; L73-T75 VanDerWaalsContact C-N 3.3Å; L73-T75 PolarHBondContact O-N 2.9Å; T75-E78 PolarHBondContact O-N 3.36Å; T75-M79 HydrophobicContact CG2-CE 4Å; T75-M79 WeakPolarHBondContact O-CB 3.44Å; T75-M79 VanDerWaalsContact O-CG 3.26Å; T75-M79 WeakPolarHBondContact O-CG 3.49Å; T75-M79 PolarHBondContact O-N 2.89Å; T75-F157 HydrophobicContact CG2-CB 4.49Å; T75-F157 HydrophobicContact CG2-CD1 3.49Å; T75-F157 VanDerWaalsContact CG2-CD1 3.49Å; T75-F157 HydrophobicContact CG2-CD2 4.36Å; T75-F157 HydrophobicContact CG2-CE1 3.63Å; T75-F157 HydrophobicContact CG2-CE2 4.47Å; T75-F157 HydrophobicContact CG2-CG 3.87Å; T75-F157 HydrophobicContact CG2-CZ 4.12Å; T75-K160 WeakPolarHBondContact OG1-CG 3.37Å
76	L	90.3	Very high	88.6	Confident	1 Å²	1	70.7 Å²	70.7	1%	0.005	34%	0.339	C	S	.	.	H	α-helix	trans	-68.9	-35.4	176.5	-69.5	162.6	0	0	0	112.1	W61 I72 L73 Q74 M79 K80 F81 L113 I117 F157	W61-L76 HydrophobicContact CD2-CD1 3.67Å; W61-L76 HydrophobicContact CE3-CD1 3.85Å; W61-L76 HydrophobicContact CG-CD1 4.16Å; W61-L76 HydrophobicContact CH2-CD1 4.25Å; W61-L76 HydrophobicContact CH2-CD2 4.09Å; W61-L76 HydrophobicContact CZ2-CD1 4.08Å; W61-L76 HydrophobicContact CZ2-CD2 3.78Å; W61-L76 HydrophobicContact CZ2-CG 4.46Å; W61-L76 HydrophobicContact CZ3-CD1 4.14Å; I72-L76 HydrophobicContact CG2-CD1 4.02Å; I72-L76 WeakPolarHBondContact O-CG 3.15Å; I72-L76 PolarHBondContact O-N 3.05Å; L73-L76 WeakPolarHBondContact O-CB 3.34Å; L73-L76 PolarHBondContact O-N 3.38Å; L73-L76 VanDerWaalsContact O-N 3.1Å; Q74-L76 VanDerWaalsContact C-N 3.34Å; Q74-L76 PolarHBondContact O-N 3.36Å; L76-M79 CarbonylContact O-C 3.56Å; L76-M79 PolarHBondContact O-N 2.92Å; L76-K80 PolarHBondContact O-N 3.12Å; L76-F81 HydrophobicContact CD2-CB 4.39Å; L76-F81 HydrophobicContact CD2-CD2 4.3Å; L76-F81 PolarHBondContact O-N 2.85Å; L76-L113 HydrophobicContact CD2-CD1 4.02Å; L76-I117 HydrophobicContact CD1-CD1 4Å; L76-I117 HydrophobicContact CD2-CD1 4.24Å; L76-F157 HydrophobicContact CD2-CE1 4.22Å; L76-F157 HydrophobicContact CD2-CZ 3.9Å; L76-F157 HydrophobicContact CG-CE1 4.07Å; L76-F157 HydrophobicContact CG-CZ 4.26Å
77	E	88.8	Confident	88.7	Confident	154 Å²	154	69.7 Å²	69.7	72%	0.72	33%	0.334	S	S	*	.	H	α-helix	trans	-67.1	-44.5	172	-173.4	175	-156.1	0	0	111.8	L73 Q74 M79 K80	L73-E77 PolarHBondContact O-N 3.44Å; Q74-E77 PolarHBondContact O-N 3.49Å; E77-M79 VanDerWaalsContact C-N 3.29Å; E77-M79 PolarHBondContact O-N 3.1Å; E77-K80 WeakPolarHBondContact O-CA 3.42Å; E77-K80 PolarHBondContact O-N 2.77Å
78	E	89.8	Confident	89	Confident	124 Å²	124	61.6 Å²	61.6	58%	0.579	30%	0.296	S	S	*	.	H	α-helix	trans	-59.7	-38.1	172.8	-75.2	171.5	175.4	0	0	112.1	Q74 T75 K80 K160	Q74-E78 WeakPolarHBondContact O-CB 3.36Å; Q74-E78 WeakPolarHBondContact O-CG 3.49Å; Q74-E78 PolarHBondContact O-N 2.96Å; T75-E78 PolarHBondContact O-N 3.36Å; E78-K80 PolarHBondContact O-N 2.93Å; E78-K160 IonicContact OE1-NZ 2.71Å; E78-K160 PolarHBondContact OE1-NZ 3.28Å; E78-K160 WeakPolarHBondContact OE2-CE 3.26Å; E78-K160 IonicContact OE2-NZ 3.85Å; E78-K160 PolarHBondContact OE2-NZ 3.16Å
79	M	86.1	Confident	88.9	Confident	37 Å²	37	61.4 Å²	61.4	18%	0.182	30%	0.296	C	S	.	.	T	Hydrogen-bonded Turn	trans	-72.2	-10.9	170.8	-71.5	-177.3	179.4	0	0	114.2	T75 L76 E77 F81 M156 F157	T75-M79 HydrophobicContact CG2-CE 4Å; T75-M79 WeakPolarHBondContact O-CB 3.44Å; T75-M79 VanDerWaalsContact O-CG 3.26Å; T75-M79 WeakPolarHBondContact O-CG 3.49Å; T75-M79 PolarHBondContact O-N 2.89Å; L76-M79 CarbonylContact O-C 3.56Å; L76-M79 PolarHBondContact O-N 2.92Å; E77-M79 VanDerWaalsContact C-N 3.29Å; E77-M79 PolarHBondContact O-N 3.1Å; M79-F81 VanDerWaalsContact C-N 3.28Å; M79-F81 HydrophobicContact CB-CD2 3.49Å; M79-F81 VanDerWaalsContact CB-CD2 3.49Å; M79-F81 HydrophobicContact CB-CE2 3.72Å; M79-F81 HydrophobicContact CB-CG 4.18Å; M79-F81 HydrophobicContact CG-CD2 4.26Å; M79-F81 HydrophobicContact CG-CE2 4.18Å; M79-F81 PolarHBondContact O-N 3.44Å; M79-F81 HydrophobicContact SD-CD2 3.82Å; M79-F81 HydrophobicContact SD-CE2 3.64Å; M79-M156 HydrophobicContact CE-CB 3.53Å; M79-M156 HydrophobicContact CE-CE 3.71Å; M79-M156 HydrophobicContact CE-CG 4.29Å; M79-M156 HydrophobicContact CE-SD 3.92Å; M79-F157 HydrophobicContact CE-CD2 4.1Å; M79-F157 HydrophobicContact CE-CE2 3.55Å; M79-F157 HydrophobicContact CE-CZ 3.95Å; M79-F157 HydrophobicContact SD-CE2 4.05Å; M79-F157 HydrophobicContact SD-CZ 3.94Å
80	K	86.8	Confident	88.8	Confident	175 Å²	175	60 Å²	60	76%	0.761	29%	0.293	S	S	*	.	T	Hydrogen-bonded Turn	trans	61.6	29.6	-175	-51.7	-178.5	-177.6	-178.2	0	114.2	L76 E77 E78 T82	L76-K80 PolarHBondContact O-N 3.12Å; E77-K80 WeakPolarHBondContact O-CA 3.42Å; E77-K80 PolarHBondContact O-N 2.77Å; E78-K80 PolarHBondContact O-N 2.93Å; K80-T82 PolarHBondContact O-N 2.73Å
81	F	85.4	Confident	88.8	Confident	83 Å²	83	53 Å²	53	36%	0.364	26%	0.26	S	S	.	.			trans	-89.8	76.8	171.9	-63.1	-42	0	0	0	110.1	W61 L76 M79 Y83 L113	W61-F81 PolarHBondContact NE1-O 2.92Å; L76-F81 HydrophobicContact CD2-CB 4.39Å; L76-F81 HydrophobicContact CD2-CD2 4.3Å; L76-F81 PolarHBondContact O-N 2.85Å; M79-F81 VanDerWaalsContact C-N 3.28Å; M79-F81 HydrophobicContact CB-CD2 3.49Å; M79-F81 VanDerWaalsContact CB-CD2 3.49Å; M79-F81 HydrophobicContact CB-CE2 3.72Å; M79-F81 HydrophobicContact CB-CG 4.18Å; M79-F81 HydrophobicContact CG-CD2 4.26Å; M79-F81 HydrophobicContact CG-CE2 4.18Å; M79-F81 PolarHBondContact O-N 3.44Å; M79-F81 HydrophobicContact SD-CD2 3.82Å; M79-F81 HydrophobicContact SD-CE2 3.64Å; F81-Y83 PolarHBondContact O-N 3.13Å; F81-L113 HydrophobicContact CD2-CD1 3.68Å; F81-L113 HydrophobicContact CE2-CD1 3.91Å; F81-L113 HydrophobicContact CG-CD1 4.43Å
82	T	81.3	Confident	88.8	Confident	91 Å²	91	49.5 Å²	49.5	56%	0.558	25%	0.245	S	C	*	.			trans	-65.8	-20.8	-177.7	-37.2	0	0	0	0	114	K80	K80-T82 PolarHBondContact O-N 2.73Å
83	Y	84.9	Confident	88.7	Confident	104 Å²	104	50.1 Å²	50.1	41%	0.408	25%	0.249	S	C	.	.	S	Bend	trans	-136.2	153.2	-172.7	-56.6	-74.4	0	0	0	112.1	M53 T57 T60 F81	M53-Y83 HydrophobicContact CE-CD2 3.77Å; M53-Y83 HydrophobicContact CE-CE2 3.8Å; M53-Y83 HydrophobicContact SD-CE2 4.5Å; T57-Y83 VanDerWaalsContact CG2-CB 3.44Å; T57-Y83 HydrophobicContact CG2-CD2 4.22Å; T57-Y83 HydrophobicContact CG2-CG 4Å; T60-Y83 HydrophobicContact CG2-CD1 3.86Å; T60-Y83 HydrophobicContact CG2-CE1 3.85Å; F81-Y83 PolarHBondContact O-N 3.13Å
84	M	88.3	Confident	88.7	Confident	2 Å²	2	49.9 Å²	49.9	1%	0.01	25%	0.248	C	C	.	.			trans	-85.9	149	176	-62.9	-174.9	-64.1	0	0	112.2	T57 D58 G59 T60 W61 L64 Q88	T57-M84 CarbonylContact C-O 3.59Å; T57-M84 WeakPolarHBondContact CA-O 3.36Å; D58-M84 PolarHBondContact N-O 2.94Å; D58-M84 WeakPolarHBondContact O-CE 3.19Å; G59-M84 PolarHBondContact O-N 3.08Å; T60-M84 VanDerWaalsContact O-CE 3.25Å; T60-M84 WeakPolarHBondContact O-CE 3.26Å; W61-M84 HydrophobicContact CD2-CG 3.5Å; W61-M84 VanDerWaalsContact CD2-CG 3.5Å; W61-M84 HydrophobicContact CD2-SD 4.19Å; W61-M84 HydrophobicContact CE3-CG 3.43Å; W61-M84 VanDerWaalsContact CE3-CG 3.43Å; W61-M84 HydrophobicContact CE3-SD 3.7Å; W61-M84 HydrophobicContact CG-CG 4.15Å; W61-M84 HydrophobicContact CH2-CG 3.9Å; W61-M84 HydrophobicContact CZ2-CG 3.95Å; W61-M84 HydrophobicContact CZ3-CG 3.65Å; W61-M84 HydrophobicContact CZ3-SD 4.07Å; L64-M84 HydrophobicContact CD1-SD 3.77Å; L64-M84 HydrophobicContact CD2-CE 3.85Å; L64-M84 HydrophobicContact CD2-SD 3.49Å; L64-M84 WeakPolarHBondContact CD2-SD 3.36Å; L64-M84 HydrophobicContact CG-CE 3.86Å; L64-M84 HydrophobicContact CG-SD 3.47Å; L64-M84 WeakPolarHBondContact CG-SD 3.34Å; M84-Q88 HydrophobicContact CB-CB 4.32Å
85	T	87.4	Confident	88.7	Confident	26 Å²	26	45.7 Å²	45.7	16%	0.16	23%	0.229	C	C	.	.			trans	-84.3	155.5	164.5	72.1	0	0	0	0	111.4	V87 Q88 S89 S109	T85-V87 PolarHBondContact O-N 3.41Å; T85-V87 WeakPolarHBondContact OG1-CG1 3.4Å; T85-Q88 WeakPolarHBondContact O-CA 3.29Å; T85-Q88 WeakPolarHBondContact O-CB 3.47Å; T85-Q88 PolarHBondContact O-N 2.67Å; T85-Q88 VanDerWaalsContact OG1-CD 3.27Å; T85-Q88 WeakPolarHBondContact OG1-CG 3.2Å; T85-S89 PolarHBondContact O-N 2.78Å; T85-S89 VanDerWaalsContact O-N 3.13Å; T85-S109 WeakPolarHBondContact CB-O 3.4Å; T85-S109 PolarHBondContact OG1-O 3.21Å
86	P	86.5	Confident	88.6	Confident	44 Å²	44	46.5 Å²	46.5	29%	0.286	23%	0.232	S	C	.	.	H	α-helix	trans	-59.2	-12	179.8	-25.7	31.1	0	0	0	116.7	I56 D58 S89 A90 V277	I56-P86 VanDerWaalsContact O-CD 3.26Å; I56-P86 WeakPolarHBondContact O-CD 3.18Å; D58-P86 HydrophobicContact CB-CB 4.29Å; D58-P86 HydrophobicContact CB-CG 4.05Å; P86-S89 WeakPolarHBondContact CA-OG 3.05Å; P86-S89 PolarHBondContact O-OG 3.24Å; P86-A90 WeakPolarHBondContact O-CB 3.42Å; P86-V277 HydrophobicContact CB-CG1 3.83Å
87	V	88.2	Confident	88.5	Confident	1 Å²	1	51 Å²	51	1%	0.006	26%	0.257	C	S	.	.	H	α-helix	trans	-89.4	-26.8	170.4	68.1	0	0	0	0	112.2	T85 C91 A105 S109 K111 V277	T85-V87 PolarHBondContact O-N 3.41Å; T85-V87 WeakPolarHBondContact OG1-CG1 3.4Å; V87-C91 WeakPolarHBondContact O-CB 3.36Å; V87-C91 PolarHBondContact O-N 3.14Å; V87-C91 PolarHBondContact O-SG 3.3Å; V87-A105 HydrophobicContact CB-CB 3.98Å; V87-A105 HydrophobicContact CG1-CB 4.39Å; V87-A105 HydrophobicContact CG2-CB 3.81Å; V87-S109 WeakPolarHBondContact CG1-O 3.5Å; V87-K111 HydrophobicContact CG1-CG 4.26Å; V87-K111 HydrophobicContact CG2-CG 4.3Å; V87-V277 HydrophobicContact CB-CG2 3.87Å; V87-V277 HydrophobicContact CG2-CG2 4.13Å
88	Q	91.8	Very high	88.3	Confident	7 Å²	7	48.7 Å²	48.7	3%	0.033	25%	0.249	C	C	.	.	H	α-helix	trans	-73.9	-51.4	175	-66.3	160.2	-1.3	0	0	110.1	W61 M84 T85 A90 C91 I92 G110 L113 A114	W61-Q88 HydrophobicContact CH2-CB 4.49Å; M84-Q88 HydrophobicContact CB-CB 4.32Å; T85-Q88 WeakPolarHBondContact O-CA 3.29Å; T85-Q88 WeakPolarHBondContact O-CB 3.47Å; T85-Q88 PolarHBondContact O-N 2.67Å; T85-Q88 VanDerWaalsContact OG1-CD 3.27Å; T85-Q88 WeakPolarHBondContact OG1-CG 3.2Å; Q88-A90 VanDerWaalsContact C-N 3.29Å; Q88-A90 PolarHBondContact O-N 2.98Å; Q88-C91 PolarHBondContact O-N 2.57Å; Q88-I92 HydrophobicContact CB-CD1 3.96Å; Q88-I92 VanDerWaalsContact O-CB 3.29Å; Q88-I92 WeakPolarHBondContact O-CB 3.4Å; Q88-I92 WeakPolarHBondContact O-CG1 3.43Å; Q88-I92 PolarHBondContact O-N 2.88Å; Q88-G110 PolarHBondContact NE2-O 2.85Å; Q88-L113 HydrophobicContact CG-CB 4.41Å; Q88-A114 HydrophobicContact CB-CB 4.48Å; Q88-A114 HydrophobicContact CG-CB 3.97Å
89	S	89.7	Confident	88.3	Confident	16 Å²	16	47.6 Å²	47.6	11%	0.112	24%	0.242	C	C	.	.	H	α-helix	trans	-55.2	-42	176.8	58.9	0	0	0	0	112.8	D58 T85 P86 P93	D58-S89 VanDerWaalsContact OD2-CB 3.29Å; D58-S89 WeakPolarHBondContact OD2-CB 3.46Å; D58-S89 PolarHBondContact OD2-OG 2.95Å; T85-S89 PolarHBondContact O-N 2.78Å; T85-S89 VanDerWaalsContact O-N 3.13Å; P86-S89 WeakPolarHBondContact CA-OG 3.05Å; P86-S89 PolarHBondContact O-OG 3.24Å; S89-P93 WeakPolarHBondContact O-CD 3.22Å; S89-P93 WeakPolarHBondContact O-CG 3.29Å
90	A	89.2	Confident	88.6	Confident	33 Å²	33	46.3 Å²	46.3	27%	0.273	24%	0.236	S	C	.	.	H	α-helix	trans	-75.6	-44.2	179.5	0	0	0	0	0	113.5	P86 Q88 L94 I275	P86-A90 WeakPolarHBondContact O-CB 3.42Å; Q88-A90 VanDerWaalsContact C-N 3.29Å; Q88-A90 PolarHBondContact O-N 2.98Å; A90-L94 WeakPolarHBondContact O-CD1 3.5Å; A90-I275 HydrophobicContact CB-CG2 3.74Å
91	C	91.3	Very high	88.8	Confident	0 Å²	0	38 Å²	38	0%	0	20%	0.2	C	C	.	.	H	α-helix	trans	-78.1	-40.9	-174.2	-64.1	0	0	0	0	113.2	V87 Q88 L94 F95 A114 I275	V87-C91 WeakPolarHBondContact O-CB 3.36Å; V87-C91 PolarHBondContact O-N 3.14Å; V87-C91 PolarHBondContact O-SG 3.3Å; Q88-C91 PolarHBondContact O-N 2.57Å; C91-L94 PolarHBondContact O-N 3.26Å; C91-F95 WeakPolarHBondContact O-CB 3.43Å; C91-F95 PolarHBondContact O-N 2.99Å; C91-A114 HydrophobicContact CB-CB 4.08Å; C91-I275 HydrophobicContact CB-CD1 4.27Å
92	I	92.9	Very high	89.1	Confident	0 Å²	0	34.6 Å²	34.6	0%	0	19%	0.188	C	C	.	.	H	α-helix	trans	-59.9	-50.8	-168.1	-69.1	171.5	0	0	0	111.9	W61 L64 V66 L68 Q88 L94 F95 M96 I117 P118	W61-I92 HydrophobicContact CZ3-CD1 3.84Å; L64-I92 HydrophobicContact CD1-CG2 4.17Å; V66-I92 HydrophobicContact CG2-CG2 4.38Å; L68-I92 HydrophobicContact CD2-CG2 4.29Å; Q88-I92 HydrophobicContact CB-CD1 3.96Å; Q88-I92 VanDerWaalsContact O-CB 3.29Å; Q88-I92 WeakPolarHBondContact O-CB 3.4Å; Q88-I92 WeakPolarHBondContact O-CG1 3.43Å; Q88-I92 PolarHBondContact O-N 2.88Å; I92-L94 VanDerWaalsContact C-N 3.34Å; I92-L94 PolarHBondContact O-N 2.84Å; I92-F95 PolarHBondContact O-N 3Å; I92-M96 HydrophobicContact CG2-CG 4.49Å; I92-M96 HydrophobicContact CG2-SD 3.62Å; I92-M96 WeakPolarHBondContact O-CB 3.41Å; I92-M96 VanDerWaalsContact O-CG 3.32Å; I92-M96 WeakPolarHBondContact O-CG 3.49Å; I92-M96 PolarHBondContact O-N 3.38Å; I92-I117 HydrophobicContact CD1-CB 4.31Å; I92-I117 HydrophobicContact CD1-CD1 4Å; I92-I117 HydrophobicContact CD1-CG2 4.33Å; I92-I117 HydrophobicContact CG2-CG2 4.33Å; I92-P118 HydrophobicContact CB-CG 4.25Å; I92-P118 HydrophobicContact CG1-CG 3.98Å; I92-P118 HydrophobicContact CG2-CG 4.21Å
93	P	91.1	Very high	89.4	Confident	13 Å²	13	30.4 Å²	30.4	8%	0.084	16%	0.162	C	C	.	.	H	α-helix	trans	-62.7	-36.9	177.8	-23.1	34.7	0	0	0	113.8	L64 P65 V66 S89 N97	L64-P93 HydrophobicContact CD2-CG 3.89Å; P65-P93 HydrophobicContact CG-CB 3.87Å; P65-P93 HydrophobicContact CG-CG 3.74Å; V66-P93 HydrophobicContact CG1-CB 4.18Å; V66-P93 HydrophobicContact CG2-CB 4.18Å; V66-P93 HydrophobicContact CG2-CG 4.14Å; S89-P93 WeakPolarHBondContact O-CD 3.22Å; S89-P93 WeakPolarHBondContact O-CG 3.29Å; P93-N97 WeakPolarHBondContact O-CB 3.41Å; P93-N97 VanDerWaalsContact O-CG 3.25Å; P93-N97 PolarHBondContact O-N 3.01Å; P93-N97 PolarHBondContact O-ND2 2.94Å
94	L	91.2	Very high	89.5	Confident	47 Å²	47	27.5 Å²	27.5	25%	0.246	15%	0.152	C	C	.	.	H	α-helix	trans	-72.2	-40.5	-177.9	-71.3	172.4	0	0	0	111.6	A90 C91 I92 N97 K99 V101 V273 I275	A90-L94 WeakPolarHBondContact O-CD1 3.5Å; C91-L94 PolarHBondContact O-N 3.26Å; I92-L94 VanDerWaalsContact C-N 3.34Å; I92-L94 PolarHBondContact O-N 2.84Å; L94-N97 PolarHBondContact O-N 3.04Å; L94-K99 HydrophobicContact CD2-CD 4.21Å; L94-K99 WeakPolarHBondContact O-CB 3.39Å; L94-K99 PolarHBondContact O-N 3.13Å; L94-V101 HydrophobicContact CB-CG2 4.13Å; L94-V273 HydrophobicContact CD1-CB 4.44Å; L94-V273 HydrophobicContact CD1-CG1 3.8Å; L94-I275 HydrophobicContact CD1-CD1 3.6Å; L94-I275 HydrophobicContact CD1-CG1 4.13Å
95	F	90	Very high	89.2	Confident	0 Å²	0	27.5 Å²	27.5	0%	0	15%	0.153	C	C	.	.	H	α-helix	trans	-74.5	-36	179.9	-156.8	-155.6	0	0	0	111.4	C91 I92 N98 V101 F115 P118 V219 V221 R249	C91-F95 WeakPolarHBondContact O-CB 3.43Å; C91-F95 PolarHBondContact O-N 2.99Å; I92-F95 PolarHBondContact O-N 3Å; F95-N98 PolarHBondContact O-N 3.2Å; F95-V101 HydrophobicContact CB-CG2 4.08Å; F95-V101 HydrophobicContact CD2-CG2 4.25Å; F95-V101 HydrophobicContact CG-CG2 4.42Å; F95-F115 HydrophobicContact CE1-CB 4.23Å; F95-P118 HydrophobicContact CB-CB 4.11Å; F95-P118 HydrophobicContact CB-CG 4.22Å; F95-P118 HydrophobicContact CD1-CB 3.55Å; F95-P118 HydrophobicContact CD1-CG 3.95Å; F95-P118 HydrophobicContact CE1-CB 4.33Å; F95-P118 HydrophobicContact CG-CB 4.12Å; F95-V219 HydrophobicContact CE1-CG1 4.13Å; F95-V219 HydrophobicContact CE2-CG1 4.35Å; F95-V219 HydrophobicContact CZ-CG1 3.59Å; F95-V221 HydrophobicContact CE1-CG2 4.17Å; F95-V221 HydrophobicContact CZ-CG2 4.13Å; F95-R249 HydrophobicContact CE2-CB 4.17Å
96	M	89.4	Confident	88.6	Confident	18 Å²	18	27.6 Å²	27.6	9%	0.089	15%	0.153	C	C	.	.	H	α-helix	trans	-66	-36.8	170.5	-72.8	175.1	64.7	0	0	112.6	V66 L68 I92 N98 P118 E121	V66-M96 HydrophobicContact CB-CE 4.02Å; V66-M96 HydrophobicContact CB-SD 4.37Å; V66-M96 HydrophobicContact CG2-CE 4.01Å; V66-M96 HydrophobicContact CG2-SD 3.73Å; L68-M96 HydrophobicContact CD2-CE 4.03Å; L68-M96 HydrophobicContact CD2-SD 3.75Å; I92-M96 HydrophobicContact CG2-CG 4.49Å; I92-M96 HydrophobicContact CG2-SD 3.62Å; I92-M96 WeakPolarHBondContact O-CB 3.41Å; I92-M96 VanDerWaalsContact O-CG 3.32Å; I92-M96 WeakPolarHBondContact O-CG 3.49Å; I92-M96 PolarHBondContact O-N 3.38Å; M96-N98 PolarHBondContact O-N 3.31Å; M96-P118 HydrophobicContact CG-CB 4.06Å; M96-P118 HydrophobicContact CG-CG 4.3Å; M96-E121 HydrophobicContact CE-CB 3.93Å; M96-E121 HydrophobicContact CE-CG 3.76Å; M96-E121 WeakPolarHBondContact CE-OE2 3.46Å; M96-E121 HydrophobicContact CG-CB 4.31Å; M96-E121 HydrophobicContact SD-CB 4.19Å; M96-E121 HydrophobicContact SD-CG 4.01Å
97	N	88.5	Confident	87.9	Confident	97 Å²	97	25.8 Å²	25.8	52%	0.519	14%	0.141	S	C	.	.	T	Hydrogen-bonded Turn	trans	-78.7	37.1	175.3	-72.9	-37.3	0	0	0	113.6	P93 L94 K99	P93-N97 WeakPolarHBondContact O-CB 3.41Å; P93-N97 VanDerWaalsContact O-CG 3.25Å; P93-N97 PolarHBondContact O-N 3.01Å; P93-N97 PolarHBondContact O-ND2 2.94Å; L94-N97 PolarHBondContact O-N 3.04Å; N97-K99 WeakPolarHBondContact O-CG 3.3Å; N97-K99 PolarHBondContact O-N 3.37Å; N97-K99 VanDerWaalsContact O-N 3.11Å
98	N	84.9	Confident	87	Confident	105 Å²	105	27 Å²	27	56%	0.561	15%	0.153	S	C	*	.	T	Hydrogen-bonded Turn	trans	59.3	17.7	171.7	-58.5	-47.4	0	0	0	116.7	F95 M96 R249	F95-N98 PolarHBondContact O-N 3.2Å; M96-N98 PolarHBondContact O-N 3.31Å; N98-R249 VanDerWaalsContact OD1-CZ 3.24Å; N98-R249 PolarHBondContact OD1-NE 3.5Å; N98-R249 PolarHBondContact OD1-NH2 3.06Å
99	K	88.9	Confident	86.2	Confident	101 Å²	101	27.6 Å²	27.6	44%	0.439	16%	0.159	S	C	.	.			trans	-94.3	144.5	178.4	-55.3	-170.6	-178	-179.9	0	111.8	L94 N97 V273	L94-K99 HydrophobicContact CD2-CD 4.21Å; L94-K99 WeakPolarHBondContact O-CB 3.39Å; L94-K99 PolarHBondContact O-N 3.13Å; N97-K99 WeakPolarHBondContact O-CG 3.3Å; N97-K99 PolarHBondContact O-N 3.37Å; N97-K99 VanDerWaalsContact O-N 3.11Å; K99-V273 HydrophobicContact CB-CG2 4.18Å; K99-V273 HydrophobicContact CD-CG2 3.65Å
100	D	92.2	Very high	85.9	Confident	9 Å²	9	28 Å²	28	5%	0.048	17%	0.165	C	C	.	.			trans	-67.9	142.9	163	-80.4	13.1	0	0	0	109.8	R249 T250 L269 R270 P272 V273	D100-R249 WeakPolarHBondContact OD1-CA 3.39Å; D100-T250 WeakPolarHBondContact CA-O 3.3Å; D100-T250 PolarHBondContact OD1-N 3.3Å; D100-L269 HydrophobicContact CB-CB 4.17Å; D100-L269 HydrophobicContact CB-CD2 4.37Å; D100-L269 HydrophobicContact CB-CG 4.36Å; D100-L269 WeakPolarHBondContact OD2-CA 3.48Å; D100-L269 WeakPolarHBondContact OD2-CB 3.45Å; D100-R270 PolarHBondContact OD2-N 3.24Å; D100-P272 HydrophobicContact CB-CB 4.08Å; D100-P272 CarbonylContact O-C 3.49Å; D100-P272 WeakPolarHBondContact O-CA 3.37Å; D100-V273 PolarHBondContact O-N 3.1Å
101	V	91.8	Very high	85.9	Confident	0 Å²	0	27.1 Å²	27.1	0%	0	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	131.1	-173	173.5	0	0	0	0	110.2	L94 F95 A103 T250 G251 L252 V273 I275	L94-V101 HydrophobicContact CB-CG2 4.13Å; F95-V101 HydrophobicContact CB-CG2 4.08Å; F95-V101 HydrophobicContact CD2-CG2 4.25Å; F95-V101 HydrophobicContact CG-CG2 4.42Å; V101-A103 HydrophobicContact CG1-CB 4.22Å; V101-T250 PolarHBondContact N-O 3.22Å; V101-T250 VanDerWaalsContact N-O 3.08Å; V101-G251 CarbonylContact O-C 3.09Å; V101-G251 WeakPolarHBondContact O-CA 3.44Å; V101-L252 PolarHBondContact O-N 3.24Å; V101-V273 WeakPolarHBondContact CA-O 3.31Å; V101-I275 HydrophobicContact CG1-CD1 3.59Å; V101-I275 HydrophobicContact CG1-CG1 4.28Å
102	A	90.8	Very high	85.9	Confident	13 Å²	13	28.3 Å²	28.3	11%	0.107	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	102.5	168.9	0	0	0	0	0	109.1	L252 V265 L269 V273 R274 I275	A102-L252 WeakPolarHBondContact CA-O 3.1Å; A102-L252 HydrophobicContact CB-CD2 4.44Å; A102-V265 HydrophobicContact CB-CG2 4.38Å; A102-L269 HydrophobicContact CB-CD2 4.34Å; A102-V273 PolarHBondContact N-O 3.49Å; A102-R274 WeakPolarHBondContact O-CA 3.49Å; A102-I275 PolarHBondContact O-N 2.77Å
103	A	88.9	Confident	85.9	Confident	3 Å²	3	28.9 Å²	28.9	3%	0.025	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	117	-173.1	0	0	0	0	0	112.1	V101 L252 F253 S254 I275	V101-A103 HydrophobicContact CG1-CB 4.22Å; A103-L252 PolarHBondContact N-O 3.4Å; A103-F253 HydrophobicContact CB-CD1 3.65Å; A103-F253 HydrophobicContact CB-CE1 3.73Å; A103-F253 HydrophobicContact CB-CG 4.46Å; A103-S254 PolarHBondContact O-N 3.36Å; A103-I275 WeakPolarHBondContact CA-O 3.49Å
104	E	86	Confident	86	Confident	43 Å²	43	28.3 Å²	28.3	20%	0.201	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105	116	168.9	-174.5	179	-149.7	0	0	109.4	Q257 I275 V277	E104-Q257 WeakPolarHBondContact OE1-CB 3.22Å; E104-Q257 PolarHBondContact OE1-N 3Å; E104-I275 PolarHBondContact N-O 2.97Å; E104-V277 PolarHBondContact O-N 3.31Å
105	A	81.8	Confident	86.2	Confident	2 Å²	2	26 Å²	26	2%	0.017	15%	0.15	C	C	.	.			trans	-149.5	150.7	173.7	0	0	0	0	0	110.2	V87 S109 K111 S254 A255 V277	V87-A105 HydrophobicContact CB-CB 3.98Å; V87-A105 HydrophobicContact CG1-CB 4.39Å; V87-A105 HydrophobicContact CG2-CB 3.81Å; A105-S109 WeakPolarHBondContact CB-OG 3.17Å; A105-K111 HydrophobicContact CB-CD 4.23Å; A105-K111 HydrophobicContact CB-CG 4.26Å; A105-K111 PolarHBondContact O-NZ 3.01Å; A105-S254 PolarHBondContact N-O 3.45Å; A105-A255 WeakPolarHBondContact O-CA 3.38Å; A105-V277 HydrophobicContact CB-CB 4.08Å; A105-V277 HydrophobicContact CB-CG2 4.47Å
106	V	74.8	Confident	86.4	Confident	27 Å²	27	26 Å²	26	16%	0.164	15%	0.15	C	C	.	.			trans	-55.8	158.9	-176.4	-62.5	0	0	0	0	113.3	G108 S109 K111	V106-G108 PolarHBondContact O-N 3.21Å; V106-S109 WeakPolarHBondContact O-CB 3.44Å; V106-S109 PolarHBondContact O-N 3.1Å; V106-S109 PolarHBondContact O-OG 3.05Å; V106-K111 PolarHBondContact O-NZ 3.14Å
107	T	72.3	Confident	86.7	Confident	7 Å²	7	25.2 Å²	25.2	4%	0.043	15%	0.146	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.1	130.1	174.1	50.5	0	0	0	0	110.6	A255 G409	T107-A255 HydrophobicContact CG2-CB 3.76Å; T107-G409 WeakPolarHBondContact OG1-CA 3.41Å; T107-G409 PolarHBondContact OG1-O 3.43Å
108	G	69.4	Low	86.9	Confident	25 Å²	25	20.6 Å²	20.6	26%	0.258	12%	0.121	S	C	.	.	T	Hydrogen-bonded Turn	trans	91.9	1.2	-177.2	0	0	0	0	0	115.4	V106 G110	V106-G108 PolarHBondContact O-N 3.21Å; G108-G110 PolarHBondContact O-N 3.05Å
109	S	75.6	Confident	87.4	Confident	21 Å²	21	15.6 Å²	15.6	15%	0.147	9%	0.094	C	C	.	.	S	Bend	trans	-74.4	6.9	178.2	54.2	0	0	0	0	115.8	T85 V87 A105 V106	T85-S109 WeakPolarHBondContact CB-O 3.4Å; T85-S109 PolarHBondContact OG1-O 3.21Å; V87-S109 WeakPolarHBondContact CG1-O 3.5Å; A105-S109 WeakPolarHBondContact CB-OG 3.17Å; V106-S109 WeakPolarHBondContact O-CB 3.44Å; V106-S109 PolarHBondContact O-N 3.1Å; V106-S109 PolarHBondContact O-OG 3.05Å
110	G	83.3	Confident	87.7	Confident	24 Å²	24	10.8 Å²	10.8	25%	0.247	7%	0.073	C	C	.	.			trans	79.6	17.6	179.1	0	0	0	0	0	116	Q88 G108 T112 L113	Q88-G110 PolarHBondContact NE2-O 2.85Å; G108-G110 PolarHBondContact O-N 3.05Å; G110-T112 PolarHBondContact O-N 3.43Å; G110-L113 PolarHBondContact O-N 3.38Å
111	K	89.1	Confident	87.7	Confident	15 Å²	15	10.5 Å²	10.5	7%	0.065	7%	0.072	C	C	.	.	H	α-helix	trans	-46.8	-32.7	-179.8	-70.8	-160.6	-69.2	-85.2	0	115.2	V87 A105 V106 L113 A114 F115 F253 S254	V87-K111 HydrophobicContact CG1-CG 4.26Å; V87-K111 HydrophobicContact CG2-CG 4.3Å; A105-K111 HydrophobicContact CB-CD 4.23Å; A105-K111 HydrophobicContact CB-CG 4.26Å; A105-K111 PolarHBondContact O-NZ 3.01Å; V106-K111 PolarHBondContact O-NZ 3.14Å; K111-L113 PolarHBondContact O-N 3.02Å; K111-A114 VanDerWaalsContact O-CB 3.28Å; K111-A114 WeakPolarHBondContact O-CB 3.43Å; K111-A114 PolarHBondContact O-N 2.96Å; K111-A114 VanDerWaalsContact O-N 3.11Å; K111-F115 WeakPolarHBondContact O-CD1 3.31Å; K111-F253 HydrophobicContact CB-CD1 4.38Å; K111-F253 HydrophobicContact CD-CB 4.27Å; K111-F253 HydrophobicContact CD-CD1 4.2Å; K111-S254 WeakPolarHBondContact CE-O 3.37Å; K111-S254 PolarHBondContact NZ-O 2.98Å; K111-S254 VanDerWaalsContact NZ-O 3.13Å
112	T	91.9	Very high	87.8	Confident	25 Å²	25	11 Å²	11	15%	0.153	7%	0.074	C	C	.	.	H	α-helix	trans	-58.3	-45.6	-178.1	-48.1	0	0	0	0	112.7	G110 A114 F115 V116 I150 V153	G110-T112 PolarHBondContact O-N 3.43Å; T112-A114 VanDerWaalsContact C-N 3.26Å; T112-A114 PolarHBondContact O-N 3.06Å; T112-F115 HydrophobicContact CG2-CE2 4.24Å; T112-F115 HydrophobicContact CG2-CZ 4.05Å; T112-F115 PolarHBondContact O-N 3.36Å; T112-V116 HydrophobicContact CG2-CG2 3.98Å; T112-V116 WeakPolarHBondContact O-CB 3.21Å; T112-V116 VanDerWaalsContact O-CG2 3.25Å; T112-V116 WeakPolarHBondContact O-CG2 3.45Å; T112-V116 PolarHBondContact O-N 2.9Å; T112-I150 HydrophobicContact CG2-CG1 4.19Å; T112-V153 HydrophobicContact CG2-CB 4.36Å; T112-V153 HydrophobicContact CG2-CG1 4.09Å
113	L	92.9	Very high	87.8	Confident	12 Å²	12	10.8 Å²	10.8	6%	0.063	7%	0.071	C	C	.	.	H	α-helix	trans	-67.6	-29.8	177.8	-62.5	-179.2	0	0	0	112.3	W61 L76 F81 Q88 G110 K111 F115 V116 I117 V153 F157	W61-L113 HydrophobicContact CH2-CD1 4.42Å; L76-L113 HydrophobicContact CD2-CD1 4.02Å; F81-L113 HydrophobicContact CD2-CD1 3.68Å; F81-L113 HydrophobicContact CE2-CD1 3.91Å; F81-L113 HydrophobicContact CG-CD1 4.43Å; Q88-L113 HydrophobicContact CG-CB 4.41Å; G110-L113 PolarHBondContact O-N 3.38Å; K111-L113 PolarHBondContact O-N 3.02Å; L113-F115 PolarHBondContact O-N 3.37Å; L113-F115 VanDerWaalsContact O-N 3.14Å; L113-V116 PolarHBondContact O-N 3.44Å; L113-I117 HydrophobicContact CB-CD1 4.17Å; L113-I117 WeakPolarHBondContact O-CB 3.32Å; L113-I117 PolarHBondContact O-N 2.83Å; L113-I117 VanDerWaalsContact O-N 3.12Å; L113-V153 HydrophobicContact CD2-CG1 3.97Å; L113-F157 HydrophobicContact CD2-CE2 3.7Å; L113-F157 HydrophobicContact CD2-CZ 3.81Å
114	A	92.7	Very high	88	Confident	0 Å²	0	13.1 Å²	13.1	0%	0	8%	0.083	C	C	.	.	H	α-helix	trans	-65.2	-14	178.4	0	0	0	0	0	113.8	Q88 C91 K111 T112 F253	Q88-A114 HydrophobicContact CB-CB 4.48Å; Q88-A114 HydrophobicContact CG-CB 3.97Å; C91-A114 HydrophobicContact CB-CB 4.08Å; K111-A114 VanDerWaalsContact O-CB 3.28Å; K111-A114 WeakPolarHBondContact O-CB 3.43Å; K111-A114 PolarHBondContact O-N 2.96Å; K111-A114 VanDerWaalsContact O-N 3.11Å; T112-A114 VanDerWaalsContact C-N 3.26Å; T112-A114 PolarHBondContact O-N 3.06Å; A114-F253 HydrophobicContact CB-CE1 4.3Å
115	F	94.3	Very high	88.1	Confident	0 Å²	0	17.3 Å²	17.3	0%	0	10%	0.101	C	C	.	.	H	α-helix	trans	-116.1	-29.9	167.5	61.2	-109.2	0	0	0	114.8	F95 K111 T112 L113 I119 V139 I150 V221 D223 F253	F95-F115 HydrophobicContact CE1-CB 4.23Å; K111-F115 WeakPolarHBondContact O-CD1 3.31Å; T112-F115 HydrophobicContact CG2-CE2 4.24Å; T112-F115 HydrophobicContact CG2-CZ 4.05Å; T112-F115 PolarHBondContact O-N 3.36Å; L113-F115 PolarHBondContact O-N 3.37Å; L113-F115 VanDerWaalsContact O-N 3.14Å; F115-I119 HydrophobicContact CD2-CD1 4.25Å; F115-I119 WeakPolarHBondContact O-CB 3.28Å; F115-I119 WeakPolarHBondContact O-CD1 3.4Å; F115-I119 VanDerWaalsContact O-CG1 3.24Å; F115-I119 WeakPolarHBondContact O-CG1 3.17Å; F115-I119 PolarHBondContact O-N 3.23Å; F115-V139 HydrophobicContact CE2-CG1 4.08Å; F115-V139 HydrophobicContact CZ-CG1 4.44Å; F115-I150 HydrophobicContact CE2-CG2 4.08Å; F115-I150 HydrophobicContact CZ-CD1 4.12Å; F115-I150 HydrophobicContact CZ-CG1 4.42Å; F115-V221 HydrophobicContact CB-CG1 4.23Å; F115-V221 HydrophobicContact CB-CG2 4.06Å; F115-V221 HydrophobicContact CD1-CG1 3.96Å; F115-V221 HydrophobicContact CD2-CG1 4.01Å; F115-V221 HydrophobicContact CD2-CG2 4.47Å; F115-V221 HydrophobicContact CE1-CG1 4.22Å; F115-V221 HydrophobicContact CE2-CG1 4.29Å; F115-V221 HydrophobicContact CG-CG1 3.84Å; F115-V221 HydrophobicContact CG-CG2 4.4Å; F115-V221 HydrophobicContact CZ-CG1 4.38Å; F115-D223 HydrophobicContact CE1-CB 4.15Å; F115-D223 HydrophobicContact CZ-CB 4.23Å; F115-F253 HydrophobicContact CB-CD2 4.45Å; F115-F253 HydrophobicContact CB-CE2 3.69Å; F115-F253 HydrophobicContact CB-CZ 3.74Å; F115-F253 HydrophobicContact CD1-CD1 4.17Å; F115-F253 AromaticContact CD1-CD2 3.78Å; F115-F253 HydrophobicContact CD1-CD2 3.78Å; F115-F253 HydrophobicContact CD1-CE1 4.23Å; F115-F253 AromaticContact CD1-CE2 3.84Å; F115-F253 HydrophobicContact CD1-CE2 3.84Å; F115-F253 AromaticContact CD1-CG 3.96Å; F115-F253 HydrophobicContact CD1-CG 3.96Å; F115-F253 HydrophobicContact CD1-CZ 4.08Å; F115-F253 HydrophobicContact CE1-CD2 4.45Å; F115-F253 HydrophobicContact CE1-CG 4.43Å; F115-F253 HydrophobicContact CG-CD2 4.48Å; F115-F253 HydrophobicContact CG-CE2 4.18Å; F115-F253 HydrophobicContact CG-CZ 4.43Å
116	V	95.4	Very high	88.5	Confident	0 Å²	0	19.7 Å²	19.7	0%	0	11%	0.109	C	C	.	.	H	α-helix	trans	-61.9	-44.1	177.4	167.8	0	0	0	0	111.6	T112 L113 I119 I120 V153 M154 F157	T112-V116 HydrophobicContact CG2-CG2 3.98Å; T112-V116 WeakPolarHBondContact O-CB 3.21Å; T112-V116 VanDerWaalsContact O-CG2 3.25Å; T112-V116 WeakPolarHBondContact O-CG2 3.45Å; T112-V116 PolarHBondContact O-N 2.9Å; L113-V116 PolarHBondContact O-N 3.44Å; V116-I119 PolarHBondContact O-N 2.93Å; V116-I120 HydrophobicContact CG1-CD1 4.32Å; V116-I120 PolarHBondContact O-N 2.97Å; V116-V153 HydrophobicContact CG2-CG1 4.32Å; V116-M154 HydrophobicContact CB-CE 4.31Å; V116-M154 HydrophobicContact CG1-CE 4.13Å; V116-M154 HydrophobicContact CG1-SD 3.97Å; V116-M154 HydrophobicContact CG2-CE 3.94Å; V116-F157 HydrophobicContact CG1-CD2 3.61Å; V116-F157 HydrophobicContact CG1-CE2 3.85Å; V116-F157 HydrophobicContact CG1-CG 4.36Å
117	I	94.6	Very high	88.9	Confident	0 Å²	0	28.1 Å²	28.1	0%	0	15%	0.147	C	C	.	.	H	α-helix	trans	-64.8	-53.3	-179.4	-66	168.1	0	0	0	110.7	W61 L68 I72 L76 I92 L113 I119 I120 E121	W61-I117 HydrophobicContact CE3-CD1 4.21Å; W61-I117 HydrophobicContact CH2-CD1 3.75Å; W61-I117 HydrophobicContact CZ3-CD1 3.39Å; L68-I117 HydrophobicContact CD1-CG2 4.02Å; L68-I117 HydrophobicContact CD2-CG2 3.72Å; I72-I117 HydrophobicContact CG2-CG1 4.07Å; I72-I117 HydrophobicContact CG2-CG2 4.21Å; L76-I117 HydrophobicContact CD1-CD1 4Å; L76-I117 HydrophobicContact CD2-CD1 4.24Å; I92-I117 HydrophobicContact CD1-CB 4.31Å; I92-I117 HydrophobicContact CD1-CD1 4Å; I92-I117 HydrophobicContact CD1-CG2 4.33Å; I92-I117 HydrophobicContact CG2-CG2 4.33Å; L113-I117 HydrophobicContact CB-CD1 4.17Å; L113-I117 WeakPolarHBondContact O-CB 3.32Å; L113-I117 PolarHBondContact O-N 2.83Å; L113-I117 VanDerWaalsContact O-N 3.12Å; I117-I119 VanDerWaalsContact C-N 3.31Å; I117-I119 PolarHBondContact O-N 3.15Å; I117-I120 PolarHBondContact O-N 3.21Å; I117-E121 HydrophobicContact CG2-CG 4.47Å; I117-E121 WeakPolarHBondContact O-CB 3.25Å; I117-E121 PolarHBondContact O-N 2.74Å
118	P	94.3	Very high	89.5	Confident	0 Å²	0	35.4 Å²	35.4	0%	0	18%	0.181	C	C	.	.	H	α-helix	trans	-59.5	-34	175.4	-29.1	37.4	0	0	0	114.7	I92 F95 M96 I120 L122	I92-P118 HydrophobicContact CB-CG 4.25Å; I92-P118 HydrophobicContact CG1-CG 3.98Å; I92-P118 HydrophobicContact CG2-CG 4.21Å; F95-P118 HydrophobicContact CB-CB 4.11Å; F95-P118 HydrophobicContact CB-CG 4.22Å; F95-P118 HydrophobicContact CD1-CB 3.55Å; F95-P118 HydrophobicContact CD1-CG 3.95Å; F95-P118 HydrophobicContact CE1-CB 4.33Å; F95-P118 HydrophobicContact CG-CB 4.12Å; M96-P118 HydrophobicContact CG-CB 4.06Å; M96-P118 HydrophobicContact CG-CG 4.3Å; P118-I120 PolarHBondContact O-N 3.06Å; P118-L122 HydrophobicContact CB-CD1 4.45Å; P118-L122 WeakPolarHBondContact O-CB 3.35Å; P118-L122 WeakPolarHBondContact O-CD1 3.19Å; P118-L122 WeakPolarHBondContact O-CG 3.11Å; P118-L122 PolarHBondContact O-N 3.44Å
119	I	95.2	Very high	90.4	Very high	0 Å²	0	43.5 Å²	43.5	0%	0	21%	0.208	C	C	.	.	H	α-helix	trans	-56.3	-52.5	174.6	-79	165.6	0	0	0	110.1	F115 V116 I117 L122 L123 A137 V139 M154 I189 V219 V221	F115-I119 HydrophobicContact CD2-CD1 4.25Å; F115-I119 WeakPolarHBondContact O-CB 3.28Å; F115-I119 WeakPolarHBondContact O-CD1 3.4Å; F115-I119 VanDerWaalsContact O-CG1 3.24Å; F115-I119 WeakPolarHBondContact O-CG1 3.17Å; F115-I119 PolarHBondContact O-N 3.23Å; V116-I119 PolarHBondContact O-N 2.93Å; I117-I119 VanDerWaalsContact C-N 3.31Å; I117-I119 PolarHBondContact O-N 3.15Å; I119-L122 PolarHBondContact O-N 2.85Å; I119-L123 HydrophobicContact CG2-CD1 4.39Å; I119-L123 VanDerWaalsContact O-CG 3.3Å; I119-L123 WeakPolarHBondContact O-CG 3.15Å; I119-L123 PolarHBondContact O-N 2.8Å; I119-A137 HydrophobicContact CB-CB 4.5Å; I119-A137 HydrophobicContact CD1-CB 4.49Å; I119-A137 HydrophobicContact CG1-CB 4.2Å; I119-A137 HydrophobicContact CG2-CB 3.58Å; I119-V139 HydrophobicContact CD1-CG2 3.76Å; I119-M154 HydrophobicContact CB-CE 4.27Å; I119-M154 HydrophobicContact CD1-CE 3.92Å; I119-M154 HydrophobicContact CG2-CE 3.88Å; I119-I189 HydrophobicContact CG2-CD1 4.11Å; I119-I189 HydrophobicContact CG2-CG1 4.28Å; I119-V219 HydrophobicContact CG1-CB 4.47Å; I119-V219 HydrophobicContact CG1-CG1 3.9Å; I119-V221 HydrophobicContact CD1-CG2 3.95Å; I119-V221 HydrophobicContact CG1-CG2 4.49Å
120	I	94.3	Very high	91	Very high	0 Å²	0	43.8 Å²	43.8	0%	0	21%	0.208	C	C	.	.	H	α-helix	trans	-68.6	-45.4	-174.8	-61.9	175	0	0	0	110.2	I72 V116 I117 P118 L122 L123 L124 M154 F157 F161 F164	I72-I120 HydrophobicContact CD1-CB 4.23Å; I72-I120 HydrophobicContact CD1-CG2 4Å; V116-I120 HydrophobicContact CG1-CD1 4.32Å; V116-I120 PolarHBondContact O-N 2.97Å; I117-I120 PolarHBondContact O-N 3.21Å; P118-I120 PolarHBondContact O-N 3.06Å; I120-L122 PolarHBondContact O-N 3.44Å; I120-L123 PolarHBondContact O-N 2.95Å; I120-L124 HydrophobicContact CG2-CD1 3.92Å; I120-L124 HydrophobicContact CG2-CG 4.39Å; I120-L124 VanDerWaalsContact O-CG 3.3Å; I120-L124 WeakPolarHBondContact O-CG 3.33Å; I120-L124 PolarHBondContact O-N 3.11Å; I120-M154 HydrophobicContact CD1-SD 3.93Å; I120-M154 HydrophobicContact CG1-SD 4.07Å; I120-F157 HydrophobicContact CD1-CB 3.31Å; I120-F157 HydrophobicContact CD1-CG 3.99Å; I120-F161 HydrophobicContact CG2-CD2 3.95Å; I120-F161 HydrophobicContact CG2-CE2 3.78Å; I120-F161 HydrophobicContact CG2-CZ 4.18Å; I120-F164 HydrophobicContact CG2-CE2 4.34Å
121	E	93.3	Very high	91.2	Very high	3 Å²	3	49.8 Å²	49.8	1%	0.014	23%	0.227	C	C	.	.	H	α-helix	trans	-53.8	-48.3	174.5	-80.7	-67.3	139.8	0	0	113.3	L68 N69 I72 M96 I117 L123 L124 K125	L68-E121 HydrophobicContact CD2-CG 4Å; N69-E121 WeakPolarHBondContact CB-OE1 3.41Å; N69-E121 PolarHBondContact N-OE1 3.3Å; I72-E121 HydrophobicContact CD1-CG 3.91Å; I72-E121 WeakPolarHBondContact CD1-OE1 3.24Å; M96-E121 HydrophobicContact CE-CB 3.93Å; M96-E121 HydrophobicContact CE-CG 3.76Å; M96-E121 WeakPolarHBondContact CE-OE2 3.46Å; M96-E121 HydrophobicContact CG-CB 4.31Å; M96-E121 HydrophobicContact SD-CB 4.19Å; M96-E121 HydrophobicContact SD-CG 4.01Å; I117-E121 HydrophobicContact CG2-CG 4.47Å; I117-E121 WeakPolarHBondContact O-CB 3.25Å; I117-E121 PolarHBondContact O-N 2.74Å; E121-L123 VanDerWaalsContact C-N 3.35Å; E121-L123 PolarHBondContact O-N 3.5Å; E121-L124 PolarHBondContact O-N 3.09Å; E121-K125 WeakPolarHBondContact O-CB 3.44Å; E121-K125 WeakPolarHBondContact O-CG 3.46Å; E121-K125 PolarHBondContact O-N 3.31Å; E121-K125 VanDerWaalsContact OE2-CE 3.25Å; E121-K125 WeakPolarHBondContact OE2-CE 3.36Å; E121-K125 IonicContact OE2-NZ 2.64Å; E121-K125 PolarHBondContact OE2-NZ 3.42Å
122	L	92.3	Very high	90.9	Very high	10 Å²	10	54.6 Å²	54.6	5%	0.052	25%	0.248	C	C	.	.	H	α-helix	trans	-70.1	-30.4	-179.2	-70.7	168.6	0	0	0	112.6	P118 I119 I120 R126 V219	P118-L122 HydrophobicContact CB-CD1 4.45Å; P118-L122 WeakPolarHBondContact O-CB 3.35Å; P118-L122 WeakPolarHBondContact O-CD1 3.19Å; P118-L122 WeakPolarHBondContact O-CG 3.11Å; P118-L122 PolarHBondContact O-N 3.44Å; I119-L122 PolarHBondContact O-N 2.85Å; I120-L122 PolarHBondContact O-N 3.44Å; L122-R126 WeakPolarHBondContact O-CG 3.19Å; L122-V219 HydrophobicContact CB-CG2 4.26Å; L122-V219 HydrophobicContact CD1-CG2 3.86Å
123	L	92.4	Very high	90.6	Very high	9 Å²	9	59.1 Å²	59.1	5%	0.047	27%	0.266	C	S	.	.	H	α-helix	trans	-77.3	-28.8	174.7	-65.8	-169.2	0	0	0	113.1	I119 I120 E121 L130 A137 F164 I189 D218	I119-L123 HydrophobicContact CG2-CD1 4.39Å; I119-L123 VanDerWaalsContact O-CG 3.3Å; I119-L123 WeakPolarHBondContact O-CG 3.15Å; I119-L123 PolarHBondContact O-N 2.8Å; I120-L123 PolarHBondContact O-N 2.95Å; E121-L123 VanDerWaalsContact C-N 3.35Å; E121-L123 PolarHBondContact O-N 3.5Å; L123-L130 HydrophobicContact CD1-CD1 4.14Å; L123-L130 HydrophobicContact CD2-CD1 4.06Å; L123-A137 HydrophobicContact CD1-CB 4.08Å; L123-F164 HydrophobicContact CB-CE1 3.86Å; L123-F164 HydrophobicContact CB-CE2 4.37Å; L123-F164 HydrophobicContact CB-CZ 3.69Å; L123-I189 HydrophobicContact CD1-CD1 4.09Å; L123-I189 HydrophobicContact CD1-CG1 3.73Å; L123-D218 HydrophobicContact CD2-CB 4.49Å
124	L	91.8	Very high	90.5	Very high	52 Å²	52	61.1 Å²	61.1	27%	0.272	28%	0.275	S	S	.	.	H	α-helix	trans	-71.7	-36.2	172.1	-71.3	166.9	0	0	0	112.3	N69 I120 E121 R126 F161 F164	N69-L124 HydrophobicContact CB-CD1 4.37Å; I120-L124 HydrophobicContact CG2-CD1 3.92Å; I120-L124 HydrophobicContact CG2-CG 4.39Å; I120-L124 VanDerWaalsContact O-CG 3.3Å; I120-L124 WeakPolarHBondContact O-CG 3.33Å; I120-L124 PolarHBondContact O-N 3.11Å; E121-L124 PolarHBondContact O-N 3.09Å; L124-R126 VanDerWaalsContact C-N 3.29Å; L124-R126 PolarHBondContact O-N 2.94Å; L124-F161 HydrophobicContact CD1-CD1 4.17Å; L124-F161 HydrophobicContact CD1-CE1 3.5Å; L124-F161 HydrophobicContact CD1-CZ 3.81Å; L124-F161 HydrophobicContact CD2-CD1 3.8Å; L124-F161 HydrophobicContact CD2-CE1 3.86Å; L124-F161 HydrophobicContact CG-CE1 4.28Å; L124-F164 HydrophobicContact CD2-CE2 3.65Å; L124-F164 HydrophobicContact CD2-CZ 3.77Å; L124-F164 HydrophobicContact CG-CE2 3.82Å; L124-F164 HydrophobicContact CG-CZ 3.97Å
125	K	89.5	Confident	90.5	Very high	132 Å²	132	61.1 Å²	61.1	57%	0.574	28%	0.275	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.9	17.8	-175.6	-71.9	168.4	171.9	163.9	0	114	Q67 E121	Q67-K125 PolarHBondContact O-NZ 3.23Å; E121-K125 WeakPolarHBondContact O-CB 3.44Å; E121-K125 WeakPolarHBondContact O-CG 3.46Å; E121-K125 PolarHBondContact O-N 3.31Å; E121-K125 VanDerWaalsContact OE2-CE 3.25Å; E121-K125 WeakPolarHBondContact OE2-CE 3.36Å; E121-K125 IonicContact OE2-NZ 2.64Å; E121-K125 PolarHBondContact OE2-NZ 3.42Å
126	R	88.3	Confident	90.5	Very high	51 Å²	51	61.1 Å²	61.1	19%	0.192	28%	0.275	C	S	.	.			trans	-83.5	138.2	175.1	-54.5	-174.4	95.1	-171.9	2.5	111.1	L122 L124 E128 L130 S216 D218	L122-R126 WeakPolarHBondContact O-CG 3.19Å; L124-R126 VanDerWaalsContact C-N 3.29Å; L124-R126 PolarHBondContact O-N 2.94Å; R126-E128 WeakPolarHBondContact CB-O 3.3Å; R126-L130 VanDerWaalsContact NH1-CD2 3.27Å; R126-S216 PolarHBondContact NH1-O 2.81Å; R126-S216 VanDerWaalsContact NH1-O 3.1Å; R126-S216 PolarHBondContact NH2-O 2.85Å; R126-D218 VanDerWaalsContact CZ-CG 3.4Å; R126-D218 IonicContact CZ-OD1 3.74Å; R126-D218 IonicContact CZ-OD2 3.6Å; R126-D218 VanDerWaalsContact NE-CG 3.3Å; R126-D218 IonicContact NE-OD1 3.63Å; R126-D218 IonicContact NE-OD2 3.25Å; R126-D218 PolarHBondContact NE-OD2 2.94Å; R126-D218 IonicContact NH2-OD1 2.67Å; R126-D218 PolarHBondContact NH2-OD1 3.09Å; R126-D218 IonicContact NH2-OD2 2.84Å
127	E	83.6	Confident	90.5	Very high	205 Å²	205	61.1 Å²	61.1	96%	0.958	28%	0.275	S	S	*	.	S	Bend	trans	-63.4	-48.8	173.5	-63.7	168.7	-172.1	0	0	111.1
128	E	86.4	Confident	90.6	Very high	160 Å²	160	61.2 Å²	61.2	75%	0.748	28%	0.275	S	S	*	.	S	Bend	trans	-87.5	121.7	170.3	-68.8	-162.4	168.6	0	0	111.8	R126	R126-E128 WeakPolarHBondContact CB-O 3.3Å
129	K	87.2	Confident	90.7	Very high	194 Å²	194	61.2 Å²	61.2	84%	0.843	28%	0.275	S	S	*	.	P	Polyproline II helix	trans	-70.2	133.8	172.7	-65.4	-169.5	179.1	-172.7	0	111.2	K131	K129-K131 PolarHBondContact O-N 3.01Å
130	L	88.3	Confident	90.8	Very high	28 Å²	28	61.2 Å²	61.2	15%	0.147	28%	0.275	C	S	.	.	P	Polyproline II helix	trans	-60.9	131.8	177.2	-82.4	167.9	0	0	0	112.4	L123 R126 Q134 N188	L123-L130 HydrophobicContact CD1-CD1 4.14Å; L123-L130 HydrophobicContact CD2-CD1 4.06Å; R126-L130 VanDerWaalsContact NH1-CD2 3.27Å; L130-Q134 HydrophobicContact CD2-CB 3.62Å; L130-N188 HydrophobicContact CD1-CB 4.05Å
131	K	88.1	Confident	90.7	Very high	149 Å²	149	61.2 Å²	61.2	65%	0.648	28%	0.275	S	S	*	.	P	Polyproline II helix	trans	-75.2	150.8	166.6	-60.6	169.1	-174.6	173.1	0	109.1	K129 K133 Q134 N188	K129-K131 PolarHBondContact O-N 3.01Å; K131-K133 PolarHBondContact O-N 3.41Å; K131-Q134 HydrophobicContact CB-CG 4.24Å; K131-Q134 VanDerWaalsContact CB-OE1 3.27Å; K131-Q134 WeakPolarHBondContact O-CB 3.36Å; K131-Q134 PolarHBondContact O-N 2.93Å; K131-N188 PolarHBondContact O-ND2 3.25Å; K131-N188 VanDerWaalsContact O-ND2 3.1Å
132	K	82.5	Confident	90.5	Very high	116 Å²	116	61.3 Å²	61.3	50%	0.504	28%	0.277	S	S	.	.	T	Hydrogen-bonded Turn	trans	-49.8	-33.9	-176.7	-172.2	171.2	178.2	-176.8	0	114.7	E184 H185 G186 G187	K132-E184 WeakPolarHBondContact CE-O 3.49Å; K132-E184 PolarHBondContact NZ-O 3.5Å; K132-H185 WeakPolarHBondContact CE-O 3.21Å; K132-G186 WeakPolarHBondContact O-CA 3.44Å; K132-G187 PolarHBondContact O-N 3.07Å
133	K	85.3	Confident	90.2	Very high	121 Å²	121	61.5 Å²	61.5	53%	0.526	28%	0.278	S	S	.	.	T	Hydrogen-bonded Turn	trans	-97.2	10.9	179.7	-63.2	-176.2	177.8	-178.8	0	114.6	K131 F182 K183 A213	K131-K133 PolarHBondContact O-N 3.41Å; K133-F182 HydrophobicContact CB-CE1 4.39Å; K133-K183 WeakPolarHBondContact CE-O 3.35Å; K133-K183 PolarHBondContact NZ-O 3.37Å; K133-A213 WeakPolarHBondContact O-CB 3.42Å
134	Q	90.9	Very high	89.9	Confident	53 Å²	53	63 Å²	63	25%	0.248	28%	0.283	C	S	.	.			trans	-101.8	129.5	174.8	-82.3	176.7	-45	0	0	110.2	L130 K131 N188 S216	L130-Q134 HydrophobicContact CD2-CB 3.62Å; K131-Q134 HydrophobicContact CB-CG 4.24Å; K131-Q134 VanDerWaalsContact CB-OE1 3.27Å; K131-Q134 WeakPolarHBondContact O-CB 3.36Å; K131-Q134 PolarHBondContact O-N 2.93Å; Q134-N188 WeakPolarHBondContact O-CA 3.23Å; Q134-N188 PolarHBondContact O-ND2 3.41Å; Q134-S216 VanDerWaalsContact CB-OG 3.32Å; Q134-S216 WeakPolarHBondContact CB-OG 3.35Å
135	V	93.4	Very high	89.5	Confident	0 Å²	0	60.6 Å²	60.6	0%	0	27%	0.27	C	S	.	.			trans	-84.4	128.9	173.2	-172.4	0	0	0	0	108.3	A137 F182 V190 L210 A213 V214 S216 L217	V135-A137 WeakPolarHBondContact CG1-O 3.21Å; V135-F182 HydrophobicContact CG2-CE2 4.3Å; V135-F182 HydrophobicContact CG2-CZ 4.37Å; V135-V190 HydrophobicContact CB-CG2 4.42Å; V135-V190 HydrophobicContact CG1-CB 4.28Å; V135-V190 HydrophobicContact CG1-CG2 3.67Å; V135-V190 HydrophobicContact CG2-CG2 3.81Å; V135-L210 HydrophobicContact CG2-CD1 4.35Å; V135-A213 HydrophobicContact CG2-CB 4.1Å; V135-A213 PolarHBondContact N-O 2.92Å; V135-V214 HydrophobicContact CB-CG1 4.03Å; V135-V214 HydrophobicContact CG1-CG1 4.4Å; V135-V214 HydrophobicContact CG2-CG1 3.89Å; V135-S216 CarbonylContact O-C 3.59Å; V135-S216 PolarHBondContact O-OG 2.75Å; V135-L217 HydrophobicContact CG1-CD1 3.82Å; V135-L217 PolarHBondContact O-N 3.03Å
136	G	93.4	Very high	89.4	Confident	0 Å²	0	54.4 Å²	54.4	0%	0	24%	0.243	C	C	.	.			trans	-105.1	-35.3	173	0	0	0	0	0	113.2	N188 D218 V219	G136-N188 PolarHBondContact N-O 2.83Å; G136-D218 PolarHBondContact O-N 3.14Å; G136-V219 PolarHBondContact O-N 3.05Å; G136-V219 VanDerWaalsContact O-N 3.14Å
137	A	96.1	Very high	89.5	Confident	0 Å²	0	52 Å²	52	0%	0	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.9	145.4	177.4	0	0	0	0	0	112.7	I119 L123 V135 N188 I189 V190 V219	I119-A137 HydrophobicContact CB-CB 4.5Å; I119-A137 HydrophobicContact CD1-CB 4.49Å; I119-A137 HydrophobicContact CG1-CB 4.2Å; I119-A137 HydrophobicContact CG2-CB 3.58Å; L123-A137 HydrophobicContact CD1-CB 4.08Å; V135-A137 WeakPolarHBondContact CG1-O 3.21Å; A137-N188 PolarHBondContact N-O 3.49Å; A137-N188 VanDerWaalsContact N-O 3.09Å; A137-I189 HydrophobicContact CB-CG1 4.31Å; A137-I189 WeakPolarHBondContact O-CA 3.41Å; A137-V190 PolarHBondContact O-N 2.87Å; A137-V219 CarbonylContact C-O 3.59Å; A137-V219 VanDerWaalsContact CA-O 3.31Å; A137-V219 WeakPolarHBondContact CA-O 3.48Å; A137-V219 HydrophobicContact CB-CB 4.13Å
138	L	96.4	Very high	89.9	Confident	2 Å²	2	44.3 Å²	44.3	1%	0.01	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.5	119.3	-178.2	172.8	60.1	0	0	0	110.1	I140 V190 L197 L217 V219 L220 V221 L244	L138-I140 HydrophobicContact CD1-CG1 4.27Å; L138-I140 HydrophobicContact CD2-CD1 4.24Å; L138-I140 HydrophobicContact CD2-CG1 4.38Å; L138-I140 HydrophobicContact CG-CD1 4.43Å; L138-I140 HydrophobicContact CG-CG1 4.03Å; L138-V190 CarbonylContact C-O 3.48Å; L138-V190 WeakPolarHBondContact CA-O 3.46Å; L138-V190 HydrophobicContact CD1-CB 3.82Å; L138-V190 HydrophobicContact CD1-CG1 3.62Å; L138-L197 HydrophobicContact CD1-CD1 4.35Å; L138-L197 HydrophobicContact CD1-CD2 3.81Å; L138-L197 HydrophobicContact CD2-CD2 4.05Å; L138-L197 HydrophobicContact CG-CD2 4.45Å; L138-L217 HydrophobicContact CB-CD1 3.57Å; L138-L217 HydrophobicContact CB-CD2 4.24Å; L138-L217 HydrophobicContact CD2-CD2 4.43Å; L138-V219 PolarHBondContact N-O 3.28Å; L138-L220 HydrophobicContact CB-CD1 4.36Å; L138-L220 HydrophobicContact CD2-CD1 4.02Å; L138-L220 HydrophobicContact CG-CD1 4.06Å; L138-L220 CarbonylContact O-C 3.56Å; L138-L220 WeakPolarHBondContact O-CA 3.39Å; L138-V221 PolarHBondContact O-N 2.82Å; L138-L244 HydrophobicContact CD2-CD1 3.86Å; L138-L244 HydrophobicContact CD2-CD2 3.93Å
139	V	97	Very high	90	Very high	0 Å²	0	37.4 Å²	37.4	0%	0	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109	117.7	175.6	-171.4	0	0	0	0	109.4	F115 I119 I150 V190 I191 A192 V221	F115-V139 HydrophobicContact CE2-CG1 4.08Å; F115-V139 HydrophobicContact CZ-CG1 4.44Å; I119-V139 HydrophobicContact CD1-CG2 3.76Å; V139-I150 HydrophobicContact CG1-CD1 4.25Å; V139-I150 HydrophobicContact CG1-CG2 4.33Å; V139-V190 PolarHBondContact N-O 3.37Å; V139-I191 HydrophobicContact CB-CG1 4.2Å; V139-I191 HydrophobicContact CG2-CG1 4.3Å; V139-I191 WeakPolarHBondContact O-CA 3.43Å; V139-A192 PolarHBondContact O-N 3.11Å; V139-V221 HydrophobicContact CB-CB 4.43Å; V139-V221 HydrophobicContact CG1-CB 4.16Å; V139-V221 HydrophobicContact CG1-CG1 4.07Å; V139-V221 HydrophobicContact CG2-CB 4.21Å
140	I	95.4	Very high	90.3	Very high	0 Å²	0	28.2 Å²	28.2	0%	0	13%	0.127	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.1	131.9	177.8	-50.9	-178.2	0	0	0	109.4	L138 A192 P194 L197 L220 V221 L222 D223 L228 L237 I240	L138-I140 HydrophobicContact CD1-CG1 4.27Å; L138-I140 HydrophobicContact CD2-CD1 4.24Å; L138-I140 HydrophobicContact CD2-CG1 4.38Å; L138-I140 HydrophobicContact CG-CD1 4.43Å; L138-I140 HydrophobicContact CG-CG1 4.03Å; I140-A192 WeakPolarHBondContact CA-O 3.49Å; I140-P194 HydrophobicContact CG2-CG 3.71Å; I140-L197 HydrophobicContact CD1-CD2 3.99Å; I140-L197 HydrophobicContact CG1-CD2 4.12Å; I140-L220 HydrophobicContact CD1-CD1 3.95Å; I140-L220 HydrophobicContact CG1-CD1 4.22Å; I140-V221 PolarHBondContact N-O 3.23Å; I140-L222 HydrophobicContact CB-CD2 3.9Å; I140-L222 HydrophobicContact CD1-CD2 3.92Å; I140-L222 HydrophobicContact CG1-CD2 4.19Å; I140-D223 PolarHBondContact O-N 3.09Å; I140-L228 HydrophobicContact CG2-CD1 4.38Å; I140-L228 HydrophobicContact CG2-CD2 4.36Å; I140-L237 HydrophobicContact CD1-CD2 4.3Å; I140-L237 HydrophobicContact CG2-CD2 3.98Å; I140-I240 HydrophobicContact CD1-CG2 3.81Å
141	T	93	Very high	90.6	Very high	0 Å²	0	27.7 Å²	27.7	0%	0	13%	0.126	C	C	.	.			trans	-145.5	145.6	-173.6	169.1	0	0	0	0	111.9	T143 L146 A147 I150 A192 P194	T141-T143 PolarHBondContact O-N 3.12Å; T141-L146 WeakPolarHBondContact OG1-CB 3.1Å; T141-L146 WeakPolarHBondContact OG1-CD2 3.39Å; T141-L146 VanDerWaalsContact OG1-CG 3.26Å; T141-L146 WeakPolarHBondContact OG1-CG 3.36Å; T141-A147 HydrophobicContact CG2-CB 3.59Å; T141-I150 HydrophobicContact CG2-CD1 4.3Å; T141-A192 WeakPolarHBondContact CG2-O 3.43Å; T141-A192 PolarHBondContact N-O 3.08Å; T141-P194 WeakPolarHBondContact O-CD 3.46Å
142	P	88.6	Confident	90.8	Very high	6 Å²	6	24.1 Å²	24.1	4%	0.039	11%	0.112	C	C	.	.	S	Bend	trans	-73.6	-17.6	-169.3	27.5	-38.2	0	0	0	115.8	D223 E224 R227 L228 M231	P142-D223 WeakPolarHBondContact CD-O 3.45Å; P142-E224 HydrophobicContact CG-CB 4.04Å; P142-R227 HydrophobicContact CB-CB 4.27Å; P142-R227 HydrophobicContact CB-CG 3.81Å; P142-R227 HydrophobicContact CG-CB 3.97Å; P142-R227 HydrophobicContact CG-CG 3.81Å; P142-L228 HydrophobicContact CB-CD2 3.88Å; P142-L228 HydrophobicContact CB-CG 4.33Å; P142-M231 HydrophobicContact CB-SD 4.1Å
143	T	86	Confident	91.3	Very high	13 Å²	13	19.8 Å²	19.8	8%	0.08	10%	0.095	C	C	.	.			trans	-130.2	148.4	-175.4	71.1	0	0	0	0	112.9	T141 E145 L146 A147	T141-T143 PolarHBondContact O-N 3.12Å; T143-E145 PolarHBondContact O-N 3.49Å; T143-L146 PolarHBondContact O-N 3.2Å; T143-L146 VanDerWaalsContact OG1-CB 3.32Å; T143-L146 WeakPolarHBondContact OG1-CB 3.48Å; T143-L146 PolarHBondContact OG1-N 3.35Å; T143-A147 WeakPolarHBondContact O-CB 3.3Å; T143-A147 PolarHBondContact O-N 3.07Å
144	R	86.6	Confident	91.8	Very high	41 Å²	41	14 Å²	14	16%	0.155	7%	0.07	C	C	.	.	H	α-helix	trans	-61.6	-34.3	177.2	-60.3	173.1	64.4	-168.7	13.9	111.4	L148 I170 G171 T193 K356	R144-L148 WeakPolarHBondContact O-CB 3.37Å; R144-L148 WeakPolarHBondContact O-CD1 3.38Å; R144-L148 WeakPolarHBondContact O-CG 3.5Å; R144-L148 PolarHBondContact O-N 3.36Å; R144-I170 HydrophobicContact CB-CB 4.4Å; R144-I170 HydrophobicContact CB-CD1 4.39Å; R144-I170 HydrophobicContact CG-CB 4.25Å; R144-G171 VanDerWaalsContact CD-O 3.24Å; R144-G171 WeakPolarHBondContact CD-O 3.44Å; R144-G171 PolarHBondContact NE-O 3.04Å; R144-G171 PolarHBondContact NH2-O 2.91Å; R144-T193 HydrophobicContact CG-CG2 4.38Å; R144-K356 PolarHBondContact NH1-O 3.48Å
145	E	84.2	Confident	91.9	Very high	1 Å²	1	12 Å²	12	1%	0.005	6%	0.064	C	C	.	.	H	α-helix	trans	-72.6	-41.7	-177.1	-66.9	62.1	-141.3	0	0	111.4	T143 L148 Q149 R359 I384	T143-E145 PolarHBondContact O-N 3.49Å; E145-L148 PolarHBondContact O-N 3.29Å; E145-Q149 WeakPolarHBondContact O-CB 3.33Å; E145-Q149 PolarHBondContact O-N 3.42Å; E145-R359 IonicContact OE1-CZ 3.3Å; E145-R359 IonicContact OE1-NE 3.24Å; E145-R359 PolarHBondContact OE1-NE 3.06Å; E145-R359 IonicContact OE1-NH2 3.63Å; E145-R359 PolarHBondContact OE1-NH2 3.47Å; E145-R359 IonicContact OE2-CZ 3.56Å; E145-R359 IonicContact OE2-NE 3.89Å; E145-R359 IonicContact OE2-NH2 2.73Å; E145-R359 PolarHBondContact OE2-NH2 3.31Å; E145-I384 HydrophobicContact CB-CD1 3.35Å; E145-I384 HydrophobicContact CB-CG1 3.67Å; E145-I384 HydrophobicContact CG-CD1 3.85Å
146	L	86.6	Confident	91.9	Very high	2 Å²	2	16 Å²	16	1%	0.01	8%	0.084	C	C	.	.	H	α-helix	trans	-69.3	-37.5	172.4	-177.9	55.4	0	0	0	111.1	T141 T143 Q149 I150 D223 E224 G383	T141-L146 WeakPolarHBondContact OG1-CB 3.1Å; T141-L146 WeakPolarHBondContact OG1-CD2 3.39Å; T141-L146 VanDerWaalsContact OG1-CG 3.26Å; T141-L146 WeakPolarHBondContact OG1-CG 3.36Å; T143-L146 PolarHBondContact O-N 3.2Å; T143-L146 VanDerWaalsContact OG1-CB 3.32Å; T143-L146 WeakPolarHBondContact OG1-CB 3.48Å; T143-L146 PolarHBondContact OG1-N 3.35Å; L146-Q149 PolarHBondContact O-N 3.43Å; L146-I150 HydrophobicContact CD1-CD1 4.01Å; L146-I150 HydrophobicContact CD1-CG1 4.05Å; L146-I150 HydrophobicContact CG-CD1 3.83Å; L146-I150 HydrophobicContact CG-CG1 4.36Å; L146-I150 VanDerWaalsContact O-CG1 3.27Å; L146-I150 WeakPolarHBondContact O-CG1 3.41Å; L146-I150 PolarHBondContact O-N 3.36Å; L146-D223 WeakPolarHBondContact CD2-OD2 3.41Å; L146-E224 HydrophobicContact CD2-CG 4.21Å; L146-G383 VanDerWaalsContact CD2-CA 3.48Å
147	A	91.4	Very high	91.9	Very high	0 Å²	0	16 Å²	16	0%	0	8%	0.084	C	C	.	.	H	α-helix	trans	-60.6	-43.8	173.2	0	0	0	0	0	112.8	T141 T143 I150 S151 L168 I170 I191 T193	T141-A147 HydrophobicContact CG2-CB 3.59Å; T143-A147 WeakPolarHBondContact O-CB 3.3Å; T143-A147 PolarHBondContact O-N 3.07Å; A147-I150 PolarHBondContact O-N 2.9Å; A147-S151 WeakPolarHBondContact O-CB 3.35Å; A147-S151 PolarHBondContact O-N 3Å; A147-L168 HydrophobicContact CB-CD1 3.77Å; A147-L168 WeakPolarHBondContact O-CD1 3.39Å; A147-I170 HydrophobicContact CB-CG2 3.52Å; A147-I191 HydrophobicContact CB-CG2 4.24Å; A147-I191 WeakPolarHBondContact O-CG2 3.34Å; A147-T193 HydrophobicContact CB-CG2 4.38Å
148	L	90.4	Very high	91.7	Very high	44 Å²	44	16.9 Å²	16.9	23%	0.23	9%	0.088	C	C	.	.	H	α-helix	trans	-58.1	-51.4	172	-80.9	159.8	0	0	0	111.1	R144 E145 I150 S151 E152 L168 I170	R144-L148 WeakPolarHBondContact O-CB 3.37Å; R144-L148 WeakPolarHBondContact O-CD1 3.38Å; R144-L148 WeakPolarHBondContact O-CG 3.5Å; R144-L148 PolarHBondContact O-N 3.36Å; E145-L148 PolarHBondContact O-N 3.29Å; L148-I150 PolarHBondContact O-N 2.83Å; L148-S151 CarbonylContact O-C 3.55Å; L148-S151 WeakPolarHBondContact O-CB 3.48Å; L148-S151 PolarHBondContact O-N 3.47Å; L148-S151 VanDerWaalsContact O-N 3.08Å; L148-E152 WeakPolarHBondContact O-CG 3.29Å; L148-E152 PolarHBondContact O-N 2.8Å; L148-L168 HydrophobicContact CD2-CD2 3.49Å; L148-L168 VanDerWaalsContact CD2-CD2 3.49Å; L148-L168 HydrophobicContact CG-CD2 3.98Å; L148-I170 HydrophobicContact CD1-CD1 4.2Å; L148-I170 HydrophobicContact CD2-CD1 4.34Å; L148-I170 HydrophobicContact CG-CD1 4.06Å
149	Q	89.7	Confident	91.4	Very high	16 Å²	16	24.3 Å²	24.3	8%	0.075	12%	0.123	C	C	.	.	H	α-helix	trans	-60.4	-40.8	179.9	-177.3	-169.8	-43.8	0	0	113.1	E145 L146 S151 E152 V153	E145-Q149 WeakPolarHBondContact O-CB 3.33Å; E145-Q149 PolarHBondContact O-N 3.42Å; L146-Q149 PolarHBondContact O-N 3.43Å; Q149-S151 VanDerWaalsContact C-N 3.33Å; Q149-E152 PolarHBondContact O-N 3.29Å; Q149-V153 WeakPolarHBondContact O-CG2 3.37Å; Q149-V153 PolarHBondContact O-N 2.93Å
150	I	93.4	Very high	91.1	Very high	0 Å²	0	26.8 Å²	26.8	0%	0	13%	0.133	C	C	.	.	H	α-helix	trans	-67	-37	175.6	-64.4	165	0	0	0	110.3	T112 F115 V139 T141 L146 A147 L148 V153 M154 I191	T112-I150 HydrophobicContact CG2-CG1 4.19Å; F115-I150 HydrophobicContact CE2-CG2 4.08Å; F115-I150 HydrophobicContact CZ-CD1 4.12Å; F115-I150 HydrophobicContact CZ-CG1 4.42Å; V139-I150 HydrophobicContact CG1-CD1 4.25Å; V139-I150 HydrophobicContact CG1-CG2 4.33Å; T141-I150 HydrophobicContact CG2-CD1 4.3Å; L146-I150 HydrophobicContact CD1-CD1 4.01Å; L146-I150 HydrophobicContact CD1-CG1 4.05Å; L146-I150 HydrophobicContact CG-CD1 3.83Å; L146-I150 HydrophobicContact CG-CG1 4.36Å; L146-I150 VanDerWaalsContact O-CG1 3.27Å; L146-I150 WeakPolarHBondContact O-CG1 3.41Å; L146-I150 PolarHBondContact O-N 3.36Å; A147-I150 PolarHBondContact O-N 2.9Å; L148-I150 PolarHBondContact O-N 2.83Å; I150-V153 PolarHBondContact O-N 2.88Å; I150-M154 WeakPolarHBondContact O-CB 3.5Å; I150-M154 PolarHBondContact O-N 2.91Å; I150-I191 HydrophobicContact CB-CG2 4.22Å; I150-I191 HydrophobicContact CG2-CD1 4Å; I150-I191 HydrophobicContact CG2-CG1 4.34Å; I150-I191 HydrophobicContact CG2-CG2 4.19Å
151	S	94.4	Very high	90.9	Very high	18 Å²	18	26.8 Å²	26.8	13%	0.126	13%	0.134	C	C	.	.	H	α-helix	trans	-70.4	-32.6	177	-172.9	0	0	0	0	113.4	A147 L148 Q149 G155 Q166	A147-S151 WeakPolarHBondContact O-CB 3.35Å; A147-S151 PolarHBondContact O-N 3Å; L148-S151 CarbonylContact O-C 3.55Å; L148-S151 WeakPolarHBondContact O-CB 3.48Å; L148-S151 PolarHBondContact O-N 3.47Å; L148-S151 VanDerWaalsContact O-N 3.08Å; Q149-S151 VanDerWaalsContact C-N 3.33Å; S151-G155 WeakPolarHBondContact O-CA 3.44Å; S151-G155 PolarHBondContact O-N 2.98Å; S151-Q166 PolarHBondContact O-NE2 3.47Å; S151-Q166 PolarHBondContact O-OE1 2.93Å; S151-Q166 PolarHBondContact OG-NE2 2.84Å
152	E	92.5	Very high	90.6	Very high	73 Å²	73	32.1 Å²	32.1	34%	0.341	17%	0.168	S	C	.	.	H	α-helix	trans	-63.7	-49.2	168.2	-69.6	169.3	-173.2	0	0	111.1	L148 Q149 G155 M156 R367	L148-E152 WeakPolarHBondContact O-CG 3.29Å; L148-E152 PolarHBondContact O-N 2.8Å; Q149-E152 PolarHBondContact O-N 3.29Å; E152-G155 PolarHBondContact O-N 3.4Å; E152-M156 WeakPolarHBondContact O-CE 3.41Å; E152-M156 PolarHBondContact O-N 3.48Å; E152-R367 IonicContact OE1-NH1 2.73Å; E152-R367 PolarHBondContact OE1-NH1 2.69Å; E152-R367 IonicContact OE2-CZ 3.63Å; E152-R367 IonicContact OE2-NH1 3.84Å; E152-R367 PolarHBondContact OE2-NH1 2.97Å; E152-R367 IonicContact OE2-NH2 2.7Å; E152-R367 PolarHBondContact OE2-NH2 2.89Å
153	V	93	Very high	90.6	Very high	25 Å²	25	36.6 Å²	36.6	15%	0.152	19%	0.189	C	C	.	.	H	α-helix	trans	-62.8	-50.4	180	172.9	0	0	0	0	111.3	T112 L113 V116 Q149 I150 G155 M156 F157	T112-V153 HydrophobicContact CG2-CB 4.36Å; T112-V153 HydrophobicContact CG2-CG1 4.09Å; L113-V153 HydrophobicContact CD2-CG1 3.97Å; V116-V153 HydrophobicContact CG2-CG1 4.32Å; Q149-V153 WeakPolarHBondContact O-CG2 3.37Å; Q149-V153 PolarHBondContact O-N 2.93Å; I150-V153 PolarHBondContact O-N 2.88Å; V153-G155 VanDerWaalsContact C-N 3.31Å; V153-G155 PolarHBondContact O-N 3.46Å; V153-M156 HydrophobicContact CG2-CE 4.42Å; V153-M156 PolarHBondContact O-N 2.72Å; V153-F157 HydrophobicContact CG1-CE2 4.24Å; V153-F157 VanDerWaalsContact O-CD2 3.3Å; V153-F157 WeakPolarHBondContact O-CD2 3.31Å
154	M	94.8	Very high	90.9	Very high	0 Å²	0	36.7 Å²	36.7	0%	0	19%	0.188	C	C	.	.	H	α-helix	trans	-60.5	-40.1	176.9	-177.2	67.1	78.3	0	0	111.6	V116 I119 I120 I150 M156 F157 I158 I189 I191	V116-M154 HydrophobicContact CB-CE 4.31Å; V116-M154 HydrophobicContact CG1-CE 4.13Å; V116-M154 HydrophobicContact CG1-SD 3.97Å; V116-M154 HydrophobicContact CG2-CE 3.94Å; I119-M154 HydrophobicContact CB-CE 4.27Å; I119-M154 HydrophobicContact CD1-CE 3.92Å; I119-M154 HydrophobicContact CG2-CE 3.88Å; I120-M154 HydrophobicContact CD1-SD 3.93Å; I120-M154 HydrophobicContact CG1-SD 4.07Å; I150-M154 WeakPolarHBondContact O-CB 3.5Å; I150-M154 PolarHBondContact O-N 2.91Å; M154-M156 VanDerWaalsContact C-N 3.31Å; M154-M156 PolarHBondContact O-N 3.28Å; M154-F157 PolarHBondContact O-N 2.84Å; M154-I158 HydrophobicContact CG-CD1 3.6Å; M154-I158 HydrophobicContact CG-CG1 4.25Å; M154-I158 WeakPolarHBondContact O-CG1 3.49Å; M154-I158 PolarHBondContact O-N 3.06Å; M154-I158 HydrophobicContact SD-CD1 4.16Å; M154-I158 HydrophobicContact SD-CG1 4.41Å; M154-I189 HydrophobicContact CE-CG2 3.89Å; M154-I189 HydrophobicContact CG-CG2 4.03Å; M154-I189 HydrophobicContact SD-CD1 4.04Å; M154-I189 HydrophobicContact SD-CG2 4.2Å; M154-I191 HydrophobicContact CB-CD1 3.91Å; M154-I191 HydrophobicContact CG-CD1 4.12Å
155	G	93.6	Very high	91.1	Very high	12 Å²	12	36.6 Å²	36.6	12%	0.124	19%	0.192	C	C	.	.	H	α-helix	trans	-61	-34.6	178.5	0	0	0	0	0	114.1	S151 E152 V153 I158 Q159 Q166	S151-G155 WeakPolarHBondContact O-CA 3.44Å; S151-G155 PolarHBondContact O-N 2.98Å; E152-G155 PolarHBondContact O-N 3.4Å; V153-G155 VanDerWaalsContact C-N 3.31Å; V153-G155 PolarHBondContact O-N 3.46Å; G155-I158 PolarHBondContact O-N 2.57Å; G155-Q159 WeakPolarHBondContact O-CG 3.11Å; G155-Q159 PolarHBondContact O-N 2.61Å; G155-Q166 VanDerWaalsContact CA-NE2 3.34Å
156	M	92.4	Very high	91.6	Very high	83 Å²	83	39.1 Å²	39.1	41%	0.409	20%	0.204	S	C	.	.	H	α-helix	trans	-65.7	-36.8	176.5	-73.5	-178.7	-78.2	0	0	112.4	M79 E152 V153 M154	M79-M156 HydrophobicContact CE-CB 3.53Å; M79-M156 HydrophobicContact CE-CE 3.71Å; M79-M156 HydrophobicContact CE-CG 4.29Å; M79-M156 HydrophobicContact CE-SD 3.92Å; E152-M156 WeakPolarHBondContact O-CE 3.41Å; E152-M156 PolarHBondContact O-N 3.48Å; V153-M156 HydrophobicContact CG2-CE 4.42Å; V153-M156 PolarHBondContact O-N 2.72Å; M154-M156 VanDerWaalsContact C-N 3.31Å; M154-M156 PolarHBondContact O-N 3.28Å
157	F	93.6	Very high	91.9	Very high	0 Å²	0	39.8 Å²	39.8	0%	0	21%	0.207	C	C	.	.	H	α-helix	trans	-73.8	-44.2	173.1	-66.5	-86	0	0	0	112.2	I72 T75 L76 M79 L113 V116 I120 V153 M154 Q159 K160 F161	I72-F157 HydrophobicContact CG2-CD1 4.1Å; I72-F157 HydrophobicContact CG2-CE1 3.83Å; T75-F157 HydrophobicContact CG2-CB 4.49Å; T75-F157 HydrophobicContact CG2-CD1 3.49Å; T75-F157 VanDerWaalsContact CG2-CD1 3.49Å; T75-F157 HydrophobicContact CG2-CD2 4.36Å; T75-F157 HydrophobicContact CG2-CE1 3.63Å; T75-F157 HydrophobicContact CG2-CE2 4.47Å; T75-F157 HydrophobicContact CG2-CG 3.87Å; T75-F157 HydrophobicContact CG2-CZ 4.12Å; L76-F157 HydrophobicContact CD2-CE1 4.22Å; L76-F157 HydrophobicContact CD2-CZ 3.9Å; L76-F157 HydrophobicContact CG-CE1 4.07Å; L76-F157 HydrophobicContact CG-CZ 4.26Å; M79-F157 HydrophobicContact CE-CD2 4.1Å; M79-F157 HydrophobicContact CE-CE2 3.55Å; M79-F157 HydrophobicContact CE-CZ 3.95Å; M79-F157 HydrophobicContact SD-CE2 4.05Å; M79-F157 HydrophobicContact SD-CZ 3.94Å; L113-F157 HydrophobicContact CD2-CE2 3.7Å; L113-F157 HydrophobicContact CD2-CZ 3.81Å; V116-F157 HydrophobicContact CG1-CD2 3.61Å; V116-F157 HydrophobicContact CG1-CE2 3.85Å; V116-F157 HydrophobicContact CG1-CG 4.36Å; I120-F157 HydrophobicContact CD1-CB 3.31Å; I120-F157 HydrophobicContact CD1-CG 3.99Å; V153-F157 HydrophobicContact CG1-CE2 4.24Å; V153-F157 VanDerWaalsContact O-CD2 3.3Å; V153-F157 WeakPolarHBondContact O-CD2 3.31Å; M154-F157 PolarHBondContact O-N 2.84Å; F157-Q159 PolarHBondContact O-N 2.89Å; F157-Q159 VanDerWaalsContact O-N 3.14Å; F157-K160 PolarHBondContact O-N 2.87Å; F157-F161 WeakPolarHBondContact O-CD2 3.27Å
158	I	92.6	Very high	92.1	Very high	18 Å²	18	41.7 Å²	41.7	9%	0.092	22%	0.217	C	C	.	.	H	α-helix	trans	-60.5	-25.7	-177.6	-71	175.2	0	0	0	112.5	M154 G155 K160 F161 F164 Q166 I189	M154-I158 HydrophobicContact CG-CD1 3.6Å; M154-I158 HydrophobicContact CG-CG1 4.25Å; M154-I158 WeakPolarHBondContact O-CG1 3.49Å; M154-I158 PolarHBondContact O-N 3.06Å; M154-I158 HydrophobicContact SD-CD1 4.16Å; M154-I158 HydrophobicContact SD-CG1 4.41Å; G155-I158 PolarHBondContact O-N 2.57Å; I158-K160 PolarHBondContact O-N 3.38Å; I158-K160 VanDerWaalsContact O-N 3.1Å; I158-F161 CarbonylContact O-C 3.59Å; I158-F161 WeakPolarHBondContact O-CA 3.35Å; I158-F161 PolarHBondContact O-N 3.44Å; I158-F164 WeakPolarHBondContact CG2-O 3.46Å; I158-Q166 HydrophobicContact CD1-CB 3.63Å; I158-Q166 HydrophobicContact CD1-CG 3.84Å; I158-I189 HydrophobicContact CD1-CD1 3.7Å; I158-I189 HydrophobicContact CG1-CD1 4.27Å
159	Q	91.1	Very high	92.1	Very high	158 Å²	158	39.6 Å²	39.6	74%	0.738	21%	0.206	S	C	*	.	T	Hydrogen-bonded Turn	trans	-56.5	-24.9	172.9	-77	172	31.3	0	0	114.1	G155 F157	G155-Q159 WeakPolarHBondContact O-CG 3.11Å; G155-Q159 PolarHBondContact O-N 2.61Å; F157-Q159 PolarHBondContact O-N 2.89Å; F157-Q159 VanDerWaalsContact O-N 3.14Å
160	K	90.6	Very high	92.2	Very high	52 Å²	52	39.7 Å²	39.7	23%	0.226	21%	0.207	C	C	.	.	T	Hydrogen-bonded Turn	trans	-86.4	-10.2	174.2	-49.1	-68.9	-177.1	169.1	0	113.2	K71 T75 E78 F157 I158	K71-K160 HydrophobicContact CB-CB 3.92Å; K71-K160 HydrophobicContact CB-CG 4.44Å; K71-K160 HydrophobicContact CD-CB 4.17Å; K71-K160 WeakPolarHBondContact CD-O 3.35Å; K71-K160 WeakPolarHBondContact CE-O 3.3Å; K71-K160 HydrophobicContact CG-CB 4.27Å; K71-K160 PolarHBondContact NZ-O 3.44Å; T75-K160 WeakPolarHBondContact OG1-CG 3.37Å; E78-K160 IonicContact OE1-NZ 2.71Å; E78-K160 PolarHBondContact OE1-NZ 3.28Å; E78-K160 WeakPolarHBondContact OE2-CE 3.26Å; E78-K160 IonicContact OE2-NZ 3.85Å; E78-K160 PolarHBondContact OE2-NZ 3.16Å; F157-K160 PolarHBondContact O-N 2.87Å; I158-K160 PolarHBondContact O-N 3.38Å; I158-K160 VanDerWaalsContact O-N 3.1Å
161	F	90.5	Very high	91.7	Very high	1 Å²	1	40.8 Å²	40.8	0%	0.004	22%	0.218	C	C	.	.			trans	-128.2	73.5	-171.7	-61.6	-76.2	0	0	0	111.8	K71 I72 I120 L124 F157 I158 E163 F164	K71-F161 HydrophobicContact CB-CE1 4.1Å; K71-F161 HydrophobicContact CB-CE2 3.98Å; K71-F161 HydrophobicContact CB-CZ 3.53Å; K71-F161 HydrophobicContact CD-CD1 3.92Å; K71-F161 HydrophobicContact CD-CE1 3.44Å; K71-F161 VanDerWaalsContact CD-CE1 3.44Å; K71-F161 HydrophobicContact CD-CE2 4.48Å; K71-F161 HydrophobicContact CD-CZ 3.77Å; K71-F161 HydrophobicContact CG-CE1 4.41Å; K71-F161 HydrophobicContact CG-CZ 4.32Å; I72-F161 HydrophobicContact CG1-CE2 3.9Å; I72-F161 HydrophobicContact CG1-CZ 3.91Å; I120-F161 HydrophobicContact CG2-CD2 3.95Å; I120-F161 HydrophobicContact CG2-CE2 3.78Å; I120-F161 HydrophobicContact CG2-CZ 4.18Å; L124-F161 HydrophobicContact CD1-CD1 4.17Å; L124-F161 HydrophobicContact CD1-CE1 3.5Å; L124-F161 HydrophobicContact CD1-CZ 3.81Å; L124-F161 HydrophobicContact CD2-CD1 3.8Å; L124-F161 HydrophobicContact CD2-CE1 3.86Å; L124-F161 HydrophobicContact CG-CE1 4.28Å; F157-F161 WeakPolarHBondContact O-CD2 3.27Å; I158-F161 CarbonylContact O-C 3.59Å; I158-F161 WeakPolarHBondContact O-CA 3.35Å; I158-F161 PolarHBondContact O-N 3.44Å; F161-E163 WeakPolarHBondContact CA-OE2 3.44Å; F161-E163 PolarHBondContact O-N 3.08Å; F161-F164 HydrophobicContact CB-CD2 3.79Å; F161-F164 HydrophobicContact CB-CE2 4.29Å; F161-F164 HydrophobicContact CG-CD2 4.43Å; F161-F164 PolarHBondContact O-N 2.87Å
162	P	86.8	Confident	90.9	Very high	112 Å²	112	42.5 Å²	42.5	73%	0.727	24%	0.238	S	C	*	.	T	Hydrogen-bonded Turn	trans	-62.7	-10.8	-179	28.6	-37.2	0	0	0	114.5	F164	P162-F164 VanDerWaalsContact C-N 3.25Å; P162-F164 PolarHBondContact O-N 3.01Å
163	E	87.9	Confident	90.3	Very high	100 Å²	100	40.7 Å²	40.7	47%	0.467	23%	0.234	S	C	.	.	T	Hydrogen-bonded Turn	trans	-69.8	-15.6	170.7	60.2	-95.1	-117.1	0	0	114.3	F161	F161-E163 WeakPolarHBondContact CA-OE2 3.44Å; F161-E163 PolarHBondContact O-N 3.08Å
164	F	91.8	Very high	89.9	Confident	14 Å²	14	43.8 Å²	43.8	6%	0.061	25%	0.25	C	C	.	.			trans	-113.9	138.1	179.2	-57.1	-47.7	0	0	0	112.6	I120 L123 L124 I158 F161 P162 N188	I120-F164 HydrophobicContact CG2-CE2 4.34Å; L123-F164 HydrophobicContact CB-CE1 3.86Å; L123-F164 HydrophobicContact CB-CE2 4.37Å; L123-F164 HydrophobicContact CB-CZ 3.69Å; L124-F164 HydrophobicContact CD2-CE2 3.65Å; L124-F164 HydrophobicContact CD2-CZ 3.77Å; L124-F164 HydrophobicContact CG-CE2 3.82Å; L124-F164 HydrophobicContact CG-CZ 3.97Å; I158-F164 WeakPolarHBondContact CG2-O 3.46Å; F161-F164 HydrophobicContact CB-CD2 3.79Å; F161-F164 HydrophobicContact CB-CE2 4.29Å; F161-F164 HydrophobicContact CG-CD2 4.43Å; F161-F164 PolarHBondContact O-N 2.87Å; P162-F164 VanDerWaalsContact C-N 3.25Å; P162-F164 PolarHBondContact O-N 3.01Å; F164-N188 HydrophobicContact CD1-CB 4.49Å
165	T	92.5	Very high	89.4	Confident	39 Å²	39	44.6 Å²	44.6	24%	0.239	26%	0.255	C	S	.	.			trans	-112.8	143.4	167.6	67.8	0	0	0	0	111.8	H185 G187 N188 I189	T165-H185 WeakPolarHBondContact CB-O 3.45Å; T165-H185 WeakPolarHBondContact CG2-O 3.36Å; T165-H185 PolarHBondContact OG1-O 3.45Å; T165-G187 CarbonylContact O-C 3.33Å; T165-G187 PolarHBondContact OG1-N 2.9Å; T165-N188 PolarHBondContact N-OD1 3.29Å; T165-N188 PolarHBondContact O-N 2.88Å; T165-I189 PolarHBondContact O-N 2.66Å
166	Q	93.9	Very high	88.9	Confident	55 Å²	55	45.3 Å²	45.3	26%	0.257	26%	0.26	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	150.9	172.5	63.4	166.9	10.5	0	0	112.5	S151 G155 I158 I189	S151-Q166 PolarHBondContact O-NE2 3.47Å; S151-Q166 PolarHBondContact O-OE1 2.93Å; S151-Q166 PolarHBondContact OG-NE2 2.84Å; G155-Q166 VanDerWaalsContact CA-NE2 3.34Å; I158-Q166 HydrophobicContact CD1-CB 3.63Å; I158-Q166 HydrophobicContact CD1-CG 3.84Å; Q166-I189 CarbonylContact C-O 3.56Å; Q166-I189 WeakPolarHBondContact CA-O 3.49Å; Q166-I189 HydrophobicContact CB-CB 4.25Å; Q166-I189 HydrophobicContact CB-CG2 4.49Å
167	I	93.4	Very high	88.6	Confident	15 Å²	15	45 Å²	45	8%	0.077	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.8	141.6	172.7	-167.8	170	0	0	0	111.4	L169 K181 F182 I189 V190 I191	I167-L169 HydrophobicContact CD1-CD2 3.96Å; I167-L169 HydrophobicContact CG1-CD2 4.05Å; I167-L169 HydrophobicContact CG2-CG 4.48Å; I167-K181 HydrophobicContact CD1-CB 4.28Å; I167-F182 HydrophobicContact CD1-CB 3.72Å; I167-F182 HydrophobicContact CD1-CD2 4.05Å; I167-F182 HydrophobicContact CD1-CG 4.41Å; I167-F182 HydrophobicContact CG2-CD2 4.25Å; I167-I189 PolarHBondContact N-O 3.46Å; I167-V190 HydrophobicContact CG2-CB 4.32Å; I167-V190 HydrophobicContact CG2-CG1 4.38Å; I167-V190 HydrophobicContact CG2-CG2 3.75Å; I167-I191 PolarHBondContact O-N 3.49Å
168	L	94.3	Very high	88.3	Confident	40 Å²	40	45.4 Å²	45.4	21%	0.209	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	107	-177.9	178.3	63.1	0	0	0	110.7	A147 L148 I170 I191	A147-L168 HydrophobicContact CB-CD1 3.77Å; A147-L168 WeakPolarHBondContact O-CD1 3.39Å; L148-L168 HydrophobicContact CD2-CD2 3.49Å; L148-L168 VanDerWaalsContact CD2-CD2 3.49Å; L148-L168 HydrophobicContact CG-CD2 3.98Å; L168-I170 HydrophobicContact CD1-CG2 3.6Å; L168-I170 HydrophobicContact CD2-CD1 4.1Å; L168-I170 HydrophobicContact CD2-CG1 4.46Å; L168-I170 HydrophobicContact CG-CD1 4.37Å; L168-I170 HydrophobicContact CG-CG1 4.21Å; L168-I170 HydrophobicContact CG-CG2 3.91Å; L168-I191 CarbonylContact C-O 3.59Å; L168-I191 WeakPolarHBondContact CA-O 3.41Å; L168-I191 HydrophobicContact CD1-CB 4.26Å; L168-I191 HydrophobicContact CD1-CG2 4.01Å
169	L	92.4	Very high	88	Confident	1 Å²	1	44.6 Å²	44.6	1%	0.005	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	83.7	-176.2	-60.9	-177.5	0	0	0	111	I167 D178 V190 I191 A192 T193 R196 L197 M200 L210	I167-L169 HydrophobicContact CD1-CD2 3.96Å; I167-L169 HydrophobicContact CG1-CD2 4.05Å; I167-L169 HydrophobicContact CG2-CG 4.48Å; L169-D178 HydrophobicContact CD2-CB 3.86Å; L169-V190 HydrophobicContact CD1-CG1 3.73Å; L169-V190 HydrophobicContact CG-CG1 4.21Å; L169-I191 PolarHBondContact N-O 2.94Å; L169-A192 HydrophobicContact CB-CB 3.88Å; L169-A192 WeakPolarHBondContact O-CA 3.37Å; L169-T193 PolarHBondContact O-N 3.01Å; L169-T193 VanDerWaalsContact O-N 3.08Å; L169-R196 HydrophobicContact CB-CG 4.19Å; L169-L197 HydrophobicContact CD1-CD1 4.06Å; L169-M200 HydrophobicContact CD1-CG 4.43Å; L169-M200 HydrophobicContact CD2-CE 4.09Å; L169-L210 HydrophobicContact CD1-CD2 4.43Å
170	I	91.3	Very high	87.7	Confident	18 Å²	18	42.3 Å²	42.3	9%	0.092	25%	0.245	C	C	.	.			trans	-116.4	135.9	-177	59.3	170.1	0	0	0	112.7	R144 A147 L148 L168 T193 R196	R144-I170 HydrophobicContact CB-CB 4.4Å; R144-I170 HydrophobicContact CB-CD1 4.39Å; R144-I170 HydrophobicContact CG-CB 4.25Å; A147-I170 HydrophobicContact CB-CG2 3.52Å; L148-I170 HydrophobicContact CD1-CD1 4.2Å; L148-I170 HydrophobicContact CD2-CD1 4.34Å; L148-I170 HydrophobicContact CG-CD1 4.06Å; L168-I170 HydrophobicContact CD1-CG2 3.6Å; L168-I170 HydrophobicContact CD2-CD1 4.1Å; L168-I170 HydrophobicContact CD2-CG1 4.46Å; L168-I170 HydrophobicContact CG-CD1 4.37Å; L168-I170 HydrophobicContact CG-CG1 4.21Å; L168-I170 HydrophobicContact CG-CG2 3.91Å; I170-T193 HydrophobicContact CG2-CG2 4.19Å; I170-R196 PolarHBondContact O-NH1 3.23Å
171	G	82.9	Confident	87.5	Confident	23 Å²	23	43.7 Å²	43.7	24%	0.237	25%	0.251	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59	146.2	178.9	0	0	0	0	0	112.9	R144 T193	R144-G171 VanDerWaalsContact CD-O 3.24Å; R144-G171 WeakPolarHBondContact CD-O 3.44Å; R144-G171 PolarHBondContact NE-O 3.04Å; R144-G171 PolarHBondContact NH2-O 2.91Å; G171-T193 PolarHBondContact N-OG1 3.49Å
172	G	77.8	Confident	87.4	Confident	53 Å²	53	44 Å²	44	55%	0.546	25%	0.252	S	S	.	.	T	Hydrogen-bonded Turn	trans	102.6	-7.1	171.7	0	0	0	0	0	116.6
173	S	79.8	Confident	87.3	Confident	36 Å²	36	42.4 Å²	42.4	25%	0.252	23%	0.234	S	C	.	.	S	Bend	trans	-78.2	171	148.5	56.2	0	0	0	0	110.1	D178 R196	S173-D178 PolarHBondContact OG-OD1 2.78Å; S173-D178 PolarHBondContact OG-OD2 2.98Å; S173-R196 PolarHBondContact O-NH2 3.4Å; S173-R196 PolarHBondContact OG-NH1 2.82Å
174	N	83.9	Confident	87.2	Confident	89 Å²	89	43.4 Å²	43.4	48%	0.476	24%	0.239	S	C	.	.			trans	-70.9	124	164.5	177.6	19	0	0	0	109.5	A176 E177	N174-A176 PolarHBondContact O-N 2.83Å; N174-A176 PolarHBondContact OD1-N 2.73Å; N174-E177 HydrophobicContact CB-CG 4.04Å; N174-E177 WeakPolarHBondContact CB-OE1 3.19Å; N174-E177 PolarHBondContact O-N 2.7Å
175	P	84.1	Confident	86.9	Confident	17 Å²	17	48.1 Å²	48.1	11%	0.11	26%	0.261	C	S	.	.	H	α-helix	trans	-56.9	-32.3	179.6	-23.2	31.4	0	0	0	114.4	E177 D178 V179 D199	P175-E177 VanDerWaalsContact C-N 3.28Å; P175-E177 PolarHBondContact O-N 3.29Å; P175-D178 WeakPolarHBondContact O-CA 3.45Å; P175-D178 WeakPolarHBondContact O-CB 3.21Å; P175-D178 PolarHBondContact O-N 2.83Å; P175-V179 PolarHBondContact O-N 3.04Å; P175-D199 WeakPolarHBondContact CG-OD2 3.48Å
176	A	84.2	Confident	86.6	Confident	28 Å²	28	46.3 Å²	46.3	23%	0.231	25%	0.25	C	C	.	.	H	α-helix	trans	-60.9	-36.9	-179.9	0	0	0	0	0	112.3	N174 D178 V179 E180	N174-A176 PolarHBondContact O-N 2.83Å; N174-A176 PolarHBondContact OD1-N 2.73Å; A176-D178 VanDerWaalsContact C-N 3.27Å; A176-D178 PolarHBondContact O-N 2.93Å; A176-V179 WeakPolarHBondContact O-CB 3.5Å; A176-V179 PolarHBondContact O-N 3.25Å; A176-E180 WeakPolarHBondContact O-CG 3.41Å; A176-E180 PolarHBondContact O-N 2.92Å
177	E	85.7	Confident	86.3	Confident	77 Å²	77	43.7 Å²	43.7	36%	0.36	24%	0.237	S	C	.	.	H	α-helix	trans	-64.2	-34.3	174.5	-55.7	167.4	-143.9	0	0	111.8	N174 P175 V179 K181	N174-E177 HydrophobicContact CB-CG 4.04Å; N174-E177 WeakPolarHBondContact CB-OE1 3.19Å; N174-E177 PolarHBondContact O-N 2.7Å; P175-E177 VanDerWaalsContact C-N 3.28Å; P175-E177 PolarHBondContact O-N 3.29Å; E177-V179 VanDerWaalsContact C-N 3.34Å; E177-K181 WeakPolarHBondContact O-CB 3.3Å; E177-K181 WeakPolarHBondContact O-CD 3.06Å; E177-K181 VanDerWaalsContact O-CE 3.3Å; E177-K181 WeakPolarHBondContact O-CE 3.08Å; E177-K181 WeakPolarHBondContact O-CG 3.43Å; E177-K181 PolarHBondContact O-N 2.85Å; E177-K181 IonicContact OE2-NZ 3.41Å; E177-K181 PolarHBondContact OE2-NZ 2.68Å
178	D	87	Confident	86.4	Confident	7 Å²	7	43.1 Å²	43.1	4%	0.037	24%	0.235	C	C	.	.	H	α-helix	trans	-71.6	-33.4	178.2	-59.7	-6.1	0	0	0	110.3	L169 S173 P175 A176 K181 F182 R196 M200	L169-D178 HydrophobicContact CD2-CB 3.86Å; S173-D178 PolarHBondContact OG-OD1 2.78Å; S173-D178 PolarHBondContact OG-OD2 2.98Å; P175-D178 WeakPolarHBondContact O-CA 3.45Å; P175-D178 WeakPolarHBondContact O-CB 3.21Å; P175-D178 PolarHBondContact O-N 2.83Å; A176-D178 VanDerWaalsContact C-N 3.27Å; A176-D178 PolarHBondContact O-N 2.93Å; D178-K181 IonicContact OD1-NZ 3.5Å; D178-F182 PolarHBondContact O-N 3.28Å; D178-F182 VanDerWaalsContact O-N 3.14Å; D178-R196 IonicContact OD2-CZ 3.89Å; D178-R196 IonicContact OD2-NH1 2.96Å; D178-R196 PolarHBondContact OD2-NH1 3.48Å; D178-M200 HydrophobicContact CB-CE 3.99Å; D178-M200 HydrophobicContact CB-SD 4.26Å
179	V	85.3	Confident	86.4	Confident	2 Å²	2	41.2 Å²	41.2	1%	0.012	23%	0.225	C	C	.	.	H	α-helix	trans	-65.2	-46.2	172	172.2	0	0	0	0	111.2	P175 A176 E177 F182 K183 M200 L208	P175-V179 PolarHBondContact O-N 3.04Å; A176-V179 WeakPolarHBondContact O-CB 3.5Å; A176-V179 PolarHBondContact O-N 3.25Å; E177-V179 VanDerWaalsContact C-N 3.34Å; V179-F182 PolarHBondContact O-N 2.81Å; V179-K183 HydrophobicContact CG1-CD 4.07Å; V179-K183 WeakPolarHBondContact O-CG 3.49Å; V179-K183 PolarHBondContact O-N 2.8Å; V179-M200 HydrophobicContact CB-CE 4.46Å; V179-M200 HydrophobicContact CG2-CE 3.68Å; V179-M200 HydrophobicContact CG2-SD 3.87Å; V179-L208 HydrophobicContact CB-CD2 4.27Å; V179-L208 HydrophobicContact CG1-CB 4.02Å; V179-L208 HydrophobicContact CG1-CD2 4.16Å; V179-L208 HydrophobicContact CG2-CD2 3.85Å
180	E	85.9	Confident	86.6	Confident	110 Å²	110	41.3 Å²	41.3	51%	0.514	23%	0.225	S	C	.	.	H	α-helix	trans	-62.4	-50.7	177.6	-72.3	165.1	168.2	0	0	111.1	A176 F182 K183 E184	A176-E180 WeakPolarHBondContact O-CG 3.41Å; A176-E180 PolarHBondContact O-N 2.92Å; E180-F182 VanDerWaalsContact C-N 3.28Å; E180-F182 PolarHBondContact O-N 3.1Å; E180-K183 WeakPolarHBondContact O-CB 3.42Å; E180-K183 PolarHBondContact O-N 3.27Å; E180-E184 WeakPolarHBondContact O-CG 3.11Å; E180-E184 PolarHBondContact O-N 3.14Å
181	K	87.3	Confident	86.8	Confident	81 Å²	81	40.4 Å²	40.4	35%	0.352	22%	0.22	S	C	.	.	H	α-helix	trans	-53.4	-43.8	175.9	-70.2	157.9	-155.5	158.5	0	111.6	I167 E177 D178 H185	I167-K181 HydrophobicContact CD1-CB 4.28Å; E177-K181 WeakPolarHBondContact O-CB 3.3Å; E177-K181 WeakPolarHBondContact O-CD 3.06Å; E177-K181 VanDerWaalsContact O-CE 3.3Å; E177-K181 WeakPolarHBondContact O-CE 3.08Å; E177-K181 WeakPolarHBondContact O-CG 3.43Å; E177-K181 PolarHBondContact O-N 2.85Å; E177-K181 IonicContact OE2-NZ 3.41Å; E177-K181 PolarHBondContact OE2-NZ 2.68Å; D178-K181 IonicContact OD1-NZ 3.5Å; K181-H185 VanDerWaalsContact O-CB 3.3Å; K181-H185 WeakPolarHBondContact O-CB 3.04Å; K181-H185 PolarHBondContact O-N 3.04Å
182	F	87.2	Confident	87.4	Confident	7 Å²	7	39.3 Å²	39.3	3%	0.031	21%	0.209	C	C	.	.	H	α-helix	trans	-66.4	-39.2	176.1	-169.9	-87.2	0	0	0	113.1	K133 V135 I167 D178 V179 E180 G186 L208 L210 A213	K133-F182 HydrophobicContact CB-CE1 4.39Å; V135-F182 HydrophobicContact CG2-CE2 4.3Å; V135-F182 HydrophobicContact CG2-CZ 4.37Å; I167-F182 HydrophobicContact CD1-CB 3.72Å; I167-F182 HydrophobicContact CD1-CD2 4.05Å; I167-F182 HydrophobicContact CD1-CG 4.41Å; I167-F182 HydrophobicContact CG2-CD2 4.25Å; D178-F182 PolarHBondContact O-N 3.28Å; D178-F182 VanDerWaalsContact O-N 3.14Å; V179-F182 PolarHBondContact O-N 2.81Å; E180-F182 VanDerWaalsContact C-N 3.28Å; E180-F182 PolarHBondContact O-N 3.1Å; F182-G186 WeakPolarHBondContact O-CA 3.37Å; F182-G186 PolarHBondContact O-N 3.39Å; F182-L208 HydrophobicContact CB-CD1 4.48Å; F182-L208 HydrophobicContact CD1-CD1 3.39Å; F182-L208 HydrophobicContact CE1-CD1 3.9Å; F182-L208 HydrophobicContact CG-CD1 4.15Å; F182-L210 HydrophobicContact CE2-CD1 4.17Å; F182-L210 HydrophobicContact CZ-CD1 4.24Å; F182-A213 HydrophobicContact CE1-CB 4.31Å; F182-A213 HydrophobicContact CZ-CB 3.9Å
183	K	84.8	Confident	88.2	Confident	79 Å²	79	37.4 Å²	37.4	34%	0.343	19%	0.187	S	C	.	.	H	α-helix	trans	-65	-38.8	178.7	-75.6	170	179.1	173.6	0	112.4	K133 V179 E180 E206 G207	K133-K183 WeakPolarHBondContact CE-O 3.35Å; K133-K183 PolarHBondContact NZ-O 3.37Å; V179-K183 HydrophobicContact CG1-CD 4.07Å; V179-K183 WeakPolarHBondContact O-CG 3.49Å; V179-K183 PolarHBondContact O-N 2.8Å; E180-K183 WeakPolarHBondContact O-CB 3.42Å; E180-K183 PolarHBondContact O-N 3.27Å; K183-E206 PolarHBondContact NZ-O 2.9Å; K183-G207 VanDerWaalsContact CE-O 3.27Å; K183-G207 WeakPolarHBondContact CE-O 3.3Å
184	E	86.1	Confident	88.7	Confident	121 Å²	121	35.7 Å²	35.7	57%	0.565	18%	0.175	S	C	*	.	H	α-helix	trans	-80.9	-53.7	-179.4	-68	176.6	156.8	0	0	113.1	K132 E180	K132-E184 WeakPolarHBondContact CE-O 3.49Å; K132-E184 PolarHBondContact NZ-O 3.5Å; E180-E184 WeakPolarHBondContact O-CG 3.11Å; E180-E184 PolarHBondContact O-N 3.14Å
185	H	84.8	Confident	89.1	Confident	113 Å²	113	33.4 Å²	33.4	52%	0.523	17%	0.172	S	C	.	.	H	α-helix	trans	-98.8	-18	-168.7	-61.2	80.4	0	0	0	112.6	K132 T165 K181	K132-H185 WeakPolarHBondContact CE-O 3.21Å; T165-H185 WeakPolarHBondContact CB-O 3.45Å; T165-H185 WeakPolarHBondContact CG2-O 3.36Å; T165-H185 PolarHBondContact OG1-O 3.45Å; K181-H185 VanDerWaalsContact O-CB 3.3Å; K181-H185 WeakPolarHBondContact O-CB 3.04Å; K181-H185 PolarHBondContact O-N 3.04Å
186	G	86.1	Confident	89.4	Confident	1 Å²	1	33.4 Å²	33.4	1%	0.01	17%	0.17	C	C	.	.			trans	79.9	-156.4	-174.6	0	0	0	0	0	112.7	K132 F182	K132-G186 WeakPolarHBondContact O-CA 3.44Å; F182-G186 WeakPolarHBondContact O-CA 3.37Å; F182-G186 PolarHBondContact O-N 3.39Å
187	G	88.9	Confident	89.7	Confident	0 Å²	0	32.1 Å²	32.1	0%	0	16%	0.159	C	C	.	.			trans	174.9	76.3	177	0	0	0	0	0	111.7	K132 T165 I189	K132-G187 PolarHBondContact O-N 3.07Å; T165-G187 CarbonylContact O-C 3.33Å; T165-G187 PolarHBondContact OG1-N 2.9Å; G187-I189 PolarHBondContact O-N 3.47Å
188	N	93.8	Very high	90	Very high	3 Å²	3	29.7 Å²	29.7	2%	0.016	15%	0.148	C	C	.	.	S	Bend	trans	-65.4	-32.1	174.5	-56.6	121.3	0	0	0	112.1	L130 K131 Q134 G136 A137 F164 T165	L130-N188 HydrophobicContact CD1-CB 4.05Å; K131-N188 PolarHBondContact O-ND2 3.25Å; K131-N188 VanDerWaalsContact O-ND2 3.1Å; Q134-N188 WeakPolarHBondContact O-CA 3.23Å; Q134-N188 PolarHBondContact O-ND2 3.41Å; G136-N188 PolarHBondContact N-O 2.83Å; A137-N188 PolarHBondContact N-O 3.49Å; A137-N188 VanDerWaalsContact N-O 3.09Å; F164-N188 HydrophobicContact CD1-CB 4.49Å; T165-N188 PolarHBondContact N-OD1 3.29Å; T165-N188 PolarHBondContact O-N 2.88Å
189	I	95.7	Very high	90	Very high	0 Å²	0	31.6 Å²	31.6	0%	0	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	114.2	176.3	-64.6	166.5	0	0	0	108.3	I119 L123 A137 M154 I158 T165 Q166 I167 G187 I191	I119-I189 HydrophobicContact CG2-CD1 4.11Å; I119-I189 HydrophobicContact CG2-CG1 4.28Å; L123-I189 HydrophobicContact CD1-CD1 4.09Å; L123-I189 HydrophobicContact CD1-CG1 3.73Å; A137-I189 HydrophobicContact CB-CG1 4.31Å; A137-I189 WeakPolarHBondContact O-CA 3.41Å; M154-I189 HydrophobicContact CE-CG2 3.89Å; M154-I189 HydrophobicContact CG-CG2 4.03Å; M154-I189 HydrophobicContact SD-CD1 4.04Å; M154-I189 HydrophobicContact SD-CG2 4.2Å; I158-I189 HydrophobicContact CD1-CD1 3.7Å; I158-I189 HydrophobicContact CG1-CD1 4.27Å; T165-I189 PolarHBondContact O-N 2.66Å; Q166-I189 CarbonylContact C-O 3.56Å; Q166-I189 WeakPolarHBondContact CA-O 3.49Å; Q166-I189 HydrophobicContact CB-CB 4.25Å; Q166-I189 HydrophobicContact CB-CG2 4.49Å; I167-I189 PolarHBondContact N-O 3.46Å; G187-I189 PolarHBondContact O-N 3.47Å; I189-I191 HydrophobicContact CG2-CG1 4.43Å
190	V	95.6	Very high	90.1	Very high	2 Å²	2	31.6 Å²	31.6	1%	0.012	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104	126.6	179.7	176.9	0	0	0	0	109.4	V135 A137 L138 V139 I167 L169 A192 L197	V135-V190 HydrophobicContact CB-CG2 4.42Å; V135-V190 HydrophobicContact CG1-CB 4.28Å; V135-V190 HydrophobicContact CG1-CG2 3.67Å; V135-V190 HydrophobicContact CG2-CG2 3.81Å; A137-V190 PolarHBondContact O-N 2.87Å; L138-V190 CarbonylContact C-O 3.48Å; L138-V190 WeakPolarHBondContact CA-O 3.46Å; L138-V190 HydrophobicContact CD1-CB 3.82Å; L138-V190 HydrophobicContact CD1-CG1 3.62Å; V139-V190 PolarHBondContact N-O 3.37Å; I167-V190 HydrophobicContact CG2-CB 4.32Å; I167-V190 HydrophobicContact CG2-CG1 4.38Å; I167-V190 HydrophobicContact CG2-CG2 3.75Å; L169-V190 HydrophobicContact CD1-CG1 3.73Å; L169-V190 HydrophobicContact CG-CG1 4.21Å; V190-A192 HydrophobicContact CG1-CB 4.26Å; V190-L197 HydrophobicContact CG1-CD1 4.39Å
191	I	96.6	Very high	90.1	Very high	0 Å²	0	26.5 Å²	26.5	0%	0	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	122.6	174.5	-61.3	162.6	0	0	0	107.7	V139 A147 I150 M154 I167 L168 L169 I189	V139-I191 HydrophobicContact CB-CG1 4.2Å; V139-I191 HydrophobicContact CG2-CG1 4.3Å; V139-I191 WeakPolarHBondContact O-CA 3.43Å; A147-I191 HydrophobicContact CB-CG2 4.24Å; A147-I191 WeakPolarHBondContact O-CG2 3.34Å; I150-I191 HydrophobicContact CB-CG2 4.22Å; I150-I191 HydrophobicContact CG2-CD1 4Å; I150-I191 HydrophobicContact CG2-CG1 4.34Å; I150-I191 HydrophobicContact CG2-CG2 4.19Å; M154-I191 HydrophobicContact CB-CD1 3.91Å; M154-I191 HydrophobicContact CG-CD1 4.12Å; I167-I191 PolarHBondContact O-N 3.49Å; L168-I191 CarbonylContact C-O 3.59Å; L168-I191 WeakPolarHBondContact CA-O 3.41Å; L168-I191 HydrophobicContact CD1-CB 4.26Å; L168-I191 HydrophobicContact CD1-CG2 4.01Å; L169-I191 PolarHBondContact N-O 2.94Å; I189-I191 HydrophobicContact CG2-CG1 4.43Å
192	A	95	Very high	89.8	Confident	0 Å²	0	30.1 Å²	30.1	0%	0	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.8	153	-164.1	0	0	0	0	0	115.9	V139 I140 T141 L169 V190 L197	V139-A192 PolarHBondContact O-N 3.11Å; I140-A192 WeakPolarHBondContact CA-O 3.49Å; T141-A192 WeakPolarHBondContact CG2-O 3.43Å; T141-A192 PolarHBondContact N-O 3.08Å; L169-A192 HydrophobicContact CB-CB 3.88Å; L169-A192 WeakPolarHBondContact O-CA 3.37Å; V190-A192 HydrophobicContact CG1-CB 4.26Å; A192-L197 HydrophobicContact CB-CB 3.98Å; A192-L197 HydrophobicContact CB-CD1 4.22Å; A192-L197 HydrophobicContact CB-CD2 4.16Å; A192-L197 HydrophobicContact CB-CG 4.36Å
193	T	93.5	Very high	89.3	Confident	13 Å²	13	32.7 Å²	32.7	8%	0.08	16%	0.155	C	C	.	.			trans	-94	136.4	163.5	53.2	0	0	0	0	110.6	R144 A147 L169 I170 G171 G195 R196 L197	R144-T193 HydrophobicContact CG-CG2 4.38Å; A147-T193 HydrophobicContact CB-CG2 4.38Å; L169-T193 PolarHBondContact O-N 3.01Å; L169-T193 VanDerWaalsContact O-N 3.08Å; I170-T193 HydrophobicContact CG2-CG2 4.19Å; G171-T193 PolarHBondContact N-OG1 3.49Å; T193-G195 PolarHBondContact O-N 2.97Å; T193-R196 PolarHBondContact O-N 3.03Å; T193-L197 PolarHBondContact O-N 3.4Å; T193-L197 VanDerWaalsContact O-N 3.14Å
194	P	92.1	Very high	88.3	Confident	0 Å²	0	35.7 Å²	35.7	0%	0	17%	0.168	C	C	.	.	H	α-helix	trans	-46.4	-53.8	-170.8	-29.3	30.1	0	0	0	115	I140 T141 R196 L197 E198 L228 F233 L237 I240	I140-P194 HydrophobicContact CG2-CG 3.71Å; T141-P194 WeakPolarHBondContact O-CD 3.46Å; P194-R196 VanDerWaalsContact C-N 3.29Å; P194-R196 PolarHBondContact O-N 3.09Å; P194-L197 PolarHBondContact O-N 2.84Å; P194-L197 VanDerWaalsContact O-N 3.08Å; P194-E198 WeakPolarHBondContact O-CB 3.39Å; P194-E198 PolarHBondContact O-N 3.22Å; P194-L228 HydrophobicContact CG-CD2 3.58Å; P194-F233 HydrophobicContact CB-CB 4.21Å; P194-F233 HydrophobicContact CB-CD1 4.2Å; P194-F233 HydrophobicContact CB-CG 4.15Å; P194-F233 HydrophobicContact CG-CB 4.17Å; P194-F233 HydrophobicContact CG-CD2 4.13Å; P194-F233 HydrophobicContact CG-CG 4.06Å; P194-L237 HydrophobicContact CG-CD2 4.38Å; P194-I240 HydrophobicContact CB-CD1 4.13Å
195	G	90.6	Very high	86.7	Confident	40 Å²	40	35.4 Å²	35.4	41%	0.412	18%	0.18	S	C	.	.	H	α-helix	trans	-66.2	-21.4	-175	0	0	0	0	0	115.7	T193 D199	T193-G195 PolarHBondContact O-N 2.97Å; G195-D199 WeakPolarHBondContact O-CB 3.48Å; G195-D199 PolarHBondContact O-N 3.47Å
196	R	90.7	Very high	85.4	Confident	17 Å²	17	33.1 Å²	33.1	6%	0.064	17%	0.169	C	C	.	.	H	α-helix	trans	-85.9	-36.2	170.4	173.5	54.2	59.9	81.1	-1	110.9	L169 I170 S173 D178 T193 P194 E198 D199 M200	L169-R196 HydrophobicContact CB-CG 4.19Å; I170-R196 PolarHBondContact O-NH1 3.23Å; S173-R196 PolarHBondContact O-NH2 3.4Å; S173-R196 PolarHBondContact OG-NH1 2.82Å; D178-R196 IonicContact OD2-CZ 3.89Å; D178-R196 IonicContact OD2-NH1 2.96Å; D178-R196 PolarHBondContact OD2-NH1 3.48Å; T193-R196 PolarHBondContact O-N 3.03Å; P194-R196 VanDerWaalsContact C-N 3.29Å; P194-R196 PolarHBondContact O-N 3.09Å; R196-E198 VanDerWaalsContact C-N 3.34Å; R196-E198 PolarHBondContact O-N 3.25Å; R196-D199 IonicContact NE-OD2 3.6Å; R196-D199 PolarHBondContact O-N 2.83Å; R196-M200 HydrophobicContact CG-CG 4.4Å; R196-M200 WeakPolarHBondContact O-CB 3.48Å; R196-M200 WeakPolarHBondContact O-CG 3.42Å; R196-M200 PolarHBondContact O-N 2.88Å
197	L	92	Very high	83.9	Confident	2 Å²	2	36 Å²	36	1%	0.01	20%	0.198	C	C	.	.	H	α-helix	trans	-63.1	-41.8	175.3	-173.5	61.4	0	0	0	111.8	L138 I140 L169 V190 A192 T193 P194 M200 F201 L210 I240	L138-L197 HydrophobicContact CD1-CD1 4.35Å; L138-L197 HydrophobicContact CD1-CD2 3.81Å; L138-L197 HydrophobicContact CD2-CD2 4.05Å; L138-L197 HydrophobicContact CG-CD2 4.45Å; I140-L197 HydrophobicContact CD1-CD2 3.99Å; I140-L197 HydrophobicContact CG1-CD2 4.12Å; L169-L197 HydrophobicContact CD1-CD1 4.06Å; V190-L197 HydrophobicContact CG1-CD1 4.39Å; A192-L197 HydrophobicContact CB-CB 3.98Å; A192-L197 HydrophobicContact CB-CD1 4.22Å; A192-L197 HydrophobicContact CB-CD2 4.16Å; A192-L197 HydrophobicContact CB-CG 4.36Å; T193-L197 PolarHBondContact O-N 3.4Å; T193-L197 VanDerWaalsContact O-N 3.14Å; P194-L197 PolarHBondContact O-N 2.84Å; P194-L197 VanDerWaalsContact O-N 3.08Å; L197-M200 PolarHBondContact O-N 2.92Å; L197-F201 HydrophobicContact CD1-CD2 4.36Å; L197-F201 HydrophobicContact CD1-CE2 3.85Å; L197-F201 HydrophobicContact CD1-CZ 4.39Å; L197-F201 HydrophobicContact CD2-CE2 4.16Å; L197-F201 HydrophobicContact CG-CD2 4.04Å; L197-F201 HydrophobicContact CG-CE2 3.65Å; L197-F201 VanDerWaalsContact O-CD2 3.22Å; L197-F201 WeakPolarHBondContact O-CD2 3.41Å; L197-F201 PolarHBondContact O-N 3.1Å; L197-L210 HydrophobicContact CD1-CD2 4.15Å; L197-I240 HydrophobicContact CB-CD1 4.2Å; L197-I240 HydrophobicContact CD2-CD1 3.98Å; L197-I240 HydrophobicContact CD2-CG1 4.21Å; L197-I240 HydrophobicContact CD2-CG2 3.92Å; L197-I240 HydrophobicContact CG-CD1 4.28Å; L197-I240 HydrophobicContact CG-CG1 4.32Å
198	E	90.2	Very high	82.5	Confident	26 Å²	26	36.4 Å²	36.4	12%	0.121	20%	0.2	C	C	.	.	H	α-helix	trans	-64.4	-44	175.8	-170.9	-175.1	177.1	0	0	112.5	P194 R196 M200 F201 R202 S236 I240	P194-E198 WeakPolarHBondContact O-CB 3.39Å; P194-E198 PolarHBondContact O-N 3.22Å; R196-E198 VanDerWaalsContact C-N 3.34Å; R196-E198 PolarHBondContact O-N 3.25Å; E198-M200 VanDerWaalsContact C-N 3.32Å; E198-M200 PolarHBondContact O-N 2.97Å; E198-F201 PolarHBondContact O-N 2.87Å; E198-R202 WeakPolarHBondContact O-CG 3.45Å; E198-R202 PolarHBondContact O-N 2.99Å; E198-R202 VanDerWaalsContact O-N 3.15Å; E198-R202 IonicContact OE1-CZ 3.82Å; E198-R202 IonicContact OE1-NE 3.53Å; E198-R202 PolarHBondContact OE1-NE 2.94Å; E198-R202 IonicContact OE1-NH2 3.83Å; E198-R202 PolarHBondContact OE1-NH2 2.74Å; E198-S236 WeakPolarHBondContact OE2-CA 3.42Å; E198-S236 WeakPolarHBondContact OE2-CB 3.35Å; E198-S236 PolarHBondContact OE2-OG 2.99Å; E198-I240 HydrophobicContact CB-CG1 4.42Å
199	D	88.6	Confident	81.2	Confident	47 Å²	47	42.5 Å²	42.5	25%	0.251	23%	0.229	S	C	.	.	H	α-helix	trans	-55.9	-45.8	172.2	-176.9	23.8	0	0	0	110.8	P175 G195 R196 F201 R202 R203	P175-D199 WeakPolarHBondContact CG-OD2 3.48Å; G195-D199 WeakPolarHBondContact O-CB 3.48Å; G195-D199 PolarHBondContact O-N 3.47Å; R196-D199 IonicContact NE-OD2 3.6Å; R196-D199 PolarHBondContact O-N 2.83Å; D199-F201 PolarHBondContact O-N 3.33Å; D199-R202 PolarHBondContact O-N 2.89Å; D199-R203 WeakPolarHBondContact O-CG 3.38Å; D199-R203 PolarHBondContact O-N 3.29Å; D199-R203 IonicContact OD1-CZ 3.43Å; D199-R203 VanDerWaalsContact OD1-CZ 3.24Å; D199-R203 IonicContact OD1-NE 3.17Å; D199-R203 PolarHBondContact OD1-NE 2.88Å; D199-R203 IonicContact OD1-NH2 3.72Å; D199-R203 PolarHBondContact OD1-NH2 2.79Å; D199-R203 IonicContact OD2-CZ 3.32Å; D199-R203 IonicContact OD2-NE 2.84Å; D199-R203 IonicContact OD2-NH2 2.97Å; D199-R203 PolarHBondContact OD2-NH2 2.75Å
200	M	86.3	Confident	80.3	Confident	2 Å²	2	42.7 Å²	42.7	1%	0.01	23%	0.23	C	C	.	.	H	α-helix	trans	-67.7	-31.2	178	-66.1	-69.5	-74	0	0	113.9	L169 D178 V179 R196 L197 E198 L208 L210	L169-M200 HydrophobicContact CD1-CG 4.43Å; L169-M200 HydrophobicContact CD2-CE 4.09Å; D178-M200 HydrophobicContact CB-CE 3.99Å; D178-M200 HydrophobicContact CB-SD 4.26Å; V179-M200 HydrophobicContact CB-CE 4.46Å; V179-M200 HydrophobicContact CG2-CE 3.68Å; V179-M200 HydrophobicContact CG2-SD 3.87Å; R196-M200 HydrophobicContact CG-CG 4.4Å; R196-M200 WeakPolarHBondContact O-CB 3.48Å; R196-M200 WeakPolarHBondContact O-CG 3.42Å; R196-M200 PolarHBondContact O-N 2.88Å; L197-M200 PolarHBondContact O-N 2.92Å; E198-M200 VanDerWaalsContact C-N 3.32Å; E198-M200 PolarHBondContact O-N 2.97Å; M200-L208 HydrophobicContact CE-CD2 3.56Å; M200-L210 HydrophobicContact CB-CD2 3.73Å
201	F	85.6	Confident	79.4	Confident	3 Å²	3	43.8 Å²	43.8	1%	0.013	24%	0.239	C	C	.	.	H	α-helix	trans	-71.6	-29.1	172.5	-80.3	-58.8	0	0	0	113.3	L197 E198 D199 L210 A211 V214 I240 Y243 L244	L197-F201 HydrophobicContact CD1-CD2 4.36Å; L197-F201 HydrophobicContact CD1-CE2 3.85Å; L197-F201 HydrophobicContact CD1-CZ 4.39Å; L197-F201 HydrophobicContact CD2-CE2 4.16Å; L197-F201 HydrophobicContact CG-CD2 4.04Å; L197-F201 HydrophobicContact CG-CE2 3.65Å; L197-F201 VanDerWaalsContact O-CD2 3.22Å; L197-F201 WeakPolarHBondContact O-CD2 3.41Å; L197-F201 PolarHBondContact O-N 3.1Å; E198-F201 PolarHBondContact O-N 2.87Å; D199-F201 PolarHBondContact O-N 3.33Å; F201-L210 HydrophobicContact CD1-CB 4.18Å; F201-L210 HydrophobicContact CD1-CD2 4.12Å; F201-L210 HydrophobicContact CD1-CG 4.04Å; F201-L210 HydrophobicContact CE1-CB 4.34Å; F201-L210 HydrophobicContact CE1-CD2 4.1Å; F201-L210 HydrophobicContact CE1-CG 3.81Å; F201-L210 HydrophobicContact CG-CD2 4.43Å; F201-L210 HydrophobicContact CZ-CD2 4.43Å; F201-L210 HydrophobicContact CZ-CG 4.44Å; F201-A211 HydrophobicContact CD1-CB 4.31Å; F201-V214 HydrophobicContact CE1-CG1 4.04Å; F201-V214 HydrophobicContact CE1-CG2 3.75Å; F201-V214 HydrophobicContact CZ-CG1 3.98Å; F201-V214 HydrophobicContact CZ-CG2 4.09Å; F201-I240 HydrophobicContact CD2-CG1 4.3Å; F201-I240 HydrophobicContact CE2-CG1 4.32Å; F201-I240 HydrophobicContact CE2-CG2 4.07Å; F201-Y243 HydrophobicContact CB-CD2 3.81Å; F201-Y243 HydrophobicContact CB-CE2 3.7Å; F201-Y243 HydrophobicContact CD1-CD2 4.09Å; F201-Y243 HydrophobicContact CD1-CG 4.14Å; F201-Y243 AromaticContact CD2-CD2 3.97Å; F201-Y243 HydrophobicContact CD2-CD2 3.97Å; F201-Y243 AromaticContact CG-CD2 3.72Å; F201-Y243 HydrophobicContact CG-CD2 3.72Å; F201-Y243 HydrophobicContact CG-CE2 4.16Å; F201-Y243 HydrophobicContact CG-CG 4.24Å; F201-L244 HydrophobicContact CZ-CD2 4.01Å
202	R	82.5	Confident	78.6	Confident	157 Å²	157	45.1 Å²	45.1	59%	0.592	25%	0.249	S	C	*	.	H	α-helix	trans	-78.5	-26.4	180	-68.8	172.5	-177.8	-132.8	4.5	112.9	E198 D199 K204	E198-R202 WeakPolarHBondContact O-CG 3.45Å; E198-R202 PolarHBondContact O-N 2.99Å; E198-R202 VanDerWaalsContact O-N 3.15Å; E198-R202 IonicContact OE1-CZ 3.82Å; E198-R202 IonicContact OE1-NE 3.53Å; E198-R202 PolarHBondContact OE1-NE 2.94Å; E198-R202 IonicContact OE1-NH2 3.83Å; E198-R202 PolarHBondContact OE1-NH2 2.74Å; D199-R202 PolarHBondContact O-N 2.89Å; R202-K204 PolarHBondContact O-N 3.26Å
203	R	75.3	Confident	78.1	Confident	60 Å²	60	45.6 Å²	45.6	23%	0.226	25%	0.252	C	S	.	.			trans	-74.4	45.6	-176	-72.9	171.7	-171.4	-95.5	-7.1	116	D199 S205 E206	D199-R203 WeakPolarHBondContact O-CG 3.38Å; D199-R203 PolarHBondContact O-N 3.29Å; D199-R203 IonicContact OD1-CZ 3.43Å; D199-R203 VanDerWaalsContact OD1-CZ 3.24Å; D199-R203 IonicContact OD1-NE 3.17Å; D199-R203 PolarHBondContact OD1-NE 2.88Å; D199-R203 IonicContact OD1-NH2 3.72Å; D199-R203 PolarHBondContact OD1-NH2 2.79Å; D199-R203 IonicContact OD2-CZ 3.32Å; D199-R203 IonicContact OD2-NE 2.84Å; D199-R203 IonicContact OD2-NH2 2.97Å; D199-R203 PolarHBondContact OD2-NH2 2.75Å; R203-S205 PolarHBondContact O-N 2.99Å; R203-E206 VanDerWaalsContact CD-OE1 3.3Å; R203-E206 WeakPolarHBondContact CD-OE1 3.25Å; R203-E206 WeakPolarHBondContact CG-OE1 3.38Å; R203-E206 IonicContact CZ-OE1 3.04Å; R203-E206 IonicContact NE-OE1 3.61Å; R203-E206 IonicContact NH1-OE1 2.79Å; R203-E206 PolarHBondContact NH1-OE1 3.01Å; R203-E206 IonicContact NH1-OE2 2.69Å; R203-E206 PolarHBondContact O-N 2.82Å
204	K	63.9	Low	77.9	Confident	142 Å²	142	45.1 Å²	45.1	62%	0.617	25%	0.249	S	C	*	.	G	3₁₀ helix	trans	-56.5	-37.3	175.8	-64.3	-175.2	179.1	-177.3	0	112.9	R202 E206 G207	R202-K204 PolarHBondContact O-N 3.26Å; K204-E206 VanDerWaalsContact C-N 3.25Å; K204-E206 PolarHBondContact O-N 2.9Å; K204-G207 PolarHBondContact O-N 2.76Å
205	S	52.4	Low	77.7	Confident	116 Å²	116	54 Å²	54	81%	0.811	28%	0.283	S	S	*	.	G	3₁₀ helix	trans	-64.8	-21.2	-177.4	47.4	0	0	0	0	114.7	R203 G207	R203-S205 PolarHBondContact O-N 2.99Å; S205-G207 PolarHBondContact O-N 2.97Å
206	E	57.8	Low	77.5	Confident	65 Å²	65	53 Å²	53	30%	0.304	27%	0.27	S	S	.	.	G	3₁₀ helix	trans	-83.6	10.9	178.1	-66.9	175.5	-137.7	0	0	112.5	K183 R203 K204	K183-E206 PolarHBondContact NZ-O 2.9Å; R203-E206 VanDerWaalsContact CD-OE1 3.3Å; R203-E206 WeakPolarHBondContact CD-OE1 3.25Å; R203-E206 WeakPolarHBondContact CG-OE1 3.38Å; R203-E206 IonicContact CZ-OE1 3.04Å; R203-E206 IonicContact NE-OE1 3.61Å; R203-E206 IonicContact NH1-OE1 2.79Å; R203-E206 PolarHBondContact NH1-OE1 3.01Å; R203-E206 IonicContact NH1-OE2 2.69Å; R203-E206 PolarHBondContact O-N 2.82Å; K204-E206 VanDerWaalsContact C-N 3.25Å; K204-E206 PolarHBondContact O-N 2.9Å
207	G	54.2	Low	77.6	Confident	60 Å²	60	52.3 Å²	52.3	62%	0.619	27%	0.267	S	S	*	.	T	Hydrogen-bonded Turn	trans	70.6	33.1	-179.9	0	0	0	0	0	113.2	K183 K204 S205	K183-G207 VanDerWaalsContact CE-O 3.27Å; K183-G207 WeakPolarHBondContact CE-O 3.3Å; K204-G207 PolarHBondContact O-N 2.76Å; S205-G207 PolarHBondContact O-N 2.97Å
208	L	60.8	Low	77.6	Confident	9 Å²	9	54 Å²	54	5%	0.047	28%	0.276	C	S	.	.			trans	-123.6	101.3	174.9	179.2	64.8	0	0	0	110.6	V179 F182 M200 L210	V179-L208 HydrophobicContact CB-CD2 4.27Å; V179-L208 HydrophobicContact CG1-CB 4.02Å; V179-L208 HydrophobicContact CG1-CD2 4.16Å; V179-L208 HydrophobicContact CG2-CD2 3.85Å; F182-L208 HydrophobicContact CB-CD1 4.48Å; F182-L208 HydrophobicContact CD1-CD1 3.39Å; F182-L208 HydrophobicContact CE1-CD1 3.9Å; F182-L208 HydrophobicContact CG-CD1 4.15Å; M200-L208 HydrophobicContact CE-CD2 3.56Å; L208-L210 VanDerWaalsContact C-N 3.26Å; L208-L210 HydrophobicContact CD2-CB 4.43Å; L208-L210 HydrophobicContact CG-CB 4.28Å; L208-L210 PolarHBondContact O-N 2.94Å
209	E	66.8	Low	77.8	Confident	132 Å²	132	52.8 Å²	52.8	62%	0.617	27%	0.271	S	S	*	.			trans	-83.5	65.6	169.9	-62	-156.1	147.7	0	0	111.9	A211 S212 A213	E209-A211 PolarHBondContact O-N 3.33Å; E209-S212 PolarHBondContact O-N 2.89Å; E209-S212 VanDerWaalsContact OE2-CB 3.24Å; E209-S212 WeakPolarHBondContact OE2-CB 3.32Å; E209-S212 PolarHBondContact OE2-OG 3.15Å; E209-A213 PolarHBondContact O-N 3.22Å
210	L	75.9	Confident	78.1	Confident	3 Å²	3	50.6 Å²	50.6	2%	0.016	26%	0.259	C	S	.	.	H	α-helix	trans	-57.6	-32.6	173.4	-173.1	63.4	0	0	0	111.2	V135 L169 F182 L197 M200 F201 L208 S212 A213 V214	V135-L210 HydrophobicContact CG2-CD1 4.35Å; L169-L210 HydrophobicContact CD1-CD2 4.43Å; F182-L210 HydrophobicContact CE2-CD1 4.17Å; F182-L210 HydrophobicContact CZ-CD1 4.24Å; L197-L210 HydrophobicContact CD1-CD2 4.15Å; M200-L210 HydrophobicContact CB-CD2 3.73Å; F201-L210 HydrophobicContact CD1-CB 4.18Å; F201-L210 HydrophobicContact CD1-CD2 4.12Å; F201-L210 HydrophobicContact CD1-CG 4.04Å; F201-L210 HydrophobicContact CE1-CB 4.34Å; F201-L210 HydrophobicContact CE1-CD2 4.1Å; F201-L210 HydrophobicContact CE1-CG 3.81Å; F201-L210 HydrophobicContact CG-CD2 4.43Å; F201-L210 HydrophobicContact CZ-CD2 4.43Å; F201-L210 HydrophobicContact CZ-CG 4.44Å; L208-L210 VanDerWaalsContact C-N 3.26Å; L208-L210 HydrophobicContact CD2-CB 4.43Å; L208-L210 HydrophobicContact CG-CB 4.28Å; L208-L210 PolarHBondContact O-N 2.94Å; L210-S212 VanDerWaalsContact C-N 3.32Å; L210-S212 PolarHBondContact O-N 3.23Å; L210-A213 HydrophobicContact CD1-CB 4.39Å; L210-A213 WeakPolarHBondContact O-CB 3.45Å; L210-A213 PolarHBondContact O-N 3.39Å; L210-V214 PolarHBondContact O-N 3.13Å
211	A	77.1	Confident	78.6	Confident	26 Å²	26	50.5 Å²	50.5	22%	0.215	26%	0.258	C	S	.	.	H	α-helix	trans	-63.1	-31	172.6	0	0	0	0	0	114	F201 E209 Y243	F201-A211 HydrophobicContact CD1-CB 4.31Å; E209-A211 PolarHBondContact O-N 3.33Å; A211-Y243 HydrophobicContact CB-CD1 4.22Å
212	S	80.1	Confident	79	Confident	28 Å²	28	50.5 Å²	50.5	20%	0.196	26%	0.258	C	S	.	.	H	α-helix	trans	-80.6	-35.5	171.9	-65.6	0	0	0	0	111.2	E209 L210 V214 R215	E209-S212 PolarHBondContact O-N 2.89Å; E209-S212 VanDerWaalsContact OE2-CB 3.24Å; E209-S212 WeakPolarHBondContact OE2-CB 3.32Å; E209-S212 PolarHBondContact OE2-OG 3.15Å; L210-S212 VanDerWaalsContact C-N 3.32Å; L210-S212 PolarHBondContact O-N 3.23Å; S212-V214 VanDerWaalsContact C-N 3.32Å; S212-V214 PolarHBondContact O-N 3.09Å; S212-R215 WeakPolarHBondContact O-CB 3.35Å; S212-R215 WeakPolarHBondContact O-CG 3.35Å; S212-R215 PolarHBondContact O-N 3.17Å
213	A	84.3	Confident	79.4	Confident	9 Å²	9	43.3 Å²	43.3	7%	0.074	23%	0.232	C	C	.	.	H	α-helix	trans	-63.2	-32.5	177.2	0	0	0	0	0	113.6	K133 V135 F182 E209 L210 S216	K133-A213 WeakPolarHBondContact O-CB 3.42Å; V135-A213 HydrophobicContact CG2-CB 4.1Å; V135-A213 PolarHBondContact N-O 2.92Å; F182-A213 HydrophobicContact CE1-CB 4.31Å; F182-A213 HydrophobicContact CZ-CB 3.9Å; E209-A213 PolarHBondContact O-N 3.22Å; L210-A213 HydrophobicContact CD1-CB 4.39Å; L210-A213 WeakPolarHBondContact O-CB 3.45Å; L210-A213 PolarHBondContact O-N 3.39Å; A213-S216 PolarHBondContact O-OG 3.17Å; A213-S216 VanDerWaalsContact O-OG 3.14Å
214	V	88.3	Confident	80	Confident	3 Å²	3	40.8 Å²	40.8	2%	0.018	22%	0.223	C	C	.	.	G	3₁₀ helix	trans	-84	0.2	177	-60.5	0	0	0	0	114.8	V135 F201 L210 S212 S216 L217 L244 P245	V135-V214 HydrophobicContact CB-CG1 4.03Å; V135-V214 HydrophobicContact CG1-CG1 4.4Å; V135-V214 HydrophobicContact CG2-CG1 3.89Å; F201-V214 HydrophobicContact CE1-CG1 4.04Å; F201-V214 HydrophobicContact CE1-CG2 3.75Å; F201-V214 HydrophobicContact CZ-CG1 3.98Å; F201-V214 HydrophobicContact CZ-CG2 4.09Å; L210-V214 PolarHBondContact O-N 3.13Å; S212-V214 VanDerWaalsContact C-N 3.32Å; S212-V214 PolarHBondContact O-N 3.09Å; V214-S216 PolarHBondContact O-N 2.86Å; V214-L217 WeakPolarHBondContact O-CB 3.43Å; V214-L217 PolarHBondContact O-N 3.12Å; V214-L217 VanDerWaalsContact O-N 3.08Å; V214-L244 HydrophobicContact CB-CD2 4.1Å; V214-L244 HydrophobicContact CG1-CD2 4.39Å; V214-L244 HydrophobicContact CG2-CD2 3.96Å; V214-P245 WeakPolarHBondContact O-CD 3.35Å
215	R	87.5	Confident	81	Confident	188 Å²	188	34 Å²	34	71%	0.709	19%	0.193	S	C	*	.	G	3₁₀ helix	trans	-61	-27.2	174.4	-68.6	177.8	-179	164.3	3.1	112.6	S212 L217	S212-R215 WeakPolarHBondContact O-CB 3.35Å; S212-R215 WeakPolarHBondContact O-CG 3.35Å; S212-R215 PolarHBondContact O-N 3.17Å; R215-L217 VanDerWaalsContact C-N 3.35Å
216	S	87.9	Confident	82.4	Confident	19 Å²	19	28.6 Å²	28.6	13%	0.133	16%	0.155	C	C	.	.	G	3₁₀ helix	trans	-89.5	12.8	176.9	53.4	0	0	0	0	114.5	R126 Q134 V135 A213 V214 D218	R126-S216 PolarHBondContact NH1-O 2.81Å; R126-S216 VanDerWaalsContact NH1-O 3.1Å; R126-S216 PolarHBondContact NH2-O 2.85Å; Q134-S216 VanDerWaalsContact CB-OG 3.32Å; Q134-S216 WeakPolarHBondContact CB-OG 3.35Å; V135-S216 CarbonylContact O-C 3.59Å; V135-S216 PolarHBondContact O-OG 2.75Å; A213-S216 PolarHBondContact O-OG 3.17Å; A213-S216 VanDerWaalsContact O-OG 3.14Å; V214-S216 PolarHBondContact O-N 2.86Å; S216-D218 PolarHBondContact O-N 3.12Å
217	L	92.9	Very high	83.4	Confident	2 Å²	2	27.7 Å²	27.7	1%	0.01	15%	0.149	C	C	.	.			trans	-71.8	113.2	-175.5	-174.8	81.1	0	0	0	111.8	V135 L138 V214 R215 V219 L220 L244 P245	V135-L217 HydrophobicContact CG1-CD1 3.82Å; V135-L217 PolarHBondContact O-N 3.03Å; L138-L217 HydrophobicContact CB-CD1 3.57Å; L138-L217 HydrophobicContact CB-CD2 4.24Å; L138-L217 HydrophobicContact CD2-CD2 4.43Å; V214-L217 WeakPolarHBondContact O-CB 3.43Å; V214-L217 PolarHBondContact O-N 3.12Å; V214-L217 VanDerWaalsContact O-N 3.08Å; R215-L217 VanDerWaalsContact C-N 3.35Å; L217-V219 WeakPolarHBondContact CD1-O 3.18Å; L217-L220 HydrophobicContact CD2-CB 4.48Å; L217-L244 HydrophobicContact CD2-CB 4.33Å; L217-L244 HydrophobicContact CD2-CD1 3.88Å; L217-L244 HydrophobicContact CD2-CD2 4.03Å; L217-L244 HydrophobicContact CD2-CG 4.28Å; L217-P245 HydrophobicContact CB-CG 3.9Å
218	D	91.5	Very high	84.8	Confident	38 Å²	38	24.9 Å²	24.9	20%	0.203	12%	0.119	C	C	.	.			trans	-92.2	-28.4	178.2	-113.3	31.5	0	0	0	113.1	L123 R126 G136 S216 R249	L123-D218 HydrophobicContact CD2-CB 4.49Å; R126-D218 VanDerWaalsContact CZ-CG 3.4Å; R126-D218 IonicContact CZ-OD1 3.74Å; R126-D218 IonicContact CZ-OD2 3.6Å; R126-D218 VanDerWaalsContact NE-CG 3.3Å; R126-D218 IonicContact NE-OD1 3.63Å; R126-D218 IonicContact NE-OD2 3.25Å; R126-D218 PolarHBondContact NE-OD2 2.94Å; R126-D218 IonicContact NH2-OD1 2.67Å; R126-D218 PolarHBondContact NH2-OD1 3.09Å; R126-D218 IonicContact NH2-OD2 2.84Å; G136-D218 PolarHBondContact O-N 3.14Å; S216-D218 PolarHBondContact O-N 3.12Å; D218-R249 WeakPolarHBondContact O-CB 3.47Å; D218-R249 PolarHBondContact O-N 3.1Å; D218-R249 IonicContact OD1-NH1 3.63Å; D218-R249 IonicContact OD2-CZ 2.85Å; D218-R249 IonicContact OD2-NH1 3.01Å; D218-R249 PolarHBondContact OD2-NH1 3Å; D218-R249 IonicContact OD2-NH2 2.67Å
219	V	94.8	Very high	85.8	Confident	0 Å²	0	25.5 Å²	25.5	0%	0	12%	0.123	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.8	122.6	-173	-169.3	0	0	0	0	111.8	F95 I119 L122 G136 A137 L138 L217 V221 R249	F95-V219 HydrophobicContact CE1-CG1 4.13Å; F95-V219 HydrophobicContact CE2-CG1 4.35Å; F95-V219 HydrophobicContact CZ-CG1 3.59Å; I119-V219 HydrophobicContact CG1-CB 4.47Å; I119-V219 HydrophobicContact CG1-CG1 3.9Å; L122-V219 HydrophobicContact CB-CG2 4.26Å; L122-V219 HydrophobicContact CD1-CG2 3.86Å; G136-V219 PolarHBondContact O-N 3.05Å; G136-V219 VanDerWaalsContact O-N 3.14Å; A137-V219 CarbonylContact C-O 3.59Å; A137-V219 VanDerWaalsContact CA-O 3.31Å; A137-V219 WeakPolarHBondContact CA-O 3.48Å; A137-V219 HydrophobicContact CB-CB 4.13Å; L138-V219 PolarHBondContact N-O 3.28Å; L217-V219 WeakPolarHBondContact CD1-O 3.18Å; V219-V221 HydrophobicContact CG1-CG2 4.21Å; V219-R249 CarbonylContact C-O 3.57Å; V219-R249 WeakPolarHBondContact CA-O 3.36Å
220	L	95.3	Very high	86.1	Confident	0 Å²	0	21.9 Å²	21.9	0%	0	11%	0.107	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.4	133.7	167	175	64.3	0	0	0	109.6	L138 I140 L217 L222 L241 L244 R249 T250 G251	L138-L220 HydrophobicContact CB-CD1 4.36Å; L138-L220 HydrophobicContact CD2-CD1 4.02Å; L138-L220 HydrophobicContact CG-CD1 4.06Å; L138-L220 CarbonylContact O-C 3.56Å; L138-L220 WeakPolarHBondContact O-CA 3.39Å; I140-L220 HydrophobicContact CD1-CD1 3.95Å; I140-L220 HydrophobicContact CG1-CD1 4.22Å; L217-L220 HydrophobicContact CD2-CB 4.48Å; L220-L222 HydrophobicContact CD1-CD2 4.11Å; L220-L222 HydrophobicContact CD2-CD2 4.43Å; L220-L222 HydrophobicContact CG-CD2 4.29Å; L220-L222 HydrophobicContact CG-CG 4.49Å; L220-L241 HydrophobicContact CD2-CD2 3.61Å; L220-L244 HydrophobicContact CD1-CD1 3.92Å; L220-L244 HydrophobicContact CD2-CD1 3.98Å; L220-L244 HydrophobicContact CG-CD1 4.46Å; L220-R249 PolarHBondContact N-O 3.25Å; L220-T250 HydrophobicContact CB-CG2 4.31Å; L220-T250 HydrophobicContact CD2-CG2 3.96Å; L220-T250 HydrophobicContact CG-CG2 4.2Å; L220-T250 CarbonylContact O-C 3.55Å; L220-T250 WeakPolarHBondContact O-CA 3.48Å; L220-G251 PolarHBondContact O-N 3.39Å
221	V	95.4	Very high	85.9	Confident	0 Å²	0	25.5 Å²	25.5	0%	0	13%	0.125	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	131.9	171.1	177	0	0	0	0	110.4	F95 F115 I119 L138 V139 I140 V219 G251 F253	F95-V221 HydrophobicContact CE1-CG2 4.17Å; F95-V221 HydrophobicContact CZ-CG2 4.13Å; F115-V221 HydrophobicContact CB-CG1 4.23Å; F115-V221 HydrophobicContact CB-CG2 4.06Å; F115-V221 HydrophobicContact CD1-CG1 3.96Å; F115-V221 HydrophobicContact CD2-CG1 4.01Å; F115-V221 HydrophobicContact CD2-CG2 4.47Å; F115-V221 HydrophobicContact CE1-CG1 4.22Å; F115-V221 HydrophobicContact CE2-CG1 4.29Å; F115-V221 HydrophobicContact CG-CG1 3.84Å; F115-V221 HydrophobicContact CG-CG2 4.4Å; F115-V221 HydrophobicContact CZ-CG1 4.38Å; I119-V221 HydrophobicContact CD1-CG2 3.95Å; I119-V221 HydrophobicContact CG1-CG2 4.49Å; L138-V221 PolarHBondContact O-N 2.82Å; V139-V221 HydrophobicContact CB-CB 4.43Å; V139-V221 HydrophobicContact CG1-CB 4.16Å; V139-V221 HydrophobicContact CG1-CG1 4.07Å; V139-V221 HydrophobicContact CG2-CB 4.21Å; I140-V221 PolarHBondContact N-O 3.23Å; V219-V221 HydrophobicContact CG1-CG2 4.21Å; V221-G251 CarbonylContact C-O 3.59Å; V221-G251 VanDerWaalsContact CA-O 3.27Å; V221-G251 WeakPolarHBondContact CA-O 3.45Å; V221-F253 HydrophobicContact CG1-CD2 3.88Å; V221-F253 HydrophobicContact CG1-CE2 4.13Å
222	L	93.9	Very high	86	Confident	3 Å²	3	27 Å²	27	2%	0.016	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	103.5	172.5	-55.6	-178.8	0	0	0	108.4	I140 L220 A225 L228 G251 L252 F253 L264	I140-L222 HydrophobicContact CB-CD2 3.9Å; I140-L222 HydrophobicContact CD1-CD2 3.92Å; I140-L222 HydrophobicContact CG1-CD2 4.19Å; L220-L222 HydrophobicContact CD1-CD2 4.11Å; L220-L222 HydrophobicContact CD2-CD2 4.43Å; L220-L222 HydrophobicContact CG-CD2 4.29Å; L220-L222 HydrophobicContact CG-CG 4.49Å; L222-A225 HydrophobicContact CB-CB 4.16Å; L222-L228 HydrophobicContact CB-CD1 4.4Å; L222-G251 PolarHBondContact N-O 3.14Å; L222-L252 HydrophobicContact CD1-CD1 4.45Å; L222-F253 PolarHBondContact O-N 3.41Å; L222-L264 HydrophobicContact CD1-CD2 4.25Å
223	D	92.1	Very high	86.2	Confident	6 Å²	6	28 Å²	28	3%	0.032	15%	0.145	C	C	.	.	T	Hydrogen-bonded Turn	trans	-102.2	145.5	-178.6	-173.9	36.4	0	0	0	112.6	F115 I140 P142 L146 A225	F115-D223 HydrophobicContact CE1-CB 4.15Å; F115-D223 HydrophobicContact CZ-CB 4.23Å; I140-D223 PolarHBondContact O-N 3.09Å; P142-D223 WeakPolarHBondContact CD-O 3.45Å; L146-D223 WeakPolarHBondContact CD2-OD2 3.41Å; D223-A225 PolarHBondContact O-N 2.99Å
224	E	87.4	Confident	86.2	Confident	8 Å²	8	33.1 Å²	33.1	4%	0.037	17%	0.167	C	C	.	.	T	Hydrogen-bonded Turn	trans	38.6	56	-159.9	-65.7	-126.5	-171.8	0	0	111.2	P142 L146 D226 R227 L228 F253 R382 G383 H406	P142-E224 HydrophobicContact CG-CB 4.04Å; L146-E224 HydrophobicContact CD2-CG 4.21Å; E224-D226 VanDerWaalsContact C-N 3.3Å; E224-D226 PolarHBondContact O-N 2.84Å; E224-R227 HydrophobicContact CB-CB 4.12Å; E224-R227 WeakPolarHBondContact O-CA 3.46Å; E224-R227 VanDerWaalsContact O-CB 3.26Å; E224-R227 WeakPolarHBondContact O-CB 3.4Å; E224-R227 PolarHBondContact O-N 3.36Å; E224-L228 PolarHBondContact O-N 2.75Å; E224-L228 VanDerWaalsContact O-N 3.16Å; E224-F253 PolarHBondContact N-O 2.85Å; E224-F253 VanDerWaalsContact N-O 3.17Å; E224-R382 VanDerWaalsContact OE2-CB 3.26Å; E224-R382 WeakPolarHBondContact OE2-CB 3.34Å; E224-R382 WeakPolarHBondContact OE2-CD 3.43Å; E224-R382 WeakPolarHBondContact OE2-CG 3.4Å; E224-R382 IonicContact OE2-NE 3.67Å; E224-G383 VanDerWaalsContact CD-N 3.27Å; E224-G383 WeakPolarHBondContact OE1-CA 3.42Å; E224-G383 PolarHBondContact OE1-N 3.44Å; E224-H406 IonicContact OE2-ND1 2.68Å
225	A	84.8	Confident	86.1	Confident	0 Å²	0	36.5 Å²	36.5	0%	0	20%	0.195	C	C	.	.	H	α-helix	trans	-66.3	-27.1	-172	0	0	0	0	0	114.1	L222 D223 R227 L228 L229 L252 F253 L261	L222-A225 HydrophobicContact CB-CB 4.16Å; D223-A225 PolarHBondContact O-N 2.99Å; A225-R227 PolarHBondContact O-N 2.85Å; A225-L228 PolarHBondContact O-N 2.91Å; A225-L229 PolarHBondContact O-N 2.91Å; A225-L252 HydrophobicContact CB-CD1 4.05Å; A225-L252 HydrophobicContact CB-CD2 4.34Å; A225-L252 HydrophobicContact CB-CG 3.82Å; A225-F253 PolarHBondContact N-O 3.03Å; A225-F253 VanDerWaalsContact N-O 3.09Å; A225-L261 HydrophobicContact CB-CD1 3.69Å
226	D	81.8	Confident	86.2	Confident	1 Å²	1	28.5 Å²	28.5	1%	0.005	17%	0.168	C	C	.	.	H	α-helix	trans	-60.4	-35.5	167.4	66.7	-34	0	0	0	111.4	E224 D230 S254 T256 T258 R382 H406	E224-D226 VanDerWaalsContact C-N 3.3Å; E224-D226 PolarHBondContact O-N 2.84Å; D226-D230 PolarHBondContact O-N 3.29Å; D226-S254 PolarHBondContact OD1-OG 2.98Å; D226-T256 PolarHBondContact OD2-OG1 2.95Å; D226-T258 HydrophobicContact CB-CG2 4.24Å; D226-R382 IonicContact OD2-CZ 2.66Å; D226-R382 IonicContact OD2-NH2 3.48Å; D226-R382 PolarHBondContact OD2-NH2 2.82Å; D226-H406 IonicContact OD2-CE1 3.51Å; D226-H406 PolarHBondContact OD2-CE1 3.32Å; D226-H406 IonicContact OD2-NE2 3.04Å; D226-H406 PolarHBondContact OD2-NE2 3.08Å
227	R	78.1	Confident	86.3	Confident	47 Å²	47	27.7 Å²	27.7	18%	0.177	16%	0.162	C	C	.	.	H	α-helix	trans	-77.9	-29.5	178.9	-174.3	51.3	165.3	176.6	0.7	114	P142 E224 A225 L229 D230 M231 R382	P142-R227 HydrophobicContact CB-CB 4.27Å; P142-R227 HydrophobicContact CB-CG 3.81Å; P142-R227 HydrophobicContact CG-CB 3.97Å; P142-R227 HydrophobicContact CG-CG 3.81Å; E224-R227 HydrophobicContact CB-CB 4.12Å; E224-R227 WeakPolarHBondContact O-CA 3.46Å; E224-R227 VanDerWaalsContact O-CB 3.26Å; E224-R227 WeakPolarHBondContact O-CB 3.4Å; E224-R227 PolarHBondContact O-N 3.36Å; A225-R227 PolarHBondContact O-N 2.85Å; R227-L229 PolarHBondContact O-N 2.88Å; R227-D230 IonicContact NH1-OD2 3.59Å; R227-M231 HydrophobicContact CG-CG 4.36Å; R227-M231 HydrophobicContact CG-SD 3.97Å; R227-M231 PolarHBondContact NE-SD 3.32Å; R227-M231 VanDerWaalsContact NE-SD 3.42Å; R227-M231 WeakPolarHBondContact O-CB 3.33Å; R227-M231 WeakPolarHBondContact O-CG 3.27Å; R227-M231 PolarHBondContact O-N 3.43Å; R227-M231 VanDerWaalsContact O-N 3.16Å; R227-R382 VanDerWaalsContact CG-CD 3.49Å
228	L	84	Confident	86	Confident	0 Å²	0	31.5 Å²	31.5	0%	0	18%	0.183	C	C	.	.	H	α-helix	trans	-59.2	-41.4	171.3	-69.1	169.9	0	0	0	110.6	I140 P142 P194 L222 E224 A225 F233 L237	I140-L228 HydrophobicContact CG2-CD1 4.38Å; I140-L228 HydrophobicContact CG2-CD2 4.36Å; P142-L228 HydrophobicContact CB-CD2 3.88Å; P142-L228 HydrophobicContact CB-CG 4.33Å; P194-L228 HydrophobicContact CG-CD2 3.58Å; L222-L228 HydrophobicContact CB-CD1 4.4Å; E224-L228 PolarHBondContact O-N 2.75Å; E224-L228 VanDerWaalsContact O-N 3.16Å; A225-L228 PolarHBondContact O-N 2.91Å; L228-F233 HydrophobicContact CD2-CD2 4.23Å; L228-F233 WeakPolarHBondContact O-CB 3.38Å; L228-F233 PolarHBondContact O-N 3.17Å; L228-L237 HydrophobicContact CB-CD1 3.94Å; L228-L237 HydrophobicContact CD1-CD1 4.24Å; L228-L237 HydrophobicContact CD1-CD2 4.4Å
229	L	81.4	Confident	85.9	Confident	23 Å²	23	31 Å²	31	12%	0.12	18%	0.182	C	C	.	.	H	α-helix	trans	-72.9	-50	176.4	-60.4	173.5	0	0	0	112.2	A225 R227 M231 G232 E234 E260 L261 L264	A225-L229 PolarHBondContact O-N 2.91Å; R227-L229 PolarHBondContact O-N 2.88Å; L229-M231 PolarHBondContact O-N 3.18Å; L229-G232 PolarHBondContact O-N 3.42Å; L229-E234 HydrophobicContact CD2-CB 4.23Å; L229-E234 HydrophobicContact CD2-CG 4.38Å; L229-E260 HydrophobicContact CD1-CB 3.9Å; L229-L261 HydrophobicContact CD1-CB 4.43Å; L229-L261 HydrophobicContact CD1-CD1 4.21Å; L229-L264 HydrophobicContact CD1-CB 4.16Å; L229-L264 HydrophobicContact CD1-CD2 4.05Å; L229-L264 HydrophobicContact CD2-CD2 4.27Å; L229-L264 HydrophobicContact CG-CD2 4.24Å
230	D	73.4	Confident	85.7	Confident	55 Å²	55	31 Å²	31	29%	0.294	18%	0.182	S	C	.	.	H	α-helix	trans	-51.2	-26.9	175.7	-88.5	7.6	0	0	0	113.3	D226 R227 R382 R402	D226-D230 PolarHBondContact O-N 3.29Å; R227-D230 IonicContact NH1-OD2 3.59Å; D230-R382 IonicContact OD2-CZ 3.14Å; D230-R382 IonicContact OD2-NH1 3.21Å; D230-R382 PolarHBondContact OD2-NH1 3.3Å; D230-R382 IonicContact OD2-NH2 3.37Å; D230-R382 PolarHBondContact OD2-NH2 3.17Å; D230-R402 IonicContact OD1-NH1 3.58Å; D230-R402 PolarHBondContact OD1-NH1 3.02Å
231	M	71.9	Confident	85.4	Confident	79 Å²	79	32.3 Å²	32.3	39%	0.389	19%	0.189	S	C	.	.	T	Hydrogen-bonded Turn	trans	-92.8	-0.4	-178.5	-73.6	-177.9	64.5	0	0	114.4	P142 R227 L229 F233	P142-M231 HydrophobicContact CB-SD 4.1Å; R227-M231 HydrophobicContact CG-CG 4.36Å; R227-M231 HydrophobicContact CG-SD 3.97Å; R227-M231 PolarHBondContact NE-SD 3.32Å; R227-M231 VanDerWaalsContact NE-SD 3.42Å; R227-M231 WeakPolarHBondContact O-CB 3.33Å; R227-M231 WeakPolarHBondContact O-CG 3.27Å; R227-M231 PolarHBondContact O-N 3.43Å; R227-M231 VanDerWaalsContact O-N 3.16Å; L229-M231 PolarHBondContact O-N 3.18Å; M231-F233 HydrophobicContact CB-CD2 3.74Å; M231-F233 HydrophobicContact CB-CE2 3.74Å; M231-F233 HydrophobicContact CE-CE2 3.62Å; M231-F233 HydrophobicContact CE-CZ 3.89Å; M231-F233 HydrophobicContact CG-CE2 4.48Å; M231-F233 HydrophobicContact SD-CE2 4.06Å
232	G	80.4	Confident	85	Confident	59 Å²	59	36.6 Å²	36.6	61%	0.608	22%	0.219	S	C	*	.	T	Hydrogen-bonded Turn	trans	75.9	18.8	-179.1	0	0	0	0	0	114.3	L229 E234	L229-G232 PolarHBondContact O-N 3.42Å; G232-E234 PolarHBondContact O-N 2.93Å
233	F	83.6	Confident	84.8	Confident	47 Å²	47	40.2 Å²	40.2	21%	0.206	23%	0.233	C	C	.	.	T	Hydrogen-bonded Turn	trans	-77.7	6.9	175.2	-63.3	-55.8	0	0	0	113.5	P194 L228 M231 A235 S236 L237	P194-F233 HydrophobicContact CB-CB 4.21Å; P194-F233 HydrophobicContact CB-CD1 4.2Å; P194-F233 HydrophobicContact CB-CG 4.15Å; P194-F233 HydrophobicContact CG-CB 4.17Å; P194-F233 HydrophobicContact CG-CD2 4.13Å; P194-F233 HydrophobicContact CG-CG 4.06Å; L228-F233 HydrophobicContact CD2-CD2 4.23Å; L228-F233 WeakPolarHBondContact O-CB 3.38Å; L228-F233 PolarHBondContact O-N 3.17Å; M231-F233 HydrophobicContact CB-CD2 3.74Å; M231-F233 HydrophobicContact CB-CE2 3.74Å; M231-F233 HydrophobicContact CE-CE2 3.62Å; M231-F233 HydrophobicContact CE-CZ 3.89Å; M231-F233 HydrophobicContact CG-CE2 4.48Å; M231-F233 HydrophobicContact SD-CE2 4.06Å; F233-A235 VanDerWaalsContact C-N 3.32Å; F233-A235 PolarHBondContact O-N 2.87Å; F233-S236 WeakPolarHBondContact O-CB 3.49Å; F233-S236 PolarHBondContact O-N 2.88Å; F233-S236 VanDerWaalsContact O-N 3.14Å; F233-L237 WeakPolarHBondContact O-CB 3.43Å; F233-L237 WeakPolarHBondContact O-CG 3.5Å; F233-L237 PolarHBondContact O-N 2.82Å
234	E	84	Confident	84.8	Confident	118 Å²	118	40.4 Å²	40.4	55%	0.551	23%	0.234	S	C	*	.	H	α-helix	trans	-53.7	-45.1	179.5	-175.9	176.1	-168.4	0	0	112.5	L229 G232 L237 N238	L229-E234 HydrophobicContact CD2-CB 4.23Å; L229-E234 HydrophobicContact CD2-CG 4.38Å; G232-E234 PolarHBondContact O-N 2.93Å; E234-L237 PolarHBondContact O-N 3.31Å; E234-N238 WeakPolarHBondContact O-CB 3.43Å; E234-N238 VanDerWaalsContact O-CG 3.23Å; E234-N238 PolarHBondContact O-N 2.92Å; E234-N238 PolarHBondContact O-ND2 2.83Å
235	A	86.3	Confident	84.9	Confident	74 Å²	74	41.5 Å²	41.5	61%	0.612	24%	0.242	S	C	*	.	H	α-helix	trans	-63	-45.7	176.3	0	0	0	0	0	112.3	F233 N238 S239	F233-A235 VanDerWaalsContact C-N 3.32Å; F233-A235 PolarHBondContact O-N 2.87Å; A235-N238 PolarHBondContact O-N 3.02Å; A235-S239 WeakPolarHBondContact O-CB 3.16Å; A235-S239 PolarHBondContact O-N 3.08Å
236	S	89.8	Confident	84.9	Confident	20 Å²	20	49.8 Å²	49.8	14%	0.14	28%	0.278	C	S	.	.	H	α-helix	trans	-61.7	-43.1	175.2	-64.4	0	0	0	0	112	E198 F233 S239 I240	E198-S236 WeakPolarHBondContact OE2-CA 3.42Å; E198-S236 WeakPolarHBondContact OE2-CB 3.35Å; E198-S236 PolarHBondContact OE2-OG 2.99Å; F233-S236 WeakPolarHBondContact O-CB 3.49Å; F233-S236 PolarHBondContact O-N 2.88Å; F233-S236 VanDerWaalsContact O-N 3.14Å; S236-S239 PolarHBondContact O-N 3.31Å; S236-I240 WeakPolarHBondContact O-CB 3.37Å; S236-I240 VanDerWaalsContact O-CD1 3.32Å; S236-I240 WeakPolarHBondContact O-CD1 3.14Å; S236-I240 VanDerWaalsContact O-CG1 3.24Å; S236-I240 WeakPolarHBondContact O-CG1 3.5Å; S236-I240 PolarHBondContact O-N 2.9Å
237	L	88.9	Confident	85.2	Confident	1 Å²	1	57.5 Å²	57.5	1%	0.005	31%	0.314	C	S	.	.	H	α-helix	trans	-62.1	-47.6	176.2	-75.2	-176.2	0	0	0	111	I140 P194 L228 F233 E234 S239 I240 L241 L264	I140-L237 HydrophobicContact CD1-CD2 4.3Å; I140-L237 HydrophobicContact CG2-CD2 3.98Å; P194-L237 HydrophobicContact CG-CD2 4.38Å; L228-L237 HydrophobicContact CB-CD1 3.94Å; L228-L237 HydrophobicContact CD1-CD1 4.24Å; L228-L237 HydrophobicContact CD1-CD2 4.4Å; F233-L237 WeakPolarHBondContact O-CB 3.43Å; F233-L237 WeakPolarHBondContact O-CG 3.5Å; F233-L237 PolarHBondContact O-N 2.82Å; E234-L237 PolarHBondContact O-N 3.31Å; L237-S239 VanDerWaalsContact C-N 3.29Å; L237-S239 PolarHBondContact O-N 3.49Å; L237-I240 PolarHBondContact O-N 3.02Å; L237-L241 WeakPolarHBondContact O-CB 3.15Å; L237-L241 WeakPolarHBondContact O-CG 3.26Å; L237-L241 PolarHBondContact O-N 3.48Å; L237-L264 HydrophobicContact CD1-CD2 4.46Å
238	N	87.6	Confident	85.8	Confident	82 Å²	82	57 Å²	57	44%	0.439	31%	0.312	S	S	.	.	H	α-helix	trans	-61.9	-37.8	177.8	-69.2	-21.2	0	0	0	111.6	E234 A235 S242	E234-N238 WeakPolarHBondContact O-CB 3.43Å; E234-N238 VanDerWaalsContact O-CG 3.23Å; E234-N238 PolarHBondContact O-N 2.92Å; E234-N238 PolarHBondContact O-ND2 2.83Å; A235-N238 PolarHBondContact O-N 3.02Å; N238-S242 PolarHBondContact O-N 3.22Å
239	S	89.2	Confident	86.1	Confident	28 Å²	28	59 Å²	59	20%	0.196	32%	0.32	C	S	.	.	H	α-helix	trans	-69.9	-27.9	172.7	-171.8	0	0	0	0	114	A235 S236 L237 S242 Y243	A235-S239 WeakPolarHBondContact O-CB 3.16Å; A235-S239 PolarHBondContact O-N 3.08Å; S236-S239 PolarHBondContact O-N 3.31Å; L237-S239 VanDerWaalsContact C-N 3.29Å; L237-S239 PolarHBondContact O-N 3.49Å; S239-S242 PolarHBondContact O-OG 2.95Å; S239-S242 VanDerWaalsContact O-OG 3.1Å; S239-Y243 WeakPolarHBondContact O-CD2 3.32Å; S239-Y243 VanDerWaalsContact O-CE2 3.27Å; S239-Y243 WeakPolarHBondContact O-CE2 3.49Å
240	I	90.3	Very high	86.7	Confident	0 Å²	0	58 Å²	58	0%	0	32%	0.315	C	S	.	.	H	α-helix	trans	-75.3	-48.9	173.5	-73.8	155.4	0	0	0	109.7	I140 P194 L197 E198 F201 S236 L237 S242 Y243 L244	I140-I240 HydrophobicContact CD1-CG2 3.81Å; P194-I240 HydrophobicContact CB-CD1 4.13Å; L197-I240 HydrophobicContact CB-CD1 4.2Å; L197-I240 HydrophobicContact CD2-CD1 3.98Å; L197-I240 HydrophobicContact CD2-CG1 4.21Å; L197-I240 HydrophobicContact CD2-CG2 3.92Å; L197-I240 HydrophobicContact CG-CD1 4.28Å; L197-I240 HydrophobicContact CG-CG1 4.32Å; E198-I240 HydrophobicContact CB-CG1 4.42Å; F201-I240 HydrophobicContact CD2-CG1 4.3Å; F201-I240 HydrophobicContact CE2-CG1 4.32Å; F201-I240 HydrophobicContact CE2-CG2 4.07Å; S236-I240 WeakPolarHBondContact O-CB 3.37Å; S236-I240 VanDerWaalsContact O-CD1 3.32Å; S236-I240 WeakPolarHBondContact O-CD1 3.14Å; S236-I240 VanDerWaalsContact O-CG1 3.24Å; S236-I240 WeakPolarHBondContact O-CG1 3.5Å; S236-I240 PolarHBondContact O-N 2.9Å; L237-I240 PolarHBondContact O-N 3.02Å; I240-S242 PolarHBondContact O-N 2.87Å; I240-Y243 PolarHBondContact O-N 3.14Å; I240-L244 HydrophobicContact CG2-CD1 4.27Å; I240-L244 HydrophobicContact CG2-CG 4.42Å; I240-L244 WeakPolarHBondContact O-CG 3.46Å
241	L	88.8	Confident	87.7	Confident	27 Å²	27	55.4 Å²	55.4	14%	0.141	30%	0.301	C	S	.	.	H	α-helix	trans	-60.9	-25.9	-175.6	-71.2	170.4	0	0	0	113.2	L220 L237 L244	L220-L241 HydrophobicContact CD2-CD2 3.61Å; L237-L241 WeakPolarHBondContact O-CB 3.15Å; L237-L241 WeakPolarHBondContact O-CG 3.26Å; L237-L241 PolarHBondContact O-N 3.48Å; L241-L244 HydrophobicContact CD2-CD1 4.37Å; L241-L244 PolarHBondContact O-N 2.77Å
242	S	88.3	Confident	88.6	Confident	90 Å²	90	51.9 Å²	51.9	63%	0.629	28%	0.283	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75	-22.1	175.2	63.4	0	0	0	0	114.2	N238 S239 I240	N238-S242 PolarHBondContact O-N 3.22Å; S239-S242 PolarHBondContact O-OG 2.95Å; S239-S242 VanDerWaalsContact O-OG 3.1Å; I240-S242 PolarHBondContact O-N 2.87Å
243	Y	88.9	Confident	89.1	Confident	80 Å²	80	49.1 Å²	49.1	31%	0.314	25%	0.254	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.4	-16.8	171	-65.8	-64.2	0	0	0	113.3	F201 A211 S239 I240	F201-Y243 HydrophobicContact CB-CD2 3.81Å; F201-Y243 HydrophobicContact CB-CE2 3.7Å; F201-Y243 HydrophobicContact CD1-CD2 4.09Å; F201-Y243 HydrophobicContact CD1-CG 4.14Å; F201-Y243 AromaticContact CD2-CD2 3.97Å; F201-Y243 HydrophobicContact CD2-CD2 3.97Å; F201-Y243 AromaticContact CG-CD2 3.72Å; F201-Y243 HydrophobicContact CG-CD2 3.72Å; F201-Y243 HydrophobicContact CG-CE2 4.16Å; F201-Y243 HydrophobicContact CG-CG 4.24Å; A211-Y243 HydrophobicContact CB-CD1 4.22Å; S239-Y243 WeakPolarHBondContact O-CD2 3.32Å; S239-Y243 VanDerWaalsContact O-CE2 3.27Å; S239-Y243 WeakPolarHBondContact O-CE2 3.49Å; I240-Y243 PolarHBondContact O-N 3.14Å
244	L	91.1	Very high	89.2	Confident	9 Å²	9	47 Å²	47	5%	0.047	25%	0.245	C	C	.	.	S	Bend	trans	-87.2	144.7	-175	-54.9	-170.3	0	0	0	111.9	L138 F201 V214 L217 L220 I240 L241 K246	L138-L244 HydrophobicContact CD2-CD1 3.86Å; L138-L244 HydrophobicContact CD2-CD2 3.93Å; F201-L244 HydrophobicContact CZ-CD2 4.01Å; V214-L244 HydrophobicContact CB-CD2 4.1Å; V214-L244 HydrophobicContact CG1-CD2 4.39Å; V214-L244 HydrophobicContact CG2-CD2 3.96Å; L217-L244 HydrophobicContact CD2-CB 4.33Å; L217-L244 HydrophobicContact CD2-CD1 3.88Å; L217-L244 HydrophobicContact CD2-CD2 4.03Å; L217-L244 HydrophobicContact CD2-CG 4.28Å; L220-L244 HydrophobicContact CD1-CD1 3.92Å; L220-L244 HydrophobicContact CD2-CD1 3.98Å; L220-L244 HydrophobicContact CG-CD1 4.46Å; I240-L244 HydrophobicContact CG2-CD1 4.27Å; I240-L244 HydrophobicContact CG2-CG 4.42Å; I240-L244 WeakPolarHBondContact O-CG 3.46Å; L241-L244 HydrophobicContact CD2-CD1 4.37Å; L241-L244 PolarHBondContact O-N 2.77Å; L244-K246 PolarHBondContact O-N 3.13Å
245	P	90.1	Very high	88.8	Confident	32 Å²	32	42 Å²	42	21%	0.208	22%	0.224	C	C	.	.			trans	-57.9	139.8	176.8	24.1	-34.1	0	0	0	111.3	V214 L217 Q247 R248	V214-P245 WeakPolarHBondContact O-CD 3.35Å; L217-P245 HydrophobicContact CB-CG 3.9Å; P245-Q247 VanDerWaalsContact C-N 3.26Å; P245-Q247 PolarHBondContact O-N 2.77Å; P245-R248 WeakPolarHBondContact O-CD 3.41Å; P245-R248 PolarHBondContact O-NH1 2.96Å
246	K	85.4	Confident	88	Confident	173 Å²	173	38.5 Å²	38.5	75%	0.752	20%	0.195	S	C	*	.	S	Bend	trans	-68	-27.1	179	-68.7	-176.4	178.7	178.3	0	112.5	L244 R270	L244-K246 PolarHBondContact O-N 3.13Å; K246-R270 PolarHBondContact O-NE 3.43Å; K246-R270 PolarHBondContact O-NH2 3.18Å
247	Q	87.4	Confident	87	Confident	163 Å²	163	42.8 Å²	42.8	76%	0.762	21%	0.213	S	C	*	.	S	Bend	trans	-97.4	106	172.7	177.5	170	-15.3	0	0	108.4	P245	P245-Q247 VanDerWaalsContact C-N 3.26Å; P245-Q247 PolarHBondContact O-N 2.77Å
248	R	90.9	Very high	86	Confident	37 Å²	37	43.1 Å²	43.1	14%	0.14	22%	0.215	C	C	.	.	S	Bend	trans	-163	158.9	178.9	60.6	178.7	-173	-103.6	-4.2	107.5	P245 T250 G268	P245-R248 WeakPolarHBondContact O-CD 3.41Å; P245-R248 PolarHBondContact O-NH1 2.96Å; R248-T250 PolarHBondContact NE-OG1 3.08Å; R248-G268 PolarHBondContact NH2-O 3.41Å
249	R	91.4	Very high	85.3	Confident	43 Å²	43	47.2 Å²	47.2	16%	0.162	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.9	135.1	167.7	-55.1	169.6	-166.7	91.8	-6.8	108.5	F95 N98 D100 D218 V219 L220	F95-R249 HydrophobicContact CE2-CB 4.17Å; N98-R249 VanDerWaalsContact OD1-CZ 3.24Å; N98-R249 PolarHBondContact OD1-NE 3.5Å; N98-R249 PolarHBondContact OD1-NH2 3.06Å; D100-R249 WeakPolarHBondContact OD1-CA 3.39Å; D218-R249 WeakPolarHBondContact O-CB 3.47Å; D218-R249 PolarHBondContact O-N 3.1Å; D218-R249 IonicContact OD1-NH1 3.63Å; D218-R249 IonicContact OD2-CZ 2.85Å; D218-R249 IonicContact OD2-NH1 3.01Å; D218-R249 PolarHBondContact OD2-NH1 3Å; D218-R249 IonicContact OD2-NH2 2.67Å; V219-R249 CarbonylContact C-O 3.57Å; V219-R249 WeakPolarHBondContact CA-O 3.36Å; L220-R249 PolarHBondContact N-O 3.25Å
250	T	93.3	Very high	84.5	Confident	2 Å²	2	50.5 Å²	50.5	1%	0.012	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	118.4	-178	-53.6	0	0	0	0	111.3	D100 V101 L220 R248 L269	D100-T250 WeakPolarHBondContact CA-O 3.3Å; D100-T250 PolarHBondContact OD1-N 3.3Å; V101-T250 PolarHBondContact N-O 3.22Å; V101-T250 VanDerWaalsContact N-O 3.08Å; L220-T250 HydrophobicContact CB-CG2 4.31Å; L220-T250 HydrophobicContact CD2-CG2 3.96Å; L220-T250 HydrophobicContact CG-CG2 4.2Å; L220-T250 CarbonylContact O-C 3.55Å; L220-T250 WeakPolarHBondContact O-CA 3.48Å; R248-T250 PolarHBondContact NE-OG1 3.08Å; T250-L269 HydrophobicContact CG2-CD1 3.6Å; T250-L269 HydrophobicContact CG2-CG 3.74Å
251	G	93.6	Very high	83.9	Confident	0 Å²	0	51 Å²	51	0%	0	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106	117.1	175.3	0	0	0	0	0	111.4	V101 L220 V221 L222	V101-G251 CarbonylContact O-C 3.09Å; V101-G251 WeakPolarHBondContact O-CA 3.44Å; L220-G251 PolarHBondContact O-N 3.39Å; V221-G251 CarbonylContact C-O 3.59Å; V221-G251 VanDerWaalsContact CA-O 3.27Å; V221-G251 WeakPolarHBondContact CA-O 3.45Å; L222-G251 PolarHBondContact N-O 3.14Å
252	L	92.1	Very high	83.4	Confident	5 Å²	5	51.4 Å²	51.4	3%	0.026	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	124.7	177.3	179.3	146.6	0	0	0	109.6	V101 A102 A103 L222 A225 L261 L264 V265 L269	V101-L252 PolarHBondContact O-N 3.24Å; A102-L252 WeakPolarHBondContact CA-O 3.1Å; A102-L252 HydrophobicContact CB-CD2 4.44Å; A103-L252 PolarHBondContact N-O 3.4Å; L222-L252 HydrophobicContact CD1-CD1 4.45Å; A225-L252 HydrophobicContact CB-CD1 4.05Å; A225-L252 HydrophobicContact CB-CD2 4.34Å; A225-L252 HydrophobicContact CB-CG 3.82Å; L252-L261 HydrophobicContact CD1-CD1 3.97Å; L252-L261 HydrophobicContact CD2-CD1 4.07Å; L252-L261 HydrophobicContact CD2-CD2 4.21Å; L252-L261 HydrophobicContact CD2-CG 4.2Å; L252-L261 HydrophobicContact CG-CD1 4.43Å; L252-L264 HydrophobicContact CD1-CD2 4.18Å; L252-L264 HydrophobicContact CD1-CG 4.42Å; L252-V265 HydrophobicContact CD1-CG2 3.79Å; L252-V265 HydrophobicContact CD2-CG2 4.05Å; L252-V265 HydrophobicContact CG-CG2 4.48Å; L252-L269 HydrophobicContact CB-CD1 4.34Å; L252-L269 HydrophobicContact CB-CD2 4.06Å; L252-L269 HydrophobicContact CD1-CD1 4.35Å
253	F	90.6	Very high	82.9	Confident	0 Å²	0	54.3 Å²	54.3	0%	0	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	127.2	-175.2	-66.5	-93.8	0	0	0	110.2	A103 K111 A114 F115 V221 L222 E224 A225	A103-F253 HydrophobicContact CB-CD1 3.65Å; A103-F253 HydrophobicContact CB-CE1 3.73Å; A103-F253 HydrophobicContact CB-CG 4.46Å; K111-F253 HydrophobicContact CB-CD1 4.38Å; K111-F253 HydrophobicContact CD-CB 4.27Å; K111-F253 HydrophobicContact CD-CD1 4.2Å; A114-F253 HydrophobicContact CB-CE1 4.3Å; F115-F253 HydrophobicContact CB-CD2 4.45Å; F115-F253 HydrophobicContact CB-CE2 3.69Å; F115-F253 HydrophobicContact CB-CZ 3.74Å; F115-F253 HydrophobicContact CD1-CD1 4.17Å; F115-F253 AromaticContact CD1-CD2 3.78Å; F115-F253 HydrophobicContact CD1-CD2 3.78Å; F115-F253 HydrophobicContact CD1-CE1 4.23Å; F115-F253 AromaticContact CD1-CE2 3.84Å; F115-F253 HydrophobicContact CD1-CE2 3.84Å; F115-F253 AromaticContact CD1-CG 3.96Å; F115-F253 HydrophobicContact CD1-CG 3.96Å; F115-F253 HydrophobicContact CD1-CZ 4.08Å; F115-F253 HydrophobicContact CE1-CD2 4.45Å; F115-F253 HydrophobicContact CE1-CG 4.43Å; F115-F253 HydrophobicContact CG-CD2 4.48Å; F115-F253 HydrophobicContact CG-CE2 4.18Å; F115-F253 HydrophobicContact CG-CZ 4.43Å; V221-F253 HydrophobicContact CG1-CD2 3.88Å; V221-F253 HydrophobicContact CG1-CE2 4.13Å; L222-F253 PolarHBondContact O-N 3.41Å; E224-F253 PolarHBondContact N-O 2.85Å; E224-F253 VanDerWaalsContact N-O 3.17Å; A225-F253 PolarHBondContact N-O 3.03Å; A225-F253 VanDerWaalsContact N-O 3.09Å
254	S	85.3	Confident	82.2	Confident	2 Å²	2	51 Å²	51	1%	0.014	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.1	165.5	-178.9	-171.1	0	0	0	0	111.8	A103 A105 K111 D226 T256	A103-S254 PolarHBondContact O-N 3.36Å; A105-S254 PolarHBondContact N-O 3.45Å; K111-S254 WeakPolarHBondContact CE-O 3.37Å; K111-S254 PolarHBondContact NZ-O 2.98Å; K111-S254 VanDerWaalsContact NZ-O 3.13Å; D226-S254 PolarHBondContact OD1-OG 2.98Å; S254-T256 PolarHBondContact OG-N 3.4Å; S254-T256 PolarHBondContact OG-O 3.43Å
255	A	75.5	Confident	81.6	Confident	13 Å²	13	50.9 Å²	50.9	11%	0.107	24%	0.236	C	C	.	.	S	Bend	trans	-108.6	-6.8	163.6	0	0	0	0	0	113	A105 T107	A105-A255 WeakPolarHBondContact O-CA 3.38Å; T107-A255 HydrophobicContact CG2-CB 3.76Å
256	T	69.6	Low	80.9	Confident	1 Å²	1	58.8 Å²	58.8	1%	0.006	26%	0.262	C	S	.	.	S	Bend	trans	-142.3	137.1	172.8	72.2	0	0	0	0	112.6	D226 S254 L261	D226-T256 PolarHBondContact OD2-OG1 2.95Å; S254-T256 PolarHBondContact OG-N 3.4Å; S254-T256 PolarHBondContact OG-O 3.43Å; T256-L261 WeakPolarHBondContact O-CD2 3.36Å
257	Q	68.6	Low	80.3	Confident	110 Å²	110	54.8 Å²	54.8	51%	0.514	26%	0.261	S	S	.	.			trans	-75.8	132	164.8	-165.4	-178.3	25.9	0	0	110.7	E104 E262	E104-Q257 WeakPolarHBondContact OE1-CB 3.22Å; E104-Q257 PolarHBondContact OE1-N 3Å; Q257-E262 PolarHBondContact NE2-OE1 3.14Å
258	T	69.2	Low	79.5	Confident	9 Å²	9	47.5 Å²	47.5	6%	0.055	23%	0.23	C	C	.	.			trans	-135.4	158.2	173.9	90.8	0	0	0	0	110.5	D226 E260 L261 E262	D226-T258 HydrophobicContact CB-CG2 4.24Å; T258-E260 VanDerWaalsContact C-N 3.26Å; T258-E260 PolarHBondContact O-N 3.46Å; T258-E260 PolarHBondContact OG1-N 2.99Å; T258-E260 PolarHBondContact OG1-OE2 2.86Å; T258-L261 WeakPolarHBondContact O-CB 3.32Å; T258-L261 PolarHBondContact O-N 3.28Å; T258-L261 WeakPolarHBondContact OG1-CB 3.2Å; T258-L261 PolarHBondContact OG1-N 3.14Å; T258-E262 PolarHBondContact O-N 3.38Å
259	Q	72.6	Confident	79	Confident	168 Å²	168	46.4 Å²	46.4	79%	0.785	23%	0.227	S	C	*	.	H	α-helix	trans	-67.4	-27	176.7	-69.3	-175.8	-7.2	0	0	112.9	K263	Q259-K263 WeakPolarHBondContact O-CG 3.36Å; Q259-K263 PolarHBondContact O-N 3.29Å
260	E	72.7	Confident	78.5	Confident	97 Å²	97	51.3 Å²	51.3	45%	0.453	25%	0.245	S	C	.	.	H	α-helix	trans	-71.3	-39.9	172.6	-58	126.7	159.8	0	0	110.3	L229 T258 E262 K263 L264 R402	L229-E260 HydrophobicContact CD1-CB 3.9Å; T258-E260 VanDerWaalsContact C-N 3.26Å; T258-E260 PolarHBondContact O-N 3.46Å; T258-E260 PolarHBondContact OG1-N 2.99Å; T258-E260 PolarHBondContact OG1-OE2 2.86Å; E260-E262 VanDerWaalsContact C-N 3.34Å; E260-E262 PolarHBondContact O-N 2.73Å; E260-K263 WeakPolarHBondContact O-CB 3.39Å; E260-K263 PolarHBondContact O-N 3.21Å; E260-K263 VanDerWaalsContact O-N 3.15Å; E260-L264 PolarHBondContact O-N 3.11Å; E260-R402 IonicContact OE2-NH1 3.47Å; E260-R402 PolarHBondContact OE2-NH1 3.41Å; E260-R402 IonicContact OE2-NH2 2.66Å
261	L	77.3	Confident	77.8	Confident	10 Å²	10	58.7 Å²	58.7	5%	0.052	29%	0.285	C	S	.	.	H	α-helix	trans	-64	-38.2	174.5	-164.5	67	0	0	0	111.7	A225 L229 L252 T256 T258 K263 L264 V265	A225-L261 HydrophobicContact CB-CD1 3.69Å; L229-L261 HydrophobicContact CD1-CB 4.43Å; L229-L261 HydrophobicContact CD1-CD1 4.21Å; L252-L261 HydrophobicContact CD1-CD1 3.97Å; L252-L261 HydrophobicContact CD2-CD1 4.07Å; L252-L261 HydrophobicContact CD2-CD2 4.21Å; L252-L261 HydrophobicContact CD2-CG 4.2Å; L252-L261 HydrophobicContact CG-CD1 4.43Å; T256-L261 WeakPolarHBondContact O-CD2 3.36Å; T258-L261 WeakPolarHBondContact O-CB 3.32Å; T258-L261 PolarHBondContact O-N 3.28Å; T258-L261 WeakPolarHBondContact OG1-CB 3.2Å; T258-L261 PolarHBondContact OG1-N 3.14Å; L261-K263 VanDerWaalsContact C-N 3.31Å; L261-K263 PolarHBondContact O-N 2.78Å; L261-L264 HydrophobicContact CD1-CD2 4.31Å; L261-L264 PolarHBondContact O-N 2.7Å; L261-V265 WeakPolarHBondContact O-CB 3.16Å; L261-V265 VanDerWaalsContact O-CG2 3.27Å; L261-V265 WeakPolarHBondContact O-CG2 3.11Å; L261-V265 PolarHBondContact O-N 2.96Å
262	E	77.9	Confident	77.5	Confident	35 Å²	35	60.1 Å²	60.1	16%	0.164	29%	0.294	C	S	.	.	H	α-helix	trans	-59.6	-38.1	171.7	-76.5	-68.6	150.3	0	0	112.8	Q257 T258 E260 R266 R274	Q257-E262 PolarHBondContact NE2-OE1 3.14Å; T258-E262 PolarHBondContact O-N 3.38Å; E260-E262 VanDerWaalsContact C-N 3.34Å; E260-E262 PolarHBondContact O-N 2.73Å; E262-R266 VanDerWaalsContact O-CG 3.27Å; E262-R266 WeakPolarHBondContact O-CG 3.09Å; E262-R266 PolarHBondContact O-N 2.72Å; E262-R266 VanDerWaalsContact O-N 3.1Å; E262-R274 VanDerWaalsContact CD-NH1 3.31Å; E262-R274 IonicContact OE1-CZ 3.83Å; E262-R274 IonicContact OE1-NH1 3.39Å; E262-R274 PolarHBondContact OE1-NH1 3.48Å; E262-R274 IonicContact OE1-NH2 3.16Å; E262-R274 IonicContact OE2-CZ 3.98Å; E262-R274 IonicContact OE2-NH1 3.57Å; E262-R274 PolarHBondContact OE2-NH1 3.41Å; E262-R274 VanDerWaalsContact OE2-NH1 3.14Å; E262-R274 IonicContact OE2-NH2 3.63Å; E262-R274 PolarHBondContact OE2-NH2 3.38Å
263	K	77.2	Confident	77.3	Confident	152 Å²	152	61.9 Å²	61.9	66%	0.661	31%	0.305	S	S	*	.	H	α-helix	trans	-66.9	-45.9	173.4	-67.5	173.5	-179.1	179.9	0	111	Q259 E260 L261 V265 R266 A267	Q259-K263 WeakPolarHBondContact O-CG 3.36Å; Q259-K263 PolarHBondContact O-N 3.29Å; E260-K263 WeakPolarHBondContact O-CB 3.39Å; E260-K263 PolarHBondContact O-N 3.21Å; E260-K263 VanDerWaalsContact O-N 3.15Å; L261-K263 VanDerWaalsContact C-N 3.31Å; L261-K263 PolarHBondContact O-N 2.78Å; K263-V265 VanDerWaalsContact C-N 3.31Å; K263-V265 PolarHBondContact O-N 3.11Å; K263-R266 PolarHBondContact O-N 3.02Å; K263-A267 WeakPolarHBondContact O-CB 3.15Å; K263-A267 PolarHBondContact O-N 2.96Å
264	L	75	Confident	77.1	Confident	10 Å²	10	68 Å²	68	5%	0.052	33%	0.328	C	S	.	.	H	α-helix	trans	-60.8	-39.4	176.7	-174.4	66.5	0	0	0	111.8	L222 L229 L237 L252 E260 L261 A267 G268	L222-L264 HydrophobicContact CD1-CD2 4.25Å; L229-L264 HydrophobicContact CD1-CB 4.16Å; L229-L264 HydrophobicContact CD1-CD2 4.05Å; L229-L264 HydrophobicContact CD2-CD2 4.27Å; L229-L264 HydrophobicContact CG-CD2 4.24Å; L237-L264 HydrophobicContact CD1-CD2 4.46Å; L252-L264 HydrophobicContact CD1-CD2 4.18Å; L252-L264 HydrophobicContact CD1-CG 4.42Å; E260-L264 PolarHBondContact O-N 3.11Å; L261-L264 HydrophobicContact CD1-CD2 4.31Å; L261-L264 PolarHBondContact O-N 2.7Å; L264-A267 PolarHBondContact O-N 2.81Å; L264-G268 WeakPolarHBondContact O-CA 3.38Å; L264-G268 PolarHBondContact O-N 3.01Å
265	V	78.4	Confident	77.1	Confident	6 Å²	6	68.6 Å²	68.6	4%	0.036	33%	0.331	C	S	.	.	H	α-helix	trans	-60.9	-46.3	174	167.9	0	0	0	0	111.1	A102 L252 L261 K263 A267 L269 P272	A102-V265 HydrophobicContact CB-CG2 4.38Å; L252-V265 HydrophobicContact CD1-CG2 3.79Å; L252-V265 HydrophobicContact CD2-CG2 4.05Å; L252-V265 HydrophobicContact CG-CG2 4.48Å; L261-V265 WeakPolarHBondContact O-CB 3.16Å; L261-V265 VanDerWaalsContact O-CG2 3.27Å; L261-V265 WeakPolarHBondContact O-CG2 3.11Å; L261-V265 PolarHBondContact O-N 2.96Å; K263-V265 VanDerWaalsContact C-N 3.31Å; K263-V265 PolarHBondContact O-N 3.11Å; V265-A267 PolarHBondContact O-N 3.11Å; V265-L269 WeakPolarHBondContact O-CB 3.48Å; V265-L269 PolarHBondContact O-N 2.86Å; V265-L269 VanDerWaalsContact O-N 3.16Å; V265-P272 HydrophobicContact CG1-CG 3.78Å
266	R	75.2	Confident	77.5	Confident	198 Å²	198	71.8 Å²	71.8	75%	0.747	35%	0.349	S	S	*	.	H	α-helix	trans	-68.5	-30.4	179.3	-69.2	170.2	-170.1	-150.1	0.7	113.8	E262 K263	E262-R266 VanDerWaalsContact O-CG 3.27Å; E262-R266 WeakPolarHBondContact O-CG 3.09Å; E262-R266 PolarHBondContact O-N 2.72Å; E262-R266 VanDerWaalsContact O-N 3.1Å; K263-R266 PolarHBondContact O-N 3.02Å
267	A	71.8	Confident	77.7	Confident	89 Å²	89	73.4 Å²	73.4	74%	0.736	36%	0.359	S	S	*	.	H	α-helix	trans	-87.1	-31.6	179.8	0	0	0	0	0	113.4	K263 L264 V265	K263-A267 WeakPolarHBondContact O-CB 3.15Å; K263-A267 PolarHBondContact O-N 2.96Å; L264-A267 PolarHBondContact O-N 2.81Å; V265-A267 PolarHBondContact O-N 3.11Å
268	G	72.4	Confident	77.5	Confident	11 Å²	11	75.3 Å²	75.3	11%	0.113	37%	0.366	C	S	.	.	H	α-helix	trans	-101.1	-24.3	-169.9	0	0	0	0	0	116.2	R248 L264	R248-G268 PolarHBondContact NH2-O 3.41Å; L264-G268 WeakPolarHBondContact O-CA 3.38Å; L264-G268 PolarHBondContact O-N 3.01Å
269	L	79.8	Confident	76.8	Confident	13 Å²	13	78.9 Å²	78.9	7%	0.068	38%	0.382	C	S	.	.			trans	-119.8	149.2	-171.2	-70.8	66	0	0	0	112.1	D100 A102 T250 L252 V265 P272	D100-L269 HydrophobicContact CB-CB 4.17Å; D100-L269 HydrophobicContact CB-CD2 4.37Å; D100-L269 HydrophobicContact CB-CG 4.36Å; D100-L269 WeakPolarHBondContact OD2-CA 3.48Å; D100-L269 WeakPolarHBondContact OD2-CB 3.45Å; A102-L269 HydrophobicContact CB-CD2 4.34Å; T250-L269 HydrophobicContact CG2-CD1 3.6Å; T250-L269 HydrophobicContact CG2-CG 3.74Å; L252-L269 HydrophobicContact CB-CD1 4.34Å; L252-L269 HydrophobicContact CB-CD2 4.06Å; L252-L269 HydrophobicContact CD1-CD1 4.35Å; V265-L269 WeakPolarHBondContact O-CB 3.48Å; V265-L269 PolarHBondContact O-N 2.86Å; V265-L269 VanDerWaalsContact O-N 3.16Å; L269-P272 HydrophobicContact CB-CB 3.88Å; L269-P272 HydrophobicContact CB-CG 3.91Å; L269-P272 HydrophobicContact CD2-CB 3.65Å; L269-P272 HydrophobicContact CD2-CG 4.28Å; L269-P272 HydrophobicContact CG-CB 4.4Å
270	R	79.9	Confident	75.2	Confident	146 Å²	146	78.5 Å²	78.5	55%	0.551	38%	0.377	S	S	*	.	S	Bend	trans	-106.7	111.7	-179.7	-69.7	175.3	166	-162	-6.7	111.1	D100 K246	D100-R270 PolarHBondContact OD2-N 3.24Å; K246-R270 PolarHBondContact O-NE 3.43Å; K246-R270 PolarHBondContact O-NH2 3.18Å
271	N	80.2	Confident	73.8	Confident	157 Å²	157	77.6 Å²	77.6	84%	0.84	39%	0.394	S	S	*	.	S	Bend	trans	45.1	53.8	-177.8	-166.9	24.3	0	0	0	114
272	P	86.3	Confident	71.8	Confident	30 Å²	30	80.4 Å²	80.4	20%	0.195	41%	0.407	C	S	.	.	P	Polyproline II helix	trans	-71	134.8	-169.1	28	-35.1	0	0	0	113.4	D100 V265 L269 R274	D100-P272 HydrophobicContact CB-CB 4.08Å; D100-P272 CarbonylContact O-C 3.49Å; D100-P272 WeakPolarHBondContact O-CA 3.37Å; V265-P272 HydrophobicContact CG1-CG 3.78Å; L269-P272 HydrophobicContact CB-CB 3.88Å; L269-P272 HydrophobicContact CB-CG 3.91Å; L269-P272 HydrophobicContact CD2-CB 3.65Å; L269-P272 HydrophobicContact CD2-CG 4.28Å; L269-P272 HydrophobicContact CG-CB 4.4Å; P272-R274 PolarHBondContact O-N 3.16Å
273	V	87.8	Confident	69.6	Low	43 Å²	43	82.6 Å²	82.6	26%	0.261	43%	0.431	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.2	124.9	168.8	-172.6	0	0	0	0	109	L94 K99 D100 V101 A102 I275	L94-V273 HydrophobicContact CD1-CB 4.44Å; L94-V273 HydrophobicContact CD1-CG1 3.8Å; K99-V273 HydrophobicContact CB-CG2 4.18Å; K99-V273 HydrophobicContact CD-CG2 3.65Å; D100-V273 PolarHBondContact O-N 3.1Å; V101-V273 WeakPolarHBondContact CA-O 3.31Å; A102-V273 PolarHBondContact N-O 3.49Å; V273-I275 HydrophobicContact CG1-CG1 4.35Å
274	R	86.9	Confident	67.6	Low	127 Å²	127	80.7 Å²	80.7	48%	0.479	44%	0.444	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.5	123	179.8	-65.6	171.8	175.5	-120	-7.2	109.6	A102 E262 P272	A102-R274 WeakPolarHBondContact O-CA 3.49Å; E262-R274 VanDerWaalsContact CD-NH1 3.31Å; E262-R274 IonicContact OE1-CZ 3.83Å; E262-R274 IonicContact OE1-NH1 3.39Å; E262-R274 PolarHBondContact OE1-NH1 3.48Å; E262-R274 IonicContact OE1-NH2 3.16Å; E262-R274 IonicContact OE2-CZ 3.98Å; E262-R274 IonicContact OE2-NH1 3.57Å; E262-R274 PolarHBondContact OE2-NH1 3.41Å; E262-R274 VanDerWaalsContact OE2-NH1 3.14Å; E262-R274 IonicContact OE2-NH2 3.63Å; E262-R274 PolarHBondContact OE2-NH2 3.38Å; P272-R274 PolarHBondContact O-N 3.16Å
275	I	85.4	Confident	65.8	Low	16 Å²	16	85.9 Å²	85.9	8%	0.082	48%	0.481	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121	100.5	-177.4	-53.3	176.3	0	0	0	107.9	A90 C91 L94 V101 A102 A103 E104 V273 V277	A90-I275 HydrophobicContact CB-CG2 3.74Å; C91-I275 HydrophobicContact CB-CD1 4.27Å; L94-I275 HydrophobicContact CD1-CD1 3.6Å; L94-I275 HydrophobicContact CD1-CG1 4.13Å; V101-I275 HydrophobicContact CG1-CD1 3.59Å; V101-I275 HydrophobicContact CG1-CG1 4.28Å; A102-I275 PolarHBondContact O-N 2.77Å; A103-I275 WeakPolarHBondContact CA-O 3.49Å; E104-I275 PolarHBondContact N-O 2.97Å; V273-I275 HydrophobicContact CG1-CG1 4.35Å; I275-V277 HydrophobicContact CG2-CG2 4.01Å
276	T	83	Confident	64	Low	79 Å²	79	88 Å²	88	49%	0.485	50%	0.499	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	101.9	175	-59.1	0	0	0	0	109.1	K278	T276-K278 HydrophobicContact CG2-CG 4.5Å
277	V	74	Confident	62.9	Low	35 Å²	35	81.5 Å²	81.5	21%	0.212	48%	0.481	C	S	.	.			trans	-83.3	125.3	-179.6	179.5	0	0	0	0	110	P86 V87 E104 A105 I275	P86-V277 HydrophobicContact CB-CG1 3.83Å; V87-V277 HydrophobicContact CB-CG2 3.87Å; V87-V277 HydrophobicContact CG2-CG2 4.13Å; E104-V277 PolarHBondContact O-N 3.31Å; A105-V277 HydrophobicContact CB-CB 4.08Å; A105-V277 HydrophobicContact CB-CG2 4.47Å; I275-V277 HydrophobicContact CG2-CG2 4.01Å
278	K	65	Low	62.2	Low	151 Å²	151	80.6 Å²	80.6	66%	0.657	46%	0.462	S	S	*	.			trans	-117.3	131.1	176.7	-60.2	173.3	-174.1	170.2	0	108.5	T276 K280	T276-K278 HydrophobicContact CG2-CG 4.5Å; K278-K280 PolarHBondContact O-N 3.03Å
279	E	53.3	Low	61.7	Low	83 Å²	83	83.1 Å²	83.1	39%	0.388	47%	0.47	S	S	.	.			trans	-64	129.6	173	-65.9	-179.3	161.6	0	0	109.3	A292	E279-A292 WeakPolarHBondContact OE2-CB 3.48Å; E279-A292 PolarHBondContact OE2-N 3.47Å
280	K	40.4	Very low	60.9	Low	160 Å²	160	82.7 Å²	82.7	70%	0.696	47%	0.468	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.4	143.2	173.7	-68.6	174.6	-177.1	164.6	0	108.8	N55 K278	N55-K280 PolarHBondContact OD1-O 3.11Å; K278-K280 PolarHBondContact O-N 3.03Å
281	G	42.1	Very low	60.2	Low	78 Å²	78	76.1 Å²	76.1	80%	0.804	44%	0.444	S	S	*	.	T	Hydrogen-bonded Turn	trans	119.7	-8.4	173.8	0	0	0	0	0	116.7
282	Q	35.6	Very low	59.5	Low	70 Å²	70	71.5 Å²	71.5	33%	0.327	43%	0.427	S	S	.	.	S	Bend	trans	-96	138.8	170.3	-59.4	-163.2	2.8	0	0	111.3	A286 Q288	Q282-A286 PolarHBondContact OE1-O 3.18Å; Q282-Q288 VanDerWaalsContact OE1-CD 3.3Å
283	A	32.8	Very low	59.1	Low	80 Å²	80	73.8 Å²	73.8	66%	0.661	43%	0.432	S	S	*	.			trans	-61.7	143.2	178.5	0	0	0	0	0	111.2	S285 A286	A283-S285 PolarHBondContact O-N 3.12Å; A283-A286 PolarHBondContact O-N 3.37Å
284	A	34.9	Very low	58.9	Low	112 Å²	112	72.4 Å²	72.4	93%	0.926	42%	0.424	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.3	-12	-166.4	0	0	0	0	0	116.6
285	S	36.3	Very low	59	Low	120 Å²	120	68.4 Å²	68.4	84%	0.839	42%	0.415	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.6	-33.3	173.6	-176.7	0	0	0	0	113.6	A283	A283-S285 PolarHBondContact O-N 3.12Å
286	A	41.6	Very low	59.2	Low	51 Å²	51	68.1 Å²	68.1	42%	0.421	41%	0.413	S	S	.	.			trans	-107.6	99.7	-170.4	0	0	0	0	0	112.1	Q282 A283 Q288	Q282-A286 PolarHBondContact OE1-O 3.18Å; A283-A286 PolarHBondContact O-N 3.37Å; A286-Q288 PolarHBondContact O-N 3.21Å
287	T	51.3	Low	59.8	Low	60 Å²	60	67 Å²	67	37%	0.368	40%	0.401	S	S	.	.			trans	-96.5	72	179.5	6.3	0	0	0	0	111.3	K440	T287-K440 WeakPolarHBondContact O-CB 3.44Å; T287-K440 WeakPolarHBondContact O-CD 3.1Å; T287-K440 PolarHBondContact OG1-NZ 2.94Å
288	Q	56.9	Low	60.8	Low	70 Å²	70	66.5 Å²	66.5	33%	0.327	40%	0.395	S	S	.	.			trans	-64.7	143.5	-178.5	-65	-177.4	-1.8	0	0	112.6	Q282 A286 K440	Q282-Q288 VanDerWaalsContact OE1-CD 3.3Å; A286-Q288 PolarHBondContact O-N 3.21Å; Q288-K440 WeakPolarHBondContact CA-O 3.36Å; Q288-K440 WeakPolarHBondContact CG-O 3.38Å
289	K	62.2	Low	62.1	Low	65 Å²	65	59.7 Å²	59.7	28%	0.283	37%	0.366	S	S	.	.	S	Bend	trans	-93.9	-0.2	174.6	-64.6	-173.6	-178.9	179.2	0	113.7	V405	K289-V405 HydrophobicContact CB-CG1 3.97Å; K289-V405 WeakPolarHBondContact O-CG1 3.5Å
290	T	64.1	Low	63.9	Low	3 Å²	3	58 Å²	58	2%	0.018	36%	0.36	C	S	.	.	S	Bend	trans	-104.4	148.8	-177.3	43.3	0	0	0	0	111.3	A292 L294 V405	T290-A292 PolarHBondContact O-N 3.33Å; T290-L294 HydrophobicContact CG2-CD2 3.99Å; T290-V405 HydrophobicContact CG2-CG1 4.21Å
291	P	64.9	Low	66.3	Low	8 Å²	8	50.9 Å²	50.9	5%	0.052	33%	0.33	C	S	.	.			trans	-57	136.4	175.6	-21.8	32.5	0	0	0	111.8	R293 L294 A412	P291-R293 PolarHBondContact O-N 3.22Å; P291-L294 WeakPolarHBondContact O-CB 3.38Å; P291-L294 PolarHBondContact O-N 3.38Å; P291-A412 HydrophobicContact CB-CB 4.34Å
292	A	65.4	Low	68.5	Low	60 Å²	60	54.7 Å²	54.7	50%	0.496	32%	0.32	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.6	-17.9	-172.9	0	0	0	0	0	115.4	E279 T290	E279-A292 WeakPolarHBondContact OE2-CB 3.48Å; E279-A292 PolarHBondContact OE2-N 3.47Å; T290-A292 PolarHBondContact O-N 3.33Å
293	R	77.4	Confident	70.9	Confident	78 Å²	78	51.9 Å²	51.9	29%	0.294	31%	0.309	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.5	7.6	177.2	-57	-178.4	88.9	146.2	4.5	113.8	P291 G415 H417 G418	P291-R293 PolarHBondContact O-N 3.22Å; R293-G415 WeakPolarHBondContact CD-O 3.28Å; R293-G415 PolarHBondContact NE-O 2.96Å; R293-G415 VanDerWaalsContact NE-O 3.14Å; R293-G415 PolarHBondContact NH1-O 3.33Å; R293-H417 PolarHBondContact NE-NE2 3.12Å; R293-H417 PolarHBondContact NH2-NE2 2.91Å; R293-G418 PolarHBondContact O-N 3.49Å
294	L	83.7	Confident	73.5	Confident	15 Å²	15	50.1 Å²	50.1	8%	0.079	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.2	119.4	176.8	-179.2	62.4	0	0	0	111.6	T290 P291 N296 C408 T411 A412 G418 A420	T290-L294 HydrophobicContact CG2-CD2 3.99Å; P291-L294 WeakPolarHBondContact O-CB 3.38Å; P291-L294 PolarHBondContact O-N 3.38Å; L294-N296 WeakPolarHBondContact CD2-OD1 3.33Å; L294-C408 HydrophobicContact CD2-CB 3.79Å; L294-C408 VanDerWaalsContact CD2-SG 3.6Å; L294-T411 HydrophobicContact CD1-CG2 3.55Å; L294-A412 HydrophobicContact CB-CB 3.75Å; L294-A412 HydrophobicContact CD1-CB 4.13Å; L294-G418 WeakPolarHBondContact CA-O 3.41Å; L294-A420 HydrophobicContact CD1-CB 4.22Å
295	S	88.1	Confident	76	Confident	42 Å²	42	47.8 Å²	47.8	29%	0.294	26%	0.259	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.9	109.9	169.1	-59.2	0	0	0	0	110.2	Y297 G418 N419 A420	S295-Y297 VanDerWaalsContact CB-CE2 3.47Å; S295-G418 PolarHBondContact N-O 2.85Å; S295-N419 CarbonylContact O-C 3.6Å; S295-N419 WeakPolarHBondContact O-CA 3.38Å; S295-A420 PolarHBondContact O-N 3.48Å
296	N	90.7	Very high	78.6	Confident	10 Å²	10	42.2 Å²	42.2	5%	0.053	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92	124.6	176.5	-66.9	-64.3	0	0	0	110.8	L294 L443 Q444	L294-N296 WeakPolarHBondContact CD2-OD1 3.33Å; N296-L443 HydrophobicContact CB-CG 4.23Å; N296-L443 WeakPolarHBondContact O-CA 3.46Å; N296-Q444 PolarHBondContact O-N 3.1Å
297	Y	94.4	Very high	81.1	Confident	55 Å²	55	39.8 Å²	39.8	22%	0.216	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	153.5	-179.2	-60.3	-74.3	0	0	0	111.8	S295 W391 N419 A420 L421 V422 Q444	S295-Y297 VanDerWaalsContact CB-CE2 3.47Å; Y297-W391 HydrophobicContact CD2-CH2 4.28Å; Y297-W391 HydrophobicContact CD2-CZ3 4.06Å; Y297-W391 HydrophobicContact CE2-CH2 4.29Å; Y297-W391 HydrophobicContact CE2-CZ3 4.46Å; Y297-N419 HydrophobicContact CD2-CB 4.49Å; Y297-N419 HydrophobicContact CE2-CB 4.22Å; Y297-A420 WeakPolarHBondContact CA-O 3.48Å; Y297-A420 WeakPolarHBondContact CB-O 3.27Å; Y297-A420 PolarHBondContact N-O 3.37Å; Y297-L421 WeakPolarHBondContact O-CA 3.46Å; Y297-V422 PolarHBondContact O-N 3.2Å; Y297-Q444 CarbonylContact C-O 3.54Å; Y297-Q444 VanDerWaalsContact CA-O 3.23Å; Y297-Q444 WeakPolarHBondContact CA-O 3.42Å; Y297-Q444 HydrophobicContact CD1-CB 3.89Å; Y297-Q444 HydrophobicContact CE1-CB 4.13Å
298	Y	94.8	Very high	83.1	Confident	26 Å²	26	37.3 Å²	37.3	10%	0.102	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129	152.1	164.8	75.2	-80.7	0	0	0	111.1	I300 V422 L424 E429 V432 L443 Q444 K445 M446	Y298-I300 HydrophobicContact CD2-CG1 4.14Å; Y298-I300 HydrophobicContact CE2-CD1 4.02Å; Y298-I300 HydrophobicContact CE2-CG1 4.13Å; Y298-V422 WeakPolarHBondContact CA-O 3.27Å; Y298-L424 HydrophobicContact CD2-CD1 4.26Å; Y298-E429 HydrophobicContact CE2-CG 4.47Å; Y298-E429 PolarHBondContact OH-OE1 2.95Å; Y298-V432 HydrophobicContact CD1-CG1 4.15Å; Y298-V432 HydrophobicContact CD1-CG2 3.9Å; Y298-V432 HydrophobicContact CD2-CG2 3.75Å; Y298-V432 HydrophobicContact CE1-CG1 3.89Å; Y298-V432 HydrophobicContact CE1-CG2 4.04Å; Y298-V432 HydrophobicContact CE2-CG2 3.91Å; Y298-V432 HydrophobicContact CG-CG2 3.73Å; Y298-L443 HydrophobicContact CD1-CB 3.78Å; Y298-Q444 WeakPolarHBondContact CD1-O 3.38Å; Y298-Q444 PolarHBondContact N-O 3.01Å; Y298-K445 HydrophobicContact CD1-CB 4.44Å; Y298-K445 HydrophobicContact CD2-CG 4.5Å; Y298-K445 HydrophobicContact CE1-CB 3.74Å; Y298-K445 HydrophobicContact CE1-CG 4.19Å; Y298-K445 HydrophobicContact CE2-CB 4.31Å; Y298-K445 HydrophobicContact CE2-CD 4.08Å; Y298-K445 HydrophobicContact CE2-CG 3.84Å; Y298-K445 WeakPolarHBondContact OH-CD 3.47Å; Y298-M446 PolarHBondContact O-N 2.79Å
299	T	93.8	Very high	84.9	Confident	7 Å²	7	35 Å²	35	4%	0.043	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.7	149.1	169.4	-171.7	0	0	0	0	110.1	L421 V422 F423 L424	T299-L421 HydrophobicContact CG2-CD1 4.05Å; T299-L421 HydrophobicContact CG2-CD2 4.46Å; T299-L421 HydrophobicContact CG2-CG 4.43Å; T299-V422 PolarHBondContact N-O 3.01Å; T299-F423 HydrophobicContact CG2-CD1 3.55Å; T299-F423 HydrophobicContact CG2-CE1 3.84Å; T299-F423 HydrophobicContact CG2-CG 4Å; T299-L424 PolarHBondContact O-N 2.93Å
300	I	91.4	Very high	86.4	Confident	49 Å²	49	31.9 Å²	31.9	25%	0.251	16%	0.16	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	126.5	179.1	-64.3	-179.7	0	0	0	108.8	Y298 L424 P426 E429	Y298-I300 HydrophobicContact CD2-CG1 4.14Å; Y298-I300 HydrophobicContact CE2-CD1 4.02Å; Y298-I300 HydrophobicContact CE2-CG1 4.13Å; I300-L424 WeakPolarHBondContact CA-O 3.33Å; I300-P426 HydrophobicContact CG2-CB 4.19Å; I300-P426 HydrophobicContact CG2-CG 3.96Å; I300-E429 HydrophobicContact CD1-CB 3.82Å; I300-E429 HydrophobicContact CD1-CG 3.81Å; I300-E429 VanDerWaalsContact CD1-OE1 3.25Å; I300-E429 WeakPolarHBondContact CD1-OE1 3.46Å; I300-E429 WeakPolarHBondContact CD1-OE2 3.23Å
301	C	89.3	Confident	87.8	Confident	10 Å²	10	31.7 Å²	31.7	7%	0.068	16%	0.159	C	C	.	.			trans	-148.8	150	-177.7	53.1	0	0	0	0	110.6	L424 L425	C301-L424 PolarHBondContact N-O 3.18Å; C301-L425 WeakPolarHBondContact O-CD2 3.3Å
302	R	88.5	Confident	89.2	Confident	157 Å²	157	31.6 Å²	31.6	59%	0.592	16%	0.159	S	C	*	.			trans	-68	157.2	173.3	-62.4	179.3	173.2	-163.3	-1	110.1	E304 D305 K306	R302-E304 HydrophobicContact CB-CG 4.07Å; R302-E304 IonicContact NH1-OE1 2.86Å; R302-E304 PolarHBondContact O-N 3.12Å; R302-D305 PolarHBondContact O-N 3.4Å; R302-D305 VanDerWaalsContact O-N 3.12Å; R302-K306 PolarHBondContact O-N 2.95Å
303	A	86.4	Confident	90.6	Very high	12 Å²	12	28.8 Å²	28.8	10%	0.099	14%	0.135	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.3	-29.3	-175.9	0	0	0	0	0	113.4	L425 L505	A303-L425 HydrophobicContact CB-CD2 3.86Å; A303-L505 HydrophobicContact CB-CB 4.28Å; A303-L505 HydrophobicContact CB-CD1 4.22Å
304	E	86.4	Confident	91.3	Very high	43 Å²	43	25 Å²	25	20%	0.201	12%	0.121	C	C	.	.	T	Hydrogen-bonded Turn	trans	-71.5	-49.3	172.2	58.6	-148.9	176.9	0	0	112.4	R302 K306 S504 N507	R302-E304 HydrophobicContact CB-CG 4.07Å; R302-E304 IonicContact NH1-OE1 2.86Å; R302-E304 PolarHBondContact O-N 3.12Å; E304-K306 VanDerWaalsContact C-N 3.25Å; E304-K306 PolarHBondContact O-N 3.41Å; E304-S504 PolarHBondContact N-O 2.95Å; E304-S504 PolarHBondContact OE1-OG 3.35Å; E304-S504 WeakPolarHBondContact OE2-CB 3.49Å; E304-S504 PolarHBondContact OE2-OG 3.4Å; E304-N507 HydrophobicContact CB-CB 4.23Å
305	D	89.3	Confident	91.8	Very high	63 Å²	63	27.9 Å²	27.9	34%	0.337	13%	0.131	S	C	.	.	H	α-helix	trans	-68.7	-20.4	178.9	-61.7	-48.5	0	0	0	113.9	R302 F307 N308 N309	R302-D305 PolarHBondContact O-N 3.4Å; R302-D305 VanDerWaalsContact O-N 3.12Å; D305-F307 VanDerWaalsContact C-N 3.32Å; D305-F307 PolarHBondContact O-N 3.26Å; D305-N308 PolarHBondContact O-N 2.95Å; D305-N308 VanDerWaalsContact O-N 3.12Å; D305-N309 PolarHBondContact O-N 3.22Å; D305-N309 PolarHBondContact O-ND2 3.47Å
306	K	91.1	Very high	91.9	Very high	2 Å²	2	30.7 Å²	30.7	1%	0.009	14%	0.14	C	C	.	.	H	α-helix	trans	-52.7	-46.6	-173.9	-159.4	179.3	-160.9	-167.8	0	112.1	R302 E304 L310 Y395 D396 F423 L425 Y484	R302-K306 PolarHBondContact O-N 2.95Å; E304-K306 VanDerWaalsContact C-N 3.25Å; E304-K306 PolarHBondContact O-N 3.41Å; K306-L310 PolarHBondContact O-N 2.8Å; K306-L310 VanDerWaalsContact O-N 3.12Å; K306-Y395 HydrophobicContact CB-CE2 4.26Å; K306-Y395 HydrophobicContact CD-CE1 4.09Å; K306-Y395 HydrophobicContact CD-CE2 4.21Å; K306-Y395 WeakPolarHBondContact CE-O 3.48Å; K306-Y395 HydrophobicContact CG-CD2 4.39Å; K306-Y395 HydrophobicContact CG-CE1 4.48Å; K306-Y395 HydrophobicContact CG-CE2 3.7Å; K306-Y395 PolarHBondContact NZ-O 3.43Å; K306-D396 IonicContact NZ-OD1 2.77Å; K306-D396 PolarHBondContact NZ-OD1 2.99Å; K306-D396 VanDerWaalsContact NZ-OD1 3.16Å; K306-F423 WeakPolarHBondContact CE-O 3.35Å; K306-F423 HydrophobicContact CG-CB 4.2Å; K306-F423 PolarHBondContact NZ-O 3.01Å; K306-L425 HydrophobicContact CD-CD2 4.35Å; K306-Y484 PolarHBondContact NZ-OH 3.31Å
307	F	93.8	Very high	91.9	Very high	1 Å²	1	32.1 Å²	32.1	0%	0.004	15%	0.146	C	C	.	.	H	α-helix	trans	-75.2	-35.1	179.4	-171.9	-114.2	0	0	0	113.1	D305 L310 V311 F335 A338 L339 L342 Y395 V455 L456 V459	D305-F307 VanDerWaalsContact C-N 3.32Å; D305-F307 PolarHBondContact O-N 3.26Å; F307-L310 HydrophobicContact CD2-CD2 4.22Å; F307-L310 HydrophobicContact CE2-CD2 4.26Å; F307-L310 PolarHBondContact O-N 3.16Å; F307-V311 HydrophobicContact CD1-CG2 4.37Å; F307-V311 HydrophobicContact CD2-CG2 4.45Å; F307-V311 HydrophobicContact CE1-CG2 3.88Å; F307-V311 HydrophobicContact CE2-CG2 3.96Å; F307-V311 HydrophobicContact CZ-CG2 3.65Å; F307-V311 WeakPolarHBondContact O-CG2 3.31Å; F307-V311 PolarHBondContact O-N 2.83Å; F307-F335 AromaticContact CD2-CD1 3.53Å; F307-F335 HydrophobicContact CD2-CD1 3.53Å; F307-F335 AromaticContact CD2-CE1 3.76Å; F307-F335 HydrophobicContact CD2-CE1 3.76Å; F307-F335 HydrophobicContact CD2-CG 4.49Å; F307-F335 HydrophobicContact CE2-CB 4.36Å; F307-F335 AromaticContact CE2-CD1 3.45Å; F307-F335 HydrophobicContact CE2-CD1 3.45Å; F307-F335 VanDerWaalsContact CE2-CD1 3.45Å; F307-F335 HydrophobicContact CE2-CE1 4.14Å; F307-F335 HydrophobicContact CE2-CG 4.27Å; F307-F335 HydrophobicContact CG-CD1 4.24Å; F307-F335 HydrophobicContact CG-CE1 4.09Å; F307-F335 HydrophobicContact CZ-CD1 4.08Å; F307-A338 HydrophobicContact CE1-CB 4.24Å; F307-A338 HydrophobicContact CZ-CB 3.74Å; F307-L339 HydrophobicContact CE2-CD2 3.9Å; F307-L339 HydrophobicContact CE2-CG 4.3Å; F307-L339 HydrophobicContact CZ-CD2 3.96Å; F307-L339 HydrophobicContact CZ-CG 4.42Å; F307-L342 HydrophobicContact CE1-CD1 3.58Å; F307-L342 HydrophobicContact CZ-CD1 3.86Å; F307-Y395 HydrophobicContact CB-CE2 4.48Å; F307-Y395 HydrophobicContact CD2-CE2 4.42Å; F307-Y395 PolarHBondContact N-OH 2.8Å; F307-V455 HydrophobicContact CD1-CG2 3.85Å; F307-V455 HydrophobicContact CE1-CG2 3.85Å; F307-L456 HydrophobicContact CB-CD2 4.48Å; F307-L456 HydrophobicContact CD1-CD2 4.23Å; F307-V459 HydrophobicContact CE1-CG2 3.96Å
308	N	93.4	Very high	91.7	Very high	8 Å²	8	33.1 Å²	33.1	4%	0.043	15%	0.151	C	C	.	.	H	α-helix	trans	-63.2	-44.2	175.7	-70.5	-20.1	0	0	0	111	D305 V311 A312 V452 D454 V455	D305-N308 PolarHBondContact O-N 2.95Å; D305-N308 VanDerWaalsContact O-N 3.12Å; N308-V311 PolarHBondContact O-N 3.47Å; N308-A312 PolarHBondContact O-N 3.19Å; N308-V452 HydrophobicContact CB-CG1 3.68Å; N308-D454 PolarHBondContact ND2-OD1 3.44Å; N308-D454 PolarHBondContact OD1-OD1 3.15Å; N308-V455 WeakPolarHBondContact OD1-CG2 3.43Å; N308-V455 PolarHBondContact OD1-N 2.79Å
309	N	93.1	Very high	91.4	Very high	20 Å²	20	39.9 Å²	39.9	11%	0.107	18%	0.183	C	C	.	.	H	α-helix	trans	-63	-44.6	174.4	-80.4	-84.8	0	0	0	112.4	D305 V311 A312 F313 F423 I449	D305-N309 PolarHBondContact O-N 3.22Å; D305-N309 PolarHBondContact O-ND2 3.47Å; N309-V311 VanDerWaalsContact C-N 3.33Å; N309-V311 PolarHBondContact O-N 2.97Å; N309-A312 PolarHBondContact O-N 2.84Å; N309-F313 PolarHBondContact O-N 2.94Å; N309-F423 HydrophobicContact CB-CE1 4.03Å; N309-I449 HydrophobicContact CB-CD1 4.24Å; N309-I449 VanDerWaalsContact O-CD1 3.3Å; N309-I449 WeakPolarHBondContact O-CD1 3.09Å
310	L	94.4	Very high	91.4	Very high	0 Å²	0	42.2 Å²	42.2	0%	0	19%	0.194	C	C	.	.	H	α-helix	trans	-55.6	-49.2	173.6	177.4	69.3	0	0	0	110.7	K306 F307 A312 F313 L314 V324 F326 L339 L393 Y395 F423	K306-L310 PolarHBondContact O-N 2.8Å; K306-L310 VanDerWaalsContact O-N 3.12Å; F307-L310 HydrophobicContact CD2-CD2 4.22Å; F307-L310 HydrophobicContact CE2-CD2 4.26Å; F307-L310 PolarHBondContact O-N 3.16Å; L310-A312 VanDerWaalsContact C-N 3.31Å; L310-A312 PolarHBondContact O-N 2.85Å; L310-F313 WeakPolarHBondContact O-CB 3.43Å; L310-F313 PolarHBondContact O-N 3.39Å; L310-L314 HydrophobicContact CD1-CD1 4.1Å; L310-L314 HydrophobicContact CD1-CD2 4.4Å; L310-L314 HydrophobicContact CD1-CG 4.1Å; L310-L314 HydrophobicContact CD2-CD1 4.29Å; L310-L314 HydrophobicContact CG-CD1 3.83Å; L310-L314 HydrophobicContact CG-CG 4.22Å; L310-L314 VanDerWaalsContact O-CG 3.24Å; L310-L314 WeakPolarHBondContact O-CG 3.13Å; L310-L314 PolarHBondContact O-N 2.87Å; L310-V324 HydrophobicContact CD1-CG1 4.05Å; L310-V324 HydrophobicContact CD2-CG1 4.26Å; L310-F326 HydrophobicContact CD2-CZ 3.91Å; L310-L339 HydrophobicContact CD2-CD1 4.45Å; L310-L393 HydrophobicContact CD1-CD1 3.82Å; L310-Y395 HydrophobicContact CB-CD2 4.03Å; L310-Y395 HydrophobicContact CB-CE2 4.11Å; L310-Y395 HydrophobicContact CD1-CD2 4.49Å; L310-Y395 HydrophobicContact CD2-CD2 3.64Å; L310-Y395 HydrophobicContact CD2-CE2 4.07Å; L310-Y395 HydrophobicContact CD2-CG 4.4Å; L310-Y395 HydrophobicContact CG-CD2 4.24Å; L310-F423 HydrophobicContact CB-CZ 4.39Å; L310-F423 HydrophobicContact CD1-CE2 4.17Å; L310-F423 HydrophobicContact CD1-CZ 4.22Å
311	V	94.3	Very high	91.5	Very high	0 Å²	0	40.1 Å²	40.1	0%	0	18%	0.183	C	C	.	.	H	α-helix	trans	-67.2	-31.9	-178	173.5	0	0	0	0	112.4	F307 N308 N309 R315 L339 L342 V343 V455	F307-V311 HydrophobicContact CD1-CG2 4.37Å; F307-V311 HydrophobicContact CD2-CG2 4.45Å; F307-V311 HydrophobicContact CE1-CG2 3.88Å; F307-V311 HydrophobicContact CE2-CG2 3.96Å; F307-V311 HydrophobicContact CZ-CG2 3.65Å; F307-V311 WeakPolarHBondContact O-CG2 3.31Å; F307-V311 PolarHBondContact O-N 2.83Å; N308-V311 PolarHBondContact O-N 3.47Å; N309-V311 VanDerWaalsContact C-N 3.33Å; N309-V311 PolarHBondContact O-N 2.97Å; V311-R315 VanDerWaalsContact CG1-CZ 3.43Å; V311-R315 WeakPolarHBondContact O-CB 3.35Å; V311-R315 WeakPolarHBondContact O-CD 3.26Å; V311-R315 WeakPolarHBondContact O-CG 3.19Å; V311-R315 PolarHBondContact O-N 2.96Å; V311-L339 HydrophobicContact CG2-CD2 3.58Å; V311-L342 HydrophobicContact CG1-CB 4.19Å; V311-L342 HydrophobicContact CG2-CD1 4.3Å; V311-V343 HydrophobicContact CG1-CG2 4.43Å; V311-V455 HydrophobicContact CB-CG2 4.2Å; V311-V455 HydrophobicContact CG1-CG1 4.09Å; V311-V455 HydrophobicContact CG1-CG2 4.37Å; V311-V455 HydrophobicContact CG2-CG2 4.14Å
312	A	93.6	Very high	91.8	Very high	6 Å²	6	39.6 Å²	39.6	5%	0.05	18%	0.179	C	C	.	.	H	α-helix	trans	-64.4	-47.4	171	0	0	0	0	0	111.6	N308 N309 L310 R315 Q316 I449 V452	N308-A312 PolarHBondContact O-N 3.19Å; N309-A312 PolarHBondContact O-N 2.84Å; L310-A312 VanDerWaalsContact C-N 3.31Å; L310-A312 PolarHBondContact O-N 2.85Å; A312-R315 WeakPolarHBondContact O-CB 3.5Å; A312-R315 PolarHBondContact O-N 2.87Å; A312-R315 VanDerWaalsContact O-N 3.12Å; A312-Q316 PolarHBondContact O-N 2.77Å; A312-I449 HydrophobicContact CB-CG2 3.71Å; A312-V452 HydrophobicContact CB-CB 4.45Å; A312-V452 HydrophobicContact CB-CG2 3.87Å
313	F	94.1	Very high	92.1	Very high	0 Å²	0	32.1 Å²	32.1	0%	0	15%	0.151	C	C	.	.	H	α-helix	trans	-56.2	-54.3	176	-168.6	-79.1	0	0	0	112	N309 L310 R315 Q316 H317 W391 L393 L421 M446 I449	N309-F313 PolarHBondContact O-N 2.94Å; L310-F313 WeakPolarHBondContact O-CB 3.43Å; L310-F313 PolarHBondContact O-N 3.39Å; F313-R315 PolarHBondContact O-N 3.04Å; F313-R315 VanDerWaalsContact O-N 3.09Å; F313-Q316 PolarHBondContact O-N 2.86Å; F313-H317 AromaticContact CD1-CD2 3.88Å; F313-H317 HydrophobicContact CE1-CB 4.18Å; F313-H317 AromaticContact CE1-CD2 3.41Å; F313-H317 VanDerWaalsContact CE1-CD2 3.41Å; F313-H317 WeakPolarHBondContact CE1-CD2 3.37Å; F313-H317 AromaticContact CE1-CG 3.87Å; F313-H317 AromaticContact CE2-CD2 3.84Å; F313-H317 AromaticContact CE2-NE2 3.88Å; F313-H317 AromaticContact CZ-CD2 3.38Å; F313-H317 WeakPolarHBondContact CZ-CD2 3.24Å; F313-H317 AromaticContact CZ-NE2 3.63Å; F313-H317 PolarHBondContact O-N 3.33Å; F313-H317 VanDerWaalsContact O-N 3.12Å; F313-W391 HydrophobicContact CE1-CD2 4.06Å; F313-W391 HydrophobicContact CE1-CE3 4.35Å; F313-W391 HydrophobicContact CE1-CG 4.15Å; F313-W391 HydrophobicContact CE2-CE3 4.33Å; F313-W391 HydrophobicContact CE2-CH2 4.21Å; F313-W391 HydrophobicContact CE2-CZ2 4.44Å; F313-W391 HydrophobicContact CE2-CZ3 4.15Å; F313-W391 AromaticContact CZ-CD2 3.5Å; F313-W391 HydrophobicContact CZ-CD2 3.5Å; F313-W391 VanDerWaalsContact CZ-CD2 3.5Å; F313-W391 AromaticContact CZ-CE2 3.63Å; F313-W391 AromaticContact CZ-CE3 3.58Å; F313-W391 HydrophobicContact CZ-CE3 3.58Å; F313-W391 HydrophobicContact CZ-CG 4.07Å; F313-W391 AromaticContact CZ-CH2 3.96Å; F313-W391 HydrophobicContact CZ-CH2 3.96Å; F313-W391 AromaticContact CZ-CZ2 3.88Å; F313-W391 HydrophobicContact CZ-CZ2 3.88Å; F313-W391 AromaticContact CZ-CZ3 3.81Å; F313-W391 HydrophobicContact CZ-CZ3 3.81Å; F313-L393 HydrophobicContact CD1-CD1 3.53Å; F313-L393 HydrophobicContact CD1-CD2 4Å; F313-L393 HydrophobicContact CD1-CG 4.39Å; F313-L393 HydrophobicContact CE1-CD1 3.87Å; F313-L393 HydrophobicContact CE1-CD2 3.65Å; F313-L393 HydrophobicContact CE1-CG 4.3Å; F313-L393 HydrophobicContact CG-CD1 4.33Å; F313-L393 HydrophobicContact CZ-CD2 3.94Å; F313-L421 HydrophobicContact CD2-CD2 3.95Å; F313-L421 HydrophobicContact CE2-CD2 3.93Å; F313-M446 HydrophobicContact CD2-CE 4.17Å; F313-M446 HydrophobicContact CE2-CE 3.96Å; F313-M446 HydrophobicContact CE2-SD 4.38Å; F313-I449 HydrophobicContact CB-CD1 3.82Å; F313-I449 HydrophobicContact CD2-CD1 4.09Å; F313-I449 HydrophobicContact CG-CD1 4.48Å
314	L	93.8	Very high	92.6	Very high	0 Å²	0	31.6 Å²	31.6	0%	0	15%	0.147	C	C	.	.	H	α-helix	trans	-59.9	-23.7	179.7	-63.3	176.2	0	0	0	112.4	L310 K318 V324 L339 V343 I373 L393	L310-L314 HydrophobicContact CD1-CD1 4.1Å; L310-L314 HydrophobicContact CD1-CD2 4.4Å; L310-L314 HydrophobicContact CD1-CG 4.1Å; L310-L314 HydrophobicContact CD2-CD1 4.29Å; L310-L314 HydrophobicContact CG-CD1 3.83Å; L310-L314 HydrophobicContact CG-CG 4.22Å; L310-L314 VanDerWaalsContact O-CG 3.24Å; L310-L314 WeakPolarHBondContact O-CG 3.13Å; L310-L314 PolarHBondContact O-N 2.87Å; L314-K318 WeakPolarHBondContact O-CG 3.19Å; L314-V324 HydrophobicContact CD2-CG2 4.06Å; L314-L339 HydrophobicContact CD1-CD1 3.84Å; L314-L339 HydrophobicContact CD1-CD2 3.47Å; L314-L339 VanDerWaalsContact CD1-CD2 3.47Å; L314-L339 HydrophobicContact CD1-CG 4.26Å; L314-V343 HydrophobicContact CB-CG1 4.46Å; L314-V343 HydrophobicContact CB-CG2 4.05Å; L314-V343 HydrophobicContact CD1-CG2 4.36Å; L314-I373 HydrophobicContact CB-CD1 4.18Å; L314-I373 HydrophobicContact CD1-CD1 4.39Å; L314-I373 HydrophobicContact CD2-CD1 3.95Å; L314-I373 HydrophobicContact CD2-CG1 4.29Å; L314-I373 HydrophobicContact CD2-CG2 4.31Å; L314-I373 HydrophobicContact CG-CD1 4.39Å; L314-L393 HydrophobicContact CD2-CD1 3.65Å; L314-L393 HydrophobicContact CG-CD1 4.49Å
315	R	92.3	Very high	93	Very high	75 Å²	75	29.5 Å²	29.5	28%	0.283	14%	0.137	S	C	.	.	H	α-helix	trans	-83.9	-23.3	177.1	-79.2	170.5	178.3	166.9	4.1	114.4	V311 A312 F313 K318 L342	V311-R315 VanDerWaalsContact CG1-CZ 3.43Å; V311-R315 WeakPolarHBondContact O-CB 3.35Å; V311-R315 WeakPolarHBondContact O-CD 3.26Å; V311-R315 WeakPolarHBondContact O-CG 3.19Å; V311-R315 PolarHBondContact O-N 2.96Å; A312-R315 WeakPolarHBondContact O-CB 3.5Å; A312-R315 PolarHBondContact O-N 2.87Å; A312-R315 VanDerWaalsContact O-N 3.12Å; F313-R315 PolarHBondContact O-N 3.04Å; F313-R315 VanDerWaalsContact O-N 3.09Å; R315-K318 WeakPolarHBondContact O-CE 3.32Å; R315-K318 WeakPolarHBondContact O-CG 3.38Å; R315-K318 PolarHBondContact O-NZ 3.4Å; R315-L342 PolarHBondContact NE-O 3.13Å; R315-L342 PolarHBondContact NH2-O 2.91Å
316	Q	91.3	Very high	93.3	Very high	101 Å²	101	26.5 Å²	26.5	47%	0.472	12%	0.121	S	C	.	.	H	α-helix	trans	-81.9	-45.7	175	-70.9	169	-5.3	0	0	110	A312 F313 K318 K450	A312-Q316 PolarHBondContact O-N 2.77Å; F313-Q316 PolarHBondContact O-N 2.86Å; Q316-K318 PolarHBondContact O-N 2.68Å; Q316-K450 PolarHBondContact NE2-O 3.01Å
317	H	91.3	Very high	93.3	Very high	39 Å²	39	27.8 Å²	27.8	18%	0.181	13%	0.13	C	C	.	.	S	Bend	trans	-89.3	22.7	-174.4	-68.5	-82.4	0	0	0	115.7	F313 H319 E320 Q322 W391	F313-H317 AromaticContact CD1-CD2 3.88Å; F313-H317 HydrophobicContact CE1-CB 4.18Å; F313-H317 AromaticContact CE1-CD2 3.41Å; F313-H317 VanDerWaalsContact CE1-CD2 3.41Å; F313-H317 WeakPolarHBondContact CE1-CD2 3.37Å; F313-H317 AromaticContact CE1-CG 3.87Å; F313-H317 AromaticContact CE2-CD2 3.84Å; F313-H317 AromaticContact CE2-NE2 3.88Å; F313-H317 AromaticContact CZ-CD2 3.38Å; F313-H317 WeakPolarHBondContact CZ-CD2 3.24Å; F313-H317 AromaticContact CZ-NE2 3.63Å; F313-H317 PolarHBondContact O-N 3.33Å; F313-H317 VanDerWaalsContact O-N 3.12Å; H317-H319 PolarHBondContact O-N 3.23Å; H317-E320 IonicContact CE1-OE1 3.2Å; H317-E320 IonicContact CG-OE1 2.69Å; H317-E320 IonicContact CG-OE2 3.73Å; H317-E320 IonicContact ND1-OE1 2.87Å; H317-E320 PolarHBondContact ND1-OE1 3.48Å; H317-E320 IonicContact ND1-OE2 3.68Å; H317-E320 PolarHBondContact ND1-OE2 3.03Å; H317-E320 WeakPolarHBondContact O-CB 3.26Å; H317-E320 PolarHBondContact O-N 3.08Å; H317-Q322 VanDerWaalsContact CB-NE2 3.29Å; H317-Q322 PolarHBondContact O-NE2 3.23Å; H317-W391 AromaticContact CE1-NE1 3.78Å; H317-W391 AromaticContact ND1-NE1 3.56Å
318	K	89.4	Confident	93.3	Very high	77 Å²	77	28.5 Å²	28.5	34%	0.335	13%	0.134	S	C	.	.	T	Hydrogen-bonded Turn	trans	-53.6	-25.1	-169.3	-69.1	176.3	-174.4	139.8	0	116.7	L314 R315 Q316 E320 V346	L314-K318 WeakPolarHBondContact O-CG 3.19Å; R315-K318 WeakPolarHBondContact O-CE 3.32Å; R315-K318 WeakPolarHBondContact O-CG 3.38Å; R315-K318 PolarHBondContact O-NZ 3.4Å; Q316-K318 PolarHBondContact O-N 2.68Å; K318-E320 VanDerWaalsContact C-N 3.33Å; K318-V346 HydrophobicContact CB-CG2 3.73Å; K318-V346 HydrophobicContact CD-CG2 4.17Å; K318-V346 HydrophobicContact CG-CG2 3.7Å
319	H	89.6	Confident	93.3	Very high	168 Å²	168	29.5 Å²	29.5	78%	0.778	14%	0.142	S	C	*	.	T	Hydrogen-bonded Turn	trans	-89.3	-0.9	-176.8	-61.7	-75.7	0	0	0	113.3	H317 S371	H317-H319 PolarHBondContact O-N 3.23Å; H319-S371 WeakPolarHBondContact O-CB 3.14Å
320	E	92.5	Very high	93.3	Very high	55 Å²	55	29.7 Å²	29.7	26%	0.257	15%	0.146	S	C	.	.	S	Bend	trans	-101.5	166.3	-177.4	-65.8	169.8	-152.1	0	0	111.5	H317 K318 Q322 G372 N390 W391	H317-E320 IonicContact CE1-OE1 3.2Å; H317-E320 IonicContact CG-OE1 2.69Å; H317-E320 IonicContact CG-OE2 3.73Å; H317-E320 IonicContact ND1-OE1 2.87Å; H317-E320 PolarHBondContact ND1-OE1 3.48Å; H317-E320 IonicContact ND1-OE2 3.68Å; H317-E320 PolarHBondContact ND1-OE2 3.03Å; H317-E320 WeakPolarHBondContact O-CB 3.26Å; H317-E320 PolarHBondContact O-N 3.08Å; K318-E320 VanDerWaalsContact C-N 3.33Å; E320-Q322 HydrophobicContact CB-CG 4.43Å; E320-G372 PolarHBondContact O-N 3.44Å; E320-N390 WeakPolarHBondContact CA-OD1 3.24Å; E320-N390 HydrophobicContact CB-CB 3.99Å; E320-N390 VanDerWaalsContact CB-OD1 3.3Å; E320-N390 WeakPolarHBondContact CB-OD1 3.2Å; E320-N390 HydrophobicContact CG-CB 4.3Å; E320-W391 PolarHBondContact OE2-NE1 2.92Å
321	K	94.3	Very high	93.3	Very high	5 Å²	5	29.7 Å²	29.7	2%	0.022	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.8	123.9	177	-165.6	174.8	-175.1	173	0	109.9	F366 R367 L369 G372 P387 D388 V389 N390 W391	K321-F366 VanDerWaalsContact CE-O 3.3Å; K321-F366 WeakPolarHBondContact CE-O 3.38Å; K321-F366 HydrophobicContact CG-CE1 4.37Å; K321-F366 HydrophobicContact CG-CE2 4.43Å; K321-F366 HydrophobicContact CG-CZ 3.84Å; K321-R367 PolarHBondContact NZ-O 2.87Å; K321-L369 WeakPolarHBondContact CD-O 3.49Å; K321-L369 WeakPolarHBondContact CE-O 3.5Å; K321-L369 PolarHBondContact NZ-O 3.38Å; K321-G372 WeakPolarHBondContact CA-O 3.45Å; K321-P387 WeakPolarHBondContact CD-O 3.33Å; K321-P387 WeakPolarHBondContact CE-O 3.45Å; K321-P387 PolarHBondContact NZ-O 3.3Å; K321-D388 WeakPolarHBondContact CB-O 3.2Å; K321-V389 CarbonylContact O-C 3.15Å; K321-N390 PolarHBondContact N-OD1 3.38Å; K321-N390 PolarHBondContact O-N 3.01Å; K321-W391 PolarHBondContact O-N 2.71Å
322	Q	94.5	Very high	93.4	Very high	0 Å²	0	29.7 Å²	29.7	0%	0	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.2	140.3	-162.2	-51.7	177.9	18.9	0	0	112.2	H317 E320 G372 I373 L374 W391	H317-Q322 VanDerWaalsContact CB-NE2 3.29Å; H317-Q322 PolarHBondContact O-NE2 3.23Å; E320-Q322 HydrophobicContact CB-CG 4.43Å; Q322-G372 PolarHBondContact N-O 3.12Å; Q322-I373 HydrophobicContact CB-CG1 4.41Å; Q322-L374 PolarHBondContact O-N 2.84Å; Q322-W391 WeakPolarHBondContact CA-O 3.32Å; Q322-W391 HydrophobicContact CG-CB 4.43Å
323	L	95.1	Very high	93.4	Very high	0 Å²	0	33.1 Å²	33.1	0%	0	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	132.4	170.6	-59.1	-177.2	0	0	0	109.7	F325 F366 L374 I386 V389 W391 V392 L393 R410	L323-F325 HydrophobicContact CB-CE2 4.08Å; L323-F325 HydrophobicContact CD1-CE2 4.33Å; L323-F366 HydrophobicContact CD2-CE1 3.64Å; L323-F366 HydrophobicContact CD2-CZ 4.07Å; L323-L374 HydrophobicContact CD2-CB 3.83Å; L323-L374 HydrophobicContact CD2-CD2 3.92Å; L323-L374 HydrophobicContact CD2-CG 4.2Å; L323-I386 HydrophobicContact CD1-CD1 4.32Å; L323-I386 HydrophobicContact CD2-CD1 3.89Å; L323-V389 HydrophobicContact CD1-CG1 4.17Å; L323-V389 HydrophobicContact CD1-CG2 4.19Å; L323-V389 HydrophobicContact CG-CG1 3.89Å; L323-V389 HydrophobicContact CG-CG2 4.17Å; L323-W391 PolarHBondContact N-O 3.06Å; L323-V392 HydrophobicContact CD1-CG2 4.43Å; L323-L393 PolarHBondContact O-N 3.22Å; L323-R410 HydrophobicContact CD1-CB 3.42Å; L323-R410 VanDerWaalsContact CD1-CB 3.42Å; L323-R410 HydrophobicContact CD1-CG 3.84Å
324	V	96.3	Very high	93.4	Very high	0 Å²	0	33.4 Å²	33.4	0%	0	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	104.4	179.2	-166.4	0	0	0	0	110	L310 L314 F326 I373 L374 C376 L393	L310-V324 HydrophobicContact CD1-CG1 4.05Å; L310-V324 HydrophobicContact CD2-CG1 4.26Å; L314-V324 HydrophobicContact CD2-CG2 4.06Å; V324-F326 HydrophobicContact CB-CE2 4.27Å; V324-F326 HydrophobicContact CG1-CD2 4.16Å; V324-F326 HydrophobicContact CG1-CE2 3.48Å; V324-F326 VanDerWaalsContact CG1-CE2 3.48Å; V324-F326 HydrophobicContact CG1-CZ 4.17Å; V324-I373 HydrophobicContact CG2-CG2 3.62Å; V324-L374 PolarHBondContact N-O 3.25Å; V324-C376 PolarHBondContact O-N 3.26Å; V324-L393 CarbonylContact C-O 3.57Å; V324-L393 WeakPolarHBondContact CA-O 3.24Å; V324-L393 HydrophobicContact CG1-CB 4.27Å; V324-L393 HydrophobicContact CG2-CB 4.35Å; V324-L393 HydrophobicContact CG2-CD1 4.25Å
325	F	96.1	Very high	93.5	Very high	0 Å²	0	33.4 Å²	33.4	0%	0	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.8	126.8	-179.1	-74.3	-80.9	0	0	0	112.5	L323 C376 M380 A381 V392 L393 Y395 R407 R410	L323-F325 HydrophobicContact CB-CE2 4.08Å; L323-F325 HydrophobicContact CD1-CE2 4.33Å; F325-C376 WeakPolarHBondContact CA-O 3.48Å; F325-M380 HydrophobicContact CE1-CB 4.11Å; F325-M380 HydrophobicContact CZ-CB 4.33Å; F325-A381 HydrophobicContact CE1-CB 3.8Å; F325-A381 HydrophobicContact CZ-CB 4.14Å; F325-V392 HydrophobicContact CD2-CG1 3.77Å; F325-V392 HydrophobicContact CE2-CG1 3.79Å; F325-L393 PolarHBondContact N-O 2.81Å; F325-Y395 PolarHBondContact O-N 3.14Å; F325-R407 HydrophobicContact CD1-CG 4.02Å; F325-R407 HydrophobicContact CD2-CB 4.23Å; F325-R407 HydrophobicContact CD2-CG 3.99Å; F325-R407 HydrophobicContact CE1-CG 4.1Å; F325-R407 HydrophobicContact CE2-CB 4.16Å; F325-R407 HydrophobicContact CE2-CG 4.07Å; F325-R407 HydrophobicContact CG-CG 3.97Å; F325-R407 HydrophobicContact CZ-CG 4.13Å; F325-R410 HydrophobicContact CE2-CG 4.37Å; F325-R410 HydrophobicContact CZ-CG 4.16Å
326	F	95.4	Very high	93.6	Very high	0 Å²	0	29.9 Å²	29.9	0%	0	15%	0.149	C	C	.	.			trans	-121.1	142.9	170.8	-71	-95.6	0	0	0	109.9	L310 V324 T328 C331 V332 F335 V375 C376 Y395	L310-F326 HydrophobicContact CD2-CZ 3.91Å; V324-F326 HydrophobicContact CB-CE2 4.27Å; V324-F326 HydrophobicContact CG1-CD2 4.16Å; V324-F326 HydrophobicContact CG1-CE2 3.48Å; V324-F326 VanDerWaalsContact CG1-CE2 3.48Å; V324-F326 HydrophobicContact CG1-CZ 4.17Å; F326-T328 VanDerWaalsContact C-N 3.26Å; F326-T328 PolarHBondContact O-N 3.26Å; F326-C331 HydrophobicContact CB-CB 3.98Å; F326-C331 HydrophobicContact CD1-CB 3.97Å; F326-C331 HydrophobicContact CG-CB 4.29Å; F326-V332 HydrophobicContact CB-CG2 3.99Å; F326-F335 AromaticContact CD1-CD2 3.64Å; F326-F335 HydrophobicContact CD1-CD2 3.64Å; F326-F335 HydrophobicContact CD1-CE2 4.19Å; F326-F335 HydrophobicContact CD1-CG 4.4Å; F326-F335 HydrophobicContact CE1-CB 3.78Å; F326-F335 HydrophobicContact CE1-CD1 4.5Å; F326-F335 AromaticContact CE1-CD2 3.22Å; F326-F335 HydrophobicContact CE1-CD2 3.22Å; F326-F335 AromaticContact CE1-CE2 3.86Å; F326-F335 HydrophobicContact CE1-CE2 3.86Å; F326-F335 AromaticContact CE1-CG 3.6Å; F326-F335 HydrophobicContact CE1-CG 3.6Å; F326-F335 HydrophobicContact CE2-CB 4.33Å; F326-F335 HydrophobicContact CZ-CB 3.63Å; F326-F335 HydrophobicContact CZ-CD2 4.01Å; F326-F335 AromaticContact CZ-CG 3.94Å; F326-F335 HydrophobicContact CZ-CG 3.94Å; F326-V375 HydrophobicContact CD2-CG1 3.66Å; F326-V375 HydrophobicContact CE2-CG1 3.63Å; F326-C376 PolarHBondContact N-O 3.45Å; F326-Y395 AromaticContact CD1-CD1 3.46Å; F326-Y395 HydrophobicContact CD1-CD1 3.46Å; F326-Y395 VanDerWaalsContact CD1-CD1 3.46Å; F326-Y395 HydrophobicContact CD1-CE1 4.2Å; F326-Y395 AromaticContact CD1-CG 3.94Å; F326-Y395 HydrophobicContact CD1-CG 3.94Å; F326-Y395 AromaticContact CE1-CD1 3.17Å; F326-Y395 HydrophobicContact CE1-CD1 3.17Å; F326-Y395 HydrophobicContact CE1-CD2 4.16Å; F326-Y395 AromaticContact CE1-CE1 3.72Å; F326-Y395 HydrophobicContact CE1-CE1 3.72Å; F326-Y395 AromaticContact CE1-CG 3.41Å; F326-Y395 HydrophobicContact CE1-CG 3.41Å; F326-Y395 VanDerWaalsContact CE1-CG 3.41Å; F326-Y395 HydrophobicContact CZ-CD1 4.09Å; F326-Y395 HydrophobicContact CZ-CD2 4.36Å; F326-Y395 AromaticContact CZ-CG 3.86Å; F326-Y395 HydrophobicContact CZ-CG 3.86Å
327	S	91	Very high	93.7	Very high	28 Å²	28	30 Å²	30	20%	0.196	15%	0.145	C	C	.	.	S	Bend	trans	-76.9	-3.3	-171.9	-67.4	0	0	0	0	114.9	D396 P397	S327-D396 WeakPolarHBondContact OG-CB 3.2Å; S327-P397 PolarHBondContact OG-O 3.38Å
328	T	93.1	Very high	93.9	Very high	16 Å²	16	28.2 Å²	28.2	10%	0.098	14%	0.137	C	C	.	.	S	Bend	trans	-140.8	151.6	175.3	95.4	0	0	0	0	114.5	F326 A330 C331 V332 T377 S479 A483	F326-T328 VanDerWaalsContact C-N 3.26Å; F326-T328 PolarHBondContact O-N 3.26Å; T328-A330 PolarHBondContact O-N 2.95Å; T328-A330 PolarHBondContact OG1-N 2.93Å; T328-C331 PolarHBondContact O-N 3.07Å; T328-C331 PolarHBondContact OG1-N 3.2Å; T328-C331 VanDerWaalsContact OG1-N 3.08Å; T328-C331 PolarHBondContact OG1-SG 3.14Å; T328-V332 PolarHBondContact O-N 3Å; T328-V332 VanDerWaalsContact O-N 3.12Å; T328-T377 VanDerWaalsContact C-CG2 3.48Å; T328-S479 WeakPolarHBondContact CB-OG 3.43Å; T328-S479 PolarHBondContact OG1-OG 3.24Å; T328-A483 HydrophobicContact CG2-CB 3.9Å
329	C	93.6	Very high	94.1	Very high	30 Å²	30	24.5 Å²	24.5	20%	0.203	12%	0.121	C	C	.	.	H	α-helix	trans	-56.7	-35.8	173	-70	0	0	0	0	112.9	E333 H352	C329-E333 WeakPolarHBondContact O-CB 3.47Å; C329-E333 PolarHBondContact O-N 3.04Å; C329-H352 HydrophobicContact CB-CB 4.17Å
330	A	93.4	Very high	94.3	Very high	23 Å²	23	21.6 Å²	21.6	19%	0.19	11%	0.107	C	C	.	.	H	α-helix	trans	-76.1	-31.7	-178.1	0	0	0	0	0	111.7	T328 E333 F334 R475 A476	T328-A330 PolarHBondContact O-N 2.95Å; T328-A330 PolarHBondContact OG1-N 2.93Å; A330-E333 PolarHBondContact O-N 3.19Å; A330-F334 VanDerWaalsContact O-CB 3.31Å; A330-F334 WeakPolarHBondContact O-CB 3.35Å; A330-F334 PolarHBondContact O-N 2.94Å; A330-R475 HydrophobicContact CB-CB 4.38Å; A330-A476 HydrophobicContact CB-CB 4.33Å
331	C	94.6	Very high	94.3	Very high	0 Å²	0	20.8 Å²	20.8	0%	0	11%	0.108	C	C	.	.	H	α-helix	trans	-64.7	-47.7	170.4	-64	0	0	0	0	111.1	F326 T328 E333 F334 F335	F326-C331 HydrophobicContact CB-CB 3.98Å; F326-C331 HydrophobicContact CD1-CB 3.97Å; F326-C331 HydrophobicContact CG-CB 4.29Å; T328-C331 PolarHBondContact O-N 3.07Å; T328-C331 PolarHBondContact OG1-N 3.2Å; T328-C331 VanDerWaalsContact OG1-N 3.08Å; T328-C331 PolarHBondContact OG1-SG 3.14Å; C331-E333 VanDerWaalsContact C-N 3.32Å; C331-E333 PolarHBondContact O-N 2.58Å; C331-F334 PolarHBondContact O-N 2.86Å; C331-F334 VanDerWaalsContact O-N 3.14Å; C331-F335 HydrophobicContact CB-CD2 3.97Å; C331-F335 HydrophobicContact CB-CE2 4.17Å; C331-F335 WeakPolarHBondContact O-CB 3.49Å; C331-F335 WeakPolarHBondContact O-CD2 3.35Å; C331-F335 PolarHBondContact O-N 3.31Å
332	V	95.3	Very high	94.2	Very high	0 Å²	0	20.8 Å²	20.8	0%	0	11%	0.108	C	C	.	.	H	α-helix	trans	-54.1	-48.5	172.1	170.1	0	0	0	0	111.2	F326 T328 F334 G336 C350 H352 V375 T377	F326-V332 HydrophobicContact CB-CG2 3.99Å; T328-V332 PolarHBondContact O-N 3Å; T328-V332 VanDerWaalsContact O-N 3.12Å; V332-F334 VanDerWaalsContact C-N 3.28Å; V332-F334 PolarHBondContact O-N 3.37Å; V332-G336 WeakPolarHBondContact O-CA 3.48Å; V332-G336 PolarHBondContact O-N 3.24Å; V332-C350 HydrophobicContact CG1-CB 4Å; V332-H352 HydrophobicContact CB-CB 4.42Å; V332-H352 HydrophobicContact CG1-CB 4.25Å; V332-V375 HydrophobicContact CB-CG1 4.32Å; V332-V375 HydrophobicContact CG1-CG1 4.05Å; V332-V375 HydrophobicContact CG2-CG1 4.23Å; V332-T377 HydrophobicContact CG2-CG2 3.67Å
333	E	93.8	Very high	94	Very high	79 Å²	79	21 Å²	21	37%	0.369	11%	0.109	S	C	.	.	H	α-helix	trans	-64.8	-25.6	179.9	-89.7	-155.1	-113.1	0	0	115.1	C329 A330 C331 H352 K472	C329-E333 WeakPolarHBondContact O-CB 3.47Å; C329-E333 PolarHBondContact O-N 3.04Å; A330-E333 PolarHBondContact O-N 3.19Å; C331-E333 VanDerWaalsContact C-N 3.32Å; C331-E333 PolarHBondContact O-N 2.58Å; E333-H352 IonicContact OE1-CE1 3.69Å; E333-K472 WeakPolarHBondContact O-CD 3.2Å; E333-K472 PolarHBondContact O-NZ 2.98Å; E333-K472 WeakPolarHBondContact OE2-CE 3.5Å; E333-K472 IonicContact OE2-NZ 3.19Å; E333-K472 PolarHBondContact OE2-NZ 3.47Å
334	F	95.4	Very high	93.7	Very high	5 Å²	5	28.6 Å²	28.6	2%	0.022	14%	0.142	C	C	.	.	H	α-helix	trans	-92.4	-58.9	-179.2	173.2	-112.9	0	0	0	111.4	A330 C331 V332 G336 R337 A338 V459 M469 K472 G473 A476 F509	A330-F334 VanDerWaalsContact O-CB 3.31Å; A330-F334 WeakPolarHBondContact O-CB 3.35Å; A330-F334 PolarHBondContact O-N 2.94Å; C331-F334 PolarHBondContact O-N 2.86Å; C331-F334 VanDerWaalsContact O-N 3.14Å; V332-F334 VanDerWaalsContact C-N 3.28Å; V332-F334 PolarHBondContact O-N 3.37Å; F334-G336 VanDerWaalsContact C-N 3.33Å; F334-G336 PolarHBondContact O-N 2.64Å; F334-R337 PolarHBondContact O-N 3.36Å; F334-A338 PolarHBondContact O-N 2.84Å; F334-A338 VanDerWaalsContact O-N 3.11Å; F334-V459 HydrophobicContact CE2-CG1 4.42Å; F334-V459 HydrophobicContact CZ-CG1 3.94Å; F334-M469 HydrophobicContact CD2-CE 3.73Å; F334-M469 HydrophobicContact CD2-SD 3.95Å; F334-M469 HydrophobicContact CE2-CE 3.58Å; F334-M469 HydrophobicContact CE2-CG 4.4Å; F334-M469 HydrophobicContact CE2-SD 4.09Å; F334-M469 HydrophobicContact CZ-CE 4.36Å; F334-K472 HydrophobicContact CB-CB 4.27Å; F334-K472 HydrophobicContact CD2-CB 4.04Å; F334-G473 VanDerWaalsContact CD2-N 3.3Å; F334-A476 HydrophobicContact CB-CB 3.83Å; F334-A476 HydrophobicContact CD1-CB 4.15Å; F334-A476 HydrophobicContact CG-CB 4.14Å; F334-F509 HydrophobicContact CD1-CD1 4.33Å; F334-F509 HydrophobicContact CE1-CD1 4.17Å; F334-F509 VanDerWaalsContact CZ-O 3.28Å; F334-F509 WeakPolarHBondContact CZ-O 3.32Å
335	F	95.6	Very high	93.2	Very high	1 Å²	1	38.9 Å²	38.9	0%	0.004	19%	0.187	C	C	.	.	H	α-helix	trans	-66.2	-33.9	-178.6	-67.3	-66	0	0	0	111.8	F307 F326 C331 R337 A338 L339 Y395 F509	F307-F335 AromaticContact CD2-CD1 3.53Å; F307-F335 HydrophobicContact CD2-CD1 3.53Å; F307-F335 AromaticContact CD2-CE1 3.76Å; F307-F335 HydrophobicContact CD2-CE1 3.76Å; F307-F335 HydrophobicContact CD2-CG 4.49Å; F307-F335 HydrophobicContact CE2-CB 4.36Å; F307-F335 AromaticContact CE2-CD1 3.45Å; F307-F335 HydrophobicContact CE2-CD1 3.45Å; F307-F335 VanDerWaalsContact CE2-CD1 3.45Å; F307-F335 HydrophobicContact CE2-CE1 4.14Å; F307-F335 HydrophobicContact CE2-CG 4.27Å; F307-F335 HydrophobicContact CG-CD1 4.24Å; F307-F335 HydrophobicContact CG-CE1 4.09Å; F307-F335 HydrophobicContact CZ-CD1 4.08Å; F326-F335 AromaticContact CD1-CD2 3.64Å; F326-F335 HydrophobicContact CD1-CD2 3.64Å; F326-F335 HydrophobicContact CD1-CE2 4.19Å; F326-F335 HydrophobicContact CD1-CG 4.4Å; F326-F335 HydrophobicContact CE1-CB 3.78Å; F326-F335 HydrophobicContact CE1-CD1 4.5Å; F326-F335 AromaticContact CE1-CD2 3.22Å; F326-F335 HydrophobicContact CE1-CD2 3.22Å; F326-F335 AromaticContact CE1-CE2 3.86Å; F326-F335 HydrophobicContact CE1-CE2 3.86Å; F326-F335 AromaticContact CE1-CG 3.6Å; F326-F335 HydrophobicContact CE1-CG 3.6Å; F326-F335 HydrophobicContact CE2-CB 4.33Å; F326-F335 HydrophobicContact CZ-CB 3.63Å; F326-F335 HydrophobicContact CZ-CD2 4.01Å; F326-F335 AromaticContact CZ-CG 3.94Å; F326-F335 HydrophobicContact CZ-CG 3.94Å; C331-F335 HydrophobicContact CB-CD2 3.97Å; C331-F335 HydrophobicContact CB-CE2 4.17Å; C331-F335 WeakPolarHBondContact O-CB 3.49Å; C331-F335 WeakPolarHBondContact O-CD2 3.35Å; C331-F335 PolarHBondContact O-N 3.31Å; F335-R337 PolarHBondContact O-N 3.33Å; F335-A338 WeakPolarHBondContact O-CB 3.34Å; F335-A338 PolarHBondContact O-N 3.38Å; F335-A338 VanDerWaalsContact O-N 3.07Å; F335-L339 WeakPolarHBondContact O-CB 3.42Å; F335-L339 VanDerWaalsContact O-CG 3.24Å; F335-L339 WeakPolarHBondContact O-CG 3.27Å; F335-L339 PolarHBondContact O-N 3.34Å; F335-Y395 HydrophobicContact CE2-CE1 4.34Å; F335-Y395 HydrophobicContact CZ-CE1 4.41Å; F335-F509 HydrophobicContact CE2-CD1 4.19Å; F335-F509 AromaticContact CE2-CE1 3.53Å; F335-F509 HydrophobicContact CE2-CE1 3.53Å; F335-F509 HydrophobicContact CE2-CE2 4.44Å; F335-F509 AromaticContact CE2-CZ 3.68Å; F335-F509 HydrophobicContact CE2-CZ 3.68Å; F335-F509 AromaticContact CZ-CD1 3.85Å; F335-F509 HydrophobicContact CZ-CD1 3.85Å; F335-F509 HydrophobicContact CZ-CD2 4.35Å; F335-F509 AromaticContact CZ-CE1 3.63Å; F335-F509 HydrophobicContact CZ-CE1 3.63Å; F335-F509 HydrophobicContact CZ-CE2 4.15Å; F335-F509 HydrophobicContact CZ-CG 4.21Å; F335-F509 AromaticContact CZ-CZ 3.79Å; F335-F509 HydrophobicContact CZ-CZ 3.79Å
336	G	94.3	Very high	92.9	Very high	0 Å²	0	40.1 Å²	40.1	0%	0	19%	0.194	C	C	.	.	H	α-helix	trans	-53.3	-49.8	172.1	0	0	0	0	0	112.8	V332 F334 A338 L339 E340	V332-G336 WeakPolarHBondContact O-CA 3.48Å; V332-G336 PolarHBondContact O-N 3.24Å; F334-G336 VanDerWaalsContact C-N 3.33Å; F334-G336 PolarHBondContact O-N 2.64Å; G336-A338 VanDerWaalsContact C-N 3.34Å; G336-A338 PolarHBondContact O-N 3.17Å; G336-L339 PolarHBondContact O-N 3.01Å; G336-E340 VanDerWaalsContact O-CG 3.32Å; G336-E340 WeakPolarHBondContact O-CG 3.42Å; G336-E340 PolarHBondContact O-N 3.27Å
337	R	93.6	Very high	92.8	Very high	105 Å²	105	43.4 Å²	43.4	40%	0.396	21%	0.214	S	C	.	.	H	α-helix	trans	-65.6	-32.3	174.9	-80	-172.3	166.3	-155.9	-7.3	114	F334 F335 M469	F334-R337 PolarHBondContact O-N 3.36Å; F335-R337 PolarHBondContact O-N 3.33Å; R337-M469 HydrophobicContact CB-CE 4.34Å; R337-M469 HydrophobicContact CB-SD 4.07Å
338	A	94.1	Very high	93	Very high	0 Å²	0	43.1 Å²	43.1	0%	0	21%	0.211	C	C	.	.	H	α-helix	trans	-66.5	-46.5	172.8	0	0	0	0	0	110.4	F307 F334 F335 G336 S341 L342 V459 M462 M469	F307-A338 HydrophobicContact CE1-CB 4.24Å; F307-A338 HydrophobicContact CZ-CB 3.74Å; F334-A338 PolarHBondContact O-N 2.84Å; F334-A338 VanDerWaalsContact O-N 3.11Å; F335-A338 WeakPolarHBondContact O-CB 3.34Å; F335-A338 PolarHBondContact O-N 3.38Å; F335-A338 VanDerWaalsContact O-N 3.07Å; G336-A338 VanDerWaalsContact C-N 3.34Å; G336-A338 PolarHBondContact O-N 3.17Å; A338-S341 WeakPolarHBondContact O-CB 3.39Å; A338-S341 PolarHBondContact O-N 3.47Å; A338-S341 VanDerWaalsContact O-N 3.14Å; A338-L342 HydrophobicContact CB-CD1 4.26Å; A338-L342 VanDerWaalsContact O-CB 3.32Å; A338-L342 WeakPolarHBondContact O-CB 3.49Å; A338-L342 WeakPolarHBondContact O-CD1 3.4Å; A338-L342 WeakPolarHBondContact O-CG 3.24Å; A338-L342 PolarHBondContact O-N 3.21Å; A338-V459 HydrophobicContact CB-CG2 4.25Å; A338-M462 HydrophobicContact CB-CE 4.47Å; A338-M469 HydrophobicContact CB-CE 3.91Å
339	L	94.8	Very high	93.1	Very high	0 Å²	0	44.1 Å²	44.1	0%	0	21%	0.214	C	C	.	.	H	α-helix	trans	-62.8	-43	179.6	-67.3	177.5	0	0	0	112.3	F307 L310 V311 L314 F335 G336 S341 L342 V343 I348 V375	F307-L339 HydrophobicContact CE2-CD2 3.9Å; F307-L339 HydrophobicContact CE2-CG 4.3Å; F307-L339 HydrophobicContact CZ-CD2 3.96Å; F307-L339 HydrophobicContact CZ-CG 4.42Å; L310-L339 HydrophobicContact CD2-CD1 4.45Å; V311-L339 HydrophobicContact CG2-CD2 3.58Å; L314-L339 HydrophobicContact CD1-CD1 3.84Å; L314-L339 HydrophobicContact CD1-CD2 3.47Å; L314-L339 VanDerWaalsContact CD1-CD2 3.47Å; L314-L339 HydrophobicContact CD1-CG 4.26Å; F335-L339 WeakPolarHBondContact O-CB 3.42Å; F335-L339 VanDerWaalsContact O-CG 3.24Å; F335-L339 WeakPolarHBondContact O-CG 3.27Å; F335-L339 PolarHBondContact O-N 3.34Å; G336-L339 PolarHBondContact O-N 3.01Å; L339-S341 PolarHBondContact O-N 3.05Å; L339-S341 VanDerWaalsContact O-N 3.13Å; L339-L342 PolarHBondContact O-N 2.89Å; L339-V343 HydrophobicContact CD2-CG2 4.19Å; L339-V343 PolarHBondContact O-N 3.41Å; L339-I348 HydrophobicContact CB-CD1 3.85Å; L339-V375 HydrophobicContact CD1-CG2 3.87Å
340	E	93.6	Very high	93.1	Very high	107 Å²	107	43.9 Å²	43.9	50%	0.5	21%	0.212	S	C	.	.	H	α-helix	trans	-50	-36.7	172.2	-75.2	163.8	-167	0	0	112.4	G336 I348	G336-E340 VanDerWaalsContact O-CG 3.32Å; G336-E340 WeakPolarHBondContact O-CG 3.42Å; G336-E340 PolarHBondContact O-N 3.27Å; E340-I348 HydrophobicContact CG-CB 4.39Å
341	S	92.1	Very high	93	Very high	37 Å²	37	42.8 Å²	42.8	26%	0.259	20%	0.203	S	C	.	.	H	α-helix	trans	-86.9	-22.6	178.7	-178.4	0	0	0	0	113.9	A338 L339 K458 M462	A338-S341 WeakPolarHBondContact O-CB 3.39Å; A338-S341 PolarHBondContact O-N 3.47Å; A338-S341 VanDerWaalsContact O-N 3.14Å; L339-S341 PolarHBondContact O-N 3.05Å; L339-S341 VanDerWaalsContact O-N 3.13Å; S341-K458 PolarHBondContact O-NZ 3.28Å; S341-K458 WeakPolarHBondContact OG-CE 3.38Å; S341-K458 PolarHBondContact OG-NZ 3.24Å; S341-M462 WeakPolarHBondContact CB-SD 3.49Å; S341-M462 PolarHBondContact OG-SD 2.95Å
342	L	92.3	Very high	92.8	Very high	6 Å²	6	43.5 Å²	43.5	3%	0.031	21%	0.207	C	C	.	.	H	α-helix	trans	-105.8	-24.5	-167.8	-70	172	0	0	0	114.7	F307 V311 R315 A338 L339 V455 K458 V459	F307-L342 HydrophobicContact CE1-CD1 3.58Å; F307-L342 HydrophobicContact CZ-CD1 3.86Å; V311-L342 HydrophobicContact CG1-CB 4.19Å; V311-L342 HydrophobicContact CG2-CD1 4.3Å; R315-L342 PolarHBondContact NE-O 3.13Å; R315-L342 PolarHBondContact NH2-O 2.91Å; A338-L342 HydrophobicContact CB-CD1 4.26Å; A338-L342 VanDerWaalsContact O-CB 3.32Å; A338-L342 WeakPolarHBondContact O-CB 3.49Å; A338-L342 WeakPolarHBondContact O-CD1 3.4Å; A338-L342 WeakPolarHBondContact O-CG 3.24Å; A338-L342 PolarHBondContact O-N 3.21Å; L339-L342 PolarHBondContact O-N 2.89Å; L342-V455 HydrophobicContact CD1-CB 3.94Å; L342-V455 HydrophobicContact CD1-CG1 4.48Å; L342-V455 HydrophobicContact CD1-CG2 3.98Å; L342-V455 HydrophobicContact CD2-CB 3.81Å; L342-V455 HydrophobicContact CD2-CG1 3.81Å; L342-K458 HydrophobicContact CD2-CB 4.43Å; L342-K458 HydrophobicContact CD2-CD 3.67Å; L342-K458 HydrophobicContact CD2-CG 4.16Å; L342-V459 HydrophobicContact CD1-CG2 3.91Å
343	V	90.7	Very high	92.1	Very high	3 Å²	3	45.1 Å²	45.1	2%	0.018	22%	0.224	C	C	.	.	S	Bend	trans	-114.1	70.5	179.5	-169.7	0	0	0	0	108.9	V311 L314 L339 V346 I348 I373	V311-V343 HydrophobicContact CG1-CG2 4.43Å; L314-V343 HydrophobicContact CB-CG1 4.46Å; L314-V343 HydrophobicContact CB-CG2 4.05Å; L314-V343 HydrophobicContact CD1-CG2 4.36Å; L339-V343 HydrophobicContact CD2-CG2 4.19Å; L339-V343 PolarHBondContact O-N 3.41Å; V343-V346 HydrophobicContact CG1-CB 4.16Å; V343-V346 HydrophobicContact CG1-CG2 3.86Å; V343-I348 HydrophobicContact CB-CD1 4.19Å; V343-I373 HydrophobicContact CG1-CD1 4.14Å
344	K	87.8	Confident	91.6	Very high	161 Å²	161	49.8 Å²	49.8	70%	0.7	24%	0.243	S	C	*	.	T	Hydrogen-bonded Turn	trans	-59.6	148.8	178.1	-66.3	-174.3	177.3	-176.1	0	111.5
345	K	86.8	Confident	91	Very high	215 Å²	215	51.1 Å²	51.1	94%	0.935	25%	0.25	S	C	*	.	T	Hydrogen-bonded Turn	trans	67.2	26	179.8	-51.6	-172.8	179.3	-173.5	0	115.2
346	V	90.6	Very high	89.8	Confident	26 Å²	26	58.9 Å²	58.9	16%	0.158	28%	0.283	C	S	.	.	S	Bend	trans	-130.8	139.3	172	-175.9	0	0	0	0	109.2	K318 V343 I373	K318-V346 HydrophobicContact CB-CG2 3.73Å; K318-V346 HydrophobicContact CD-CG2 4.17Å; K318-V346 HydrophobicContact CG-CG2 3.7Å; V343-V346 HydrophobicContact CG1-CB 4.16Å; V343-V346 HydrophobicContact CG1-CG2 3.86Å; V346-I373 HydrophobicContact CB-CD1 4.47Å; V346-I373 HydrophobicContact CG1-CD1 3.77Å; V346-I373 HydrophobicContact CG1-CG1 3.92Å
347	T	93.2	Very high	88.5	Confident	69 Å²	69	65.4 Å²	65.4	42%	0.423	32%	0.318	S	S	.	.			trans	-76.2	124.9	173	-49	0	0	0	0	109.5	H349 L369 G372 I373	T347-H349 WeakPolarHBondContact CG2-NE2 3.5Å; T347-L369 HydrophobicContact CG2-CD1 3.86Å; T347-G372 WeakPolarHBondContact O-CA 3.46Å; T347-I373 PolarHBondContact O-N 3.01Å
348	I	94.7	Very high	87.9	Confident	23 Å²	23	67.7 Å²	67.7	12%	0.118	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120	127.1	-179.3	-52.6	-170.5	0	0	0	109.2	L339 E340 V343 I373 V375	L339-I348 HydrophobicContact CB-CD1 3.85Å; E340-I348 HydrophobicContact CG-CB 4.39Å; V343-I348 HydrophobicContact CB-CD1 4.19Å; I348-I373 WeakPolarHBondContact CA-O 3.35Å; I348-I373 HydrophobicContact CD1-CD1 4.22Å; I348-I373 HydrophobicContact CG1-CB 4.3Å; I348-I373 HydrophobicContact CG1-CD1 4.33Å; I348-V375 HydrophobicContact CG2-CG2 3.98Å
349	H	94.8	Very high	87.4	Confident	36 Å²	36	68.8 Å²	68.8	17%	0.167	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	153.4	176.5	-71.7	-77.5	0	0	0	110.4	T347 I362 I373 L374 V375	T347-H349 WeakPolarHBondContact CG2-NE2 3.5Å; H349-I362 HydrophobicContact CB-CG2 3.76Å; H349-I373 PolarHBondContact N-O 2.92Å; H349-L374 HydrophobicContact CB-CD1 3.98Å; H349-V375 PolarHBondContact O-N 3.2Å
350	C	94.1	Very high	86.7	Confident	25 Å²	25	70.4 Å²	70.4	17%	0.169	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	126.2	179.6	-68.8	0	0	0	0	110.5	V332 M355 V375	V332-C350 HydrophobicContact CG1-CB 4Å; C350-M355 WeakPolarHBondContact O-CE 3.3Å; C350-M355 VanDerWaalsContact O-SD 3.39Å; C350-V375 CarbonylContact C-O 3.5Å; C350-V375 VanDerWaalsContact CA-O 3.3Å; C350-V375 WeakPolarHBondContact CA-O 3.21Å
351	I	91.6	Very high	86.3	Confident	0 Å²	0	68.4 Å²	68.4	0%	0	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.9	124.3	174.6	-67.9	175.5	0	0	0	111.7	R359 I362 F363 L374 V375 C376 T377 M380	I351-R359 HydrophobicContact CG1-CG 4.5Å; I351-R359 HydrophobicContact CG2-CG 3.69Å; I351-I362 HydrophobicContact CD1-CG2 4.02Å; I351-I362 HydrophobicContact CG1-CB 4.41Å; I351-I362 HydrophobicContact CG1-CG2 3.74Å; I351-F363 HydrophobicContact CD1-CB 3.99Å; I351-L374 HydrophobicContact CB-CD1 4.06Å; I351-L374 HydrophobicContact CD1-CD1 3.92Å; I351-L374 HydrophobicContact CD1-CD2 4.18Å; I351-L374 HydrophobicContact CG1-CD1 3.81Å; I351-V375 PolarHBondContact N-O 3.42Å; I351-C376 WeakPolarHBondContact O-CA 2.96Å; I351-C376 WeakPolarHBondContact O-CB 3.43Å; I351-T377 PolarHBondContact O-N 3.16Å; I351-M380 HydrophobicContact CB-CG 4.15Å; I351-M380 HydrophobicContact CB-SD 4.21Å; I351-M380 HydrophobicContact CD1-CE 4.11Å; I351-M380 HydrophobicContact CD1-SD 4.08Å; I351-M380 HydrophobicContact CG2-CG 3.82Å; I351-M380 HydrophobicContact CG2-SD 3.51Å; I351-M380 VanDerWaalsContact CG2-SD 3.51Å
352	H	89.6	Confident	86.2	Confident	15 Å²	15	67.9 Å²	67.9	7%	0.069	34%	0.338	C	S	.	.			trans	-144.5	157.4	174.4	64.2	106.7	0	0	0	112.5	C329 V332 E333 K354 M355 T377	C329-H352 HydrophobicContact CB-CB 4.17Å; V332-H352 HydrophobicContact CB-CB 4.42Å; V332-H352 HydrophobicContact CG1-CB 4.25Å; E333-H352 IonicContact OE1-CE1 3.69Å; H352-K354 PolarHBondContact O-N 2.94Å; H352-M355 VanDerWaalsContact CD2-CG 3.48Å; H352-M355 WeakPolarHBondContact CD2-CG 3.25Å; H352-M355 PolarHBondContact CD2-SD 3.37Å; H352-M355 PolarHBondContact N-SD 3.01Å; H352-M355 VanDerWaalsContact N-SD 3.38Å; H352-M355 WeakPolarHBondContact NE2-CG 3.33Å; H352-M355 WeakPolarHBondContact O-CB 3.39Å; H352-M355 WeakPolarHBondContact O-CG 3.46Å; H352-M355 PolarHBondContact O-N 3.34Å; H352-T377 HydrophobicContact CB-CG2 4.01Å
353	G	81.2	Confident	86	Confident	35 Å²	35	67.9 Å²	67.9	36%	0.361	34%	0.338	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.9	-22.2	-169	0	0	0	0	0	116.2	M355 R359	G353-M355 VanDerWaalsContact C-N 3.31Å; G353-M355 PolarHBondContact O-N 2.79Å; G353-R359 PolarHBondContact O-NH1 3.29Å
354	K	83	Confident	85.8	Confident	176 Å²	176	70.6 Å²	70.6	77%	0.765	36%	0.357	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.6	-3.6	177.9	-63.7	-170.8	177.7	-172.8	0	114.3	H352 K356	H352-K354 PolarHBondContact O-N 2.94Å; K354-K356 PolarHBondContact O-N 3.21Å
355	M	82.4	Confident	85.9	Confident	34 Å²	34	66.6 Å²	66.6	17%	0.167	34%	0.343	C	S	.	.			trans	-78.7	117.9	174.6	-60	174.2	79.2	0	0	110.5	C350 H352 G353 K358 R359 I362	C350-M355 WeakPolarHBondContact O-CE 3.3Å; C350-M355 VanDerWaalsContact O-SD 3.39Å; H352-M355 VanDerWaalsContact CD2-CG 3.48Å; H352-M355 WeakPolarHBondContact CD2-CG 3.25Å; H352-M355 PolarHBondContact CD2-SD 3.37Å; H352-M355 PolarHBondContact N-SD 3.01Å; H352-M355 VanDerWaalsContact N-SD 3.38Å; H352-M355 WeakPolarHBondContact NE2-CG 3.33Å; H352-M355 WeakPolarHBondContact O-CB 3.39Å; H352-M355 WeakPolarHBondContact O-CG 3.46Å; H352-M355 PolarHBondContact O-N 3.34Å; G353-M355 VanDerWaalsContact C-N 3.31Å; G353-M355 PolarHBondContact O-N 2.79Å; M355-K358 HydrophobicContact CE-CB 4.42Å; M355-R359 HydrophobicContact CB-CB 4.21Å; M355-I362 HydrophobicContact CE-CD1 3.63Å
356	K	70.3	Confident	86.1	Confident	164 Å²	164	56.3 Å²	56.3	71%	0.713	30%	0.299	S	S	*	.			trans	-81.6	-64.6	-179.1	-63.4	-171	175	-170.2	0	113.1	R144 K354	R144-K356 PolarHBondContact NH1-O 3.48Å; K354-K356 PolarHBondContact O-N 3.21Å
357	N	68.6	Low	86.1	Confident	137 Å²	137	58.4 Å²	58.4	73%	0.733	30%	0.304	S	S	*	.	S	Bend	trans	-103.3	-31.9	-164.4	-57.9	37.2	0	0	0	113.9	R359	N357-R359 VanDerWaalsContact C-N 3.33Å; N357-R359 PolarHBondContact O-N 3.06Å
358	K	80.8	Confident	85.9	Confident	153 Å²	153	59.2 Å²	59.2	67%	0.665	32%	0.318	S	S	*	.	S	Bend	trans	-81.6	-6.3	-176.5	-65.4	-161.4	172.6	-159.9	0	115	M355 I362	M355-K358 HydrophobicContact CE-CB 4.42Å; K358-I362 HydrophobicContact CB-CD1 3.96Å; K358-I362 WeakPolarHBondContact O-CB 3.42Å; K358-I362 WeakPolarHBondContact O-CD1 3.44Å; K358-I362 VanDerWaalsContact O-CG1 3.27Å; K358-I362 WeakPolarHBondContact O-CG1 3.39Å; K358-I362 PolarHBondContact O-N 3.47Å
359	R	83.2	Confident	85.7	Confident	23 Å²	23	60.4 Å²	60.4	9%	0.087	32%	0.324	C	S	.	.	H	α-helix	trans	-68.6	-40.8	-167.4	-160.8	167	73.5	-168.3	21.2	112.7	E145 I351 G353 M355 N357 F363	E145-R359 IonicContact OE1-CZ 3.3Å; E145-R359 IonicContact OE1-NE 3.24Å; E145-R359 PolarHBondContact OE1-NE 3.06Å; E145-R359 IonicContact OE1-NH2 3.63Å; E145-R359 PolarHBondContact OE1-NH2 3.47Å; E145-R359 IonicContact OE2-CZ 3.56Å; E145-R359 IonicContact OE2-NE 3.89Å; E145-R359 IonicContact OE2-NH2 2.73Å; E145-R359 PolarHBondContact OE2-NH2 3.31Å; I351-R359 HydrophobicContact CG1-CG 4.5Å; I351-R359 HydrophobicContact CG2-CG 3.69Å; G353-R359 PolarHBondContact O-NH1 3.29Å; M355-R359 HydrophobicContact CB-CB 4.21Å; N357-R359 VanDerWaalsContact C-N 3.33Å; N357-R359 PolarHBondContact O-N 3.06Å; R359-F363 WeakPolarHBondContact O-CB 3.5Å; R359-F363 PolarHBondContact O-N 3.15Å; R359-F363 VanDerWaalsContact O-N 3.08Å
360	S	80.2	Confident	85.4	Confident	34 Å²	34	68 Å²	68	24%	0.238	36%	0.357	C	S	.	.	H	α-helix	trans	-69.3	-43.9	-179.4	-53.2	0	0	0	0	112.7	F363 S364	S360-F363 PolarHBondContact O-N 2.95Å; S360-S364 PolarHBondContact O-N 3.28Å; S360-S364 PolarHBondContact O-OG 2.88Å
361	S	85.2	Confident	85.3	Confident	65 Å²	65	69.1 Å²	69.1	46%	0.455	37%	0.365	S	S	.	.	H	α-helix	trans	-63.5	-49.9	176.9	98.3	0	0	0	0	110.6	F363 S364 D365	S361-F363 PolarHBondContact O-N 3.01Å; S361-F363 VanDerWaalsContact O-N 3.1Å; S361-S364 CarbonylContact O-C 3.48Å; S361-S364 PolarHBondContact O-N 3.31Å; S361-D365 VanDerWaalsContact C-OD2 3.23Å; S361-D365 WeakPolarHBondContact O-CB 3.43Å; S361-D365 PolarHBondContact O-N 3.34Å; S361-D365 PolarHBondContact OG-OD2 3.03Å
362	I	89.9	Confident	85.4	Confident	26 Å²	26	69.1 Å²	69.1	13%	0.133	37%	0.365	C	S	.	.	H	α-helix	trans	-58.2	-31.4	-179.9	-66.6	170.1	0	0	0	111.7	H349 I351 M355 K358 D365 F366	H349-I362 HydrophobicContact CB-CG2 3.76Å; I351-I362 HydrophobicContact CD1-CG2 4.02Å; I351-I362 HydrophobicContact CG1-CB 4.41Å; I351-I362 HydrophobicContact CG1-CG2 3.74Å; M355-I362 HydrophobicContact CE-CD1 3.63Å; K358-I362 HydrophobicContact CB-CD1 3.96Å; K358-I362 WeakPolarHBondContact O-CB 3.42Å; K358-I362 WeakPolarHBondContact O-CD1 3.44Å; K358-I362 VanDerWaalsContact O-CG1 3.27Å; K358-I362 WeakPolarHBondContact O-CG1 3.39Å; K358-I362 PolarHBondContact O-N 3.47Å; I362-D365 WeakPolarHBondContact CA-OD2 3.32Å; I362-D365 PolarHBondContact N-OD2 2.98Å; I362-F366 WeakPolarHBondContact O-CB 3.27Å; I362-F366 PolarHBondContact O-N 2.81Å; I362-F366 VanDerWaalsContact O-N 3.13Å
363	F	87.4	Confident	85.7	Confident	5 Å²	5	68.4 Å²	68.4	2%	0.022	36%	0.361	C	S	.	.	H	α-helix	trans	-69.1	-50.7	172	173.3	-113.6	0	0	0	112.3	I351 R359 S360 S361 D365 F366 R367 M380 I384 I386	I351-F363 HydrophobicContact CD1-CB 3.99Å; R359-F363 WeakPolarHBondContact O-CB 3.5Å; R359-F363 PolarHBondContact O-N 3.15Å; R359-F363 VanDerWaalsContact O-N 3.08Å; S360-F363 PolarHBondContact O-N 2.95Å; S361-F363 PolarHBondContact O-N 3.01Å; S361-F363 VanDerWaalsContact O-N 3.1Å; F363-D365 PolarHBondContact O-N 3.41Å; F363-F366 PolarHBondContact O-N 2.9Å; F363-R367 WeakPolarHBondContact O-CB 3.48Å; F363-R367 PolarHBondContact O-N 2.74Å; F363-M380 HydrophobicContact CD2-CE 3.64Å; F363-M380 HydrophobicContact CE2-CE 4.03Å; F363-I384 HydrophobicContact CD2-CG2 4.18Å; F363-I384 HydrophobicContact CE1-CG2 4.46Å; F363-I384 HydrophobicContact CE2-CG2 3.24Å; F363-I384 HydrophobicContact CZ-CG2 3.42Å; F363-I384 VanDerWaalsContact CZ-CG2 3.42Å; F363-I386 HydrophobicContact CE2-CD1 4.22Å; F363-I386 HydrophobicContact CE2-CG1 3.86Å
364	S	85.9	Confident	86.4	Confident	61 Å²	61	66.8 Å²	66.8	43%	0.427	34%	0.344	S	S	.	.	H	α-helix	trans	-60.7	-43.5	177	-59.1	0	0	0	0	112.3	S360 S361 F366 R367 A368	S360-S364 PolarHBondContact O-N 3.28Å; S360-S364 PolarHBondContact O-OG 2.88Å; S361-S364 CarbonylContact O-C 3.48Å; S361-S364 PolarHBondContact O-N 3.31Å; S364-F366 PolarHBondContact O-N 3.12Å; S364-R367 PolarHBondContact O-N 3.41Å; S364-A368 PolarHBondContact O-N 3.41Å
365	D	90.5	Very high	87	Confident	76 Å²	76	58.4 Å²	58.4	41%	0.406	31%	0.308	S	S	.	.	H	α-helix	trans	-53.8	-53.5	174.4	-59	-30.6	0	0	0	109.7	S361 I362 F363 R367 A368 L369	S361-D365 VanDerWaalsContact C-OD2 3.23Å; S361-D365 WeakPolarHBondContact O-CB 3.43Å; S361-D365 PolarHBondContact O-N 3.34Å; S361-D365 PolarHBondContact OG-OD2 3.03Å; I362-D365 WeakPolarHBondContact CA-OD2 3.32Å; I362-D365 PolarHBondContact N-OD2 2.98Å; F363-D365 PolarHBondContact O-N 3.41Å; D365-R367 PolarHBondContact O-N 2.71Å; D365-A368 PolarHBondContact O-N 3.45Å; D365-L369 WeakPolarHBondContact O-CG 3.43Å; D365-L369 PolarHBondContact O-N 3.39Å
366	F	91.8	Very high	87.6	Confident	0 Å²	0	56.8 Å²	56.8	0%	0	30%	0.3	C	S	.	.	H	α-helix	trans	-69.3	-31.7	179.7	-175.3	-101.4	0	0	0	113.9	K321 L323 I362 F363 S364 A368 L369 L374 I386	K321-F366 VanDerWaalsContact CE-O 3.3Å; K321-F366 WeakPolarHBondContact CE-O 3.38Å; K321-F366 HydrophobicContact CG-CE1 4.37Å; K321-F366 HydrophobicContact CG-CE2 4.43Å; K321-F366 HydrophobicContact CG-CZ 3.84Å; L323-F366 HydrophobicContact CD2-CE1 3.64Å; L323-F366 HydrophobicContact CD2-CZ 4.07Å; I362-F366 WeakPolarHBondContact O-CB 3.27Å; I362-F366 PolarHBondContact O-N 2.81Å; I362-F366 VanDerWaalsContact O-N 3.13Å; F363-F366 PolarHBondContact O-N 2.9Å; S364-F366 PolarHBondContact O-N 3.12Å; F366-A368 VanDerWaalsContact C-N 3.32Å; F366-A368 PolarHBondContact O-N 3.44Å; F366-L369 HydrophobicContact CD2-CD1 4.15Å; F366-L369 PolarHBondContact O-N 3.33Å; F366-L374 HydrophobicContact CD1-CB 3.77Å; F366-L374 HydrophobicContact CD1-CD2 3.63Å; F366-L374 HydrophobicContact CD1-CG 4.3Å; F366-L374 HydrophobicContact CD2-CB 3.86Å; F366-L374 HydrophobicContact CE1-CB 3.55Å; F366-L374 HydrophobicContact CE1-CD2 3.93Å; F366-L374 HydrophobicContact CE1-CG 4.39Å; F366-L374 HydrophobicContact CE2-CB 3.66Å; F366-L374 HydrophobicContact CG-CB 3.92Å; F366-L374 HydrophobicContact CG-CD2 4.18Å; F366-L374 HydrophobicContact CZ-CB 3.5Å; F366-L374 VanDerWaalsContact CZ-CB 3.5Å; F366-I386 HydrophobicContact CD1-CD1 4.24Å; F366-I386 HydrophobicContact CD1-CG2 4.23Å; F366-I386 HydrophobicContact CE1-CD1 4.19Å; F366-I386 HydrophobicContact CE1-CG2 3.92Å
367	R	89.1	Confident	88.7	Confident	70 Å²	70	49.5 Å²	49.5	26%	0.264	27%	0.269	S	S	.	.	H	α-helix	trans	-62.7	-42.1	176.1	-169.6	179.7	178.5	-164.3	2.3	110.6	E152 K321 F363 S364 D365	E152-R367 IonicContact OE1-NH1 2.73Å; E152-R367 PolarHBondContact OE1-NH1 2.69Å; E152-R367 IonicContact OE2-CZ 3.63Å; E152-R367 IonicContact OE2-NH1 3.84Å; E152-R367 PolarHBondContact OE2-NH1 2.97Å; E152-R367 IonicContact OE2-NH2 2.7Å; E152-R367 PolarHBondContact OE2-NH2 2.89Å; K321-R367 PolarHBondContact NZ-O 2.87Å; F363-R367 WeakPolarHBondContact O-CB 3.48Å; F363-R367 PolarHBondContact O-N 2.74Å; S364-R367 PolarHBondContact O-N 3.41Å; D365-R367 PolarHBondContact O-N 2.71Å
368	A	89.2	Confident	89.5	Confident	86 Å²	86	44.3 Å²	44.3	71%	0.711	24%	0.241	S	C	*	.	H	α-helix	trans	-73.6	-21.5	178.6	0	0	0	0	0	114.7	S364 D365 F366	S364-A368 PolarHBondContact O-N 3.41Å; D365-A368 PolarHBondContact O-N 3.45Å; F366-A368 VanDerWaalsContact C-N 3.32Å; F366-A368 PolarHBondContact O-N 3.44Å
369	L	90.6	Very high	89.6	Confident	48 Å²	48	38.6 Å²	38.6	25%	0.251	22%	0.219	S	C	.	.			trans	-65.6	136.5	176.1	-73.2	176.6	0	0	0	112.1	K321 T347 D365 F366	K321-L369 WeakPolarHBondContact CD-O 3.49Å; K321-L369 WeakPolarHBondContact CE-O 3.5Å; K321-L369 PolarHBondContact NZ-O 3.38Å; T347-L369 HydrophobicContact CG2-CD1 3.86Å; D365-L369 WeakPolarHBondContact O-CG 3.43Å; D365-L369 PolarHBondContact O-N 3.39Å; F366-L369 HydrophobicContact CD2-CD1 4.15Å; F366-L369 PolarHBondContact O-N 3.33Å
370	K	89.1	Confident	89.6	Confident	196 Å²	196	37.5 Å²	37.5	85%	0.852	22%	0.215	S	C	*	.	S	Bend	trans	-76.8	-29.1	170.3	-64.1	-173.3	178.1	-175.3	0	112.8
371	S	92.3	Very high	89.4	Confident	48 Å²	48	36 Å²	36	34%	0.336	21%	0.205	S	C	.	.	S	Bend	trans	-149.6	150	-179	59.2	0	0	0	0	110.6	H319	H319-S371 WeakPolarHBondContact O-CB 3.14Å
372	G	94.2	Very high	88.9	Confident	0 Å²	0	33.2 Å²	33.2	0%	0	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	146.5	173.8	-175	0	0	0	0	0	113.5	E320 K321 Q322 T347	E320-G372 PolarHBondContact O-N 3.44Å; K321-G372 WeakPolarHBondContact CA-O 3.45Å; Q322-G372 PolarHBondContact N-O 3.12Å; T347-G372 WeakPolarHBondContact O-CA 3.46Å
373	I	95.7	Very high	87.8	Confident	0 Å²	0	32.5 Å²	32.5	0%	0	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	121.9	-173.3	-57.7	162.3	0	0	0	109.9	L314 Q322 V324 V343 V346 T347 I348 H349 V375	L314-I373 HydrophobicContact CB-CD1 4.18Å; L314-I373 HydrophobicContact CD1-CD1 4.39Å; L314-I373 HydrophobicContact CD2-CD1 3.95Å; L314-I373 HydrophobicContact CD2-CG1 4.29Å; L314-I373 HydrophobicContact CD2-CG2 4.31Å; L314-I373 HydrophobicContact CG-CD1 4.39Å; Q322-I373 HydrophobicContact CB-CG1 4.41Å; V324-I373 HydrophobicContact CG2-CG2 3.62Å; V343-I373 HydrophobicContact CG1-CD1 4.14Å; V346-I373 HydrophobicContact CB-CD1 4.47Å; V346-I373 HydrophobicContact CG1-CD1 3.77Å; V346-I373 HydrophobicContact CG1-CG1 3.92Å; T347-I373 PolarHBondContact O-N 3.01Å; I348-I373 WeakPolarHBondContact CA-O 3.35Å; I348-I373 HydrophobicContact CD1-CD1 4.22Å; I348-I373 HydrophobicContact CG1-CB 4.3Å; I348-I373 HydrophobicContact CG1-CD1 4.33Å; H349-I373 PolarHBondContact N-O 2.92Å; I373-V375 HydrophobicContact CG2-CG2 4.22Å
374	L	95.3	Very high	87.3	Confident	0 Å²	0	32.3 Å²	32.3	0%	0	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	111.7	169.7	173.2	58.8	0	0	0	110.5	Q322 L323 V324 H349 I351 F366 C376 M380 I386	Q322-L374 PolarHBondContact O-N 2.84Å; L323-L374 HydrophobicContact CD2-CB 3.83Å; L323-L374 HydrophobicContact CD2-CD2 3.92Å; L323-L374 HydrophobicContact CD2-CG 4.2Å; V324-L374 PolarHBondContact N-O 3.25Å; H349-L374 HydrophobicContact CB-CD1 3.98Å; I351-L374 HydrophobicContact CB-CD1 4.06Å; I351-L374 HydrophobicContact CD1-CD1 3.92Å; I351-L374 HydrophobicContact CD1-CD2 4.18Å; I351-L374 HydrophobicContact CG1-CD1 3.81Å; F366-L374 HydrophobicContact CD1-CB 3.77Å; F366-L374 HydrophobicContact CD1-CD2 3.63Å; F366-L374 HydrophobicContact CD1-CG 4.3Å; F366-L374 HydrophobicContact CD2-CB 3.86Å; F366-L374 HydrophobicContact CE1-CB 3.55Å; F366-L374 HydrophobicContact CE1-CD2 3.93Å; F366-L374 HydrophobicContact CE1-CG 4.39Å; F366-L374 HydrophobicContact CE2-CB 3.66Å; F366-L374 HydrophobicContact CG-CB 3.92Å; F366-L374 HydrophobicContact CG-CD2 4.18Å; F366-L374 HydrophobicContact CZ-CB 3.5Å; F366-L374 VanDerWaalsContact CZ-CB 3.5Å; L374-C376 HydrophobicContact CG-CB 4.36Å; L374-M380 HydrophobicContact CD2-CE 4.1Å; L374-I386 HydrophobicContact CD2-CD1 4.28Å
375	V	96.3	Very high	86.8	Confident	0 Å²	0	31.2 Å²	31.2	0%	0	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.5	120.7	175	-175.9	0	0	0	0	109.1	F326 V332 L339 I348 H349 C350 I351 I373	F326-V375 HydrophobicContact CD2-CG1 3.66Å; F326-V375 HydrophobicContact CE2-CG1 3.63Å; V332-V375 HydrophobicContact CB-CG1 4.32Å; V332-V375 HydrophobicContact CG1-CG1 4.05Å; V332-V375 HydrophobicContact CG2-CG1 4.23Å; L339-V375 HydrophobicContact CD1-CG2 3.87Å; I348-V375 HydrophobicContact CG2-CG2 3.98Å; H349-V375 PolarHBondContact O-N 3.2Å; C350-V375 CarbonylContact C-O 3.5Å; C350-V375 VanDerWaalsContact CA-O 3.3Å; C350-V375 WeakPolarHBondContact CA-O 3.21Å; I351-V375 PolarHBondContact N-O 3.42Å; I373-V375 HydrophobicContact CG2-CG2 4.22Å
376	C	94.3	Very high	86.4	Confident	0 Å²	0	27.8 Å²	27.8	0%	0	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.7	162.4	-170	55.5	0	0	0	0	116.8	V324 F325 F326 I351 L374 M380	V324-C376 PolarHBondContact O-N 3.26Å; F325-C376 WeakPolarHBondContact CA-O 3.48Å; F326-C376 PolarHBondContact N-O 3.45Å; I351-C376 WeakPolarHBondContact O-CA 2.96Å; I351-C376 WeakPolarHBondContact O-CB 3.43Å; L374-C376 HydrophobicContact CG-CB 4.36Å; C376-M380 HydrophobicContact CB-CB 3.9Å; C376-M380 HydrophobicContact CB-CG 3.54Å
377	T	92.2	Very high	85.9	Confident	12 Å²	12	30.2 Å²	30.2	7%	0.074	17%	0.169	C	C	.	.			trans	-98.1	173.1	165.7	59.7	0	0	0	0	111.1	T328 V332 I351 H352 V379 M380	T328-T377 VanDerWaalsContact C-CG2 3.48Å; V332-T377 HydrophobicContact CG2-CG2 3.67Å; I351-T377 PolarHBondContact O-N 3.16Å; H352-T377 HydrophobicContact CB-CG2 4.01Å; T377-V379 PolarHBondContact O-N 3.18Å; T377-M380 PolarHBondContact O-N 3.38Å
378	D	86.9	Confident	85.7	Confident	27 Å²	27	31.7 Å²	31.7	14%	0.144	18%	0.182	C	C	.	.	T	Hydrogen-bonded Turn	trans	-56.1	3.4	179	-65.4	-74.2	0	0	0	118	A381 R407	D378-A381 HydrophobicContact CB-CB 4.24Å; D378-A381 PolarHBondContact O-N 2.81Å; D378-R407 IonicContact OD1-CZ 2.7Å; D378-R407 IonicContact OD1-NE 2.73Å; D378-R407 PolarHBondContact OD1-NE 2.74Å; D378-R407 IonicContact OD1-NH2 3.79Å; D378-R407 PolarHBondContact OD1-NH2 3.05Å; D378-R407 IonicContact OD2-CZ 3.64Å; D378-R407 IonicContact OD2-NE 3.4Å; D378-R407 IonicContact OD2-NH2 3.62Å; D378-R407 PolarHBondContact OD2-NH2 2.81Å
379	V	82.6	Confident	85.8	Confident	33 Å²	33	27.9 Å²	27.9	20%	0.2	15%	0.15	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.4	-33.2	161.6	178	0	0	0	0	110.8	T377	T377-V379 PolarHBondContact O-N 3.18Å
380	M	83.8	Confident	86	Confident	0 Å²	0	28.5 Å²	28.5	0%	0	15%	0.153	C	C	.	.	S	Bend	trans	-90.8	2.4	178.2	-56.2	-52.5	-66.5	0	0	113.9	F325 I351 F363 L374 C376 T377 I384 I386 R410	F325-M380 HydrophobicContact CE1-CB 4.11Å; F325-M380 HydrophobicContact CZ-CB 4.33Å; I351-M380 HydrophobicContact CB-CG 4.15Å; I351-M380 HydrophobicContact CB-SD 4.21Å; I351-M380 HydrophobicContact CD1-CE 4.11Å; I351-M380 HydrophobicContact CD1-SD 4.08Å; I351-M380 HydrophobicContact CG2-CG 3.82Å; I351-M380 HydrophobicContact CG2-SD 3.51Å; I351-M380 VanDerWaalsContact CG2-SD 3.51Å; F363-M380 HydrophobicContact CD2-CE 3.64Å; F363-M380 HydrophobicContact CE2-CE 4.03Å; L374-M380 HydrophobicContact CD2-CE 4.1Å; C376-M380 HydrophobicContact CB-CB 3.9Å; C376-M380 HydrophobicContact CB-CG 3.54Å; T377-M380 PolarHBondContact O-N 3.38Å; M380-I384 HydrophobicContact CE-CD1 3.5Å; M380-I384 VanDerWaalsContact CE-CD1 3.5Å; M380-I384 HydrophobicContact CE-CG2 3.99Å; M380-I384 HydrophobicContact SD-CD1 3.55Å; M380-I384 VanDerWaalsContact SD-CD1 3.55Å; M380-I386 HydrophobicContact CE-CD1 4.35Å; M380-R410 WeakPolarHBondContact O-CD 3.41Å
381	A	75.4	Confident	86.2	Confident	3 Å²	3	20.2 Å²	20.2	3%	0.025	12%	0.117	C	C	.	.	S	Bend	trans	-87	-13.7	-173	0	0	0	0	0	114.5	F325 D378 H406 R407 R410	F325-A381 HydrophobicContact CE1-CB 3.8Å; F325-A381 HydrophobicContact CZ-CB 4.14Å; D378-A381 HydrophobicContact CB-CB 4.24Å; D378-A381 PolarHBondContact O-N 2.81Å; A381-H406 CarbonylContact O-C 3.52Å; A381-H406 WeakPolarHBondContact O-CB 3.44Å; A381-R407 HydrophobicContact CB-CG 3.61Å; A381-R410 PolarHBondContact O-NE 3.31Å; A381-R410 VanDerWaalsContact O-NE 3.09Å; A381-R410 PolarHBondContact O-NH2 2.92Å
382	R	75.5	Confident	86.4	Confident	7 Å²	7	17.9 Å²	17.9	3%	0.026	10%	0.101	C	C	.	.	S	Bend	trans	-137.7	148.9	-170.4	-83.8	-176.6	161	141.9	-33	111.9	E224 D226 R227 D230 I384 H406 R410	E224-R382 VanDerWaalsContact OE2-CB 3.26Å; E224-R382 WeakPolarHBondContact OE2-CB 3.34Å; E224-R382 WeakPolarHBondContact OE2-CD 3.43Å; E224-R382 WeakPolarHBondContact OE2-CG 3.4Å; E224-R382 IonicContact OE2-NE 3.67Å; D226-R382 IonicContact OD2-CZ 2.66Å; D226-R382 IonicContact OD2-NH2 3.48Å; D226-R382 PolarHBondContact OD2-NH2 2.82Å; R227-R382 VanDerWaalsContact CG-CD 3.49Å; D230-R382 IonicContact OD2-CZ 3.14Å; D230-R382 IonicContact OD2-NH1 3.21Å; D230-R382 PolarHBondContact OD2-NH1 3.3Å; D230-R382 IonicContact OD2-NH2 3.37Å; D230-R382 PolarHBondContact OD2-NH2 3.17Å; R382-I384 PolarHBondContact O-N 3.06Å; R382-H406 HydrophobicContact CG-CB 3.49Å; R382-H406 VanDerWaalsContact CG-CB 3.49Å; R382-H406 VanDerWaalsContact CZ-NE2 3.31Å; R382-H406 PolarHBondContact NE-CD2 2.87Å; R382-H406 PolarHBondContact NE-CE1 2.99Å; R382-H406 PolarHBondContact NE-ND1 3.5Å; R382-H406 PolarHBondContact NE-NE2 3.15Å; R382-H406 VanDerWaalsContact NE-NE2 3.11Å; R382-H406 PolarHBondContact NH2-NE2 3.49Å; R382-H406 VanDerWaalsContact NH2-NE2 3.12Å; R382-R410 VanDerWaalsContact C-NH1 3.31Å
383	G	65.9	Low	86.4	Confident	10 Å²	10	17.9 Å²	17.9	10%	0.103	10%	0.101	C	C	.	.	S	Bend	trans	68.8	-70.9	-176.4	0	0	0	0	0	113.8	L146 E224 R410	L146-G383 VanDerWaalsContact CD2-CA 3.48Å; E224-G383 VanDerWaalsContact CD-N 3.27Å; E224-G383 WeakPolarHBondContact OE1-CA 3.42Å; E224-G383 PolarHBondContact OE1-N 3.44Å; G383-R410 VanDerWaalsContact N-NH1 3.2Å; G383-R410 PolarHBondContact O-NH1 3.36Å
384	I	77.1	Confident	86.4	Confident	1 Å²	1	17.9 Å²	17.9	1%	0.005	10%	0.101	C	C	.	.			trans	-43.1	131.9	-168.4	-55.2	177.2	0	0	0	113.6	E145 F363 M380 R382 I386 R410 R413	E145-I384 HydrophobicContact CB-CD1 3.35Å; E145-I384 HydrophobicContact CB-CG1 3.67Å; E145-I384 HydrophobicContact CG-CD1 3.85Å; F363-I384 HydrophobicContact CD2-CG2 4.18Å; F363-I384 HydrophobicContact CE1-CG2 4.46Å; F363-I384 HydrophobicContact CE2-CG2 3.24Å; F363-I384 HydrophobicContact CZ-CG2 3.42Å; F363-I384 VanDerWaalsContact CZ-CG2 3.42Å; M380-I384 HydrophobicContact CE-CD1 3.5Å; M380-I384 VanDerWaalsContact CE-CD1 3.5Å; M380-I384 HydrophobicContact CE-CG2 3.99Å; M380-I384 HydrophobicContact SD-CD1 3.55Å; M380-I384 VanDerWaalsContact SD-CD1 3.55Å; R382-I384 PolarHBondContact O-N 3.06Å; I384-I386 HydrophobicContact CG2-CG1 4.2Å; I384-R410 PolarHBondContact O-NH1 3.28Å; I384-R413 PolarHBondContact O-NH1 2.83Å
385	D	74.9	Confident	86.4	Confident	38 Å²	38	18 Å²	18	20%	0.203	10%	0.101	C	C	.	.			trans	-102.9	131.3	174.4	-167.8	58.8	0	0	0	112.3	R413	D385-R413 VanDerWaalsContact OD1-CD 3.29Å; D385-R413 WeakPolarHBondContact OD1-CD 3.22Å; D385-R413 IonicContact OD1-CZ 3.81Å; D385-R413 IonicContact OD1-NE 3.83Å; D385-R413 IonicContact OD1-NH1 2.87Å; D385-R413 PolarHBondContact OD1-NH1 3.03Å
386	I	82.9	Confident	86.1	Confident	5 Å²	5	18 Å²	18	3%	0.026	10%	0.101	C	C	.	.			trans	-135.3	113.1	177.8	-59.8	175.9	0	0	0	105.3	L323 F363 F366 L374 M380 I384 V389	L323-I386 HydrophobicContact CD1-CD1 4.32Å; L323-I386 HydrophobicContact CD2-CD1 3.89Å; F363-I386 HydrophobicContact CE2-CD1 4.22Å; F363-I386 HydrophobicContact CE2-CG1 3.86Å; F366-I386 HydrophobicContact CD1-CD1 4.24Å; F366-I386 HydrophobicContact CD1-CG2 4.23Å; F366-I386 HydrophobicContact CE1-CD1 4.19Å; F366-I386 HydrophobicContact CE1-CG2 3.92Å; L374-I386 HydrophobicContact CD2-CD1 4.28Å; M380-I386 HydrophobicContact CE-CD1 4.35Å; I384-I386 HydrophobicContact CG2-CG1 4.2Å; I386-V389 HydrophobicContact CB-CG2 3.8Å; I386-V389 HydrophobicContact CG2-CG2 3.5Å; I386-V389 VanDerWaalsContact CG2-CG2 3.5Å
387	P	81.8	Confident	85.9	Confident	51 Å²	51	18.1 Å²	18.1	33%	0.331	10%	0.102	S	C	.	.	T	Hydrogen-bonded Turn	trans	-68	146.3	-179.7	28	-33.8	0	0	0	110.4	K321 V389	K321-P387 WeakPolarHBondContact CD-O 3.33Å; K321-P387 WeakPolarHBondContact CE-O 3.45Å; K321-P387 PolarHBondContact NZ-O 3.3Å; P387-V389 VanDerWaalsContact C-N 3.31Å; P387-V389 PolarHBondContact O-N 2.75Å
388	D	84.3	Confident	85.8	Confident	100 Å²	100	17.5 Å²	17.5	54%	0.535	10%	0.098	S	C	.	.	T	Hydrogen-bonded Turn	trans	58.8	29.6	168.2	-47.2	-42.3	0	0	0	116.2	K321 N390 N416	K321-D388 WeakPolarHBondContact CB-O 3.2Å; D388-N390 PolarHBondContact O-N 2.87Å; D388-N416 PolarHBondContact OD1-ND2 3.01Å; D388-N416 VanDerWaalsContact OD1-ND2 3.09Å
389	V	91.4	Very high	85.7	Confident	7 Å²	7	19.3 Å²	19.3	4%	0.042	11%	0.113	C	C	.	.			trans	-62.3	118	165.7	178.9	0	0	0	0	109	K321 L323 I386 P387 W391 V392 T411	K321-V389 CarbonylContact O-C 3.15Å; L323-V389 HydrophobicContact CD1-CG1 4.17Å; L323-V389 HydrophobicContact CD1-CG2 4.19Å; L323-V389 HydrophobicContact CG-CG1 3.89Å; L323-V389 HydrophobicContact CG-CG2 4.17Å; I386-V389 HydrophobicContact CB-CG2 3.8Å; I386-V389 HydrophobicContact CG2-CG2 3.5Å; I386-V389 VanDerWaalsContact CG2-CG2 3.5Å; P387-V389 VanDerWaalsContact C-N 3.31Å; P387-V389 PolarHBondContact O-N 2.75Å; V389-W391 WeakPolarHBondContact CG1-O 3.5Å; V389-V392 HydrophobicContact CG1-CG2 4.26Å; V389-T411 WeakPolarHBondContact O-CB 3.37Å; V389-T411 PolarHBondContact O-OG1 3.19Å
390	N	93.3	Very high	85.7	Confident	60 Å²	60	18.8 Å²	18.8	32%	0.321	11%	0.111	S	C	.	.			trans	-83.6	-38.6	176.7	-51.3	105	0	0	0	111.9	E320 K321 D388 N419	E320-N390 WeakPolarHBondContact CA-OD1 3.24Å; E320-N390 HydrophobicContact CB-CB 3.99Å; E320-N390 VanDerWaalsContact CB-OD1 3.3Å; E320-N390 WeakPolarHBondContact CB-OD1 3.2Å; E320-N390 HydrophobicContact CG-CB 4.3Å; K321-N390 PolarHBondContact N-OD1 3.38Å; K321-N390 PolarHBondContact O-N 3.01Å; D388-N390 PolarHBondContact O-N 2.87Å; N390-N419 PolarHBondContact O-N 3.3Å
391	W	94.6	Very high	85.8	Confident	22 Å²	22	18.9 Å²	18.9	8%	0.083	11%	0.112	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.5	137.4	-176.9	-71.8	88.7	0	0	0	114.4	Y297 F313 H317 E320 K321 Q322 L323 V389 L393 N419 L421	Y297-W391 HydrophobicContact CD2-CH2 4.28Å; Y297-W391 HydrophobicContact CD2-CZ3 4.06Å; Y297-W391 HydrophobicContact CE2-CH2 4.29Å; Y297-W391 HydrophobicContact CE2-CZ3 4.46Å; F313-W391 HydrophobicContact CE1-CD2 4.06Å; F313-W391 HydrophobicContact CE1-CE3 4.35Å; F313-W391 HydrophobicContact CE1-CG 4.15Å; F313-W391 HydrophobicContact CE2-CE3 4.33Å; F313-W391 HydrophobicContact CE2-CH2 4.21Å; F313-W391 HydrophobicContact CE2-CZ2 4.44Å; F313-W391 HydrophobicContact CE2-CZ3 4.15Å; F313-W391 AromaticContact CZ-CD2 3.5Å; F313-W391 HydrophobicContact CZ-CD2 3.5Å; F313-W391 VanDerWaalsContact CZ-CD2 3.5Å; F313-W391 AromaticContact CZ-CE2 3.63Å; F313-W391 AromaticContact CZ-CE3 3.58Å; F313-W391 HydrophobicContact CZ-CE3 3.58Å; F313-W391 HydrophobicContact CZ-CG 4.07Å; F313-W391 AromaticContact CZ-CH2 3.96Å; F313-W391 HydrophobicContact CZ-CH2 3.96Å; F313-W391 AromaticContact CZ-CZ2 3.88Å; F313-W391 HydrophobicContact CZ-CZ2 3.88Å; F313-W391 AromaticContact CZ-CZ3 3.81Å; F313-W391 HydrophobicContact CZ-CZ3 3.81Å; H317-W391 AromaticContact CE1-NE1 3.78Å; H317-W391 AromaticContact ND1-NE1 3.56Å; E320-W391 PolarHBondContact OE2-NE1 2.92Å; K321-W391 PolarHBondContact O-N 2.71Å; Q322-W391 WeakPolarHBondContact CA-O 3.32Å; Q322-W391 HydrophobicContact CG-CB 4.43Å; L323-W391 PolarHBondContact N-O 3.06Å; V389-W391 WeakPolarHBondContact CG1-O 3.5Å; W391-L393 HydrophobicContact CB-CD2 4.19Å; W391-L393 HydrophobicContact CE3-CD2 4.04Å; W391-N419 CarbonylContact C-O 3.6Å; W391-N419 VanDerWaalsContact CA-O 3.3Å; W391-N419 WeakPolarHBondContact CA-O 3.17Å; W391-N419 HydrophobicContact CD2-CB 3.56Å; W391-N419 HydrophobicContact CE3-CB 3.38Å; W391-N419 HydrophobicContact CG-CB 4.39Å; W391-N419 HydrophobicContact CH2-CB 3.62Å; W391-N419 HydrophobicContact CZ2-CB 3.79Å; W391-N419 HydrophobicContact CZ3-CB 3.41Å; W391-N419 VanDerWaalsContact CZ3-CB 3.41Å; W391-L421 HydrophobicContact CE3-CB 4.37Å; W391-L421 HydrophobicContact CZ3-CB 4.19Å
392	V	95.1	Very high	86	Confident	0 Å²	0	21.4 Å²	21.4	0%	0	12%	0.121	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	103	162.6	178.2	0	0	0	0	109.3	L323 F325 V389 Q394 R407 R410 T411 N419 A420 L421	L323-V392 HydrophobicContact CD1-CG2 4.43Å; F325-V392 HydrophobicContact CD2-CG1 3.77Å; F325-V392 HydrophobicContact CE2-CG1 3.79Å; V389-V392 HydrophobicContact CG1-CG2 4.26Å; V392-Q394 HydrophobicContact CG1-CG 4.27Å; V392-R407 WeakPolarHBondContact CG1-O 3.45Å; V392-R410 HydrophobicContact CG2-CB 3.95Å; V392-T411 HydrophobicContact CB-CG2 4.42Å; V392-T411 HydrophobicContact CG2-CG2 3.7Å; V392-N419 PolarHBondContact N-O 3.19Å; V392-A420 HydrophobicContact CB-CB 4.19Å; V392-A420 CarbonylContact O-C 3.52Å; V392-A420 VanDerWaalsContact O-CA 3.25Å; V392-A420 WeakPolarHBondContact O-CA 3.49Å; V392-L421 PolarHBondContact O-N 3.16Å
393	L	95.9	Very high	86.4	Confident	0 Å²	0	21.4 Å²	21.4	0%	0	12%	0.122	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.8	123.9	173.6	-51.2	-174.9	0	0	0	109.2	L310 F313 L314 L323 V324 F325 W391 L421	L310-L393 HydrophobicContact CD1-CD1 3.82Å; F313-L393 HydrophobicContact CD1-CD1 3.53Å; F313-L393 HydrophobicContact CD1-CD2 4Å; F313-L393 HydrophobicContact CD1-CG 4.39Å; F313-L393 HydrophobicContact CE1-CD1 3.87Å; F313-L393 HydrophobicContact CE1-CD2 3.65Å; F313-L393 HydrophobicContact CE1-CG 4.3Å; F313-L393 HydrophobicContact CG-CD1 4.33Å; F313-L393 HydrophobicContact CZ-CD2 3.94Å; L314-L393 HydrophobicContact CD2-CD1 3.65Å; L314-L393 HydrophobicContact CG-CD1 4.49Å; L323-L393 PolarHBondContact O-N 3.22Å; V324-L393 CarbonylContact C-O 3.57Å; V324-L393 WeakPolarHBondContact CA-O 3.24Å; V324-L393 HydrophobicContact CG1-CB 4.27Å; V324-L393 HydrophobicContact CG2-CB 4.35Å; V324-L393 HydrophobicContact CG2-CD1 4.25Å; F325-L393 PolarHBondContact N-O 2.81Å; W391-L393 HydrophobicContact CB-CD2 4.19Å; W391-L393 HydrophobicContact CE3-CD2 4.04Å; L393-L421 CarbonylContact C-O 3.53Å; L393-L421 WeakPolarHBondContact CA-O 3.38Å; L393-L421 HydrophobicContact CD2-CB 3.88Å; L393-L421 HydrophobicContact CD2-CD2 4.25Å
394	Q	95.1	Very high	87.5	Confident	0 Å²	0	21 Å²	21	0%	0	12%	0.117	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	90.8	172.6	-58.3	-168.9	62.2	0	0	107.4	V392 D396 F404 R407 L421 V422 F423	V392-Q394 HydrophobicContact CG1-CG 4.27Å; Q394-D396 PolarHBondContact O-N 3.07Å; Q394-F404 VanDerWaalsContact NE2-CZ 3.33Å; Q394-R407 VanDerWaalsContact OE1-NH1 3.11Å; Q394-L421 PolarHBondContact N-O 2.89Å; Q394-V422 HydrophobicContact CB-CB 4.15Å; Q394-V422 HydrophobicContact CB-CG2 4.05Å; Q394-F423 PolarHBondContact O-N 2.88Å
395	Y	94.3	Very high	87.7	Confident	3 Å²	3	21.1 Å²	21.1	1%	0.012	12%	0.118	C	C	.	.	S	Bend	trans	-62.5	-36.5	178.6	-177.4	-95.2	0	0	0	110.8	K306 F307 L310 F325 F326 F335	K306-Y395 HydrophobicContact CB-CE2 4.26Å; K306-Y395 HydrophobicContact CD-CE1 4.09Å; K306-Y395 HydrophobicContact CD-CE2 4.21Å; K306-Y395 WeakPolarHBondContact CE-O 3.48Å; K306-Y395 HydrophobicContact CG-CD2 4.39Å; K306-Y395 HydrophobicContact CG-CE1 4.48Å; K306-Y395 HydrophobicContact CG-CE2 3.7Å; K306-Y395 PolarHBondContact NZ-O 3.43Å; F307-Y395 HydrophobicContact CB-CE2 4.48Å; F307-Y395 HydrophobicContact CD2-CE2 4.42Å; F307-Y395 PolarHBondContact N-OH 2.8Å; L310-Y395 HydrophobicContact CB-CD2 4.03Å; L310-Y395 HydrophobicContact CB-CE2 4.11Å; L310-Y395 HydrophobicContact CD1-CD2 4.49Å; L310-Y395 HydrophobicContact CD2-CD2 3.64Å; L310-Y395 HydrophobicContact CD2-CE2 4.07Å; L310-Y395 HydrophobicContact CD2-CG 4.4Å; L310-Y395 HydrophobicContact CG-CD2 4.24Å; F325-Y395 PolarHBondContact O-N 3.14Å; F326-Y395 AromaticContact CD1-CD1 3.46Å; F326-Y395 HydrophobicContact CD1-CD1 3.46Å; F326-Y395 VanDerWaalsContact CD1-CD1 3.46Å; F326-Y395 HydrophobicContact CD1-CE1 4.2Å; F326-Y395 AromaticContact CD1-CG 3.94Å; F326-Y395 HydrophobicContact CD1-CG 3.94Å; F326-Y395 AromaticContact CE1-CD1 3.17Å; F326-Y395 HydrophobicContact CE1-CD1 3.17Å; F326-Y395 HydrophobicContact CE1-CD2 4.16Å; F326-Y395 AromaticContact CE1-CE1 3.72Å; F326-Y395 HydrophobicContact CE1-CE1 3.72Å; F326-Y395 AromaticContact CE1-CG 3.41Å; F326-Y395 HydrophobicContact CE1-CG 3.41Å; F326-Y395 VanDerWaalsContact CE1-CG 3.41Å; F326-Y395 HydrophobicContact CZ-CD1 4.09Å; F326-Y395 HydrophobicContact CZ-CD2 4.36Å; F326-Y395 AromaticContact CZ-CG 3.86Å; F326-Y395 HydrophobicContact CZ-CG 3.86Å; F335-Y395 HydrophobicContact CE2-CE1 4.34Å; F335-Y395 HydrophobicContact CZ-CE1 4.41Å
396	D	90	Very high	88.2	Confident	0 Å²	0	19.4 Å²	19.4	0%	0	11%	0.109	C	C	.	.	S	Bend	trans	-118.8	139.1	170.8	-67.7	-45.9	0	0	0	110.9	K306 S327 Q394 R407 Y480 Y484	K306-D396 IonicContact NZ-OD1 2.77Å; K306-D396 PolarHBondContact NZ-OD1 2.99Å; K306-D396 VanDerWaalsContact NZ-OD1 3.16Å; S327-D396 WeakPolarHBondContact OG-CB 3.2Å; Q394-D396 PolarHBondContact O-N 3.07Å; D396-R407 PolarHBondContact O-NH1 3.11Å; D396-Y480 WeakPolarHBondContact OD1-CE2 3.13Å; D396-Y484 PolarHBondContact OD1-OH 3.12Å
397	P	90.4	Very high	88.4	Confident	1 Å²	1	19.1 Å²	19.1	1%	0.006	11%	0.107	C	C	.	.			trans	-54	142.2	167.2	20.3	-30.4	0	0	0	111.4	S327 L424 Y431 Y484 F493	S327-P397 PolarHBondContact OG-O 3.38Å; P397-L424 HydrophobicContact CG-CD2 4.47Å; P397-Y431 HydrophobicContact CB-CD1 4.43Å; P397-Y431 HydrophobicContact CB-CE1 3.87Å; P397-Y484 WeakPolarHBondContact CD-OH 3.46Å; P397-Y484 HydrophobicContact CG-CE1 4.42Å; P397-F493 HydrophobicContact CB-CE1 4.12Å; P397-F493 HydrophobicContact CB-CZ 3.78Å; P397-F493 HydrophobicContact CG-CD1 4.3Å; P397-F493 HydrophobicContact CG-CE1 3.48Å; P397-F493 VanDerWaalsContact CG-CE1 3.48Å; P397-F493 HydrophobicContact CG-CZ 3.7Å
398	P	89.8	Confident	88.7	Confident	0 Å²	0	16.7 Å²	16.7	0%	0	9%	0.092	C	C	.	.			trans	-73.1	140.9	-179.9	26.1	-29.5	0	0	0	111.1	S400 A403 F404 Y431 H487	P398-S400 PolarHBondContact O-N 3.26Å; P398-A403 HydrophobicContact CB-CB 3.86Å; P398-F404 HydrophobicContact CG-CB 3.64Å; P398-F404 HydrophobicContact CG-CD2 4.04Å; P398-F404 HydrophobicContact CG-CG 4.35Å; P398-Y431 WeakPolarHBondContact CD-OH 3.26Å; P398-H487 PolarHBondContact O-CE1 3.42Å; P398-H487 PolarHBondContact O-NE2 2.97Å
399	S	84.8	Confident	88.6	Confident	64 Å²	64	12 Å²	12	45%	0.448	7%	0.066	S	C	.	.	S	Bend	trans	-55	-18.7	-177.2	59.4	0	0	0	0	115.5	H487 E488	S399-H487 PolarHBondContact O-ND1 3.29Å; S399-E488 VanDerWaalsContact O-CB 3.24Å; S399-E488 WeakPolarHBondContact O-CB 3.2Å; S399-E488 PolarHBondContact O-N 3.42Å
400	S	84.1	Confident	88.4	Confident	23 Å²	23	11.8 Å²	11.8	16%	0.161	7%	0.065	C	C	.	.	S	Bend	trans	-134.1	151.1	169.7	69	0	0	0	0	112.8	P398 R402 A403 E488	P398-S400 PolarHBondContact O-N 3.26Å; S400-R402 VanDerWaalsContact C-N 3.28Å; S400-R402 PolarHBondContact O-N 3.36Å; S400-A403 PolarHBondContact O-N 2.98Å; S400-E488 WeakPolarHBondContact CA-OE2 3.48Å; S400-E488 VanDerWaalsContact CB-OE2 3.27Å; S400-E488 WeakPolarHBondContact CB-OE2 3.32Å
401	A	84.4	Confident	88.1	Confident	2 Å²	2	9.1 Å²	9.1	2%	0.017	5%	0.05	C	C	.	.	H	α-helix	trans	-60	-37.1	-179.7	0	0	0	0	0	112.6	F404 F434 Q439 E488	A401-F404 WeakPolarHBondContact O-CB 3.32Å; A401-F404 PolarHBondContact O-N 3.31Å; A401-F434 HydrophobicContact CB-CE1 3.7Å; A401-F434 HydrophobicContact CB-CZ 4.14Å; A401-Q439 HydrophobicContact CB-CG 3.88Å; A401-E488 PolarHBondContact N-OE2 2.91Å
402	R	80.1	Confident	87.6	Confident	56 Å²	56	8.4 Å²	8.4	21%	0.211	5%	0.05	C	C	.	.	H	α-helix	trans	-58.6	-49.4	176.6	-58.5	180	-167.1	157.1	-0.9	110.4	D230 E260 S400 F404 V405 H406	D230-R402 IonicContact OD1-NH1 3.58Å; D230-R402 PolarHBondContact OD1-NH1 3.02Å; E260-R402 IonicContact OE2-NH1 3.47Å; E260-R402 PolarHBondContact OE2-NH1 3.41Å; E260-R402 IonicContact OE2-NH2 2.66Å; S400-R402 VanDerWaalsContact C-N 3.28Å; S400-R402 PolarHBondContact O-N 3.36Å; R402-F404 PolarHBondContact O-N 3.38Å; R402-F404 VanDerWaalsContact O-N 3.11Å; R402-V405 WeakPolarHBondContact O-CB 3.4Å; R402-V405 PolarHBondContact O-N 3.19Å; R402-H406 PolarHBondContact O-CD2 3.03Å
403	A	83.9	Confident	86.7	Confident	6 Å²	6	9.7 Å²	9.7	5%	0.05	5%	0.054	C	C	.	.	H	α-helix	trans	-60.3	-24.1	-175.9	0	0	0	0	0	113.8	P398 S400 R407	P398-A403 HydrophobicContact CB-CB 3.86Å; S400-A403 PolarHBondContact O-N 2.98Å; A403-R407 WeakPolarHBondContact O-CB 3.32Å; A403-R407 VanDerWaalsContact O-CG 3.31Å; A403-R407 WeakPolarHBondContact O-CG 3.48Å; A403-R407 PolarHBondContact O-N 2.92Å
404	F	88.3	Confident	85.4	Confident	1 Å²	1	15 Å²	15	0%	0.004	8%	0.081	C	C	.	.	H	α-helix	trans	-56.7	-49.3	169.4	-169.8	-80.4	0	0	0	112.1	Q394 P398 A401 R402 H406 R407 C408 V422 Y431 L435 L443	Q394-F404 VanDerWaalsContact NE2-CZ 3.33Å; P398-F404 HydrophobicContact CG-CB 3.64Å; P398-F404 HydrophobicContact CG-CD2 4.04Å; P398-F404 HydrophobicContact CG-CG 4.35Å; A401-F404 WeakPolarHBondContact O-CB 3.32Å; A401-F404 PolarHBondContact O-N 3.31Å; R402-F404 PolarHBondContact O-N 3.38Å; R402-F404 VanDerWaalsContact O-N 3.11Å; F404-H406 PolarHBondContact O-N 3.07Å; F404-R407 PolarHBondContact O-N 3.21Å; F404-C408 HydrophobicContact CE1-CB 4.32Å; F404-C408 PolarHBondContact O-N 2.67Å; F404-C408 PolarHBondContact O-SG 2.98Å; F404-C408 VanDerWaalsContact O-SG 3.33Å; F404-V422 HydrophobicContact CE2-CB 3.96Å; F404-V422 HydrophobicContact CE2-CG1 4.06Å; F404-V422 HydrophobicContact CE2-CG2 4.26Å; F404-V422 HydrophobicContact CZ-CG1 4.39Å; F404-Y431 HydrophobicContact CD2-CE1 4.38Å; F404-L435 HydrophobicContact CB-CD2 4.02Å; F404-L435 HydrophobicContact CD1-CD1 4.14Å; F404-L435 HydrophobicContact CD1-CD2 4.41Å; F404-L435 HydrophobicContact CD2-CD1 3.63Å; F404-L435 HydrophobicContact CD2-CD2 4.38Å; F404-L435 HydrophobicContact CE1-CD1 4.19Å; F404-L435 HydrophobicContact CE2-CD1 3.65Å; F404-L435 HydrophobicContact CG-CD1 3.9Å; F404-L435 HydrophobicContact CG-CD2 4.01Å; F404-L435 HydrophobicContact CZ-CD1 3.96Å; F404-L443 HydrophobicContact CE1-CD2 4.31Å; F404-L443 HydrophobicContact CE2-CD2 4.26Å; F404-L443 HydrophobicContact CZ-CD2 3.59Å
405	V	83.2	Confident	84	Confident	5 Å²	5	16 Å²	16	3%	0.03	9%	0.092	C	C	.	.	H	α-helix	trans	-63.5	-43.2	-176.6	-175.6	0	0	0	0	110.9	K289 T290 R402 C408 G409 Q439	K289-V405 HydrophobicContact CB-CG1 3.97Å; K289-V405 WeakPolarHBondContact O-CG1 3.5Å; T290-V405 HydrophobicContact CG2-CG1 4.21Å; R402-V405 WeakPolarHBondContact O-CB 3.4Å; R402-V405 PolarHBondContact O-N 3.19Å; V405-C408 PolarHBondContact O-SG 3.46Å; V405-G409 PolarHBondContact O-N 3.21Å; V405-Q439 HydrophobicContact CG2-CB 4Å; V405-Q439 HydrophobicContact CG2-CG 4.34Å
406	H	83.4	Confident	83.2	Confident	1 Å²	1	19.6 Å²	19.6	1%	0.005	11%	0.111	C	C	.	.	H	α-helix	trans	-70.8	-35.4	179.2	-51.9	-101.9	0	0	0	112.4	E224 D226 A381 R382 R402 F404 G409 R410	E224-H406 IonicContact OE2-ND1 2.68Å; D226-H406 IonicContact OD2-CE1 3.51Å; D226-H406 PolarHBondContact OD2-CE1 3.32Å; D226-H406 IonicContact OD2-NE2 3.04Å; D226-H406 PolarHBondContact OD2-NE2 3.08Å; A381-H406 CarbonylContact O-C 3.52Å; A381-H406 WeakPolarHBondContact O-CB 3.44Å; R382-H406 HydrophobicContact CG-CB 3.49Å; R382-H406 VanDerWaalsContact CG-CB 3.49Å; R382-H406 VanDerWaalsContact CZ-NE2 3.31Å; R382-H406 PolarHBondContact NE-CD2 2.87Å; R382-H406 PolarHBondContact NE-CE1 2.99Å; R382-H406 PolarHBondContact NE-ND1 3.5Å; R382-H406 PolarHBondContact NE-NE2 3.15Å; R382-H406 VanDerWaalsContact NE-NE2 3.11Å; R382-H406 PolarHBondContact NH2-NE2 3.49Å; R382-H406 VanDerWaalsContact NH2-NE2 3.12Å; R402-H406 PolarHBondContact O-CD2 3.03Å; F404-H406 PolarHBondContact O-N 3.07Å; H406-G409 CarbonylContact O-C 3.59Å; H406-R410 PolarHBondContact O-NE 3.42Å; H406-R410 PolarHBondContact O-NH2 3.14Å
407	R	89.2	Confident	83	Confident	0 Å²	0	25.7 Å²	25.7	0%	0	14%	0.14	C	C	.	.	H	α-helix	trans	-60.5	-57	172.6	-79.1	177.5	177.3	-171	2.1	111	F325 D378 A381 V392 Q394 D396 A403 F404 G409 R410	F325-R407 HydrophobicContact CD1-CG 4.02Å; F325-R407 HydrophobicContact CD2-CB 4.23Å; F325-R407 HydrophobicContact CD2-CG 3.99Å; F325-R407 HydrophobicContact CE1-CG 4.1Å; F325-R407 HydrophobicContact CE2-CB 4.16Å; F325-R407 HydrophobicContact CE2-CG 4.07Å; F325-R407 HydrophobicContact CG-CG 3.97Å; F325-R407 HydrophobicContact CZ-CG 4.13Å; D378-R407 IonicContact OD1-CZ 2.7Å; D378-R407 IonicContact OD1-NE 2.73Å; D378-R407 PolarHBondContact OD1-NE 2.74Å; D378-R407 IonicContact OD1-NH2 3.79Å; D378-R407 PolarHBondContact OD1-NH2 3.05Å; D378-R407 IonicContact OD2-CZ 3.64Å; D378-R407 IonicContact OD2-NE 3.4Å; D378-R407 IonicContact OD2-NH2 3.62Å; D378-R407 PolarHBondContact OD2-NH2 2.81Å; A381-R407 HydrophobicContact CB-CG 3.61Å; V392-R407 WeakPolarHBondContact CG1-O 3.45Å; Q394-R407 VanDerWaalsContact OE1-NH1 3.11Å; D396-R407 PolarHBondContact O-NH1 3.11Å; A403-R407 WeakPolarHBondContact O-CB 3.32Å; A403-R407 VanDerWaalsContact O-CG 3.31Å; A403-R407 WeakPolarHBondContact O-CG 3.48Å; A403-R407 PolarHBondContact O-N 2.92Å; F404-R407 PolarHBondContact O-N 3.21Å; R407-G409 PolarHBondContact O-N 3.22Å; R407-R410 VanDerWaalsContact O-CB 3.32Å; R407-R410 WeakPolarHBondContact O-CB 3.45Å; R407-R410 WeakPolarHBondContact O-CG 3.3Å; R407-R410 PolarHBondContact O-N 3.25Å
408	C	87.3	Confident	82.9	Confident	0 Å²	0	25.8 Å²	25.8	0%	0	14%	0.14	C	C	.	.	H	α-helix	trans	-64.4	-32.3	-178.4	70.9	0	0	0	0	111.4	L294 F404 V405 R410 T411 A420	L294-C408 HydrophobicContact CD2-CB 3.79Å; L294-C408 VanDerWaalsContact CD2-SG 3.6Å; F404-C408 HydrophobicContact CE1-CB 4.32Å; F404-C408 PolarHBondContact O-N 2.67Å; F404-C408 PolarHBondContact O-SG 2.98Å; F404-C408 VanDerWaalsContact O-SG 3.33Å; V405-C408 PolarHBondContact O-SG 3.46Å; C408-R410 PolarHBondContact O-N 2.72Å; C408-T411 WeakPolarHBondContact O-CG2 3.38Å; C408-T411 PolarHBondContact O-N 2.81Å; C408-A420 HydrophobicContact CB-CB 3.62Å
409	G	82.4	Confident	83.1	Confident	0 Å²	0	27.8 Å²	27.8	0%	0	15%	0.151	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68.5	16.8	166.7	0	0	0	0	0	116.9	T107 V405 H406 R407 R413	T107-G409 WeakPolarHBondContact OG1-CA 3.41Å; T107-G409 PolarHBondContact OG1-O 3.43Å; V405-G409 PolarHBondContact O-N 3.21Å; H406-G409 CarbonylContact O-C 3.59Å; R407-G409 PolarHBondContact O-N 3.22Å; G409-R413 PolarHBondContact O-NE 3.34Å; G409-R413 VanDerWaalsContact O-NE 3.15Å; G409-R413 PolarHBondContact O-NH2 3.28Å
410	R	86.5	Confident	83.5	Confident	4 Å²	4	24.8 Å²	24.8	2%	0.015	13%	0.13	C	C	.	.	T	Hydrogen-bonded Turn	trans	-86.4	-14.7	162	-64.8	-49.1	100.7	173.8	6.8	113.4	L323 F325 M380 A381 R382 G383 I384 V392 H406 R407 C408	L323-R410 HydrophobicContact CD1-CB 3.42Å; L323-R410 VanDerWaalsContact CD1-CB 3.42Å; L323-R410 HydrophobicContact CD1-CG 3.84Å; F325-R410 HydrophobicContact CE2-CG 4.37Å; F325-R410 HydrophobicContact CZ-CG 4.16Å; M380-R410 WeakPolarHBondContact O-CD 3.41Å; A381-R410 PolarHBondContact O-NE 3.31Å; A381-R410 VanDerWaalsContact O-NE 3.09Å; A381-R410 PolarHBondContact O-NH2 2.92Å; R382-R410 VanDerWaalsContact C-NH1 3.31Å; G383-R410 VanDerWaalsContact N-NH1 3.2Å; G383-R410 PolarHBondContact O-NH1 3.36Å; I384-R410 PolarHBondContact O-NH1 3.28Å; V392-R410 HydrophobicContact CG2-CB 3.95Å; H406-R410 PolarHBondContact O-NE 3.42Å; H406-R410 PolarHBondContact O-NH2 3.14Å; R407-R410 VanDerWaalsContact O-CB 3.32Å; R407-R410 WeakPolarHBondContact O-CB 3.45Å; R407-R410 WeakPolarHBondContact O-CG 3.3Å; R407-R410 PolarHBondContact O-N 3.25Å; C408-R410 PolarHBondContact O-N 2.72Å
411	T	87.5	Confident	84	Confident	3 Å²	3	23.7 Å²	23.7	2%	0.018	12%	0.123	C	C	.	.	S	Bend	trans	-114.2	-176.7	168.6	-176	0	0	0	0	110.3	L294 V389 V392 C408 R413 G418	L294-T411 HydrophobicContact CD1-CG2 3.55Å; V389-T411 WeakPolarHBondContact O-CB 3.37Å; V389-T411 PolarHBondContact O-OG1 3.19Å; V392-T411 HydrophobicContact CB-CG2 4.42Å; V392-T411 HydrophobicContact CG2-CG2 3.7Å; C408-T411 WeakPolarHBondContact O-CG2 3.38Å; C408-T411 PolarHBondContact O-N 2.81Å; T411-R413 PolarHBondContact O-N 2.9Å; T411-G418 WeakPolarHBondContact OG1-CA 3.24Å
412	A	82.9	Confident	84.5	Confident	8 Å²	8	23.7 Å²	23.7	7%	0.066	12%	0.122	C	C	.	.	S	Bend	trans	53.5	46.8	-176.5	0	0	0	0	0	114.3	P291 L294 N416	P291-A412 HydrophobicContact CB-CB 4.34Å; L294-A412 HydrophobicContact CB-CB 3.75Å; L294-A412 HydrophobicContact CD1-CB 4.13Å; A412-N416 CarbonylContact C-O 3.58Å; A412-N416 VanDerWaalsContact CA-O 3.31Å; A412-N416 WeakPolarHBondContact CA-O 3.43Å
413	R	76.6	Confident	85.2	Confident	26 Å²	26	21 Å²	21	10%	0.098	11%	0.112	C	C	.	.			trans	-99.5	148.2	-175.5	-65.1	-170.4	161	-144.5	-6.4	112.7	I384 D385 G409 T411 G415 N416	I384-R413 PolarHBondContact O-NH1 2.83Å; D385-R413 VanDerWaalsContact OD1-CD 3.29Å; D385-R413 WeakPolarHBondContact OD1-CD 3.22Å; D385-R413 IonicContact OD1-CZ 3.81Å; D385-R413 IonicContact OD1-NE 3.83Å; D385-R413 IonicContact OD1-NH1 2.87Å; D385-R413 PolarHBondContact OD1-NH1 3.03Å; G409-R413 PolarHBondContact O-NE 3.34Å; G409-R413 VanDerWaalsContact O-NE 3.15Å; G409-R413 PolarHBondContact O-NH2 3.28Å; T411-R413 PolarHBondContact O-N 2.9Å; R413-G415 PolarHBondContact O-N 3.32Å; R413-G415 VanDerWaalsContact O-N 3.15Å; R413-N416 WeakPolarHBondContact O-CB 3.45Å; R413-N416 PolarHBondContact O-N 3.19Å
414	I	68.6	Low	85.6	Confident	111 Å²	111	20.7 Å²	20.7	57%	0.569	11%	0.11	S	C	*	.	T	Hydrogen-bonded Turn	trans	46.4	48.1	173.1	-42.5	179.5	0	0	0	111.3	N416	I414-N416 VanDerWaalsContact C-N 3.29Å; I414-N416 PolarHBondContact O-N 3.01Å
415	G	67.2	Low	85.6	Confident	21 Å²	21	21.3 Å²	21.3	22%	0.216	11%	0.113	C	C	.	.	T	Hydrogen-bonded Turn	trans	77.8	-6.4	179.6	0	0	0	0	0	117	R293 R413	R293-G415 WeakPolarHBondContact CD-O 3.28Å; R293-G415 PolarHBondContact NE-O 2.96Å; R293-G415 VanDerWaalsContact NE-O 3.14Å; R293-G415 PolarHBondContact NH1-O 3.33Å; R413-G415 PolarHBondContact O-N 3.32Å; R413-G415 VanDerWaalsContact O-N 3.15Å
416	N	77.2	Confident	85.9	Confident	79 Å²	79	24.3 Å²	24.3	42%	0.422	13%	0.132	S	C	.	.			trans	-66.8	155.2	171.6	-79.7	-19.5	0	0	0	111.8	D388 A412 R413 I414	D388-N416 PolarHBondContact OD1-ND2 3.01Å; D388-N416 VanDerWaalsContact OD1-ND2 3.09Å; A412-N416 CarbonylContact C-O 3.58Å; A412-N416 VanDerWaalsContact CA-O 3.31Å; A412-N416 WeakPolarHBondContact CA-O 3.43Å; R413-N416 WeakPolarHBondContact O-CB 3.45Å; R413-N416 PolarHBondContact O-N 3.19Å; I414-N416 VanDerWaalsContact C-N 3.29Å; I414-N416 PolarHBondContact O-N 3.01Å
417	H	84.6	Confident	85.9	Confident	129 Å²	129	29.4 Å²	29.4	60%	0.597	16%	0.158	S	C	*	.			trans	-79.4	156.6	167.1	-76.5	-83.8	0	0	0	111.3	R293	R293-H417 PolarHBondContact NE-NE2 3.12Å; R293-H417 PolarHBondContact NH2-NE2 2.91Å
418	G	89.5	Confident	85.9	Confident	2 Å²	2	29.8 Å²	29.8	2%	0.021	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-161.9	152.9	179.7	0	0	0	0	0	113.3	R293 L294 S295 T411	R293-G418 PolarHBondContact O-N 3.49Å; L294-G418 WeakPolarHBondContact CA-O 3.41Å; S295-G418 PolarHBondContact N-O 2.85Å; T411-G418 WeakPolarHBondContact OG1-CA 3.24Å
419	N	92.5	Very high	86	Confident	43 Å²	43	33 Å²	33	23%	0.23	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	139.9	179.8	-56.6	-59.9	0	0	0	110.9	S295 Y297 N390 W391 V392	S295-N419 CarbonylContact O-C 3.6Å; S295-N419 WeakPolarHBondContact O-CA 3.38Å; Y297-N419 HydrophobicContact CD2-CB 4.49Å; Y297-N419 HydrophobicContact CE2-CB 4.22Å; N390-N419 PolarHBondContact O-N 3.3Å; W391-N419 CarbonylContact C-O 3.6Å; W391-N419 VanDerWaalsContact CA-O 3.3Å; W391-N419 WeakPolarHBondContact CA-O 3.17Å; W391-N419 HydrophobicContact CD2-CB 3.56Å; W391-N419 HydrophobicContact CE3-CB 3.38Å; W391-N419 HydrophobicContact CG-CB 4.39Å; W391-N419 HydrophobicContact CH2-CB 3.62Å; W391-N419 HydrophobicContact CZ2-CB 3.79Å; W391-N419 HydrophobicContact CZ3-CB 3.41Å; W391-N419 VanDerWaalsContact CZ3-CB 3.41Å; V392-N419 PolarHBondContact N-O 3.19Å
420	A	94.2	Very high	86.4	Confident	1 Å²	1	36.4 Å²	36.4	1%	0.008	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	139.8	169.8	0	0	0	0	0	110.3	L294 S295 Y297 V392 C408	L294-A420 HydrophobicContact CD1-CB 4.22Å; S295-A420 PolarHBondContact O-N 3.48Å; Y297-A420 WeakPolarHBondContact CA-O 3.48Å; Y297-A420 WeakPolarHBondContact CB-O 3.27Å; Y297-A420 PolarHBondContact N-O 3.37Å; V392-A420 HydrophobicContact CB-CB 4.19Å; V392-A420 CarbonylContact O-C 3.52Å; V392-A420 VanDerWaalsContact O-CA 3.25Å; V392-A420 WeakPolarHBondContact O-CA 3.49Å; C408-A420 HydrophobicContact CB-CB 3.62Å
421	L	94.9	Very high	86.6	Confident	0 Å²	0	36.2 Å²	36.2	0%	0	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.6	125.8	178.4	176.4	64	0	0	0	110.1	Y297 T299 F313 W391 V392 L393 Q394 F423 M446	Y297-L421 WeakPolarHBondContact O-CA 3.46Å; T299-L421 HydrophobicContact CG2-CD1 4.05Å; T299-L421 HydrophobicContact CG2-CD2 4.46Å; T299-L421 HydrophobicContact CG2-CG 4.43Å; F313-L421 HydrophobicContact CD2-CD2 3.95Å; F313-L421 HydrophobicContact CE2-CD2 3.93Å; W391-L421 HydrophobicContact CE3-CB 4.37Å; W391-L421 HydrophobicContact CZ3-CB 4.19Å; V392-L421 PolarHBondContact O-N 3.16Å; L393-L421 CarbonylContact C-O 3.53Å; L393-L421 WeakPolarHBondContact CA-O 3.38Å; L393-L421 HydrophobicContact CD2-CB 3.88Å; L393-L421 HydrophobicContact CD2-CD2 4.25Å; Q394-L421 PolarHBondContact N-O 2.89Å; L421-F423 HydrophobicContact CD2-CE2 3.87Å; L421-F423 HydrophobicContact CD2-CZ 3.84Å; L421-F423 HydrophobicContact CG-CE2 4.14Å; L421-M446 HydrophobicContact CD1-CB 4.18Å; L421-M446 HydrophobicContact CD1-SD 3.83Å; L421-M446 HydrophobicContact CD2-SD 3.75Å; L421-M446 HydrophobicContact CG-SD 4.4Å
422	V	95	Very high	86.7	Confident	1 Å²	1	36.6 Å²	36.6	1%	0.006	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.5	135.3	170.6	64.3	0	0	0	0	111.8	Y297 Y298 T299 Q394 F404 L424 L443	Y297-V422 PolarHBondContact O-N 3.2Å; Y298-V422 WeakPolarHBondContact CA-O 3.27Å; T299-V422 PolarHBondContact N-O 3.01Å; Q394-V422 HydrophobicContact CB-CB 4.15Å; Q394-V422 HydrophobicContact CB-CG2 4.05Å; F404-V422 HydrophobicContact CE2-CB 3.96Å; F404-V422 HydrophobicContact CE2-CG1 4.06Å; F404-V422 HydrophobicContact CE2-CG2 4.26Å; F404-V422 HydrophobicContact CZ-CG1 4.39Å; V422-L424 HydrophobicContact CG1-CD1 4.41Å; V422-L424 HydrophobicContact CG1-CD2 4.49Å; V422-L424 HydrophobicContact CG1-CG 4.24Å; V422-L424 HydrophobicContact CG2-CD2 3.86Å; V422-L424 HydrophobicContact CG2-CG 4.31Å; V422-L443 HydrophobicContact CG1-CD2 3.72Å
423	F	93.5	Very high	87	Confident	0 Å²	0	41.4 Å²	41.4	0%	0	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.8	110.7	175.9	-68.5	-101.3	0	0	0	109.9	T299 K306 N309 L310 Q394 L421	T299-F423 HydrophobicContact CG2-CD1 3.55Å; T299-F423 HydrophobicContact CG2-CE1 3.84Å; T299-F423 HydrophobicContact CG2-CG 4Å; K306-F423 WeakPolarHBondContact CE-O 3.35Å; K306-F423 HydrophobicContact CG-CB 4.2Å; K306-F423 PolarHBondContact NZ-O 3.01Å; N309-F423 HydrophobicContact CB-CE1 4.03Å; L310-F423 HydrophobicContact CB-CZ 4.39Å; L310-F423 HydrophobicContact CD1-CE2 4.17Å; L310-F423 HydrophobicContact CD1-CZ 4.22Å; Q394-F423 PolarHBondContact O-N 2.88Å; L421-F423 HydrophobicContact CD2-CE2 3.87Å; L421-F423 HydrophobicContact CD2-CZ 3.84Å; L421-F423 HydrophobicContact CG-CE2 4.14Å
424	L	92.1	Very high	87.6	Confident	0 Å²	0	42.5 Å²	42.5	0%	0	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	147.7	-179.6	-60.6	178.9	0	0	0	111	Y298 T299 I300 C301 P397 V422 E428 Y431 V432	Y298-L424 HydrophobicContact CD2-CD1 4.26Å; T299-L424 PolarHBondContact O-N 2.93Å; I300-L424 WeakPolarHBondContact CA-O 3.33Å; C301-L424 PolarHBondContact N-O 3.18Å; P397-L424 HydrophobicContact CG-CD2 4.47Å; V422-L424 HydrophobicContact CG1-CD1 4.41Å; V422-L424 HydrophobicContact CG1-CD2 4.49Å; V422-L424 HydrophobicContact CG1-CG 4.24Å; V422-L424 HydrophobicContact CG2-CD2 3.86Å; V422-L424 HydrophobicContact CG2-CG 4.31Å; L424-E428 WeakPolarHBondContact CA-OE2 3.11Å; L424-E428 HydrophobicContact CB-CB 4.11Å; L424-E428 HydrophobicContact CD2-CB 4.27Å; L424-Y431 HydrophobicContact CD2-CD1 3.99Å; L424-V432 HydrophobicContact CD1-CG2 3.66Å
425	L	89.8	Confident	88.5	Confident	13 Å²	13	37.3 Å²	37.3	7%	0.068	20%	0.202	C	C	.	.			trans	-76.2	160.6	165	-55.4	-177.7	0	0	0	110.1	C301 A303 K306 M427 E428	C301-L425 WeakPolarHBondContact O-CD2 3.3Å; A303-L425 HydrophobicContact CB-CD2 3.86Å; K306-L425 HydrophobicContact CD-CD2 4.35Å; L425-M427 PolarHBondContact O-N 2.97Å; L425-E428 HydrophobicContact CB-CG 3.95Å; L425-E428 PolarHBondContact N-OE2 3.28Å; L425-E428 WeakPolarHBondContact O-CB 3.27Å; L425-E428 PolarHBondContact O-N 3.33Å
426	P	88.3	Confident	89.4	Confident	68 Å²	68	38.7 Å²	38.7	44%	0.442	21%	0.208	S	C	.	.	G	3₁₀ helix	trans	-55.9	-36.5	-179.8	-27.3	36.2	0	0	0	114	I300 E428	I300-P426 HydrophobicContact CG2-CB 4.19Å; I300-P426 HydrophobicContact CG2-CG 3.96Å; P426-E428 PolarHBondContact O-N 2.94Å
427	M	84.8	Confident	89.7	Confident	108 Å²	108	40.9 Å²	40.9	53%	0.532	22%	0.219	S	C	.	.	G	3₁₀ helix	trans	-73.8	-8.9	178.8	-47	-56.4	-86.9	0	0	113.2	L425 D499	L425-M427 PolarHBondContact O-N 2.97Å; M427-D499 HydrophobicContact CB-CB 4.41Å; M427-D499 HydrophobicContact CE-CB 3.93Å; M427-D499 VanDerWaalsContact CE-OD1 3.3Å; M427-D499 WeakPolarHBondContact CE-OD1 3.49Å; M427-D499 HydrophobicContact CG-CB 4.13Å
428	E	89	Confident	89.5	Confident	8 Å²	8	38.9 Å²	38.9	4%	0.037	21%	0.212	C	C	.	.	G	3₁₀ helix	trans	-101.5	-2	-175	-60	171.7	172.2	0	0	112.9	L424 L425 P426 P430 Y431 Y484 F493	L424-E428 WeakPolarHBondContact CA-OE2 3.11Å; L424-E428 HydrophobicContact CB-CB 4.11Å; L424-E428 HydrophobicContact CD2-CB 4.27Å; L425-E428 HydrophobicContact CB-CG 3.95Å; L425-E428 PolarHBondContact N-OE2 3.28Å; L425-E428 WeakPolarHBondContact O-CB 3.27Å; L425-E428 PolarHBondContact O-N 3.33Å; P426-E428 PolarHBondContact O-N 2.94Å; E428-P430 VanDerWaalsContact C-N 3.27Å; E428-Y431 WeakPolarHBondContact O-CB 3.39Å; E428-Y431 PolarHBondContact O-N 3.27Å; E428-Y484 WeakPolarHBondContact OE1-CE1 3.38Å; E428-F493 HydrophobicContact CB-CE1 4Å; E428-F493 VanDerWaalsContact CD-CE1 3.5Å; E428-F493 HydrophobicContact CG-CD1 3.82Å; E428-F493 HydrophobicContact CG-CE1 3.61Å
429	E	89.4	Confident	88.9	Confident	69 Å²	69	39.7 Å²	39.7	32%	0.322	22%	0.216	S	C	.	.	T	Hydrogen-bonded Turn	trans	-51.7	-35	175.2	-171.1	157.4	-138.5	0	0	114.2	Y298 I300 Y431 V432 K445	Y298-E429 HydrophobicContact CE2-CG 4.47Å; Y298-E429 PolarHBondContact OH-OE1 2.95Å; I300-E429 HydrophobicContact CD1-CB 3.82Å; I300-E429 HydrophobicContact CD1-CG 3.81Å; I300-E429 VanDerWaalsContact CD1-OE1 3.25Å; I300-E429 WeakPolarHBondContact CD1-OE1 3.46Å; I300-E429 WeakPolarHBondContact CD1-OE2 3.23Å; E429-Y431 PolarHBondContact O-N 2.85Å; E429-V432 WeakPolarHBondContact O-CB 3.27Å; E429-V432 PolarHBondContact O-N 3.14Å; E429-K445 IonicContact OE1-NZ 2.78Å; E429-K445 PolarHBondContact OE1-NZ 3.45Å; E429-K445 IonicContact OE2-NZ 2.82Å
430	P	90.7	Very high	88.3	Confident	71 Å²	71	42.2 Å²	42.2	46%	0.461	22%	0.224	S	C	.	.	H	α-helix	trans	-56.7	-20.7	172	-27.9	37.1	0	0	0	115.4	E428 V432 N433 F434	E428-P430 VanDerWaalsContact C-N 3.27Å; P430-V432 PolarHBondContact O-N 3.42Å; P430-N433 PolarHBondContact O-N 3.33Å; P430-F434 PolarHBondContact O-N 2.89Å; P430-F434 VanDerWaalsContact O-N 3.17Å
431	Y	90.5	Very high	87.7	Confident	0 Å²	0	42.1 Å²	42.1	0%	0	22%	0.224	C	C	.	.	H	α-helix	trans	-63.2	-29	174.6	-171	-118.8	0	0	0	112.5	P397 P398 F404 L424 E428 E429 F434 L435 I492 F493	P397-Y431 HydrophobicContact CB-CD1 4.43Å; P397-Y431 HydrophobicContact CB-CE1 3.87Å; P398-Y431 WeakPolarHBondContact CD-OH 3.26Å; F404-Y431 HydrophobicContact CD2-CE1 4.38Å; L424-Y431 HydrophobicContact CD2-CD1 3.99Å; E428-Y431 WeakPolarHBondContact O-CB 3.39Å; E428-Y431 PolarHBondContact O-N 3.27Å; E429-Y431 PolarHBondContact O-N 2.85Å; Y431-F434 AromaticContact CD2-CD1 3.96Å; Y431-F434 HydrophobicContact CD2-CD1 3.96Å; Y431-F434 HydrophobicContact CE2-CD1 4.03Å; Y431-F434 HydrophobicContact CE2-CE1 4.31Å; Y431-F434 PolarHBondContact O-N 3.38Å; Y431-L435 HydrophobicContact CD1-CD1 3.84Å; Y431-L435 HydrophobicContact CD1-CG 4.22Å; Y431-L435 HydrophobicContact CE1-CD1 3.54Å; Y431-L435 HydrophobicContact CE1-CD2 4.33Å; Y431-L435 HydrophobicContact CE1-CG 3.97Å; Y431-L435 HydrophobicContact CE2-CD2 4.44Å; Y431-L435 HydrophobicContact CE2-CG 4.41Å; Y431-L435 WeakPolarHBondContact O-CG 3.24Å; Y431-L435 PolarHBondContact O-N 3.12Å; Y431-I492 HydrophobicContact CD2-CD1 4.35Å; Y431-F493 HydrophobicContact CD1-CZ 4.07Å; Y431-F493 AromaticContact CD2-CE2 3.57Å; Y431-F493 HydrophobicContact CD2-CE2 3.57Å; Y431-F493 AromaticContact CD2-CZ 3.63Å; Y431-F493 HydrophobicContact CD2-CZ 3.63Å; Y431-F493 HydrophobicContact CE1-CZ 4.36Å; Y431-F493 AromaticContact CE2-CE2 3.72Å; Y431-F493 HydrophobicContact CE2-CE2 3.72Å; Y431-F493 AromaticContact CE2-CZ 3.96Å; Y431-F493 HydrophobicContact CE2-CZ 3.96Å; Y431-F493 HydrophobicContact CG-CE2 4.13Å; Y431-F493 AromaticContact CG-CZ 3.68Å; Y431-F493 HydrophobicContact CG-CZ 3.68Å
432	V	90.3	Very high	87.1	Confident	10 Å²	10	44.8 Å²	44.8	6%	0.061	24%	0.241	C	C	.	.	H	α-helix	trans	-63.2	-48.3	176.6	177.6	0	0	0	0	110.7	Y298 L424 E429 P430 F434 L435 S436 L443	Y298-V432 HydrophobicContact CD1-CG1 4.15Å; Y298-V432 HydrophobicContact CD1-CG2 3.9Å; Y298-V432 HydrophobicContact CD2-CG2 3.75Å; Y298-V432 HydrophobicContact CE1-CG1 3.89Å; Y298-V432 HydrophobicContact CE1-CG2 4.04Å; Y298-V432 HydrophobicContact CE2-CG2 3.91Å; Y298-V432 HydrophobicContact CG-CG2 3.73Å; L424-V432 HydrophobicContact CD1-CG2 3.66Å; E429-V432 WeakPolarHBondContact O-CB 3.27Å; E429-V432 PolarHBondContact O-N 3.14Å; P430-V432 PolarHBondContact O-N 3.42Å; V432-F434 VanDerWaalsContact C-N 3.34Å; V432-F434 PolarHBondContact O-N 3.36Å; V432-L435 PolarHBondContact O-N 2.79Å; V432-S436 WeakPolarHBondContact O-CB 3.15Å; V432-S436 PolarHBondContact O-N 2.82Å; V432-L443 HydrophobicContact CG1-CB 4.23Å; V432-L443 HydrophobicContact CG1-CD1 4.04Å
433	N	88.7	Confident	86.9	Confident	109 Å²	109	45.7 Å²	45.7	58%	0.583	25%	0.246	S	C	*	.	H	α-helix	trans	-63.9	-41.3	177.5	-67.5	-14.4	0	0	0	111.1	P430 S436 I437	P430-N433 PolarHBondContact O-N 3.33Å; N433-S436 PolarHBondContact O-N 3.08Å; N433-I437 WeakPolarHBondContact O-CG1 3.03Å; N433-I437 PolarHBondContact O-N 3.29Å
434	F	89	Confident	86.7	Confident	50 Å²	50	51.5 Å²	51.5	22%	0.219	27%	0.273	C	S	.	.	H	α-helix	trans	-62.3	-42.6	175.8	173	-97.3	0	0	0	113	A401 P430 Y431 V432 I437 N438 C489 I492	A401-F434 HydrophobicContact CB-CE1 3.7Å; A401-F434 HydrophobicContact CB-CZ 4.14Å; P430-F434 PolarHBondContact O-N 2.89Å; P430-F434 VanDerWaalsContact O-N 3.17Å; Y431-F434 AromaticContact CD2-CD1 3.96Å; Y431-F434 HydrophobicContact CD2-CD1 3.96Å; Y431-F434 HydrophobicContact CE2-CD1 4.03Å; Y431-F434 HydrophobicContact CE2-CE1 4.31Å; Y431-F434 PolarHBondContact O-N 3.38Å; V432-F434 VanDerWaalsContact C-N 3.34Å; V432-F434 PolarHBondContact O-N 3.36Å; F434-I437 PolarHBondContact O-N 2.59Å; F434-N438 HydrophobicContact CD2-CB 4.32Å; F434-N438 WeakPolarHBondContact CD2-OD1 3.32Å; F434-N438 HydrophobicContact CE2-CB 4.03Å; F434-N438 VanDerWaalsContact CE2-CG 3.46Å; F434-N438 HydrophobicContact CZ-CB 4.21Å; F434-N438 VanDerWaalsContact O-CB 3.32Å; F434-N438 WeakPolarHBondContact O-CB 3.1Å; F434-N438 PolarHBondContact O-N 3.09Å; F434-N438 PolarHBondContact O-OD1 3.12Å; F434-C489 WeakPolarHBondContact CE1-SG 3.42Å; F434-I492 HydrophobicContact CB-CD1 4.14Å; F434-I492 HydrophobicContact CG-CD1 4.33Å
435	L	87.3	Confident	86.8	Confident	1 Å²	1	57.4 Å²	57.4	1%	0.005	30%	0.299	C	S	.	.	H	α-helix	trans	-64.5	-40.5	173.6	-74.2	177.7	0	0	0	112.1	F404 Y431 V432 I437 Q439 K440 C441 L443	F404-L435 HydrophobicContact CB-CD2 4.02Å; F404-L435 HydrophobicContact CD1-CD1 4.14Å; F404-L435 HydrophobicContact CD1-CD2 4.41Å; F404-L435 HydrophobicContact CD2-CD1 3.63Å; F404-L435 HydrophobicContact CD2-CD2 4.38Å; F404-L435 HydrophobicContact CE1-CD1 4.19Å; F404-L435 HydrophobicContact CE2-CD1 3.65Å; F404-L435 HydrophobicContact CG-CD1 3.9Å; F404-L435 HydrophobicContact CG-CD2 4.01Å; F404-L435 HydrophobicContact CZ-CD1 3.96Å; Y431-L435 HydrophobicContact CD1-CD1 3.84Å; Y431-L435 HydrophobicContact CD1-CG 4.22Å; Y431-L435 HydrophobicContact CE1-CD1 3.54Å; Y431-L435 HydrophobicContact CE1-CD2 4.33Å; Y431-L435 HydrophobicContact CE1-CG 3.97Å; Y431-L435 HydrophobicContact CE2-CD2 4.44Å; Y431-L435 HydrophobicContact CE2-CG 4.41Å; Y431-L435 WeakPolarHBondContact O-CG 3.24Å; Y431-L435 PolarHBondContact O-N 3.12Å; V432-L435 PolarHBondContact O-N 2.79Å; L435-I437 VanDerWaalsContact C-N 3.34Å; L435-I437 PolarHBondContact O-N 3.34Å; L435-Q439 HydrophobicContact CD2-CG 4.47Å; L435-Q439 CarbonylContact O-C 3.6Å; L435-Q439 PolarHBondContact O-N 3.14Å; L435-Q439 VanDerWaalsContact O-N 3.11Å; L435-K440 PolarHBondContact O-N 3.37Å; L435-C441 CarbonylContact C-O 3.52Å; L435-C441 PolarHBondContact O-N 2.66Å; L435-C441 VanDerWaalsContact O-N 3.14Å; L435-L443 HydrophobicContact CB-CD1 3.85Å; L435-L443 HydrophobicContact CD1-CD1 3.82Å; L435-L443 HydrophobicContact CD1-CD2 4.29Å
436	S	85.7	Confident	86.8	Confident	51 Å²	51	58.8 Å²	58.8	36%	0.357	31%	0.305	S	S	.	.	H	α-helix	trans	-64.4	-35.8	177.9	-166.3	0	0	0	0	112.6	V432 N433 K440 C441	V432-S436 WeakPolarHBondContact O-CB 3.15Å; V432-S436 PolarHBondContact O-N 2.82Å; N433-S436 PolarHBondContact O-N 3.08Å; S436-K440 VanDerWaalsContact O-CA 3.31Å; S436-K440 WeakPolarHBondContact O-CA 3.33Å; S436-C441 WeakPolarHBondContact CA-O 3.48Å; S436-C441 PolarHBondContact N-O 3.23Å
437	I	83.1	Confident	86.6	Confident	125 Å²	125	59.8 Å²	59.8	64%	0.641	31%	0.314	S	S	*	.	H	α-helix	trans	-83.6	-58.7	178.7	-64.5	165.3	0	0	0	110.8	N433 F434 L435	N433-I437 WeakPolarHBondContact O-CG1 3.03Å; N433-I437 PolarHBondContact O-N 3.29Å; F434-I437 PolarHBondContact O-N 2.59Å; L435-I437 VanDerWaalsContact C-N 3.34Å; L435-I437 PolarHBondContact O-N 3.34Å
438	N	80.5	Confident	86.3	Confident	86 Å²	86	59.7 Å²	59.7	46%	0.46	32%	0.321	S	S	.	.	H	α-helix	trans	-80.4	-26	-166.6	-66.7	62.9	0	0	0	113.8	F434	F434-N438 HydrophobicContact CD2-CB 4.32Å; F434-N438 WeakPolarHBondContact CD2-OD1 3.32Å; F434-N438 HydrophobicContact CE2-CB 4.03Å; F434-N438 VanDerWaalsContact CE2-CG 3.46Å; F434-N438 HydrophobicContact CZ-CB 4.21Å; F434-N438 VanDerWaalsContact O-CB 3.32Å; F434-N438 WeakPolarHBondContact O-CB 3.1Å; F434-N438 PolarHBondContact O-N 3.09Å; F434-N438 PolarHBondContact O-OD1 3.12Å
439	Q	78.3	Confident	86	Confident	20 Å²	20	60.1 Å²	60.1	9%	0.093	32%	0.323	C	S	.	.	S	Bend	trans	-116.2	1.4	176.3	-58.4	-53.7	-27.3	0	0	113.8	A401 V405 L435 C441	A401-Q439 HydrophobicContact CB-CG 3.88Å; V405-Q439 HydrophobicContact CG2-CB 4Å; V405-Q439 HydrophobicContact CG2-CG 4.34Å; L435-Q439 HydrophobicContact CD2-CG 4.47Å; L435-Q439 CarbonylContact O-C 3.6Å; L435-Q439 PolarHBondContact O-N 3.14Å; L435-Q439 VanDerWaalsContact O-N 3.11Å; Q439-C441 HydrophobicContact CB-CB 4.37Å; Q439-C441 PolarHBondContact O-N 3.48Å
440	K	79.3	Confident	85.4	Confident	95 Å²	95	64.7 Å²	64.7	41%	0.413	34%	0.342	S	S	.	.			trans	52.8	41	-176.9	-60.4	178.3	176.4	178.9	0	111.3	T287 Q288 L435 S436 P442	T287-K440 WeakPolarHBondContact O-CB 3.44Å; T287-K440 WeakPolarHBondContact O-CD 3.1Å; T287-K440 PolarHBondContact OG1-NZ 2.94Å; Q288-K440 WeakPolarHBondContact CA-O 3.36Å; Q288-K440 WeakPolarHBondContact CG-O 3.38Å; L435-K440 PolarHBondContact O-N 3.37Å; S436-K440 VanDerWaalsContact O-CA 3.31Å; S436-K440 WeakPolarHBondContact O-CA 3.33Å; K440-P442 WeakPolarHBondContact O-CD 3.48Å
441	C	80.8	Confident	84.8	Confident	0 Å²	0	68.2 Å²	68.2	0%	0	36%	0.357	C	S	.	.			trans	-119.6	87.9	-177.9	-173.9	0	0	0	0	108.9	L435 S436 Q439 L443	L435-C441 CarbonylContact C-O 3.52Å; L435-C441 PolarHBondContact O-N 2.66Å; L435-C441 VanDerWaalsContact O-N 3.14Å; S436-C441 WeakPolarHBondContact CA-O 3.48Å; S436-C441 PolarHBondContact N-O 3.23Å; Q439-C441 HydrophobicContact CB-CB 4.37Å; Q439-C441 PolarHBondContact O-N 3.48Å; C441-L443 VanDerWaalsContact O-CD1 3.28Å; C441-L443 WeakPolarHBondContact O-CD1 3.5Å
442	P	84.1	Confident	84.6	Confident	56 Å²	56	70.8 Å²	70.8	36%	0.364	37%	0.373	S	S	.	.			trans	-71.4	144.7	175.7	30.4	-34.1	0	0	0	110.4	K440	K440-P442 WeakPolarHBondContact O-CD 3.48Å
443	L	89.1	Confident	84.6	Confident	19 Å²	19	74.7 Å²	74.7	10%	0.099	40%	0.396	C	S	.	.			trans	-122.5	141.5	177.7	-52.9	91.9	0	0	0	110.8	N296 Y298 F404 V422 V432 L435 C441	N296-L443 HydrophobicContact CB-CG 4.23Å; N296-L443 WeakPolarHBondContact O-CA 3.46Å; Y298-L443 HydrophobicContact CD1-CB 3.78Å; F404-L443 HydrophobicContact CE1-CD2 4.31Å; F404-L443 HydrophobicContact CE2-CD2 4.26Å; F404-L443 HydrophobicContact CZ-CD2 3.59Å; V422-L443 HydrophobicContact CG1-CD2 3.72Å; V432-L443 HydrophobicContact CG1-CB 4.23Å; V432-L443 HydrophobicContact CG1-CD1 4.04Å; L435-L443 HydrophobicContact CB-CD1 3.85Å; L435-L443 HydrophobicContact CD1-CD1 3.82Å; L435-L443 HydrophobicContact CD1-CD2 4.29Å; C441-L443 VanDerWaalsContact O-CD1 3.28Å; C441-L443 WeakPolarHBondContact O-CD1 3.5Å
444	Q	91	Very high	84.7	Confident	123 Å²	123	73.5 Å²	73.5	58%	0.575	39%	0.39	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-94.1	140.9	176.2	-62.3	-179.7	0.1	0	0	110.7	N296 Y297 Y298 M446	N296-Q444 PolarHBondContact O-N 3.1Å; Y297-Q444 CarbonylContact C-O 3.54Å; Y297-Q444 VanDerWaalsContact CA-O 3.23Å; Y297-Q444 WeakPolarHBondContact CA-O 3.42Å; Y297-Q444 HydrophobicContact CD1-CB 3.89Å; Y297-Q444 HydrophobicContact CE1-CB 4.13Å; Y298-Q444 WeakPolarHBondContact CD1-O 3.38Å; Y298-Q444 PolarHBondContact N-O 3.01Å; Q444-M446 PolarHBondContact O-N 3.01Å
445	K	92.9	Very high	84.8	Confident	124 Å²	124	71.3 Å²	71.3	54%	0.539	38%	0.381	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.4	114	177.9	-159.9	167.4	-163.9	152.4	0	109.3	Y298 E429	Y298-K445 HydrophobicContact CD1-CB 4.44Å; Y298-K445 HydrophobicContact CD2-CG 4.5Å; Y298-K445 HydrophobicContact CE1-CB 3.74Å; Y298-K445 HydrophobicContact CE1-CG 4.19Å; Y298-K445 HydrophobicContact CE2-CB 4.31Å; Y298-K445 HydrophobicContact CE2-CD 4.08Å; Y298-K445 HydrophobicContact CE2-CG 3.84Å; Y298-K445 WeakPolarHBondContact OH-CD 3.47Å; E429-K445 IonicContact OE1-NZ 2.78Å; E429-K445 PolarHBondContact OE1-NZ 3.45Å; E429-K445 IonicContact OE2-NZ 2.82Å
446	M	90.3	Very high	85	Confident	42 Å²	42	72.1 Å²	72.1	21%	0.207	39%	0.385	C	S	.	.	P	Polyproline II helix	trans	-75.2	144.3	175.3	-175.8	178.2	162.2	0	0	110	Y298 F313 L421 Q444 I449	Y298-M446 PolarHBondContact O-N 2.79Å; F313-M446 HydrophobicContact CD2-CE 4.17Å; F313-M446 HydrophobicContact CE2-CE 3.96Å; F313-M446 HydrophobicContact CE2-SD 4.38Å; L421-M446 HydrophobicContact CD1-CB 4.18Å; L421-M446 HydrophobicContact CD1-SD 3.83Å; L421-M446 HydrophobicContact CD2-SD 3.75Å; L421-M446 HydrophobicContact CG-SD 4.4Å; Q444-M446 PolarHBondContact O-N 3.01Å; M446-I449 HydrophobicContact CE-CG1 4.23Å
447	S	83.9	Confident	85.3	Confident	89 Å²	89	73.2 Å²	73.2	62%	0.622	39%	0.391	S	S	*	.	P	Polyproline II helix	trans	-62.9	144.6	172.1	48	0	0	0	0	111.4	I449	S447-I449 PolarHBondContact O-N 3.44Å
448	P	78.4	Confident	85.8	Confident	105 Å²	105	71.4 Å²	71.4	68%	0.682	38%	0.378	S	S	*	.	P	Polyproline II helix	trans	-54.4	140.2	172.1	-26.7	35.5	0	0	0	112
449	I	82.6	Confident	86.3	Confident	17 Å²	17	67.4 Å²	67.4	9%	0.087	36%	0.357	C	S	.	.	P	Polyproline II helix	trans	-70.5	132.5	-179.6	-58.8	164	0	0	0	108.3	N309 A312 F313 M446 S447 V452	N309-I449 HydrophobicContact CB-CD1 4.24Å; N309-I449 VanDerWaalsContact O-CD1 3.3Å; N309-I449 WeakPolarHBondContact O-CD1 3.09Å; A312-I449 HydrophobicContact CB-CG2 3.71Å; F313-I449 HydrophobicContact CB-CD1 3.82Å; F313-I449 HydrophobicContact CD2-CD1 4.09Å; F313-I449 HydrophobicContact CG-CD1 4.48Å; M446-I449 HydrophobicContact CE-CG1 4.23Å; S447-I449 PolarHBondContact O-N 3.44Å; I449-V452 HydrophobicContact CB-CG2 4.08Å; I449-V452 HydrophobicContact CG2-CG2 4.15Å; I449-V452 WeakPolarHBondContact O-CG2 3.37Å
450	K	77.4	Confident	87	Confident	165 Å²	165	68.9 Å²	68.9	72%	0.717	36%	0.363	S	S	*	.	S	Bend	trans	-82.9	158	174.1	-62	-176.3	-178.9	-178	0	110.6	Q316 V452	Q316-K450 PolarHBondContact NE2-O 3.01Å; K450-V452 VanDerWaalsContact C-N 3.34Å; K450-V452 PolarHBondContact O-N 3.48Å
451	D	78.7	Confident	87.5	Confident	145 Å²	145	67 Å²	67	78%	0.775	37%	0.365	S	S	*	.	S	Bend	trans	61.8	37	174.5	-43.2	-49.2	0	0	0	114.3	V453	D451-V453 PolarHBondContact O-N 3.47Å; D451-V453 VanDerWaalsContact O-N 3.12Å
452	V	86.4	Confident	88	Confident	54 Å²	54	68.9 Å²	68.9	33%	0.327	37%	0.374	S	S	.	.			trans	-72	102.2	176.2	179.6	0	0	0	0	110.2	N308 A312 I449 K450	N308-V452 HydrophobicContact CB-CG1 3.68Å; A312-V452 HydrophobicContact CB-CB 4.45Å; A312-V452 HydrophobicContact CB-CG2 3.87Å; I449-V452 HydrophobicContact CB-CG2 4.08Å; I449-V452 HydrophobicContact CG2-CG2 4.15Å; I449-V452 WeakPolarHBondContact O-CG2 3.37Å; K450-V452 VanDerWaalsContact C-N 3.34Å; K450-V452 PolarHBondContact O-N 3.48Å
453	V	89.4	Confident	88.3	Confident	92 Å²	92	66.4 Å²	66.4	56%	0.558	36%	0.359	S	S	*	.			trans	-83.4	127.5	172.2	-179.8	0	0	0	0	109.9	D451 V455	D451-V453 PolarHBondContact O-N 3.47Å; D451-V453 VanDerWaalsContact O-N 3.12Å; V453-V455 PolarHBondContact O-N 3.42Å
454	D	90.6	Very high	88.4	Confident	84 Å²	84	68.5 Å²	68.5	45%	0.449	37%	0.37	S	S	.	.			trans	-61.2	125.1	173.3	-179.6	24.1	0	0	0	111.6	N308 L456 P457	N308-D454 PolarHBondContact ND2-OD1 3.44Å; N308-D454 PolarHBondContact OD1-OD1 3.15Å; D454-L456 WeakPolarHBondContact OD1-CB 3.5Å; D454-L456 WeakPolarHBondContact OD1-CG 3.27Å; D454-L456 PolarHBondContact OD1-N 3.24Å; D454-P457 VanDerWaalsContact CG-CD 3.41Å; D454-P457 WeakPolarHBondContact OD1-CD 3.05Å; D454-P457 WeakPolarHBondContact OD2-CD 3.31Å; D454-P457 WeakPolarHBondContact OD2-CG 3.37Å
455	V	92	Very high	88.3	Confident	5 Å²	5	66.2 Å²	66.2	3%	0.03	37%	0.372	C	S	.	.			trans	-111.7	-7.3	178.3	-68.1	0	0	0	0	113.1	F307 N308 V311 L342 V453 K458 V459	F307-V455 HydrophobicContact CD1-CG2 3.85Å; F307-V455 HydrophobicContact CE1-CG2 3.85Å; N308-V455 WeakPolarHBondContact OD1-CG2 3.43Å; N308-V455 PolarHBondContact OD1-N 2.79Å; V311-V455 HydrophobicContact CB-CG2 4.2Å; V311-V455 HydrophobicContact CG1-CG1 4.09Å; V311-V455 HydrophobicContact CG1-CG2 4.37Å; V311-V455 HydrophobicContact CG2-CG2 4.14Å; L342-V455 HydrophobicContact CD1-CB 3.94Å; L342-V455 HydrophobicContact CD1-CG1 4.48Å; L342-V455 HydrophobicContact CD1-CG2 3.98Å; L342-V455 HydrophobicContact CD2-CB 3.81Å; L342-V455 HydrophobicContact CD2-CG1 3.81Å; V453-V455 PolarHBondContact O-N 3.42Å; V455-K458 PolarHBondContact O-N 2.73Å; V455-K458 VanDerWaalsContact O-N 3.12Å; V455-V459 PolarHBondContact O-N 3.3Å; V455-V459 VanDerWaalsContact O-N 3.09Å
456	L	91.2	Very high	88.2	Confident	17 Å²	17	61.6 Å²	61.6	9%	0.089	35%	0.353	C	S	.	.	H	α-helix	trans	-58.7	-39.9	-179.4	-57	174.5	0	0	0	113.1	F307 D454 K458 V459 K460 G508 A510	F307-L456 HydrophobicContact CB-CD2 4.48Å; F307-L456 HydrophobicContact CD1-CD2 4.23Å; D454-L456 WeakPolarHBondContact OD1-CB 3.5Å; D454-L456 WeakPolarHBondContact OD1-CG 3.27Å; D454-L456 PolarHBondContact OD1-N 3.24Å; L456-K458 VanDerWaalsContact C-N 3.28Å; L456-K458 PolarHBondContact O-N 2.82Å; L456-V459 PolarHBondContact O-N 2.78Å; L456-K460 PolarHBondContact O-N 3.27Å; L456-G508 WeakPolarHBondContact CD2-O 3.34Å; L456-A510 HydrophobicContact CD2-CB 4.41Å
457	P	92.1	Very high	88.1	Confident	74 Å²	74	60.6 Å²	60.6	48%	0.481	35%	0.347	S	S	.	.	H	α-helix	trans	-60.1	-37.7	175.7	-26	35.2	0	0	0	112.5	D454 K460 A461	D454-P457 VanDerWaalsContact CG-CD 3.41Å; D454-P457 WeakPolarHBondContact OD1-CD 3.05Å; D454-P457 WeakPolarHBondContact OD2-CD 3.31Å; D454-P457 WeakPolarHBondContact OD2-CG 3.37Å; P457-K460 PolarHBondContact O-N 3.21Å; P457-A461 WeakPolarHBondContact O-CB 3.4Å; P457-A461 PolarHBondContact O-N 2.88Å
458	K	92.1	Very high	88.3	Confident	87 Å²	87	56.7 Å²	56.7	38%	0.378	32%	0.32	S	S	.	.	H	α-helix	trans	-71.1	-32.6	175.4	179.8	171.5	161.6	-172.1	0	112	S341 L342 V455 L456 M462	S341-K458 PolarHBondContact O-NZ 3.28Å; S341-K458 WeakPolarHBondContact OG-CE 3.38Å; S341-K458 PolarHBondContact OG-NZ 3.24Å; L342-K458 HydrophobicContact CD2-CB 4.43Å; L342-K458 HydrophobicContact CD2-CD 3.67Å; L342-K458 HydrophobicContact CD2-CG 4.16Å; V455-K458 PolarHBondContact O-N 2.73Å; V455-K458 VanDerWaalsContact O-N 3.12Å; L456-K458 VanDerWaalsContact C-N 3.28Å; L456-K458 PolarHBondContact O-N 2.82Å; K458-M462 WeakPolarHBondContact O-CG 3.43Å; K458-M462 PolarHBondContact O-N 2.69Å
459	V	92.5	Very high	89	Confident	2 Å²	2	52.1 Å²	52.1	1%	0.012	29%	0.29	C	S	.	.	H	α-helix	trans	-70.3	-41.8	172.2	-173.9	0	0	0	0	111.2	F307 F334 A338 L342 V455 L456 A461 M462 A463 M469 A510	F307-V459 HydrophobicContact CE1-CG2 3.96Å; F334-V459 HydrophobicContact CE2-CG1 4.42Å; F334-V459 HydrophobicContact CZ-CG1 3.94Å; A338-V459 HydrophobicContact CB-CG2 4.25Å; L342-V459 HydrophobicContact CD1-CG2 3.91Å; V455-V459 PolarHBondContact O-N 3.3Å; V455-V459 VanDerWaalsContact O-N 3.09Å; L456-V459 PolarHBondContact O-N 2.78Å; V459-A461 VanDerWaalsContact C-N 3.32Å; V459-A461 PolarHBondContact O-N 2.87Å; V459-M462 HydrophobicContact CB-CE 4.31Å; V459-M462 HydrophobicContact CG2-CE 3.98Å; V459-M462 PolarHBondContact O-N 3.06Å; V459-M462 VanDerWaalsContact O-N 3.13Å; V459-A463 PolarHBondContact O-N 2.96Å; V459-M469 HydrophobicContact CG1-CE 4.24Å; V459-A510 HydrophobicContact CB-CB 3.6Å; V459-A510 HydrophobicContact CG1-CB 3.5Å
460	K	91.2	Very high	89.3	Confident	52 Å²	52	51.7 Å²	51.7	23%	0.226	29%	0.287	C	S	.	.	H	α-helix	trans	-57.3	-43.8	171.5	-71.1	-177	177.7	-180	0	110.9	L456 P457 M462 A463 L464 N507 A510 L512	L456-K460 PolarHBondContact O-N 3.27Å; P457-K460 PolarHBondContact O-N 3.21Å; K460-M462 PolarHBondContact O-N 2.88Å; K460-A463 PolarHBondContact O-N 2.82Å; K460-L464 WeakPolarHBondContact O-CG 3.4Å; K460-L464 PolarHBondContact O-N 3.07Å; K460-N507 PolarHBondContact NZ-OD1 3Å; K460-A510 HydrophobicContact CG-CB 3.94Å; K460-L512 HydrophobicContact CB-CD2 4.01Å; K460-L512 HydrophobicContact CG-CD2 4.17Å
461	A	91.8	Very high	89.9	Confident	54 Å²	54	45 Å²	45	45%	0.446	26%	0.26	S	S	.	.	H	α-helix	trans	-62.2	-39.2	173.9	0	0	0	0	0	113.4	P457 V459 L464 A465	P457-A461 WeakPolarHBondContact O-CB 3.4Å; P457-A461 PolarHBondContact O-N 2.88Å; V459-A461 VanDerWaalsContact C-N 3.32Å; V459-A461 PolarHBondContact O-N 2.87Å; A461-L464 PolarHBondContact O-N 3.37Å; A461-A465 WeakPolarHBondContact O-CB 3.37Å; A461-A465 PolarHBondContact O-N 3.38Å
462	M	90.9	Very high	90.6	Very high	40 Å²	40	39.8 Å²	39.8	20%	0.197	23%	0.23	C	C	.	.	H	α-helix	trans	-66.4	-34.7	173.5	-71.5	-173.8	-65.9	0	0	112.8	A338 S341 K458 V459 K460 A465 D466 M469	A338-M462 HydrophobicContact CB-CE 4.47Å; S341-M462 WeakPolarHBondContact CB-SD 3.49Å; S341-M462 PolarHBondContact OG-SD 2.95Å; K458-M462 WeakPolarHBondContact O-CG 3.43Å; K458-M462 PolarHBondContact O-N 2.69Å; V459-M462 HydrophobicContact CB-CE 4.31Å; V459-M462 HydrophobicContact CG2-CE 3.98Å; V459-M462 PolarHBondContact O-N 3.06Å; V459-M462 VanDerWaalsContact O-N 3.13Å; K460-M462 PolarHBondContact O-N 2.88Å; M462-A465 PolarHBondContact O-N 2.7Å; M462-D466 PolarHBondContact O-N 3.19Å; M462-D466 VanDerWaalsContact O-N 3.13Å; M462-M469 HydrophobicContact CB-CG 4.2Å
463	A	90.1	Very high	90.9	Very high	4 Å²	4	37.3 Å²	37.3	3%	0.033	22%	0.215	C	C	.	.	H	α-helix	trans	-69.6	-34.6	174.4	0	0	0	0	0	112.9	V459 K460 F470 L512	V459-A463 PolarHBondContact O-N 2.96Å; K460-A463 PolarHBondContact O-N 2.82Å; A463-F470 HydrophobicContact CB-CB 4.21Å; A463-L512 HydrophobicContact CB-CD1 4.15Å; A463-L512 HydrophobicContact CB-CG 4.3Å
464	L	90.3	Very high	90.9	Very high	64 Å²	64	34.1 Å²	34.1	34%	0.335	19%	0.194	S	C	.	.	H	α-helix	trans	-69.6	-34.4	171.6	-72.5	165.3	0	0	0	112.5	K460 A461 L512 V533 I538	K460-L464 WeakPolarHBondContact O-CG 3.4Å; K460-L464 PolarHBondContact O-N 3.07Å; A461-L464 PolarHBondContact O-N 3.37Å; L464-L512 HydrophobicContact CD2-CD1 3.64Å; L464-L512 HydrophobicContact CD2-CD2 4.49Å; L464-L512 HydrophobicContact CG-CD1 3.82Å; L464-L512 HydrophobicContact CG-CD2 4.17Å; L464-V533 HydrophobicContact CD2-CB 4.08Å; L464-V533 HydrophobicContact CD2-CG1 4.02Å; L464-V533 HydrophobicContact CD2-CG2 4.2Å; L464-I538 HydrophobicContact CD2-CD1 4.23Å
465	A	90.1	Very high	91	Very high	74 Å²	74	37.8 Å²	37.8	61%	0.612	20%	0.202	S	C	*	.	H	α-helix	trans	-82.3	-24.6	-176.8	0	0	0	0	0	115	A461 M462	A461-A465 WeakPolarHBondContact O-CB 3.37Å; A461-A465 PolarHBondContact O-N 3.38Å; M462-A465 PolarHBondContact O-N 2.7Å
466	D	90.3	Very high	91.1	Very high	27 Å²	27	37.6 Å²	37.6	14%	0.144	20%	0.201	C	C	.	.			trans	-143.6	118.5	174.9	179.9	20.7	0	0	0	111.8	M462 A468 M469 F470 K541	M462-D466 PolarHBondContact O-N 3.19Å; M462-D466 VanDerWaalsContact O-N 3.13Å; D466-A468 PolarHBondContact O-N 3.43Å; D466-A468 PolarHBondContact OD1-N 2.98Å; D466-A468 WeakPolarHBondContact OD2-CB 3.03Å; D466-M469 WeakPolarHBondContact O-CB 3.35Å; D466-M469 PolarHBondContact O-N 3.03Å; D466-F470 PolarHBondContact O-N 3.03Å; D466-K541 HydrophobicContact CB-CB 4.05Å; D466-K541 PolarHBondContact OD1-N 3.27Å
467	R	88	Confident	91.1	Very high	21 Å²	21	36.8 Å²	36.8	8%	0.079	20%	0.196	C	C	.	.	H	α-helix	trans	-54.8	-27.5	175.4	-172.3	66.5	-165.8	-136.8	-5.2	112.9	M469 F470 D471 T535 D536 I538 R539 Y540	R467-M469 VanDerWaalsContact C-N 3.29Å; R467-M469 PolarHBondContact O-N 3.4Å; R467-F470 VanDerWaalsContact CZ-CE1 3.49Å; R467-F470 VanDerWaalsContact NE-CD1 3.32Å; R467-F470 PolarHBondContact O-N 3.14Å; R467-D471 IonicContact CZ-OD1 3.43Å; R467-D471 IonicContact NE-OD1 3.65Å; R467-D471 PolarHBondContact NE-OD1 3.06Å; R467-D471 IonicContact NE-OD2 3.49Å; R467-D471 IonicContact NH2-OD1 2.73Å; R467-D471 PolarHBondContact NH2-OD1 3.44Å; R467-D471 WeakPolarHBondContact O-CB 3.3Å; R467-D471 PolarHBondContact O-N 2.98Å; R467-T535 PolarHBondContact NH1-O 3.17Å; R467-D536 IonicContact CZ-OD1 2.67Å; R467-D536 IonicContact NH1-OD1 3.12Å; R467-D536 PolarHBondContact NH1-OD1 3.13Å; R467-D536 IonicContact NH2-OD1 2.78Å; R467-D536 PolarHBondContact NH2-OD1 2.79Å; R467-I538 HydrophobicContact CB-CG2 3.95Å; R467-R539 WeakPolarHBondContact CB-O 3.1Å; R467-R539 PolarHBondContact N-O 2.9Å; R467-Y540 HydrophobicContact CB-CD1 3.79Å; R467-Y540 HydrophobicContact CB-CE1 4.02Å; R467-Y540 HydrophobicContact CB-CG 4.07Å; R467-Y540 HydrophobicContact CG-CD1 4.32Å; R467-Y540 HydrophobicContact CG-CE1 4.08Å; R467-Y540 HydrophobicContact CG-CE2 4.41Å
468	A	88.8	Confident	91.1	Very high	8 Å²	8	35 Å²	35	7%	0.066	18%	0.184	C	C	.	.	H	α-helix	trans	-70.5	-22.4	175.7	0	0	0	0	0	113.6	D466 K472 Y540	D466-A468 PolarHBondContact O-N 3.43Å; D466-A468 PolarHBondContact OD1-N 2.98Å; D466-A468 WeakPolarHBondContact OD2-CB 3.03Å; A468-K472 WeakPolarHBondContact O-CB 3.41Å; A468-K472 WeakPolarHBondContact O-CD 3.34Å; A468-K472 WeakPolarHBondContact O-CG 3.5Å; A468-K472 PolarHBondContact O-N 2.83Å; A468-Y540 HydrophobicContact CB-CD1 3.77Å; A468-Y540 HydrophobicContact CB-CE1 3.78Å
469	M	91.6	Very high	91	Very high	9 Å²	9	32.1 Å²	32.1	4%	0.044	18%	0.175	C	C	.	.	H	α-helix	trans	-79.4	-43.2	171.2	-169.5	61.6	175.3	0	0	110.8	F334 R337 A338 V459 M462 D466 R467 K472 G473	F334-M469 HydrophobicContact CD2-CE 3.73Å; F334-M469 HydrophobicContact CD2-SD 3.95Å; F334-M469 HydrophobicContact CE2-CE 3.58Å; F334-M469 HydrophobicContact CE2-CG 4.4Å; F334-M469 HydrophobicContact CE2-SD 4.09Å; F334-M469 HydrophobicContact CZ-CE 4.36Å; R337-M469 HydrophobicContact CB-CE 4.34Å; R337-M469 HydrophobicContact CB-SD 4.07Å; A338-M469 HydrophobicContact CB-CE 3.91Å; V459-M469 HydrophobicContact CG1-CE 4.24Å; M462-M469 HydrophobicContact CB-CG 4.2Å; D466-M469 WeakPolarHBondContact O-CB 3.35Å; D466-M469 PolarHBondContact O-N 3.03Å; R467-M469 VanDerWaalsContact C-N 3.29Å; R467-M469 PolarHBondContact O-N 3.4Å; M469-K472 WeakPolarHBondContact O-CB 3.3Å; M469-K472 PolarHBondContact O-N 3.39Å; M469-G473 PolarHBondContact O-N 3.38Å
470	F	90.3	Very high	91	Very high	7 Å²	7	32.1 Å²	32.1	3%	0.031	18%	0.175	C	C	.	.	H	α-helix	trans	-57.9	-54.3	173.1	172.5	-91.2	0	0	0	112.4	A463 D466 R467 K472 G473 M474 L512 R513 T535	A463-F470 HydrophobicContact CB-CB 4.21Å; D466-F470 PolarHBondContact O-N 3.03Å; R467-F470 VanDerWaalsContact CZ-CE1 3.49Å; R467-F470 VanDerWaalsContact NE-CD1 3.32Å; R467-F470 PolarHBondContact O-N 3.14Å; F470-K472 PolarHBondContact O-N 2.97Å; F470-G473 PolarHBondContact O-N 3.26Å; F470-G473 VanDerWaalsContact O-N 3.12Å; F470-M474 HydrophobicContact CD1-CG 4.19Å; F470-M474 HydrophobicContact CD2-CG 4.46Å; F470-M474 HydrophobicContact CE1-CG 3.8Å; F470-M474 HydrophobicContact CE2-CG 4.1Å; F470-M474 HydrophobicContact CE2-SD 4.11Å; F470-M474 HydrophobicContact CZ-CE 4.26Å; F470-M474 HydrophobicContact CZ-CG 3.76Å; F470-M474 HydrophobicContact CZ-SD 3.98Å; F470-M474 WeakPolarHBondContact O-CG 3.2Å; F470-M474 PolarHBondContact O-N 2.96Å; F470-L512 HydrophobicContact CD2-CB 4.32Å; F470-L512 HydrophobicContact CD2-CD1 3.83Å; F470-L512 HydrophobicContact CD2-CG 4.12Å; F470-L512 HydrophobicContact CE2-CB 4.08Å; F470-L512 HydrophobicContact CE2-CD1 4.3Å; F470-L512 HydrophobicContact CE2-CG 4.39Å; F470-R513 HydrophobicContact CE2-CG 4.3Å; F470-R513 HydrophobicContact CZ-CG 4.04Å; F470-T535 HydrophobicContact CE2-CG2 4.05Å; F470-T535 HydrophobicContact CZ-CG2 4.32Å
471	D	89.7	Confident	90.8	Very high	26 Å²	26	29.8 Å²	29.8	14%	0.139	17%	0.165	C	C	.	.	H	α-helix	trans	-63.9	-24.6	-179	-74.4	-19.8	0	0	0	111.9	R467 R475 Y540	R467-D471 IonicContact CZ-OD1 3.43Å; R467-D471 IonicContact NE-OD1 3.65Å; R467-D471 PolarHBondContact NE-OD1 3.06Å; R467-D471 IonicContact NE-OD2 3.49Å; R467-D471 IonicContact NH2-OD1 2.73Å; R467-D471 PolarHBondContact NH2-OD1 3.44Å; R467-D471 WeakPolarHBondContact O-CB 3.3Å; R467-D471 PolarHBondContact O-N 2.98Å; D471-R475 VanDerWaalsContact O-CD 3.32Å; D471-R475 WeakPolarHBondContact O-CD 3.29Å; D471-R475 WeakPolarHBondContact O-CG 3.39Å; D471-R475 PolarHBondContact O-N 3.45Å; D471-Y540 PolarHBondContact OD2-OH 3.24Å
472	K	92.4	Very high	90.6	Very high	35 Å²	35	31.1 Å²	31.1	15%	0.152	16%	0.162	C	C	.	.	H	α-helix	trans	-70.9	-50.1	170.6	-86.2	-179.2	167.1	-140.4	0	112.1	E333 F334 A468 M469 F470 M474 R475 A476	E333-K472 WeakPolarHBondContact O-CD 3.2Å; E333-K472 PolarHBondContact O-NZ 2.98Å; E333-K472 WeakPolarHBondContact OE2-CE 3.5Å; E333-K472 IonicContact OE2-NZ 3.19Å; E333-K472 PolarHBondContact OE2-NZ 3.47Å; F334-K472 HydrophobicContact CB-CB 4.27Å; F334-K472 HydrophobicContact CD2-CB 4.04Å; A468-K472 WeakPolarHBondContact O-CB 3.41Å; A468-K472 WeakPolarHBondContact O-CD 3.34Å; A468-K472 WeakPolarHBondContact O-CG 3.5Å; A468-K472 PolarHBondContact O-N 2.83Å; M469-K472 WeakPolarHBondContact O-CB 3.3Å; M469-K472 PolarHBondContact O-N 3.39Å; F470-K472 PolarHBondContact O-N 2.97Å; K472-M474 VanDerWaalsContact C-N 3.32Å; K472-M474 PolarHBondContact O-N 3.36Å; K472-R475 PolarHBondContact O-N 2.88Å; K472-R475 VanDerWaalsContact O-N 3.16Å; K472-A476 WeakPolarHBondContact O-CB 3.39Å; K472-A476 PolarHBondContact O-N 2.83Å
473	G	92.5	Very high	90.5	Very high	2 Å²	2	30.5 Å²	30.5	2%	0.021	16%	0.163	C	C	.	.	H	α-helix	trans	-57.4	-44.8	177.9	0	0	0	0	0	112.3	F334 M469 F470 R475 A476 F477	F334-G473 VanDerWaalsContact CD2-N 3.3Å; M469-G473 PolarHBondContact O-N 3.38Å; F470-G473 PolarHBondContact O-N 3.26Å; F470-G473 VanDerWaalsContact O-N 3.12Å; G473-R475 VanDerWaalsContact C-N 3.35Å; G473-R475 PolarHBondContact O-N 2.93Å; G473-A476 PolarHBondContact O-N 3.15Å; G473-F477 PolarHBondContact O-N 2.86Å
474	M	91.1	Very high	90.3	Very high	24 Å²	24	30.5 Å²	30.5	12%	0.118	16%	0.162	C	C	.	.	H	α-helix	trans	-59	-42.1	176	-63.3	-63.3	-78.4	0	0	112.6	F470 K472 V478 L511 R513 P515	F470-M474 HydrophobicContact CD1-CG 4.19Å; F470-M474 HydrophobicContact CD2-CG 4.46Å; F470-M474 HydrophobicContact CE1-CG 3.8Å; F470-M474 HydrophobicContact CE2-CG 4.1Å; F470-M474 HydrophobicContact CE2-SD 4.11Å; F470-M474 HydrophobicContact CZ-CE 4.26Å; F470-M474 HydrophobicContact CZ-CG 3.76Å; F470-M474 HydrophobicContact CZ-SD 3.98Å; F470-M474 WeakPolarHBondContact O-CG 3.2Å; F470-M474 PolarHBondContact O-N 2.96Å; K472-M474 VanDerWaalsContact C-N 3.32Å; K472-M474 PolarHBondContact O-N 3.36Å; M474-V478 WeakPolarHBondContact O-CG2 3.35Å; M474-V478 PolarHBondContact O-N 3.38Å; M474-L511 HydrophobicContact SD-CD1 4.39Å; M474-L511 HydrophobicContact SD-CD2 4.05Å; M474-R513 HydrophobicContact CE-CG 3.97Å; M474-R513 WeakPolarHBondContact CE-O 3.32Å; M474-P515 HydrophobicContact CE-CB 3.86Å
475	R	92.3	Very high	90.1	Very high	162 Å²	162	30.2 Å²	30.2	61%	0.611	17%	0.169	S	C	*	.	H	α-helix	trans	-71.7	-37	176.2	-69.9	168.7	-165	-172.6	5.1	112.3	A330 D471 K472 G473 S479	A330-R475 HydrophobicContact CB-CB 4.38Å; D471-R475 VanDerWaalsContact O-CD 3.32Å; D471-R475 WeakPolarHBondContact O-CD 3.29Å; D471-R475 WeakPolarHBondContact O-CG 3.39Å; D471-R475 PolarHBondContact O-N 3.45Å; K472-R475 PolarHBondContact O-N 2.88Å; K472-R475 VanDerWaalsContact O-N 3.16Å; G473-R475 VanDerWaalsContact C-N 3.35Å; G473-R475 PolarHBondContact O-N 2.93Å; R475-S479 WeakPolarHBondContact O-CB 3.44Å; R475-S479 PolarHBondContact O-N 3.19Å; R475-S479 PolarHBondContact O-OG 2.72Å
476	A	93.4	Very high	89.9	Confident	0 Å²	0	34.8 Å²	34.8	0%	0	18%	0.175	C	C	.	.	H	α-helix	trans	-61.7	-53.8	178.8	0	0	0	0	0	110.2	A330 F334 K472 G473 V478 S479 Y480 F509	A330-A476 HydrophobicContact CB-CB 4.33Å; F334-A476 HydrophobicContact CB-CB 3.83Å; F334-A476 HydrophobicContact CD1-CB 4.15Å; F334-A476 HydrophobicContact CG-CB 4.14Å; K472-A476 WeakPolarHBondContact O-CB 3.39Å; K472-A476 PolarHBondContact O-N 2.83Å; G473-A476 PolarHBondContact O-N 3.15Å; A476-V478 PolarHBondContact O-N 3.06Å; A476-S479 PolarHBondContact O-N 3.33Å; A476-S479 VanDerWaalsContact O-N 3.17Å; A476-S479 PolarHBondContact O-OG 3.17Å; A476-Y480 WeakPolarHBondContact O-CB 3.45Å; A476-Y480 PolarHBondContact O-N 3.44Å; A476-F509 HydrophobicContact CB-CD1 4.11Å; A476-F509 HydrophobicContact CB-CE1 3.71Å
477	F	92.3	Very high	89.7	Confident	0 Å²	0	34 Å²	34	0%	0	17%	0.17	C	C	.	.	H	α-helix	trans	-55.7	-50.3	176.6	-179.5	-81	0	0	0	112.7	G473 S479 Y480 V481 F502 L505 A506 F509 L511 P515 M517 L520	G473-F477 PolarHBondContact O-N 2.86Å; F477-S479 VanDerWaalsContact C-N 3.29Å; F477-S479 PolarHBondContact O-N 3.19Å; F477-Y480 WeakPolarHBondContact O-CB 3.28Å; F477-Y480 PolarHBondContact O-N 2.83Å; F477-Y480 VanDerWaalsContact O-N 3.15Å; F477-V481 HydrophobicContact CD1-CG2 4.25Å; F477-V481 HydrophobicContact CE1-CG2 3.95Å; F477-V481 HydrophobicContact CZ-CG2 4.24Å; F477-V481 PolarHBondContact O-N 2.89Å; F477-F502 HydrophobicContact CZ-CD1 4.28Å; F477-L505 HydrophobicContact CD2-CD2 4.34Å; F477-L505 HydrophobicContact CD2-CG 4.17Å; F477-L505 HydrophobicContact CE2-CB 4.17Å; F477-L505 HydrophobicContact CE2-CD2 3.78Å; F477-L505 HydrophobicContact CE2-CG 3.74Å; F477-L505 HydrophobicContact CZ-CD2 4.26Å; F477-A506 HydrophobicContact CE2-CB 3.94Å; F477-F509 HydrophobicContact CB-CD1 4Å; F477-F509 HydrophobicContact CB-CE1 4.45Å; F477-F509 HydrophobicContact CB-CG 4.18Å; F477-F509 HydrophobicContact CD2-CB 4.15Å; F477-F509 HydrophobicContact CD2-CD2 4.15Å; F477-F509 HydrophobicContact CD2-CG 4.08Å; F477-L511 HydrophobicContact CB-CD1 3.99Å; F477-L511 HydrophobicContact CD1-CD1 4.35Å; F477-L511 HydrophobicContact CD2-CD1 3.73Å; F477-L511 HydrophobicContact CE2-CD1 4.24Å; F477-L511 HydrophobicContact CG-CD1 3.78Å; F477-P515 HydrophobicContact CD1-CG 3.59Å; F477-P515 HydrophobicContact CE1-CG 3.77Å; F477-M517 HydrophobicContact CD1-SD 4.29Å; F477-M517 HydrophobicContact CE1-SD 4Å; F477-L520 HydrophobicContact CE1-CD1 4.29Å
478	V	90.7	Very high	89.6	Confident	36 Å²	36	38 Å²	38	22%	0.218	19%	0.19	C	C	.	.	H	α-helix	trans	-59.9	-41.8	179.1	172.7	0	0	0	0	110.9	M474 A476 Q482 P515 M517	M474-V478 WeakPolarHBondContact O-CG2 3.35Å; M474-V478 PolarHBondContact O-N 3.38Å; A476-V478 PolarHBondContact O-N 3.06Å; V478-Q482 WeakPolarHBondContact O-CB 3.43Å; V478-Q482 VanDerWaalsContact O-CG 3.29Å; V478-Q482 WeakPolarHBondContact O-CG 3.49Å; V478-Q482 PolarHBondContact O-N 2.96Å; V478-P515 HydrophobicContact CG2-CB 3.6Å; V478-P515 HydrophobicContact CG2-CG 3.72Å; V478-M517 HydrophobicContact CB-CE 4.38Å; V478-M517 HydrophobicContact CG1-CE 4.08Å; V478-M517 HydrophobicContact CG2-CE 4.36Å; V478-M517 HydrophobicContact CG2-SD 3.91Å
479	S	91.6	Very high	89.4	Confident	27 Å²	27	38.2 Å²	38.2	19%	0.189	19%	0.191	C	C	.	.	H	α-helix	trans	-68.4	-34.3	177.6	75	0	0	0	0	113.4	T328 R475 A476 F477 Q482 A483	T328-S479 WeakPolarHBondContact CB-OG 3.43Å; T328-S479 PolarHBondContact OG1-OG 3.24Å; R475-S479 WeakPolarHBondContact O-CB 3.44Å; R475-S479 PolarHBondContact O-N 3.19Å; R475-S479 PolarHBondContact O-OG 2.72Å; A476-S479 PolarHBondContact O-N 3.33Å; A476-S479 VanDerWaalsContact O-N 3.17Å; A476-S479 PolarHBondContact O-OG 3.17Å; F477-S479 VanDerWaalsContact C-N 3.29Å; F477-S479 PolarHBondContact O-N 3.19Å; S479-Q482 PolarHBondContact O-N 2.72Å; S479-A483 WeakPolarHBondContact O-CB 3.42Å; S479-A483 PolarHBondContact O-N 3.42Å
480	Y	90.8	Very high	88.9	Confident	3 Å²	3	41.3 Å²	41.3	1%	0.012	21%	0.213	C	C	.	.	H	α-helix	trans	-64.4	-52.6	178.4	175.7	-76.8	0	0	0	110.1	D396 A476 F477 Q482 A483 Y484 L505 F509	D396-Y480 WeakPolarHBondContact OD1-CE2 3.13Å; A476-Y480 WeakPolarHBondContact O-CB 3.45Å; A476-Y480 PolarHBondContact O-N 3.44Å; F477-Y480 WeakPolarHBondContact O-CB 3.28Å; F477-Y480 PolarHBondContact O-N 2.83Å; F477-Y480 VanDerWaalsContact O-N 3.15Å; Y480-Q482 PolarHBondContact O-N 3.3Å; Y480-A483 WeakPolarHBondContact O-CA 3.48Å; Y480-A483 WeakPolarHBondContact O-CB 3.35Å; Y480-A483 PolarHBondContact O-N 3.24Å; Y480-Y484 AromaticContact CD1-CD2 3.82Å; Y480-Y484 HydrophobicContact CD1-CD2 3.82Å; Y480-Y484 AromaticContact CD1-CE2 3.93Å; Y480-Y484 HydrophobicContact CD1-CE2 3.93Å; Y480-Y484 HydrophobicContact CD2-CD2 4.38Å; Y480-Y484 AromaticContact CD2-CE2 3.84Å; Y480-Y484 HydrophobicContact CD2-CE2 3.84Å; Y480-Y484 AromaticContact CE1-CD2 3.64Å; Y480-Y484 HydrophobicContact CE1-CD2 3.64Å; Y480-Y484 HydrophobicContact CE1-CE1 4.43Å; Y480-Y484 AromaticContact CE1-CE2 3.47Å; Y480-Y484 HydrophobicContact CE1-CE2 3.47Å; Y480-Y484 VanDerWaalsContact CE1-CE2 3.47Å; Y480-Y484 HydrophobicContact CE1-CG 4.2Å; Y480-Y484 AromaticContact CE1-CZ 3.89Å; Y480-Y484 HydrophobicContact CE2-CD2 4.31Å; Y480-Y484 AromaticContact CE2-CE2 3.46Å; Y480-Y484 HydrophobicContact CE2-CE2 3.46Å; Y480-Y484 VanDerWaalsContact CE2-CE2 3.46Å; Y480-Y484 AromaticContact CE2-CZ 3.91Å; Y480-Y484 HydrophobicContact CG-CD2 4.18Å; Y480-Y484 HydrophobicContact CG-CE2 4.09Å; Y480-Y484 AromaticContact CZ-CD2 3.93Å; Y480-Y484 AromaticContact CZ-CE2 3.23Å; Y480-Y484 AromaticContact CZ-CZ 3.42Å; Y480-Y484 VanDerWaalsContact CZ-CZ 3.42Å; Y480-Y484 WeakPolarHBondContact O-CD2 3.46Å; Y480-Y484 PolarHBondContact O-N 3.13Å; Y480-Y484 VanDerWaalsContact OH-CZ 3.28Å; Y480-Y484 PolarHBondContact OH-OH 3.4Å; Y480-L505 HydrophobicContact CD1-CD1 4.19Å; Y480-L505 HydrophobicContact CD1-CD2 3.92Å; Y480-L505 HydrophobicContact CE1-CD1 3.55Å; Y480-L505 HydrophobicContact CE1-CD2 3.74Å; Y480-L505 HydrophobicContact CE1-CG 4.29Å; Y480-L505 HydrophobicContact CE2-CD1 4.47Å; Y480-F509 HydrophobicContact CD1-CE2 4.42Å; Y480-F509 AromaticContact CD2-CE2 3.75Å; Y480-F509 HydrophobicContact CD2-CE2 3.75Å; Y480-F509 AromaticContact CD2-CZ 3.48Å; Y480-F509 HydrophobicContact CD2-CZ 3.48Å; Y480-F509 VanDerWaalsContact CD2-CZ 3.48Å; Y480-F509 AromaticContact CE2-CE2 3.94Å; Y480-F509 HydrophobicContact CE2-CE2 3.94Å; Y480-F509 HydrophobicContact CE2-CZ 4.08Å; Y480-F509 AromaticContact CG-CE2 3.97Å; Y480-F509 HydrophobicContact CG-CE2 3.97Å; Y480-F509 AromaticContact CG-CZ 3.77Å; Y480-F509 HydrophobicContact CG-CZ 3.77Å
481	V	88.7	Confident	88.5	Confident	2 Å²	2	47.3 Å²	47.3	1%	0.012	25%	0.245	C	C	.	.	H	α-helix	trans	-58.7	-39.2	178.1	175	0	0	0	0	110.7	F477 A483 A485 V495 F502 L505 M517 E519	F477-V481 HydrophobicContact CD1-CG2 4.25Å; F477-V481 HydrophobicContact CE1-CG2 3.95Å; F477-V481 HydrophobicContact CZ-CG2 4.24Å; F477-V481 PolarHBondContact O-N 2.89Å; V481-A483 VanDerWaalsContact C-N 3.34Å; V481-A483 PolarHBondContact O-N 3.43Å; V481-A485 WeakPolarHBondContact O-CB 3.36Å; V481-A485 PolarHBondContact O-N 3.16Å; V481-V495 HydrophobicContact CG1-CG1 3.9Å; V481-F502 HydrophobicContact CG1-CE1 4.14Å; V481-F502 HydrophobicContact CG2-CE1 4.28Å; V481-L505 HydrophobicContact CG2-CD2 4.03Å; V481-M517 HydrophobicContact CB-CE 3.83Å; V481-M517 HydrophobicContact CG1-CE 3.77Å; V481-M517 HydrophobicContact CG2-CE 4.45Å; V481-E519 HydrophobicContact CG1-CB 4.3Å; V481-E519 HydrophobicContact CG1-CG 4.2Å
482	Q	87.5	Confident	88.3	Confident	83 Å²	83	47.9 Å²	47.9	39%	0.388	25%	0.247	S	C	.	.	H	α-helix	trans	-70.3	-22.6	174.9	-72.8	179.1	-4.8	0	0	114.8	V478 S479 Y480 K486	V478-Q482 WeakPolarHBondContact O-CB 3.43Å; V478-Q482 VanDerWaalsContact O-CG 3.29Å; V478-Q482 WeakPolarHBondContact O-CG 3.49Å; V478-Q482 PolarHBondContact O-N 2.96Å; S479-Q482 PolarHBondContact O-N 2.72Å; Y480-Q482 PolarHBondContact O-N 3.3Å; Q482-K486 WeakPolarHBondContact O-CD 3.33Å; Q482-K486 WeakPolarHBondContact O-CG 3.34Å
483	A	88.1	Confident	87.8	Confident	26 Å²	26	46.4 Å²	46.4	22%	0.215	24%	0.241	C	C	.	.	H	α-helix	trans	-80.2	-46.5	174.4	0	0	0	0	0	111	T328 S479 Y480 V481 A485 K486 H487	T328-A483 HydrophobicContact CG2-CB 3.9Å; S479-A483 WeakPolarHBondContact O-CB 3.42Å; S479-A483 PolarHBondContact O-N 3.42Å; Y480-A483 WeakPolarHBondContact O-CA 3.48Å; Y480-A483 WeakPolarHBondContact O-CB 3.35Å; Y480-A483 PolarHBondContact O-N 3.24Å; V481-A483 VanDerWaalsContact C-N 3.34Å; V481-A483 PolarHBondContact O-N 3.43Å; A483-A485 VanDerWaalsContact C-N 3.31Å; A483-A485 PolarHBondContact O-N 2.96Å; A483-K486 CarbonylContact O-C 3.58Å; A483-K486 PolarHBondContact O-N 3.47Å; A483-H487 PolarHBondContact O-N 3.19Å
484	Y	86.1	Confident	86.8	Confident	5 Å²	5	52.5 Å²	52.5	2%	0.02	26%	0.263	C	S	.	.	H	α-helix	trans	-61.8	-39.7	174.5	-80.7	-112.7	0	0	0	111.1	K306 D396 P397 E428 Y480 K486 H487 F493	K306-Y484 PolarHBondContact NZ-OH 3.31Å; D396-Y484 PolarHBondContact OD1-OH 3.12Å; P397-Y484 WeakPolarHBondContact CD-OH 3.46Å; P397-Y484 HydrophobicContact CG-CE1 4.42Å; E428-Y484 WeakPolarHBondContact OE1-CE1 3.38Å; Y480-Y484 AromaticContact CD1-CD2 3.82Å; Y480-Y484 HydrophobicContact CD1-CD2 3.82Å; Y480-Y484 AromaticContact CD1-CE2 3.93Å; Y480-Y484 HydrophobicContact CD1-CE2 3.93Å; Y480-Y484 HydrophobicContact CD2-CD2 4.38Å; Y480-Y484 AromaticContact CD2-CE2 3.84Å; Y480-Y484 HydrophobicContact CD2-CE2 3.84Å; Y480-Y484 AromaticContact CE1-CD2 3.64Å; Y480-Y484 HydrophobicContact CE1-CD2 3.64Å; Y480-Y484 HydrophobicContact CE1-CE1 4.43Å; Y480-Y484 AromaticContact CE1-CE2 3.47Å; Y480-Y484 HydrophobicContact CE1-CE2 3.47Å; Y480-Y484 VanDerWaalsContact CE1-CE2 3.47Å; Y480-Y484 HydrophobicContact CE1-CG 4.2Å; Y480-Y484 AromaticContact CE1-CZ 3.89Å; Y480-Y484 HydrophobicContact CE2-CD2 4.31Å; Y480-Y484 AromaticContact CE2-CE2 3.46Å; Y480-Y484 HydrophobicContact CE2-CE2 3.46Å; Y480-Y484 VanDerWaalsContact CE2-CE2 3.46Å; Y480-Y484 AromaticContact CE2-CZ 3.91Å; Y480-Y484 HydrophobicContact CG-CD2 4.18Å; Y480-Y484 HydrophobicContact CG-CE2 4.09Å; Y480-Y484 AromaticContact CZ-CD2 3.93Å; Y480-Y484 AromaticContact CZ-CE2 3.23Å; Y480-Y484 AromaticContact CZ-CZ 3.42Å; Y480-Y484 VanDerWaalsContact CZ-CZ 3.42Å; Y480-Y484 WeakPolarHBondContact O-CD2 3.46Å; Y480-Y484 PolarHBondContact O-N 3.13Å; Y480-Y484 VanDerWaalsContact OH-CZ 3.28Å; Y480-Y484 PolarHBondContact OH-OH 3.4Å; Y484-K486 PolarHBondContact O-N 2.95Å; Y484-H487 WeakPolarHBondContact O-CB 3.44Å; Y484-H487 PolarHBondContact O-N 2.99Å; Y484-H487 VanDerWaalsContact O-N 3.14Å; Y484-F493 HydrophobicContact CD1-CB 4.25Å; Y484-F493 HydrophobicContact CD1-CD1 4.13Å; Y484-F493 HydrophobicContact CD1-CG 4.5Å; Y484-F493 HydrophobicContact CE1-CD1 4.06Å
485	A	84.9	Confident	85.6	Confident	57 Å²	57	52.2 Å²	52.2	47%	0.471	26%	0.263	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.6	-5	175.5	0	0	0	0	0	114.7	V481 A483 V495	V481-A485 WeakPolarHBondContact O-CB 3.36Å; V481-A485 PolarHBondContact O-N 3.16Å; A483-A485 VanDerWaalsContact C-N 3.31Å; A483-A485 PolarHBondContact O-N 2.96Å; A485-V495 HydrophobicContact CB-CB 4.27Å; A485-V495 HydrophobicContact CB-CG1 4.39Å; A485-V495 HydrophobicContact CB-CG2 3.98Å
486	K	85.9	Confident	84	Confident	171 Å²	171	53.6 Å²	53.6	74%	0.743	27%	0.274	S	S	*	.	T	Hydrogen-bonded Turn	trans	-123.6	13.6	177.8	-66.6	179.7	-179.8	-176.1	0	112.7	Q482 A483 Y484	Q482-K486 WeakPolarHBondContact O-CD 3.33Å; Q482-K486 WeakPolarHBondContact O-CG 3.34Å; A483-K486 CarbonylContact O-C 3.58Å; A483-K486 PolarHBondContact O-N 3.47Å; Y484-K486 PolarHBondContact O-N 2.95Å
487	H	87.4	Confident	81.9	Confident	9 Å²	9	56.2 Å²	56.2	4%	0.042	30%	0.301	C	S	.	.			trans	-70.1	138.4	-178.9	-161	-42	0	0	0	110.9	P398 S399 A483 Y484 C489 S490 F493	P398-H487 PolarHBondContact O-CE1 3.42Å; P398-H487 PolarHBondContact O-NE2 2.97Å; S399-H487 PolarHBondContact O-ND1 3.29Å; A483-H487 PolarHBondContact O-N 3.19Å; Y484-H487 WeakPolarHBondContact O-CB 3.44Å; Y484-H487 PolarHBondContact O-N 2.99Å; Y484-H487 VanDerWaalsContact O-N 3.14Å; H487-C489 VanDerWaalsContact C-N 3.35Å; H487-C489 PolarHBondContact ND1-N 3.17Å; H487-C489 PolarHBondContact O-N 3.42Å; H487-S490 WeakPolarHBondContact O-CB 3.49Å; H487-S490 PolarHBondContact O-N 3.37Å; H487-F493 HydrophobicContact CB-CB 4.22Å; H487-F493 HydrophobicContact CB-CD2 4.27Å; H487-F493 AromaticContact CD2-CD2 3.26Å; H487-F493 WeakPolarHBondContact CD2-CD2 3.21Å; H487-F493 AromaticContact CD2-CE2 3.65Å; H487-F493 AromaticContact CD2-CG 3.67Å; H487-F493 AromaticContact CE1-CD2 3.67Å; H487-F493 AromaticContact CE1-CE2 3.53Å; H487-F493 AromaticContact CG-CD2 3.51Å; H487-F493 AromaticContact ND1-CD2 3.76Å; H487-F493 AromaticContact NE2-CD2 3.39Å; H487-F493 WeakPolarHBondContact NE2-CD2 3.35Å; H487-F493 AromaticContact NE2-CE2 3.23Å; H487-F493 WeakPolarHBondContact NE2-CE2 3.14Å; H487-F493 AromaticContact NE2-CZ 3.89Å
488	E	85.3	Confident	79.8	Confident	106 Å²	106	64.6 Å²	64.6	50%	0.495	34%	0.344	S	S	.	.	T	Hydrogen-bonded Turn	trans	-49.3	-53.9	175.4	-179.7	-177.7	-142.2	0	0	111.4	S399 S400 A401 S490	S399-E488 VanDerWaalsContact O-CB 3.24Å; S399-E488 WeakPolarHBondContact O-CB 3.2Å; S399-E488 PolarHBondContact O-N 3.42Å; S400-E488 WeakPolarHBondContact CA-OE2 3.48Å; S400-E488 VanDerWaalsContact CB-OE2 3.27Å; S400-E488 WeakPolarHBondContact CB-OE2 3.32Å; A401-E488 PolarHBondContact N-OE2 2.91Å; E488-S490 PolarHBondContact O-N 3.34Å
489	C	83.9	Confident	77.9	Confident	12 Å²	12	65.8 Å²	65.8	8%	0.081	35%	0.349	C	S	.	.	T	Hydrogen-bonded Turn	trans	-74.4	45.9	175.9	-45.9	0	0	0	0	113.6	F434 H487 L491 I492 F493	F434-C489 WeakPolarHBondContact CE1-SG 3.42Å; H487-C489 VanDerWaalsContact C-N 3.35Å; H487-C489 PolarHBondContact ND1-N 3.17Å; H487-C489 PolarHBondContact O-N 3.42Å; C489-L491 PolarHBondContact O-N 3.39Å; C489-I492 HydrophobicContact CB-CD1 4.33Å; C489-I492 PolarHBondContact O-N 2.87Å; C489-F493 HydrophobicContact CB-CD2 3.83Å; C489-F493 HydrophobicContact CB-CE2 3.88Å; C489-F493 PolarHBondContact O-N 3.43Å
490	S	82.1	Confident	76.4	Confident	74 Å²	74	65.2 Å²	65.2	52%	0.517	34%	0.344	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.9	-22.9	-177.6	56.7	0	0	0	0	115.2	H487 E488 I492	H487-S490 WeakPolarHBondContact O-CB 3.49Å; H487-S490 PolarHBondContact O-N 3.37Å; E488-S490 PolarHBondContact O-N 3.34Å; S490-I492 VanDerWaalsContact C-N 3.3Å
491	L	82.4	Confident	75.6	Confident	133 Å²	133	68.5 Å²	68.5	70%	0.696	36%	0.362	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.5	-20.6	173.1	-66.9	178	0	0	0	113.9	C489 R494	C489-L491 PolarHBondContact O-N 3.39Å; L491-R494 PolarHBondContact O-NE 3.06Å; L491-R494 PolarHBondContact O-NH2 3.07Å
492	I	84	Confident	75.2	Confident	38 Å²	38	68.9 Å²	68.9	20%	0.195	36%	0.364	C	S	.	.	T	Hydrogen-bonded Turn	trans	-97.9	-53.3	175.5	-55.5	177	0	0	0	108.9	Y431 F434 C489 S490 R494	Y431-I492 HydrophobicContact CD2-CD1 4.35Å; F434-I492 HydrophobicContact CB-CD1 4.14Å; F434-I492 HydrophobicContact CG-CD1 4.33Å; C489-I492 HydrophobicContact CB-CD1 4.33Å; C489-I492 PolarHBondContact O-N 2.87Å; S490-I492 VanDerWaalsContact C-N 3.3Å; I492-R494 VanDerWaalsContact C-N 3.28Å; I492-R494 PolarHBondContact O-N 3.13Å
493	F	82.1	Confident	74.9	Confident	5 Å²	5	65.5 Å²	65.5	2%	0.022	35%	0.349	C	S	.	.	S	Bend	trans	-84.6	65	-177.8	-57.4	-72.6	0	0	0	112.1	P397 E428 Y431 Y484 H487 C489 V495	P397-F493 HydrophobicContact CB-CE1 4.12Å; P397-F493 HydrophobicContact CB-CZ 3.78Å; P397-F493 HydrophobicContact CG-CD1 4.3Å; P397-F493 HydrophobicContact CG-CE1 3.48Å; P397-F493 VanDerWaalsContact CG-CE1 3.48Å; P397-F493 HydrophobicContact CG-CZ 3.7Å; E428-F493 HydrophobicContact CB-CE1 4Å; E428-F493 VanDerWaalsContact CD-CE1 3.5Å; E428-F493 HydrophobicContact CG-CD1 3.82Å; E428-F493 HydrophobicContact CG-CE1 3.61Å; Y431-F493 HydrophobicContact CD1-CZ 4.07Å; Y431-F493 AromaticContact CD2-CE2 3.57Å; Y431-F493 HydrophobicContact CD2-CE2 3.57Å; Y431-F493 AromaticContact CD2-CZ 3.63Å; Y431-F493 HydrophobicContact CD2-CZ 3.63Å; Y431-F493 HydrophobicContact CE1-CZ 4.36Å; Y431-F493 AromaticContact CE2-CE2 3.72Å; Y431-F493 HydrophobicContact CE2-CE2 3.72Å; Y431-F493 AromaticContact CE2-CZ 3.96Å; Y431-F493 HydrophobicContact CE2-CZ 3.96Å; Y431-F493 HydrophobicContact CG-CE2 4.13Å; Y431-F493 AromaticContact CG-CZ 3.68Å; Y431-F493 HydrophobicContact CG-CZ 3.68Å; Y484-F493 HydrophobicContact CD1-CB 4.25Å; Y484-F493 HydrophobicContact CD1-CD1 4.13Å; Y484-F493 HydrophobicContact CD1-CG 4.5Å; Y484-F493 HydrophobicContact CE1-CD1 4.06Å; H487-F493 HydrophobicContact CB-CB 4.22Å; H487-F493 HydrophobicContact CB-CD2 4.27Å; H487-F493 AromaticContact CD2-CD2 3.26Å; H487-F493 WeakPolarHBondContact CD2-CD2 3.21Å; H487-F493 AromaticContact CD2-CE2 3.65Å; H487-F493 AromaticContact CD2-CG 3.67Å; H487-F493 AromaticContact CE1-CD2 3.67Å; H487-F493 AromaticContact CE1-CE2 3.53Å; H487-F493 AromaticContact CG-CD2 3.51Å; H487-F493 AromaticContact ND1-CD2 3.76Å; H487-F493 AromaticContact NE2-CD2 3.39Å; H487-F493 WeakPolarHBondContact NE2-CD2 3.35Å; H487-F493 AromaticContact NE2-CE2 3.23Å; H487-F493 WeakPolarHBondContact NE2-CE2 3.14Å; H487-F493 AromaticContact NE2-CZ 3.89Å; C489-F493 HydrophobicContact CB-CD2 3.83Å; C489-F493 HydrophobicContact CB-CE2 3.88Å; C489-F493 PolarHBondContact O-N 3.43Å; F493-V495 PolarHBondContact O-N 2.95Å
494	R	71.5	Confident	74.7	Confident	129 Å²	129	65.1 Å²	65.1	49%	0.487	34%	0.344	S	S	.	.			trans	-76.9	112.7	-173.9	-62.9	-177.1	-175.3	-164.6	-0.4	112.5	L491 I492	L491-R494 PolarHBondContact O-NE 3.06Å; L491-R494 PolarHBondContact O-NH2 3.07Å; I492-R494 VanDerWaalsContact C-N 3.28Å; I492-R494 PolarHBondContact O-N 3.13Å
495	V	67.3	Low	74.7	Confident	18 Å²	18	65 Å²	65	11%	0.109	34%	0.344	C	S	.	.	S	Bend	trans	-90.1	-3.9	172.9	-170.4	0	0	0	0	112.6	V481 A485 F493 L500 F502	V481-V495 HydrophobicContact CG1-CG1 3.9Å; A485-V495 HydrophobicContact CB-CB 4.27Å; A485-V495 HydrophobicContact CB-CG1 4.39Å; A485-V495 HydrophobicContact CB-CG2 3.98Å; F493-V495 PolarHBondContact O-N 2.95Å; V495-L500 HydrophobicContact CB-CD1 4.4Å; V495-L500 HydrophobicContact CG2-CD1 3.86Å; V495-F502 HydrophobicContact CG1-CZ 4.18Å
496	K	58.4	Low	74.8	Confident	192 Å²	192	62.3 Å²	62.3	84%	0.835	32%	0.322	S	S	*	.	S	Bend	trans	-128.7	122.8	174.9	-65.1	179.8	-178.2	176.1	0	108.8
497	G	49.9	Very low	74.9	Confident	55 Å²	55	56 Å²	56	57%	0.567	30%	0.296	S	S	*	.	S	Bend	trans	127.3	175.1	-161	0	0	0	0	0	109.3	D499	G497-D499 PolarHBondContact O-N 2.81Å
498	L	46.3	Very low	75	Confident	175 Å²	175	55.7 Å²	55.7	92%	0.916	30%	0.295	S	S	*	.	S	Bend	trans	-76.4	-8.6	-177.4	-101.7	67	0	0	0	113.8
499	D	51.9	Low	75.2	Confident	61 Å²	61	50.8 Å²	50.8	33%	0.326	27%	0.272	S	S	.	.			trans	-83.8	-22.6	-153.6	-46	-47.6	0	0	0	114.8	M427 G497	M427-D499 HydrophobicContact CB-CB 4.41Å; M427-D499 HydrophobicContact CE-CB 3.93Å; M427-D499 VanDerWaalsContact CE-OD1 3.3Å; M427-D499 WeakPolarHBondContact CE-OD1 3.49Å; M427-D499 HydrophobicContact CG-CB 4.13Å; G497-D499 PolarHBondContact O-N 2.81Å
500	L	60.5	Low	75.5	Confident	15 Å²	15	50.3 Å²	50.3	8%	0.079	27%	0.27	C	S	.	.	S	Bend	trans	-103.9	90.2	-178.4	-131.7	172.5	0	0	0	109.5	V495 F502 L505	V495-L500 HydrophobicContact CB-CD1 4.4Å; V495-L500 HydrophobicContact CG2-CD1 3.86Å; L500-F502 WeakPolarHBondContact O-CD2 3.3Å; L500-F502 WeakPolarHBondContact O-CE2 3.48Å; L500-F502 PolarHBondContact O-N 3.35Å; L500-L505 HydrophobicContact CD2-CD2 3.97Å
501	D	74.1	Confident	75.8	Confident	72 Å²	72	47.1 Å²	47.1	39%	0.385	25%	0.247	S	C	.	.			trans	-66.5	105.4	177.6	179.5	20.8	0	0	0	111.2	V503 S504 L505	D501-V503 PolarHBondContact O-N 2.96Å; D501-V503 WeakPolarHBondContact OD1-CA 3.2Å; D501-V503 VanDerWaalsContact OD1-CB 3.3Å; D501-V503 WeakPolarHBondContact OD1-CB 3.32Å; D501-V503 PolarHBondContact OD1-N 3.3Å; D501-S504 WeakPolarHBondContact OD2-CB 3.14Å; D501-S504 PolarHBondContact OD2-N 3.39Å; D501-S504 PolarHBondContact OD2-OG 3.01Å; D501-L505 WeakPolarHBondContact O-CB 3.21Å; D501-L505 PolarHBondContact O-N 2.86Å
502	F	78.5	Confident	76	Confident	11 Å²	11	40.9 Å²	40.9	5%	0.048	21%	0.214	C	C	.	.	H	α-helix	trans	-66.9	-19.6	176.6	-65.2	-84.4	0	0	0	112.7	F477 V481 V495 L500 A506 L520 F525	F477-F502 HydrophobicContact CZ-CD1 4.28Å; V481-F502 HydrophobicContact CG1-CE1 4.14Å; V481-F502 HydrophobicContact CG2-CE1 4.28Å; V495-F502 HydrophobicContact CG1-CZ 4.18Å; L500-F502 WeakPolarHBondContact O-CD2 3.3Å; L500-F502 WeakPolarHBondContact O-CE2 3.48Å; L500-F502 PolarHBondContact O-N 3.35Å; F502-A506 WeakPolarHBondContact O-CB 3.47Å; F502-A506 PolarHBondContact O-N 2.95Å; F502-L520 HydrophobicContact CB-CD2 4.19Å; F502-L520 HydrophobicContact CD1-CD2 3.57Å; F502-L520 HydrophobicContact CD2-CD2 4.37Å; F502-L520 HydrophobicContact CE1-CD2 3.99Å; F502-L520 HydrophobicContact CG-CD2 3.78Å; F502-F525 HydrophobicContact CB-CD1 4.48Å; F502-F525 HydrophobicContact CB-CE1 3.85Å; F502-F525 HydrophobicContact CB-CZ 4.2Å; F502-F525 HydrophobicContact CD2-CE1 4.12Å; F502-F525 HydrophobicContact CD2-CZ 4.32Å; F502-F525 HydrophobicContact CG-CE1 4.3Å; F502-F525 HydrophobicContact CG-CZ 4.39Å
503	V	81.9	Confident	76.1	Confident	12 Å²	12	43 Å²	43	7%	0.073	22%	0.219	C	C	.	.	H	α-helix	trans	-77	-59.6	176.6	-174.1	0	0	0	0	110.3	D501 L505 A506 N507 F525 D527 F528	D501-V503 PolarHBondContact O-N 2.96Å; D501-V503 WeakPolarHBondContact OD1-CA 3.2Å; D501-V503 VanDerWaalsContact OD1-CB 3.3Å; D501-V503 WeakPolarHBondContact OD1-CB 3.32Å; D501-V503 PolarHBondContact OD1-N 3.3Å; V503-L505 PolarHBondContact O-N 2.8Å; V503-A506 PolarHBondContact O-N 3.46Å; V503-A506 VanDerWaalsContact O-N 3.08Å; V503-N507 PolarHBondContact O-N 2.97Å; V503-F525 HydrophobicContact CG2-CB 4.21Å; V503-F525 HydrophobicContact CG2-CD1 4.1Å; V503-D527 HydrophobicContact CG1-CB 4.39Å; V503-F528 HydrophobicContact CG1-CB 4.14Å; V503-F528 HydrophobicContact CG1-CD2 4.27Å; V503-F528 HydrophobicContact CG2-CB 4.31Å
504	S	84.1	Confident	76.2	Confident	18 Å²	18	44.8 Å²	44.8	13%	0.126	23%	0.229	C	C	.	.	H	α-helix	trans	-55.1	-38.2	171.7	-76.2	0	0	0	0	112.2	E304 D501 N507 G508	E304-S504 PolarHBondContact N-O 2.95Å; E304-S504 PolarHBondContact OE1-OG 3.35Å; E304-S504 WeakPolarHBondContact OE2-CB 3.49Å; E304-S504 PolarHBondContact OE2-OG 3.4Å; D501-S504 WeakPolarHBondContact OD2-CB 3.14Å; D501-S504 PolarHBondContact OD2-N 3.39Å; D501-S504 PolarHBondContact OD2-OG 3.01Å; S504-N507 PolarHBondContact O-N 3.45Å; S504-G508 PolarHBondContact O-N 3.06Å
505	L	86.6	Confident	76.8	Confident	3 Å²	3	39.2 Å²	39.2	2%	0.016	21%	0.21	C	C	.	.	H	α-helix	trans	-65.6	-43.2	175.5	-173.9	67.2	0	0	0	112.2	A303 F477 Y480 V481 L500 D501 V503 N507 G508 F509	A303-L505 HydrophobicContact CB-CB 4.28Å; A303-L505 HydrophobicContact CB-CD1 4.22Å; F477-L505 HydrophobicContact CD2-CD2 4.34Å; F477-L505 HydrophobicContact CD2-CG 4.17Å; F477-L505 HydrophobicContact CE2-CB 4.17Å; F477-L505 HydrophobicContact CE2-CD2 3.78Å; F477-L505 HydrophobicContact CE2-CG 3.74Å; F477-L505 HydrophobicContact CZ-CD2 4.26Å; Y480-L505 HydrophobicContact CD1-CD1 4.19Å; Y480-L505 HydrophobicContact CD1-CD2 3.92Å; Y480-L505 HydrophobicContact CE1-CD1 3.55Å; Y480-L505 HydrophobicContact CE1-CD2 3.74Å; Y480-L505 HydrophobicContact CE1-CG 4.29Å; Y480-L505 HydrophobicContact CE2-CD1 4.47Å; V481-L505 HydrophobicContact CG2-CD2 4.03Å; L500-L505 HydrophobicContact CD2-CD2 3.97Å; D501-L505 WeakPolarHBondContact O-CB 3.21Å; D501-L505 PolarHBondContact O-N 2.86Å; V503-L505 PolarHBondContact O-N 2.8Å; L505-N507 VanDerWaalsContact C-N 3.3Å; L505-N507 PolarHBondContact O-N 3.33Å; L505-G508 PolarHBondContact O-N 3.19Å; L505-F509 HydrophobicContact CD1-CD2 3.94Å; L505-F509 HydrophobicContact CD1-CE2 3.83Å; L505-F509 HydrophobicContact CG-CD2 4.22Å; L505-F509 HydrophobicContact CG-CE2 4.42Å; L505-F509 WeakPolarHBondContact O-CD2 3.29Å; L505-F509 PolarHBondContact O-N 3Å
506	A	87.6	Confident	77.4	Confident	0 Å²	0	49 Å²	49	0%	0	25%	0.251	C	S	.	.	H	α-helix	trans	-67.7	-32	176.8	0	0	0	0	0	112.2	F477 F502 V503 F509 A510 L511 L514 F528	F477-A506 HydrophobicContact CE2-CB 3.94Å; F502-A506 WeakPolarHBondContact O-CB 3.47Å; F502-A506 PolarHBondContact O-N 2.95Å; V503-A506 PolarHBondContact O-N 3.46Å; V503-A506 VanDerWaalsContact O-N 3.08Å; A506-F509 CarbonylContact O-C 3.59Å; A506-A510 PolarHBondContact O-N 3.44Å; A506-L511 HydrophobicContact CB-CB 4.48Å; A506-L511 HydrophobicContact CB-CD1 4.06Å; A506-L511 HydrophobicContact CB-CG 4.45Å; A506-L511 PolarHBondContact O-N 2.87Å; A506-L514 HydrophobicContact CB-CD2 3.52Å; A506-F528 HydrophobicContact CB-CD2 3.98Å; A506-F528 HydrophobicContact CB-CE2 3.55Å; A506-F528 HydrophobicContact CB-CZ 4.47Å
507	N	87.9	Confident	78.5	Confident	39 Å²	39	40.5 Å²	40.5	21%	0.209	21%	0.214	C	C	.	.	H	α-helix	trans	-65.5	-47.7	171	-80.1	-31.6	0	0	0	112	E304 K460 V503 S504 L505 F509 A510	E304-N507 HydrophobicContact CB-CB 4.23Å; K460-N507 PolarHBondContact NZ-OD1 3Å; V503-N507 PolarHBondContact O-N 2.97Å; S504-N507 PolarHBondContact O-N 3.45Å; L505-N507 VanDerWaalsContact C-N 3.3Å; L505-N507 PolarHBondContact O-N 3.33Å; N507-F509 VanDerWaalsContact C-N 3.29Å; N507-F509 PolarHBondContact O-N 3.2Å; N507-A510 VanDerWaalsContact O-CA 3.29Å; N507-A510 WeakPolarHBondContact O-CA 3.44Å; N507-A510 PolarHBondContact O-N 3.08Å
508	G	87.6	Confident	79.7	Confident	2 Å²	2	42.8 Å²	42.8	2%	0.021	22%	0.219	C	C	.	.	H	α-helix	trans	-63.9	-30.3	175.8	0	0	0	0	0	114	L456 S504 L505 A510	L456-G508 WeakPolarHBondContact CD2-O 3.34Å; S504-G508 PolarHBondContact O-N 3.06Å; L505-G508 PolarHBondContact O-N 3.19Å; G508-A510 PolarHBondContact O-N 3.33Å
509	F	90.2	Very high	81.2	Confident	2 Å²	2	37 Å²	37	1%	0.009	19%	0.187	C	C	.	.	T	Hydrogen-bonded Turn	trans	-80.2	2.6	167.9	-87	-97.8	0	0	0	114	F334 F335 A476 F477 Y480 L505 A506 N507 L511	F334-F509 HydrophobicContact CD1-CD1 4.33Å; F334-F509 HydrophobicContact CE1-CD1 4.17Å; F334-F509 VanDerWaalsContact CZ-O 3.28Å; F334-F509 WeakPolarHBondContact CZ-O 3.32Å; F335-F509 HydrophobicContact CE2-CD1 4.19Å; F335-F509 AromaticContact CE2-CE1 3.53Å; F335-F509 HydrophobicContact CE2-CE1 3.53Å; F335-F509 HydrophobicContact CE2-CE2 4.44Å; F335-F509 AromaticContact CE2-CZ 3.68Å; F335-F509 HydrophobicContact CE2-CZ 3.68Å; F335-F509 AromaticContact CZ-CD1 3.85Å; F335-F509 HydrophobicContact CZ-CD1 3.85Å; F335-F509 HydrophobicContact CZ-CD2 4.35Å; F335-F509 AromaticContact CZ-CE1 3.63Å; F335-F509 HydrophobicContact CZ-CE1 3.63Å; F335-F509 HydrophobicContact CZ-CE2 4.15Å; F335-F509 HydrophobicContact CZ-CG 4.21Å; F335-F509 AromaticContact CZ-CZ 3.79Å; F335-F509 HydrophobicContact CZ-CZ 3.79Å; A476-F509 HydrophobicContact CB-CD1 4.11Å; A476-F509 HydrophobicContact CB-CE1 3.71Å; F477-F509 HydrophobicContact CB-CD1 4Å; F477-F509 HydrophobicContact CB-CE1 4.45Å; F477-F509 HydrophobicContact CB-CG 4.18Å; F477-F509 HydrophobicContact CD2-CB 4.15Å; F477-F509 HydrophobicContact CD2-CD2 4.15Å; F477-F509 HydrophobicContact CD2-CG 4.08Å; Y480-F509 HydrophobicContact CD1-CE2 4.42Å; Y480-F509 AromaticContact CD2-CE2 3.75Å; Y480-F509 HydrophobicContact CD2-CE2 3.75Å; Y480-F509 AromaticContact CD2-CZ 3.48Å; Y480-F509 HydrophobicContact CD2-CZ 3.48Å; Y480-F509 VanDerWaalsContact CD2-CZ 3.48Å; Y480-F509 AromaticContact CE2-CE2 3.94Å; Y480-F509 HydrophobicContact CE2-CE2 3.94Å; Y480-F509 HydrophobicContact CE2-CZ 4.08Å; Y480-F509 AromaticContact CG-CE2 3.97Å; Y480-F509 HydrophobicContact CG-CE2 3.97Å; Y480-F509 AromaticContact CG-CZ 3.77Å; Y480-F509 HydrophobicContact CG-CZ 3.77Å; L505-F509 HydrophobicContact CD1-CD2 3.94Å; L505-F509 HydrophobicContact CD1-CE2 3.83Å; L505-F509 HydrophobicContact CG-CD2 4.22Å; L505-F509 HydrophobicContact CG-CE2 4.42Å; L505-F509 WeakPolarHBondContact O-CD2 3.29Å; L505-F509 PolarHBondContact O-N 3Å; A506-F509 CarbonylContact O-C 3.59Å; N507-F509 VanDerWaalsContact C-N 3.29Å; N507-F509 PolarHBondContact O-N 3.2Å; F509-L511 HydrophobicContact CB-CD2 4.13Å; F509-L511 HydrophobicContact CB-CG 3.97Å; F509-L511 PolarHBondContact O-N 3.3Å
510	A	90.1	Very high	82.3	Confident	3 Å²	3	34.8 Å²	34.8	3%	0.025	18%	0.175	C	C	.	.	T	Hydrogen-bonded Turn	trans	51.3	36.7	179.7	0	0	0	0	0	114	L456 V459 K460 A506 N507 G508	L456-A510 HydrophobicContact CD2-CB 4.41Å; V459-A510 HydrophobicContact CB-CB 3.6Å; V459-A510 HydrophobicContact CG1-CB 3.5Å; K460-A510 HydrophobicContact CG-CB 3.94Å; A506-A510 PolarHBondContact O-N 3.44Å; N507-A510 VanDerWaalsContact O-CA 3.29Å; N507-A510 WeakPolarHBondContact O-CA 3.44Å; N507-A510 PolarHBondContact O-N 3.08Å; G508-A510 PolarHBondContact O-N 3.33Å
511	L	88.5	Confident	82.9	Confident	7 Å²	7	42.8 Å²	42.8	4%	0.037	21%	0.21	C	C	.	.			trans	-70.9	143.6	-178.2	-59.3	-171.5	0	0	0	111.7	M474 F477 A506 F509	M474-L511 HydrophobicContact SD-CD1 4.39Å; M474-L511 HydrophobicContact SD-CD2 4.05Å; F477-L511 HydrophobicContact CB-CD1 3.99Å; F477-L511 HydrophobicContact CD1-CD1 4.35Å; F477-L511 HydrophobicContact CD2-CD1 3.73Å; F477-L511 HydrophobicContact CE2-CD1 4.24Å; F477-L511 HydrophobicContact CG-CD1 3.78Å; A506-L511 HydrophobicContact CB-CB 4.48Å; A506-L511 HydrophobicContact CB-CD1 4.06Å; A506-L511 HydrophobicContact CB-CG 4.45Å; A506-L511 PolarHBondContact O-N 2.87Å; F509-L511 HydrophobicContact CB-CD2 4.13Å; F509-L511 HydrophobicContact CB-CG 3.97Å; F509-L511 PolarHBondContact O-N 3.3Å
512	L	86.9	Confident	82.5	Confident	2 Å²	2	43.5 Å²	43.5	1%	0.01	23%	0.233	C	C	.	.	S	Bend	trans	-88	-27.2	173	-50	177.9	0	0	0	112.2	K460 A463 L464 F470 T531 T535 I538	K460-L512 HydrophobicContact CB-CD2 4.01Å; K460-L512 HydrophobicContact CG-CD2 4.17Å; A463-L512 HydrophobicContact CB-CD1 4.15Å; A463-L512 HydrophobicContact CB-CG 4.3Å; L464-L512 HydrophobicContact CD2-CD1 3.64Å; L464-L512 HydrophobicContact CD2-CD2 4.49Å; L464-L512 HydrophobicContact CG-CD1 3.82Å; L464-L512 HydrophobicContact CG-CD2 4.17Å; F470-L512 HydrophobicContact CD2-CB 4.32Å; F470-L512 HydrophobicContact CD2-CD1 3.83Å; F470-L512 HydrophobicContact CD2-CG 4.12Å; F470-L512 HydrophobicContact CE2-CB 4.08Å; F470-L512 HydrophobicContact CE2-CD1 4.3Å; F470-L512 HydrophobicContact CE2-CG 4.39Å; L512-T531 PolarHBondContact O-N 2.85Å; L512-T531 VanDerWaalsContact O-N 3.17Å; L512-T535 HydrophobicContact CB-CG2 3.95Å; L512-I538 HydrophobicContact CD1-CD1 3.65Å
513	R	85.7	Confident	82.1	Confident	82 Å²	82	47.7 Å²	47.7	31%	0.309	25%	0.252	S	S	.	.	S	Bend	trans	-147.2	152.2	173.3	72.5	177.4	-178.9	-164.4	0.8	110.8	F470 M474 T535 D536	F470-R513 HydrophobicContact CE2-CG 4.3Å; F470-R513 HydrophobicContact CZ-CG 4.04Å; M474-R513 HydrophobicContact CE-CG 3.97Å; M474-R513 WeakPolarHBondContact CE-O 3.32Å; R513-T535 HydrophobicContact CB-CG2 4.33Å; R513-T535 WeakPolarHBondContact CD-OG1 3.37Å; R513-T535 HydrophobicContact CG-CG2 4.17Å; R513-T535 PolarHBondContact NH1-OG1 2.64Å; R513-D536 IonicContact CZ-OD1 3.71Å; R513-D536 IonicContact CZ-OD2 2.68Å; R513-D536 IonicContact NH1-OD1 3.58Å; R513-D536 IonicContact NH1-OD2 2.64Å; R513-D536 PolarHBondContact NH1-OD2 3.03Å; R513-D536 IonicContact NH2-OD1 3.8Å; R513-D536 PolarHBondContact NH2-OD1 3.33Å; R513-D536 IonicContact NH2-OD2 2.86Å; R513-D536 PolarHBondContact NH2-OD2 3Å; R513-D536 VanDerWaalsContact NH2-OD2 3.17Å
514	L	84.4	Confident	81.2	Confident	42 Å²	42	53.5 Å²	53.5	22%	0.22	29%	0.287	C	S	.	.			trans	-70	146.1	173.5	-67.2	173.4	0	0	0	112.1	A506 F525 F528	A506-L514 HydrophobicContact CB-CD2 3.52Å; L514-F525 HydrophobicContact CD1-CB 4.16Å; L514-F525 HydrophobicContact CD1-CD2 3.74Å; L514-F525 HydrophobicContact CD1-CE2 4.44Å; L514-F525 HydrophobicContact CD1-CG 4.11Å; L514-F528 HydrophobicContact CD1-CB 4.32Å; L514-F528 HydrophobicContact CD1-CD1 4.16Å; L514-F528 HydrophobicContact CD1-CG 4.09Å; L514-F528 HydrophobicContact CD2-CD2 4.16Å; L514-F528 HydrophobicContact CD2-CE2 4.2Å; L514-F528 HydrophobicContact CD2-CG 4.39Å; L514-F528 HydrophobicContact CD2-CZ 4.44Å; L514-F528 HydrophobicContact CG-CD1 3.9Å; L514-F528 HydrophobicContact CG-CD2 4.3Å; L514-F528 HydrophobicContact CG-CE1 4.05Å; L514-F528 HydrophobicContact CG-CE2 4.44Å; L514-F528 HydrophobicContact CG-CG 4.04Å; L514-F528 HydrophobicContact CG-CZ 4.32Å
515	P	84.4	Confident	80.8	Confident	13 Å²	13	55 Å²	55	8%	0.084	29%	0.292	C	S	.	.			trans	-77.1	150	176.4	30	-33.2	0	0	0	112.7	M474 F477 V478 M517 L520	M474-P515 HydrophobicContact CE-CB 3.86Å; F477-P515 HydrophobicContact CD1-CG 3.59Å; F477-P515 HydrophobicContact CE1-CG 3.77Å; V478-P515 HydrophobicContact CG2-CB 3.6Å; V478-P515 HydrophobicContact CG2-CG 3.72Å; P515-M517 HydrophobicContact CG-SD 3.85Å; P515-M517 PolarHBondContact O-N 2.97Å; P515-L520 HydrophobicContact CG-CD1 4.18Å
516	K	80.8	Confident	79.6	Confident	224 Å²	224	60.1 Å²	60.1	97%	0.974	33%	0.325	S	S	*	.			trans	-82.3	98.7	170.3	-66.5	-178.8	179.5	178.4	0	109.3
517	M	80.1	Confident	78.7	Confident	13 Å²	13	65.9 Å²	65.9	6%	0.064	36%	0.356	C	S	.	.			trans	-136.8	154.5	-179.7	68.4	-166.5	-69.9	0	0	112	F477 V478 V481 P515 E519 L520 K521	F477-M517 HydrophobicContact CD1-SD 4.29Å; F477-M517 HydrophobicContact CE1-SD 4Å; V478-M517 HydrophobicContact CB-CE 4.38Å; V478-M517 HydrophobicContact CG1-CE 4.08Å; V478-M517 HydrophobicContact CG2-CE 4.36Å; V478-M517 HydrophobicContact CG2-SD 3.91Å; V481-M517 HydrophobicContact CB-CE 3.83Å; V481-M517 HydrophobicContact CG1-CE 3.77Å; V481-M517 HydrophobicContact CG2-CE 4.45Å; P515-M517 HydrophobicContact CG-SD 3.85Å; P515-M517 PolarHBondContact O-N 2.97Å; M517-E519 WeakPolarHBondContact CB-OE2 3.48Å; M517-E519 HydrophobicContact CE-CB 4.19Å; M517-E519 VanDerWaalsContact CE-CD 3.48Å; M517-E519 HydrophobicContact CE-CG 4.18Å; M517-E519 WeakPolarHBondContact CE-OE2 3.44Å; M517-E519 HydrophobicContact CG-CB 4.42Å; M517-E519 WeakPolarHBondContact CG-OE2 3.33Å; M517-E519 PolarHBondContact O-N 2.91Å; M517-L520 HydrophobicContact CG-CB 4.11Å; M517-L520 HydrophobicContact CG-CD1 3.88Å; M517-L520 HydrophobicContact CG-CG 3.72Å; M517-L520 PolarHBondContact O-N 3.31Å; M517-L520 HydrophobicContact SD-CD1 3.93Å; M517-L520 HydrophobicContact SD-CG 4.08Å; M517-K521 PolarHBondContact O-N 3.46Å
518	P	76.5	Confident	78	Confident	103 Å²	103	65 Å²	65	67%	0.669	35%	0.351	S	S	*	.	G	3₁₀ helix	trans	-52.1	-36.5	-178.8	-28.8	35.6	0	0	0	115.1	L520 K521	P518-L520 VanDerWaalsContact C-N 3.27Å; P518-L520 PolarHBondContact O-N 2.84Å; P518-K521 WeakPolarHBondContact O-CB 3.18Å; P518-K521 PolarHBondContact O-N 2.86Å
519	E	76.9	Confident	77.2	Confident	52 Å²	52	70.8 Å²	70.8	24%	0.243	39%	0.385	C	S	.	.	G	3₁₀ helix	trans	-71.7	-20.2	-174.3	-57.1	85.3	165.4	0	0	113.3	V481 M517 K523	V481-E519 HydrophobicContact CG1-CB 4.3Å; V481-E519 HydrophobicContact CG1-CG 4.2Å; M517-E519 WeakPolarHBondContact CB-OE2 3.48Å; M517-E519 HydrophobicContact CE-CB 4.19Å; M517-E519 VanDerWaalsContact CE-CD 3.48Å; M517-E519 HydrophobicContact CE-CG 4.18Å; M517-E519 WeakPolarHBondContact CE-OE2 3.44Å; M517-E519 HydrophobicContact CG-CB 4.42Å; M517-E519 WeakPolarHBondContact CG-OE2 3.33Å; M517-E519 PolarHBondContact O-N 2.91Å; E519-K523 PolarHBondContact O-NZ 3.04Å
520	L	75.1	Confident	76.1	Confident	16 Å²	16	73.3 Å²	73.3	8%	0.084	41%	0.406	C	S	.	.	G	3₁₀ helix	trans	-105.2	-3.2	175	-57.6	-179.3	0	0	0	112.4	F477 F502 P515 M517 P518 G522 K523 F525	F477-L520 HydrophobicContact CE1-CD1 4.29Å; F502-L520 HydrophobicContact CB-CD2 4.19Å; F502-L520 HydrophobicContact CD1-CD2 3.57Å; F502-L520 HydrophobicContact CD2-CD2 4.37Å; F502-L520 HydrophobicContact CE1-CD2 3.99Å; F502-L520 HydrophobicContact CG-CD2 3.78Å; P515-L520 HydrophobicContact CG-CD1 4.18Å; M517-L520 HydrophobicContact CG-CB 4.11Å; M517-L520 HydrophobicContact CG-CD1 3.88Å; M517-L520 HydrophobicContact CG-CG 3.72Å; M517-L520 PolarHBondContact O-N 3.31Å; M517-L520 HydrophobicContact SD-CD1 3.93Å; M517-L520 HydrophobicContact SD-CG 4.08Å; P518-L520 VanDerWaalsContact C-N 3.27Å; P518-L520 PolarHBondContact O-N 2.84Å; L520-G522 PolarHBondContact O-N 2.91Å; L520-K523 PolarHBondContact O-N 3.4Å; L520-F525 HydrophobicContact CB-CE2 4.36Å; L520-F525 HydrophobicContact CD2-CE2 3.82Å; L520-F525 HydrophobicContact CD2-CZ 3.6Å
521	K	73.4	Confident	74.9	Confident	183 Å²	183	75.3 Å²	75.3	80%	0.796	42%	0.418	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.2	117.8	-174.1	-173.2	-174.3	175.6	-170.9	0	110.8	M517 P518	M517-K521 PolarHBondContact O-N 3.46Å; P518-K521 WeakPolarHBondContact O-CB 3.18Å; P518-K521 PolarHBondContact O-N 2.86Å
522	G	64.4	Low	73.7	Confident	86 Å²	86	82 Å²	82	89%	0.887	46%	0.46	S	S	*	.	T	Hydrogen-bonded Turn	trans	87	6.4	179.7	0	0	0	0	0	114.6	L520	L520-G522 PolarHBondContact O-N 2.91Å
523	K	71	Confident	72.9	Confident	99 Å²	99	85 Å²	85	43%	0.43	48%	0.478	S	S	.	.			trans	-99	143.7	168.4	-65.2	176.8	179.4	168.8	0	110.1	E519 L520 F525	E519-K523 PolarHBondContact O-NZ 3.04Å; L520-K523 PolarHBondContact O-N 3.4Å; K523-F525 HydrophobicContact CB-CD2 4.47Å; K523-F525 HydrophobicContact CB-CE1 4.47Å; K523-F525 HydrophobicContact CB-CE2 3.6Å; K523-F525 HydrophobicContact CB-CZ 3.6Å; K523-F525 HydrophobicContact CD-CE1 4.47Å; K523-F525 HydrophobicContact CD-CE2 4.46Å; K523-F525 HydrophobicContact CD-CZ 3.72Å; K523-F525 HydrophobicContact CG-CZ 4.34Å
524	T	63.8	Low	72.3	Confident	134 Å²	134	85.5 Å²	85.5	82%	0.822	49%	0.487	S	S	*	.			trans	-105.8	147.4	167.6	42	0	0	0	0	109.5
525	F	74.3	Confident	71.9	Confident	49 Å²	49	84 Å²	84	22%	0.215	48%	0.479	C	S	.	.			trans	-134	83.5	-177.6	-60.8	-81.4	0	0	0	108.2	F502 V503 L514 L520 K523 D527 F528	F502-F525 HydrophobicContact CB-CD1 4.48Å; F502-F525 HydrophobicContact CB-CE1 3.85Å; F502-F525 HydrophobicContact CB-CZ 4.2Å; F502-F525 HydrophobicContact CD2-CE1 4.12Å; F502-F525 HydrophobicContact CD2-CZ 4.32Å; F502-F525 HydrophobicContact CG-CE1 4.3Å; F502-F525 HydrophobicContact CG-CZ 4.39Å; V503-F525 HydrophobicContact CG2-CB 4.21Å; V503-F525 HydrophobicContact CG2-CD1 4.1Å; L514-F525 HydrophobicContact CD1-CB 4.16Å; L514-F525 HydrophobicContact CD1-CD2 3.74Å; L514-F525 HydrophobicContact CD1-CE2 4.44Å; L514-F525 HydrophobicContact CD1-CG 4.11Å; L520-F525 HydrophobicContact CB-CE2 4.36Å; L520-F525 HydrophobicContact CD2-CE2 3.82Å; L520-F525 HydrophobicContact CD2-CZ 3.6Å; K523-F525 HydrophobicContact CB-CD2 4.47Å; K523-F525 HydrophobicContact CB-CE1 4.47Å; K523-F525 HydrophobicContact CB-CE2 3.6Å; K523-F525 HydrophobicContact CB-CZ 3.6Å; K523-F525 HydrophobicContact CD-CE1 4.47Å; K523-F525 HydrophobicContact CD-CE2 4.46Å; K523-F525 HydrophobicContact CD-CZ 3.72Å; K523-F525 HydrophobicContact CG-CZ 4.34Å; F525-D527 VanDerWaalsContact C-N 3.26Å; F525-D527 PolarHBondContact O-N 2.97Å; F525-F528 HydrophobicContact CB-CB 4.24Å; F525-F528 PolarHBondContact O-N 3.4Å
526	P	61.6	Low	71.4	Confident	112 Å²	112	86.7 Å²	86.7	73%	0.727	49%	0.493	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.6	-31.9	-174.1	26.2	-31.5	0	0	0	112.2	F528	P526-F528 VanDerWaalsContact C-N 3.27Å; P526-F528 PolarHBondContact O-N 3.33Å
527	D	69.5	Low	71.3	Confident	120 Å²	120	79.3 Å²	79.3	64%	0.642	47%	0.469	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.2	-7.4	-175.7	-39.5	-78.5	0	0	0	113.4	V503 F525 V529	V503-D527 HydrophobicContact CG1-CB 4.39Å; F525-D527 VanDerWaalsContact C-N 3.26Å; F525-D527 PolarHBondContact O-N 2.97Å; D527-V529 PolarHBondContact O-N 3.1Å; D527-V529 VanDerWaalsContact O-N 3.1Å
528	F	73.8	Confident	71.3	Confident	22 Å²	22	79.1 Å²	79.1	10%	0.096	47%	0.469	C	S	.	.			trans	-79.5	94.7	175.8	-175.4	-95.5	0	0	0	111	V503 A506 L514 F525 P526 A530	V503-F528 HydrophobicContact CG1-CB 4.14Å; V503-F528 HydrophobicContact CG1-CD2 4.27Å; V503-F528 HydrophobicContact CG2-CB 4.31Å; A506-F528 HydrophobicContact CB-CD2 3.98Å; A506-F528 HydrophobicContact CB-CE2 3.55Å; A506-F528 HydrophobicContact CB-CZ 4.47Å; L514-F528 HydrophobicContact CD1-CB 4.32Å; L514-F528 HydrophobicContact CD1-CD1 4.16Å; L514-F528 HydrophobicContact CD1-CG 4.09Å; L514-F528 HydrophobicContact CD2-CD2 4.16Å; L514-F528 HydrophobicContact CD2-CE2 4.2Å; L514-F528 HydrophobicContact CD2-CG 4.39Å; L514-F528 HydrophobicContact CD2-CZ 4.44Å; L514-F528 HydrophobicContact CG-CD1 3.9Å; L514-F528 HydrophobicContact CG-CD2 4.3Å; L514-F528 HydrophobicContact CG-CE1 4.05Å; L514-F528 HydrophobicContact CG-CE2 4.44Å; L514-F528 HydrophobicContact CG-CG 4.04Å; L514-F528 HydrophobicContact CG-CZ 4.32Å; F525-F528 HydrophobicContact CB-CB 4.24Å; F525-F528 PolarHBondContact O-N 3.4Å; P526-F528 VanDerWaalsContact C-N 3.27Å; P526-F528 PolarHBondContact O-N 3.33Å; F528-A530 VanDerWaalsContact C-N 3.31Å; F528-A530 HydrophobicContact CD1-CB 4.12Å; F528-A530 HydrophobicContact CE1-CB 3.88Å; F528-A530 PolarHBondContact O-N 3.18Å
529	V	70.1	Confident	71.6	Confident	123 Å²	123	82.9 Å²	82.9	75%	0.745	47%	0.47	S	S	*	.			trans	-68	86.9	172.7	-172.8	0	0	0	0	110.3	D527	D527-V529 PolarHBondContact O-N 3.1Å; D527-V529 VanDerWaalsContact O-N 3.1Å
530	A	66.9	Low	72	Confident	55 Å²	55	82.5 Å²	82.5	46%	0.455	47%	0.466	S	S	.	.			trans	-61.7	146.2	171.6	0	0	0	0	0	111	F528	F528-A530 VanDerWaalsContact C-N 3.31Å; F528-A530 HydrophobicContact CD1-CB 4.12Å; F528-A530 HydrophobicContact CE1-CB 3.88Å; F528-A530 PolarHBondContact O-N 3.18Å
531	T	65.6	Low	72.4	Confident	44 Å²	44	90.2 Å²	90.2	27%	0.27	50%	0.499	S	S	.	.			trans	-72.8	135.3	178.8	-50.6	0	0	0	0	110.4	L512 V533	L512-T531 PolarHBondContact O-N 2.85Å; L512-T531 VanDerWaalsContact O-N 3.17Å; T531-V533 HydrophobicContact CG2-CB 4.23Å; T531-V533 HydrophobicContact CG2-CG2 4.13Å; T531-V533 PolarHBondContact O-N 3.41Å; T531-V533 VanDerWaalsContact O-N 3.15Å
532	T	62.5	Low	72.9	Confident	149 Å²	149	84.9 Å²	84.9	91%	0.914	48%	0.479	S	S	*	.	S	Bend	trans	-66	-12.8	-177.6	50.2	0	0	0	0	114.9
533	V	69.3	Low	73.7	Confident	63 Å²	63	89.1 Å²	89.1	38%	0.382	47%	0.473	S	S	.	.	S	Bend	trans	-74.3	131	177.1	178.5	0	0	0	0	110.3	L464 T531 T535	L464-V533 HydrophobicContact CD2-CB 4.08Å; L464-V533 HydrophobicContact CD2-CG1 4.02Å; L464-V533 HydrophobicContact CD2-CG2 4.2Å; T531-V533 HydrophobicContact CG2-CB 4.23Å; T531-V533 HydrophobicContact CG2-CG2 4.13Å; T531-V533 PolarHBondContact O-N 3.41Å; T531-V533 VanDerWaalsContact O-N 3.15Å; V533-T535 PolarHBondContact O-N 3.17Å
534	D	73	Confident	74.2	Confident	94 Å²	94	89.5 Å²	89.5	50%	0.503	48%	0.48	S	S	.	.			trans	-59.5	104	168.2	169.2	32.9	0	0	0	110.5	D536 S537	D534-D536 PolarHBondContact O-N 3.27Å; D534-D536 VanDerWaalsContact O-N 3.13Å; D534-D536 PolarHBondContact OD1-N 3.11Å; D534-S537 WeakPolarHBondContact O-CB 3.43Å; D534-S537 PolarHBondContact O-N 3.15Å; D534-S537 VanDerWaalsContact O-N 3.11Å; D534-S537 PolarHBondContact O-OG 2.86Å; D534-S537 PolarHBondContact OD2-N 2.8Å
535	T	76.6	Confident	75	Confident	11 Å²	11	89.1 Å²	89.1	7%	0.067	46%	0.463	C	S	.	.	T	Hydrogen-bonded Turn	trans	-54.2	-27.3	176.7	49.1	0	0	0	0	114.7	R467 F470 L512 R513 V533 I538	R467-T535 PolarHBondContact NH1-O 3.17Å; F470-T535 HydrophobicContact CE2-CG2 4.05Å; F470-T535 HydrophobicContact CZ-CG2 4.32Å; L512-T535 HydrophobicContact CB-CG2 3.95Å; R513-T535 HydrophobicContact CB-CG2 4.33Å; R513-T535 WeakPolarHBondContact CD-OG1 3.37Å; R513-T535 HydrophobicContact CG-CG2 4.17Å; R513-T535 PolarHBondContact NH1-OG1 2.64Å; V533-T535 PolarHBondContact O-N 3.17Å; T535-I538 WeakPolarHBondContact O-CB 3.47Å; T535-I538 WeakPolarHBondContact O-CD1 3.42Å; T535-I538 WeakPolarHBondContact O-CG1 3.43Å; T535-I538 PolarHBondContact O-N 3.04Å
536	D	75.1	Confident	75.3	Confident	68 Å²	68	88 Å²	88	36%	0.364	46%	0.459	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.1	-14.1	-178.6	-69.5	-43.3	0	0	0	113.4	R467 R513 D534 I538 R549	R467-D536 IonicContact CZ-OD1 2.67Å; R467-D536 IonicContact NH1-OD1 3.12Å; R467-D536 PolarHBondContact NH1-OD1 3.13Å; R467-D536 IonicContact NH2-OD1 2.78Å; R467-D536 PolarHBondContact NH2-OD1 2.79Å; R513-D536 IonicContact CZ-OD1 3.71Å; R513-D536 IonicContact CZ-OD2 2.68Å; R513-D536 IonicContact NH1-OD1 3.58Å; R513-D536 IonicContact NH1-OD2 2.64Å; R513-D536 PolarHBondContact NH1-OD2 3.03Å; R513-D536 IonicContact NH2-OD1 3.8Å; R513-D536 PolarHBondContact NH2-OD1 3.33Å; R513-D536 IonicContact NH2-OD2 2.86Å; R513-D536 PolarHBondContact NH2-OD2 3Å; R513-D536 VanDerWaalsContact NH2-OD2 3.17Å; D534-D536 PolarHBondContact O-N 3.27Å; D534-D536 VanDerWaalsContact O-N 3.13Å; D534-D536 PolarHBondContact OD1-N 3.11Å; D536-I538 VanDerWaalsContact C-N 3.33Å; D536-R549 PolarHBondContact O-NH2 3.11Å
537	S	77.2	Confident	76.2	Confident	69 Å²	69	89.5 Å²	89.5	48%	0.483	45%	0.454	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.8	-27.2	164.6	77.9	0	0	0	0	114.2	D534 R539	D534-S537 WeakPolarHBondContact O-CB 3.43Å; D534-S537 PolarHBondContact O-N 3.15Å; D534-S537 VanDerWaalsContact O-N 3.11Å; D534-S537 PolarHBondContact O-OG 2.86Å; D534-S537 PolarHBondContact OD2-N 2.8Å; S537-R539 PolarHBondContact O-N 3.49Å
538	I	81.4	Confident	76.7	Confident	9 Å²	9	90.2 Å²	90.2	5%	0.046	45%	0.454	C	S	.	.	P	Polyproline II helix	trans	-56.7	126.4	-174.7	-57.7	173.2	0	0	0	110.3	L464 R467 L512 T535 D536 R549	L464-I538 HydrophobicContact CD2-CD1 4.23Å; R467-I538 HydrophobicContact CB-CG2 3.95Å; L512-I538 HydrophobicContact CD1-CD1 3.65Å; T535-I538 WeakPolarHBondContact O-CB 3.47Å; T535-I538 WeakPolarHBondContact O-CD1 3.42Å; T535-I538 WeakPolarHBondContact O-CG1 3.43Å; T535-I538 PolarHBondContact O-N 3.04Å; D536-I538 VanDerWaalsContact C-N 3.33Å; I538-R549 PolarHBondContact O-NH1 3.39Å
539	R	82.9	Confident	77	Confident	183 Å²	183	91.3 Å²	91.3	69%	0.691	46%	0.457	S	S	*	.	P	Polyproline II helix	trans	-95.7	155	-176.3	-58.4	-175.8	-177.9	-176.8	0.9	111.8	R467 S537	R467-R539 WeakPolarHBondContact CB-O 3.1Å; R467-R539 PolarHBondContact N-O 2.9Å; S537-R539 PolarHBondContact O-N 3.49Å
540	Y	84.9	Confident	77.6	Confident	43 Å²	43	90.7 Å²	90.7	17%	0.169	45%	0.446	C	S	.	.	P	Polyproline II helix	trans	-72.2	138.6	165.6	-73.4	-69.1	0	0	0	110.3	R467 A468 D471 D542 R545 R549	R467-Y540 HydrophobicContact CB-CD1 3.79Å; R467-Y540 HydrophobicContact CB-CE1 4.02Å; R467-Y540 HydrophobicContact CB-CG 4.07Å; R467-Y540 HydrophobicContact CG-CD1 4.32Å; R467-Y540 HydrophobicContact CG-CE1 4.08Å; R467-Y540 HydrophobicContact CG-CE2 4.41Å; A468-Y540 HydrophobicContact CB-CD1 3.77Å; A468-Y540 HydrophobicContact CB-CE1 3.78Å; D471-Y540 PolarHBondContact OD2-OH 3.24Å; Y540-D542 PolarHBondContact O-N 2.79Å; Y540-R545 HydrophobicContact CD1-CB 4.45Å; Y540-R545 HydrophobicContact CD2-CB 4.03Å; Y540-R545 HydrophobicContact CE2-CB 4.48Å; Y540-R545 HydrophobicContact CG-CB 4Å; Y540-R549 HydrophobicContact CD2-CB 4.24Å; Y540-R549 HydrophobicContact CE2-CB 3.98Å; Y540-R549 HydrophobicContact CE2-CG 4.37Å
541	K	83.1	Confident	78.4	Confident	178 Å²	178	94.8 Å²	94.8	77%	0.774	45%	0.454	S	S	*	.	S	Bend	trans	-67.3	-28.2	171.4	-172.4	173.4	-178.7	177.7	0	112.2	D466	D466-K541 HydrophobicContact CB-CB 4.05Å; D466-K541 PolarHBondContact OD1-N 3.27Å
542	D	83.6	Confident	79.1	Confident	71 Å²	71	98.4 Å²	98.4	38%	0.38	47%	0.469	S	S	.	.	S	Bend	trans	-77.5	114.2	171.5	171.9	2.6	0	0	0	111	Y540 N544 R545 Q546	Y540-D542 PolarHBondContact O-N 2.79Å; D542-N544 VanDerWaalsContact C-N 3.27Å; D542-N544 PolarHBondContact O-N 3.49Å; D542-N544 WeakPolarHBondContact OD1-CB 3.42Å; D542-N544 PolarHBondContact OD1-N 2.91Å; D542-R545 HydrophobicContact CB-CB 4.12Å; D542-R545 PolarHBondContact O-N 2.75Å; D542-R545 PolarHBondContact OD1-N 3.24Å; D542-R545 VanDerWaalsContact OD2-CD 3.32Å; D542-R545 WeakPolarHBondContact OD2-CD 3.41Å; D542-R545 WeakPolarHBondContact OD2-CG 3.48Å; D542-Q546 PolarHBondContact O-N 2.71Å
543	K	81.2	Confident	80	Confident	175 Å²	175	95 Å²	95	76%	0.761	44%	0.444	S	S	*	.	H	α-helix	trans	-58.1	-34.2	178.9	-66.4	-178.1	179	178.8	0	112.9	K547	K543-K547 WeakPolarHBondContact O-CG 3.36Å; K543-K547 PolarHBondContact O-N 3.38Å
544	N	82	Confident	80.5	Confident	108 Å²	108	94 Å²	94	58%	0.578	44%	0.443	S	S	*	.	H	α-helix	trans	-76.1	-43.7	-177.3	-69	-16.3	0	0	0	111	D542 Q546 K547 Q548	D542-N544 VanDerWaalsContact C-N 3.27Å; D542-N544 PolarHBondContact O-N 3.49Å; D542-N544 WeakPolarHBondContact OD1-CB 3.42Å; D542-N544 PolarHBondContact OD1-N 2.91Å; N544-Q546 VanDerWaalsContact C-N 3.31Å; N544-Q546 PolarHBondContact O-N 3.47Å; N544-K547 PolarHBondContact O-N 2.94Å; N544-Q548 WeakPolarHBondContact O-CG 3.37Å; N544-Q548 PolarHBondContact O-N 2.86Å
545	R	80.4	Confident	80.8	Confident	125 Å²	125	93.2 Å²	93.2	47%	0.472	44%	0.436	S	S	.	.	H	α-helix	trans	-62	-36.9	170.1	-81.8	177.9	170.3	-154.3	-2.6	112.8	Y540 D542 Q548 R549	Y540-R545 HydrophobicContact CD1-CB 4.45Å; Y540-R545 HydrophobicContact CD2-CB 4.03Å; Y540-R545 HydrophobicContact CE2-CB 4.48Å; Y540-R545 HydrophobicContact CG-CB 4Å; D542-R545 HydrophobicContact CB-CB 4.12Å; D542-R545 PolarHBondContact O-N 2.75Å; D542-R545 PolarHBondContact OD1-N 3.24Å; D542-R545 VanDerWaalsContact OD2-CD 3.32Å; D542-R545 WeakPolarHBondContact OD2-CD 3.41Å; D542-R545 WeakPolarHBondContact OD2-CG 3.48Å; R545-Q548 PolarHBondContact O-N 3.36Å; R545-R549 WeakPolarHBondContact O-CB 3.41Å; R545-R549 PolarHBondContact O-N 3.31Å
546	Q	81.4	Confident	80.9	Confident	27 Å²	27	96.8 Å²	96.8	13%	0.126	46%	0.455	C	S	.	.	H	α-helix	trans	-64.1	-45	175.3	-172.5	61.2	17.2	0	0	111.7	D542 N544 R549 Q550	D542-Q546 PolarHBondContact O-N 2.71Å; N544-Q546 VanDerWaalsContact C-N 3.31Å; N544-Q546 PolarHBondContact O-N 3.47Å; Q546-R549 PolarHBondContact O-N 2.95Å; Q546-Q550 WeakPolarHBondContact O-CG 3.38Å; Q546-Q550 PolarHBondContact O-N 2.96Å
547	K	80.1	Confident	81	Confident	142 Å²	142	100 Å²	100	62%	0.617	47%	0.465	S	S	*	.	H	α-helix	trans	-58.4	-46.4	172.8	-75.7	178.5	176.1	-174.8	0	112	K543 N544 R549 Q550 K551	K543-K547 WeakPolarHBondContact O-CG 3.36Å; K543-K547 PolarHBondContact O-N 3.38Å; N544-K547 PolarHBondContact O-N 2.94Å; K547-R549 PolarHBondContact O-N 3.39Å; K547-Q550 PolarHBondContact O-N 3.24Å; K547-K551 PolarHBondContact O-N 2.91Å
548	Q	80.5	Confident	80.8	Confident	136 Å²	136	100.3 Å²	100.3	64%	0.636	46%	0.462	S	S	*	.	H	α-helix	trans	-60.4	-43.2	177	-74	176.4	-15.8	0	0	112.3	N544 R545 K551 M552	N544-Q548 WeakPolarHBondContact O-CG 3.37Å; N544-Q548 PolarHBondContact O-N 2.86Å; R545-Q548 PolarHBondContact O-N 3.36Å; Q548-K551 PolarHBondContact O-N 3.36Å; Q548-M552 WeakPolarHBondContact O-CB 3.38Å; Q548-M552 PolarHBondContact O-N 3.05Å
549	R	80.2	Confident	80.4	Confident	44 Å²	44	105.6 Å²	105.6	17%	0.166	48%	0.484	C	S	.	.	H	α-helix	trans	-64.1	-41.4	174.8	179.4	177.9	170.5	-141.7	-2.7	112	D536 I538 Y540 R545 Q546 K547 M552 L553	D536-R549 PolarHBondContact O-NH2 3.11Å; I538-R549 PolarHBondContact O-NH1 3.39Å; Y540-R549 HydrophobicContact CD2-CB 4.24Å; Y540-R549 HydrophobicContact CE2-CB 3.98Å; Y540-R549 HydrophobicContact CE2-CG 4.37Å; R545-R549 WeakPolarHBondContact O-CB 3.41Å; R545-R549 PolarHBondContact O-N 3.31Å; Q546-R549 PolarHBondContact O-N 2.95Å; K547-R549 PolarHBondContact O-N 3.39Å; R549-M552 PolarHBondContact O-N 3.31Å; R549-L553 HydrophobicContact CG-CD1 3.88Å; R549-L553 HydrophobicContact CG-CG 4.27Å; R549-L553 WeakPolarHBondContact O-CB 3.49Å; R549-L553 VanDerWaalsContact O-CG 3.3Å; R549-L553 WeakPolarHBondContact O-CG 3.44Å; R549-L553 PolarHBondContact O-N 3.04Å
550	Q	81.1	Confident	79.6	Confident	110 Å²	110	103.9 Å²	103.9	51%	0.514	48%	0.484	S	S	.	.	H	α-helix	trans	-62.3	-42.6	176.4	-75.4	172.5	-53	0	0	111.5	Q546 K547 L553 A554	Q546-Q550 WeakPolarHBondContact O-CG 3.38Å; Q546-Q550 PolarHBondContact O-N 2.96Å; K547-Q550 PolarHBondContact O-N 3.24Å; Q550-L553 PolarHBondContact O-N 3.48Å; Q550-A554 PolarHBondContact O-N 3.05Å
551	K	83.4	Confident	78.5	Confident	142 Å²	142	109.2 Å²	109.2	62%	0.617	51%	0.508	S	S	*	.	H	α-helix	trans	-60.9	-49.4	173.3	-163.3	-166	-179.8	-150.8	0	111.8	K547 Q548 L553 A554 E555	K547-K551 PolarHBondContact O-N 2.91Å; Q548-K551 PolarHBondContact O-N 3.36Å; K551-L553 VanDerWaalsContact C-N 3.3Å; K551-L553 PolarHBondContact O-N 3.22Å; K551-A554 WeakPolarHBondContact O-CB 3.41Å; K551-A554 PolarHBondContact O-N 3.3Å; K551-A554 VanDerWaalsContact O-N 3.12Å; K551-E555 WeakPolarHBondContact CD-OE1 3.48Å; K551-E555 WeakPolarHBondContact CE-OE1 3.45Å; K551-E555 IonicContact NZ-OE1 2.58Å; K551-E555 PolarHBondContact NZ-OE1 3.36Å; K551-E555 VanDerWaalsContact NZ-OE1 3.12Å; K551-E555 WeakPolarHBondContact O-CG 3.46Å; K551-E555 PolarHBondContact O-N 3.17Å
552	M	81.6	Confident	77.2	Confident	119 Å²	119	106.2 Å²	106.2	59%	0.586	51%	0.505	S	S	*	.	H	α-helix	trans	-62.2	-35.7	178.8	-174.7	178.9	-73	0	0	112.7	Q548 R549 L556	Q548-M552 WeakPolarHBondContact O-CB 3.38Å; Q548-M552 PolarHBondContact O-N 3.05Å; R549-M552 PolarHBondContact O-N 3.31Å; M552-L556 HydrophobicContact CG-CD1 4.28Å; M552-L556 WeakPolarHBondContact O-CB 3.37Å; M552-L556 VanDerWaalsContact O-CG 3.25Å; M552-L556 WeakPolarHBondContact O-CG 3.39Å; M552-L556 PolarHBondContact O-N 3.19Å
553	L	80.6	Confident	75.6	Confident	77 Å²	77	108.5 Å²	108.5	40%	0.403	51%	0.513	S	S	.	.	H	α-helix	trans	-71.7	-32.5	174.3	-74.4	172.8	0	0	0	112.8	R549 Q550 K551 K557	R549-L553 HydrophobicContact CG-CD1 3.88Å; R549-L553 HydrophobicContact CG-CG 4.27Å; R549-L553 WeakPolarHBondContact O-CB 3.49Å; R549-L553 VanDerWaalsContact O-CG 3.3Å; R549-L553 WeakPolarHBondContact O-CG 3.44Å; R549-L553 PolarHBondContact O-N 3.04Å; Q550-L553 PolarHBondContact O-N 3.48Å; K551-L553 VanDerWaalsContact C-N 3.3Å; K551-L553 PolarHBondContact O-N 3.22Å; L553-K557 WeakPolarHBondContact O-CB 3.04Å; L553-K557 WeakPolarHBondContact O-CG 3.41Å; L553-K557 PolarHBondContact O-N 3.36Å
554	A	79.9	Confident	73.9	Confident	43 Å²	43	107.3 Å²	107.3	36%	0.355	51%	0.514	S	S	.	.	H	α-helix	trans	-66.6	-51.8	170.4	0	0	0	0	0	110.3	Q550 K551 L556 K557 D558	Q550-A554 PolarHBondContact O-N 3.05Å; K551-A554 WeakPolarHBondContact O-CB 3.41Å; K551-A554 PolarHBondContact O-N 3.3Å; K551-A554 VanDerWaalsContact O-N 3.12Å; A554-L556 PolarHBondContact O-N 3.43Å; A554-L556 VanDerWaalsContact O-N 3.17Å; A554-K557 PolarHBondContact O-N 3.03Å; A554-D558 PolarHBondContact O-N 3.39Å
555	E	80.6	Confident	72	Confident	77 Å²	77	107.5 Å²	107.5	36%	0.36	52%	0.522	S	S	.	.	H	α-helix	trans	-55.4	-34.5	175.6	-70.4	174.2	-162.1	0	0	113	K551 K559	K551-E555 WeakPolarHBondContact CD-OE1 3.48Å; K551-E555 WeakPolarHBondContact CE-OE1 3.45Å; K551-E555 IonicContact NZ-OE1 2.58Å; K551-E555 PolarHBondContact NZ-OE1 3.36Å; K551-E555 VanDerWaalsContact NZ-OE1 3.12Å; K551-E555 WeakPolarHBondContact O-CG 3.46Å; K551-E555 PolarHBondContact O-N 3.17Å; E555-K559 WeakPolarHBondContact O-CB 3.23Å; E555-K559 VanDerWaalsContact O-CD 3.23Å; E555-K559 WeakPolarHBondContact O-CD 3.2Å; E555-K559 WeakPolarHBondContact O-CG 3.33Å; E555-K559 PolarHBondContact O-N 3.17Å
556	L	77.6	Confident	70.5	Confident	86 Å²	86	109.4 Å²	109.4	45%	0.45	53%	0.533	S	S	.	.	H	α-helix	trans	-73.3	-45.9	173.2	-76.4	167.5	0	0	0	112.2	M552 A554 D558 K559 E560	M552-L556 HydrophobicContact CG-CD1 4.28Å; M552-L556 WeakPolarHBondContact O-CB 3.37Å; M552-L556 VanDerWaalsContact O-CG 3.25Å; M552-L556 WeakPolarHBondContact O-CG 3.39Å; M552-L556 PolarHBondContact O-N 3.19Å; A554-L556 PolarHBondContact O-N 3.43Å; A554-L556 VanDerWaalsContact O-N 3.17Å; L556-D558 VanDerWaalsContact C-N 3.29Å; L556-D558 PolarHBondContact O-N 3.02Å; L556-K559 CarbonylContact O-C 3.57Å; L556-K559 WeakPolarHBondContact O-CB 3.3Å; L556-K559 PolarHBondContact O-N 3.13Å; L556-E560 WeakPolarHBondContact O-CG 3.45Å; L556-E560 PolarHBondContact O-N 3.07Å
557	K	77.4	Confident	68.4	Low	136 Å²	136	117.4 Å²	117.4	59%	0.591	57%	0.568	S	S	*	*	H	α-helix	trans	-62.3	-35.6	176.6	-78.8	-177.4	174.1	-168.9	0	112.6	L553 A554 E560 K561	L553-K557 WeakPolarHBondContact O-CB 3.04Å; L553-K557 WeakPolarHBondContact O-CG 3.41Å; L553-K557 PolarHBondContact O-N 3.36Å; A554-K557 PolarHBondContact O-N 3.03Å; K557-E560 CarbonylContact O-C 3.59Å; K557-E560 PolarHBondContact O-N 3.42Å; K557-K561 VanDerWaalsContact O-CG 3.3Å; K557-K561 WeakPolarHBondContact O-CG 3.27Å; K557-K561 PolarHBondContact O-N 3.38Å
558	D	73.9	Confident	66.4	Low	76 Å²	76	117.8 Å²	117.8	41%	0.406	58%	0.577	S	S	.	*	H	α-helix	trans	-77.4	-27.8	178.8	-61.6	-32.8	0	0	0	111.7	A554 L556 K561 T562	A554-D558 PolarHBondContact O-N 3.39Å; L556-D558 VanDerWaalsContact C-N 3.29Å; L556-D558 PolarHBondContact O-N 3.02Å; D558-K561 IonicContact OD1-NZ 3.38Å; D558-K561 PolarHBondContact OD1-NZ 3.25Å; D558-T562 PolarHBondContact O-N 3.27Å; D558-T562 VanDerWaalsContact O-N 3.08Å; D558-T562 PolarHBondContact O-OG1 3.2Å
559	K	72.3	Confident	64.3	Low	120 Å²	120	119.6 Å²	119.6	52%	0.522	58%	0.582	S	S	.	*	H	α-helix	trans	-67.3	-39.1	163.8	-74.7	164.5	-170.6	158.2	0	112.3	E555 L556 T562 E563	E555-K559 WeakPolarHBondContact O-CB 3.23Å; E555-K559 VanDerWaalsContact O-CD 3.23Å; E555-K559 WeakPolarHBondContact O-CD 3.2Å; E555-K559 WeakPolarHBondContact O-CG 3.33Å; E555-K559 PolarHBondContact O-N 3.17Å; L556-K559 CarbonylContact O-C 3.57Å; L556-K559 WeakPolarHBondContact O-CB 3.3Å; L556-K559 PolarHBondContact O-N 3.13Å; K559-T562 WeakPolarHBondContact CA-OG1 3.43Å; K559-T562 PolarHBondContact O-N 3.19Å; K559-T562 PolarHBondContact O-OG1 3.17Å; K559-E563 PolarHBondContact O-N 3.42Å
560	E	65.6	Low	62.5	Low	147 Å²	147	123 Å²	123	69%	0.687	61%	0.608	S	S	*	*	H	α-helix	trans	-72	-25.6	174.9	-72.1	-179.1	145.4	0	0	113.2	L556 K557	L556-E560 WeakPolarHBondContact O-CG 3.45Å; L556-E560 PolarHBondContact O-N 3.07Å; K557-E560 CarbonylContact O-C 3.59Å; K557-E560 PolarHBondContact O-N 3.42Å
561	K	61.6	Low	60.9	Low	155 Å²	155	126.8 Å²	126.8	67%	0.674	62%	0.623	S	S	*	*	H	α-helix	trans	-74.9	-33	169.2	-71.9	169.9	-166.8	162.9	0	113	K557 D558	K557-K561 VanDerWaalsContact O-CG 3.3Å; K557-K561 WeakPolarHBondContact O-CG 3.27Å; K557-K561 PolarHBondContact O-N 3.38Å; D558-K561 IonicContact OD1-NZ 3.38Å; D558-K561 PolarHBondContact OD1-NZ 3.25Å
562	T	55.8	Low	59.3	Low	115 Å²	115	127.3 Å²	127.3	71%	0.706	63%	0.632	S	S	*	*	H	α-helix	trans	-85.3	-29.1	179	42.2	0	0	0	0	112.9	D558 K559 L564	D558-T562 PolarHBondContact O-N 3.27Å; D558-T562 VanDerWaalsContact O-N 3.08Å; D558-T562 PolarHBondContact O-OG1 3.2Å; K559-T562 WeakPolarHBondContact CA-OG1 3.43Å; K559-T562 PolarHBondContact O-N 3.19Å; K559-T562 PolarHBondContact O-OG1 3.17Å; T562-L564 PolarHBondContact O-N 3.44Å; T562-L564 VanDerWaalsContact O-N 3.12Å
563	E	49.7	Very low	57.5	Low	119 Å²	119	129.4 Å²	129.4	56%	0.556	64%	0.638	S	S	*	*	S	Bend	trans	-76.1	90.3	161.1	-74.2	-154.7	167	0	0	110.8	K559 K566	K559-E563 PolarHBondContact O-N 3.42Å; E563-K566 IonicContact OE2-NZ 3.88Å; E563-K566 PolarHBondContact OE2-NZ 3.45Å
564	L	46	Very low	56.2	Low	149 Å²	149	129 Å²	129	78%	0.78	65%	0.646	S	S	*	*			trans	-37.7	136	167.6	-82.4	168.2	0	0	0	111.6	T562 K566	T562-L564 PolarHBondContact O-N 3.44Å; T562-L564 VanDerWaalsContact O-N 3.12Å; L564-K566 PolarHBondContact O-N 3.2Å
565	P	43.5	Very low	54.5	Low	112 Å²	112	137.1 Å²	137.1	73%	0.727	67%	0.667	S	S	*	*			trans	-54	128.4	-169.9	20.9	-33.2	0	0	0	110.4	K567	P565-K567 VanDerWaalsContact C-N 3.29Å; P565-K567 PolarHBondContact O-N 3.27Å
566	K	47.4	Very low	53.2	Low	165 Å²	165	137 Å²	137	72%	0.717	68%	0.675	S	S	*	*			trans	-63	90	-177.5	-68.1	-180	179.1	74.2	0	108.8	E563 L564 N568	E563-K566 IonicContact OE2-NZ 3.88Å; E563-K566 PolarHBondContact OE2-NZ 3.45Å; L564-K566 PolarHBondContact O-N 3.2Å; K566-N568 PolarHBondContact O-N 2.73Å; K566-N568 VanDerWaalsContact O-N 3.14Å
567	K	38.2	Very low	51.9	Low	196 Å²	196	140.8 Å²	140.8	85%	0.852	69%	0.688	S	S	*	*			trans	-41.9	123.2	-180	-77.6	-165.4	174.2	-168.9	0	108.8	P565 F569	P565-K567 VanDerWaalsContact C-N 3.29Å; P565-K567 PolarHBondContact O-N 3.27Å; K567-F569 PolarHBondContact O-N 3.4Å
568	N	38	Very low	50.6	Low	150 Å²	150	140.2 Å²	140.2	80%	0.802	69%	0.687	S	S	*	*			trans	-40.9	126.7	176.2	-75.4	-15.6	0	0	0	108.7	K566 V570	K566-N568 PolarHBondContact O-N 2.73Å; K566-N568 VanDerWaalsContact O-N 3.14Å; N568-V570 PolarHBondContact O-N 3.05Å
569	F	35.3	Very low	49.6	Very low	173 Å²	173	143.4 Å²	143.4	76%	0.759	70%	0.698	S	S	*	*			trans	-77.9	73.5	-168.4	-156.8	-80.8	0	0	0	109.8	K567 K571	K567-F569 PolarHBondContact O-N 3.4Å; F569-K571 PolarHBondContact O-N 3.39Å; F569-K571 VanDerWaalsContact O-N 3.15Å
570	V	43.8	Very low	49	Very low	115 Å²	115	141.4 Å²	141.4	70%	0.697	70%	0.696	S	S	*	*			trans	-48.9	121.6	169.1	177	0	0	0	0	107.1	N568 N572	N568-V570 PolarHBondContact O-N 3.05Å; V570-N572 PolarHBondContact O-N 2.94Å
571	K	46.7	Very low	48.6	Very low	190 Å²	190	141.6 Å²	141.6	83%	0.826	69%	0.694	S	S	*	*	S	Bend	trans	-67.1	83.7	174.4	-73.2	-179.8	176.6	177.2	0	108.6	F569	F569-K571 PolarHBondContact O-N 3.39Å; F569-K571 VanDerWaalsContact O-N 3.15Å
572	N	50.4	Low	48.6	Very low	153 Å²	153	141.8 Å²	141.8	82%	0.818	70%	0.695	S	S	*	*			trans	178.6	118.3	143.5	-88	-19.6	0	0	0	110.3	V570	V570-N572 PolarHBondContact O-N 2.94Å
573	K	42.4	Very low	48.9	Very low	163 Å²	163	141.3 Å²	141.3	71%	0.709	69%	0.685	S	S	*	*			trans	-139.2	130	164.3	-80.7	-172.6	175.4	174.1	0	108.5
574	A	54.5	Low	49.7	Very low	68 Å²	68	144.9 Å²	144.9	56%	0.562	69%	0.693	S	S	*	*			trans	-54.6	137.9	-173.8	0	0	0	0	0	113.3	S576 K577	A574-S576 PolarHBondContact O-N 3.12Å; A574-S576 VanDerWaalsContact O-N 3.09Å; A574-K577 PolarHBondContact O-N 3.35Å
575	W	43.8	Very low	50.7	Low	215 Å²	215	146.9 Å²	146.9	81%	0.814	69%	0.69	S	S	*	*	T	Hydrogen-bonded Turn	trans	-46.3	-39.3	-175.3	-175.2	-98.9	0	0	0	114.3	K577 Q578 K579	W575-K577 VanDerWaalsContact C-N 3.26Å; W575-K577 PolarHBondContact O-N 2.95Å; W575-Q578 PolarHBondContact O-N 2.86Å; W575-K579 PolarHBondContact O-N 2.9Å
576	S	52.3	Low	51.8	Low	75 Å²	75	149.2 Å²	149.2	52%	0.524	69%	0.689	S	S	.	*	H	α-helix	trans	-54.7	-36.9	178.9	56.9	0	0	0	0	113.8	A574 Q578	A574-S576 PolarHBondContact O-N 3.12Å; A574-S576 VanDerWaalsContact O-N 3.09Å; S576-Q578 VanDerWaalsContact C-N 3.31Å; S576-Q578 PolarHBondContact O-N 3.12Å
577	K	51.1	Low	52.9	Low	165 Å²	165	149.1 Å²	149.1	72%	0.717	69%	0.689	S	S	*	*	H	α-helix	trans	-81.1	-6.5	-178.9	-64.7	-176.1	179.4	178.1	0	113.6	A574 W575	A574-K577 PolarHBondContact O-N 3.35Å; W575-K577 VanDerWaalsContact C-N 3.26Å; W575-K577 PolarHBondContact O-N 2.95Å
578	Q	50.1	Low	54.1	Low	123 Å²	123	149.2 Å²	149.2	58%	0.575	68%	0.684	S	S	*	*	H	α-helix	trans	-88.8	-39.2	168	-76.6	-175.1	-19.3	0	0	112.5	W575 S576 T580 K581 K582	W575-Q578 PolarHBondContact O-N 2.86Å; S576-Q578 VanDerWaalsContact C-N 3.31Å; S576-Q578 PolarHBondContact O-N 3.12Å; Q578-T580 PolarHBondContact O-N 2.92Å; Q578-K581 PolarHBondContact O-N 3.14Å; Q578-K582 PolarHBondContact O-N 2.59Å
579	K	53	Low	55.2	Low	144 Å²	144	144.9 Å²	144.9	63%	0.626	67%	0.669	S	S	*	*	H	α-helix	trans	-55.5	-54.1	-178	-165.7	177.8	-178.9	-175.4	0	111.4	W575 K581 K582 E583	W575-K579 PolarHBondContact O-N 2.9Å; K579-K581 VanDerWaalsContact C-N 3.3Å; K579-K581 PolarHBondContact O-N 2.94Å; K579-K582 WeakPolarHBondContact O-CB 3.39Å; K579-K582 PolarHBondContact O-N 3Å; K579-K582 VanDerWaalsContact O-N 3.13Å; K579-E583 WeakPolarHBondContact O-CB 3.39Å; K579-E583 PolarHBondContact O-N 3.24Å
580	T	59.2	Low	56.6	Low	78 Å²	78	139.7 Å²	139.7	48%	0.479	66%	0.657	S	S	.	*	H	α-helix	trans	-61.3	-31.5	178.6	52.9	0	0	0	0	113.9	Q578 R584	Q578-T580 PolarHBondContact O-N 2.92Å; T580-R584 WeakPolarHBondContact O-CG 3.37Å; T580-R584 PolarHBondContact O-N 3.48Å
581	K	58.1	Low	57.5	Low	151 Å²	151	140.5 Å²	140.5	66%	0.657	65%	0.652	S	S	*	*	H	α-helix	trans	-75.7	-34.2	176	-167.2	171.8	-176.5	175.6	0	112.5	Q578 K579 E583 R585	Q578-K581 PolarHBondContact O-N 3.14Å; K579-K581 VanDerWaalsContact C-N 3.3Å; K579-K581 PolarHBondContact O-N 2.94Å; K581-E583 VanDerWaalsContact C-N 3.32Å; K581-R585 PolarHBondContact O-N 3.02Å
582	K	61.4	Low	57.9	Low	159 Å²	159	139.9 Å²	139.9	69%	0.691	64%	0.644	S	S	*	*	H	α-helix	trans	-65.7	-38.3	171.6	-167.6	176.1	-176.7	178.9	0	110.7	Q578 K579 R585 K586	Q578-K582 PolarHBondContact O-N 2.59Å; K579-K582 WeakPolarHBondContact O-CB 3.39Å; K579-K582 PolarHBondContact O-N 3Å; K579-K582 VanDerWaalsContact O-N 3.13Å; K582-R585 WeakPolarHBondContact O-CB 3.48Å; K582-R585 PolarHBondContact O-N 2.91Å; K582-K586 PolarHBondContact O-N 3.39Å
583	E	63	Low	58	Low	105 Å²	105	137.8 Å²	137.8	49%	0.491	63%	0.628	S	S	.	*	H	α-helix	trans	-70.7	-46.8	-180	-162.7	158	-116.2	0	0	113.3	K579 K581 R585 K586 K587	K579-E583 WeakPolarHBondContact O-CB 3.39Å; K579-E583 PolarHBondContact O-N 3.24Å; K581-E583 VanDerWaalsContact C-N 3.32Å; E583-R585 PolarHBondContact O-N 3.12Å; E583-K586 WeakPolarHBondContact O-CB 3.3Å; E583-K586 PolarHBondContact O-N 3.1Å; E583-K586 VanDerWaalsContact O-N 3.08Å; E583-K587 PolarHBondContact O-N 3.46Å
584	R	66.4	Low	58.4	Low	193 Å²	193	137.1 Å²	137.1	73%	0.728	63%	0.627	S	S	*	*	H	α-helix	trans	-62.6	-27	171	-68.8	179.3	85.2	173.9	7.1	112.6	T580 R588	T580-R584 WeakPolarHBondContact O-CG 3.37Å; T580-R584 PolarHBondContact O-N 3.48Å; R584-R588 PolarHBondContact O-N 3.48Å
585	R	65.2	Low	58.2	Low	192 Å²	192	138.4 Å²	138.4	73%	0.725	62%	0.624	S	S	*	*	H	α-helix	trans	-71	-44.7	168.8	-91.3	-176.3	163.5	-175.5	-6.5	112.2	K581 K582 E583 R588 A589	K581-R585 PolarHBondContact O-N 3.02Å; K582-R585 WeakPolarHBondContact O-CB 3.48Å; K582-R585 PolarHBondContact O-N 2.91Å; E583-R585 PolarHBondContact O-N 3.12Å; R585-R588 PolarHBondContact O-N 3.11Å; R585-A589 PolarHBondContact O-N 3.36Å
586	K	68.1	Low	58.1	Low	160 Å²	160	135.1 Å²	135.1	70%	0.696	62%	0.618	S	S	*	*	H	α-helix	trans	-56	-50.6	173.2	-91.6	-164	168.7	-165	0	111.8	K582 E583 R588 A589 A590	K582-K586 PolarHBondContact O-N 3.39Å; E583-K586 WeakPolarHBondContact O-CB 3.3Å; E583-K586 PolarHBondContact O-N 3.1Å; E583-K586 VanDerWaalsContact O-N 3.08Å; K586-R588 VanDerWaalsContact C-N 3.32Å; K586-R588 PolarHBondContact O-N 3.34Å; K586-A589 PolarHBondContact O-N 2.94Å; K586-A589 VanDerWaalsContact O-N 3.12Å; K586-A590 PolarHBondContact O-N 3.21Å
587	K	69	Low	57.5	Low	164 Å²	164	135.8 Å²	135.8	71%	0.713	62%	0.615	S	S	*	*	H	α-helix	trans	-60.2	-37.1	179.1	-71.2	-162.8	174.4	-167.9	0	113.2	E583 K591	E583-K587 PolarHBondContact O-N 3.46Å; K587-K591 PolarHBondContact O-N 3.11Å; K587-K591 VanDerWaalsContact O-N 3.13Å
588	R	63.7	Low	57.1	Low	198 Å²	198	132.2 Å²	132.2	75%	0.747	61%	0.611	S	S	*	*	H	α-helix	trans	-72.9	-29	174.8	-77.2	-174.7	172.2	-170.5	-3.2	114.2	R584 R585 K586 R592	R584-R588 PolarHBondContact O-N 3.48Å; R585-R588 PolarHBondContact O-N 3.11Å; K586-R588 VanDerWaalsContact C-N 3.32Å; K586-R588 PolarHBondContact O-N 3.34Å; R588-R592 PolarHBondContact O-N 3.47Å
589	A	62.3	Low	57.1	Low	59 Å²	59	133.6 Å²	133.6	49%	0.488	62%	0.623	S	S	.	*	H	α-helix	trans	-74.9	-40.1	173.4	0	0	0	0	0	111.6	R585 K586 R592 K593	R585-A589 PolarHBondContact O-N 3.36Å; K586-A589 PolarHBondContact O-N 2.94Å; K586-A589 VanDerWaalsContact O-N 3.12Å; A589-R592 PolarHBondContact O-N 3.26Å; A589-K593 PolarHBondContact O-N 2.92Å; A589-K593 VanDerWaalsContact O-N 3.15Å
590	A	64.4	Low	56.8	Low	63 Å²	63	132.6 Å²	132.6	52%	0.521	62%	0.622	S	S	.	*	H	α-helix	trans	-60.9	-46.8	175	0	0	0	0	0	111.9	K586 R592 K593 H594	K586-A590 PolarHBondContact O-N 3.21Å; A590-R592 VanDerWaalsContact C-N 3.34Å; A590-R592 PolarHBondContact O-N 3.43Å; A590-K593 PolarHBondContact O-N 2.93Å; A590-H594 PolarHBondContact O-N 3.19Å; A590-H594 VanDerWaalsContact O-N 3.12Å
591	K	63	Low	56.6	Low	133 Å²	133	135 Å²	135	58%	0.578	63%	0.632	S	S	*	*	H	α-helix	trans	-60.3	-41.4	175.4	177.1	156.1	-176.4	158.6	0	112.3	K587 K593 H594 D595	K587-K591 PolarHBondContact O-N 3.11Å; K587-K591 VanDerWaalsContact O-N 3.13Å; K591-K593 VanDerWaalsContact C-N 3.33Å; K591-K593 PolarHBondContact O-N 3.22Å; K591-H594 CarbonylContact O-C 3.59Å; K591-H594 WeakPolarHBondContact O-CB 3.25Å; K591-H594 PolarHBondContact O-N 3.23Å; K591-H594 VanDerWaalsContact O-N 3.12Å; K591-D595 WeakPolarHBondContact CE-OD1 3.35Å; K591-D595 WeakPolarHBondContact CE-OD2 3.39Å; K591-D595 VanDerWaalsContact CG-OD2 3.31Å; K591-D595 WeakPolarHBondContact CG-OD2 3.18Å; K591-D595 IonicContact NZ-OD1 2.73Å; K591-D595 VanDerWaalsContact O-CG 3.24Å; K591-D595 PolarHBondContact O-N 3.21Å
592	R	54.6	Low	56.3	Low	177 Å²	177	136.2 Å²	136.2	67%	0.668	64%	0.64	S	S	*	*	H	α-helix	trans	-62.5	-35.7	177.6	-81	-174.5	172.1	-164.2	-7.4	114.1	R588 A589 A590 D595 E596	R588-R592 PolarHBondContact O-N 3.47Å; A589-R592 PolarHBondContact O-N 3.26Å; A590-R592 VanDerWaalsContact C-N 3.34Å; A590-R592 PolarHBondContact O-N 3.43Å; R592-D595 CarbonylContact O-C 3.59Å; R592-D595 PolarHBondContact O-N 3.26Å; R592-E596 VanDerWaalsContact O-CB 3.31Å; R592-E596 WeakPolarHBondContact O-CB 3.37Å; R592-E596 WeakPolarHBondContact O-CG 3.5Å; R592-E596 PolarHBondContact O-N 3.26Å; R592-E596 VanDerWaalsContact O-N 3.12Å
593	K	53.3	Low	55.8	Low	109 Å²	109	136.4 Å²	136.4	47%	0.474	64%	0.643	S	S	.	*	H	α-helix	trans	-64.3	-45	171.1	-75.2	-155.7	93.5	-53.8	0	111.7	A589 A590 K591 D595 E596 D597	A589-K593 PolarHBondContact O-N 2.92Å; A589-K593 VanDerWaalsContact O-N 3.15Å; A590-K593 PolarHBondContact O-N 2.93Å; K591-K593 VanDerWaalsContact C-N 3.33Å; K591-K593 PolarHBondContact O-N 3.22Å; K593-D595 PolarHBondContact O-N 2.69Å; K593-E596 CarbonylContact O-C 3.55Å; K593-E596 WeakPolarHBondContact O-CA 3.14Å; K593-E596 PolarHBondContact O-N 3.13Å; K593-D597 IonicContact NZ-OD1 3.06Å; K593-D597 PolarHBondContact NZ-OD1 2.98Å; K593-D597 IonicContact NZ-OD2 3.48Å; K593-D597 PolarHBondContact NZ-OD2 2.93Å; K593-D597 WeakPolarHBondContact O-CB 3.36Å; K593-D597 PolarHBondContact O-N 3.32Å; K593-D597 VanDerWaalsContact O-OD2 3.08Å
594	H	50	Low	55.4	Low	149 Å²	149	137.6 Å²	137.6	69%	0.69	64%	0.644	S	S	*	*	H	α-helix	trans	-62.2	-29.3	176	-165.4	-36.9	0	0	0	113.1	A590 K591 E596	A590-H594 PolarHBondContact O-N 3.19Å; A590-H594 VanDerWaalsContact O-N 3.12Å; K591-H594 CarbonylContact O-C 3.59Å; K591-H594 WeakPolarHBondContact O-CB 3.25Å; K591-H594 PolarHBondContact O-N 3.23Å; K591-H594 VanDerWaalsContact O-N 3.12Å; H594-E596 VanDerWaalsContact C-N 3.35Å
595	D	49.3	Very low	54.9	Low	95 Å²	95	132.4 Å²	132.4	51%	0.508	63%	0.629	S	S	.	*	T	Hydrogen-bonded Turn	trans	-85.7	-0.2	173.1	-55.3	-31	0	0	0	112.9	K591 R592 K593	K591-D595 WeakPolarHBondContact CE-OD1 3.35Å; K591-D595 WeakPolarHBondContact CE-OD2 3.39Å; K591-D595 VanDerWaalsContact CG-OD2 3.31Å; K591-D595 WeakPolarHBondContact CG-OD2 3.18Å; K591-D595 IonicContact NZ-OD1 2.73Å; K591-D595 VanDerWaalsContact O-CG 3.24Å; K591-D595 PolarHBondContact O-N 3.21Å; R592-D595 CarbonylContact O-C 3.59Å; R592-D595 PolarHBondContact O-N 3.26Å; K593-D595 PolarHBondContact O-N 2.69Å
596	E	43.7	Very low	54.9	Low	145 Å²	145	129.4 Å²	129.4	68%	0.678	62%	0.621	S	S	*	*	T	Hydrogen-bonded Turn	trans	-119.2	-25.5	-179.4	-78.3	169.8	172.7	0	0	113	R592 K593 H594	R592-E596 VanDerWaalsContact O-CB 3.31Å; R592-E596 WeakPolarHBondContact O-CB 3.37Å; R592-E596 WeakPolarHBondContact O-CG 3.5Å; R592-E596 PolarHBondContact O-N 3.26Å; R592-E596 VanDerWaalsContact O-N 3.12Å; K593-E596 CarbonylContact O-C 3.55Å; K593-E596 WeakPolarHBondContact O-CA 3.14Å; K593-E596 PolarHBondContact O-N 3.13Å; H594-E596 VanDerWaalsContact C-N 3.35Å
597	D	38.6	Very low	54.8	Low	89 Å²	89	125 Å²	125	48%	0.476	60%	0.603	S	S	.	*	S	Bend	trans	-88.9	8.4	-177	-61.4	-39.9	0	0	0	112.8	K593	K593-D597 IonicContact NZ-OD1 3.06Å; K593-D597 PolarHBondContact NZ-OD1 2.98Å; K593-D597 IonicContact NZ-OD2 3.48Å; K593-D597 PolarHBondContact NZ-OD2 2.93Å; K593-D597 WeakPolarHBondContact O-CB 3.36Å; K593-D597 PolarHBondContact O-N 3.32Å; K593-D597 VanDerWaalsContact O-OD2 3.08Å
598	S	42.3	Very low	54.4	Low	90 Å²	90	121.1 Å²	121.1	63%	0.629	59%	0.59	S	S	*	*	T	Hydrogen-bonded Turn	trans	-93.6	13.2	-166.5	71.7	0	0	0	0	117.3
599	D	50.3	Low	54.6	Low	153 Å²	153	116.1 Å²	116.1	82%	0.818	58%	0.577	S	S	*	*	T	Hydrogen-bonded Turn	trans	-135.9	22.5	-175.2	-96.9	-35.9	0	0	0	112.2
600	M	46.2	Very low	55	Low	122 Å²	122	117.7 Å²	117.7	60%	0.601	58%	0.575	S	S	*	*	S	Bend	trans	-142.3	138.1	178.4	-65.8	-67.4	-55.9	0	0	109.9	E602 Y604	M600-E602 PolarHBondContact O-N 3.05Å; M600-Y604 HydrophobicContact CE-CD1 4.4Å
601	D	54.8	Low	55.6	Low	129 Å²	129	116.5 Å²	116.5	69%	0.69	56%	0.56	S	S	*	*			trans	-60.3	129.8	-179.5	-66.3	-63.1	0	0	0	112.7	E603 Y604 M605	D601-E603 PolarHBondContact O-N 3.01Å; D601-Y604 PolarHBondContact O-N 3.06Å; D601-M605 PolarHBondContact O-N 2.78Å
602	E	53	Low	55.9	Low	177 Å²	177	112.7 Å²	112.7	83%	0.827	55%	0.547	S	S	*	.	H	α-helix	trans	-59.5	-32.1	-177.7	-66.1	-163.5	129.1	0	0	112.3	M600 M605 K606	M600-E602 PolarHBondContact O-N 3.05Å; E602-M605 PolarHBondContact O-N 3.28Å; E602-K606 WeakPolarHBondContact O-CB 3.2Å; E602-K606 PolarHBondContact O-N 2.79Å
603	E	50.3	Low	57	Low	162 Å²	162	111.6 Å²	111.6	76%	0.757	54%	0.543	S	S	*	.	H	α-helix	trans	-66.5	-46	-179.5	-167.2	149.6	-116.2	0	0	112.1	D601 M605 K606 E607	D601-E603 PolarHBondContact O-N 3.01Å; E603-M605 VanDerWaalsContact C-N 3.33Å; E603-M605 PolarHBondContact O-N 2.91Å; E603-K606 WeakPolarHBondContact O-CB 3.42Å; E603-K606 PolarHBondContact O-N 3.12Å; E603-E607 PolarHBondContact O-N 3.35Å
604	Y	54.5	Low	58.2	Low	130 Å²	130	107.4 Å²	107.4	51%	0.51	53%	0.526	S	S	.	.	H	α-helix	trans	-65.7	-36.8	176.1	-167.8	-110.2	0	0	0	112	M600 D601 K606 L608	M600-Y604 HydrophobicContact CE-CD1 4.4Å; D601-Y604 PolarHBondContact O-N 3.06Å; Y604-K606 VanDerWaalsContact C-N 3.27Å; Y604-K606 PolarHBondContact O-N 2.67Å; Y604-L608 HydrophobicContact CE1-CD1 4.2Å; Y604-L608 WeakPolarHBondContact O-CB 3.37Å; Y604-L608 PolarHBondContact O-N 3.22Å
605	M	56.2	Low	59.1	Low	84 Å²	84	103.7 Å²	103.7	41%	0.414	51%	0.511	S	S	.	.	H	α-helix	trans	-67.2	-26.5	172.6	-91.1	-59.1	-50.6	0	0	113.2	D601 E602 E603 L609	D601-M605 PolarHBondContact O-N 2.78Å; E602-M605 PolarHBondContact O-N 3.28Å; E603-M605 VanDerWaalsContact C-N 3.33Å; E603-M605 PolarHBondContact O-N 2.91Å; M605-L609 HydrophobicContact CE-CD1 4.26Å; M605-L609 HydrophobicContact CE-CG 4.27Å; M605-L609 WeakPolarHBondContact O-CB 3.33Å; M605-L609 WeakPolarHBondContact O-CD1 3.27Å; M605-L609 WeakPolarHBondContact O-CG 3.31Å; M605-L609 PolarHBondContact O-N 2.96Å
606	K	64.9	Low	60.4	Low	130 Å²	130	105.2 Å²	105.2	57%	0.565	51%	0.513	S	S	*	.	H	α-helix	trans	-75.9	-48.3	177	-170.6	-174.5	171.2	-158.7	0	111.4	E602 E603 Y604 L608 L609 E610	E602-K606 WeakPolarHBondContact O-CB 3.2Å; E602-K606 PolarHBondContact O-N 2.79Å; E603-K606 WeakPolarHBondContact O-CB 3.42Å; E603-K606 PolarHBondContact O-N 3.12Å; Y604-K606 VanDerWaalsContact C-N 3.27Å; Y604-K606 PolarHBondContact O-N 2.67Å; K606-L608 VanDerWaalsContact C-N 3.35Å; K606-L608 PolarHBondContact O-N 3.39Å; K606-L609 PolarHBondContact O-N 2.82Å; K606-E610 PolarHBondContact O-N 3.03Å
607	E	67.3	Low	62.1	Low	68 Å²	68	102.4 Å²	102.4	32%	0.318	50%	0.499	S	S	.	.	H	α-helix	trans	-51.5	-53.7	172.5	-175.3	-165.4	176.6	0	0	110.6	E603 L609 E610 D611 K636	E603-E607 PolarHBondContact O-N 3.35Å; E607-L609 VanDerWaalsContact C-N 3.26Å; E607-L609 PolarHBondContact O-N 2.84Å; E607-E610 PolarHBondContact O-N 3.17Å; E607-D611 PolarHBondContact O-N 3.21Å; E607-K636 WeakPolarHBondContact OE1-CE 3.42Å
608	L	60.3	Low	63.7	Low	81 Å²	81	100.1 Å²	100.1	42%	0.424	49%	0.486	S	S	.	.	H	α-helix	trans	-64.2	-30.2	-175.8	-156.3	154.7	0	0	0	112.4	Y604 K606 T612	Y604-L608 HydrophobicContact CE1-CD1 4.2Å; Y604-L608 WeakPolarHBondContact O-CB 3.37Å; Y604-L608 PolarHBondContact O-N 3.22Å; K606-L608 VanDerWaalsContact C-N 3.35Å; K606-L608 PolarHBondContact O-N 3.39Å; L608-T612 WeakPolarHBondContact O-CB 3.39Å; L608-T612 PolarHBondContact O-N 3.25Å; L608-T612 VanDerWaalsContact O-N 3.13Å; L608-T612 PolarHBondContact O-OG1 3.07Å
609	L	66.7	Low	64.9	Low	94 Å²	94	103.8 Å²	103.8	49%	0.492	49%	0.49	S	S	.	.	H	α-helix	trans	-71.2	-27.7	172.5	-81	170.2	0	0	0	113.3	M605 K606 E607 R613	M605-L609 HydrophobicContact CE-CD1 4.26Å; M605-L609 HydrophobicContact CE-CG 4.27Å; M605-L609 WeakPolarHBondContact O-CB 3.33Å; M605-L609 WeakPolarHBondContact O-CD1 3.27Å; M605-L609 WeakPolarHBondContact O-CG 3.31Å; M605-L609 PolarHBondContact O-N 2.96Å; K606-L609 PolarHBondContact O-N 2.82Å; E607-L609 VanDerWaalsContact C-N 3.26Å; E607-L609 PolarHBondContact O-N 2.84Å; L609-R613 WeakPolarHBondContact O-CD 3.21Å; L609-R613 VanDerWaalsContact O-CG 3.27Å; L609-R613 WeakPolarHBondContact O-CG 3.43Å; L609-R613 PolarHBondContact O-N 3.38Å
610	E	72.3	Confident	66.3	Low	92 Å²	92	103.9 Å²	103.9	43%	0.43	48%	0.484	S	S	.	.	H	α-helix	trans	-87.7	-41.3	-178.2	-67.5	-173.1	161.7	0	0	112.1	K606 E607 T612 R613 L614	K606-E610 PolarHBondContact O-N 3.03Å; E607-E610 PolarHBondContact O-N 3.17Å; E610-T612 PolarHBondContact O-N 3.02Å; E610-R613 WeakPolarHBondContact O-CA 3.46Å; E610-R613 WeakPolarHBondContact O-CB 3.48Å; E610-R613 PolarHBondContact O-N 3.29Å; E610-R613 IonicContact OE1-NH1 3.76Å; E610-R613 PolarHBondContact OE1-NH1 3.15Å; E610-L614 PolarHBondContact O-N 3.12Å
611	D	75.2	Confident	67.6	Low	38 Å²	38	101.3 Å²	101.3	20%	0.203	49%	0.489	C	S	.	.	H	α-helix	trans	-52.5	-46.2	163.3	-91.6	16.5	0	0	0	110.3	E607 R613 L614 L615 L632 K636	E607-D611 PolarHBondContact O-N 3.21Å; D611-R613 PolarHBondContact O-N 3.41Å; D611-L614 PolarHBondContact O-N 3.12Å; D611-L615 WeakPolarHBondContact O-CB 3.4Å; D611-L615 PolarHBondContact O-N 3.4Å; D611-L632 VanDerWaalsContact OD1-CD1 3.23Å; D611-L632 WeakPolarHBondContact OD1-CD1 3.43Å; D611-K636 IonicContact OD2-NZ 3.38Å; D611-K636 PolarHBondContact OD2-NZ 2.97Å
612	T	70.4	Confident	68.5	Low	53 Å²	53	101.2 Å²	101.2	33%	0.325	48%	0.484	S	S	.	.	H	α-helix	trans	-68	-15.8	178	-62.1	0	0	0	0	113.6	L608 E610 K616	L608-T612 WeakPolarHBondContact O-CB 3.39Å; L608-T612 PolarHBondContact O-N 3.25Å; L608-T612 VanDerWaalsContact O-N 3.13Å; L608-T612 PolarHBondContact O-OG1 3.07Å; E610-T612 PolarHBondContact O-N 3.02Å; T612-K616 WeakPolarHBondContact O-CD 3.25Å; T612-K616 WeakPolarHBondContact O-CE 3.46Å; T612-K616 VanDerWaalsContact O-CG 3.25Å; T612-K616 WeakPolarHBondContact O-CG 3.23Å
613	R	77.7	Confident	69.9	Low	153 Å²	153	94 Å²	94	58%	0.577	45%	0.451	S	S	*	.	H	α-helix	trans	-85.9	-46.3	170.3	-76.6	162.4	172.8	177.9	-0.4	111.1	L609 E610 D611 L615 K616 K617	L609-R613 WeakPolarHBondContact O-CD 3.21Å; L609-R613 VanDerWaalsContact O-CG 3.27Å; L609-R613 WeakPolarHBondContact O-CG 3.43Å; L609-R613 PolarHBondContact O-N 3.38Å; E610-R613 WeakPolarHBondContact O-CA 3.46Å; E610-R613 WeakPolarHBondContact O-CB 3.48Å; E610-R613 PolarHBondContact O-N 3.29Å; E610-R613 IonicContact OE1-NH1 3.76Å; E610-R613 PolarHBondContact OE1-NH1 3.15Å; D611-R613 PolarHBondContact O-N 3.41Å; R613-L615 PolarHBondContact O-N 2.58Å; R613-K616 WeakPolarHBondContact O-CB 3.44Å; R613-K616 PolarHBondContact O-N 3.35Å; R613-K616 VanDerWaalsContact O-N 3.11Å; R613-K617 PolarHBondContact O-N 2.88Å
614	L	77.9	Confident	71.4	Confident	21 Å²	21	88.8 Å²	88.8	11%	0.11	43%	0.432	C	S	.	.	H	α-helix	trans	-56.9	-48.9	176.6	-74.2	167.3	0	0	0	111	E610 D611 K616 K617 L618 I623 F628 Q631 L632	E610-L614 PolarHBondContact O-N 3.12Å; D611-L614 PolarHBondContact O-N 3.12Å; L614-K616 PolarHBondContact O-N 3.26Å; L614-K616 VanDerWaalsContact O-N 3.12Å; L614-K617 WeakPolarHBondContact O-CA 3.39Å; L614-K617 WeakPolarHBondContact O-CB 3.34Å; L614-K617 PolarHBondContact O-N 3.37Å; L614-L618 PolarHBondContact O-N 3.3Å; L614-I623 HydrophobicContact CD2-CD1 4.37Å; L614-F628 HydrophobicContact CB-CD2 3.88Å; L614-F628 HydrophobicContact CB-CE2 3.75Å; L614-Q631 HydrophobicContact CD1-CB 4.19Å; L614-Q631 HydrophobicContact CD2-CB 3.93Å; L614-Q631 VanDerWaalsContact CD2-OE1 3.24Å; L614-L632 HydrophobicContact CD1-CD1 3.94Å
615	L	70.1	Confident	72.3	Confident	71 Å²	71	89.2 Å²	89.2	37%	0.372	44%	0.439	S	S	.	.	H	α-helix	trans	-64.9	-20.9	179.8	-145.4	159.4	0	0	0	112.4	D611 R613 K619 F628	D611-L615 WeakPolarHBondContact O-CB 3.4Å; D611-L615 PolarHBondContact O-N 3.4Å; R613-L615 PolarHBondContact O-N 2.58Å; L615-K619 HydrophobicContact CD2-CD 3.76Å; L615-K619 VanDerWaalsContact CD2-CE 3.43Å; L615-K619 HydrophobicContact CD2-CG 4.33Å; L615-K619 WeakPolarHBondContact O-CB 3.18Å; L615-K619 WeakPolarHBondContact O-CG 3.44Å; L615-K619 PolarHBondContact O-N 3.24Å; L615-F628 HydrophobicContact CB-CE2 4.03Å; L615-F628 HydrophobicContact CB-CZ 4.29Å; L615-F628 HydrophobicContact CD1-CZ 4.29Å; L615-F628 HydrophobicContact CG-CE2 4.25Å; L615-F628 HydrophobicContact CG-CZ 4.04Å
616	K	76.7	Confident	73.2	Confident	127 Å²	127	92.2 Å²	92.2	55%	0.552	45%	0.452	S	S	*	.	H	α-helix	trans	-85.8	-21.9	171.1	-74.3	172.6	-167.6	159.7	0	114.1	T612 R613 L614 K620	T612-K616 WeakPolarHBondContact O-CD 3.25Å; T612-K616 WeakPolarHBondContact O-CE 3.46Å; T612-K616 VanDerWaalsContact O-CG 3.25Å; T612-K616 WeakPolarHBondContact O-CG 3.23Å; R613-K616 WeakPolarHBondContact O-CB 3.44Å; R613-K616 PolarHBondContact O-N 3.35Å; R613-K616 VanDerWaalsContact O-N 3.11Å; L614-K616 PolarHBondContact O-N 3.26Å; L614-K616 VanDerWaalsContact O-N 3.12Å; K616-K620 WeakPolarHBondContact O-CD 3.47Å; K616-K620 VanDerWaalsContact O-CG 3.32Å; K616-K620 WeakPolarHBondContact O-CG 3.32Å
617	K	78.4	Confident	73.6	Confident	87 Å²	87	89.3 Å²	89.3	38%	0.378	44%	0.443	S	S	.	.	H	α-helix	trans	-72.9	-47.5	168	-67.4	-179.8	-178.2	176.5	0	109.8	R613 L614 K619 K620 G621 Q622 I623	R613-K617 PolarHBondContact O-N 2.88Å; L614-K617 WeakPolarHBondContact O-CA 3.39Å; L614-K617 WeakPolarHBondContact O-CB 3.34Å; L614-K617 PolarHBondContact O-N 3.37Å; K617-K619 PolarHBondContact O-N 2.86Å; K617-K620 CarbonylContact O-C 3.54Å; K617-K620 PolarHBondContact O-N 3.08Å; K617-G621 PolarHBondContact O-N 2.75Å; K617-Q622 HydrophobicContact CB-CB 4.15Å; K617-Q622 PolarHBondContact O-N 2.73Å; K617-I623 HydrophobicContact CB-CD1 3.77Å; K617-I623 HydrophobicContact CB-CG1 3.81Å; K617-I623 HydrophobicContact CB-CG2 4.28Å; K617-I623 HydrophobicContact CD-CD1 4.37Å; K617-I623 HydrophobicContact CD-CG2 4.01Å
618	L	72.5	Confident	74.2	Confident	41 Å²	41	87.4 Å²	87.4	22%	0.215	43%	0.433	C	S	.	.	H	α-helix	trans	-57.4	-50.4	177.4	-176.3	68.4	0	0	0	111.3	L614 K620 G621 I623 E625 F628	L614-L618 PolarHBondContact O-N 3.3Å; L618-K620 PolarHBondContact O-N 3.35Å; L618-G621 PolarHBondContact O-N 2.85Å; L618-I623 HydrophobicContact CB-CD1 4.3Å; L618-I623 HydrophobicContact CB-CG1 4.16Å; L618-I623 HydrophobicContact CD1-CG1 4.5Å; L618-E625 HydrophobicContact CD1-CB 4.26Å; L618-F628 HydrophobicContact CB-CD2 4.25Å; L618-F628 HydrophobicContact CB-CG 4.39Å; L618-F628 HydrophobicContact CD1-CB 4.19Å; L618-F628 HydrophobicContact CD2-CB 4.28Å; L618-F628 HydrophobicContact CD2-CD1 3.76Å; L618-F628 HydrophobicContact CD2-CD2 4.28Å; L618-F628 HydrophobicContact CD2-CE1 4.15Å; L618-F628 HydrophobicContact CD2-CG 3.84Å
619	K	67.6	Low	74.9	Confident	166 Å²	166	89.7 Å²	89.7	72%	0.722	44%	0.442	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.8	4.1	175.7	-74.4	179	175.3	169.4	0	115.6	L615 K617	L615-K619 HydrophobicContact CD2-CD 3.76Å; L615-K619 VanDerWaalsContact CD2-CE 3.43Å; L615-K619 HydrophobicContact CD2-CG 4.33Å; L615-K619 WeakPolarHBondContact O-CB 3.18Å; L615-K619 WeakPolarHBondContact O-CG 3.44Å; L615-K619 PolarHBondContact O-N 3.24Å; K617-K619 PolarHBondContact O-N 2.86Å
620	K	80.1	Confident	75.5	Confident	155 Å²	155	91.2 Å²	91.2	67%	0.674	45%	0.446	S	S	*	.	T	Hydrogen-bonded Turn	trans	-121.1	3.7	171.8	-72.4	179.3	173.7	-172	0	113	K616 K617 L618 Q622	K616-K620 WeakPolarHBondContact O-CD 3.47Å; K616-K620 VanDerWaalsContact O-CG 3.32Å; K616-K620 WeakPolarHBondContact O-CG 3.32Å; K617-K620 CarbonylContact O-C 3.54Å; K617-K620 PolarHBondContact O-N 3.08Å; L618-K620 PolarHBondContact O-N 3.35Å; K620-Q622 VanDerWaalsContact C-N 3.26Å; K620-Q622 HydrophobicContact CB-CG 3.75Å; K620-Q622 VanDerWaalsContact CD-OE1 3.28Å; K620-Q622 PolarHBondContact O-N 3.31Å
621	G	71.9	Confident	75.6	Confident	69 Å²	69	90.3 Å²	90.3	71%	0.711	44%	0.442	S	S	*	.	T	Hydrogen-bonded Turn	trans	64.1	27.7	-173.8	0	0	0	0	0	113.8	K617 L618	K617-G621 PolarHBondContact O-N 2.75Å; L618-G621 PolarHBondContact O-N 2.85Å
622	Q	73.8	Confident	75.6	Confident	127 Å²	127	90.3 Å²	90.3	59%	0.593	44%	0.442	S	S	*	.	S	Bend	trans	-93.9	-3.4	-177.9	-59.6	-170.1	-77.2	0	0	114	K617 K620	K617-Q622 HydrophobicContact CB-CB 4.15Å; K617-Q622 PolarHBondContact O-N 2.73Å; K620-Q622 VanDerWaalsContact C-N 3.26Å; K620-Q622 HydrophobicContact CB-CG 3.75Å; K620-Q622 VanDerWaalsContact CD-OE1 3.28Å; K620-Q622 PolarHBondContact O-N 3.31Å
623	I	83.9	Confident	75.5	Confident	25 Å²	25	91.5 Å²	91.5	13%	0.128	45%	0.45	C	S	.	.	S	Bend	trans	-149.1	154.5	171.1	55.8	-180	0	0	0	106.8	L614 K617 L618 D627 F628	L614-I623 HydrophobicContact CD2-CD1 4.37Å; K617-I623 HydrophobicContact CB-CD1 3.77Å; K617-I623 HydrophobicContact CB-CG1 3.81Å; K617-I623 HydrophobicContact CB-CG2 4.28Å; K617-I623 HydrophobicContact CD-CD1 4.37Å; K617-I623 HydrophobicContact CD-CG2 4.01Å; L618-I623 HydrophobicContact CB-CD1 4.3Å; L618-I623 HydrophobicContact CB-CG1 4.16Å; L618-I623 HydrophobicContact CD1-CG1 4.5Å; I623-D627 HydrophobicContact CB-CB 4.01Å; I623-F628 HydrophobicContact CD1-CB 3.81Å; I623-F628 HydrophobicContact CD1-CD2 4.02Å; I623-F628 HydrophobicContact CD1-CG 4.41Å; I623-F628 HydrophobicContact CG1-CB 4.43Å
624	S	80.6	Confident	74.8	Confident	52 Å²	52	88.8 Å²	88.8	36%	0.364	45%	0.446	S	S	.	.			trans	-73.6	172.6	169.7	71.4	0	0	0	0	111.7	D627 F628	S624-D627 VanDerWaalsContact CB-OD2 3.27Å; S624-D627 WeakPolarHBondContact CB-OD2 3.44Å; S624-D627 PolarHBondContact N-OD2 2.97Å; S624-D627 WeakPolarHBondContact OG-CB 3.12Å; S624-D627 PolarHBondContact OG-N 3.12Å; S624-D627 PolarHBondContact OG-OD2 3.14Å; S624-F628 WeakPolarHBondContact O-CB 3.31Å; S624-F628 PolarHBondContact O-N 2.9Å; S624-F628 VanDerWaalsContact O-N 3.14Å
625	E	72.9	Confident	73.9	Confident	139 Å²	139	89.7 Å²	89.7	65%	0.65	45%	0.454	S	S	*	.	H	α-helix	trans	-71.2	-35	174.9	-157.1	148.7	-141.6	0	0	110.9	L618 F628 E629	L618-E625 HydrophobicContact CD1-CB 4.26Å; E625-F628 WeakPolarHBondContact O-CB 3.11Å; E625-F628 PolarHBondContact O-N 3.12Å; E625-E629 PolarHBondContact O-N 3.33Å
626	E	75.4	Confident	73.2	Confident	148 Å²	148	91.1 Å²	91.1	69%	0.692	46%	0.458	S	S	*	.	H	α-helix	trans	-67.5	-43.3	173.5	-60.8	177.4	166.6	0	0	112.2	F628 E629 Q630	E626-F628 PolarHBondContact O-N 3.21Å; E626-E629 PolarHBondContact O-N 3.3Å; E626-Q630 WeakPolarHBondContact O-CG 3.46Å; E626-Q630 PolarHBondContact O-N 3.13Å
627	D	73.9	Confident	71.8	Confident	69 Å²	69	92 Å²	92	37%	0.369	46%	0.464	S	S	.	.	H	α-helix	trans	-59	-37.9	172.4	-70.8	-59	0	0	0	111.8	I623 S624 Q631	I623-D627 HydrophobicContact CB-CB 4.01Å; S624-D627 VanDerWaalsContact CB-OD2 3.27Å; S624-D627 WeakPolarHBondContact CB-OD2 3.44Å; S624-D627 PolarHBondContact N-OD2 2.97Å; S624-D627 WeakPolarHBondContact OG-CB 3.12Å; S624-D627 PolarHBondContact OG-N 3.12Å; S624-D627 PolarHBondContact OG-OD2 3.14Å; D627-Q631 WeakPolarHBondContact O-CB 3.3Å; D627-Q631 VanDerWaalsContact O-CG 3.3Å; D627-Q631 WeakPolarHBondContact O-CG 3.41Å; D627-Q631 PolarHBondContact O-N 2.73Å; D627-Q631 VanDerWaalsContact O-N 3.11Å; D627-Q631 PolarHBondContact O-NE2 3.19Å
628	F	80.3	Confident	70.4	Confident	27 Å²	27	96.4 Å²	96.4	12%	0.118	49%	0.486	C	S	.	.	H	α-helix	trans	-68.5	-46.1	-179.4	171.4	-101.6	0	0	0	111.1	L614 L615 L618 I623 S624 E625 E626 Q631 L632	L614-F628 HydrophobicContact CB-CD2 3.88Å; L614-F628 HydrophobicContact CB-CE2 3.75Å; L615-F628 HydrophobicContact CB-CE2 4.03Å; L615-F628 HydrophobicContact CB-CZ 4.29Å; L615-F628 HydrophobicContact CD1-CZ 4.29Å; L615-F628 HydrophobicContact CG-CE2 4.25Å; L615-F628 HydrophobicContact CG-CZ 4.04Å; L618-F628 HydrophobicContact CB-CD2 4.25Å; L618-F628 HydrophobicContact CB-CG 4.39Å; L618-F628 HydrophobicContact CD1-CB 4.19Å; L618-F628 HydrophobicContact CD2-CB 4.28Å; L618-F628 HydrophobicContact CD2-CD1 3.76Å; L618-F628 HydrophobicContact CD2-CD2 4.28Å; L618-F628 HydrophobicContact CD2-CE1 4.15Å; L618-F628 HydrophobicContact CD2-CG 3.84Å; I623-F628 HydrophobicContact CD1-CB 3.81Å; I623-F628 HydrophobicContact CD1-CD2 4.02Å; I623-F628 HydrophobicContact CD1-CG 4.41Å; I623-F628 HydrophobicContact CG1-CB 4.43Å; S624-F628 WeakPolarHBondContact O-CB 3.31Å; S624-F628 PolarHBondContact O-N 2.9Å; S624-F628 VanDerWaalsContact O-N 3.14Å; E625-F628 WeakPolarHBondContact O-CB 3.11Å; E625-F628 PolarHBondContact O-N 3.12Å; E626-F628 PolarHBondContact O-N 3.21Å; F628-Q631 PolarHBondContact O-N 2.93Å; F628-L632 HydrophobicContact CE2-CD1 3.85Å; F628-L632 HydrophobicContact CZ-CD1 3.88Å; F628-L632 HydrophobicContact CZ-CD2 4.39Å; F628-L632 WeakPolarHBondContact O-CB 3.4Å; F628-L632 PolarHBondContact O-N 3.08Å
629	E	75.7	Confident	69.4	Low	130 Å²	130	98.5 Å²	98.5	61%	0.607	51%	0.509	S	S	*	.	H	α-helix	trans	-64.7	-45.3	177.4	-69.5	-165.1	154.2	0	0	111.9	E625 E626 Q631 L632 T633	E625-E629 PolarHBondContact O-N 3.33Å; E626-E629 PolarHBondContact O-N 3.3Å; E629-Q631 VanDerWaalsContact C-N 3.35Å; E629-Q631 PolarHBondContact O-N 3.35Å; E629-L632 PolarHBondContact O-N 3.22Å; E629-L632 VanDerWaalsContact O-N 3.11Å; E629-T633 PolarHBondContact O-N 3.28Å; E629-T633 PolarHBondContact O-OG1 2.99Å
630	Q	77.9	Confident	68.5	Low	125 Å²	125	93.4 Å²	93.4	58%	0.584	50%	0.504	S	S	*	.	H	α-helix	trans	-59.4	-42.6	177	-71.4	-177.1	22.5	0	0	112.7	E626 L632 T633 N634	E626-Q630 WeakPolarHBondContact O-CG 3.46Å; E626-Q630 PolarHBondContact O-N 3.13Å; Q630-L632 VanDerWaalsContact C-N 3.31Å; Q630-L632 PolarHBondContact O-N 3Å; Q630-T633 WeakPolarHBondContact CA-OG1 3.48Å; Q630-T633 PolarHBondContact O-N 3.13Å; Q630-T633 PolarHBondContact O-OG1 3.27Å; Q630-N634 PolarHBondContact O-N 3Å; Q630-N634 VanDerWaalsContact O-N 3.1Å; Q630-N634 PolarHBondContact O-OD1 2.95Å
631	Q	74.4	Confident	66.1	Low	73 Å²	73	89.1 Å²	89.1	34%	0.341	50%	0.503	S	S	.	.	H	α-helix	trans	-69.9	-27.7	177.8	-73.3	168.7	49.4	0	0	112.4	L614 D627 F628 E629 S635	L614-Q631 HydrophobicContact CD1-CB 4.19Å; L614-Q631 HydrophobicContact CD2-CB 3.93Å; L614-Q631 VanDerWaalsContact CD2-OE1 3.24Å; D627-Q631 WeakPolarHBondContact O-CB 3.3Å; D627-Q631 VanDerWaalsContact O-CG 3.3Å; D627-Q631 WeakPolarHBondContact O-CG 3.41Å; D627-Q631 PolarHBondContact O-N 2.73Å; D627-Q631 VanDerWaalsContact O-N 3.11Å; D627-Q631 PolarHBondContact O-NE2 3.19Å; F628-Q631 PolarHBondContact O-N 2.93Å; E629-Q631 VanDerWaalsContact C-N 3.35Å; E629-Q631 PolarHBondContact O-N 3.35Å; Q631-S635 PolarHBondContact O-N 3.15Å; Q631-S635 PolarHBondContact O-OG 2.8Å
632	L	75.8	Confident	64.6	Low	39 Å²	39	95.9 Å²	95.9	20%	0.204	54%	0.535	C	S	.	.	H	α-helix	trans	-77.3	-27.3	173.6	-131.7	83.2	0	0	0	113.6	D611 L614 F628 E629 Q630 S635	D611-L632 VanDerWaalsContact OD1-CD1 3.23Å; D611-L632 WeakPolarHBondContact OD1-CD1 3.43Å; L614-L632 HydrophobicContact CD1-CD1 3.94Å; F628-L632 HydrophobicContact CE2-CD1 3.85Å; F628-L632 HydrophobicContact CZ-CD1 3.88Å; F628-L632 HydrophobicContact CZ-CD2 4.39Å; F628-L632 WeakPolarHBondContact O-CB 3.4Å; F628-L632 PolarHBondContact O-N 3.08Å; E629-L632 PolarHBondContact O-N 3.22Å; E629-L632 VanDerWaalsContact O-N 3.11Å; Q630-L632 VanDerWaalsContact C-N 3.31Å; Q630-L632 PolarHBondContact O-N 3Å; L632-S635 PolarHBondContact O-OG 2.73Å
633	T	68.6	Low	64.1	Low	78 Å²	78	94.4 Å²	94.4	48%	0.479	53%	0.532	S	S	.	.	H	α-helix	trans	-78	-38.9	174.2	44.4	0	0	0	0	112.1	E629 Q630 K636 Q637	E629-T633 PolarHBondContact O-N 3.28Å; E629-T633 PolarHBondContact O-OG1 2.99Å; Q630-T633 WeakPolarHBondContact CA-OG1 3.48Å; Q630-T633 PolarHBondContact O-N 3.13Å; Q630-T633 PolarHBondContact O-OG1 3.27Å; T633-K636 PolarHBondContact O-N 3.39Å; T633-Q637 PolarHBondContact O-N 3.18Å
634	N	63.1	Low	63.1	Low	95 Å²	95	98 Å²	98	51%	0.508	55%	0.553	S	S	.	*	H	α-helix	trans	-66.9	-41.7	-179.1	-72.1	9.5	0	0	0	112.1	Q630 K636 Q637 E638	Q630-N634 PolarHBondContact O-N 3Å; Q630-N634 VanDerWaalsContact O-N 3.1Å; Q630-N634 PolarHBondContact O-OD1 2.95Å; N634-K636 PolarHBondContact O-N 3.46Å; N634-K636 VanDerWaalsContact O-N 3.13Å; N634-Q637 PolarHBondContact O-N 3.44Å; N634-E638 PolarHBondContact O-N 3.2Å; N634-E638 VanDerWaalsContact O-N 3.07Å
635	S	58.6	Low	62.1	Low	40 Å²	40	100.6 Å²	100.6	28%	0.28	56%	0.564	S	S	.	*	H	α-helix	trans	-59.2	-26.3	175.7	59.1	0	0	0	0	113.2	Q631 L632	Q631-S635 PolarHBondContact O-N 3.15Å; Q631-S635 PolarHBondContact O-OG 2.8Å; L632-S635 PolarHBondContact O-OG 2.73Å
636	K	54.3	Low	61.5	Low	101 Å²	101	98.3 Å²	98.3	44%	0.439	56%	0.559	S	S	.	*	H	α-helix	trans	-91.4	-10.1	178.2	-72.5	171.5	-179.6	150	0	114.2	E607 D611 T633 N634	E607-K636 WeakPolarHBondContact OE1-CE 3.42Å; D611-K636 IonicContact OD2-NZ 3.38Å; D611-K636 PolarHBondContact OD2-NZ 2.97Å; T633-K636 PolarHBondContact O-N 3.39Å; N634-K636 PolarHBondContact O-N 3.46Å; N634-K636 VanDerWaalsContact O-N 3.13Å
637	Q	49	Very low	60.6	Low	145 Å²	145	95.2 Å²	95.2	68%	0.678	55%	0.55	S	S	*	*	H	α-helix	trans	-89.3	-35.8	168.2	-71.3	-175.3	-9.1	0	0	111.7	T633 N634 A639 G640	T633-Q637 PolarHBondContact O-N 3.18Å; N634-Q637 PolarHBondContact O-N 3.44Å; Q637-A639 VanDerWaalsContact C-N 3.27Å; Q637-A639 PolarHBondContact O-N 3.03Å; Q637-G640 WeakPolarHBondContact O-CA 3.43Å; Q637-G640 PolarHBondContact O-N 3.09Å
638	E	48.6	Very low	59.7	Low	180 Å²	180	96.9 Å²	96.9	84%	0.841	56%	0.562	S	S	*	*	H	α-helix	trans	-66.6	-27.9	174.8	-68.4	-173.1	154.4	0	0	112.9	N634 G640	N634-E638 PolarHBondContact O-N 3.2Å; N634-E638 VanDerWaalsContact O-N 3.07Å; E638-G640 PolarHBondContact O-N 3.02Å
639	A	50.2	Low	58.3	Low	86 Å²	86	101.9 Å²	101.9	71%	0.711	59%	0.594	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.3	9.8	170.9	0	0	0	0	0	114.1	Q637	Q637-A639 VanDerWaalsContact C-N 3.27Å; Q637-A639 PolarHBondContact O-N 3.03Å
640	G	49.1	Very low	56.9	Low	59 Å²	59	99.8 Å²	99.8	61%	0.608	59%	0.593	S	S	*	*			trans	-130.7	47.5	-157.6	0	0	0	0	0	117	Q637 E638	Q637-G640 WeakPolarHBondContact O-CA 3.43Å; Q637-G640 PolarHBondContact O-N 3.09Å; E638-G640 PolarHBondContact O-N 3.02Å
641	G	30.2	Very low	55.2	Low	64 Å²	64	97.7 Å²	97.7	66%	0.66	59%	0.594	S	S	*	*			trans	157.5	171.8	159.4	0	0	0	0	0	116.1
642	P	40.4	Very low	53.4	Low	212 Å²	212	99.9 Å²	99.9	100%	1.377	62%	0.617	S	S	*	*			cis	-83	0	-6.9	-5.1	24.8	0	0	0	113.5

Retrieved 642 of 642 residues in 234.1 ms (Link to these results)

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