ABCF2_HUMAN Loading...

ATP-binding cassette sub-family F member 2

AlphaFold DB , UniProt , Accession Q9UG63, Species HUMAN (Homo sapiens, Human), Gene ABCF2, Length 623 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	43	Very low	65.2	Low	233 Å²	233	119.5 Å²	119.5	100%	1.148	66%	0.657	S	S	*	*				0	132.9	0	-61.9	-157.7	-178.5	0	0	108.2	S3	M1-S3 PolarHBondContact O-N 3.35Å; M1-S3 VanDerWaalsContact O-N 3.13Å
2	P	46.8	Very low	65.5	Low	105 Å²	105	123.4 Å²	123.4	68%	0.682	66%	0.662	S	S	*	*			trans	-65.5	118.1	177.3	-9.2	24.1	0	0	0	108.2
3	S	64.8	Low	65.6	Low	79 Å²	79	126.9 Å²	126.9	55%	0.552	67%	0.668	S	S	*	*			trans	-43.4	132.6	-177.9	161.5	0	0	0	0	112.6	M1 L5 A6	M1-S3 PolarHBondContact O-N 3.35Å; M1-S3 VanDerWaalsContact O-N 3.13Å; S3-L5 PolarHBondContact O-N 3.17Å; S3-L5 PolarHBondContact OG-N 3.26Å; S3-A6 WeakPolarHBondContact O-CB 3.27Å; S3-A6 PolarHBondContact O-N 3.28Å
4	D	67.5	Low	65.4	Low	120 Å²	120	129 Å²	129	64%	0.642	67%	0.669	S	S	*	*	H	α-helix	trans	-54.3	-20.7	179.5	-72.5	-41.8	0	0	0	113.6	A6 K7 K8	D4-A6 VanDerWaalsContact C-N 3.34Å; D4-A6 PolarHBondContact O-N 2.71Å; D4-K7 PolarHBondContact O-N 3.02Å; D4-K8 PolarHBondContact O-N 2.96Å; D4-K8 VanDerWaalsContact O-N 3.07Å
5	L	66.8	Low	64.7	Low	128 Å²	128	129.7 Å²	129.7	67%	0.67	67%	0.668	S	S	*	*	H	α-helix	trans	-67.5	-33.4	176.2	-134.7	126.7	0	0	0	112.4	S3 K9	S3-L5 PolarHBondContact O-N 3.17Å; S3-L5 PolarHBondContact OG-N 3.26Å; L5-K9 PolarHBondContact O-N 2.83Å
6	A	71.4	Confident	63.8	Low	62 Å²	62	125.6 Å²	125.6	51%	0.512	66%	0.659	S	S	.	*	H	α-helix	trans	-72.4	-36.9	175.4	0	0	0	0	0	111.8	S3 D4 A10	S3-A6 WeakPolarHBondContact O-CB 3.27Å; S3-A6 PolarHBondContact O-N 3.28Å; D4-A6 VanDerWaalsContact C-N 3.34Å; D4-A6 PolarHBondContact O-N 2.71Å; A6-A10 PolarHBondContact O-N 3.45Å; A6-A10 VanDerWaalsContact O-N 3.11Å
7	K	72.6	Confident	62.7	Low	138 Å²	138	121.6 Å²	121.6	60%	0.6	65%	0.648	S	S	*	*	H	α-helix	trans	-65.5	-43.3	175.3	-76.9	-178.8	179.4	173	0	111.9	D4 A10 A11	D4-K7 PolarHBondContact O-N 3.02Å; K7-A10 PolarHBondContact O-N 3.34Å; K7-A11 PolarHBondContact O-N 3.36Å
8	K	72.5	Confident	61.4	Low	170 Å²	170	124.2 Å²	124.2	74%	0.739	65%	0.653	S	S	*	*	H	α-helix	trans	-63.9	-40.1	176.9	-86.5	-175.3	174.7	178.4	0	112.9	D4 A11 K12	D4-K8 PolarHBondContact O-N 2.96Å; D4-K8 VanDerWaalsContact O-N 3.07Å; K8-A11 PolarHBondContact O-N 3.11Å; K8-K12 PolarHBondContact O-N 3.3Å
9	K	68.1	Low	60.3	Low	162 Å²	162	122.4 Å²	122.4	70%	0.704	66%	0.658	S	S	*	*	H	α-helix	trans	-66.4	-38.6	175.7	-101.4	-177.8	175.5	177.3	0	112.7	L5 K13	L5-K9 PolarHBondContact O-N 2.83Å; K9-K13 PolarHBondContact O-N 3.31Å
10	A	72	Confident	59.1	Low	62 Å²	62	127.9 Å²	127.9	51%	0.512	67%	0.669	S	S	.	*	H	α-helix	trans	-67.8	-37.5	177.5	0	0	0	0	0	112.5	A6 K7 K13 K14	A6-A10 PolarHBondContact O-N 3.45Å; A6-A10 VanDerWaalsContact O-N 3.11Å; K7-A10 PolarHBondContact O-N 3.34Å; A10-K13 PolarHBondContact O-N 2.74Å; A10-K14 PolarHBondContact O-N 3.15Å; A10-K14 VanDerWaalsContact O-N 3.15Å
11	A	71.7	Confident	57.6	Low	56 Å²	56	129.3 Å²	129.3	46%	0.463	67%	0.672	S	S	.	*	H	α-helix	trans	-63.8	-49	176.6	0	0	0	0	0	112.2	K7 K8 K13 K14 E15	K7-A11 PolarHBondContact O-N 3.36Å; K8-A11 PolarHBondContact O-N 3.11Å; A11-K13 VanDerWaalsContact C-N 3.32Å; A11-K13 PolarHBondContact O-N 3.1Å; A11-K14 PolarHBondContact O-N 3.15Å; A11-K14 VanDerWaalsContact O-N 3.1Å; A11-E15 PolarHBondContact O-N 2.83Å; A11-E15 VanDerWaalsContact O-N 3.1Å
12	K	69.3	Low	57	Low	166 Å²	166	130 Å²	130	72%	0.722	66%	0.662	S	S	*	*	H	α-helix	trans	-61.2	-36.5	177.2	-95.6	-175.2	172.4	-177.8	0	113.2	K8 K14 A16	K8-K12 PolarHBondContact O-N 3.3Å; K12-K14 VanDerWaalsContact C-N 3.33Å; K12-A16 PolarHBondContact O-N 3.24Å; K12-A16 VanDerWaalsContact O-N 3.15Å
13	K	66.5	Low	56.2	Low	169 Å²	169	130.7 Å²	130.7	74%	0.735	67%	0.666	S	S	*	*	H	α-helix	trans	-70.5	-30	177.3	-154.7	175.9	-176	-178.6	0	112.2	K9 A10 A11 A17	K9-K13 PolarHBondContact O-N 3.31Å; A10-K13 PolarHBondContact O-N 2.74Å; A11-K13 VanDerWaalsContact C-N 3.32Å; A11-K13 PolarHBondContact O-N 3.1Å; K13-A17 WeakPolarHBondContact O-CB 3.48Å; K13-A17 PolarHBondContact O-N 2.96Å
14	K	63.4	Low	54.4	Low	156 Å²	156	139 Å²	139	68%	0.678	69%	0.685	S	S	*	*	H	α-helix	trans	-75.6	-34	176.7	-126.5	178.7	-178	179.7	0	112.6	A10 A11 K12 K18	A10-K14 PolarHBondContact O-N 3.15Å; A10-K14 VanDerWaalsContact O-N 3.15Å; A11-K14 PolarHBondContact O-N 3.15Å; A11-K14 VanDerWaalsContact O-N 3.1Å; K12-K14 VanDerWaalsContact C-N 3.33Å; K14-K18 WeakPolarHBondContact O-CG 3.28Å; K14-K18 PolarHBondContact O-N 3.2Å; K14-K18 VanDerWaalsContact O-N 3.15Å
15	E	54.1	Low	52.4	Low	140 Å²	140	143.3 Å²	143.3	65%	0.654	70%	0.698	S	S	*	*	H	α-helix	trans	-69.4	-44.4	172.8	-85.8	-178.3	143.8	0	0	112.4	A11 A17 K18 A19	A11-E15 PolarHBondContact O-N 2.83Å; A11-E15 VanDerWaalsContact O-N 3.1Å; E15-A17 PolarHBondContact O-N 2.93Å; E15-K18 PolarHBondContact O-N 2.98Å; E15-K18 VanDerWaalsContact O-N 3.08Å; E15-A19 PolarHBondContact O-N 3.06Å; E15-A19 VanDerWaalsContact O-N 3.07Å
16	A	50.8	Low	50.2	Low	64 Å²	64	140.4 Å²	140.4	53%	0.529	70%	0.699	S	S	.	*	H	α-helix	trans	-62.6	-31	176.5	0	0	0	0	0	112.8	K12	K12-A16 PolarHBondContact O-N 3.24Å; K12-A16 VanDerWaalsContact O-N 3.15Å
17	A	44	Very low	48	Very low	58 Å²	58	145.7 Å²	145.7	48%	0.479	71%	0.713	S	S	.	*	H	α-helix	trans	-74.8	-32.5	174.2	0	0	0	0	0	112.9	K13 E15	K13-A17 WeakPolarHBondContact O-CB 3.48Å; K13-A17 PolarHBondContact O-N 2.96Å; E15-A17 PolarHBondContact O-N 2.93Å
18	K	39.5	Very low	45.6	Very low	168 Å²	168	146.7 Å²	146.7	73%	0.73	72%	0.72	S	S	*	*	H	α-helix	trans	-74	-27.9	176.7	-81.2	-176.9	173.9	-174.4	0	113.1	K14 E15 R20	K14-K18 WeakPolarHBondContact O-CG 3.28Å; K14-K18 PolarHBondContact O-N 3.2Å; K14-K18 VanDerWaalsContact O-N 3.15Å; E15-K18 PolarHBondContact O-N 2.98Å; E15-K18 VanDerWaalsContact O-N 3.08Å; K18-R20 PolarHBondContact O-N 3.05Å
19	A	41	Very low	43.2	Very low	90 Å²	90	146.1 Å²	146.1	74%	0.744	72%	0.72	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.4	-9.9	177.1	0	0	0	0	0	114.3	E15	E15-A19 PolarHBondContact O-N 3.06Å; E15-A19 VanDerWaalsContact O-N 3.07Å
20	R	36	Very low	41.1	Very low	232 Å²	232	145.8 Å²	145.8	88%	0.875	73%	0.726	S	S	*	*	T	Hydrogen-bonded Turn	trans	-105.8	9.2	-178	-87.1	-175.1	165.7	-169.2	-3.6	115.3	K18	K18-R20 PolarHBondContact O-N 3.05Å
21	Q	27.2	Very low	38.8	Very low	158 Å²	158	146.4 Å²	146.4	74%	0.738	74%	0.739	S	S	*	*			trans	-137	99.5	-177.8	-69.2	-174.7	-6.3	0	0	112.5
22	R	31.2	Very low	36.3	Very low	247 Å²	247	151.6 Å²	151.6	93%	0.932	76%	0.759	S	S	*	*			trans	174.9	152.3	141.1	-98.1	163.7	-174.3	-146.9	0.5	111.8
23	P	29.7	Very low	34.3	Very low	119 Å²	119	150 Å²	150	77%	0.773	76%	0.762	S	S	*	*				-120.1	152.2	-104.1	35	-22	0	0	0	114.6
24	R	27.3	Very low	32.1	Very low	253 Å²	253	148.4 Å²	148.4	96%	0.955	77%	0.767	S	S	*	*			trans	-82.3	116.8	165.8	-78.6	-179.7	167.1	172.9	-5.1	109.9
25	K	24.9	Very low	30.3	Very low	211 Å²	211	147.3 Å²	147.3	92%	0.917	77%	0.773	S	S	*	*			trans	-78.8	141.6	151.8	-64.2	175.9	173.9	-178.2	0	106.1
26	G	21.6	Very low	28.8	Very low	67 Å²	67	149.1 Å²	149.1	69%	0.691	78%	0.781	S	S	*	*			cis	142.5	116.2	15.8	0	0	0	0	0	106
27	H	24.5	Very low	27.6	Very low	173 Å²	173	152.1 Å²	152.1	80%	0.801	80%	0.795	S	S	*	*			trans	158.3	101.6	159.4	-94.1	-61.8	0	0	0	106.5
28	E	21.6	Very low	26.6	Very low	159 Å²	159	158.1 Å²	158.1	74%	0.743	81%	0.814	S	S	*	*				88.4	124.5	73.9	-94.9	179.5	170.4	0	0	114.4
29	E	23.1	Very low	25.9	Very low	159 Å²	159	157 Å²	157	74%	0.743	82%	0.82	S	S	*	*			trans	84	107.6	152	-65	-169.2	160.2	0	0	122.3
30	N	23.2	Very low	25.2	Very low	154 Å²	154	157.4 Å²	157.4	82%	0.824	82%	0.824	S	S	*	*				71.3	124.5	125.8	-67.6	-21.1	0	0	0	121.3
31	G	23.9	Very low	24.6	Very low	76 Å²	76	155.1 Å²	155.1	78%	0.784	82%	0.823	S	S	*	*			trans	129.9	100.1	140.7	0	0	0	0	0	114.9
32	D	19.7	Very low	24.5	Very low	165 Å²	165	157.1 Å²	157.1	88%	0.882	83%	0.829	S	S	*	*			trans	-50.1	141.3	158.8	-74.8	-51.3	0	0	0	111.6
33	V	27.5	Very low	24.3	Very low	132 Å²	132	153.1 Å²	153.1	80%	0.8	83%	0.826	S	S	*	*				174.1	132.5	130	158.4	0	0	0	0	109.7
34	V	20.9	Very low	24.1	Very low	136 Å²	136	156.5 Å²	156.5	82%	0.824	83%	0.832	S	S	*	*			trans	-68.7	125	177.9	177.9	0	0	0	0	111.1
35	T	25.2	Very low	24.4	Very low	132 Å²	132	148.7 Å²	148.7	81%	0.81	82%	0.822	S	S	*	*			trans	-158.8	147.4	149.2	2.3	0	0	0	0	113.1
36	E	23.1	Very low	24.7	Very low	179 Å²	179	146.1 Å²	146.1	84%	0.836	82%	0.818	S	S	*	*			trans	-57.3	166.1	-172.4	-79.4	177.1	157.8	0	0	117.4	Q38	E36-Q38 PolarHBondContact O-N 3.16Å
37	P	24.9	Very low	25	Very low	126 Å²	126	146.6 Å²	146.6	82%	0.818	82%	0.823	S	S	*	*			trans	-84	116.4	-156.7	32.3	-30.5	0	0	0	112.3
38	Q	23.6	Very low	25.6	Very low	185 Å²	185	149.6 Å²	149.6	86%	0.864	83%	0.827	S	S	*	*			trans	-104.9	114	161.7	-73	-170.8	-0.4	0	0	110.2	E36 A40	E36-Q38 PolarHBondContact O-N 3.16Å; Q38-A40 PolarHBondContact O-N 3.41Å
39	V	24.2	Very low	26.3	Very low	144 Å²	144	150.5 Å²	150.5	87%	0.873	83%	0.831	S	S	*	*			trans	4.5	94.8	152.4	-168.1	0	0	0	0	114.7
40	A	26.4	Very low	27.1	Very low	99 Å²	99	146.7 Å²	146.7	82%	0.818	82%	0.819	S	S	*	*			trans	-74.3	132.6	169.2	0	0	0	0	0	110.3	Q38	Q38-A40 PolarHBondContact O-N 3.41Å
41	E	23.3	Very low	28.3	Very low	184 Å²	184	142.8 Å²	142.8	86%	0.86	80%	0.801	S	S	*	*			trans	-56.3	151	-173	-70.8	166	138.1	0	0	114.2	N43	E41-N43 PolarHBondContact O-N 2.83Å; E41-N43 VanDerWaalsContact O-N 3.13Å
42	K	23.8	Very low	29.6	Very low	199 Å²	199	147 Å²	147	87%	0.865	80%	0.8	S	S	*	*			trans	-51.1	111	172.4	-69.5	168.1	173.5	176.3	0	110.3	E44	K42-E44 PolarHBondContact O-N 2.84Å; K42-E44 VanDerWaalsContact O-N 3.1Å
43	N	27.7	Very low	31.2	Very low	163 Å²	163	141.3 Å²	141.3	87%	0.872	77%	0.771	S	S	*	*			trans	-66.1	104.3	151.8	-87.6	-24.1	0	0	0	107.5	E41 A45	E41-N43 PolarHBondContact O-N 2.83Å; E41-N43 VanDerWaalsContact O-N 3.13Å; N43-A45 PolarHBondContact O-N 2.7Å
44	E	25.8	Very low	32.7	Very low	190 Å²	190	138.5 Å²	138.5	89%	0.888	75%	0.752	S	S	*	*			trans	-62.2	81.8	162.1	-71.1	-177	154.7	0	0	108.7	K42 N46	K42-E44 PolarHBondContact O-N 2.84Å; K42-E44 VanDerWaalsContact O-N 3.1Å; E44-N46 PolarHBondContact O-N 2.79Å; E44-N46 VanDerWaalsContact O-N 3.17Å
45	A	34.3	Very low	34.8	Very low	90 Å²	90	136.4 Å²	136.4	74%	0.744	74%	0.736	S	S	*	*			trans	-75.5	99	166.8	0	0	0	0	0	107.9	N43 G47	N43-A45 PolarHBondContact O-N 2.7Å; A45-G47 PolarHBondContact O-N 3.37Å
46	N	30.4	Very low	36.5	Very low	157 Å²	157	134.9 Å²	134.9	84%	0.84	72%	0.722	S	S	*	*			trans	9.2	94.9	159.4	-74.1	-18.7	0	0	0	114.7	E44 R48	E44-N46 PolarHBondContact O-N 2.79Å; E44-N46 VanDerWaalsContact O-N 3.17Å; N46-R48 VanDerWaalsContact C-N 3.32Å; N46-R48 PolarHBondContact O-N 2.87Å
47	G	28.9	Very low	38.3	Very low	77 Å²	77	128.7 Å²	128.7	79%	0.794	70%	0.696	S	S	*	*			trans	-60.6	95.2	164.4	0	0	0	0	0	109.2	A45 E49	A45-G47 PolarHBondContact O-N 3.37Å; G47-E49 PolarHBondContact O-N 3.12Å
48	R	35.5	Very low	40.4	Very low	236 Å²	236	128.4 Å²	128.4	89%	0.891	68%	0.682	S	S	*	*			trans	-62.7	114.1	154.7	-86.2	-178.3	174	170.6	-2	105.4	N46 T50	N46-R48 VanDerWaalsContact C-N 3.32Å; N46-R48 PolarHBondContact O-N 2.87Å; R48-T50 PolarHBondContact O-N 3.07Å
49	E	37.1	Very low	42.6	Very low	177 Å²	177	125.7 Å²	125.7	83%	0.827	67%	0.67	S	S	*	*			trans	-51	109.1	164.5	-73	178.4	158.5	0	0	107	G47 T51	G47-E49 PolarHBondContact O-N 3.12Å; E49-T51 PolarHBondContact O-N 2.88Å
50	T	39.9	Very low	44.6	Very low	80 Å²	80	123.3 Å²	123.3	49%	0.491	65%	0.652	S	S	.	*			trans	-56.5	107.5	166.7	12.3	0	0	0	0	106	R48 D54	R48-T50 PolarHBondContact O-N 3.07Å; T50-D54 HydrophobicContact CG2-CB 4.05Å
51	T	49.1	Very low	46.8	Very low	72 Å²	72	123.2 Å²	123.2	44%	0.442	63%	0.634	S	S	.	*			trans	-65	154.5	177.8	49.9	0	0	0	0	109	E49 V53 D54 L55	E49-T51 PolarHBondContact O-N 2.88Å; T51-V53 PolarHBondContact O-N 3.41Å; T51-D54 PolarHBondContact N-OD2 3.15Å; T51-D54 VanDerWaalsContact N-OD2 3.1Å; T51-D54 WeakPolarHBondContact O-CB 3.41Å; T51-D54 PolarHBondContact O-N 3.44Å; T51-D54 PolarHBondContact OG1-OD2 3.12Å; T51-L55 PolarHBondContact O-N 3.18Å
52	E	50.8	Low	49.2	Very low	164 Å²	164	119 Å²	119	77%	0.766	62%	0.617	S	S	*	*	H	α-helix	trans	-49.3	-29.5	173.7	-69.4	-179.3	157.1	0	0	112	L55 L56	E52-L55 PolarHBondContact O-N 3.44Å; E52-L56 WeakPolarHBondContact O-CG 3.46Å; E52-L56 PolarHBondContact O-N 3.1Å
53	V	52.9	Low	51.5	Low	46 Å²	46	114.9 Å²	114.9	28%	0.279	60%	0.6	S	S	.	*	H	α-helix	trans	-66.4	-41.9	175.3	-175.5	0	0	0	0	112.7	T51 L55 L56 T57 P153	T51-V53 PolarHBondContact O-N 3.41Å; V53-L55 VanDerWaalsContact C-N 3.29Å; V53-L55 PolarHBondContact O-N 3.35Å; V53-L56 PolarHBondContact O-N 3.42Å; V53-T57 WeakPolarHBondContact O-CB 3.41Å; V53-T57 PolarHBondContact O-N 2.95Å; V53-T57 PolarHBondContact O-OG1 3.47Å; V53-P153 HydrophobicContact CB-CG 4.12Å; V53-P153 HydrophobicContact CG1-CG 3.48Å; V53-P153 VanDerWaalsContact CG1-CG 3.48Å; V53-P153 HydrophobicContact CG2-CG 3.47Å; V53-P153 VanDerWaalsContact CG2-CG 3.47Å
54	D	58.9	Low	53.5	Low	73 Å²	73	109.4 Å²	109.4	39%	0.39	57%	0.569	S	S	.	*	H	α-helix	trans	-65.7	-36.4	177.5	-65.6	-45.2	0	0	0	110.9	T50 T51 K58	T50-D54 HydrophobicContact CG2-CB 4.05Å; T51-D54 PolarHBondContact N-OD2 3.15Å; T51-D54 VanDerWaalsContact N-OD2 3.1Å; T51-D54 WeakPolarHBondContact O-CB 3.41Å; T51-D54 PolarHBondContact O-N 3.44Å; T51-D54 PolarHBondContact OG1-OD2 3.12Å; D54-K58 WeakPolarHBondContact O-CG 3.36Å; D54-K58 PolarHBondContact O-N 3.12Å
55	L	65.8	Low	55.7	Low	92 Å²	92	106.9 Å²	106.9	48%	0.482	56%	0.559	S	S	.	*	H	α-helix	trans	-65.4	-50.1	174.5	-68.7	171.6	0	0	0	111.1	T51 E52 V53 T57 K58 E59	T51-L55 PolarHBondContact O-N 3.18Å; E52-L55 PolarHBondContact O-N 3.44Å; V53-L55 VanDerWaalsContact C-N 3.29Å; V53-L55 PolarHBondContact O-N 3.35Å; L55-T57 VanDerWaalsContact C-N 3.29Å; L55-T57 PolarHBondContact O-N 3.09Å; L55-K58 PolarHBondContact O-N 3.14Å; L55-E59 WeakPolarHBondContact O-CG 3.43Å; L55-E59 PolarHBondContact O-N 2.99Å
56	L	60.7	Low	57.6	Low	99 Å²	99	109.7 Å²	109.7	52%	0.518	55%	0.554	S	S	.	*	H	α-helix	trans	-59.6	-39	176.5	-74.6	163.5	0	0	0	112.3	E52 V53 E59 L60	E52-L56 WeakPolarHBondContact O-CG 3.46Å; E52-L56 PolarHBondContact O-N 3.1Å; V53-L56 PolarHBondContact O-N 3.42Å; L56-E59 PolarHBondContact O-N 2.83Å; L56-L60 WeakPolarHBondContact O-CB 3.11Å; L56-L60 VanDerWaalsContact O-CG 3.3Å; L56-L60 WeakPolarHBondContact O-CG 3.38Å; L56-L60 PolarHBondContact O-N 3.37Å
57	T	61.5	Low	59.8	Low	49 Å²	49	105.4 Å²	105.4	30%	0.301	53%	0.528	S	S	.	.	H	α-helix	trans	-66.1	-43.6	178.3	-53.6	0	0	0	0	110.9	V53 L55 L60 E61	V53-T57 WeakPolarHBondContact O-CB 3.41Å; V53-T57 PolarHBondContact O-N 2.95Å; V53-T57 PolarHBondContact O-OG1 3.47Å; L55-T57 VanDerWaalsContact C-N 3.29Å; L55-T57 PolarHBondContact O-N 3.09Å; T57-L60 PolarHBondContact O-N 2.7Å; T57-E61 WeakPolarHBondContact O-CG 3.38Å; T57-E61 PolarHBondContact O-N 2.93Å
58	K	68.2	Low	62.1	Low	120 Å²	120	103.1 Å²	103.1	52%	0.522	50%	0.501	S	S	.	.	H	α-helix	trans	-63.3	-43.4	173.9	-78	-179.1	179.8	178.3	0	112.5	D54 L55 L60 E61 D62	D54-K58 WeakPolarHBondContact O-CG 3.36Å; D54-K58 PolarHBondContact O-N 3.12Å; L55-K58 PolarHBondContact O-N 3.14Å; K58-L60 VanDerWaalsContact C-N 3.29Å; K58-L60 PolarHBondContact O-N 3.3Å; K58-E61 PolarHBondContact O-N 3.49Å; K58-D62 WeakPolarHBondContact O-CB 3.48Å; K58-D62 PolarHBondContact O-N 3.01Å
59	E	70.1	Confident	64.1	Low	129 Å²	129	96.2 Å²	96.2	60%	0.603	50%	0.495	S	S	*	.	H	α-helix	trans	-60.3	-40	176.7	-76.1	-175.5	171.1	0	0	112	L55 L56 F63	L55-E59 WeakPolarHBondContact O-CG 3.43Å; L55-E59 PolarHBondContact O-N 2.99Å; L56-E59 PolarHBondContact O-N 2.83Å; E59-F63 VanDerWaalsContact O-CB 3.28Å; E59-F63 WeakPolarHBondContact O-CB 3.29Å; E59-F63 PolarHBondContact O-N 3.38Å
60	L	66.2	Low	66.2	Low	94 Å²	94	89 Å²	89	49%	0.492	47%	0.465	S	S	.	.	H	α-helix	trans	-68	-40.1	175.3	-74.1	166.2	0	0	0	112.3	L56 T57 K58 F63 E64	L56-L60 WeakPolarHBondContact O-CB 3.11Å; L56-L60 VanDerWaalsContact O-CG 3.3Å; L56-L60 WeakPolarHBondContact O-CG 3.38Å; L56-L60 PolarHBondContact O-N 3.37Å; T57-L60 PolarHBondContact O-N 2.7Å; K58-L60 VanDerWaalsContact C-N 3.29Å; K58-L60 PolarHBondContact O-N 3.3Å; L60-F63 PolarHBondContact O-N 3.16Å; L60-E64 PolarHBondContact O-N 3.47Å
61	E	73.2	Confident	68.5	Low	96 Å²	96	86.1 Å²	86.1	45%	0.449	45%	0.446	S	S	.	.	H	α-helix	trans	-63.1	-45.3	173.8	-76	177.5	179.4	0	0	111.9	T57 K58 F63 E64 M65	T57-E61 WeakPolarHBondContact O-CG 3.38Å; T57-E61 PolarHBondContact O-N 2.93Å; K58-E61 PolarHBondContact O-N 3.49Å; E61-F63 VanDerWaalsContact C-N 3.3Å; E61-F63 PolarHBondContact O-N 3.06Å; E61-E64 PolarHBondContact O-N 3Å; E61-M65 WeakPolarHBondContact O-CB 3.31Å; E61-M65 VanDerWaalsContact O-CG 3.3Å; E61-M65 WeakPolarHBondContact O-CG 3.34Å; E61-M65 PolarHBondContact O-N 3.17Å
62	D	73	Confident	70.4	Confident	95 Å²	95	85.3 Å²	85.3	51%	0.508	45%	0.446	S	S	.	.	H	α-helix	trans	-61.4	-40.4	174.9	-78.1	-16.6	0	0	0	111.3	K58 M65 K66	K58-D62 WeakPolarHBondContact O-CB 3.48Å; K58-D62 PolarHBondContact O-N 3.01Å; D62-M65 PolarHBondContact O-N 3.47Å; D62-K66 WeakPolarHBondContact O-CB 3.29Å; D62-K66 VanDerWaalsContact O-CG 3.26Å; D62-K66 WeakPolarHBondContact O-CG 3.37Å; D62-K66 PolarHBondContact O-N 3.1Å
63	F	71.1	Confident	72.4	Confident	113 Å²	113	78.9 Å²	78.9	50%	0.496	42%	0.418	S	S	.	.	H	α-helix	trans	-64.9	-41.1	176.2	-175.1	-113.1	0	0	0	112.2	E59 L60 E61 K66 K67	E59-F63 VanDerWaalsContact O-CB 3.28Å; E59-F63 WeakPolarHBondContact O-CB 3.29Å; E59-F63 PolarHBondContact O-N 3.38Å; L60-F63 PolarHBondContact O-N 3.16Å; E61-F63 VanDerWaalsContact C-N 3.3Å; E61-F63 PolarHBondContact O-N 3.06Å; F63-K66 PolarHBondContact O-N 2.98Å; F63-K67 HydrophobicContact CD1-CD 4.43Å; F63-K67 HydrophobicContact CE1-CD 4.14Å; F63-K67 VanDerWaalsContact CE1-NZ 3.29Å; F63-K67 PolarHBondContact O-N 3.12Å
64	E	69.5	Low	74.3	Confident	48 Å²	48	80.7 Å²	80.7	22%	0.224	43%	0.429	C	S	.	.	H	α-helix	trans	-70.7	-36.5	175.4	-80.7	-170.7	-160.3	0	0	113.6	L60 E61 K66 K67 A68 K133 R149	L60-E64 PolarHBondContact O-N 3.47Å; E61-E64 PolarHBondContact O-N 3Å; E64-K66 VanDerWaalsContact C-N 3.33Å; E64-K67 PolarHBondContact O-N 2.81Å; E64-A68 WeakPolarHBondContact O-CB 3.39Å; E64-A68 PolarHBondContact O-N 3.1Å; E64-K133 IonicContact OE2-NZ 2.75Å; E64-R149 IonicContact OE1-CZ 3Å; E64-R149 VanDerWaalsContact OE1-CZ 3.3Å; E64-R149 IonicContact OE1-NE 3.37Å; E64-R149 PolarHBondContact OE1-NE 2.7Å; E64-R149 IonicContact OE1-NH2 2.71Å; E64-R149 PolarHBondContact OE1-NH2 2.88Å; E64-R149 IonicContact OE2-CZ 2.69Å; E64-R149 IonicContact OE2-NE 2.63Å; E64-R149 IonicContact OE2-NH2 3.59Å; E64-R149 PolarHBondContact OE2-NH2 3.41Å
65	M	73.4	Confident	76	Confident	137 Å²	137	78.4 Å²	78.4	68%	0.675	42%	0.423	S	S	*	.	H	α-helix	trans	-60.7	-44.5	172.2	-80.6	-89.6	-81.5	0	0	110.5	E61 D62 K67 A68 A69	E61-M65 WeakPolarHBondContact O-CB 3.31Å; E61-M65 VanDerWaalsContact O-CG 3.3Å; E61-M65 WeakPolarHBondContact O-CG 3.34Å; E61-M65 PolarHBondContact O-N 3.17Å; D62-M65 PolarHBondContact O-N 3.47Å; M65-K67 VanDerWaalsContact C-N 3.35Å; M65-K67 PolarHBondContact O-N 3.13Å; M65-A68 PolarHBondContact O-N 3.33Å; M65-A69 WeakPolarHBondContact O-CB 3.32Å; M65-A69 PolarHBondContact O-N 3.03Å
66	K	74.5	Confident	77.3	Confident	149 Å²	149	78 Å²	78	65%	0.648	42%	0.424	S	S	*	.	H	α-helix	trans	-59.9	-42.6	173	-74.1	170.9	-174.8	172.1	0	112	D62 F63 E64 A69 A70	D62-K66 WeakPolarHBondContact O-CB 3.29Å; D62-K66 VanDerWaalsContact O-CG 3.26Å; D62-K66 WeakPolarHBondContact O-CG 3.37Å; D62-K66 PolarHBondContact O-N 3.1Å; F63-K66 PolarHBondContact O-N 2.98Å; E64-K66 VanDerWaalsContact C-N 3.33Å; K66-A69 PolarHBondContact O-N 2.84Å; K66-A70 WeakPolarHBondContact O-CB 3.5Å; K66-A70 PolarHBondContact O-N 3.17Å; K66-A70 VanDerWaalsContact O-N 3.1Å
67	K	75.7	Confident	78.9	Confident	68 Å²	68	75.6 Å²	75.6	30%	0.296	41%	0.411	S	S	.	.	H	α-helix	trans	-63.5	-41.1	175.5	-78.3	-178.2	173.7	175.4	0	112.7	F63 E64 M65 A70 R71 F95	F63-K67 HydrophobicContact CD1-CD 4.43Å; F63-K67 HydrophobicContact CE1-CD 4.14Å; F63-K67 VanDerWaalsContact CE1-NZ 3.29Å; F63-K67 PolarHBondContact O-N 3.12Å; E64-K67 PolarHBondContact O-N 2.81Å; M65-K67 VanDerWaalsContact C-N 3.35Å; M65-K67 PolarHBondContact O-N 3.13Å; K67-A70 PolarHBondContact O-N 3.2Å; K67-R71 PolarHBondContact O-N 3.26Å; K67-F95 HydrophobicContact CB-CE2 4.31Å; K67-F95 HydrophobicContact CG-CE2 4.37Å; K67-F95 HydrophobicContact CG-CZ 4.28Å
68	A	76.8	Confident	80.5	Confident	28 Å²	28	76 Å²	76	23%	0.231	42%	0.419	C	S	.	.	H	α-helix	trans	-66.2	-44.7	177.9	0	0	0	0	0	111.2	E64 M65 A70 R71	E64-A68 WeakPolarHBondContact O-CB 3.39Å; E64-A68 PolarHBondContact O-N 3.1Å; M65-A68 PolarHBondContact O-N 3.33Å; A68-A70 PolarHBondContact O-N 3.19Å; A68-R71 PolarHBondContact O-N 2.87Å
69	A	78.2	Confident	81.6	Confident	92 Å²	92	70.9 Å²	70.9	76%	0.76	40%	0.399	S	S	*	.	H	α-helix	trans	-62	-30.5	176.8	0	0	0	0	0	113.1	M65 K66 R71	M65-A69 WeakPolarHBondContact O-CB 3.32Å; M65-A69 PolarHBondContact O-N 3.03Å; K66-A69 PolarHBondContact O-N 2.84Å; A69-R71 VanDerWaalsContact C-N 3.31Å
70	A	81.2	Confident	82.4	Confident	24 Å²	24	70.7 Å²	70.7	20%	0.198	40%	0.398	C	S	.	.	T	Hydrogen-bonded Turn	trans	-82.6	-5.5	177.3	0	0	0	0	0	114.1	K66 K67 A68 F95 H96	K66-A70 WeakPolarHBondContact O-CB 3.5Å; K66-A70 PolarHBondContact O-N 3.17Å; K66-A70 VanDerWaalsContact O-N 3.1Å; K67-A70 PolarHBondContact O-N 3.2Å; A68-A70 PolarHBondContact O-N 3.19Å; A70-F95 HydrophobicContact CB-CD2 4.29Å; A70-F95 HydrophobicContact CB-CE2 4.03Å; A70-F95 CarbonylContact O-C 3.57Å; A70-F95 WeakPolarHBondContact O-CA 3.39Å; A70-H96 WeakPolarHBondContact CB-CE1 3.3Å; A70-H96 WeakPolarHBondContact CB-NE2 3.45Å; A70-H96 PolarHBondContact O-N 3.43Å
71	R	87.4	Confident	83.2	Confident	21 Å²	21	69.8 Å²	69.8	8%	0.079	40%	0.398	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.5	136.7	-176.4	-168.9	-168.9	-67.7	156.8	4.4	110.5	K67 A68 A69 V73 L93 T94 F95 M126 E135	K67-R71 PolarHBondContact O-N 3.26Å; A68-R71 PolarHBondContact O-N 2.87Å; A69-R71 VanDerWaalsContact C-N 3.31Å; R71-V73 HydrophobicContact CG-CG2 4.05Å; R71-L93 HydrophobicContact CG-CD1 3.61Å; R71-T94 VanDerWaalsContact CA-O 3.32Å; R71-T94 WeakPolarHBondContact CA-O 3.39Å; R71-T94 WeakPolarHBondContact CG-O 3.35Å; R71-F95 HydrophobicContact CB-CD2 4.24Å; R71-M126 PolarHBondContact NH2-SD 2.92Å; R71-M126 VanDerWaalsContact NH2-SD 3.44Å; R71-E135 WeakPolarHBondContact CD-OE2 3.28Å; R71-E135 IonicContact CZ-OE2 3.85Å; R71-E135 IonicContact NE-OE2 3.44Å; R71-E135 IonicContact NH1-OE1 3.57Å; R71-E135 PolarHBondContact NH1-OE1 2.76Å; R71-E135 IonicContact NH1-OE2 3.58Å; R71-E135 PolarHBondContact NH1-OE2 2.78Å
72	A	89.8	Confident	83.6	Confident	55 Å²	55	69.8 Å²	69.8	46%	0.455	40%	0.401	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	134.2	167.5	0	0	0	0	0	110.4	T94	A72-T94 WeakPolarHBondContact CB-OG1 3.41Å; A72-T94 PolarHBondContact N-O 2.78Å; A72-T94 PolarHBondContact O-N 2.86Å; A72-T94 PolarHBondContact O-OG1 2.94Å
73	V	92.6	Very high	84.3	Confident	29 Å²	29	66.7 Å²	66.7	18%	0.176	39%	0.386	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	133.5	-174.3	-169	0	0	0	0	108.6	R71 L91 S92 L93 A130 E135 V136	R71-V73 HydrophobicContact CG-CG2 4.05Å; V73-L91 HydrophobicContact CG1-CD1 4Å; V73-S92 WeakPolarHBondContact CA-O 3.46Å; V73-L93 HydrophobicContact CG2-CD1 3.63Å; V73-A130 HydrophobicContact CG2-CB 4.01Å; V73-E135 HydrophobicContact CB-CB 4.22Å; V73-E135 HydrophobicContact CG2-CB 3.87Å; V73-V136 HydrophobicContact CG1-CG2 3.8Å
74	T	93.3	Very high	85.1	Confident	84 Å²	84	63.2 Å²	63.2	52%	0.515	38%	0.375	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	144.8	170.4	64.3	0	0	0	0	108.8	L91 S92	T74-L91 CarbonylContact O-C 3.59Å; T74-L91 WeakPolarHBondContact O-CA 3.34Å; T74-L91 WeakPolarHBondContact O-CD1 3.23Å; T74-S92 PolarHBondContact N-O 2.9Å; T74-S92 PolarHBondContact O-N 3.07Å; T74-S92 WeakPolarHBondContact OG1-CB 3.48Å
75	G	93.3	Very high	86.3	Confident	24 Å²	24	63 Å²	63	25%	0.247	38%	0.375	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-179.3	157.2	174.7	0	0	0	0	0	110.4
76	V	94.4	Very high	87.3	Confident	83 Å²	83	56.5 Å²	56.5	50%	0.503	34%	0.343	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	126.9	178.7	-177.9	0	0	0	0	108.9	A78 I88 I89	V76-A78 PolarHBondContact O-N 3.36Å; V76-I88 CarbonylContact O-C 3.53Å; V76-I88 VanDerWaalsContact O-CA 3.31Å; V76-I88 WeakPolarHBondContact O-CA 3.49Å; V76-I89 HydrophobicContact CB-CG1 4.08Å; V76-I89 PolarHBondContact N-O 3.17Å; V76-I89 PolarHBondContact O-N 2.83Å
77	L	94.3	Very high	88.4	Confident	49 Å²	49	52.1 Å²	52.1	26%	0.257	33%	0.325	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.3	118.3	173.1	-176.9	68.4	0	0	0	109.1	S79 I88 P137 P139	L77-S79 WeakPolarHBondContact CD1-OG 3.44Å; L77-I88 HydrophobicContact CD1-CG1 4.38Å; L77-P137 HydrophobicContact CB-CB 4.22Å; L77-P137 HydrophobicContact CB-CG 4.21Å; L77-P139 HydrophobicContact CD1-CG 4.44Å; L77-P139 HydrophobicContact CD2-CG 4.03Å
78	A	94.3	Very high	89.4	Confident	57 Å²	57	49 Å²	49	47%	0.471	31%	0.311	S	S	.	.			trans	-100.7	-26.5	178.3	0	0	0	0	0	112.6	V76 H87 I89	V76-A78 PolarHBondContact O-N 3.36Å; A78-H87 HydrophobicContact CB-CB 4.43Å; A78-H87 PolarHBondContact N-O 2.94Å; A78-I89 HydrophobicContact CB-CD1 4.27Å; A78-I89 HydrophobicContact CB-CG1 4.16Å; A78-I89 HydrophobicContact CB-CG2 3.83Å
79	S	91.1	Very high	90.3	Very high	14 Å²	14	50.3 Å²	50.3	10%	0.098	31%	0.314	C	S	.	.	S	Bend	trans	-72.5	157.2	172.5	57.4	0	0	0	0	111.2	L77 D85 H87	L77-S79 WeakPolarHBondContact CD1-OG 3.44Å; S79-D85 VanDerWaalsContact CB-O 3.26Å; S79-D85 WeakPolarHBondContact CB-O 3.18Å; S79-D85 PolarHBondContact OG-O 3.24Å; S79-H87 PolarHBondContact N-O 2.95Å; S79-H87 PolarHBondContact OG-N 3.1Å; S79-H87 VanDerWaalsContact OG-N 3.09Å
80	H	87.1	Confident	91.1	Very high	124 Å²	124	50 Å²	50	57%	0.574	30%	0.299	S	S	*	.			trans	-59.6	140.8	177.3	-170.9	-92.1	0	0	0	110.1	N82 S83	H80-N82 WeakPolarHBondContact ND1-CB 3.35Å; H80-N82 PolarHBondContact ND1-N 2.98Å; H80-N82 PolarHBondContact O-N 2.97Å; H80-N82 VanDerWaalsContact O-N 3.11Å; H80-S83 WeakPolarHBondContact O-CB 3.48Å; H80-S83 PolarHBondContact O-N 3.34Å
81	P	84	Confident	91.8	Very high	76 Å²	76	48.9 Å²	48.9	49%	0.494	29%	0.29	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57	-29.8	-179.7	-27.7	35.5	0	0	0	113.9	P139 H141	P81-P139 WeakPolarHBondContact O-CB 3.28Å; P81-H141 PolarHBondContact O-CE1 2.99Å; P81-H141 PolarHBondContact O-ND1 3.31Å
82	N	81.8	Confident	92.2	Very high	96 Å²	96	49.1 Å²	49.1	51%	0.513	30%	0.295	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93	10.3	174.6	-61.8	-9.6	0	0	0	112.9	H80 K188	H80-N82 WeakPolarHBondContact ND1-CB 3.35Å; H80-N82 PolarHBondContact ND1-N 2.98Å; H80-N82 PolarHBondContact O-N 2.97Å; H80-N82 VanDerWaalsContact O-N 3.11Å; N82-K188 VanDerWaalsContact O-CE 3.22Å; N82-K188 WeakPolarHBondContact O-CE 3.49Å; N82-K188 PolarHBondContact O-NZ 2.94Å
83	S	87.5	Confident	92.4	Very high	29 Å²	29	46.6 Å²	46.6	20%	0.203	27%	0.274	C	S	.	.			trans	-73.5	148.9	175.4	-168.5	0	0	0	0	110.6	H80 D85 H141	H80-S83 WeakPolarHBondContact O-CB 3.48Å; H80-S83 PolarHBondContact O-N 3.34Å; S83-D85 VanDerWaalsContact C-N 3.25Å; S83-D85 PolarHBondContact OG-N 3.11Å; S83-H141 PolarHBondContact O-CE1 3.1Å; S83-H141 VanDerWaalsContact O-CE1 3.23Å; S83-H141 PolarHBondContact O-NE2 2.96Å
84	T	88	Confident	92.4	Very high	41 Å²	41	47.3 Å²	47.3	25%	0.252	28%	0.278	S	S	.	.	S	Bend	trans	-76.3	-19	163.9	48.4	0	0	0	0	112.1	F248	T84-F248 HydrophobicContact CG2-CE2 4.09Å; T84-F248 HydrophobicContact CG2-CZ 3.63Å; T84-F248 WeakPolarHBondContact O-CE1 3.25Å
85	D	93.7	Very high	92.1	Very high	44 Å²	44	45.5 Å²	45.5	24%	0.235	26%	0.263	C	S	.	.	S	Bend	trans	-88.7	140.6	177.2	-61	-19.3	0	0	0	110.9	S79 S83 N109 S110	S79-D85 VanDerWaalsContact CB-O 3.26Å; S79-D85 WeakPolarHBondContact CB-O 3.18Å; S79-D85 PolarHBondContact OG-O 3.24Å; S83-D85 VanDerWaalsContact C-N 3.25Å; S83-D85 PolarHBondContact OG-N 3.11Å; D85-N109 VanDerWaalsContact OD1-CA 3.3Å; D85-N109 WeakPolarHBondContact OD1-CA 3.15Å; D85-S110 PolarHBondContact OD1-N 3.4Å
86	V	94.9	Very high	91.5	Very high	0 Å²	0	51 Å²	51	0%	0	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	99.2	-179.3	-179.1	0	0	0	0	108.9	I88 L108 I138 I142 M249 I277	V86-I88 HydrophobicContact CG1-CD1 3.49Å; V86-I88 VanDerWaalsContact CG1-CD1 3.49Å; V86-I88 HydrophobicContact CG1-CG1 4.42Å; V86-L108 HydrophobicContact CB-CB 4.32Å; V86-L108 PolarHBondContact N-O 3.42Å; V86-L108 PolarHBondContact O-N 3.13Å; V86-I138 HydrophobicContact CG1-CG1 4.35Å; V86-I138 HydrophobicContact CG2-CG2 4.47Å; V86-I142 HydrophobicContact CG2-CD1 3.2Å; V86-M249 HydrophobicContact CB-CE 4.37Å; V86-M249 HydrophobicContact CG2-CE 3.88Å; V86-I277 HydrophobicContact CG2-CD1 4.26Å
87	H	96.8	Very high	90.9	Very high	57 Å²	57	50.6 Å²	50.6	26%	0.264	30%	0.295	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	116	176.1	-60	171.6	0	0	0	109.2	A78 S79 L106 N109	A78-H87 HydrophobicContact CB-CB 4.43Å; A78-H87 PolarHBondContact N-O 2.94Å; S79-H87 PolarHBondContact N-O 2.95Å; S79-H87 PolarHBondContact OG-N 3.1Å; S79-H87 VanDerWaalsContact OG-N 3.09Å; H87-L106 CarbonylContact C-O 3.3Å; H87-L106 WeakPolarHBondContact CA-O 3.43Å; H87-N109 PolarHBondContact NE2-OD1 2.79Å
88	I	96.2	Very high	90.5	Very high	1 Å²	1	54.5 Å²	54.5	1%	0.005	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	128.8	175.7	-62.6	122.6	0	0	0	108.8	V76 L77 V86 L91 K105 L106 V136 P137	V76-I88 CarbonylContact O-C 3.53Å; V76-I88 VanDerWaalsContact O-CA 3.31Å; V76-I88 WeakPolarHBondContact O-CA 3.49Å; L77-I88 HydrophobicContact CD1-CG1 4.38Å; V86-I88 HydrophobicContact CG1-CD1 3.49Å; V86-I88 VanDerWaalsContact CG1-CD1 3.49Å; V86-I88 HydrophobicContact CG1-CG1 4.42Å; I88-L91 HydrophobicContact CG2-CB 4.33Å; I88-K105 CarbonylContact O-C 3.58Å; I88-K105 VanDerWaalsContact O-CA 3.26Å; I88-K105 WeakPolarHBondContact O-CA 3.47Å; I88-L106 HydrophobicContact CB-CB 4.26Å; I88-L106 HydrophobicContact CD1-CB 4.27Å; I88-L106 HydrophobicContact CD1-CD2 3.88Å; I88-L106 HydrophobicContact CD1-CG 4.38Å; I88-L106 PolarHBondContact N-O 2.78Å; I88-L106 PolarHBondContact O-N 2.9Å; I88-V136 HydrophobicContact CB-CG1 4.29Å; I88-V136 HydrophobicContact CD1-CG1 3.38Å; I88-V136 HydrophobicContact CG1-CG1 3.83Å; I88-V136 HydrophobicContact CG2-CG1 3.96Å; I88-P137 HydrophobicContact CG1-CG 4.34Å
89	I	96	Very high	90.3	Very high	57 Å²	57	55 Å²	55	29%	0.292	30%	0.304	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	161.9	174.4	62.8	174.9	0	0	0	110.4	V76 A78 L91 K105	V76-I89 HydrophobicContact CB-CG1 4.08Å; V76-I89 PolarHBondContact N-O 3.17Å; V76-I89 PolarHBondContact O-N 2.83Å; A78-I89 HydrophobicContact CB-CD1 4.27Å; A78-I89 HydrophobicContact CB-CG1 4.16Å; A78-I89 HydrophobicContact CB-CG2 3.83Å; I89-L91 PolarHBondContact O-N 2.92Å; I89-K105 HydrophobicContact CG2-CD 4.32Å; I89-K105 HydrophobicContact CG2-CG 4.23Å
90	N	95.5	Very high	90.3	Very high	85 Å²	85	54.8 Å²	54.8	46%	0.455	30%	0.302	S	S	.	.	E	Extended strand (participates in β ladder)	trans	54.2	36.2	179.9	-51.5	-3.4	0	0	0	112.7	S92 D103 T104	N90-S92 PolarHBondContact O-N 3.32Å; N90-D103 VanDerWaalsContact CA-OD1 3.26Å; N90-D103 WeakPolarHBondContact CA-OD1 3.44Å; N90-D103 WeakPolarHBondContact CB-OD1 3.18Å; N90-D103 PolarHBondContact OD1-OD1 2.8Å; N90-T104 PolarHBondContact N-O 3.38Å
91	L	96.1	Very high	90.7	Very high	1 Å²	1	48.9 Å²	48.9	1%	0.005	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70	119.5	177.6	179.8	65	0	0	0	109.3	V73 T74 I88 I89 L101 D103 T104 L106 L127 V136 L303	V73-L91 HydrophobicContact CG1-CD1 4Å; T74-L91 CarbonylContact O-C 3.59Å; T74-L91 WeakPolarHBondContact O-CA 3.34Å; T74-L91 WeakPolarHBondContact O-CD1 3.23Å; I88-L91 HydrophobicContact CG2-CB 4.33Å; I89-L91 PolarHBondContact O-N 2.92Å; L91-L101 HydrophobicContact CD2-CD1 4.14Å; L91-D103 PolarHBondContact O-N 3.24Å; L91-D103 VanDerWaalsContact O-N 3.14Å; L91-T104 HydrophobicContact CB-CG2 4.04Å; L91-T104 WeakPolarHBondContact CB-O 3.36Å; L91-T104 HydrophobicContact CD2-CG2 4.28Å; L91-T104 HydrophobicContact CG-CG2 4.35Å; L91-T104 PolarHBondContact N-O 3.09Å; L91-T104 PolarHBondContact O-N 2.86Å; L91-L106 HydrophobicContact CD2-CB 3.8Å; L91-L106 HydrophobicContact CD2-CD2 4.5Å; L91-L127 HydrophobicContact CD2-CD1 4.09Å; L91-V136 HydrophobicContact CD1-CG1 4.13Å; L91-V136 HydrophobicContact CD1-CG2 4.24Å; L91-L303 HydrophobicContact CD2-CD1 4.34Å
92	S	95.7	Very high	91.2	Very high	26 Å²	26	46.8 Å²	46.8	18%	0.182	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	139.5	169	-56.7	0	0	0	0	109.2	V73 T74 N90 L101 D103	V73-S92 WeakPolarHBondContact CA-O 3.46Å; T74-S92 PolarHBondContact N-O 2.9Å; T74-S92 PolarHBondContact O-N 3.07Å; T74-S92 WeakPolarHBondContact OG1-CB 3.48Å; N90-S92 PolarHBondContact O-N 3.32Å; S92-L101 CarbonylContact C-O 3.6Å; S92-L101 VanDerWaalsContact CA-O 3.32Å; S92-L101 WeakPolarHBondContact CA-O 3.45Å; S92-D103 PolarHBondContact OG-N 3.47Å
93	L	94.4	Very high	91.8	Very high	1 Å²	1	46.5 Å²	46.5	1%	0.005	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.1	123.7	-178.3	176.7	65	0	0	0	108.5	R71 V73 L100 L101 M126 L127 A130	R71-L93 HydrophobicContact CG-CD1 3.61Å; V73-L93 HydrophobicContact CG2-CD1 3.63Å; L93-L100 HydrophobicContact CD2-CB 4.35Å; L93-L100 HydrophobicContact CD2-CD1 4.21Å; L93-L100 HydrophobicContact CG-CB 4.32Å; L93-L100 HydrophobicContact CG-CD1 4.31Å; L93-L100 PolarHBondContact O-N 3.23Å; L93-L101 HydrophobicContact CB-CB 3.94Å; L93-L101 HydrophobicContact CB-CD1 4.3Å; L93-L101 HydrophobicContact CB-CG 4.32Å; L93-L101 HydrophobicContact CD2-CD1 4.48Å; L93-L101 PolarHBondContact N-O 2.87Å; L93-L101 PolarHBondContact O-N 2.83Å; L93-L101 VanDerWaalsContact O-N 3.08Å; L93-M126 HydrophobicContact CD2-CB 4.18Å; L93-L127 HydrophobicContact CD2-CB 4.26Å; L93-A130 HydrophobicContact CD1-CB 4.39Å
94	T	91.6	Very high	92.2	Very high	45 Å²	45	45.6 Å²	45.6	28%	0.276	25%	0.254	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	147	176.1	62.6	0	0	0	0	110.3	R71 A72 Q98 E99	R71-T94 VanDerWaalsContact CA-O 3.32Å; R71-T94 WeakPolarHBondContact CA-O 3.39Å; R71-T94 WeakPolarHBondContact CG-O 3.35Å; A72-T94 WeakPolarHBondContact CB-OG1 3.41Å; A72-T94 PolarHBondContact N-O 2.78Å; A72-T94 PolarHBondContact O-N 2.86Å; A72-T94 PolarHBondContact O-OG1 2.94Å; T94-Q98 CarbonylContact C-O 3.53Å; T94-Q98 VanDerWaalsContact CA-O 3.24Å; T94-Q98 WeakPolarHBondContact CA-O 3.4Å; T94-E99 HydrophobicContact CG2-CB 4.34Å; T94-E99 HydrophobicContact CG2-CG 4.43Å
95	F	86.8	Confident	92.6	Very high	45 Å²	45	48.9 Å²	48.9	20%	0.197	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.8	123.3	177.4	-175.2	-109.7	0	0	0	109.7	K67 A70 R71 G97 Q98 L100 M126	K67-F95 HydrophobicContact CB-CE2 4.31Å; K67-F95 HydrophobicContact CG-CE2 4.37Å; K67-F95 HydrophobicContact CG-CZ 4.28Å; A70-F95 HydrophobicContact CB-CD2 4.29Å; A70-F95 HydrophobicContact CB-CE2 4.03Å; A70-F95 CarbonylContact O-C 3.57Å; A70-F95 WeakPolarHBondContact O-CA 3.39Å; R71-F95 HydrophobicContact CB-CD2 4.24Å; F95-G97 PolarHBondContact O-N 3.05Å; F95-Q98 PolarHBondContact N-O 2.88Å; F95-Q98 WeakPolarHBondContact O-CB 3.12Å; F95-Q98 PolarHBondContact O-N 2.92Å; F95-L100 HydrophobicContact CB-CD1 3.73Å; F95-L100 HydrophobicContact CB-CG 4.29Å; F95-M126 HydrophobicContact CD2-SD 4.14Å; F95-M126 HydrophobicContact CE2-SD 4.02Å; F95-M126 HydrophobicContact CZ-SD 4.33Å
96	H	82.1	Confident	92.7	Very high	140 Å²	140	46.9 Å²	46.9	65%	0.648	25%	0.254	S	S	*	.	T	Hydrogen-bonded Turn	trans	49.3	38.1	-173	-66.6	86.5	0	0	0	113.2	A70 Q98	A70-H96 WeakPolarHBondContact CB-CE1 3.3Å; A70-H96 WeakPolarHBondContact CB-NE2 3.45Å; A70-H96 PolarHBondContact O-N 3.43Å; H96-Q98 PolarHBondContact O-N 3.3Å
97	G	81.1	Confident	92.8	Very high	75 Å²	75	50.4 Å²	50.4	77%	0.773	27%	0.27	S	S	*	.	T	Hydrogen-bonded Turn	trans	76.4	-6.9	-177.1	0	0	0	0	0	115.3	F95	F95-G97 PolarHBondContact O-N 3.05Å
98	Q	85	Confident	92.8	Very high	131 Å²	131	47.7 Å²	47.7	61%	0.612	26%	0.258	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-83.2	126.5	172.2	-173.9	178.5	0.8	0	0	110.2	T94 F95 H96 L100	T94-Q98 CarbonylContact C-O 3.53Å; T94-Q98 VanDerWaalsContact CA-O 3.24Å; T94-Q98 WeakPolarHBondContact CA-O 3.4Å; F95-Q98 PolarHBondContact N-O 2.88Å; F95-Q98 WeakPolarHBondContact O-CB 3.12Å; F95-Q98 PolarHBondContact O-N 2.92Å; H96-Q98 PolarHBondContact O-N 3.3Å; Q98-L100 HydrophobicContact CG-CD2 4.37Å; Q98-L100 PolarHBondContact O-N 3.37Å
99	E	90.3	Very high	92.8	Very high	66 Å²	66	50.1 Å²	50.1	31%	0.308	27%	0.271	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.7	115.8	175.4	-171.1	-175.1	-146.4	0	0	110.9	T94 S102 K301	T94-E99 HydrophobicContact CG2-CB 4.34Å; T94-E99 HydrophobicContact CG2-CG 4.43Å; E99-S102 VanDerWaalsContact CD-CB 3.49Å; E99-S102 WeakPolarHBondContact OE1-CB 3.29Å; E99-S102 PolarHBondContact OE1-OG 3.37Å; E99-K301 HydrophobicContact CG-CD 4.23Å; E99-K301 WeakPolarHBondContact O-CE 3.24Å; E99-K301 IonicContact OE2-NZ 2.83Å; E99-K301 PolarHBondContact OE2-NZ 3.25Å
100	L	92.2	Very high	92.6	Very high	11 Å²	11	49.1 Å²	49.1	6%	0.058	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.4	-40.6	179.3	-55.9	-178.8	0	0	0	111.4	L93 F95 Q98 M126 M298 K301	L93-L100 HydrophobicContact CD2-CB 4.35Å; L93-L100 HydrophobicContact CD2-CD1 4.21Å; L93-L100 HydrophobicContact CG-CB 4.32Å; L93-L100 HydrophobicContact CG-CD1 4.31Å; L93-L100 PolarHBondContact O-N 3.23Å; F95-L100 HydrophobicContact CB-CD1 3.73Å; F95-L100 HydrophobicContact CB-CG 4.29Å; Q98-L100 HydrophobicContact CG-CD2 4.37Å; Q98-L100 PolarHBondContact O-N 3.37Å; L100-M126 HydrophobicContact CD1-CB 4Å; L100-M126 HydrophobicContact CD1-CG 4.11Å; L100-M298 HydrophobicContact CB-CE 4.29Å; L100-M298 WeakPolarHBondContact O-CE 3.27Å; L100-K301 WeakPolarHBondContact O-CA 3.37Å
101	L	95.3	Very high	92.5	Very high	0 Å²	0	46.6 Å²	46.6	0%	0	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130	142.2	171	-66.2	173.4	0	0	0	109.7	L91 S92 L93 T104 L127 M298 K301 L303	L91-L101 HydrophobicContact CD2-CD1 4.14Å; S92-L101 CarbonylContact C-O 3.6Å; S92-L101 VanDerWaalsContact CA-O 3.32Å; S92-L101 WeakPolarHBondContact CA-O 3.45Å; L93-L101 HydrophobicContact CB-CB 3.94Å; L93-L101 HydrophobicContact CB-CD1 4.3Å; L93-L101 HydrophobicContact CB-CG 4.32Å; L93-L101 HydrophobicContact CD2-CD1 4.48Å; L93-L101 PolarHBondContact N-O 2.87Å; L93-L101 PolarHBondContact O-N 2.83Å; L93-L101 VanDerWaalsContact O-N 3.08Å; L101-T104 HydrophobicContact CB-CG2 4.14Å; L101-T104 HydrophobicContact CD1-CG2 4.19Å; L101-T104 HydrophobicContact CD2-CG2 4.19Å; L101-T104 HydrophobicContact CG-CG2 4.41Å; L101-L127 HydrophobicContact CD1-CD1 3.94Å; L101-L127 HydrophobicContact CD1-CD2 4.25Å; L101-M298 HydrophobicContact CD1-CE 4.44Å; L101-M298 HydrophobicContact CD2-CE 3.6Å; L101-M298 HydrophobicContact CD2-CG 4.13Å; L101-M298 HydrophobicContact CD2-SD 4.33Å; L101-M298 HydrophobicContact CG-CE 3.75Å; L101-K301 WeakPolarHBondContact CA-O 3.12Å; L101-L303 HydrophobicContact CD1-CD1 4.14Å; L101-L303 HydrophobicContact CD1-CD2 4.32Å; L101-L303 HydrophobicContact CD1-CG 4.21Å; L101-L303 HydrophobicContact CD2-CD2 3.95Å; L101-L303 HydrophobicContact CD2-CG 3.99Å
102	S	94.6	Very high	92.5	Very high	31 Å²	31	51.7 Å²	51.7	22%	0.217	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	119.7	-179	-167.5	0	0	0	0	109.5	E99 T104 K301 K302	E99-S102 VanDerWaalsContact CD-CB 3.49Å; E99-S102 WeakPolarHBondContact OE1-CB 3.29Å; E99-S102 PolarHBondContact OE1-OG 3.37Å; S102-T104 VanDerWaalsContact C-N 3.3Å; S102-T104 PolarHBondContact O-N 3.04Å; S102-T104 VanDerWaalsContact O-N 3.1Å; S102-K301 PolarHBondContact N-O 2.95Å; S102-K302 WeakPolarHBondContact O-CD 3.3Å; S102-K302 WeakPolarHBondContact O-CE 3.43Å; S102-K302 PolarHBondContact O-NZ 3.44Å
103	D	93.9	Very high	92.6	Very high	91 Å²	91	52.5 Å²	52.5	49%	0.487	28%	0.281	S	S	.	.	E	Extended strand (participates in β ladder)	trans	39.4	56.3	170.5	-169	39	0	0	0	113.4	N90 L91 S92 K302	N90-D103 VanDerWaalsContact CA-OD1 3.26Å; N90-D103 WeakPolarHBondContact CA-OD1 3.44Å; N90-D103 WeakPolarHBondContact CB-OD1 3.18Å; N90-D103 PolarHBondContact OD1-OD1 2.8Å; L91-D103 PolarHBondContact O-N 3.24Å; L91-D103 VanDerWaalsContact O-N 3.14Å; S92-D103 PolarHBondContact OG-N 3.47Å; D103-K302 PolarHBondContact O-NZ 3.32Å
104	T	95.8	Very high	92.8	Very high	9 Å²	9	52.8 Å²	52.8	6%	0.055	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	178.5	-176.3	-159.7	0	0	0	0	111.2	N90 L91 L101 S102 L303	N90-T104 PolarHBondContact N-O 3.38Å; L91-T104 HydrophobicContact CB-CG2 4.04Å; L91-T104 WeakPolarHBondContact CB-O 3.36Å; L91-T104 HydrophobicContact CD2-CG2 4.28Å; L91-T104 HydrophobicContact CG-CG2 4.35Å; L91-T104 PolarHBondContact N-O 3.09Å; L91-T104 PolarHBondContact O-N 2.86Å; L101-T104 HydrophobicContact CB-CG2 4.14Å; L101-T104 HydrophobicContact CD1-CG2 4.19Å; L101-T104 HydrophobicContact CD2-CG2 4.19Å; L101-T104 HydrophobicContact CG-CG2 4.41Å; S102-T104 VanDerWaalsContact C-N 3.3Å; S102-T104 PolarHBondContact O-N 3.04Å; S102-T104 VanDerWaalsContact O-N 3.1Å; T104-L303 HydrophobicContact CG2-CB 4.42Å; T104-L303 HydrophobicContact CG2-CD1 4.04Å; T104-L303 HydrophobicContact CG2-CG 3.95Å; T104-L303 PolarHBondContact OG1-N 3.05Å
105	K	95.9	Very high	93.1	Very high	110 Å²	110	50.6 Å²	50.6	48%	0.478	27%	0.269	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	133.1	178.7	-59.8	-176.4	-179.7	-179.3	0	110.2	I88 I89 E107 Y305	I88-K105 CarbonylContact O-C 3.58Å; I88-K105 VanDerWaalsContact O-CA 3.26Å; I88-K105 WeakPolarHBondContact O-CA 3.47Å; I89-K105 HydrophobicContact CG2-CD 4.32Å; I89-K105 HydrophobicContact CG2-CG 4.23Å; K105-E107 HydrophobicContact CB-CG 4.38Å; K105-Y305 WeakPolarHBondContact O-CE2 3.5Å; K105-Y305 PolarHBondContact O-OH 3.01Å
106	L	97	Very high	93.5	Very high	3 Å²	3	48.6 Å²	48.6	2%	0.016	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102	111.3	167.5	-177.6	64.5	0	0	0	108.9	H87 I88 L91 L108 I131 L303 Y305	H87-L106 CarbonylContact C-O 3.3Å; H87-L106 WeakPolarHBondContact CA-O 3.43Å; I88-L106 HydrophobicContact CB-CB 4.26Å; I88-L106 HydrophobicContact CD1-CB 4.27Å; I88-L106 HydrophobicContact CD1-CD2 3.88Å; I88-L106 HydrophobicContact CD1-CG 4.38Å; I88-L106 PolarHBondContact N-O 2.78Å; I88-L106 PolarHBondContact O-N 2.9Å; L91-L106 HydrophobicContact CD2-CB 3.8Å; L91-L106 HydrophobicContact CD2-CD2 4.5Å; L106-L108 HydrophobicContact CD1-CD1 4.23Å; L106-L108 HydrophobicContact CD1-CD2 4.16Å; L106-L108 HydrophobicContact CD1-CG 4.03Å; L106-L108 HydrophobicContact CD2-CD1 4.28Å; L106-L108 HydrophobicContact CG-CD1 4.24Å; L106-L108 HydrophobicContact CG-CG 4.13Å; L106-I131 HydrophobicContact CD1-CD1 4.43Å; L106-I131 HydrophobicContact CD2-CD1 3.67Å; L106-I131 HydrophobicContact CD2-CG1 3.92Å; L106-L303 HydrophobicContact CD1-CD1 4.09Å; L106-Y305 WeakPolarHBondContact CA-OH 3.5Å
107	E	96.3	Very high	94	Very high	73 Å²	73	42.3 Å²	42.3	34%	0.341	23%	0.232	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	100.4	-176.7	-67.9	178.7	-175.7	0	0	109.7	K105 Y114 Y305	K105-E107 HydrophobicContact CB-CG 4.38Å; E107-Y114 PolarHBondContact O-OH 3.47Å; E107-Y305 HydrophobicContact CB-CE1 4.11Å; E107-Y305 HydrophobicContact CB-CE2 4.44Å; E107-Y305 PolarHBondContact N-OH 2.8Å; E107-Y305 WeakPolarHBondContact O-CE1 3.37Å
108	L	97	Very high	94.4	Very high	1 Å²	1	39.3 Å²	39.3	1%	0.005	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119	114.6	178.6	-55.7	176.6	0	0	0	109.5	V86 L106 Y114 M249 I277 V279 I296	V86-L108 HydrophobicContact CB-CB 4.32Å; V86-L108 PolarHBondContact N-O 3.42Å; V86-L108 PolarHBondContact O-N 3.13Å; L106-L108 HydrophobicContact CD1-CD1 4.23Å; L106-L108 HydrophobicContact CD1-CD2 4.16Å; L106-L108 HydrophobicContact CD1-CG 4.03Å; L106-L108 HydrophobicContact CD2-CD1 4.28Å; L106-L108 HydrophobicContact CG-CD1 4.24Å; L106-L108 HydrophobicContact CG-CG 4.13Å; L108-Y114 HydrophobicContact CB-CE2 4.23Å; L108-Y114 HydrophobicContact CD2-CD1 4.42Å; L108-Y114 HydrophobicContact CD2-CD2 3.72Å; L108-Y114 HydrophobicContact CD2-CE2 3.84Å; L108-Y114 HydrophobicContact CD2-CG 4.03Å; L108-M249 HydrophobicContact CD1-CE 3.93Å; L108-M249 HydrophobicContact CD1-SD 4.41Å; L108-I277 HydrophobicContact CB-CD1 4.22Å; L108-I277 HydrophobicContact CB-CG2 4.02Å; L108-I277 HydrophobicContact CD1-CG2 4.33Å; L108-V279 HydrophobicContact CD1-CG2 3.98Å; L108-V279 HydrophobicContact CD2-CG2 3.86Å; L108-I296 HydrophobicContact CD2-CD1 3.85Å
109	N	95.5	Very high	94.2	Very high	51 Å²	51	36.1 Å²	36.1	27%	0.273	19%	0.187	S	C	.	.			trans	-103.5	145	-178.2	-60.3	2.2	0	0	0	110.2	D85 H87 R112 Y114	D85-N109 VanDerWaalsContact OD1-CA 3.3Å; D85-N109 WeakPolarHBondContact OD1-CA 3.15Å; H87-N109 PolarHBondContact NE2-OD1 2.79Å; N109-R112 HydrophobicContact CB-CG 3.92Å; N109-R112 WeakPolarHBondContact O-CB 3.37Å; N109-R112 PolarHBondContact O-N 3.28Å; N109-Y114 PolarHBondContact N-OH 2.96Å
110	S	93.1	Very high	93.6	Very high	37 Å²	37	35.7 Å²	35.7	26%	0.259	19%	0.187	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.3	145.2	173.7	-166.8	0	0	0	0	111.3	D85 R112	D85-S110 PolarHBondContact OD1-N 3.4Å; S110-R112 VanDerWaalsContact C-N 3.25Å; S110-R112 PolarHBondContact O-N 3.48Å
111	G	93	Very high	92.9	Very high	32 Å²	32	38.7 Å²	38.7	33%	0.33	22%	0.221	S	C	.	.	T	Hydrogen-bonded Turn	trans	76.3	3.2	-175.7	0	0	0	0	0	115.7	K275 R276	G111-K275 WeakPolarHBondContact CA-O 3.5Å; G111-K275 PolarHBondContact N-O 3.18Å; G111-R276 PolarHBondContact N-O 3.25Å
112	R	96.7	Very high	92.5	Very high	108 Å²	108	40.5 Å²	40.5	41%	0.408	23%	0.23	S	C	.	.			trans	-106.9	145.3	179.7	-56.8	-58	-176.9	154.8	-3.8	112.1	N109 S110 Y114 L278	N109-R112 HydrophobicContact CB-CG 3.92Å; N109-R112 WeakPolarHBondContact O-CB 3.37Å; N109-R112 PolarHBondContact O-N 3.28Å; S110-R112 VanDerWaalsContact C-N 3.25Å; S110-R112 PolarHBondContact O-N 3.48Å; R112-Y114 HydrophobicContact CB-CD2 4.14Å; R112-Y114 HydrophobicContact CB-CE1 4.41Å; R112-Y114 HydrophobicContact CB-CE2 3.38Å; R112-Y114 HydrophobicContact CG-CE2 4.42Å; R112-L278 PolarHBondContact O-N 3.23Å
113	R	97.8	Very high	92.2	Very high	42 Å²	42	39.3 Å²	39.3	16%	0.158	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	110.4	179.1	-58.1	179.9	-63.7	-78.7	1.8	108.3	L271 K272 F274 L278 V291 C292 T293 N294	R113-L271 WeakPolarHBondContact CD-O 3.4Å; R113-K272 PolarHBondContact NE-O 3.17Å; R113-K272 PolarHBondContact NH1-O 3.27Å; R113-K272 PolarHBondContact NH2-O 2.86Å; R113-F274 PolarHBondContact NH1-O 2.86Å; R113-L278 CarbonylContact C-O 3.47Å; R113-L278 WeakPolarHBondContact CA-O 3.3Å; R113-L278 HydrophobicContact CB-CB 4.19Å; R113-L278 HydrophobicContact CB-CD2 4.21Å; R113-L278 HydrophobicContact CG-CB 3.98Å; R113-L278 HydrophobicContact CG-CD2 4.12Å; R113-V291 PolarHBondContact NE-O 3.4Å; R113-C292 CarbonylContact O-C 3.57Å; R113-C292 WeakPolarHBondContact O-CA 3.5Å; R113-T293 VanDerWaalsContact CZ-CG2 3.49Å; R113-T293 PolarHBondContact N-OG1 3.04Å; R113-T293 PolarHBondContact O-N 3.35Å; R113-T293 PolarHBondContact O-OG1 3.08Å; R113-N294 PolarHBondContact O-N 2.87Å; R113-N294 VanDerWaalsContact O-N 3.14Å
114	Y	98.1	Very high	92.1	Very high	7 Å²	7	35.7 Å²	35.7	3%	0.027	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102	122.9	-170.2	-65.1	-85.4	0	0	0	111.1	E107 L108 N109 R112 L278 V279 L280 N294 I296 Y305	E107-Y114 PolarHBondContact O-OH 3.47Å; L108-Y114 HydrophobicContact CB-CE2 4.23Å; L108-Y114 HydrophobicContact CD2-CD1 4.42Å; L108-Y114 HydrophobicContact CD2-CD2 3.72Å; L108-Y114 HydrophobicContact CD2-CE2 3.84Å; L108-Y114 HydrophobicContact CD2-CG 4.03Å; N109-Y114 PolarHBondContact N-OH 2.96Å; R112-Y114 HydrophobicContact CB-CD2 4.14Å; R112-Y114 HydrophobicContact CB-CE1 4.41Å; R112-Y114 HydrophobicContact CB-CE2 3.38Å; R112-Y114 HydrophobicContact CG-CE2 4.42Å; Y114-L278 PolarHBondContact N-O 3.46Å; Y114-V279 WeakPolarHBondContact O-CA 3.45Å; Y114-L280 PolarHBondContact O-N 3.34Å; Y114-N294 CarbonylContact C-O 3.41Å; Y114-N294 VanDerWaalsContact CA-O 3.32Å; Y114-N294 WeakPolarHBondContact CA-O 3.4Å; Y114-N294 HydrophobicContact CD1-CB 3.51Å; Y114-N294 HydrophobicContact CE1-CB 3.65Å; Y114-N294 HydrophobicContact CG-CB 4.38Å; Y114-I296 HydrophobicContact CD1-CD1 3.73Å; Y114-I296 HydrophobicContact CD1-CG1 3.72Å; Y114-I296 HydrophobicContact CG-CD1 3.91Å; Y114-I296 HydrophobicContact CG-CG1 4.26Å; Y114-Y305 HydrophobicContact CE1-CD1 4.48Å
115	G	97.3	Very high	91.8	Very high	0 Å²	0	37.4 Å²	37.4	0%	0	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.3	111.6	166.4	0	0	0	0	0	110.4	L280 C292 N294 I295 I296	G115-L280 CarbonylContact C-O 3.58Å; G115-L280 WeakPolarHBondContact CA-O 3.41Å; G115-C292 VanDerWaalsContact CA-SG 3.51Å; G115-C292 PolarHBondContact N-SG 2.87Å; G115-C292 VanDerWaalsContact N-SG 3.38Å; G115-N294 PolarHBondContact N-O 3.17Å; G115-I295 CarbonylContact O-C 3.47Å; G115-I295 WeakPolarHBondContact O-CA 3.29Å; G115-I296 PolarHBondContact O-N 3.38Å
116	L	96.3	Very high	91.6	Very high	2 Å²	2	33.5 Å²	33.5	1%	0.01	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.5	108	175.3	176.4	63.2	0	0	0	109.9	K124 L127 L128 V279 L280 V281 I296 M298 L303	L116-K124 HydrophobicContact CD2-CB 4.02Å; L116-K124 HydrophobicContact CD2-CG 4.43Å; L116-K124 HydrophobicContact CG-CB 4.3Å; L116-K124 HydrophobicContact CG-CG 4.22Å; L116-L127 HydrophobicContact CD1-CD2 4.38Å; L116-L127 HydrophobicContact CD2-CD2 4.06Å; L116-L128 HydrophobicContact CD2-CG 4.32Å; L116-V279 HydrophobicContact CB-CG1 4.29Å; L116-L280 PolarHBondContact N-O 3.21Å; L116-V281 HydrophobicContact CB-CG2 3.8Å; L116-V281 HydrophobicContact CD2-CG2 3.81Å; L116-V281 HydrophobicContact CG-CG2 3.99Å; L116-I296 WeakPolarHBondContact CA-O 3.48Å; L116-I296 HydrophobicContact CD1-CB 4.01Å; L116-I296 HydrophobicContact CD1-CG2 3.81Å; L116-M298 HydrophobicContact CD1-CB 4.25Å; L116-L303 HydrophobicContact CD1-CD2 4.49Å
117	I	92.4	Very high	91.5	Very high	9 Å²	9	33.5 Å²	33.5	5%	0.046	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	159.1	-176.6	65.2	169.6	0	0	0	111.9	L288 I295 I296 H297 M298 Y310 Y313	I117-L288 HydrophobicContact CG2-CD1 3.92Å; I117-I295 HydrophobicContact CD1-CG2 3.32Å; I117-I295 HydrophobicContact CG1-CG2 3.6Å; I117-I295 HydrophobicContact CG2-CG2 4.49Å; I117-I296 PolarHBondContact N-O 2.98Å; I117-H297 HydrophobicContact CD1-CB 4.41Å; I117-H297 HydrophobicContact CG1-CB 4.18Å; I117-M298 PolarHBondContact O-N 3.46Å; I117-Y310 HydrophobicContact CD1-CD2 4.44Å; I117-Y310 HydrophobicContact CD1-CE2 4.08Å; I117-Y313 HydrophobicContact CD1-CD1 3.71Å; I117-Y313 HydrophobicContact CD1-CD2 4.36Å; I117-Y313 HydrophobicContact CD1-CE1 3.2Å; I117-Y313 HydrophobicContact CD1-CE2 3.9Å; I117-Y313 HydrophobicContact CD1-CG 4.26Å; I117-Y313 WeakPolarHBondContact CD1-OH 3.43Å
118	G	88.2	Confident	91.5	Very high	11 Å²	11	30 Å²	30	11%	0.113	18%	0.183	C	C	.	.			trans	152.1	164.9	-179	0	0	0	0	0	111.2	K124	G118-K124 WeakPolarHBondContact O-CE 3.22Å; G118-K124 PolarHBondContact O-NZ 3.49Å
119	L	82	Confident	91.3	Very high	65 Å²	65	31 Å²	31	34%	0.34	19%	0.189	S	C	.	.			trans	-57.5	153.1	-178	-62.7	177.7	0	0	0	112.6	G121 I122	L119-G121 PolarHBondContact O-N 2.83Å; L119-I122 WeakPolarHBondContact O-CB 3.35Å; L119-I122 WeakPolarHBondContact O-CG2 3.32Å; L119-I122 PolarHBondContact O-N 3.11Å
120	N	78.4	Confident	91.2	Very high	56 Å²	56	28.6 Å²	28.6	30%	0.299	18%	0.176	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.8	135.3	175.7	-76.8	-14.3	0	0	0	112	H283 H546 D548	N120-H283 PolarHBondContact OD1-CE1 2.97Å; N120-H283 VanDerWaalsContact OD1-CE1 3.24Å; N120-H283 PolarHBondContact OD1-NE2 3.31Å; N120-H546 PolarHBondContact ND2-O 2.87Å; N120-D548 PolarHBondContact ND2-N 2.93Å
121	G	76.9	Confident	91.4	Very high	75 Å²	75	26.9 Å²	26.9	77%	0.773	17%	0.165	S	C	*	.	T	Hydrogen-bonded Turn	trans	83.1	-0.4	-179	0	0	0	0	0	115.7	L119 G123	L119-G121 PolarHBondContact O-N 2.83Å; G121-G123 VanDerWaalsContact C-N 3.28Å; G121-G123 PolarHBondContact O-N 2.92Å
122	I	85.6	Confident	91.4	Very high	37 Å²	37	26.5 Å²	26.5	19%	0.19	16%	0.16	C	C	.	.	S	Bend	trans	-71.7	-21.8	180	-159.7	159.4	0	0	0	113.5	L119 K124 M298	L119-I122 WeakPolarHBondContact O-CB 3.35Å; L119-I122 WeakPolarHBondContact O-CG2 3.32Å; L119-I122 PolarHBondContact O-N 3.11Å; I122-K124 HydrophobicContact CG2-CG 4.04Å; I122-M298 HydrophobicContact CD1-CG 4.48Å; I122-M298 WeakPolarHBondContact CD1-O 3.36Å; I122-M298 HydrophobicContact CG1-CE 4.23Å; I122-M298 HydrophobicContact CG1-CG 4.32Å; I122-M298 HydrophobicContact CG2-CB 4.4Å; I122-M298 HydrophobicContact CG2-CE 4.31Å; I122-M298 HydrophobicContact CG2-CG 4Å; I122-M298 HydrophobicContact CG2-SD 3.85Å; I122-M298 WeakPolarHBondContact O-CE 3.44Å
123	G	88.7	Confident	91.2	Very high	7 Å²	7	25.5 Å²	25.5	7%	0.072	16%	0.159	C	C	.	.	S	Bend	trans	123.9	13.2	176.4	0	0	0	0	0	116.5	G121 S125 M126 L127	G121-G123 VanDerWaalsContact C-N 3.28Å; G121-G123 PolarHBondContact O-N 2.92Å; G123-S125 PolarHBondContact O-N 3.41Å; G123-M126 CarbonylContact O-C 3.58Å; G123-M126 WeakPolarHBondContact O-CA 3.38Å; G123-M126 WeakPolarHBondContact O-CB 3.4Å; G123-M126 PolarHBondContact O-N 3.15Å; G123-L127 PolarHBondContact O-N 3.49Å
124	K	92	Very high	90.9	Very high	15 Å²	15	28.2 Å²	28.2	7%	0.065	17%	0.169	C	C	.	.	H	α-helix	trans	-51.4	-58.5	179.9	-60.7	179	-64.2	-174.6	0	113.1	L116 G118 I122 M126 L127 L128 V281 H283 M298	L116-K124 HydrophobicContact CD2-CB 4.02Å; L116-K124 HydrophobicContact CD2-CG 4.43Å; L116-K124 HydrophobicContact CG-CB 4.3Å; L116-K124 HydrophobicContact CG-CG 4.22Å; G118-K124 WeakPolarHBondContact O-CE 3.22Å; G118-K124 PolarHBondContact O-NZ 3.49Å; I122-K124 HydrophobicContact CG2-CG 4.04Å; K124-M126 PolarHBondContact O-N 2.9Å; K124-L127 WeakPolarHBondContact O-CB 3.26Å; K124-L127 PolarHBondContact O-N 3.33Å; K124-L127 VanDerWaalsContact O-N 3.13Å; K124-L128 PolarHBondContact O-N 3.18Å; K124-V281 HydrophobicContact CB-CG2 4.14Å; K124-V281 HydrophobicContact CD-CG1 4.22Å; K124-H283 PolarHBondContact NZ-CE1 3.13Å; K124-H283 VanDerWaalsContact NZ-CE1 3.35Å; K124-M298 HydrophobicContact CG-SD 4.41Å
125	S	90.7	Very high	90.7	Very high	44 Å²	44	30.8 Å²	30.8	31%	0.308	18%	0.181	S	C	.	.	H	α-helix	trans	-63.1	-28.5	177.5	-46.1	0	0	0	0	112.7	G123 S129 D253	G123-S125 PolarHBondContact O-N 3.41Å; S125-S129 VanDerWaalsContact O-CB 3.27Å; S125-S129 WeakPolarHBondContact O-CB 3.47Å; S125-S129 PolarHBondContact O-N 3.27Å; S125-S129 PolarHBondContact O-OG 3.42Å; S125-D253 WeakPolarHBondContact CB-OD2 3.45Å; S125-D253 PolarHBondContact OG-OD2 3.25Å
126	M	91.3	Very high	90.5	Very high	28 Å²	28	30.8 Å²	30.8	14%	0.138	18%	0.182	C	C	.	.	H	α-helix	trans	-71.6	-39.7	175.7	-65.9	-59.3	99	0	0	111.5	R71 L93 F95 L100 G123 K124 S129 A130	R71-M126 PolarHBondContact NH2-SD 2.92Å; R71-M126 VanDerWaalsContact NH2-SD 3.44Å; L93-M126 HydrophobicContact CD2-CB 4.18Å; F95-M126 HydrophobicContact CD2-SD 4.14Å; F95-M126 HydrophobicContact CE2-SD 4.02Å; F95-M126 HydrophobicContact CZ-SD 4.33Å; L100-M126 HydrophobicContact CD1-CB 4Å; L100-M126 HydrophobicContact CD1-CG 4.11Å; G123-M126 CarbonylContact O-C 3.58Å; G123-M126 WeakPolarHBondContact O-CA 3.38Å; G123-M126 WeakPolarHBondContact O-CB 3.4Å; G123-M126 PolarHBondContact O-N 3.15Å; K124-M126 PolarHBondContact O-N 2.9Å; M126-S129 PolarHBondContact O-N 3.26Å; M126-A130 WeakPolarHBondContact O-CB 3.45Å; M126-A130 PolarHBondContact O-N 3.3Å
127	L	94.9	Very high	90.3	Very high	4 Å²	4	33.1 Å²	33.1	2%	0.021	20%	0.197	C	C	.	.	H	α-helix	trans	-63	-49.2	172.8	176.7	62.7	0	0	0	110.8	L91 L93 L101 L116 G123 K124 S129 A130 I131 L303	L91-L127 HydrophobicContact CD2-CD1 4.09Å; L93-L127 HydrophobicContact CD2-CB 4.26Å; L101-L127 HydrophobicContact CD1-CD1 3.94Å; L101-L127 HydrophobicContact CD1-CD2 4.25Å; L116-L127 HydrophobicContact CD1-CD2 4.38Å; L116-L127 HydrophobicContact CD2-CD2 4.06Å; G123-L127 PolarHBondContact O-N 3.49Å; K124-L127 WeakPolarHBondContact O-CB 3.26Å; K124-L127 PolarHBondContact O-N 3.33Å; K124-L127 VanDerWaalsContact O-N 3.13Å; L127-S129 VanDerWaalsContact C-N 3.29Å; L127-S129 PolarHBondContact O-N 3.22Å; L127-A130 WeakPolarHBondContact O-CB 3.12Å; L127-A130 PolarHBondContact O-N 3.19Å; L127-A130 VanDerWaalsContact O-N 3.1Å; L127-I131 HydrophobicContact CD1-CD1 4.1Å; L127-I131 HydrophobicContact CD1-CG1 4.35Å; L127-I131 HydrophobicContact CG-CD1 4.01Å; L127-I131 VanDerWaalsContact O-CG1 3.3Å; L127-I131 WeakPolarHBondContact O-CG1 3.3Å; L127-I131 PolarHBondContact O-N 2.87Å; L127-L303 HydrophobicContact CD2-CD1 4.03Å; L127-L303 HydrophobicContact CD2-CD2 3.98Å
128	L	95.4	Very high	90.3	Very high	0 Å²	0	33.4 Å²	33.4	0%	0	20%	0.198	C	C	.	.	H	α-helix	trans	-56.7	-44	175.4	-74.2	179.6	0	0	0	111.9	L116 K124 A130 I131 G132 L251 D253 V279 V281	L116-L128 HydrophobicContact CD2-CG 4.32Å; K124-L128 PolarHBondContact O-N 3.18Å; L128-A130 VanDerWaalsContact C-N 3.34Å; L128-A130 PolarHBondContact O-N 2.97Å; L128-I131 PolarHBondContact O-N 3.23Å; L128-G132 PolarHBondContact O-N 3.06Å; L128-L251 HydrophobicContact CD2-CB 4.17Å; L128-L251 HydrophobicContact CD2-CD2 4.04Å; L128-L251 HydrophobicContact CD2-CG 4.48Å; L128-D253 HydrophobicContact CD1-CB 3.89Å; L128-V279 HydrophobicContact CD2-CB 4.16Å; L128-V279 HydrophobicContact CD2-CG1 3.76Å; L128-V281 HydrophobicContact CD1-CB 4.3Å; L128-V281 HydrophobicContact CD1-CG2 3.54Å; L128-V281 HydrophobicContact CG-CG2 4.27Å
129	S	93.3	Very high	90.5	Very high	21 Å²	21	33.5 Å²	33.5	15%	0.147	20%	0.197	C	C	.	.	H	α-helix	trans	-62.8	-38.5	176.3	-64.5	0	0	0	0	113.1	S125 M126 L127 K133 H146	S125-S129 VanDerWaalsContact O-CB 3.27Å; S125-S129 WeakPolarHBondContact O-CB 3.47Å; S125-S129 PolarHBondContact O-N 3.27Å; S125-S129 PolarHBondContact O-OG 3.42Å; M126-S129 PolarHBondContact O-N 3.26Å; L127-S129 VanDerWaalsContact C-N 3.29Å; L127-S129 PolarHBondContact O-N 3.22Å; S129-K133 WeakPolarHBondContact O-CB 3.29Å; S129-K133 WeakPolarHBondContact O-CG 3.28Å; S129-K133 PolarHBondContact O-N 3.08Å; S129-H146 VanDerWaalsContact CA-CE1 3.5Å; S129-H146 WeakPolarHBondContact CA-CE1 3.48Å
130	A	93.8	Very high	90.7	Very high	0 Å²	0	37.5 Å²	37.5	0%	0	21%	0.214	C	C	.	.	H	α-helix	trans	-67.2	-39.9	178.1	0	0	0	0	0	111.7	V73 L93 M126 L127 L128 R134 E135 V136	V73-A130 HydrophobicContact CG2-CB 4.01Å; L93-A130 HydrophobicContact CD1-CB 4.39Å; M126-A130 WeakPolarHBondContact O-CB 3.45Å; M126-A130 PolarHBondContact O-N 3.3Å; L127-A130 WeakPolarHBondContact O-CB 3.12Å; L127-A130 PolarHBondContact O-N 3.19Å; L127-A130 VanDerWaalsContact O-N 3.1Å; L128-A130 VanDerWaalsContact C-N 3.34Å; L128-A130 PolarHBondContact O-N 2.97Å; A130-R134 PolarHBondContact O-N 2.82Å; A130-E135 VanDerWaalsContact CA-OE2 3.28Å; A130-E135 WeakPolarHBondContact CA-OE2 3.5Å; A130-E135 HydrophobicContact CB-CB 4.38Å; A130-E135 WeakPolarHBondContact CB-OE2 3.39Å; A130-E135 PolarHBondContact O-N 3.16Å; A130-V136 HydrophobicContact CB-CG2 4.15Å
131	I	95.6	Very high	90.9	Very high	2 Å²	2	36.4 Å²	36.4	1%	0.01	21%	0.207	C	C	.	.	H	α-helix	trans	-64.9	-52.4	173.5	-62.7	168	0	0	0	109.5	L106 L127 L128 K133 R134 V136 I138 I144 M249 L251	L106-I131 HydrophobicContact CD1-CD1 4.43Å; L106-I131 HydrophobicContact CD2-CD1 3.67Å; L106-I131 HydrophobicContact CD2-CG1 3.92Å; L127-I131 HydrophobicContact CD1-CD1 4.1Å; L127-I131 HydrophobicContact CD1-CG1 4.35Å; L127-I131 HydrophobicContact CG-CD1 4.01Å; L127-I131 VanDerWaalsContact O-CG1 3.3Å; L127-I131 WeakPolarHBondContact O-CG1 3.3Å; L127-I131 PolarHBondContact O-N 2.87Å; L128-I131 PolarHBondContact O-N 3.23Å; I131-K133 VanDerWaalsContact C-N 3.29Å; I131-K133 PolarHBondContact O-N 3.05Å; I131-R134 PolarHBondContact O-N 3.41Å; I131-V136 HydrophobicContact CG1-CG2 4.34Å; I131-I138 HydrophobicContact CB-CD1 4.25Å; I131-I138 HydrophobicContact CG2-CD1 3.52Å; I131-I138 WeakPolarHBondContact O-CD1 3.46Å; I131-I144 WeakPolarHBondContact O-CD1 3.42Å; I131-M249 HydrophobicContact CG2-SD 3.52Å; I131-M249 VanDerWaalsContact CG2-SD 3.52Å; I131-L251 HydrophobicContact CB-CD1 3.96Å; I131-L251 HydrophobicContact CG2-CD1 3.64Å; I131-L251 HydrophobicContact CG2-CD2 4.23Å
132	G	94	Very high	91.5	Very high	23 Å²	23	32.8 Å²	32.8	24%	0.237	17%	0.17	C	C	.	.	H	α-helix	trans	-59.5	-34.3	-178.4	0	0	0	0	0	114.4	L128 R134	L128-G132 PolarHBondContact O-N 3.06Å; G132-R134 VanDerWaalsContact C-N 3.33Å
133	K	92.1	Very high	91.7	Very high	87 Å²	87	33.1 Å²	33.1	38%	0.378	17%	0.172	S	C	.	.	T	Hydrogen-bonded Turn	trans	-87.5	4.6	176.8	-66.1	-172.5	-179.4	-166.2	0	113.9	E64 S129 I131 E135	E64-K133 IonicContact OE2-NZ 2.75Å; S129-K133 WeakPolarHBondContact O-CB 3.29Å; S129-K133 WeakPolarHBondContact O-CG 3.28Å; S129-K133 PolarHBondContact O-N 3.08Å; I131-K133 VanDerWaalsContact C-N 3.29Å; I131-K133 PolarHBondContact O-N 3.05Å; K133-E135 HydrophobicContact CB-CG 4.05Å; K133-E135 PolarHBondContact O-N 3.22Å
134	R	93	Very high	91.9	Very high	99 Å²	99	34.3 Å²	34.3	37%	0.374	18%	0.176	S	C	.	.	T	Hydrogen-bonded Turn	trans	54.1	32.2	-175.4	-59.5	-178.1	174.8	-92.3	4.3	113.7	A130 I131 G132 V136 I138 P139 E140 I142 I144	A130-R134 PolarHBondContact O-N 2.82Å; I131-R134 PolarHBondContact O-N 3.41Å; G132-R134 VanDerWaalsContact C-N 3.33Å; R134-V136 CarbonylContact C-O 3.59Å; R134-V136 PolarHBondContact O-N 3.44Å; R134-I138 PolarHBondContact NH1-O 3.36Å; R134-I138 VanDerWaalsContact NH1-O 3.12Å; R134-P139 PolarHBondContact NH1-O 3.34Å; R134-E140 PolarHBondContact NH2-O 2.86Å; R134-I142 PolarHBondContact NH2-O 2.8Å; R134-I144 HydrophobicContact CG-CD1 3.88Å
135	E	92.5	Very high	92	Very high	61 Å²	61	35.7 Å²	35.7	29%	0.285	18%	0.181	S	C	.	.			trans	-72.1	-20.3	171.2	-64.4	166	-177.1	0	0	110.9	R71 V73 A130 K133	R71-E135 WeakPolarHBondContact CD-OE2 3.28Å; R71-E135 IonicContact CZ-OE2 3.85Å; R71-E135 IonicContact NE-OE2 3.44Å; R71-E135 IonicContact NH1-OE1 3.57Å; R71-E135 PolarHBondContact NH1-OE1 2.76Å; R71-E135 IonicContact NH1-OE2 3.58Å; R71-E135 PolarHBondContact NH1-OE2 2.78Å; V73-E135 HydrophobicContact CB-CB 4.22Å; V73-E135 HydrophobicContact CG2-CB 3.87Å; A130-E135 VanDerWaalsContact CA-OE2 3.28Å; A130-E135 WeakPolarHBondContact CA-OE2 3.5Å; A130-E135 HydrophobicContact CB-CB 4.38Å; A130-E135 WeakPolarHBondContact CB-OE2 3.39Å; A130-E135 PolarHBondContact O-N 3.16Å; K133-E135 HydrophobicContact CB-CG 4.05Å; K133-E135 PolarHBondContact O-N 3.22Å
136	V	93	Very high	92.3	Very high	1 Å²	1	35.1 Å²	35.1	1%	0.006	17%	0.174	C	C	.	.	S	Bend	trans	-94.3	141.3	168.1	-165.4	0	0	0	0	108.2	V73 I88 L91 A130 I131 R134 I138	V73-V136 HydrophobicContact CG1-CG2 3.8Å; I88-V136 HydrophobicContact CB-CG1 4.29Å; I88-V136 HydrophobicContact CD1-CG1 3.38Å; I88-V136 HydrophobicContact CG1-CG1 3.83Å; I88-V136 HydrophobicContact CG2-CG1 3.96Å; L91-V136 HydrophobicContact CD1-CG1 4.13Å; L91-V136 HydrophobicContact CD1-CG2 4.24Å; A130-V136 HydrophobicContact CB-CG2 4.15Å; I131-V136 HydrophobicContact CG1-CG2 4.34Å; R134-V136 CarbonylContact C-O 3.59Å; R134-V136 PolarHBondContact O-N 3.44Å; V136-I138 PolarHBondContact O-N 3.17Å
137	P	92.5	Very high	92.4	Very high	51 Å²	51	34.6 Å²	34.6	33%	0.331	17%	0.172	S	C	.	.			trans	-68.6	91.5	-177.2	28.5	-37	0	0	0	111.3	L77 I88	L77-P137 HydrophobicContact CB-CB 4.22Å; L77-P137 HydrophobicContact CB-CG 4.21Å; I88-P137 HydrophobicContact CG1-CG 4.34Å
138	I	93.3	Very high	92	Very high	15 Å²	15	37.9 Å²	37.9	8%	0.077	19%	0.192	C	C	.	.			trans	-105.2	129.9	177.3	-60.5	166.8	0	0	0	108.2	V86 I131 R134 V136 I142 I144	V86-I138 HydrophobicContact CG1-CG1 4.35Å; V86-I138 HydrophobicContact CG2-CG2 4.47Å; I131-I138 HydrophobicContact CB-CD1 4.25Å; I131-I138 HydrophobicContact CG2-CD1 3.52Å; I131-I138 WeakPolarHBondContact O-CD1 3.46Å; R134-I138 PolarHBondContact NH1-O 3.36Å; R134-I138 VanDerWaalsContact NH1-O 3.12Å; V136-I138 PolarHBondContact O-N 3.17Å; I138-I142 HydrophobicContact CG2-CB 4.1Å; I138-I142 HydrophobicContact CG2-CG2 4.09Å; I138-I144 HydrophobicContact CB-CD1 4.25Å; I138-I144 HydrophobicContact CD1-CD1 3.42Å; I138-I144 VanDerWaalsContact CD1-CD1 3.42Å; I138-I144 HydrophobicContact CG1-CD1 4.43Å; I138-I144 HydrophobicContact CG2-CD1 3.94Å; I138-I144 HydrophobicContact CG2-CG1 4.49Å
139	P	90.6	Very high	91.6	Very high	12 Å²	12	41.9 Å²	41.9	8%	0.078	21%	0.207	C	C	.	.			trans	-50.2	143.8	177.4	-29.3	35	0	0	0	114.2	L77 P81 R134 H141 I142	L77-P139 HydrophobicContact CD1-CG 4.44Å; L77-P139 HydrophobicContact CD2-CG 4.03Å; P81-P139 WeakPolarHBondContact O-CB 3.28Å; R134-P139 PolarHBondContact NH1-O 3.34Å; P139-H141 VanDerWaalsContact C-N 3.32Å; P139-H141 WeakPolarHBondContact CB-CE1 3.27Å; P139-H141 VanDerWaalsContact CB-ND1 3.32Å; P139-H141 WeakPolarHBondContact CB-ND1 3.21Å; P139-H141 PolarHBondContact O-N 2.89Å; P139-I142 HydrophobicContact CB-CD1 4.27Å; P139-I142 HydrophobicContact CB-CG1 4.37Å; P139-I142 HydrophobicContact CG-CD1 4.17Å; P139-I142 PolarHBondContact O-N 2.87Å
140	E	86.5	Confident	91.4	Very high	150 Å²	150	44.4 Å²	44.4	70%	0.701	22%	0.216	S	C	*	.	T	Hydrogen-bonded Turn	trans	-63.5	-35.6	-174.9	-68.1	-174.2	171.5	0	0	113.1	R134 I142 R178	R134-E140 PolarHBondContact NH2-O 2.86Å; E140-I142 PolarHBondContact O-N 2.95Å; E140-R178 IonicContact OE2-NH1 2.94Å; E140-R178 PolarHBondContact OE2-NH1 3.47Å
141	H	82.5	Confident	91.2	Very high	32 Å²	32	45.6 Å²	45.6	15%	0.148	22%	0.222	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69.5	-16.6	-179.3	69	-78.6	0	0	0	113.5	P81 S83 P139 D143 E175	P81-H141 PolarHBondContact O-CE1 2.99Å; P81-H141 PolarHBondContact O-ND1 3.31Å; S83-H141 PolarHBondContact O-CE1 3.1Å; S83-H141 VanDerWaalsContact O-CE1 3.23Å; S83-H141 PolarHBondContact O-NE2 2.96Å; P139-H141 VanDerWaalsContact C-N 3.32Å; P139-H141 WeakPolarHBondContact CB-CE1 3.27Å; P139-H141 VanDerWaalsContact CB-ND1 3.32Å; P139-H141 WeakPolarHBondContact CB-ND1 3.21Å; P139-H141 PolarHBondContact O-N 2.89Å; H141-D143 PolarHBondContact O-N 2.88Å; H141-E175 WeakPolarHBondContact CB-OE1 3.47Å
142	I	89.2	Confident	91	Very high	0 Å²	0	48.8 Å²	48.8	0%	0	24%	0.243	C	C	.	.	S	Bend	trans	-85.2	99.6	175	-64.1	178.9	0	0	0	107.5	V86 R134 I138 P139 E140 I144 F248 M249	V86-I142 HydrophobicContact CG2-CD1 3.2Å; R134-I142 PolarHBondContact NH2-O 2.8Å; I138-I142 HydrophobicContact CG2-CB 4.1Å; I138-I142 HydrophobicContact CG2-CG2 4.09Å; P139-I142 HydrophobicContact CB-CD1 4.27Å; P139-I142 HydrophobicContact CB-CG1 4.37Å; P139-I142 HydrophobicContact CG-CD1 4.17Å; P139-I142 PolarHBondContact O-N 2.87Å; E140-I142 PolarHBondContact O-N 2.95Å; I142-I144 HydrophobicContact CG2-CG1 4.44Å; I142-F248 HydrophobicContact CB-CD1 4.4Å; I142-F248 HydrophobicContact CG1-CD1 4.09Å; I142-F248 HydrophobicContact CG1-CE1 4.41Å; I142-F248 HydrophobicContact CG2-CB 4.3Å; I142-F248 HydrophobicContact CG2-CD1 3.85Å; I142-F248 HydrophobicContact CG2-CG 4.41Å; I142-M249 HydrophobicContact CG2-CB 3.95Å; I142-M249 HydrophobicContact CG2-CE 4.11Å
143	D	89.8	Confident	90.9	Very high	43 Å²	43	49.8 Å²	49.8	23%	0.23	25%	0.245	C	C	.	.			trans	-74	133.7	172.5	72.1	-57.7	0	0	0	110.5	H141 R195 P247 F248 M249	H141-D143 PolarHBondContact O-N 2.88Å; D143-R195 IonicContact OD1-CZ 3.46Å; D143-R195 IonicContact OD1-NH1 3.82Å; D143-R195 PolarHBondContact OD1-NH1 3.01Å; D143-R195 IonicContact OD2-CZ 3.53Å; D143-R195 IonicContact OD2-NH1 3.84Å; D143-R195 PolarHBondContact OD2-NH1 3.47Å; D143-R195 IonicContact OD2-NH2 3.35Å; D143-R195 PolarHBondContact OD2-NH2 3.44Å; D143-P247 VanDerWaalsContact OD2-CA 3.26Å; D143-P247 WeakPolarHBondContact OD2-CA 3.48Å; D143-P247 WeakPolarHBondContact OD2-CB 3.19Å; D143-F248 PolarHBondContact O-N 3.35Å; D143-F248 WeakPolarHBondContact OD1-CB 3.35Å; D143-F248 PolarHBondContact OD1-N 3.29Å; D143-M249 PolarHBondContact O-N 3.03Å
144	I	93.9	Very high	90.9	Very high	33 Å²	33	47.3 Å²	47.3	17%	0.169	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	124.8	-175.6	-49	170.6	0	0	0	107.4	I131 R134 I138 I142 M249 L251	I131-I144 WeakPolarHBondContact O-CD1 3.42Å; R134-I144 HydrophobicContact CG-CD1 3.88Å; I138-I144 HydrophobicContact CB-CD1 4.25Å; I138-I144 HydrophobicContact CD1-CD1 3.42Å; I138-I144 VanDerWaalsContact CD1-CD1 3.42Å; I138-I144 HydrophobicContact CG1-CD1 4.43Å; I138-I144 HydrophobicContact CG2-CD1 3.94Å; I138-I144 HydrophobicContact CG2-CG1 4.49Å; I142-I144 HydrophobicContact CG2-CG1 4.44Å; I144-M249 WeakPolarHBondContact CA-O 3.33Å; I144-M249 HydrophobicContact CD1-SD 4.43Å; I144-M249 HydrophobicContact CG1-CB 4.26Å; I144-M249 HydrophobicContact CG1-SD 4.2Å; I144-M249 HydrophobicContact CG2-CB 4.39Å; I144-M249 HydrophobicContact CG2-CG 4.32Å; I144-M249 HydrophobicContact CG2-SD 4.21Å; I144-L251 HydrophobicContact CG2-CD1 3.68Å; I144-L251 HydrophobicContact CG2-CG 3.99Å
145	Y	94.6	Very high	90.9	Very high	43 Å²	43	47 Å²	47	17%	0.169	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	113.2	166.8	-159.3	-81.9	0	0	0	108.6	L147 A242 I245 M249 L250 L251	Y145-L147 HydrophobicContact CE1-CB 4.5Å; Y145-L147 HydrophobicContact CE1-CD1 4.41Å; Y145-A242 HydrophobicContact CD1-CB 3.58Å; Y145-A242 HydrophobicContact CE1-CB 3.38Å; Y145-A242 HydrophobicContact CG-CB 4.48Å; Y145-I245 HydrophobicContact CD2-CD1 3.85Å; Y145-I245 HydrophobicContact CD2-CG2 4.45Å; Y145-I245 HydrophobicContact CE2-CD1 3.3Å; Y145-M249 PolarHBondContact N-O 2.87Å; Y145-L250 HydrophobicContact CD1-CD1 4.28Å; Y145-L251 PolarHBondContact O-N 3.04Å
146	H	95.7	Very high	90.9	Very high	32 Å²	32	47.7 Å²	47.7	15%	0.148	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	104.8	175.7	-173.6	-159.1	0	0	0	110	S129 T148 L251	S129-H146 VanDerWaalsContact CA-CE1 3.5Å; S129-H146 WeakPolarHBondContact CA-CE1 3.48Å; H146-T148 HydrophobicContact CB-CG2 4.46Å; H146-T148 WeakPolarHBondContact CE1-CG2 3.44Å; H146-T148 WeakPolarHBondContact ND1-CG2 3.4Å; H146-T148 WeakPolarHBondContact NE2-CG2 3.48Å; H146-T148 PolarHBondContact O-N 2.96Å; H146-L251 HydrophobicContact CB-CB 4.16Å; H146-L251 HydrophobicContact CB-CD1 4.12Å
147	L	93.9	Very high	91	Very high	18 Å²	18	49.6 Å²	49.6	9%	0.094	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.5	99.2	177.8	-177.2	67	0	0	0	109.4	Y145 M235 A238 L239 L251 L252	Y145-L147 HydrophobicContact CE1-CB 4.5Å; Y145-L147 HydrophobicContact CE1-CD1 4.41Å; L147-M235 HydrophobicContact CD1-SD 4.4Å; L147-M235 HydrophobicContact CG-SD 4.41Å; L147-A238 HydrophobicContact CD1-CB 3.54Å; L147-L239 HydrophobicContact CD2-CB 3.84Å; L147-L239 HydrophobicContact CD2-CD1 3.69Å; L147-L239 HydrophobicContact CD2-CG 4.36Å; L147-L251 PolarHBondContact N-O 2.85Å; L147-L252 HydrophobicContact CB-CD2 3.76Å; L147-L252 HydrophobicContact CD2-CD2 3.85Å; L147-L252 HydrophobicContact CG-CD2 4.47Å
148	T	87	Confident	91	Very high	72 Å²	72	47.1 Å²	47.1	44%	0.442	24%	0.243	S	C	.	.			trans	-115.6	-23	-176.6	44.8	0	0	0	0	113.7	H146	H146-T148 HydrophobicContact CB-CG2 4.46Å; H146-T148 WeakPolarHBondContact CE1-CG2 3.44Å; H146-T148 WeakPolarHBondContact ND1-CG2 3.4Å; H146-T148 WeakPolarHBondContact NE2-CG2 3.48Å; H146-T148 PolarHBondContact O-N 2.96Å
149	R	86.3	Confident	91	Very high	84 Å²	84	47.5 Å²	47.5	32%	0.317	24%	0.244	S	C	.	.	S	Bend	trans	-134.4	149	-170.4	-58.4	-175	-172.3	178.6	7.8	110.6	E64 A238	E64-R149 IonicContact OE1-CZ 3Å; E64-R149 VanDerWaalsContact OE1-CZ 3.3Å; E64-R149 IonicContact OE1-NE 3.37Å; E64-R149 PolarHBondContact OE1-NE 2.7Å; E64-R149 IonicContact OE1-NH2 2.71Å; E64-R149 PolarHBondContact OE1-NH2 2.88Å; E64-R149 IonicContact OE2-CZ 2.69Å; E64-R149 IonicContact OE2-NE 2.63Å; E64-R149 IonicContact OE2-NH2 3.59Å; E64-R149 PolarHBondContact OE2-NH2 3.41Å; R149-A238 WeakPolarHBondContact O-CB 3.31Å
150	E	89.1	Confident	91	Very high	74 Å²	74	51.1 Å²	51.1	35%	0.346	26%	0.26	S	S	.	.	P	Polyproline II helix	trans	-70.6	157.1	166.4	57.9	179.7	-142.1	0	0	111.2	G231 R234 M235	E150-G231 WeakPolarHBondContact OE2-CA 3.35Å; E150-G231 VanDerWaalsContact OE2-O 3.07Å; E150-R234 HydrophobicContact CB-CB 4.21Å; E150-R234 IonicContact OE1-CZ 3.63Å; E150-R234 IonicContact OE1-NH1 2.86Å; E150-R234 PolarHBondContact OE1-NH1 3.44Å; E150-R234 IonicContact OE1-NH2 3.76Å; E150-R234 PolarHBondContact OE1-NH2 2.9Å; E150-M235 HydrophobicContact CB-CB 4Å; E150-M235 HydrophobicContact CB-CE 4.09Å; E150-M235 HydrophobicContact CB-SD 4.35Å
151	M	90.5	Very high	91.3	Very high	26 Å²	26	44.1 Å²	44.1	13%	0.128	23%	0.228	C	C	.	.	P	Polyproline II helix	trans	-61.6	138	172.2	-72.1	-62.2	-66.1	0	0	110.3	C161 L226 R234 V237 A238	M151-C161 HydrophobicContact CE-CB 3.96Å; M151-L226 HydrophobicContact CB-CD2 4.27Å; M151-R234 HydrophobicContact CB-CB 4.26Å; M151-R234 PolarHBondContact N-O 3Å; M151-R234 WeakPolarHBondContact O-CB 3.24Å; M151-R234 VanDerWaalsContact O-CD 3.3Å; M151-R234 WeakPolarHBondContact O-CD 3.35Å; M151-R234 PolarHBondContact O-NH1 3.15Å; M151-V237 HydrophobicContact CG-CB 4.05Å; M151-V237 HydrophobicContact CG-CG1 3.96Å; M151-A238 HydrophobicContact CG-CB 3.98Å
152	P	90.7	Very high	91.6	Very high	68 Å²	68	42.6 Å²	42.6	44%	0.442	22%	0.221	S	C	.	.	P	Polyproline II helix	trans	-63.3	152.3	172.5	27.4	-34.1	0	0	0	110.5	S154	P152-S154 PolarHBondContact O-N 2.74Å
153	P	92	Very high	91.5	Very high	44 Å²	44	45.3 Å²	45.3	29%	0.286	23%	0.234	S	C	.	.	P	Polyproline II helix	trans	-59.2	132.5	171.1	28.8	-34.4	0	0	0	109.1	V53 K227	V53-P153 HydrophobicContact CB-CG 4.12Å; V53-P153 HydrophobicContact CG1-CG 3.48Å; V53-P153 VanDerWaalsContact CG1-CG 3.48Å; V53-P153 HydrophobicContact CG2-CG 3.47Å; V53-P153 VanDerWaalsContact CG2-CG 3.47Å; P153-K227 HydrophobicContact CB-CB 3.94Å
154	S	91.5	Very high	91.4	Very high	36 Å²	36	46.1 Å²	46.1	25%	0.252	24%	0.237	S	C	.	.			trans	-147.3	156.3	-174.4	178.3	0	0	0	0	110.3	P152 K156 L226 K227	P152-S154 PolarHBondContact O-N 2.74Å; S154-K156 PolarHBondContact O-N 3.41Å; S154-K156 PolarHBondContact OG-N 3.28Å; S154-K156 VanDerWaalsContact OG-N 3.16Å; S154-L226 WeakPolarHBondContact O-CB 3.21Å; S154-L226 PolarHBondContact O-N 3.46Å; S154-K227 PolarHBondContact O-N 2.97Å
155	D	93	Very high	90.5	Very high	93 Å²	93	45 Å²	45	50%	0.497	23%	0.231	S	C	.	.	S	Bend	trans	-73.6	-9.2	169.7	-79.6	-61.4	0	0	0	112.9	K225 K227	D155-K225 HydrophobicContact CB-CD 4.46Å; D155-K225 WeakPolarHBondContact O-CG 3.17Å; D155-K225 WeakPolarHBondContact OD1-CD 3.46Å; D155-K225 IonicContact OD1-NZ 3.91Å; D155-K225 PolarHBondContact OD1-NZ 3.45Å; D155-K227 WeakPolarHBondContact OD1-CE 3.49Å; D155-K227 IonicContact OD1-NZ 3.87Å; D155-K227 PolarHBondContact OD1-NZ 3.09Å
156	K	93.5	Very high	89.6	Confident	75 Å²	75	48.5 Å²	48.5	33%	0.326	25%	0.253	S	S	.	.	S	Bend	trans	-73.2	150.8	175.1	-67.2	175.2	177.3	171.4	0	111.4	S154 C161 E164 L226	S154-K156 PolarHBondContact O-N 3.41Å; S154-K156 PolarHBondContact OG-N 3.28Å; S154-K156 VanDerWaalsContact OG-N 3.16Å; K156-C161 WeakPolarHBondContact CB-SG 3.42Å; K156-E164 WeakPolarHBondContact CD-OE2 3.36Å; K156-E164 WeakPolarHBondContact CE-OE2 3.31Å; K156-E164 IonicContact NZ-OE1 2.76Å; K156-E164 PolarHBondContact NZ-OE1 3.19Å; K156-E164 IonicContact NZ-OE2 3.22Å; K156-E164 PolarHBondContact NZ-OE2 3.34Å; K156-L226 WeakPolarHBondContact O-CB 3.39Å; K156-L226 PolarHBondContact O-N 3.27Å
157	T	94.4	Very high	88.9	Confident	40 Å²	40	51.5 Å²	51.5	25%	0.245	27%	0.273	C	S	.	.			trans	-79.5	153.6	173.5	60.6	0	0	0	0	111.4	L159 H160 C161 Q222 K224	T157-L159 VanDerWaalsContact C-N 3.25Å; T157-L159 PolarHBondContact O-N 3.43Å; T157-H160 PolarHBondContact O-N 3.23Å; T157-H160 WeakPolarHBondContact OG1-CB 3.44Å; T157-H160 PolarHBondContact OG1-N 3.36Å; T157-C161 PolarHBondContact O-N 2.9Å; T157-Q222 WeakPolarHBondContact CB-O 3.49Å; T157-K224 WeakPolarHBondContact CA-O 3.46Å
158	P	93.9	Very high	88.3	Confident	0 Å²	0	52.3 Å²	52.3	0%	0	28%	0.277	C	S	.	.	H	α-helix	trans	-47.8	-45.5	171.6	-30.5	35	0	0	0	113.8	C161 V162 L212 F217 K224 F229 V237	P158-C161 PolarHBondContact O-N 3.21Å; P158-V162 WeakPolarHBondContact O-CG2 3.44Å; P158-V162 PolarHBondContact O-N 2.87Å; P158-L212 HydrophobicContact CB-CD1 3.98Å; P158-L212 HydrophobicContact CB-CD2 4.01Å; P158-F217 HydrophobicContact CB-CD1 4.35Å; P158-F217 HydrophobicContact CB-CE1 4.2Å; P158-F217 HydrophobicContact CG-CD1 4.19Å; P158-F217 HydrophobicContact CG-CE1 3.92Å; P158-K224 WeakPolarHBondContact CD-O 3.46Å; P158-F229 HydrophobicContact CG-CE2 3.86Å; P158-F229 HydrophobicContact CG-CZ 4.24Å; P158-V237 HydrophobicContact CB-CG1 4.38Å; P158-V237 HydrophobicContact CB-CG2 3.84Å; P158-V237 HydrophobicContact CG-CG2 4.16Å
159	L	91.6	Very high	88	Confident	22 Å²	22	53 Å²	53	12%	0.115	27%	0.271	C	S	.	.	H	α-helix	trans	-58.5	-54.3	-179.1	-172.6	65.4	0	0	0	111.6	T157 C161 V162 M163 E205 A208 L212	T157-L159 VanDerWaalsContact C-N 3.25Å; T157-L159 PolarHBondContact O-N 3.43Å; L159-C161 VanDerWaalsContact C-N 3.3Å; L159-C161 PolarHBondContact O-N 2.91Å; L159-V162 PolarHBondContact O-N 2.79Å; L159-M163 HydrophobicContact CG-CE 3.98Å; L159-M163 HydrophobicContact CG-SD 4.49Å; L159-M163 WeakPolarHBondContact O-CG 3.21Å; L159-M163 PolarHBondContact O-N 3Å; L159-M163 VanDerWaalsContact O-N 3.13Å; L159-E205 HydrophobicContact CD1-CG 4.2Å; L159-E205 HydrophobicContact CD2-CG 3.83Å; L159-E205 WeakPolarHBondContact CD2-OE1 3.5Å; L159-E205 HydrophobicContact CG-CG 4.27Å; L159-A208 HydrophobicContact CD1-CB 3.78Å; L159-L212 HydrophobicContact CB-CD1 4.23Å; L159-L212 HydrophobicContact CD1-CD1 4.2Å
160	H	91.6	Very high	87.8	Confident	89 Å²	89	51.5 Å²	51.5	41%	0.412	28%	0.277	S	S	.	.	H	α-helix	trans	-57.1	-41	175.5	-172.7	-66.6	0	0	0	112.7	T157 V162 M163 E164	T157-H160 PolarHBondContact O-N 3.23Å; T157-H160 WeakPolarHBondContact OG1-CB 3.44Å; T157-H160 PolarHBondContact OG1-N 3.36Å; H160-V162 VanDerWaalsContact C-N 3.33Å; H160-V162 PolarHBondContact O-N 2.91Å; H160-M163 PolarHBondContact O-N 2.9Å; H160-E164 IonicContact CE1-OE2 3.22Å; H160-E164 IonicContact ND1-OE2 3.31Å; H160-E164 WeakPolarHBondContact O-CB 3.27Å; H160-E164 PolarHBondContact O-N 3.22Å
161	C	91.9	Very high	87.5	Confident	2 Å²	2	54.3 Å²	54.3	1%	0.014	29%	0.292	C	S	.	.	H	α-helix	trans	-69.6	-28.8	-179.3	-82	0	0	0	0	114.2	M151 K156 T157 P158 L159 L226 V237	M151-C161 HydrophobicContact CE-CB 3.96Å; K156-C161 WeakPolarHBondContact CB-SG 3.42Å; T157-C161 PolarHBondContact O-N 2.9Å; P158-C161 PolarHBondContact O-N 3.21Å; L159-C161 VanDerWaalsContact C-N 3.3Å; L159-C161 PolarHBondContact O-N 2.91Å; C161-L226 HydrophobicContact CB-CD1 3.78Å; C161-L226 WeakPolarHBondContact SG-CD1 2.92Å; C161-V237 HydrophobicContact CB-CG1 4.18Å
162	V	90.5	Very high	87.1	Confident	0 Å²	0	53.6 Å²	53.6	0%	0	29%	0.288	C	S	.	.	H	α-helix	trans	-72.1	-37.9	172.6	173	0	0	0	0	110.7	P158 L159 H160 E164 A208 L212 V237 A240 F244	P158-V162 WeakPolarHBondContact O-CG2 3.44Å; P158-V162 PolarHBondContact O-N 2.87Å; L159-V162 PolarHBondContact O-N 2.79Å; H160-V162 VanDerWaalsContact C-N 3.33Å; H160-V162 PolarHBondContact O-N 2.91Å; V162-E164 VanDerWaalsContact C-N 3.34Å; V162-A208 HydrophobicContact CB-CB 4.18Å; V162-A208 HydrophobicContact CG1-CB 3.68Å; V162-L212 HydrophobicContact CG2-CD1 4.15Å; V162-L212 HydrophobicContact CG2-CD2 4.03Å; V162-L212 HydrophobicContact CG2-CG 4.14Å; V162-V237 HydrophobicContact CG2-CG1 4.13Å; V162-A240 HydrophobicContact CG2-CB 3.63Å; V162-F244 HydrophobicContact CG1-CB 3.52Å; V162-F244 HydrophobicContact CG1-CD1 4.16Å; V162-F244 HydrophobicContact CG1-CD2 3.99Å; V162-F244 HydrophobicContact CG1-CG 3.62Å; V162-F244 VanDerWaalsContact O-CD1 3.26Å; V162-F244 WeakPolarHBondContact O-CD1 3.26Å
163	M	87.2	Confident	86.9	Confident	57 Å²	57	53.9 Å²	53.9	28%	0.281	28%	0.283	S	S	.	.	H	α-helix	trans	-78.9	-13.9	179.2	-63.5	-174.8	-56.1	0	0	114.1	L159 H160 V165 E205 A208	L159-M163 HydrophobicContact CG-CE 3.98Å; L159-M163 HydrophobicContact CG-SD 4.49Å; L159-M163 WeakPolarHBondContact O-CG 3.21Å; L159-M163 PolarHBondContact O-N 3Å; L159-M163 VanDerWaalsContact O-N 3.13Å; H160-M163 PolarHBondContact O-N 2.9Å; M163-V165 WeakPolarHBondContact O-CG2 3.3Å; M163-V165 PolarHBondContact O-N 2.79Å; M163-E205 VanDerWaalsContact SD-CA 3.53Å; M163-E205 HydrophobicContact SD-CB 3.8Å; M163-E205 HydrophobicContact SD-CG 4.08Å; M163-A208 HydrophobicContact CG-CB 3.8Å
164	E	85.9	Confident	86.7	Confident	61 Å²	61	58.7 Å²	58.7	29%	0.285	30%	0.3	S	S	.	.			trans	-78.5	74.5	179.1	-169.4	175.9	-173.3	0	0	110.9	K156 H160 V162 R241	K156-E164 WeakPolarHBondContact CD-OE2 3.36Å; K156-E164 WeakPolarHBondContact CE-OE2 3.31Å; K156-E164 IonicContact NZ-OE1 2.76Å; K156-E164 PolarHBondContact NZ-OE1 3.19Å; K156-E164 IonicContact NZ-OE2 3.22Å; K156-E164 PolarHBondContact NZ-OE2 3.34Å; H160-E164 IonicContact CE1-OE2 3.22Å; H160-E164 IonicContact ND1-OE2 3.31Å; H160-E164 WeakPolarHBondContact O-CB 3.27Å; H160-E164 PolarHBondContact O-N 3.22Å; V162-E164 VanDerWaalsContact C-N 3.34Å; E164-R241 PolarHBondContact O-NH2 3.47Å
165	V	76.3	Confident	86.3	Confident	8 Å²	8	58.3 Å²	58.3	5%	0.048	29%	0.294	C	S	.	.			trans	-117.4	22.1	-177.6	-71.9	0	0	0	0	112.6	M163 T167 E168 R169 L199 F244 I245	M163-V165 WeakPolarHBondContact O-CG2 3.3Å; M163-V165 PolarHBondContact O-N 2.79Å; V165-T167 PolarHBondContact O-N 2.87Å; V165-E168 WeakPolarHBondContact CA-OE2 3.34Å; V165-E168 HydrophobicContact CB-CB 4.45Å; V165-E168 PolarHBondContact O-N 3.1Å; V165-E168 VanDerWaalsContact O-N 3.08Å; V165-R169 WeakPolarHBondContact O-CB 3.36Å; V165-R169 PolarHBondContact O-N 2.91Å; V165-L199 HydrophobicContact CG2-CD2 4.23Å; V165-F244 HydrophobicContact CG1-CD1 4.01Å; V165-F244 HydrophobicContact CG1-CE1 4.24Å; V165-F244 HydrophobicContact CG2-CD1 4.41Å; V165-F244 HydrophobicContact CG2-CE1 3.81Å; V165-I245 HydrophobicContact CB-CG1 4.38Å; V165-I245 HydrophobicContact CG1-CD1 3.85Å; V165-I245 HydrophobicContact CG1-CG1 3.37Å
166	D	75.9	Confident	86	Confident	117 Å²	117	54 Å²	54	63%	0.626	27%	0.271	S	S	*	.	H	α-helix	trans	-55.7	-38.4	-176.9	-64.1	-51.2	0	0	0	112.2	A170	D166-A170 VanDerWaalsContact O-CB 3.27Å; D166-A170 WeakPolarHBondContact O-CB 3.19Å; D166-A170 PolarHBondContact O-N 2.83Å
167	T	79.7	Confident	85.7	Confident	95 Å²	95	56.4 Å²	56.4	58%	0.583	28%	0.284	S	S	*	.	H	α-helix	trans	-65.1	-43.2	177.8	39	0	0	0	0	112.5	V165 M171	V165-T167 PolarHBondContact O-N 2.87Å; T167-M171 WeakPolarHBondContact O-CG 3.42Å; T167-M171 PolarHBondContact O-N 2.86Å; T167-M171 VanDerWaalsContact O-N 3.12Å
168	E	81.5	Confident	85.3	Confident	35 Å²	35	58.4 Å²	58.4	16%	0.164	29%	0.287	C	S	.	.	H	α-helix	trans	-71.3	-41.9	179.8	-65.1	88.1	153.8	0	0	110.5	V165 M171 L172 R241 I245	V165-E168 WeakPolarHBondContact CA-OE2 3.34Å; V165-E168 HydrophobicContact CB-CB 4.45Å; V165-E168 PolarHBondContact O-N 3.1Å; V165-E168 VanDerWaalsContact O-N 3.08Å; E168-M171 PolarHBondContact O-N 3.47Å; E168-L172 VanDerWaalsContact O-CG 3.32Å; E168-L172 WeakPolarHBondContact O-CG 3.43Å; E168-L172 PolarHBondContact O-N 3.32Å; E168-R241 IonicContact OE1-CZ 3.8Å; E168-R241 IonicContact OE1-NE 2.8Å; E168-R241 IonicContact OE1-NH2 3.87Å; E168-R241 PolarHBondContact OE1-NH2 2.88Å; E168-R241 IonicContact OE2-NH2 3.04Å; E168-R241 PolarHBondContact OE2-NH2 2.84Å; E168-I245 HydrophobicContact CB-CG2 4.48Å; E168-I245 HydrophobicContact CG-CD1 3.98Å; E168-I245 HydrophobicContact CG-CG1 4.38Å; E168-I245 HydrophobicContact CG-CG2 4.29Å; E168-I245 VanDerWaalsContact OE1-CD1 3.29Å; E168-I245 WeakPolarHBondContact OE1-CD1 3.47Å
169	R	80.3	Confident	84.8	Confident	87 Å²	87	59.3 Å²	59.3	33%	0.328	29%	0.292	S	S	.	.	H	α-helix	trans	-58.2	-50.6	173.2	-178.4	-179.4	173.3	153.6	7.9	111.1	V165 M171 L172 E173 L196	V165-R169 WeakPolarHBondContact O-CB 3.36Å; V165-R169 PolarHBondContact O-N 2.91Å; R169-M171 VanDerWaalsContact C-N 3.27Å; R169-M171 PolarHBondContact O-N 3.28Å; R169-L172 PolarHBondContact O-N 3.07Å; R169-L172 VanDerWaalsContact O-N 3.12Å; R169-E173 HydrophobicContact CG-CG 4.39Å; R169-E173 WeakPolarHBondContact CG-OE1 3.48Å; R169-E173 IonicContact CZ-OE1 2.66Å; R169-E173 IonicContact NE-OE1 3.17Å; R169-E173 PolarHBondContact NE-OE1 3.4Å; R169-E173 IonicContact NH2-OE1 2.93Å; R169-E173 WeakPolarHBondContact O-CG 3.13Å; R169-E173 PolarHBondContact O-N 2.98Å; R169-L196 HydrophobicContact CG-CD2 4.14Å
170	A	81.8	Confident	84.4	Confident	53 Å²	53	60 Å²	60	44%	0.438	30%	0.3	S	S	.	.	H	α-helix	trans	-61	-35.1	179.1	0	0	0	0	0	112.9	D166 K174	D166-A170 VanDerWaalsContact O-CB 3.27Å; D166-A170 WeakPolarHBondContact O-CB 3.19Å; D166-A170 PolarHBondContact O-N 2.83Å; A170-K174 WeakPolarHBondContact O-CB 3.46Å; A170-K174 PolarHBondContact O-N 3.4Å; A170-K174 VanDerWaalsContact O-N 3.11Å
171	M	83.7	Confident	84.2	Confident	133 Å²	133	63.9 Å²	63.9	66%	0.655	32%	0.319	S	S	*	.	H	α-helix	trans	-67.8	-41.1	174.9	-72.5	-73.2	-73.4	0	0	111.9	T167 E168 R169 E175	T167-M171 WeakPolarHBondContact O-CG 3.42Å; T167-M171 PolarHBondContact O-N 2.86Å; T167-M171 VanDerWaalsContact O-N 3.12Å; E168-M171 PolarHBondContact O-N 3.47Å; R169-M171 VanDerWaalsContact C-N 3.27Å; R169-M171 PolarHBondContact O-N 3.28Å; M171-E175 WeakPolarHBondContact O-CB 3.27Å; M171-E175 PolarHBondContact O-N 3.13Å; M171-E175 VanDerWaalsContact O-N 3.07Å
172	L	83.1	Confident	83.7	Confident	10 Å²	10	70.4 Å²	70.4	5%	0.052	35%	0.349	C	S	.	.	H	α-helix	trans	-67.7	-41.6	176.6	-69.6	169.1	0	0	0	112.2	E168 R169 E175 A176 L192 R195 L196 L199	E168-L172 VanDerWaalsContact O-CG 3.32Å; E168-L172 WeakPolarHBondContact O-CG 3.43Å; E168-L172 PolarHBondContact O-N 3.32Å; R169-L172 PolarHBondContact O-N 3.07Å; R169-L172 VanDerWaalsContact O-N 3.12Å; L172-E175 PolarHBondContact O-N 3.11Å; L172-A176 WeakPolarHBondContact O-CB 3.32Å; L172-A176 PolarHBondContact O-N 2.76Å; L172-L192 HydrophobicContact CD2-CD2 3.74Å; L172-R195 HydrophobicContact CD1-CG 4.07Å; L172-L196 HydrophobicContact CB-CD2 3.69Å; L172-L196 HydrophobicContact CB-CG 4.2Å; L172-L196 HydrophobicContact CD1-CD2 4.5Å; L172-L199 HydrophobicContact CD1-CD1 3.51Å
173	E	85.9	Confident	83.1	Confident	74 Å²	74	74.6 Å²	74.6	35%	0.346	37%	0.371	S	S	.	.	H	α-helix	trans	-59.7	-46.8	175.6	-73	174	176.6	0	0	110.7	R169 E175 A176 E177 L196	R169-E173 HydrophobicContact CG-CG 4.39Å; R169-E173 WeakPolarHBondContact CG-OE1 3.48Å; R169-E173 IonicContact CZ-OE1 2.66Å; R169-E173 IonicContact NE-OE1 3.17Å; R169-E173 PolarHBondContact NE-OE1 3.4Å; R169-E173 IonicContact NH2-OE1 2.93Å; R169-E173 WeakPolarHBondContact O-CG 3.13Å; R169-E173 PolarHBondContact O-N 2.98Å; E173-E175 VanDerWaalsContact C-N 3.32Å; E173-E175 PolarHBondContact O-N 3.15Å; E173-A176 PolarHBondContact O-N 3.09Å; E173-E177 WeakPolarHBondContact O-CG 3.37Å; E173-E177 PolarHBondContact O-N 2.87Å; E173-L196 HydrophobicContact CG-CD1 4.09Å; E173-L196 HydrophobicContact CG-CD2 3.65Å
174	K	87.1	Confident	82.6	Confident	146 Å²	146	75.2 Å²	75.2	64%	0.635	39%	0.386	S	S	*	.	H	α-helix	trans	-62.2	-38	177	-176.2	179.5	177.1	-173	0	113	A170 R178	A170-K174 WeakPolarHBondContact O-CB 3.46Å; A170-K174 PolarHBondContact O-N 3.4Å; A170-K174 VanDerWaalsContact O-N 3.11Å; K174-R178 PolarHBondContact O-N 3.42Å; K174-R178 VanDerWaalsContact O-N 3.08Å
175	E	84.3	Confident	82	Confident	27 Å²	27	81.1 Å²	81.1	13%	0.126	41%	0.413	C	S	.	.	H	α-helix	trans	-69	-42.2	176.7	-177.4	61.6	-165.1	0	0	111.7	H141 M171 L172 E173 R178 L179 L192	H141-E175 WeakPolarHBondContact CB-OE1 3.47Å; M171-E175 WeakPolarHBondContact O-CB 3.27Å; M171-E175 PolarHBondContact O-N 3.13Å; M171-E175 VanDerWaalsContact O-N 3.07Å; L172-E175 PolarHBondContact O-N 3.11Å; E173-E175 VanDerWaalsContact C-N 3.32Å; E173-E175 PolarHBondContact O-N 3.15Å; E175-R178 WeakPolarHBondContact O-CB 3.33Å; E175-R178 PolarHBondContact O-N 2.71Å; E175-R178 IonicContact OE1-CZ 2.93Å; E175-R178 IonicContact OE1-NE 2.96Å; E175-R178 IonicContact OE1-NH2 2.81Å; E175-R178 PolarHBondContact OE1-NH2 3.32Å; E175-R178 IonicContact OE2-CZ 3.73Å; E175-R178 IonicContact OE2-NE 2.96Å; E175-R178 PolarHBondContact OE2-NE 3.24Å; E175-R178 VanDerWaalsContact OE2-NE 3.17Å; E175-R178 IonicContact OE2-NH1 3.35Å; E175-R178 IonicContact OE2-NH2 3.79Å; E175-R178 PolarHBondContact OE2-NH2 3.02Å; E175-L179 PolarHBondContact O-N 3.21Å; E175-L192 HydrophobicContact CB-CD1 4.2Å; E175-L192 HydrophobicContact CG-CD1 3.66Å
176	A	85.9	Confident	82	Confident	2 Å²	2	82.1 Å²	82.1	2%	0.017	42%	0.42	C	S	.	.	H	α-helix	trans	-61.8	-43.2	175.2	0	0	0	0	0	111.3	L172 E173 R178 L179 A180 L189 L192 Y193 L196	L172-A176 WeakPolarHBondContact O-CB 3.32Å; L172-A176 PolarHBondContact O-N 2.76Å; E173-A176 PolarHBondContact O-N 3.09Å; A176-R178 PolarHBondContact O-N 2.88Å; A176-L179 PolarHBondContact O-N 2.98Å; A176-A180 VanDerWaalsContact O-CB 3.24Å; A176-A180 WeakPolarHBondContact O-CB 3.41Å; A176-A180 PolarHBondContact O-N 3.47Å; A176-L189 HydrophobicContact CB-CD1 4Å; A176-L189 VanDerWaalsContact O-CD1 3.3Å; A176-L189 WeakPolarHBondContact O-CD1 3.46Å; A176-L192 HydrophobicContact CB-CB 4.3Å; A176-L192 HydrophobicContact CB-CD1 4.2Å; A176-Y193 HydrophobicContact CB-CE1 4.32Å; A176-L196 HydrophobicContact CB-CD1 4.21Å
177	E	87.6	Confident	82	Confident	127 Å²	127	84.7 Å²	84.7	59%	0.593	43%	0.428	S	S	*	.	H	α-helix	trans	-59.7	-43.5	173.8	-75.1	179.6	178.1	0	0	112.2	E173 H181	E173-E177 WeakPolarHBondContact O-CG 3.37Å; E173-E177 PolarHBondContact O-N 2.87Å; E177-H181 PolarHBondContact O-CD2 3.3Å; E177-H181 PolarHBondContact O-N 3.09Å; E177-H181 VanDerWaalsContact O-N 3.12Å
178	R	85.6	Confident	81.8	Confident	81 Å²	81	81.9 Å²	81.9	31%	0.306	41%	0.408	S	S	.	.	H	α-helix	trans	-60.5	-51.7	176.6	-179.4	178.6	72.2	179.1	9.9	111.2	E140 K174 E175 A176 A180 H181 E182	E140-R178 IonicContact OE2-NH1 2.94Å; E140-R178 PolarHBondContact OE2-NH1 3.47Å; K174-R178 PolarHBondContact O-N 3.42Å; K174-R178 VanDerWaalsContact O-N 3.08Å; E175-R178 WeakPolarHBondContact O-CB 3.33Å; E175-R178 PolarHBondContact O-N 2.71Å; E175-R178 IonicContact OE1-CZ 2.93Å; E175-R178 IonicContact OE1-NE 2.96Å; E175-R178 IonicContact OE1-NH2 2.81Å; E175-R178 PolarHBondContact OE1-NH2 3.32Å; E175-R178 IonicContact OE2-CZ 3.73Å; E175-R178 IonicContact OE2-NE 2.96Å; E175-R178 PolarHBondContact OE2-NE 3.24Å; E175-R178 VanDerWaalsContact OE2-NE 3.17Å; E175-R178 IonicContact OE2-NH1 3.35Å; E175-R178 IonicContact OE2-NH2 3.79Å; E175-R178 PolarHBondContact OE2-NH2 3.02Å; A176-R178 PolarHBondContact O-N 2.88Å; R178-A180 PolarHBondContact O-N 3.35Å; R178-H181 WeakPolarHBondContact O-CB 3.18Å; R178-H181 PolarHBondContact O-N 3.22Å; R178-H181 VanDerWaalsContact O-N 3.17Å; R178-E182 PolarHBondContact O-N 3.47Å; R178-E182 VanDerWaalsContact O-N 3.09Å
179	L	82.7	Confident	81.7	Confident	20 Å²	20	80.8 Å²	80.8	11%	0.105	40%	0.403	C	S	.	.	H	α-helix	trans	-64.4	-39.8	-179.5	-71.8	179.4	0	0	0	111.8	E175 A176 H181 E182 D183 K188 L189 L192	E175-L179 PolarHBondContact O-N 3.21Å; A176-L179 PolarHBondContact O-N 2.98Å; L179-H181 PolarHBondContact O-N 3.42Å; L179-E182 PolarHBondContact O-N 3Å; L179-E182 VanDerWaalsContact O-N 3.15Å; L179-D183 CarbonylContact O-C 3.46Å; L179-D183 VanDerWaalsContact O-C 3.3Å; L179-D183 PolarHBondContact O-N 3.49Å; L179-D183 VanDerWaalsContact O-O 3.12Å; L179-K188 HydrophobicContact CD1-CB 4.08Å; L179-L189 HydrophobicContact CB-CD1 4.29Å; L179-L192 HydrophobicContact CD1-CD1 3.64Å
180	A	84.4	Confident	81.8	Confident	36 Å²	36	82.8 Å²	82.8	30%	0.298	42%	0.418	S	S	.	.	H	α-helix	trans	-61.2	-30.3	175.1	0	0	0	0	0	113	A176 R178 L189	A176-A180 VanDerWaalsContact O-CB 3.24Å; A176-A180 WeakPolarHBondContact O-CB 3.41Å; A176-A180 PolarHBondContact O-N 3.47Å; R178-A180 PolarHBondContact O-N 3.35Å; A180-L189 HydrophobicContact CB-CD1 4.21Å; A180-L189 HydrophobicContact CB-CD2 3.89Å
181	H	86.2	Confident	81.8	Confident	171 Å²	171	84.2 Å²	84.2	79%	0.792	42%	0.416	S	S	*	.	H	α-helix	trans	-78.3	-32	174.5	-83.4	-54.4	0	0	0	114.1	E177 R178 L179	E177-H181 PolarHBondContact O-CD2 3.3Å; E177-H181 PolarHBondContact O-N 3.09Å; E177-H181 VanDerWaalsContact O-N 3.12Å; R178-H181 WeakPolarHBondContact O-CB 3.18Å; R178-H181 PolarHBondContact O-N 3.22Å; R178-H181 VanDerWaalsContact O-N 3.17Å; L179-H181 PolarHBondContact O-N 3.42Å
182	E	82.1	Confident	81.8	Confident	138 Å²	138	79 Å²	79	65%	0.645	39%	0.39	S	S	*	.	H	α-helix	trans	-84.7	-46	-179	-70.6	179	-177.3	0	0	112.3	R178 L179	R178-E182 PolarHBondContact O-N 3.47Å; R178-E182 VanDerWaalsContact O-N 3.09Å; L179-E182 PolarHBondContact O-N 3Å; L179-E182 VanDerWaalsContact O-N 3.15Å
183	D	78.6	Confident	81.9	Confident	88 Å²	88	84.4 Å²	84.4	47%	0.471	41%	0.411	S	S	.	.			trans	-158	98.9	-179.2	-175.7	8.4	0	0	0	111.4	L179 E185 C186	L179-D183 CarbonylContact O-C 3.46Å; L179-D183 VanDerWaalsContact O-C 3.3Å; L179-D183 PolarHBondContact O-N 3.49Å; L179-D183 VanDerWaalsContact O-O 3.12Å; D183-E185 PolarHBondContact O-N 3.24Å; D183-E185 PolarHBondContact OD1-N 3.25Å; D183-C186 HydrophobicContact CB-CB 4.21Å; D183-C186 WeakPolarHBondContact O-CB 3.33Å; D183-C186 PolarHBondContact O-N 3.11Å
184	A	76.1	Confident	81.9	Confident	71 Å²	71	86.1 Å²	86.1	59%	0.587	42%	0.419	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.3	-16.5	-176.5	0	0	0	0	0	114.4
185	E	72.3	Confident	81.7	Confident	184 Å²	184	79.7 Å²	79.7	86%	0.86	39%	0.391	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99.7	6.3	179.8	-65.1	-175.2	176	0	0	112.6	D183 E187	D183-E185 PolarHBondContact O-N 3.24Å; D183-E185 PolarHBondContact OD1-N 3.25Å; E185-E187 PolarHBondContact O-N 3.35Å
186	C	76.5	Confident	81.7	Confident	30 Å²	30	79.5 Å²	79.5	20%	0.203	39%	0.391	C	S	.	.			trans	-65.2	127.3	-179.8	-169.7	0	0	0	0	111.4	D183 K188 L189	D183-C186 HydrophobicContact CB-CB 4.21Å; D183-C186 WeakPolarHBondContact O-CB 3.33Å; D183-C186 PolarHBondContact O-N 3.11Å; C186-K188 PolarHBondContact O-N 3.22Å; C186-L189 WeakPolarHBondContact O-CB 3.3Å; C186-L189 PolarHBondContact O-N 3.38Å
187	E	77.7	Confident	81.5	Confident	170 Å²	170	86.3 Å²	86.3	79%	0.794	42%	0.422	S	S	*	.	H	α-helix	trans	-49.8	-32.6	176.2	-68.3	-178.9	162.3	0	0	112.8	E185 L189 M190 E191	E185-E187 PolarHBondContact O-N 3.35Å; E187-L189 VanDerWaalsContact C-N 3.33Å; E187-L189 PolarHBondContact O-N 2.84Å; E187-M190 WeakPolarHBondContact O-CB 3.46Å; E187-M190 PolarHBondContact O-N 2.97Å; E187-E191 PolarHBondContact O-N 3.12Å
188	K	73.6	Confident	81.1	Confident	37 Å²	37	84.4 Å²	84.4	16%	0.161	41%	0.413	C	S	.	.	H	α-helix	trans	-65.1	-33	177.8	-60.6	179.5	-174.5	176.2	0	114	N82 L179 C186 M190 E191 L192	N82-K188 VanDerWaalsContact O-CE 3.22Å; N82-K188 WeakPolarHBondContact O-CE 3.49Å; N82-K188 PolarHBondContact O-NZ 2.94Å; L179-K188 HydrophobicContact CD1-CB 4.08Å; C186-K188 PolarHBondContact O-N 3.22Å; K188-M190 PolarHBondContact O-N 3.25Å; K188-E191 PolarHBondContact O-N 2.73Å; K188-L192 WeakPolarHBondContact O-CG 3.47Å; K188-L192 PolarHBondContact O-N 3.22Å
189	L	80.9	Confident	80.7	Confident	11 Å²	11	81 Å²	81	6%	0.058	40%	0.401	C	S	.	.	H	α-helix	trans	-65.1	-37.2	177.7	-177.8	62.1	0	0	0	109.9	A176 L179 A180 C186 E187 L192 Y193	A176-L189 HydrophobicContact CB-CD1 4Å; A176-L189 VanDerWaalsContact O-CD1 3.3Å; A176-L189 WeakPolarHBondContact O-CD1 3.46Å; L179-L189 HydrophobicContact CB-CD1 4.29Å; A180-L189 HydrophobicContact CB-CD1 4.21Å; A180-L189 HydrophobicContact CB-CD2 3.89Å; C186-L189 WeakPolarHBondContact O-CB 3.3Å; C186-L189 PolarHBondContact O-N 3.38Å; E187-L189 VanDerWaalsContact C-N 3.33Å; E187-L189 PolarHBondContact O-N 2.84Å; L189-L192 PolarHBondContact O-N 3.3Å; L189-Y193 HydrophobicContact CD1-CD2 4.23Å; L189-Y193 HydrophobicContact CD1-CE2 3.67Å; L189-Y193 HydrophobicContact CD2-CE2 3.89Å; L189-Y193 HydrophobicContact CG-CD2 3.92Å; L189-Y193 HydrophobicContact CG-CE2 3.47Å; L189-Y193 VanDerWaalsContact CG-CE2 3.47Å; L189-Y193 VanDerWaalsContact O-CD2 3.25Å; L189-Y193 WeakPolarHBondContact O-CD2 3.39Å; L189-Y193 PolarHBondContact O-N 3.06Å
190	M	82.3	Confident	80.3	Confident	130 Å²	130	83.6 Å²	83.6	64%	0.64	42%	0.415	S	S	*	.	H	α-helix	trans	-63.1	-45.8	172.9	-169.7	174.7	-78.7	0	0	111.2	E187 K188 L192 Y193 E194	E187-M190 WeakPolarHBondContact O-CB 3.46Å; E187-M190 PolarHBondContact O-N 2.97Å; K188-M190 PolarHBondContact O-N 3.25Å; M190-L192 VanDerWaalsContact C-N 3.31Å; M190-L192 PolarHBondContact O-N 3.43Å; M190-Y193 PolarHBondContact O-N 3.19Å; M190-E194 WeakPolarHBondContact O-CG 3.21Å; M190-E194 PolarHBondContact O-N 2.92Å
191	E	81.9	Confident	79.4	Confident	83 Å²	83	85.1 Å²	85.1	39%	0.388	43%	0.427	S	S	.	.	H	α-helix	trans	-59.9	-37.8	175.6	-66.5	-170.5	170.1	0	0	113.2	E187 K188 R195	E187-E191 PolarHBondContact O-N 3.12Å; K188-E191 PolarHBondContact O-N 2.73Å; E191-R195 WeakPolarHBondContact O-CB 3.25Å; E191-R195 PolarHBondContact O-N 3.33Å; E191-R195 VanDerWaalsContact O-N 3.08Å
192	L	83.4	Confident	78.7	Confident	24 Å²	24	84.5 Å²	84.5	13%	0.126	43%	0.43	C	S	.	.	H	α-helix	trans	-69.1	-41.2	176.4	-73	178.2	0	0	0	112	L172 E175 A176 L179 K188 L189 M190 R195 L196	L172-L192 HydrophobicContact CD2-CD2 3.74Å; E175-L192 HydrophobicContact CB-CD1 4.2Å; E175-L192 HydrophobicContact CG-CD1 3.66Å; A176-L192 HydrophobicContact CB-CB 4.3Å; A176-L192 HydrophobicContact CB-CD1 4.2Å; L179-L192 HydrophobicContact CD1-CD1 3.64Å; K188-L192 WeakPolarHBondContact O-CG 3.47Å; K188-L192 PolarHBondContact O-N 3.22Å; L189-L192 PolarHBondContact O-N 3.3Å; M190-L192 VanDerWaalsContact C-N 3.31Å; M190-L192 PolarHBondContact O-N 3.43Å; L192-R195 PolarHBondContact O-N 3.15Å; L192-L196 WeakPolarHBondContact O-CG 3.4Å; L192-L196 PolarHBondContact O-N 3.1Å
193	Y	85.6	Confident	78.4	Confident	122 Å²	122	85.6 Å²	85.6	48%	0.478	43%	0.432	S	S	.	.	H	α-helix	trans	-65.2	-42.9	175.5	-74.4	-45.5	0	0	0	112.2	A176 L189 M190 R195 L196 E197	A176-Y193 HydrophobicContact CB-CE1 4.32Å; L189-Y193 HydrophobicContact CD1-CD2 4.23Å; L189-Y193 HydrophobicContact CD1-CE2 3.67Å; L189-Y193 HydrophobicContact CD2-CE2 3.89Å; L189-Y193 HydrophobicContact CG-CD2 3.92Å; L189-Y193 HydrophobicContact CG-CE2 3.47Å; L189-Y193 VanDerWaalsContact CG-CE2 3.47Å; L189-Y193 VanDerWaalsContact O-CD2 3.25Å; L189-Y193 WeakPolarHBondContact O-CD2 3.39Å; L189-Y193 PolarHBondContact O-N 3.06Å; M190-Y193 PolarHBondContact O-N 3.19Å; Y193-R195 PolarHBondContact O-N 2.94Å; Y193-L196 HydrophobicContact CD1-CD1 4.3Å; Y193-L196 PolarHBondContact O-N 3.04Å; Y193-E197 WeakPolarHBondContact O-CB 3.42Å; Y193-E197 PolarHBondContact O-N 3.15Å
194	E	84.6	Confident	78.6	Confident	111 Å²	111	81.8 Å²	81.8	52%	0.519	41%	0.413	S	S	.	.	H	α-helix	trans	-56.5	-40.4	172.6	-74.1	-178.1	-179.9	0	0	111.1	M190 E198	M190-E194 WeakPolarHBondContact O-CG 3.21Å; M190-E194 PolarHBondContact O-N 2.92Å; E194-E198 WeakPolarHBondContact O-CB 3.29Å; E194-E198 WeakPolarHBondContact O-CG 3.35Å; E194-E198 PolarHBondContact O-N 3.43Å
195	R	83.6	Confident	79.1	Confident	10 Å²	10	84.1 Å²	84.1	4%	0.038	41%	0.412	C	S	.	.	H	α-helix	trans	-70.3	-38.6	177.9	-170.1	175.7	173.7	-165.4	-9.8	113	D143 L172 E191 L192 Y193 E198 L199 I245 R246	D143-R195 IonicContact OD1-CZ 3.46Å; D143-R195 IonicContact OD1-NH1 3.82Å; D143-R195 PolarHBondContact OD1-NH1 3.01Å; D143-R195 IonicContact OD2-CZ 3.53Å; D143-R195 IonicContact OD2-NH1 3.84Å; D143-R195 PolarHBondContact OD2-NH1 3.47Å; D143-R195 IonicContact OD2-NH2 3.35Å; D143-R195 PolarHBondContact OD2-NH2 3.44Å; L172-R195 HydrophobicContact CD1-CG 4.07Å; E191-R195 WeakPolarHBondContact O-CB 3.25Å; E191-R195 PolarHBondContact O-N 3.33Å; E191-R195 VanDerWaalsContact O-N 3.08Å; L192-R195 PolarHBondContact O-N 3.15Å; Y193-R195 PolarHBondContact O-N 2.94Å; R195-E198 WeakPolarHBondContact O-CB 3.26Å; R195-E198 PolarHBondContact O-N 3.25Å; R195-L199 HydrophobicContact CG-CD1 4.47Å; R195-L199 VanDerWaalsContact O-CG 3.28Å; R195-L199 WeakPolarHBondContact O-CG 3.36Å; R195-L199 PolarHBondContact O-N 2.97Å; R195-L199 VanDerWaalsContact O-N 3.16Å; R195-I245 PolarHBondContact NE-O 2.77Å; R195-I245 PolarHBondContact NH2-O 3.04Å; R195-R246 PolarHBondContact NE-O 3.41Å
196	L	83.7	Confident	79.8	Confident	24 Å²	24	78.9 Å²	78.9	13%	0.126	39%	0.388	C	S	.	.	H	α-helix	trans	-66.2	-40.5	175.2	-75.8	169.8	0	0	0	111.3	R169 L172 E173 A176 L192 Y193 E198 L199 D200	R169-L196 HydrophobicContact CG-CD2 4.14Å; L172-L196 HydrophobicContact CB-CD2 3.69Å; L172-L196 HydrophobicContact CB-CG 4.2Å; L172-L196 HydrophobicContact CD1-CD2 4.5Å; E173-L196 HydrophobicContact CG-CD1 4.09Å; E173-L196 HydrophobicContact CG-CD2 3.65Å; A176-L196 HydrophobicContact CB-CD1 4.21Å; L192-L196 WeakPolarHBondContact O-CG 3.4Å; L192-L196 PolarHBondContact O-N 3.1Å; Y193-L196 HydrophobicContact CD1-CD1 4.3Å; Y193-L196 PolarHBondContact O-N 3.04Å; L196-E198 VanDerWaalsContact C-N 3.35Å; L196-L199 PolarHBondContact O-N 3.31Å; L196-D200 PolarHBondContact O-N 3.15Å
197	E	82.8	Confident	80.4	Confident	145 Å²	145	79.3 Å²	79.3	68%	0.678	39%	0.386	S	S	*	.	H	α-helix	trans	-63.9	-40.1	174.2	-171.2	-179.5	-178.4	0	0	111.4	Y193 L199 D200	Y193-E197 WeakPolarHBondContact O-CB 3.42Å; Y193-E197 PolarHBondContact O-N 3.15Å; E197-L199 PolarHBondContact O-N 2.75Å; E197-D200 WeakPolarHBondContact O-CB 3.27Å; E197-D200 PolarHBondContact O-N 2.76Å
198	E	77.5	Confident	81	Confident	87 Å²	87	71.2 Å²	71.2	41%	0.407	35%	0.348	S	S	.	.	H	α-helix	trans	-62.9	-27.1	174.1	-94	-167.4	-156.8	0	0	114.3	E194 R195 L196 D200 R207	E194-E198 WeakPolarHBondContact O-CB 3.29Å; E194-E198 WeakPolarHBondContact O-CG 3.35Å; E194-E198 PolarHBondContact O-N 3.43Å; R195-E198 WeakPolarHBondContact O-CB 3.26Å; R195-E198 PolarHBondContact O-N 3.25Å; L196-E198 VanDerWaalsContact C-N 3.35Å; E198-D200 VanDerWaalsContact C-N 3.33Å; E198-R207 PolarHBondContact O-NH1 3.19Å; E198-R207 IonicContact OE2-CZ 3.86Å; E198-R207 IonicContact OE2-NH1 2.87Å; E198-R207 PolarHBondContact OE2-NH1 2.88Å; E198-R207 IonicContact OE2-NH2 3.26Å; E198-R207 PolarHBondContact OE2-NH2 3.08Å
199	L	78.6	Confident	81.9	Confident	10 Å²	10	70.5 Å²	70.5	5%	0.052	35%	0.348	C	S	.	.	T	Hydrogen-bonded Turn	trans	-89	-2.3	176.1	-67	169.9	0	0	0	112.2	V165 L172 R195 L196 E197 F244	V165-L199 HydrophobicContact CG2-CD2 4.23Å; L172-L199 HydrophobicContact CD1-CD1 3.51Å; R195-L199 HydrophobicContact CG-CD1 4.47Å; R195-L199 VanDerWaalsContact O-CG 3.28Å; R195-L199 WeakPolarHBondContact O-CG 3.36Å; R195-L199 PolarHBondContact O-N 2.97Å; R195-L199 VanDerWaalsContact O-N 3.16Å; L196-L199 PolarHBondContact O-N 3.31Å; E197-L199 PolarHBondContact O-N 2.75Å; L199-F244 HydrophobicContact CD2-CD1 4.35Å; L199-F244 HydrophobicContact CD2-CE1 3.97Å
200	D	74.3	Confident	82.4	Confident	74 Å²	74	75 Å²	75	40%	0.396	36%	0.364	S	S	.	.	S	Bend	trans	-72.5	152.1	-177	-153.4	4.2	0	0	0	112.7	L196 E197 E198 D202 A204	L196-D200 PolarHBondContact O-N 3.15Å; E197-D200 WeakPolarHBondContact O-CB 3.27Å; E197-D200 PolarHBondContact O-N 2.76Å; E198-D200 VanDerWaalsContact C-N 3.33Å; D200-D202 PolarHBondContact O-N 2.78Å; D200-A204 WeakPolarHBondContact O-CB 3.36Å; D200-A204 PolarHBondContact O-N 3.3Å
201	A	66	Low	83	Confident	67 Å²	67	68.9 Å²	68.9	55%	0.554	33%	0.334	S	S	*	.	H	α-helix	trans	-65.3	-37.9	-159.2	0	0	0	0	0	113.8	K203 A204	A201-K203 PolarHBondContact O-N 2.69Å; A201-K203 VanDerWaalsContact O-N 3.09Å; A201-A204 PolarHBondContact O-N 3.03Å; A201-A204 VanDerWaalsContact O-N 3.14Å
202	D	70.4	Confident	83.6	Confident	158 Å²	158	64.9 Å²	64.9	85%	0.845	32%	0.315	S	S	*	.	H	α-helix	trans	-60.8	-28.8	-168.9	-70.5	-9.5	0	0	0	113.4	D200	D200-D202 PolarHBondContact O-N 2.78Å
203	K	76.5	Confident	84.1	Confident	161 Å²	161	66.3 Å²	66.3	70%	0.7	32%	0.321	S	S	*	.	H	α-helix	trans	-114.3	-6.4	177.6	-64.9	177.5	-174.9	166.3	0	113.5	A201 E205 M206 R207	A201-K203 PolarHBondContact O-N 2.69Å; A201-K203 VanDerWaalsContact O-N 3.09Å; K203-E205 PolarHBondContact O-N 2.96Å; K203-M206 PolarHBondContact O-N 3.44Å; K203-R207 WeakPolarHBondContact O-CB 3.35Å; K203-R207 PolarHBondContact O-N 2.78Å
204	A	82.4	Confident	84.4	Confident	9 Å²	9	60.8 Å²	60.8	7%	0.074	30%	0.302	C	S	.	.	H	α-helix	trans	-58.6	-47.5	-176.3	0	0	0	0	0	111.9	D200 A201 R207 A208 F244	D200-A204 WeakPolarHBondContact O-CB 3.36Å; D200-A204 PolarHBondContact O-N 3.3Å; A201-A204 PolarHBondContact O-N 3.03Å; A201-A204 VanDerWaalsContact O-N 3.14Å; A204-R207 PolarHBondContact O-N 2.78Å; A204-A208 VanDerWaalsContact O-CB 3.26Å; A204-A208 WeakPolarHBondContact O-CB 3.41Å; A204-A208 PolarHBondContact O-N 2.85Å; A204-F244 HydrophobicContact CB-CE2 4.43Å; A204-F244 HydrophobicContact CB-CZ 3.92Å; A204-F244 WeakPolarHBondContact O-CE2 3.45Å
205	E	86.5	Confident	84.8	Confident	119 Å²	119	55.5 Å²	55.5	56%	0.556	28%	0.277	S	S	*	.	H	α-helix	trans	-64.7	-44.6	-178.1	-169.5	177.6	175.1	0	0	112	L159 M163 K203 R207 A208 S209	L159-E205 HydrophobicContact CD1-CG 4.2Å; L159-E205 HydrophobicContact CD2-CG 3.83Å; L159-E205 WeakPolarHBondContact CD2-OE1 3.5Å; L159-E205 HydrophobicContact CG-CG 4.27Å; M163-E205 VanDerWaalsContact SD-CA 3.53Å; M163-E205 HydrophobicContact SD-CB 3.8Å; M163-E205 HydrophobicContact SD-CG 4.08Å; K203-E205 PolarHBondContact O-N 2.96Å; E205-R207 VanDerWaalsContact C-N 3.35Å; E205-R207 PolarHBondContact O-N 3.37Å; E205-A208 PolarHBondContact O-N 3.25Å; E205-S209 WeakPolarHBondContact O-CB 3.49Å; E205-S209 PolarHBondContact O-N 3Å
206	M	87.3	Confident	85.2	Confident	74 Å²	74	56.4 Å²	56.4	37%	0.365	29%	0.289	S	S	.	.	H	α-helix	trans	-61.9	-44	177.9	-173.2	-174.2	-68.9	0	0	111.2	K203 R210	K203-M206 PolarHBondContact O-N 3.44Å; M206-R210 WeakPolarHBondContact O-CB 3.41Å; M206-R210 PolarHBondContact O-N 2.8Å
207	R	88.4	Confident	85.6	Confident	39 Å²	39	55.3 Å²	55.3	15%	0.147	28%	0.283	C	S	.	.	H	α-helix	trans	-65.5	-46.1	177.2	179.1	-176.5	167.6	167.5	2.3	111.6	E198 K203 A204 E205 S209 R210 I211 F244	E198-R207 PolarHBondContact O-NH1 3.19Å; E198-R207 IonicContact OE2-CZ 3.86Å; E198-R207 IonicContact OE2-NH1 2.87Å; E198-R207 PolarHBondContact OE2-NH1 2.88Å; E198-R207 IonicContact OE2-NH2 3.26Å; E198-R207 PolarHBondContact OE2-NH2 3.08Å; K203-R207 WeakPolarHBondContact O-CB 3.35Å; K203-R207 PolarHBondContact O-N 2.78Å; A204-R207 PolarHBondContact O-N 2.78Å; E205-R207 VanDerWaalsContact C-N 3.35Å; E205-R207 PolarHBondContact O-N 3.37Å; R207-S209 VanDerWaalsContact C-N 3.35Å; R207-S209 PolarHBondContact O-N 3.43Å; R207-R210 WeakPolarHBondContact O-CB 3.03Å; R207-R210 PolarHBondContact O-N 3.22Å; R207-I211 HydrophobicContact CG-CD1 4.04Å; R207-I211 WeakPolarHBondContact O-CG1 3.41Å; R207-I211 PolarHBondContact O-N 2.91Å; R207-F244 HydrophobicContact CB-CE2 4.16Å; R207-F244 HydrophobicContact CG-CD2 4Å; R207-F244 HydrophobicContact CG-CE2 4.05Å; R207-F244 PolarHBondContact NH2-O 3.17Å
208	A	91.2	Very high	86	Confident	0 Å²	0	51.5 Å²	51.5	0%	0	27%	0.27	C	S	.	.	H	α-helix	trans	-61.6	-44.3	178	0	0	0	0	0	111.3	L159 V162 M163 A204 E205 I211 L212 F244	L159-A208 HydrophobicContact CD1-CB 3.78Å; V162-A208 HydrophobicContact CB-CB 4.18Å; V162-A208 HydrophobicContact CG1-CB 3.68Å; M163-A208 HydrophobicContact CG-CB 3.8Å; A204-A208 VanDerWaalsContact O-CB 3.26Å; A204-A208 WeakPolarHBondContact O-CB 3.41Å; A204-A208 PolarHBondContact O-N 2.85Å; E205-A208 PolarHBondContact O-N 3.25Å; A208-I211 PolarHBondContact O-N 2.82Å; A208-L212 WeakPolarHBondContact O-CB 3.48Å; A208-L212 WeakPolarHBondContact O-CG 3.35Å; A208-L212 PolarHBondContact O-N 3.25Å; A208-F244 HydrophobicContact CB-CD2 4.18Å; A208-F244 HydrophobicContact CB-CE2 4.13Å
209	S	92.2	Very high	86.6	Confident	22 Å²	22	50.9 Å²	50.9	15%	0.154	27%	0.273	C	S	.	.	H	α-helix	trans	-61.5	-42.2	175.3	179.3	0	0	0	0	112.3	E205 R207 L212 H213 Q222	E205-S209 WeakPolarHBondContact O-CB 3.49Å; E205-S209 PolarHBondContact O-N 3Å; R207-S209 VanDerWaalsContact C-N 3.35Å; R207-S209 PolarHBondContact O-N 3.43Å; S209-L212 PolarHBondContact O-N 3.35Å; S209-H213 VanDerWaalsContact O-CB 3.29Å; S209-H213 WeakPolarHBondContact O-CB 3.38Å; S209-H213 PolarHBondContact O-N 3.26Å; S209-Q222 PolarHBondContact O-NE2 3.31Å; S209-Q222 VanDerWaalsContact O-NE2 3.13Å; S209-Q222 PolarHBondContact OG-OE1 2.91Å; S209-Q222 VanDerWaalsContact OG-OE1 3.08Å
210	R	92	Very high	87.2	Confident	105 Å²	105	53.5 Å²	53.5	40%	0.396	30%	0.297	S	S	.	.	H	α-helix	trans	-60.2	-48.7	174.9	-174.8	-167.5	76.9	-175.6	7.5	111.8	M206 R207 H213 G214 E270	M206-R210 WeakPolarHBondContact O-CB 3.41Å; M206-R210 PolarHBondContact O-N 2.8Å; R207-R210 WeakPolarHBondContact O-CB 3.03Å; R207-R210 PolarHBondContact O-N 3.22Å; R210-H213 PolarHBondContact O-N 2.95Å; R210-G214 PolarHBondContact O-N 3.39Å; R210-E270 IonicContact CZ-OE1 3.6Å; R210-E270 IonicContact NE-OE1 3.51Å; R210-E270 IonicContact NH2-OE1 2.79Å; R210-E270 PolarHBondContact NH2-OE1 3.27Å
211	I	93.9	Very high	88	Confident	2 Å²	2	52.1 Å²	52.1	1%	0.01	29%	0.288	C	S	.	.	H	α-helix	trans	-62	-46.4	179.7	-69.1	169.8	0	0	0	110.4	R207 A208 H213 G214 L215 A240 L243 F244 W266	R207-I211 HydrophobicContact CG-CD1 4.04Å; R207-I211 WeakPolarHBondContact O-CG1 3.41Å; R207-I211 PolarHBondContact O-N 2.91Å; A208-I211 PolarHBondContact O-N 2.82Å; I211-H213 PolarHBondContact O-N 3.46Å; I211-G214 PolarHBondContact O-N 3.36Å; I211-L215 HydrophobicContact CG2-CD1 4.26Å; I211-L215 WeakPolarHBondContact O-CG 3.34Å; I211-L215 PolarHBondContact O-N 3.22Å; I211-A240 HydrophobicContact CG2-CB 3.71Å; I211-L243 HydrophobicContact CD1-CB 4.37Å; I211-L243 HydrophobicContact CG2-CB 4.19Å; I211-L243 HydrophobicContact CG2-CD1 4.2Å; I211-F244 HydrophobicContact CD1-CB 4.01Å; I211-F244 HydrophobicContact CD1-CD2 4.18Å; I211-W266 HydrophobicContact CB-CH2 4.09Å; I211-W266 HydrophobicContact CG1-CH2 4.2Å; I211-W266 HydrophobicContact CG1-CZ2 4.48Å; I211-W266 HydrophobicContact CG2-CH2 3.91Å
212	L	94.8	Very high	89.3	Confident	0 Å²	0	49.3 Å²	49.3	0%	0	26%	0.264	C	S	.	.	H	α-helix	trans	-62.1	-43.5	176.8	-75.5	169.3	0	0	0	111.5	P158 L159 V162 A208 S209 G214 L215 G216 F217 Q222 V237 A240	P158-L212 HydrophobicContact CB-CD1 3.98Å; P158-L212 HydrophobicContact CB-CD2 4.01Å; L159-L212 HydrophobicContact CB-CD1 4.23Å; L159-L212 HydrophobicContact CD1-CD1 4.2Å; V162-L212 HydrophobicContact CG2-CD1 4.15Å; V162-L212 HydrophobicContact CG2-CD2 4.03Å; V162-L212 HydrophobicContact CG2-CG 4.14Å; A208-L212 WeakPolarHBondContact O-CB 3.48Å; A208-L212 WeakPolarHBondContact O-CG 3.35Å; A208-L212 PolarHBondContact O-N 3.25Å; S209-L212 PolarHBondContact O-N 3.35Å; L212-G214 PolarHBondContact O-N 2.91Å; L212-L215 CarbonylContact O-C 3.08Å; L212-L215 PolarHBondContact O-N 3.41Å; L212-G216 PolarHBondContact O-N 3.34Å; L212-F217 HydrophobicContact CB-CB 4.03Å; L212-F217 HydrophobicContact CB-CD2 4.21Å; L212-F217 HydrophobicContact CB-CG 4.3Å; L212-F217 HydrophobicContact CD2-CD2 3.72Å; L212-F217 HydrophobicContact CD2-CE2 3.84Å; L212-F217 HydrophobicContact CD2-CG 4.12Å; L212-F217 HydrophobicContact CD2-CZ 4.37Å; L212-F217 VanDerWaalsContact O-CB 3.31Å; L212-F217 WeakPolarHBondContact O-CB 3.41Å; L212-F217 VanDerWaalsContact O-CD2 3.3Å; L212-F217 WeakPolarHBondContact O-CD2 3.35Å; L212-F217 PolarHBondContact O-N 2.78Å; L212-Q222 HydrophobicContact CB-CG 4.14Å; L212-Q222 HydrophobicContact CD1-CG 4.24Å; L212-V237 HydrophobicContact CD2-CG2 4.44Å; L212-A240 HydrophobicContact CD2-CB 3.72Å; L212-A240 HydrophobicContact CG-CB 4.26Å
213	H	93.5	Very high	90.3	Very high	53 Å²	53	50.1 Å²	50.1	25%	0.245	26%	0.255	C	S	.	.	H	α-helix	trans	-59.4	-46.8	176.8	-174.2	-86.2	0	0	0	112	S209 R210 I211 L215 G216 F217 E612 L616	S209-H213 VanDerWaalsContact O-CB 3.29Å; S209-H213 WeakPolarHBondContact O-CB 3.38Å; S209-H213 PolarHBondContact O-N 3.26Å; R210-H213 PolarHBondContact O-N 2.95Å; I211-H213 PolarHBondContact O-N 3.46Å; H213-L215 PolarHBondContact O-N 3.46Å; H213-G216 WeakPolarHBondContact O-CA 3.25Å; H213-G216 PolarHBondContact O-N 3.02Å; H213-F217 WeakPolarHBondContact CA-O 3.5Å; H213-E612 IonicContact CE1-OE2 2.77Å; H213-E612 PolarHBondContact CE1-OE2 3.21Å; H213-L616 HydrophobicContact CB-CD2 4.37Å
214	G	92.4	Very high	91.1	Very high	7 Å²	7	47 Å²	47	7%	0.072	24%	0.241	C	C	.	.	H	α-helix	trans	-61.2	-31.8	176.6	0	0	0	0	0	113.9	R210 I211 L212 G216	R210-G214 PolarHBondContact O-N 3.39Å; I211-G214 PolarHBondContact O-N 3.36Å; L212-G214 PolarHBondContact O-N 2.91Å; G214-G216 PolarHBondContact O-N 3.49Å
215	L	93.4	Very high	91.7	Very high	0 Å²	0	50.8 Å²	50.8	0%	0	26%	0.256	C	S	.	.	T	Hydrogen-bonded Turn	trans	-82.6	13.7	170.9	-64.5	173.9	0	0	0	113.6	I211 L212 H213 F217 R236 L239 A240 L243 L259 W266	I211-L215 HydrophobicContact CG2-CD1 4.26Å; I211-L215 WeakPolarHBondContact O-CG 3.34Å; I211-L215 PolarHBondContact O-N 3.22Å; L212-L215 CarbonylContact O-C 3.08Å; L212-L215 PolarHBondContact O-N 3.41Å; H213-L215 PolarHBondContact O-N 3.46Å; L215-F217 HydrophobicContact CB-CD2 4.42Å; L215-R236 WeakPolarHBondContact CD1-O 3.3Å; L215-R236 VanDerWaalsContact O-CD 3.27Å; L215-R236 WeakPolarHBondContact O-CD 3.28Å; L215-R236 PolarHBondContact O-NH1 2.76Å; L215-L239 HydrophobicContact CD1-CB 4.43Å; L215-L239 HydrophobicContact CD1-CD2 4.39Å; L215-L239 HydrophobicContact CD1-CG 4.29Å; L215-L239 HydrophobicContact CD2-CD2 3.93Å; L215-A240 HydrophobicContact CD1-CB 3.7Å; L215-L243 HydrophobicContact CD1-CD1 4.39Å; L215-L259 HydrophobicContact CD2-CD1 4.39Å; L215-L259 HydrophobicContact CD2-CD2 4.37Å; L215-W266 HydrophobicContact CD1-CZ3 4.38Å; L215-W266 HydrophobicContact CD2-CE3 3.88Å; L215-W266 HydrophobicContact CD2-CZ3 3.71Å; L215-W266 HydrophobicContact CG-CE3 4.07Å; L215-W266 HydrophobicContact CG-CH2 4.45Å; L215-W266 HydrophobicContact CG-CZ3 3.62Å
216	G	91.2	Very high	92	Very high	28 Å²	28	45.1 Å²	45.1	29%	0.289	23%	0.23	S	C	.	.	T	Hydrogen-bonded Turn	trans	90.1	8.5	172.7	0	0	0	0	0	116	L212 H213 G214 T218	L212-G216 PolarHBondContact O-N 3.34Å; H213-G216 WeakPolarHBondContact O-CA 3.25Å; H213-G216 PolarHBondContact O-N 3.02Å; G214-G216 PolarHBondContact O-N 3.49Å; G216-T218 PolarHBondContact O-N 2.96Å
217	F	92.7	Very high	92.2	Very high	1 Å²	1	46.5 Å²	46.5	0%	0.004	23%	0.234	C	C	.	.			trans	-82.2	113.8	176.1	-69.8	-98.5	0	0	0	111.9	P158 L212 H213 L215 M221 Q222 F229 W233 R236 V237	P158-F217 HydrophobicContact CB-CD1 4.35Å; P158-F217 HydrophobicContact CB-CE1 4.2Å; P158-F217 HydrophobicContact CG-CD1 4.19Å; P158-F217 HydrophobicContact CG-CE1 3.92Å; L212-F217 HydrophobicContact CB-CB 4.03Å; L212-F217 HydrophobicContact CB-CD2 4.21Å; L212-F217 HydrophobicContact CB-CG 4.3Å; L212-F217 HydrophobicContact CD2-CD2 3.72Å; L212-F217 HydrophobicContact CD2-CE2 3.84Å; L212-F217 HydrophobicContact CD2-CG 4.12Å; L212-F217 HydrophobicContact CD2-CZ 4.37Å; L212-F217 VanDerWaalsContact O-CB 3.31Å; L212-F217 WeakPolarHBondContact O-CB 3.41Å; L212-F217 VanDerWaalsContact O-CD2 3.3Å; L212-F217 WeakPolarHBondContact O-CD2 3.35Å; L212-F217 PolarHBondContact O-N 2.78Å; H213-F217 WeakPolarHBondContact CA-O 3.5Å; L215-F217 HydrophobicContact CB-CD2 4.42Å; F217-M221 HydrophobicContact CD1-CB 4.18Å; F217-Q222 HydrophobicContact CB-CG 3.75Å; F217-Q222 PolarHBondContact O-NE2 3.34Å; F217-F229 HydrophobicContact CD1-CE1 4.33Å; F217-F229 HydrophobicContact CD1-CZ 4.31Å; F217-F229 HydrophobicContact CE1-CD1 4.44Å; F217-F229 AromaticContact CE1-CE1 3.94Å; F217-F229 HydrophobicContact CE1-CE1 3.94Å; F217-F229 HydrophobicContact CE1-CZ 4.07Å; F217-W233 HydrophobicContact CD1-CE3 4.16Å; F217-W233 HydrophobicContact CD1-CZ3 4.26Å; F217-W233 HydrophobicContact CD2-CE3 4.37Å; F217-W233 HydrophobicContact CD2-CZ3 4.17Å; F217-W233 AromaticContact CE1-CE3 3.7Å; F217-W233 HydrophobicContact CE1-CE3 3.7Å; F217-W233 HydrophobicContact CE1-CZ3 4.24Å; F217-W233 AromaticContact CE2-CE3 3.96Å; F217-W233 HydrophobicContact CE2-CE3 3.96Å; F217-W233 HydrophobicContact CE2-CZ3 4.18Å; F217-W233 HydrophobicContact CG-CE3 4.47Å; F217-W233 HydrophobicContact CG-CZ3 4.22Å; F217-W233 AromaticContact CZ-CE3 3.58Å; F217-W233 HydrophobicContact CZ-CE3 3.58Å; F217-W233 HydrophobicContact CZ-CZ3 4.19Å; F217-W233 WeakPolarHBondContact CZ-O 3.36Å; F217-R236 HydrophobicContact CE2-CB 3.66Å; F217-R236 HydrophobicContact CZ-CB 4.09Å; F217-V237 HydrophobicContact CE1-CG2 3.86Å; F217-V237 HydrophobicContact CE2-CG2 4.1Å; F217-V237 HydrophobicContact CZ-CG2 3.33Å
218	T	90.3	Very high	92.4	Very high	66 Å²	66	48.4 Å²	48.4	41%	0.405	25%	0.247	S	C	.	.			trans	-65.6	157.5	169.8	68.3	0	0	0	0	111.7	G216 A220 M221 Q222	G216-T218 PolarHBondContact O-N 2.96Å; T218-A220 PolarHBondContact O-N 2.7Å; T218-A220 VanDerWaalsContact O-N 3.11Å; T218-M221 HydrophobicContact CG2-SD 3.98Å; T218-M221 WeakPolarHBondContact O-CA 3.47Å; T218-M221 WeakPolarHBondContact O-CB 3.36Å; T218-M221 PolarHBondContact O-N 2.96Å; T218-M221 WeakPolarHBondContact OG1-CG 3.49Å; T218-M221 PolarHBondContact OG1-N 3.18Å; T218-M221 PolarHBondContact OG1-SD 3.31Å; T218-M221 VanDerWaalsContact OG1-SD 3.36Å; T218-Q222 WeakPolarHBondContact O-CG 3.41Å; T218-Q222 PolarHBondContact O-N 3.2Å
219	P	90.2	Very high	92.4	Very high	73 Å²	73	49.3 Å²	49.3	47%	0.474	25%	0.251	S	S	.	.	H	α-helix	trans	-54.6	-33.3	176.4	-28.2	35.5	0	0	0	113.9	R223	P219-R223 PolarHBondContact O-NH1 3.23Å; P219-R223 PolarHBondContact O-NH2 2.99Å
220	A	91	Very high	92.2	Very high	66 Å²	66	51.7 Å²	51.7	55%	0.545	27%	0.268	S	S	.	.	H	α-helix	trans	-68.9	-40.9	175.3	0	0	0	0	0	112	T218 R223 K224	T218-A220 PolarHBondContact O-N 2.7Å; T218-A220 VanDerWaalsContact O-N 3.11Å; A220-R223 PolarHBondContact O-N 3.41Å; A220-K224 PolarHBondContact O-N 3Å
221	M	91.6	Very high	91.9	Very high	44 Å²	44	47.5 Å²	47.5	22%	0.217	26%	0.257	C	S	.	.	H	α-helix	trans	-67.3	-38.3	177.6	-69.5	166.7	77.2	0	0	112	F217 T218 R223 K224 F229 W233	F217-M221 HydrophobicContact CD1-CB 4.18Å; T218-M221 HydrophobicContact CG2-SD 3.98Å; T218-M221 WeakPolarHBondContact O-CA 3.47Å; T218-M221 WeakPolarHBondContact O-CB 3.36Å; T218-M221 PolarHBondContact O-N 2.96Å; T218-M221 WeakPolarHBondContact OG1-CG 3.49Å; T218-M221 PolarHBondContact OG1-N 3.18Å; T218-M221 PolarHBondContact OG1-SD 3.31Å; T218-M221 VanDerWaalsContact OG1-SD 3.36Å; M221-R223 PolarHBondContact O-N 3.15Å; M221-R223 VanDerWaalsContact O-N 3.09Å; M221-K224 WeakPolarHBondContact O-CB 3.3Å; M221-K224 PolarHBondContact O-N 3.25Å; M221-F229 HydrophobicContact CB-CE1 4.24Å; M221-F229 HydrophobicContact CB-CZ 3.95Å; M221-F229 HydrophobicContact CE-CE1 3.73Å; M221-F229 HydrophobicContact CG-CE1 4.46Å; M221-F229 WeakPolarHBondContact O-CZ 3.24Å; M221-W233 HydrophobicContact CE-CD2 4.04Å; M221-W233 HydrophobicContact CE-CE3 3.79Å; M221-W233 HydrophobicContact CE-CH2 3.34Å; M221-W233 HydrophobicContact CE-CZ2 3.57Å; M221-W233 HydrophobicContact CE-CZ3 3.44Å; M221-W233 VanDerWaalsContact CE-CZ3 3.44Å; M221-W233 HydrophobicContact SD-CH2 4.48Å
222	Q	92.4	Very high	91.6	Very high	9 Å²	9	48.1 Å²	48.1	4%	0.042	26%	0.264	C	S	.	.	H	α-helix	trans	-60.1	-21.1	176.9	-65.9	-175.8	21.1	0	0	113.2	T157 S209 L212 F217 T218	T157-Q222 WeakPolarHBondContact CB-O 3.49Å; S209-Q222 PolarHBondContact O-NE2 3.31Å; S209-Q222 VanDerWaalsContact O-NE2 3.13Å; S209-Q222 PolarHBondContact OG-OE1 2.91Å; S209-Q222 VanDerWaalsContact OG-OE1 3.08Å; L212-Q222 HydrophobicContact CB-CG 4.14Å; L212-Q222 HydrophobicContact CD1-CG 4.24Å; F217-Q222 HydrophobicContact CB-CG 3.75Å; F217-Q222 PolarHBondContact O-NE2 3.34Å; T218-Q222 WeakPolarHBondContact O-CG 3.41Å; T218-Q222 PolarHBondContact O-N 3.2Å
223	R	91.8	Very high	91.4	Very high	175 Å²	175	50.5 Å²	50.5	66%	0.66	27%	0.273	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97	-7	176	-66	-175.3	-71.1	-92.5	3.7	114.1	P219 A220 M221	P219-R223 PolarHBondContact O-NH1 3.23Å; P219-R223 PolarHBondContact O-NH2 2.99Å; A220-R223 PolarHBondContact O-N 3.41Å; M221-R223 PolarHBondContact O-N 3.15Å; M221-R223 VanDerWaalsContact O-N 3.09Å
224	K	93.8	Very high	91.4	Very high	94 Å²	94	49.7 Å²	49.7	41%	0.409	27%	0.268	S	S	.	.	S	Bend	trans	-78.3	155.2	176.4	-162.4	-172	-170.7	-157.6	0	109.9	T157 P158 A220 M221 D228 F229	T157-K224 WeakPolarHBondContact CA-O 3.46Å; P158-K224 WeakPolarHBondContact CD-O 3.46Å; A220-K224 PolarHBondContact O-N 3Å; M221-K224 WeakPolarHBondContact O-CB 3.3Å; M221-K224 PolarHBondContact O-N 3.25Å; K224-D228 HydrophobicContact CD-CB 3.92Å; K224-D228 HydrophobicContact CG-CB 4.18Å; K224-D228 VanDerWaalsContact NZ-CB 3.31Å; K224-D228 PolarHBondContact NZ-O 2.93Å; K224-F229 HydrophobicContact CB-CE2 3.8Å; K224-F229 HydrophobicContact CB-CZ 3.98Å; K224-F229 HydrophobicContact CD-CE2 4.17Å; K224-F229 HydrophobicContact CD-CZ 4.19Å; K224-F229 HydrophobicContact CG-CE2 4.27Å
225	K	94.8	Very high	91.4	Very high	89 Å²	89	52 Å²	52	39%	0.387	28%	0.277	S	S	.	.			trans	-74.7	142.2	178.1	-61.8	-176.4	164.5	-167.8	0	111.4	D155 K227 D228 F229	D155-K225 HydrophobicContact CB-CD 4.46Å; D155-K225 WeakPolarHBondContact O-CG 3.17Å; D155-K225 WeakPolarHBondContact OD1-CD 3.46Å; D155-K225 IonicContact OD1-NZ 3.91Å; D155-K225 PolarHBondContact OD1-NZ 3.45Å; K225-K227 HydrophobicContact CB-CG 4.14Å; K225-K227 PolarHBondContact O-N 3.42Å; K225-D228 PolarHBondContact O-N 3.29Å; K225-F229 VanDerWaalsContact O-CD2 3.24Å; K225-F229 WeakPolarHBondContact O-CD2 3.4Å
226	L	92.6	Very high	91.5	Very high	0 Å²	0	52.3 Å²	52.3	0%	0	28%	0.278	C	S	.	.	G	3₁₀ helix	trans	-56.3	-35.2	178.2	-92.5	160	0	0	0	113.7	M151 S154 K156 C161 D228 F229 R234 V237	M151-L226 HydrophobicContact CB-CD2 4.27Å; S154-L226 WeakPolarHBondContact O-CB 3.21Å; S154-L226 PolarHBondContact O-N 3.46Å; K156-L226 WeakPolarHBondContact O-CB 3.39Å; K156-L226 PolarHBondContact O-N 3.27Å; C161-L226 HydrophobicContact CB-CD1 3.78Å; C161-L226 WeakPolarHBondContact SG-CD1 2.92Å; L226-D228 PolarHBondContact O-N 2.95Å; L226-F229 WeakPolarHBondContact O-CB 3.41Å; L226-F229 PolarHBondContact O-N 3.28Å; L226-F229 VanDerWaalsContact O-N 3.15Å; L226-R234 HydrophobicContact CD2-CB 4.48Å; L226-R234 HydrophobicContact CD2-CG 3.89Å; L226-V237 HydrophobicContact CD2-CB 4.19Å; L226-V237 HydrophobicContact CD2-CG1 4.3Å; L226-V237 HydrophobicContact CD2-CG2 3.85Å
227	K	93	Very high	91.6	Very high	103 Å²	103	51 Å²	51	45%	0.448	27%	0.265	S	S	.	.	G	3₁₀ helix	trans	-62.6	-20.4	177.7	73.4	-172.7	-171.8	-175	0	114.4	P153 S154 D155 K225 F229	P153-K227 HydrophobicContact CB-CB 3.94Å; S154-K227 PolarHBondContact O-N 2.97Å; D155-K227 WeakPolarHBondContact OD1-CE 3.49Å; D155-K227 IonicContact OD1-NZ 3.87Å; D155-K227 PolarHBondContact OD1-NZ 3.09Å; K225-K227 HydrophobicContact CB-CG 4.14Å; K225-K227 PolarHBondContact O-N 3.42Å; K227-F229 VanDerWaalsContact C-N 3.3Å
228	D	91.3	Very high	91.7	Very high	79 Å²	79	51 Å²	51	42%	0.422	27%	0.266	S	S	.	.	G	3₁₀ helix	trans	-92.6	7.8	-179.9	-49.8	-32.7	0	0	0	112.7	K224 K225 L226	K224-D228 HydrophobicContact CD-CB 3.92Å; K224-D228 HydrophobicContact CG-CB 4.18Å; K224-D228 VanDerWaalsContact NZ-CB 3.31Å; K224-D228 PolarHBondContact NZ-O 2.93Å; K225-D228 PolarHBondContact O-N 3.29Å; L226-D228 PolarHBondContact O-N 2.95Å
229	F	91.2	Very high	92	Very high	19 Å²	19	48.1 Å²	48.1	8%	0.083	25%	0.248	C	C	.	.	S	Bend	trans	-106.6	146.9	176.8	-74.9	-81.8	0	0	0	110.8	P158 F217 M221 K224 K225 L226 K227 W233 R234	P158-F229 HydrophobicContact CG-CE2 3.86Å; P158-F229 HydrophobicContact CG-CZ 4.24Å; F217-F229 HydrophobicContact CD1-CE1 4.33Å; F217-F229 HydrophobicContact CD1-CZ 4.31Å; F217-F229 HydrophobicContact CE1-CD1 4.44Å; F217-F229 AromaticContact CE1-CE1 3.94Å; F217-F229 HydrophobicContact CE1-CE1 3.94Å; F217-F229 HydrophobicContact CE1-CZ 4.07Å; M221-F229 HydrophobicContact CB-CE1 4.24Å; M221-F229 HydrophobicContact CB-CZ 3.95Å; M221-F229 HydrophobicContact CE-CE1 3.73Å; M221-F229 HydrophobicContact CG-CE1 4.46Å; M221-F229 WeakPolarHBondContact O-CZ 3.24Å; K224-F229 HydrophobicContact CB-CE2 3.8Å; K224-F229 HydrophobicContact CB-CZ 3.98Å; K224-F229 HydrophobicContact CD-CE2 4.17Å; K224-F229 HydrophobicContact CD-CZ 4.19Å; K224-F229 HydrophobicContact CG-CE2 4.27Å; K225-F229 VanDerWaalsContact O-CD2 3.24Å; K225-F229 WeakPolarHBondContact O-CD2 3.4Å; L226-F229 WeakPolarHBondContact O-CB 3.41Å; L226-F229 PolarHBondContact O-N 3.28Å; L226-F229 VanDerWaalsContact O-N 3.15Å; K227-F229 VanDerWaalsContact C-N 3.3Å; F229-W233 HydrophobicContact CB-CB 3.77Å; F229-W233 HydrophobicContact CD1-CB 3.59Å; F229-W233 HydrophobicContact CD1-CD2 4.16Å; F229-W233 AromaticContact CD1-CG 3.73Å; F229-W233 HydrophobicContact CD1-CG 3.73Å; F229-W233 HydrophobicContact CE1-CD2 4.45Å; F229-W233 HydrophobicContact CE1-CG 4.47Å; F229-W233 HydrophobicContact CG-CB 4.04Å; F229-R234 HydrophobicContact CB-CG 4.13Å
230	S	87.5	Confident	92.2	Very high	73 Å²	73	44.7 Å²	44.7	51%	0.51	23%	0.225	S	C	.	.			trans	-67	163.4	170.5	70.2	0	0	0	0	111.3	G232 W233 R234	S230-G232 VanDerWaalsContact C-N 3.31Å; S230-G232 PolarHBondContact O-N 3.11Å; S230-W233 PolarHBondContact O-N 3.36Å; S230-W233 VanDerWaalsContact O-N 3.1Å; S230-R234 PolarHBondContact O-N 2.71Å
231	G	86.6	Confident	92.3	Very high	17 Å²	17	43.4 Å²	43.4	18%	0.175	21%	0.206	C	C	.	.	H	α-helix	trans	-52.2	-45.4	177.2	0	0	0	0	0	113.6	E150 W233 R234 M235	E150-G231 WeakPolarHBondContact OE2-CA 3.35Å; E150-G231 VanDerWaalsContact OE2-O 3.07Å; G231-W233 VanDerWaalsContact C-N 3.35Å; G231-W233 PolarHBondContact O-N 2.63Å; G231-R234 CarbonylContact O-C 3.56Å; G231-R234 WeakPolarHBondContact O-CA 3.3Å; G231-R234 WeakPolarHBondContact O-CB 3.34Å; G231-R234 PolarHBondContact O-N 2.98Å; G231-M235 PolarHBondContact O-N 3.16Å
232	G	87	Confident	92.4	Very high	15 Å²	15	41.3 Å²	41.3	16%	0.155	20%	0.196	C	C	.	.	H	α-helix	trans	-57.3	-42.2	176.2	0	0	0	0	0	113.7	S230 M235 R236	S230-G232 VanDerWaalsContact C-N 3.31Å; S230-G232 PolarHBondContact O-N 3.11Å; G232-M235 WeakPolarHBondContact O-CB 3.44Å; G232-M235 PolarHBondContact O-N 2.92Å; G232-R236 WeakPolarHBondContact O-CG 3.37Å; G232-R236 PolarHBondContact O-N 2.75Å
233	W	91.4	Very high	92.4	Very high	50 Å²	50	41.6 Å²	41.6	19%	0.189	20%	0.197	C	C	.	.	H	α-helix	trans	-66.3	-38.8	173.4	-79.4	105.3	0	0	0	111.9	F217 M221 F229 S230 G231 M235 R236 V237	F217-W233 HydrophobicContact CD1-CE3 4.16Å; F217-W233 HydrophobicContact CD1-CZ3 4.26Å; F217-W233 HydrophobicContact CD2-CE3 4.37Å; F217-W233 HydrophobicContact CD2-CZ3 4.17Å; F217-W233 AromaticContact CE1-CE3 3.7Å; F217-W233 HydrophobicContact CE1-CE3 3.7Å; F217-W233 HydrophobicContact CE1-CZ3 4.24Å; F217-W233 AromaticContact CE2-CE3 3.96Å; F217-W233 HydrophobicContact CE2-CE3 3.96Å; F217-W233 HydrophobicContact CE2-CZ3 4.18Å; F217-W233 HydrophobicContact CG-CE3 4.47Å; F217-W233 HydrophobicContact CG-CZ3 4.22Å; F217-W233 AromaticContact CZ-CE3 3.58Å; F217-W233 HydrophobicContact CZ-CE3 3.58Å; F217-W233 HydrophobicContact CZ-CZ3 4.19Å; F217-W233 WeakPolarHBondContact CZ-O 3.36Å; M221-W233 HydrophobicContact CE-CD2 4.04Å; M221-W233 HydrophobicContact CE-CE3 3.79Å; M221-W233 HydrophobicContact CE-CH2 3.34Å; M221-W233 HydrophobicContact CE-CZ2 3.57Å; M221-W233 HydrophobicContact CE-CZ3 3.44Å; M221-W233 VanDerWaalsContact CE-CZ3 3.44Å; M221-W233 HydrophobicContact SD-CH2 4.48Å; F229-W233 HydrophobicContact CB-CB 3.77Å; F229-W233 HydrophobicContact CD1-CB 3.59Å; F229-W233 HydrophobicContact CD1-CD2 4.16Å; F229-W233 AromaticContact CD1-CG 3.73Å; F229-W233 HydrophobicContact CD1-CG 3.73Å; F229-W233 HydrophobicContact CE1-CD2 4.45Å; F229-W233 HydrophobicContact CE1-CG 4.47Å; F229-W233 HydrophobicContact CG-CB 4.04Å; S230-W233 PolarHBondContact O-N 3.36Å; S230-W233 VanDerWaalsContact O-N 3.1Å; G231-W233 VanDerWaalsContact C-N 3.35Å; G231-W233 PolarHBondContact O-N 2.63Å; W233-M235 VanDerWaalsContact C-N 3.28Å; W233-M235 PolarHBondContact O-N 3.02Å; W233-R236 WeakPolarHBondContact O-CB 3.47Å; W233-R236 PolarHBondContact O-N 3.22Å; W233-R236 VanDerWaalsContact O-N 3.15Å; W233-V237 PolarHBondContact O-N 3.42Å; W233-V237 VanDerWaalsContact O-N 3.11Å
234	R	93.4	Very high	92.5	Very high	36 Å²	36	33.3 Å²	33.3	14%	0.136	17%	0.166	C	C	.	.	H	α-helix	trans	-65.5	-31.5	174.5	-66.4	-172.3	-73.6	114	0.4	112.3	E150 M151 L226 F229 S230 G231 V237 A238	E150-R234 HydrophobicContact CB-CB 4.21Å; E150-R234 IonicContact OE1-CZ 3.63Å; E150-R234 IonicContact OE1-NH1 2.86Å; E150-R234 PolarHBondContact OE1-NH1 3.44Å; E150-R234 IonicContact OE1-NH2 3.76Å; E150-R234 PolarHBondContact OE1-NH2 2.9Å; M151-R234 HydrophobicContact CB-CB 4.26Å; M151-R234 PolarHBondContact N-O 3Å; M151-R234 WeakPolarHBondContact O-CB 3.24Å; M151-R234 VanDerWaalsContact O-CD 3.3Å; M151-R234 WeakPolarHBondContact O-CD 3.35Å; M151-R234 PolarHBondContact O-NH1 3.15Å; L226-R234 HydrophobicContact CD2-CB 4.48Å; L226-R234 HydrophobicContact CD2-CG 3.89Å; F229-R234 HydrophobicContact CB-CG 4.13Å; S230-R234 PolarHBondContact O-N 2.71Å; G231-R234 CarbonylContact O-C 3.56Å; G231-R234 WeakPolarHBondContact O-CA 3.3Å; G231-R234 WeakPolarHBondContact O-CB 3.34Å; G231-R234 PolarHBondContact O-N 2.98Å; R234-V237 PolarHBondContact O-N 2.81Å; R234-A238 PolarHBondContact O-N 3.11Å
235	M	92.7	Very high	92.3	Very high	56 Å²	56	29 Å²	29	28%	0.276	15%	0.147	S	C	.	.	H	α-helix	trans	-66.1	-40.8	170.4	-173.6	61.5	84.8	0	0	111.3	L147 E150 G231 G232 W233 V237 A238 L239	L147-M235 HydrophobicContact CD1-SD 4.4Å; L147-M235 HydrophobicContact CG-SD 4.41Å; E150-M235 HydrophobicContact CB-CB 4Å; E150-M235 HydrophobicContact CB-CE 4.09Å; E150-M235 HydrophobicContact CB-SD 4.35Å; G231-M235 PolarHBondContact O-N 3.16Å; G232-M235 WeakPolarHBondContact O-CB 3.44Å; G232-M235 PolarHBondContact O-N 2.92Å; W233-M235 VanDerWaalsContact C-N 3.28Å; W233-M235 PolarHBondContact O-N 3.02Å; M235-V237 VanDerWaalsContact C-N 3.28Å; M235-V237 PolarHBondContact O-N 3.46Å; M235-A238 WeakPolarHBondContact O-CB 3.24Å; M235-A238 PolarHBondContact O-N 3.06Å; M235-A238 VanDerWaalsContact O-N 3.08Å; M235-A238 HydrophobicContact SD-CB 4.43Å; M235-L239 PolarHBondContact O-N 3.28Å
236	R	94.7	Very high	92.1	Very high	5 Å²	5	26.3 Å²	26.3	2%	0.019	14%	0.135	C	C	.	.	H	α-helix	trans	-60.2	-36.9	173.1	-60.4	-166.8	-175.3	-162.3	-2.5	112.3	L215 F217 G232 W233 L239 A240 H258 L259 D260 N432	L215-R236 WeakPolarHBondContact CD1-O 3.3Å; L215-R236 VanDerWaalsContact O-CD 3.27Å; L215-R236 WeakPolarHBondContact O-CD 3.28Å; L215-R236 PolarHBondContact O-NH1 2.76Å; F217-R236 HydrophobicContact CE2-CB 3.66Å; F217-R236 HydrophobicContact CZ-CB 4.09Å; G232-R236 WeakPolarHBondContact O-CG 3.37Å; G232-R236 PolarHBondContact O-N 2.75Å; W233-R236 WeakPolarHBondContact O-CB 3.47Å; W233-R236 PolarHBondContact O-N 3.22Å; W233-R236 VanDerWaalsContact O-N 3.15Å; R236-L239 PolarHBondContact O-N 2.89Å; R236-A240 WeakPolarHBondContact O-CB 3.48Å; R236-A240 PolarHBondContact O-N 2.81Å; R236-H258 VanDerWaalsContact CZ-O 3.3Å; R236-H258 PolarHBondContact NE-O 3.46Å; R236-H258 VanDerWaalsContact NE-O 3.09Å; R236-H258 PolarHBondContact NH2-O 2.88Å; R236-L259 HydrophobicContact CG-CD2 3.64Å; R236-L259 VanDerWaalsContact NH2-CA 3.35Å; R236-D260 IonicContact CZ-OD1 3.45Å; R236-D260 IonicContact NH1-OD1 3.89Å; R236-D260 PolarHBondContact NH1-OD1 3.15Å; R236-D260 VanDerWaalsContact NH2-N 3.11Å; R236-D260 IonicContact NH2-OD1 3.62Å; R236-D260 PolarHBondContact NH2-OD1 3.18Å; R236-N432 PolarHBondContact NH2-ND2 2.92Å
237	V	94.9	Very high	92.1	Very high	0 Å²	0	26.3 Å²	26.3	0%	0	14%	0.135	C	C	.	.	H	α-helix	trans	-66.6	-39.9	173.2	-176.2	0	0	0	0	111.6	M151 P158 C161 V162 L212 F217 L226 W233 R234 M235 L239 A240 R241	M151-V237 HydrophobicContact CG-CB 4.05Å; M151-V237 HydrophobicContact CG-CG1 3.96Å; P158-V237 HydrophobicContact CB-CG1 4.38Å; P158-V237 HydrophobicContact CB-CG2 3.84Å; P158-V237 HydrophobicContact CG-CG2 4.16Å; C161-V237 HydrophobicContact CB-CG1 4.18Å; V162-V237 HydrophobicContact CG2-CG1 4.13Å; L212-V237 HydrophobicContact CD2-CG2 4.44Å; F217-V237 HydrophobicContact CE1-CG2 3.86Å; F217-V237 HydrophobicContact CE2-CG2 4.1Å; F217-V237 HydrophobicContact CZ-CG2 3.33Å; L226-V237 HydrophobicContact CD2-CB 4.19Å; L226-V237 HydrophobicContact CD2-CG1 4.3Å; L226-V237 HydrophobicContact CD2-CG2 3.85Å; W233-V237 PolarHBondContact O-N 3.42Å; W233-V237 VanDerWaalsContact O-N 3.11Å; R234-V237 PolarHBondContact O-N 2.81Å; M235-V237 VanDerWaalsContact C-N 3.28Å; M235-V237 PolarHBondContact O-N 3.46Å; V237-L239 VanDerWaalsContact C-N 3.33Å; V237-L239 PolarHBondContact O-N 3.24Å; V237-A240 WeakPolarHBondContact O-CB 3.48Å; V237-A240 PolarHBondContact O-N 3.1Å; V237-R241 PolarHBondContact O-N 3.28Å
238	A	94.1	Very high	92	Very high	3 Å²	3	22.1 Å²	22.1	3%	0.025	12%	0.117	C	C	.	.	H	α-helix	trans	-63.3	-40.5	175.9	0	0	0	0	0	111.7	L147 R149 M151 R234 M235 R241 A242	L147-A238 HydrophobicContact CD1-CB 3.54Å; R149-A238 WeakPolarHBondContact O-CB 3.31Å; M151-A238 HydrophobicContact CG-CB 3.98Å; R234-A238 PolarHBondContact O-N 3.11Å; M235-A238 WeakPolarHBondContact O-CB 3.24Å; M235-A238 PolarHBondContact O-N 3.06Å; M235-A238 VanDerWaalsContact O-N 3.08Å; M235-A238 HydrophobicContact SD-CB 4.43Å; A238-R241 PolarHBondContact O-N 3.11Å; A238-A242 PolarHBondContact O-N 3.05Å
239	L	95.4	Very high	92.2	Very high	5 Å²	5	18.3 Å²	18.3	3%	0.026	10%	0.097	C	C	.	.	H	α-helix	trans	-63.5	-44.7	171.9	-179.2	61.6	0	0	0	111.6	L147 L215 M235 R236 V237 R241 A242 L243 L252 P255 L259 L267	L147-L239 HydrophobicContact CD2-CB 3.84Å; L147-L239 HydrophobicContact CD2-CD1 3.69Å; L147-L239 HydrophobicContact CD2-CG 4.36Å; L215-L239 HydrophobicContact CD1-CB 4.43Å; L215-L239 HydrophobicContact CD1-CD2 4.39Å; L215-L239 HydrophobicContact CD1-CG 4.29Å; L215-L239 HydrophobicContact CD2-CD2 3.93Å; M235-L239 PolarHBondContact O-N 3.28Å; R236-L239 PolarHBondContact O-N 2.89Å; V237-L239 VanDerWaalsContact C-N 3.33Å; V237-L239 PolarHBondContact O-N 3.24Å; L239-R241 VanDerWaalsContact C-N 3.28Å; L239-R241 PolarHBondContact O-N 2.72Å; L239-A242 WeakPolarHBondContact O-CB 3.06Å; L239-A242 PolarHBondContact O-N 2.83Å; L239-A242 VanDerWaalsContact O-N 3.08Å; L239-L243 HydrophobicContact CD1-CG 4.42Å; L239-L243 HydrophobicContact CG-CD1 4.28Å; L239-L243 WeakPolarHBondContact O-CG 3.26Å; L239-L243 PolarHBondContact O-N 2.83Å; L239-L252 HydrophobicContact CD1-CD1 4.32Å; L239-L252 HydrophobicContact CD1-CD2 3.96Å; L239-P255 HydrophobicContact CD1-CB 4.48Å; L239-L259 HydrophobicContact CD2-CD1 4.27Å; L239-L267 HydrophobicContact CD2-CD1 4.1Å; L239-L267 HydrophobicContact CD2-CD2 3.91Å
240	A	94.9	Very high	92.5	Very high	0 Å²	0	17.4 Å²	17.4	0%	0	9%	0.093	C	C	.	.	H	α-helix	trans	-55.8	-44.4	175.8	0	0	0	0	0	111.6	V162 I211 L212 L215 R236 V237 L243 F244	V162-A240 HydrophobicContact CG2-CB 3.63Å; I211-A240 HydrophobicContact CG2-CB 3.71Å; L212-A240 HydrophobicContact CD2-CB 3.72Å; L212-A240 HydrophobicContact CG-CB 4.26Å; L215-A240 HydrophobicContact CD1-CB 3.7Å; R236-A240 WeakPolarHBondContact O-CB 3.48Å; R236-A240 PolarHBondContact O-N 2.81Å; V237-A240 WeakPolarHBondContact O-CB 3.48Å; V237-A240 PolarHBondContact O-N 3.1Å; A240-L243 PolarHBondContact O-N 3.47Å; A240-F244 VanDerWaalsContact O-CB 3.31Å; A240-F244 WeakPolarHBondContact O-CB 3.43Å; A240-F244 PolarHBondContact O-N 3.1Å
241	R	93.4	Very high	93	Very high	40 Å²	40	14 Å²	14	15%	0.151	7%	0.068	C	C	.	.	H	α-helix	trans	-61.7	-43.7	175.3	-178.4	179.6	171.6	152.7	2.9	111.8	E164 E168 V237 A238 L239 L243 F244 I245	E164-R241 PolarHBondContact O-NH2 3.47Å; E168-R241 IonicContact OE1-CZ 3.8Å; E168-R241 IonicContact OE1-NE 2.8Å; E168-R241 IonicContact OE1-NH2 3.87Å; E168-R241 PolarHBondContact OE1-NH2 2.88Å; E168-R241 IonicContact OE2-NH2 3.04Å; E168-R241 PolarHBondContact OE2-NH2 2.84Å; V237-R241 PolarHBondContact O-N 3.28Å; A238-R241 PolarHBondContact O-N 3.11Å; L239-R241 VanDerWaalsContact C-N 3.28Å; L239-R241 PolarHBondContact O-N 2.72Å; R241-L243 VanDerWaalsContact C-N 3.35Å; R241-L243 PolarHBondContact O-N 3.09Å; R241-F244 PolarHBondContact O-N 3.22Å; R241-I245 HydrophobicContact CG-CD1 3.67Å; R241-I245 HydrophobicContact CG-CG1 4.39Å; R241-I245 WeakPolarHBondContact O-CG1 3.24Å; R241-I245 PolarHBondContact O-N 3.19Å
242	A	93.4	Very high	93.5	Very high	0 Å²	0	13.1 Å²	13.1	0%	0	6%	0.06	C	C	.	.	H	α-helix	trans	-60.2	-43.5	177.3	0	0	0	0	0	112.4	Y145 A238 L239 R246 L250	Y145-A242 HydrophobicContact CD1-CB 3.58Å; Y145-A242 HydrophobicContact CE1-CB 3.38Å; Y145-A242 HydrophobicContact CG-CB 4.48Å; A238-A242 PolarHBondContact O-N 3.05Å; L239-A242 WeakPolarHBondContact O-CB 3.06Å; L239-A242 PolarHBondContact O-N 2.83Å; L239-A242 VanDerWaalsContact O-N 3.08Å; A242-R246 PolarHBondContact O-N 2.8Å; A242-R246 VanDerWaalsContact O-N 3.12Å; A242-L250 HydrophobicContact CB-CD1 4.01Å
243	L	93.6	Very high	93.8	Very high	14 Å²	14	15 Å²	15	7%	0.073	7%	0.066	C	C	.	.	H	α-helix	trans	-68.2	-35.3	176.4	-63.7	174.3	0	0	0	112.2	I211 L215 L239 A240 R241 L250 W266 L267 L271	I211-L243 HydrophobicContact CD1-CB 4.37Å; I211-L243 HydrophobicContact CG2-CB 4.19Å; I211-L243 HydrophobicContact CG2-CD1 4.2Å; L215-L243 HydrophobicContact CD1-CD1 4.39Å; L239-L243 HydrophobicContact CD1-CG 4.42Å; L239-L243 HydrophobicContact CG-CD1 4.28Å; L239-L243 WeakPolarHBondContact O-CG 3.26Å; L239-L243 PolarHBondContact O-N 2.83Å; A240-L243 PolarHBondContact O-N 3.47Å; R241-L243 VanDerWaalsContact C-N 3.35Å; R241-L243 PolarHBondContact O-N 3.09Å; L243-L250 HydrophobicContact CD2-CD2 4.45Å; L243-W266 HydrophobicContact CD1-CH2 4.08Å; L243-W266 HydrophobicContact CD1-CZ3 3.84Å; L243-L267 HydrophobicContact CD1-CD1 3.74Å; L243-L267 HydrophobicContact CD2-CD1 4.28Å; L243-L271 HydrophobicContact CD2-CD2 3.64Å; L243-L271 HydrophobicContact CD2-CG 4.41Å
244	F	92.3	Very high	93.7	Very high	2 Å²	2	13.6 Å²	13.6	1%	0.009	6%	0.062	C	C	.	.	H	α-helix	trans	-67.2	-49.2	176.7	-176.4	-99	0	0	0	111.7	V162 V165 L199 A204 R207 A208 I211 A240 R241 R246	V162-F244 HydrophobicContact CG1-CB 3.52Å; V162-F244 HydrophobicContact CG1-CD1 4.16Å; V162-F244 HydrophobicContact CG1-CD2 3.99Å; V162-F244 HydrophobicContact CG1-CG 3.62Å; V162-F244 VanDerWaalsContact O-CD1 3.26Å; V162-F244 WeakPolarHBondContact O-CD1 3.26Å; V165-F244 HydrophobicContact CG1-CD1 4.01Å; V165-F244 HydrophobicContact CG1-CE1 4.24Å; V165-F244 HydrophobicContact CG2-CD1 4.41Å; V165-F244 HydrophobicContact CG2-CE1 3.81Å; L199-F244 HydrophobicContact CD2-CD1 4.35Å; L199-F244 HydrophobicContact CD2-CE1 3.97Å; A204-F244 HydrophobicContact CB-CE2 4.43Å; A204-F244 HydrophobicContact CB-CZ 3.92Å; A204-F244 WeakPolarHBondContact O-CE2 3.45Å; R207-F244 HydrophobicContact CB-CE2 4.16Å; R207-F244 HydrophobicContact CG-CD2 4Å; R207-F244 HydrophobicContact CG-CE2 4.05Å; R207-F244 PolarHBondContact NH2-O 3.17Å; A208-F244 HydrophobicContact CB-CD2 4.18Å; A208-F244 HydrophobicContact CB-CE2 4.13Å; I211-F244 HydrophobicContact CD1-CB 4.01Å; I211-F244 HydrophobicContact CD1-CD2 4.18Å; A240-F244 VanDerWaalsContact O-CB 3.31Å; A240-F244 WeakPolarHBondContact O-CB 3.43Å; A240-F244 PolarHBondContact O-N 3.1Å; R241-F244 PolarHBondContact O-N 3.22Å; F244-R246 VanDerWaalsContact C-N 3.27Å; F244-R246 PolarHBondContact O-N 2.65Å
245	I	90.4	Very high	93.6	Very high	2 Å²	2	12.5 Å²	12.5	1%	0.01	6%	0.059	C	C	.	.	H	α-helix	trans	-62.5	-35.3	178.4	-69.5	163.2	0	0	0	112	Y145 V165 E168 R195 R241	Y145-I245 HydrophobicContact CD2-CD1 3.85Å; Y145-I245 HydrophobicContact CD2-CG2 4.45Å; Y145-I245 HydrophobicContact CE2-CD1 3.3Å; V165-I245 HydrophobicContact CB-CG1 4.38Å; V165-I245 HydrophobicContact CG1-CD1 3.85Å; V165-I245 HydrophobicContact CG1-CG1 3.37Å; E168-I245 HydrophobicContact CB-CG2 4.48Å; E168-I245 HydrophobicContact CG-CD1 3.98Å; E168-I245 HydrophobicContact CG-CG1 4.38Å; E168-I245 HydrophobicContact CG-CG2 4.29Å; E168-I245 VanDerWaalsContact OE1-CD1 3.29Å; E168-I245 WeakPolarHBondContact OE1-CD1 3.47Å; R195-I245 PolarHBondContact NE-O 2.77Å; R195-I245 PolarHBondContact NH2-O 3.04Å; R241-I245 HydrophobicContact CG-CD1 3.67Å; R241-I245 HydrophobicContact CG-CG1 4.39Å; R241-I245 WeakPolarHBondContact O-CG1 3.24Å; R241-I245 PolarHBondContact O-N 3.19Å
246	R	89.6	Confident	93.4	Very high	33 Å²	33	10.8 Å²	10.8	13%	0.125	5%	0.052	C	C	.	.			trans	47.8	69.9	-179.1	-158.5	-174.8	168.1	92	-2.4	110.2	R195 A242 F244 T273 F274 R276	R195-R246 PolarHBondContact NE-O 3.41Å; A242-R246 PolarHBondContact O-N 2.8Å; A242-R246 VanDerWaalsContact O-N 3.12Å; F244-R246 VanDerWaalsContact C-N 3.27Å; F244-R246 PolarHBondContact O-N 2.65Å; R246-T273 PolarHBondContact NH2-O 3.43Å; R246-T273 VanDerWaalsContact NH2-O 3.11Å; R246-F274 HydrophobicContact CG-CD2 4.41Å; R246-F274 HydrophobicContact CG-CE2 3.8Å; R246-R276 VanDerWaalsContact CG-NH2 3.26Å; R246-R276 PolarHBondContact O-NH2 3.13Å
247	P	92.3	Very high	92.9	Very high	0 Å²	0	12.6 Å²	12.6	0%	0	6%	0.062	C	C	.	.			trans	-62.2	172.1	-178.4	35.6	-45.5	0	0	0	113.2	D143 M249 L250 F274 R276	D143-P247 VanDerWaalsContact OD2-CA 3.26Å; D143-P247 WeakPolarHBondContact OD2-CA 3.48Å; D143-P247 WeakPolarHBondContact OD2-CB 3.19Å; P247-M249 WeakPolarHBondContact CG-O 3.36Å; P247-L250 HydrophobicContact CG-CB 3.7Å; P247-L250 HydrophobicContact CG-CD1 3.98Å; P247-L250 HydrophobicContact CG-CG 4.38Å; P247-F274 WeakPolarHBondContact O-CZ 3.49Å; P247-R276 PolarHBondContact O-NE 3.08Å
248	F	92.1	Very high	92.3	Very high	15 Å²	15	16.7 Å²	16.7	7%	0.066	8%	0.081	C	C	.	.	S	Bend	trans	-67.5	-42.3	168.3	-161.1	-79.1	0	0	0	112	T84 I142 D143 R276 I277	T84-F248 HydrophobicContact CG2-CE2 4.09Å; T84-F248 HydrophobicContact CG2-CZ 3.63Å; T84-F248 WeakPolarHBondContact O-CE1 3.25Å; I142-F248 HydrophobicContact CB-CD1 4.4Å; I142-F248 HydrophobicContact CG1-CD1 4.09Å; I142-F248 HydrophobicContact CG1-CE1 4.41Å; I142-F248 HydrophobicContact CG2-CB 4.3Å; I142-F248 HydrophobicContact CG2-CD1 3.85Å; I142-F248 HydrophobicContact CG2-CG 4.41Å; D143-F248 PolarHBondContact O-N 3.35Å; D143-F248 WeakPolarHBondContact OD1-CB 3.35Å; D143-F248 PolarHBondContact OD1-N 3.29Å; F248-R276 HydrophobicContact CD2-CG 4.48Å; F248-R276 HydrophobicContact CE2-CG 4.48Å; F248-R276 WeakPolarHBondContact O-CB 3.46Å; F248-I277 HydrophobicContact CD1-CD1 4.44Å; F248-I277 HydrophobicContact CE1-CD1 4.1Å; F248-I277 HydrophobicContact CE1-CG1 4.24Å; F248-I277 PolarHBondContact O-N 3.18Å
249	M	95.7	Very high	92	Very high	0 Å²	0	16.7 Å²	16.7	0%	0	8%	0.08	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	114.8	172.9	-174.1	-179	-67.8	0	0	110.1	V86 L108 I131 I142 D143 I144 Y145 P247 L251 I277	V86-M249 HydrophobicContact CB-CE 4.37Å; V86-M249 HydrophobicContact CG2-CE 3.88Å; L108-M249 HydrophobicContact CD1-CE 3.93Å; L108-M249 HydrophobicContact CD1-SD 4.41Å; I131-M249 HydrophobicContact CG2-SD 3.52Å; I131-M249 VanDerWaalsContact CG2-SD 3.52Å; I142-M249 HydrophobicContact CG2-CB 3.95Å; I142-M249 HydrophobicContact CG2-CE 4.11Å; D143-M249 PolarHBondContact O-N 3.03Å; I144-M249 WeakPolarHBondContact CA-O 3.33Å; I144-M249 HydrophobicContact CD1-SD 4.43Å; I144-M249 HydrophobicContact CG1-CB 4.26Å; I144-M249 HydrophobicContact CG1-SD 4.2Å; I144-M249 HydrophobicContact CG2-CB 4.39Å; I144-M249 HydrophobicContact CG2-CG 4.32Å; I144-M249 HydrophobicContact CG2-SD 4.21Å; Y145-M249 PolarHBondContact N-O 2.87Å; P247-M249 WeakPolarHBondContact CG-O 3.36Å; M249-L251 HydrophobicContact CG-CD2 3.84Å; M249-L251 HydrophobicContact CG-CG 4.32Å; M249-L251 HydrophobicContact SD-CD2 4.02Å; M249-I277 CarbonylContact C-O 3.15Å; M249-I277 WeakPolarHBondContact CA-O 3.33Å; M249-I277 HydrophobicContact CB-CB 4.4Å; M249-I277 HydrophobicContact CE-CD1 4.05Å; M249-I277 HydrophobicContact CE-CG2 4.28Å; M249-I277 HydrophobicContact CG-CB 4.28Å; M249-I277 HydrophobicContact CG-CG2 4.05Å
250	L	97.2	Very high	91.7	Very high	0 Å²	0	16.8 Å²	16.8	0%	0	8%	0.081	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.6	123.6	174.5	-177.2	56.9	0	0	0	109.6	Y145 A242 L243 P247 L252 L271 F274 I277 L278 V279	Y145-L250 HydrophobicContact CD1-CD1 4.28Å; A242-L250 HydrophobicContact CB-CD1 4.01Å; L243-L250 HydrophobicContact CD2-CD2 4.45Å; P247-L250 HydrophobicContact CG-CB 3.7Å; P247-L250 HydrophobicContact CG-CD1 3.98Å; P247-L250 HydrophobicContact CG-CG 4.38Å; L250-L252 HydrophobicContact CD1-CD2 3.9Å; L250-L252 HydrophobicContact CD1-CG 4.34Å; L250-L252 HydrophobicContact CD2-CD1 4.18Å; L250-L252 HydrophobicContact CD2-CD2 4.46Å; L250-L252 HydrophobicContact CD2-CG 4.35Å; L250-L252 HydrophobicContact CG-CD1 4.37Å; L250-L252 HydrophobicContact CG-CD2 4.11Å; L250-L252 HydrophobicContact CG-CG 4Å; L250-L271 HydrophobicContact CD2-CD2 4.15Å; L250-F274 HydrophobicContact CB-CE1 4.14Å; L250-F274 HydrophobicContact CB-CE2 4.2Å; L250-F274 HydrophobicContact CB-CZ 3.66Å; L250-F274 HydrophobicContact CD2-CD2 4.4Å; L250-F274 HydrophobicContact CD2-CE2 3.86Å; L250-F274 HydrophobicContact CD2-CZ 4.2Å; L250-I277 PolarHBondContact N-O 3.05Å; L250-L278 HydrophobicContact CB-CD1 4.01Å; L250-L278 HydrophobicContact CD2-CD1 4.02Å; L250-L278 HydrophobicContact CG-CD1 3.93Å; L250-L278 WeakPolarHBondContact O-CA 3.21Å; L250-V279 PolarHBondContact O-N 3.22Å
251	L	97.8	Very high	91.4	Very high	0 Å²	0	16.8 Å²	16.8	0%	0	8%	0.081	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	119.2	177.4	-53.5	-178.8	0	0	0	109.2	L128 I131 I144 Y145 H146 L147 M249 V279	L128-L251 HydrophobicContact CD2-CB 4.17Å; L128-L251 HydrophobicContact CD2-CD2 4.04Å; L128-L251 HydrophobicContact CD2-CG 4.48Å; I131-L251 HydrophobicContact CB-CD1 3.96Å; I131-L251 HydrophobicContact CG2-CD1 3.64Å; I131-L251 HydrophobicContact CG2-CD2 4.23Å; I144-L251 HydrophobicContact CG2-CD1 3.68Å; I144-L251 HydrophobicContact CG2-CG 3.99Å; Y145-L251 PolarHBondContact O-N 3.04Å; H146-L251 HydrophobicContact CB-CB 4.16Å; H146-L251 HydrophobicContact CB-CD1 4.12Å; L147-L251 PolarHBondContact N-O 2.85Å; M249-L251 HydrophobicContact CG-CD2 3.84Å; M249-L251 HydrophobicContact CG-CG 4.32Å; M249-L251 HydrophobicContact SD-CD2 4.02Å; L251-V279 WeakPolarHBondContact CA-O 3.44Å; L251-V279 HydrophobicContact CD2-CB 3.65Å; L251-V279 HydrophobicContact CD2-CG2 3.81Å
252	L	96.5	Very high	91.2	Very high	0 Å²	0	16.5 Å²	16.5	0%	0	8%	0.082	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	128.1	-179.7	-58.9	179	0	0	0	109.9	L147 L239 L250 P255 L271 L278 V279 L280 V281	L147-L252 HydrophobicContact CB-CD2 3.76Å; L147-L252 HydrophobicContact CD2-CD2 3.85Å; L147-L252 HydrophobicContact CG-CD2 4.47Å; L239-L252 HydrophobicContact CD1-CD1 4.32Å; L239-L252 HydrophobicContact CD1-CD2 3.96Å; L250-L252 HydrophobicContact CD1-CD2 3.9Å; L250-L252 HydrophobicContact CD1-CG 4.34Å; L250-L252 HydrophobicContact CD2-CD1 4.18Å; L250-L252 HydrophobicContact CD2-CD2 4.46Å; L250-L252 HydrophobicContact CD2-CG 4.35Å; L250-L252 HydrophobicContact CG-CD1 4.37Å; L250-L252 HydrophobicContact CG-CD2 4.11Å; L250-L252 HydrophobicContact CG-CG 4Å; L252-P255 HydrophobicContact CB-CB 4.11Å; L252-P255 HydrophobicContact CB-CG 3.98Å; L252-P255 HydrophobicContact CD1-CB 4.06Å; L252-P255 HydrophobicContact CD1-CG 4.12Å; L252-L271 HydrophobicContact CD1-CD1 3.89Å; L252-L271 HydrophobicContact CD1-CD2 4.2Å; L252-L278 HydrophobicContact CD1-CD1 4.07Å; L252-L278 HydrophobicContact CG-CD1 4.3Å; L252-V279 PolarHBondContact N-O 3.03Å; L252-L280 HydrophobicContact CB-CB 4.45Å; L252-L280 CarbonylContact O-C 3.56Å; L252-L280 WeakPolarHBondContact O-CA 3.4Å; L252-V281 PolarHBondContact O-N 2.9Å
253	D	93.3	Very high	91.1	Very high	53 Å²	53	16.5 Å²	16.5	28%	0.283	8%	0.083	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	110.8	173.3	-158.5	-1.7	0	0	0	109	S125 L128 V281	S125-D253 WeakPolarHBondContact CB-OD2 3.45Å; S125-D253 PolarHBondContact OG-OD2 3.25Å; L128-D253 HydrophobicContact CD1-CB 3.89Å; D253-V281 WeakPolarHBondContact OD1-CB 3.3Å; D253-V281 WeakPolarHBondContact OD1-CG1 3.35Å
254	E	90.1	Very high	91.1	Very high	22 Å²	22	16.3 Å²	16.3	10%	0.103	8%	0.082	C	C	.	.	S	Bend	trans	48.9	58.1	-177.3	-60.9	-64.2	147	0	0	114.4	T256 N257 V281 S282 H283	E254-T256 PolarHBondContact O-N 3.12Å; E254-T256 VanDerWaalsContact O-N 3.15Å; E254-N257 WeakPolarHBondContact CB-ND2 3.05Å; E254-N257 WeakPolarHBondContact O-CB 3.49Å; E254-N257 PolarHBondContact O-N 3.38Å; E254-N257 VanDerWaalsContact O-N 3.12Å; E254-V281 VanDerWaalsContact CA-O 3.26Å; E254-V281 WeakPolarHBondContact CA-O 3.44Å; E254-V281 PolarHBondContact N-O 3.1Å; E254-V281 WeakPolarHBondContact OE1-CG1 3.44Å; E254-S282 WeakPolarHBondContact OE1-CA 3.38Å; E254-S282 PolarHBondContact OE1-N 3.29Å; E254-S282 WeakPolarHBondContact OE2-CA 3.49Å; E254-H283 IonicContact OE1-CD2 3.2Å; E254-H283 PolarHBondContact OE1-CD2 3.4Å; E254-H283 IonicContact OE1-CG 2.7Å; E254-H283 PolarHBondContact OE1-N 3.17Å; E254-H283 IonicContact OE1-ND1 2.86Å; E254-H283 IonicContact OE1-NE2 2.76Å; E254-H283 PolarHBondContact OE1-NE2 2.9Å; E254-H283 IonicContact OE2-CD2 2.79Å; E254-H283 IonicContact OE2-CG 2.73Å; E254-H283 PolarHBondContact OE2-N 2.91Å
255	P	91.8	Very high	91.1	Very high	12 Å²	12	16.2 Å²	16.2	8%	0.078	8%	0.082	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68.9	-14.7	-173.9	30.5	-37.1	0	0	0	114.2	L239 L252 N257 L259 L267 V281 F287	L239-P255 HydrophobicContact CD1-CB 4.48Å; L252-P255 HydrophobicContact CB-CB 4.11Å; L252-P255 HydrophobicContact CB-CG 3.98Å; L252-P255 HydrophobicContact CD1-CB 4.06Å; L252-P255 HydrophobicContact CD1-CG 4.12Å; P255-N257 VanDerWaalsContact C-N 3.28Å; P255-L259 VanDerWaalsContact O-CD1 3.26Å; P255-L259 WeakPolarHBondContact O-CD1 3.34Å; P255-L267 HydrophobicContact CB-CD2 4.14Å; P255-V281 WeakPolarHBondContact CD-O 3.33Å; P255-F287 HydrophobicContact CG-CE1 3.95Å; P255-F287 HydrophobicContact CG-CZ 4.17Å
256	T	88.2	Confident	91.3	Very high	20 Å²	20	17.2 Å²	17.2	12%	0.123	9%	0.086	C	C	.	.	T	Hydrogen-bonded Turn	trans	-78.2	-12.7	176	49.2	0	0	0	0	112.8	E254 H258 L259 F287	E254-T256 PolarHBondContact O-N 3.12Å; E254-T256 VanDerWaalsContact O-N 3.15Å; T256-H258 PolarHBondContact O-N 3.26Å; T256-L259 WeakPolarHBondContact O-CB 3.34Å; T256-L259 PolarHBondContact O-N 3.25Å; T256-L259 VanDerWaalsContact O-N 3.1Å; T256-F287 HydrophobicContact CG2-CB 4.27Å; T256-F287 HydrophobicContact CG2-CD1 3.92Å; T256-F287 HydrophobicContact CG2-CD2 3.62Å; T256-F287 HydrophobicContact CG2-CE1 4.06Å; T256-F287 HydrophobicContact CG2-CE2 3.78Å; T256-F287 HydrophobicContact CG2-CG 3.67Å; T256-F287 HydrophobicContact CG2-CZ 3.97Å
257	N	83.8	Confident	91.5	Very high	43 Å²	43	15.7 Å²	15.7	23%	0.23	8%	0.08	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.4	136.3	177.5	-73.6	-14.3	0	0	0	110.7	E254 P255 L259	E254-N257 WeakPolarHBondContact CB-ND2 3.05Å; E254-N257 WeakPolarHBondContact O-CB 3.49Å; E254-N257 PolarHBondContact O-N 3.38Å; E254-N257 VanDerWaalsContact O-N 3.12Å; P255-N257 VanDerWaalsContact C-N 3.28Å; N257-L259 PolarHBondContact O-N 3.36Å; N257-L259 VanDerWaalsContact O-N 3.11Å
258	H	82.4	Confident	91.6	Very high	87 Å²	87	16 Å²	16	40%	0.403	8%	0.082	S	C	.	.	T	Hydrogen-bonded Turn	trans	62.3	7.9	-176.6	-43.5	-71.8	0	0	0	115.1	R236 T256 N432	R236-H258 VanDerWaalsContact CZ-O 3.3Å; R236-H258 PolarHBondContact NE-O 3.46Å; R236-H258 VanDerWaalsContact NE-O 3.09Å; R236-H258 PolarHBondContact NH2-O 2.88Å; T256-H258 PolarHBondContact O-N 3.26Å; H258-N432 PolarHBondContact O-ND2 3.44Å
259	L	88.6	Confident	91.7	Very high	2 Å²	2	18.4 Å²	18.4	1%	0.01	9%	0.093	C	C	.	.			trans	-88.3	141.3	170.5	-62	-169.6	0	0	0	110.3	L215 R236 L239 P255 T256 N257 A263 C264 L267 H571	L215-L259 HydrophobicContact CD2-CD1 4.39Å; L215-L259 HydrophobicContact CD2-CD2 4.37Å; R236-L259 HydrophobicContact CG-CD2 3.64Å; R236-L259 VanDerWaalsContact NH2-CA 3.35Å; L239-L259 HydrophobicContact CD2-CD1 4.27Å; P255-L259 VanDerWaalsContact O-CD1 3.26Å; P255-L259 WeakPolarHBondContact O-CD1 3.34Å; T256-L259 WeakPolarHBondContact O-CB 3.34Å; T256-L259 PolarHBondContact O-N 3.25Å; T256-L259 VanDerWaalsContact O-N 3.1Å; N257-L259 PolarHBondContact O-N 3.36Å; N257-L259 VanDerWaalsContact O-N 3.11Å; L259-A263 HydrophobicContact CB-CB 4.17Å; L259-A263 HydrophobicContact CD2-CB 4.2Å; L259-C264 VanDerWaalsContact CB-SG 3.51Å; L259-L267 HydrophobicContact CD1-CB 4.4Å; L259-L267 HydrophobicContact CD1-CD2 3.6Å; L259-H571 PolarHBondContact O-CD2 3.27Å; L259-H571 PolarHBondContact O-NE2 3.39Å
260	D	88.1	Confident	91.6	Very high	8 Å²	8	20.1 Å²	20.1	4%	0.043	10%	0.101	C	C	.	.			trans	-81.5	166.7	168.4	40.7	-7.8	0	0	0	111.2	R236 D262 A263 C264 P431 N432 H571	R236-D260 IonicContact CZ-OD1 3.45Å; R236-D260 IonicContact NH1-OD1 3.89Å; R236-D260 PolarHBondContact NH1-OD1 3.15Å; R236-D260 VanDerWaalsContact NH2-N 3.11Å; R236-D260 IonicContact NH2-OD1 3.62Å; R236-D260 PolarHBondContact NH2-OD1 3.18Å; D260-D262 VanDerWaalsContact C-N 3.28Å; D260-D262 PolarHBondContact O-N 3.46Å; D260-A263 PolarHBondContact O-N 3.05Å; D260-A263 WeakPolarHBondContact OD1-CB 3.48Å; D260-C264 PolarHBondContact O-N 3.42Å; D260-C264 PolarHBondContact O-SG 2.89Å; D260-P431 VanDerWaalsContact OD2-CA 3.3Å; D260-P431 WeakPolarHBondContact OD2-CA 3.35Å; D260-N432 HydrophobicContact CB-CB 4.46Å; D260-N432 PolarHBondContact OD2-N 3.35Å; D260-H571 WeakPolarHBondContact CA-CE1 3.43Å
261	L	88.4	Confident	91.6	Very high	0 Å²	0	20.2 Å²	20.2	0%	0	10%	0.101	C	C	.	.	H	α-helix	trans	-57.2	-42.1	-176.4	-67.7	176.7	0	0	0	111.9	A263 C264 V265 V429 H571 F573 Y601 L605	L261-A263 PolarHBondContact O-N 3.1Å; L261-C264 PolarHBondContact O-N 3.48Å; L261-V265 VanDerWaalsContact O-CG2 3.3Å; L261-V265 WeakPolarHBondContact O-CG2 3.45Å; L261-V265 PolarHBondContact O-N 3.31Å; L261-V429 HydrophobicContact CD1-CB 3.69Å; L261-V429 HydrophobicContact CD1-CG1 3.55Å; L261-H571 HydrophobicContact CD2-CB 4.32Å; L261-H571 VanDerWaalsContact CD2-O 3.26Å; L261-H571 WeakPolarHBondContact CD2-O 3.5Å; L261-H571 PolarHBondContact N-ND1 3.46Å; L261-F573 HydrophobicContact CB-CZ 4.17Å; L261-F573 HydrophobicContact CD2-CD2 4.02Å; L261-F573 HydrophobicContact CD2-CE1 4.28Å; L261-F573 HydrophobicContact CD2-CE2 3.58Å; L261-F573 HydrophobicContact CD2-CZ 3.7Å; L261-F573 HydrophobicContact CG-CZ 4.37Å; L261-Y601 HydrophobicContact CD1-CD1 4.37Å; L261-Y601 HydrophobicContact CD1-CE1 3.92Å; L261-L605 HydrophobicContact CB-CD1 3.94Å
262	D	90	Very high	91.4	Very high	33 Å²	33	24.6 Å²	24.6	18%	0.176	12%	0.12	C	C	.	.	H	α-helix	trans	-55.6	-49.5	174.7	-58	-99.3	0	0	0	111.7	D260 V265 W266 L605	D260-D262 VanDerWaalsContact C-N 3.28Å; D260-D262 PolarHBondContact O-N 3.46Å; D262-V265 PolarHBondContact O-N 3.38Å; D262-W266 PolarHBondContact O-N 3.2Å; D262-L605 VanDerWaalsContact OD1-CD2 3.23Å; D262-L605 WeakPolarHBondContact OD1-CD2 3.36Å
263	A	91.9	Very high	91.2	Very high	1 Å²	1	28.3 Å²	28.3	1%	0.008	14%	0.143	C	C	.	.	H	α-helix	trans	-70.2	-34.7	-179.2	0	0	0	0	0	112.8	L259 D260 L261 W266 L267	L259-A263 HydrophobicContact CB-CB 4.17Å; L259-A263 HydrophobicContact CD2-CB 4.2Å; D260-A263 PolarHBondContact O-N 3.05Å; D260-A263 WeakPolarHBondContact OD1-CB 3.48Å; L261-A263 PolarHBondContact O-N 3.1Å; A263-W266 PolarHBondContact O-N 3.27Å; A263-L267 VanDerWaalsContact O-CB 3.25Å; A263-L267 WeakPolarHBondContact O-CB 3.48Å; A263-L267 PolarHBondContact O-N 3.04Å
264	C	91.8	Very high	91.2	Very high	9 Å²	9	26 Å²	26	6%	0.061	13%	0.131	C	C	.	.	H	α-helix	trans	-62.2	-47.2	174.2	-75.6	0	0	0	0	111.3	L259 D260 L261 L267 E268	L259-C264 VanDerWaalsContact CB-SG 3.51Å; D260-C264 PolarHBondContact O-N 3.42Å; D260-C264 PolarHBondContact O-SG 2.89Å; L261-C264 PolarHBondContact O-N 3.48Å; C264-L267 PolarHBondContact O-N 3.44Å; C264-E268 WeakPolarHBondContact O-CB 3.43Å; C264-E268 PolarHBondContact O-N 2.47Å
265	V	92.9	Very high	91.2	Very high	0 Å²	0	32.9 Å²	32.9	0%	0	16%	0.16	C	C	.	.	H	α-helix	trans	-64.2	-42.1	178.6	173.1	0	0	0	0	110.8	L261 D262 E268 E269 F573 K602 L605 K606 L609	L261-V265 VanDerWaalsContact O-CG2 3.3Å; L261-V265 WeakPolarHBondContact O-CG2 3.45Å; L261-V265 PolarHBondContact O-N 3.31Å; D262-V265 PolarHBondContact O-N 3.38Å; V265-E268 WeakPolarHBondContact O-CB 3.19Å; V265-E268 PolarHBondContact O-N 2.93Å; V265-E269 PolarHBondContact O-N 3.36Å; V265-F573 HydrophobicContact CG2-CE2 3.87Å; V265-F573 HydrophobicContact CG2-CZ 3.61Å; V265-K602 HydrophobicContact CG2-CG 3.98Å; V265-L605 HydrophobicContact CG1-CB 4.42Å; V265-L605 HydrophobicContact CG2-CB 4.44Å; V265-L605 HydrophobicContact CG2-CD1 4.25Å; V265-K606 HydrophobicContact CG1-CB 4.47Å; V265-K606 HydrophobicContact CG1-CD 4.38Å; V265-K606 HydrophobicContact CG1-CG 3.4Å; V265-L609 HydrophobicContact CG1-CD1 4.02Å
266	W	94.2	Very high	91.2	Very high	24 Å²	24	34 Å²	34	9%	0.091	16%	0.163	C	C	.	.	H	α-helix	trans	-63	-45.4	175.4	179.8	84.5	0	0	0	112.3	I211 L215 L243 D262 A263 E268 E269 E270 L609	I211-W266 HydrophobicContact CB-CH2 4.09Å; I211-W266 HydrophobicContact CG1-CH2 4.2Å; I211-W266 HydrophobicContact CG1-CZ2 4.48Å; I211-W266 HydrophobicContact CG2-CH2 3.91Å; L215-W266 HydrophobicContact CD1-CZ3 4.38Å; L215-W266 HydrophobicContact CD2-CE3 3.88Å; L215-W266 HydrophobicContact CD2-CZ3 3.71Å; L215-W266 HydrophobicContact CG-CE3 4.07Å; L215-W266 HydrophobicContact CG-CH2 4.45Å; L215-W266 HydrophobicContact CG-CZ3 3.62Å; L243-W266 HydrophobicContact CD1-CH2 4.08Å; L243-W266 HydrophobicContact CD1-CZ3 3.84Å; D262-W266 PolarHBondContact O-N 3.2Å; A263-W266 PolarHBondContact O-N 3.27Å; W266-E268 VanDerWaalsContact C-N 3.3Å; W266-E268 PolarHBondContact O-N 3.4Å; W266-E269 PolarHBondContact O-N 2.84Å; W266-E270 HydrophobicContact CD2-CG 4.37Å; W266-E270 HydrophobicContact CH2-CB 4.39Å; W266-E270 HydrophobicContact CH2-CG 3.62Å; W266-E270 HydrophobicContact CZ2-CG 3.44Å; W266-E270 VanDerWaalsContact CZ2-CG 3.44Å; W266-E270 HydrophobicContact CZ3-CG 4.16Å; W266-E270 PolarHBondContact O-N 3.43Å; W266-L609 HydrophobicContact CB-CD1 3.8Å; W266-L609 HydrophobicContact CB-CD2 4.19Å; W266-L609 HydrophobicContact CG-CD1 4.46Å; W266-L609 HydrophobicContact CG-CD2 4.44Å
267	L	95.4	Very high	91.6	Very high	0 Å²	0	33 Å²	33	0%	0	16%	0.157	C	C	.	.	H	α-helix	trans	-62.8	-38.5	178.7	-179.5	66.4	0	0	0	111.7	L239 L243 P255 L259 A263 C264 E270 L271 F287	L239-L267 HydrophobicContact CD2-CD1 4.1Å; L239-L267 HydrophobicContact CD2-CD2 3.91Å; L243-L267 HydrophobicContact CD1-CD1 3.74Å; L243-L267 HydrophobicContact CD2-CD1 4.28Å; P255-L267 HydrophobicContact CB-CD2 4.14Å; L259-L267 HydrophobicContact CD1-CB 4.4Å; L259-L267 HydrophobicContact CD1-CD2 3.6Å; A263-L267 VanDerWaalsContact O-CB 3.25Å; A263-L267 WeakPolarHBondContact O-CB 3.48Å; A263-L267 PolarHBondContact O-N 3.04Å; C264-L267 PolarHBondContact O-N 3.44Å; L267-E270 PolarHBondContact O-N 3.02Å; L267-L271 HydrophobicContact CD1-CD1 3.86Å; L267-L271 HydrophobicContact CD1-CG 3.91Å; L267-L271 HydrophobicContact CD2-CD1 4.32Å; L267-L271 HydrophobicContact CG-CD1 3.82Å; L267-L271 HydrophobicContact CG-CG 4.23Å; L267-L271 WeakPolarHBondContact O-CB 3.38Å; L267-L271 WeakPolarHBondContact O-CG 3.2Å; L267-L271 PolarHBondContact O-N 2.97Å; L267-F287 HydrophobicContact CB-CE2 4.38Å; L267-F287 HydrophobicContact CD2-CE2 4Å; L267-F287 HydrophobicContact CD2-CZ 3.8Å; L267-F287 HydrophobicContact CG-CE2 4.08Å; L267-F287 HydrophobicContact CG-CZ 4.06Å
268	E	94.5	Very high	92.3	Very high	8 Å²	8	31 Å²	31	4%	0.037	15%	0.146	C	C	.	.	H	α-helix	trans	-56.3	-50.6	173.7	-177.6	-169.7	135	0	0	110.5	C264 V265 W266 L271 K272 F287 V291 K602 K606	C264-E268 WeakPolarHBondContact O-CB 3.43Å; C264-E268 PolarHBondContact O-N 2.47Å; V265-E268 WeakPolarHBondContact O-CB 3.19Å; V265-E268 PolarHBondContact O-N 2.93Å; W266-E268 VanDerWaalsContact C-N 3.3Å; W266-E268 PolarHBondContact O-N 3.4Å; E268-L271 PolarHBondContact O-N 3.06Å; E268-K272 WeakPolarHBondContact O-CB 3.48Å; E268-K272 PolarHBondContact O-N 2.97Å; E268-F287 HydrophobicContact CB-CD2 4.19Å; E268-F287 HydrophobicContact CB-CE2 4.22Å; E268-V291 HydrophobicContact CB-CG2 4.35Å; E268-V291 HydrophobicContact CG-CG2 4.01Å; E268-K602 IonicContact OE1-NZ 3.66Å; E268-K602 PolarHBondContact OE1-NZ 2.9Å; E268-K602 WeakPolarHBondContact OE2-CE 3.41Å; E268-K602 IonicContact OE2-NZ 3.11Å; E268-K602 PolarHBondContact OE2-NZ 3.28Å; E268-K606 IonicContact OE1-NZ 3.76Å; E268-K606 PolarHBondContact OE1-NZ 2.91Å; E268-K606 VanDerWaalsContact OE1-NZ 3.11Å
269	E	93.4	Very high	93	Very high	64 Å²	64	27 Å²	27	30%	0.299	13%	0.128	S	C	.	.	H	α-helix	trans	-66.7	-37.9	-179.5	-67.6	-58.7	150.7	0	0	112.7	V265 W266 K272 K606	V265-E269 PolarHBondContact O-N 3.36Å; W266-E269 PolarHBondContact O-N 2.84Å; E269-K272 IonicContact OE1-NZ 3.65Å; E269-K272 IonicContact OE2-NZ 3.96Å; E269-K606 WeakPolarHBondContact OE1-CE 3.36Å; E269-K606 IonicContact OE1-NZ 2.8Å; E269-K606 PolarHBondContact OE1-NZ 2.99Å
270	E	94	Very high	93.3	Very high	37 Å²	37	26.9 Å²	26.9	17%	0.173	13%	0.127	C	C	.	.	H	α-helix	trans	-64.3	-50.6	173.7	-94.4	-69.8	-175.8	0	0	112	R210 W266 L267 K272 T273	R210-E270 IonicContact CZ-OE1 3.6Å; R210-E270 IonicContact NE-OE1 3.51Å; R210-E270 IonicContact NH2-OE1 2.79Å; R210-E270 PolarHBondContact NH2-OE1 3.27Å; W266-E270 HydrophobicContact CD2-CG 4.37Å; W266-E270 HydrophobicContact CH2-CB 4.39Å; W266-E270 HydrophobicContact CH2-CG 3.62Å; W266-E270 HydrophobicContact CZ2-CG 3.44Å; W266-E270 VanDerWaalsContact CZ2-CG 3.44Å; W266-E270 HydrophobicContact CZ3-CG 4.16Å; W266-E270 PolarHBondContact O-N 3.43Å; L267-E270 PolarHBondContact O-N 3.02Å; E270-K272 VanDerWaalsContact C-N 3.32Å; E270-K272 PolarHBondContact O-N 3.49Å; E270-T273 PolarHBondContact O-N 3.06Å; E270-T273 PolarHBondContact O-OG1 3.26Å
271	L	95.6	Very high	93.6	Very high	1 Å²	1	26.6 Å²	26.6	1%	0.005	13%	0.126	C	C	.	.	H	α-helix	trans	-69.6	-28.7	-177	-71	178.6	0	0	0	113.1	R113 L243 L250 L252 L267 E268 T273 F274 L278 F287 V291	R113-L271 WeakPolarHBondContact CD-O 3.4Å; L243-L271 HydrophobicContact CD2-CD2 3.64Å; L243-L271 HydrophobicContact CD2-CG 4.41Å; L250-L271 HydrophobicContact CD2-CD2 4.15Å; L252-L271 HydrophobicContact CD1-CD1 3.89Å; L252-L271 HydrophobicContact CD1-CD2 4.2Å; L267-L271 HydrophobicContact CD1-CD1 3.86Å; L267-L271 HydrophobicContact CD1-CG 3.91Å; L267-L271 HydrophobicContact CD2-CD1 4.32Å; L267-L271 HydrophobicContact CG-CD1 3.82Å; L267-L271 HydrophobicContact CG-CG 4.23Å; L267-L271 WeakPolarHBondContact O-CB 3.38Å; L267-L271 WeakPolarHBondContact O-CG 3.2Å; L267-L271 PolarHBondContact O-N 2.97Å; E268-L271 PolarHBondContact O-N 3.06Å; L271-T273 PolarHBondContact O-N 2.91Å; L271-F274 WeakPolarHBondContact O-CB 3.41Å; L271-F274 PolarHBondContact O-N 3.23Å; L271-L278 HydrophobicContact CB-CD2 4.12Å; L271-L278 HydrophobicContact CD1-CD2 4.44Å; L271-L278 HydrophobicContact CD2-CD1 4.44Å; L271-L278 HydrophobicContact CD2-CD2 4.06Å; L271-L278 HydrophobicContact CG-CD2 4.45Å; L271-F287 HydrophobicContact CD1-CE1 4.44Å; L271-F287 HydrophobicContact CD1-CZ 3.77Å; L271-V291 HydrophobicContact CB-CG1 3.71Å; L271-V291 HydrophobicContact CB-CG2 4.03Å
272	K	94.5	Very high	93.7	Very high	92 Å²	92	26.7 Å²	26.7	40%	0.4	13%	0.126	S	C	.	.	H	α-helix	trans	-58.6	-28.6	173.9	-179.9	179.6	174.8	-171.6	0	112.5	R113 E268 E269 E270	R113-K272 PolarHBondContact NE-O 3.17Å; R113-K272 PolarHBondContact NH1-O 3.27Å; R113-K272 PolarHBondContact NH2-O 2.86Å; E268-K272 WeakPolarHBondContact O-CB 3.48Å; E268-K272 PolarHBondContact O-N 2.97Å; E269-K272 IonicContact OE1-NZ 3.65Å; E269-K272 IonicContact OE2-NZ 3.96Å; E270-K272 VanDerWaalsContact C-N 3.32Å; E270-K272 PolarHBondContact O-N 3.49Å
273	T	91.4	Very high	93.4	Very high	79 Å²	79	26.2 Å²	26.2	49%	0.485	12%	0.123	S	C	.	.	T	Hydrogen-bonded Turn	trans	-91.1	7	176.6	74.6	0	0	0	0	113.9	R246 E270 L271 K275	R246-T273 PolarHBondContact NH2-O 3.43Å; R246-T273 VanDerWaalsContact NH2-O 3.11Å; E270-T273 PolarHBondContact O-N 3.06Å; E270-T273 PolarHBondContact O-OG1 3.26Å; L271-T273 PolarHBondContact O-N 2.91Å; T273-K275 PolarHBondContact O-N 3.1Å
274	F	93.5	Very high	93.1	Very high	5 Å²	5	26.9 Å²	26.9	2%	0.022	13%	0.128	C	C	.	.			trans	-67.3	116.6	178.2	-158.5	-93.9	0	0	0	110.4	R113 R246 P247 L250 L271 R276 I277 L278	R113-F274 PolarHBondContact NH1-O 2.86Å; R246-F274 HydrophobicContact CG-CD2 4.41Å; R246-F274 HydrophobicContact CG-CE2 3.8Å; P247-F274 WeakPolarHBondContact O-CZ 3.49Å; L250-F274 HydrophobicContact CB-CE1 4.14Å; L250-F274 HydrophobicContact CB-CE2 4.2Å; L250-F274 HydrophobicContact CB-CZ 3.66Å; L250-F274 HydrophobicContact CD2-CD2 4.4Å; L250-F274 HydrophobicContact CD2-CE2 3.86Å; L250-F274 HydrophobicContact CD2-CZ 4.2Å; L271-F274 WeakPolarHBondContact O-CB 3.41Å; L271-F274 PolarHBondContact O-N 3.23Å; F274-R276 HydrophobicContact CD1-CB 4.41Å; F274-R276 HydrophobicContact CE1-CB 3.85Å; F274-I277 WeakPolarHBondContact CE1-O 3.27Å; F274-L278 HydrophobicContact CD1-CB 3.83Å; F274-L278 HydrophobicContact CE1-CB 4.29Å; F274-L278 HydrophobicContact CG-CB 4.42Å
275	K	90.2	Very high	92.9	Very high	165 Å²	165	27.3 Å²	27.3	72%	0.717	13%	0.129	S	C	*	.			trans	-89.7	-6.6	-170.7	-66.7	-177.5	-178.6	177.7	0	114.6	G111 T273	G111-K275 WeakPolarHBondContact CA-O 3.5Å; G111-K275 PolarHBondContact N-O 3.18Å; T273-K275 PolarHBondContact O-N 3.1Å
276	R	92.3	Very high	92.7	Very high	35 Å²	35	28.9 Å²	28.9	13%	0.132	14%	0.137	C	C	.	.	S	Bend	trans	-115.3	-150.2	-175.6	-59.7	-171.7	-83.3	-106.2	-6	110.1	G111 R246 P247 F248 F274	G111-R276 PolarHBondContact N-O 3.25Å; R246-R276 VanDerWaalsContact CG-NH2 3.26Å; R246-R276 PolarHBondContact O-NH2 3.13Å; P247-R276 PolarHBondContact O-NE 3.08Å; F248-R276 HydrophobicContact CD2-CG 4.48Å; F248-R276 HydrophobicContact CE2-CG 4.48Å; F248-R276 WeakPolarHBondContact O-CB 3.46Å; F274-R276 HydrophobicContact CD1-CB 4.41Å; F274-R276 HydrophobicContact CE1-CB 3.85Å
277	I	96.5	Very high	92.6	Very high	0 Å²	0	27.9 Å²	27.9	0%	0	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.4	116	-179.7	-57.2	177.4	0	0	0	109	V86 L108 F248 M249 L250 F274 V279	V86-I277 HydrophobicContact CG2-CD1 4.26Å; L108-I277 HydrophobicContact CB-CD1 4.22Å; L108-I277 HydrophobicContact CB-CG2 4.02Å; L108-I277 HydrophobicContact CD1-CG2 4.33Å; F248-I277 HydrophobicContact CD1-CD1 4.44Å; F248-I277 HydrophobicContact CE1-CD1 4.1Å; F248-I277 HydrophobicContact CE1-CG1 4.24Å; F248-I277 PolarHBondContact O-N 3.18Å; M249-I277 CarbonylContact C-O 3.15Å; M249-I277 WeakPolarHBondContact CA-O 3.33Å; M249-I277 HydrophobicContact CB-CB 4.4Å; M249-I277 HydrophobicContact CE-CD1 4.05Å; M249-I277 HydrophobicContact CE-CG2 4.28Å; M249-I277 HydrophobicContact CG-CB 4.28Å; M249-I277 HydrophobicContact CG-CG2 4.05Å; L250-I277 PolarHBondContact N-O 3.05Å; F274-I277 WeakPolarHBondContact CE1-O 3.27Å; I277-V279 HydrophobicContact CG2-CG2 4.18Å
278	L	98	Very high	92.5	Very high	0 Å²	0	27.9 Å²	27.9	0%	0	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	126.7	167.9	173.5	61.9	0	0	0	108.4	R112 R113 Y114 L250 L252 L271 F274 L280 V291	R112-L278 PolarHBondContact O-N 3.23Å; R113-L278 CarbonylContact C-O 3.47Å; R113-L278 WeakPolarHBondContact CA-O 3.3Å; R113-L278 HydrophobicContact CB-CB 4.19Å; R113-L278 HydrophobicContact CB-CD2 4.21Å; R113-L278 HydrophobicContact CG-CB 3.98Å; R113-L278 HydrophobicContact CG-CD2 4.12Å; Y114-L278 PolarHBondContact N-O 3.46Å; L250-L278 HydrophobicContact CB-CD1 4.01Å; L250-L278 HydrophobicContact CD2-CD1 4.02Å; L250-L278 HydrophobicContact CG-CD1 3.93Å; L250-L278 WeakPolarHBondContact O-CA 3.21Å; L252-L278 HydrophobicContact CD1-CD1 4.07Å; L252-L278 HydrophobicContact CG-CD1 4.3Å; L271-L278 HydrophobicContact CB-CD2 4.12Å; L271-L278 HydrophobicContact CD1-CD2 4.44Å; L271-L278 HydrophobicContact CD2-CD1 4.44Å; L271-L278 HydrophobicContact CD2-CD2 4.06Å; L271-L278 HydrophobicContact CG-CD2 4.45Å; F274-L278 HydrophobicContact CD1-CB 3.83Å; F274-L278 HydrophobicContact CE1-CB 4.29Å; F274-L278 HydrophobicContact CG-CB 4.42Å; L278-L280 HydrophobicContact CD2-CD2 3.93Å; L278-L280 HydrophobicContact CG-CD2 4.23Å; L278-V291 HydrophobicContact CD2-CG1 3.67Å
279	V	98	Very high	92.5	Very high	4 Å²	4	29.1 Å²	29.1	2%	0.024	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.3	120.9	166.8	-170.4	0	0	0	0	107.7	L108 Y114 L116 L128 L250 L251 L252 I277	L108-V279 HydrophobicContact CD1-CG2 3.98Å; L108-V279 HydrophobicContact CD2-CG2 3.86Å; Y114-V279 WeakPolarHBondContact O-CA 3.45Å; L116-V279 HydrophobicContact CB-CG1 4.29Å; L128-V279 HydrophobicContact CD2-CB 4.16Å; L128-V279 HydrophobicContact CD2-CG1 3.76Å; L250-V279 PolarHBondContact O-N 3.22Å; L251-V279 WeakPolarHBondContact CA-O 3.44Å; L251-V279 HydrophobicContact CD2-CB 3.65Å; L251-V279 HydrophobicContact CD2-CG2 3.81Å; L252-V279 PolarHBondContact N-O 3.03Å; I277-V279 HydrophobicContact CG2-CG2 4.18Å
280	L	95.7	Very high	92.4	Very high	0 Å²	0	26.9 Å²	26.9	0%	0	14%	0.135	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	135.6	-176.8	78.4	92.4	0	0	0	110.8	Y114 G115 L116 L252 L278 F287 L288 V291 C292	Y114-L280 PolarHBondContact O-N 3.34Å; G115-L280 CarbonylContact C-O 3.58Å; G115-L280 WeakPolarHBondContact CA-O 3.41Å; L116-L280 PolarHBondContact N-O 3.21Å; L252-L280 HydrophobicContact CB-CB 4.45Å; L252-L280 CarbonylContact O-C 3.56Å; L252-L280 WeakPolarHBondContact O-CA 3.4Å; L278-L280 HydrophobicContact CD2-CD2 3.93Å; L278-L280 HydrophobicContact CG-CD2 4.23Å; L280-F287 HydrophobicContact CD1-CD1 4.27Å; L280-F287 HydrophobicContact CD1-CE1 4.18Å; L280-F287 HydrophobicContact CD2-CE1 4.49Å; L280-L288 HydrophobicContact CD1-CD2 3.48Å; L280-L288 VanDerWaalsContact CD1-CD2 3.48Å; L280-L288 HydrophobicContact CG-CD2 4.44Å; L280-V291 HydrophobicContact CD2-CB 4.11Å; L280-V291 HydrophobicContact CD2-CG1 3.57Å; L280-C292 VanDerWaalsContact CD2-SG 3.56Å
281	V	93.8	Very high	92.5	Very high	1 Å²	1	25.2 Å²	25.2	1%	0.006	13%	0.127	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	126.2	165.2	176.2	0	0	0	0	106.1	L116 K124 L128 L252 D253 E254 P255	L116-V281 HydrophobicContact CB-CG2 3.8Å; L116-V281 HydrophobicContact CD2-CG2 3.81Å; L116-V281 HydrophobicContact CG-CG2 3.99Å; K124-V281 HydrophobicContact CB-CG2 4.14Å; K124-V281 HydrophobicContact CD-CG1 4.22Å; L128-V281 HydrophobicContact CD1-CB 4.3Å; L128-V281 HydrophobicContact CD1-CG2 3.54Å; L128-V281 HydrophobicContact CG-CG2 4.27Å; L252-V281 PolarHBondContact O-N 2.9Å; D253-V281 WeakPolarHBondContact OD1-CB 3.3Å; D253-V281 WeakPolarHBondContact OD1-CG1 3.35Å; E254-V281 VanDerWaalsContact CA-O 3.26Å; E254-V281 WeakPolarHBondContact CA-O 3.44Å; E254-V281 PolarHBondContact N-O 3.1Å; E254-V281 WeakPolarHBondContact OE1-CG1 3.44Å; P255-V281 WeakPolarHBondContact CD-O 3.33Å
282	S	90	Very high	92.6	Very high	2 Å²	2	25.5 Å²	25.5	1%	0.014	13%	0.129	C	C	.	.			trans	-147.9	140.5	176.4	177	0	0	0	0	109.2	E254 S284	E254-S282 WeakPolarHBondContact OE1-CA 3.38Å; E254-S282 PolarHBondContact OE1-N 3.29Å; E254-S282 WeakPolarHBondContact OE2-CA 3.49Å; S282-S284 PolarHBondContact OG-N 2.84Å
283	H	83.1	Confident	92.7	Very high	24 Å²	24	22.6 Å²	22.6	11%	0.111	12%	0.119	C	C	.	.	S	Bend	trans	-87.7	-6.7	169.8	-68.7	-59.4	0	0	0	113.1	N120 K124 E254 L547 D548 I549 I552	N120-H283 PolarHBondContact OD1-CE1 2.97Å; N120-H283 VanDerWaalsContact OD1-CE1 3.24Å; N120-H283 PolarHBondContact OD1-NE2 3.31Å; K124-H283 PolarHBondContact NZ-CE1 3.13Å; K124-H283 VanDerWaalsContact NZ-CE1 3.35Å; E254-H283 IonicContact OE1-CD2 3.2Å; E254-H283 PolarHBondContact OE1-CD2 3.4Å; E254-H283 IonicContact OE1-CG 2.7Å; E254-H283 PolarHBondContact OE1-N 3.17Å; E254-H283 IonicContact OE1-ND1 2.86Å; E254-H283 IonicContact OE1-NE2 2.76Å; E254-H283 PolarHBondContact OE1-NE2 2.9Å; E254-H283 IonicContact OE2-CD2 2.79Å; E254-H283 IonicContact OE2-CG 2.73Å; E254-H283 PolarHBondContact OE2-N 2.91Å; H283-L547 WeakPolarHBondContact CB-O 3.42Å; H283-L547 PolarHBondContact CD2-O 3.35Å; H283-L547 VanDerWaalsContact CD2-O 3.27Å; H283-L547 PolarHBondContact ND1-O 3.38Å; H283-D548 WeakPolarHBondContact ND1-CA 3.36Å; H283-I549 WeakPolarHBondContact O-CG1 3.39Å; H283-I552 HydrophobicContact CB-CD1 4.41Å
284	S	85.8	Confident	93	Very high	15 Å²	15	19.5 Å²	19.5	11%	0.105	10%	0.099	C	C	.	.			trans	-88.8	111.8	176.6	178.3	0	0	0	0	111.3	S282 F287 L288	S282-S284 PolarHBondContact OG-N 2.84Å; S284-F287 PolarHBondContact O-N 2.9Å; S284-F287 PolarHBondContact OG-N 3.49Å; S284-L288 WeakPolarHBondContact O-CG 3.28Å; S284-L288 PolarHBondContact O-N 2.86Å
285	Q	87.9	Confident	93.2	Very high	18 Å²	18	19.2 Å²	19.2	8%	0.084	10%	0.098	C	C	.	.	H	α-helix	trans	-62.6	-41.4	176.4	-65.5	-169.5	-1.7	0	0	112.5	F287 L288 N289 Y310 I549 R574	Q285-F287 VanDerWaalsContact C-N 3.34Å; Q285-F287 PolarHBondContact O-N 2.87Å; Q285-L288 PolarHBondContact O-N 2.93Å; Q285-N289 WeakPolarHBondContact O-CB 3.5Å; Q285-N289 PolarHBondContact O-N 3.48Å; Q285-N289 PolarHBondContact O-ND2 3.3Å; Q285-Y310 HydrophobicContact CB-CD1 3.95Å; Q285-Y310 HydrophobicContact CB-CE1 4.14Å; Q285-Y310 HydrophobicContact CG-CD1 3.78Å; Q285-Y310 HydrophobicContact CG-CE1 3.46Å; Q285-Y310 VanDerWaalsContact CG-CE1 3.46Å; Q285-Y310 HydrophobicContact CG-CE2 4.48Å; Q285-Y310 HydrophobicContact CG-CG 4.44Å; Q285-Y310 PolarHBondContact NE2-OH 3.21Å; Q285-Y310 VanDerWaalsContact NE2-OH 3.12Å; Q285-I549 HydrophobicContact CG-CD1 4.34Å; Q285-I549 HydrophobicContact CG-CG2 4.06Å; Q285-R574 VanDerWaalsContact OE1-CD 3.23Å
286	D	89	Confident	93.5	Very high	33 Å²	33	11.5 Å²	11.5	18%	0.176	7%	0.065	C	C	.	.	H	α-helix	trans	-60.9	-44.3	178.4	176.6	61.3	0	0	0	111.1	N289 G290 F573 K602	D286-N289 PolarHBondContact O-N 3.49Å; D286-G290 PolarHBondContact O-N 3.43Å; D286-F573 HydrophobicContact CB-CB 4.19Å; D286-F573 VanDerWaalsContact OD2-CD2 3.28Å; D286-F573 WeakPolarHBondContact OD2-CD2 3.48Å; D286-K602 IonicContact OD1-NZ 3.91Å; D286-K602 PolarHBondContact OD1-NZ 3.42Å; D286-K602 IonicContact OD2-NZ 3.43Å; D286-K602 PolarHBondContact OD2-NZ 3.26Å
287	F	91.9	Very high	93.6	Very high	3 Å²	3	10.3 Å²	10.3	1%	0.013	6%	0.061	C	C	.	.	H	α-helix	trans	-64.1	-44.6	174.4	-172.2	-102.3	0	0	0	112.6	P255 T256 L267 E268 L271 L280 S284 Q285 N289 G290 V291	P255-F287 HydrophobicContact CG-CE1 3.95Å; P255-F287 HydrophobicContact CG-CZ 4.17Å; T256-F287 HydrophobicContact CG2-CB 4.27Å; T256-F287 HydrophobicContact CG2-CD1 3.92Å; T256-F287 HydrophobicContact CG2-CD2 3.62Å; T256-F287 HydrophobicContact CG2-CE1 4.06Å; T256-F287 HydrophobicContact CG2-CE2 3.78Å; T256-F287 HydrophobicContact CG2-CG 3.67Å; T256-F287 HydrophobicContact CG2-CZ 3.97Å; L267-F287 HydrophobicContact CB-CE2 4.38Å; L267-F287 HydrophobicContact CD2-CE2 4Å; L267-F287 HydrophobicContact CD2-CZ 3.8Å; L267-F287 HydrophobicContact CG-CE2 4.08Å; L267-F287 HydrophobicContact CG-CZ 4.06Å; E268-F287 HydrophobicContact CB-CD2 4.19Å; E268-F287 HydrophobicContact CB-CE2 4.22Å; L271-F287 HydrophobicContact CD1-CE1 4.44Å; L271-F287 HydrophobicContact CD1-CZ 3.77Å; L280-F287 HydrophobicContact CD1-CD1 4.27Å; L280-F287 HydrophobicContact CD1-CE1 4.18Å; L280-F287 HydrophobicContact CD2-CE1 4.49Å; S284-F287 PolarHBondContact O-N 2.9Å; S284-F287 PolarHBondContact OG-N 3.49Å; Q285-F287 VanDerWaalsContact C-N 3.34Å; Q285-F287 PolarHBondContact O-N 2.87Å; F287-N289 VanDerWaalsContact C-N 3.25Å; F287-N289 PolarHBondContact O-N 3.32Å; F287-G290 PolarHBondContact O-N 3.25Å; F287-V291 HydrophobicContact CD2-CG2 4.43Å; F287-V291 HydrophobicContact CE1-CG2 4.31Å; F287-V291 HydrophobicContact CE2-CG2 4.18Å; F287-V291 HydrophobicContact CZ-CG2 4.14Å; F287-V291 WeakPolarHBondContact O-CG2 3.5Å; F287-V291 PolarHBondContact O-N 3.33Å
288	L	93.7	Very high	93.5	Very high	0 Å²	0	10.3 Å²	10.3	0%	0	6%	0.061	C	C	.	.	H	α-helix	trans	-59	-38.7	174.3	-73.1	168.7	0	0	0	111.5	I117 L280 S284 Q285 C292 Y310 I549	I117-L288 HydrophobicContact CG2-CD1 3.92Å; L280-L288 HydrophobicContact CD1-CD2 3.48Å; L280-L288 VanDerWaalsContact CD1-CD2 3.48Å; L280-L288 HydrophobicContact CG-CD2 4.44Å; S284-L288 WeakPolarHBondContact O-CG 3.28Å; S284-L288 PolarHBondContact O-N 2.86Å; Q285-L288 PolarHBondContact O-N 2.93Å; L288-C292 WeakPolarHBondContact O-CB 3.43Å; L288-C292 PolarHBondContact O-N 3.06Å; L288-Y310 HydrophobicContact CD1-CD2 3.82Å; L288-Y310 HydrophobicContact CD1-CE2 4.41Å; L288-Y310 HydrophobicContact CD1-CG 4.39Å; L288-I549 HydrophobicContact CD1-CD1 4.36Å
289	N	93.7	Very high	93.1	Very high	33 Å²	33	11.8 Å²	11.8	18%	0.176	7%	0.068	C	C	.	.	H	α-helix	trans	-69.2	-38.9	178.9	-84	-33.7	0	0	0	113.2	Q285 D286 F287 N309 Y310 D311	Q285-N289 WeakPolarHBondContact O-CB 3.5Å; Q285-N289 PolarHBondContact O-N 3.48Å; Q285-N289 PolarHBondContact O-ND2 3.3Å; D286-N289 PolarHBondContact O-N 3.49Å; F287-N289 VanDerWaalsContact C-N 3.25Å; F287-N289 PolarHBondContact O-N 3.32Å; N289-N309 WeakPolarHBondContact OD1-CB 3.38Å; N289-N309 VanDerWaalsContact OD1-CG 3.24Å; N289-N309 PolarHBondContact OD1-ND2 3.39Å; N289-Y310 WeakPolarHBondContact OD1-CA 3.35Å; N289-Y310 VanDerWaalsContact OD1-CB 3.31Å; N289-Y310 WeakPolarHBondContact OD1-CB 3.5Å; N289-Y310 PolarHBondContact OD1-N 3.41Å; N289-D311 PolarHBondContact ND2-OD1 3.35Å; N289-D311 PolarHBondContact ND2-OD2 3.34Å; N289-D311 PolarHBondContact OD1-N 2.91Å
290	G	92.8	Very high	92.6	Very high	18 Å²	18	16.7 Å²	16.7	19%	0.186	9%	0.093	C	C	.	.	H	α-helix	trans	-71.1	-33.8	178.1	0	0	0	0	0	113.6	D286 F287	D286-G290 PolarHBondContact O-N 3.43Å; F287-G290 PolarHBondContact O-N 3.25Å
291	V	96	Very high	92.4	Very high	1 Å²	1	21 Å²	21	1%	0.006	11%	0.112	C	C	.	.	H	α-helix	trans	-100.4	-48.8	-173.2	-178.3	0	0	0	0	113.2	R113 E268 L271 L278 L280 F287	R113-V291 PolarHBondContact NE-O 3.4Å; E268-V291 HydrophobicContact CB-CG2 4.35Å; E268-V291 HydrophobicContact CG-CG2 4.01Å; L271-V291 HydrophobicContact CB-CG1 3.71Å; L271-V291 HydrophobicContact CB-CG2 4.03Å; L278-V291 HydrophobicContact CD2-CG1 3.67Å; L280-V291 HydrophobicContact CD2-CB 4.11Å; L280-V291 HydrophobicContact CD2-CG1 3.57Å; F287-V291 HydrophobicContact CD2-CG2 4.43Å; F287-V291 HydrophobicContact CE1-CG2 4.31Å; F287-V291 HydrophobicContact CE2-CG2 4.18Å; F287-V291 HydrophobicContact CZ-CG2 4.14Å; F287-V291 WeakPolarHBondContact O-CG2 3.5Å; F287-V291 PolarHBondContact O-N 3.33Å
292	C	96.8	Very high	92.4	Very high	8 Å²	8	24.6 Å²	24.6	5%	0.054	13%	0.128	C	C	.	.			trans	-77.9	141.1	-163.9	-62.7	0	0	0	0	113.9	R113 G115 L280 L288 I295	R113-C292 CarbonylContact O-C 3.57Å; R113-C292 WeakPolarHBondContact O-CA 3.5Å; G115-C292 VanDerWaalsContact CA-SG 3.51Å; G115-C292 PolarHBondContact N-SG 2.87Å; G115-C292 VanDerWaalsContact N-SG 3.38Å; L280-C292 VanDerWaalsContact CD2-SG 3.56Å; L288-C292 WeakPolarHBondContact O-CB 3.43Å; L288-C292 PolarHBondContact O-N 3.06Å; C292-I295 HydrophobicContact CB-CD1 4.1Å
293	T	96.8	Very high	92.7	Very high	30 Å²	30	25 Å²	25	18%	0.184	13%	0.13	C	C	.	.	S	Bend	trans	-99	-18	168.5	60.5	0	0	0	0	112.9	R113 G308	R113-T293 VanDerWaalsContact CZ-CG2 3.49Å; R113-T293 PolarHBondContact N-OG1 3.04Å; R113-T293 PolarHBondContact O-N 3.35Å; R113-T293 PolarHBondContact O-OG1 3.08Å; T293-G308 CarbonylContact C-O 3.6Å; T293-G308 CarbonylContact O-C 3.58Å; T293-G308 WeakPolarHBondContact O-CA 3.47Å; T293-G308 PolarHBondContact O-N 3.01Å; T293-G308 VanDerWaalsContact O-O 3.11Å
294	N	97.6	Very high	93.3	Very high	14 Å²	14	28.3 Å²	28.3	8%	0.075	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.2	148.6	-176	-68.1	84.5	0	0	0	109.2	R113 Y114 G115 Y306 G308	R113-N294 PolarHBondContact O-N 2.87Å; R113-N294 VanDerWaalsContact O-N 3.14Å; Y114-N294 CarbonylContact C-O 3.41Å; Y114-N294 VanDerWaalsContact CA-O 3.32Å; Y114-N294 WeakPolarHBondContact CA-O 3.4Å; Y114-N294 HydrophobicContact CD1-CB 3.51Å; Y114-N294 HydrophobicContact CE1-CB 3.65Å; Y114-N294 HydrophobicContact CG-CB 4.38Å; G115-N294 PolarHBondContact N-O 3.17Å; N294-Y306 CarbonylContact C-O 3.54Å; N294-Y306 VanDerWaalsContact CA-O 3.31Å; N294-Y306 WeakPolarHBondContact CA-O 3.49Å; N294-G308 CarbonylContact C-O 3.58Å; N294-G308 WeakPolarHBondContact CA-O 3.23Å; N294-G308 PolarHBondContact N-O 3.33Å
295	I	97.4	Very high	93.8	Very high	0 Å²	0	30.7 Å²	30.7	0%	0	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117	128.2	174.9	-61.8	-62.2	0	0	0	109.2	G115 I117 C292 Y306 Y313	G115-I295 CarbonylContact O-C 3.47Å; G115-I295 WeakPolarHBondContact O-CA 3.29Å; I117-I295 HydrophobicContact CD1-CG2 3.32Å; I117-I295 HydrophobicContact CG1-CG2 3.6Å; I117-I295 HydrophobicContact CG2-CG2 4.49Å; C292-I295 HydrophobicContact CB-CD1 4.1Å; I295-Y306 PolarHBondContact N-O 3.34Å; I295-Y306 PolarHBondContact O-N 3.07Å; I295-Y313 HydrophobicContact CB-CD2 4.45Å; I295-Y313 HydrophobicContact CB-CG 4.21Å; I295-Y313 HydrophobicContact CG1-CG 4.38Å; I295-Y313 HydrophobicContact CG2-CD1 4.26Å; I295-Y313 HydrophobicContact CG2-CD2 3.93Å; I295-Y313 HydrophobicContact CG2-CE2 4.42Å; I295-Y313 HydrophobicContact CG2-CG 3.82Å
296	I	97.1	Very high	94.2	Very high	3 Å²	3	31 Å²	31	2%	0.015	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.7	108.5	170.5	-52.6	178.7	0	0	0	106.9	L108 Y114 G115 L116 I117 L303 K304 Y305	L108-I296 HydrophobicContact CD2-CD1 3.85Å; Y114-I296 HydrophobicContact CD1-CD1 3.73Å; Y114-I296 HydrophobicContact CD1-CG1 3.72Å; Y114-I296 HydrophobicContact CG-CD1 3.91Å; Y114-I296 HydrophobicContact CG-CG1 4.26Å; G115-I296 PolarHBondContact O-N 3.38Å; L116-I296 WeakPolarHBondContact CA-O 3.48Å; L116-I296 HydrophobicContact CD1-CB 4.01Å; L116-I296 HydrophobicContact CD1-CG2 3.81Å; I117-I296 PolarHBondContact N-O 2.98Å; I296-L303 HydrophobicContact CG2-CB 4.14Å; I296-L303 HydrophobicContact CG2-CD2 3.93Å; I296-L303 HydrophobicContact CG2-CG 4.46Å; I296-K304 CarbonylContact C-O 3.59Å; I296-K304 WeakPolarHBondContact CA-O 3.22Å; I296-Y305 HydrophobicContact CD1-CD1 4.42Å; I296-Y305 HydrophobicContact CD1-CE1 3.77Å; I296-Y305 HydrophobicContact CG1-CD1 3.89Å; I296-Y305 HydrophobicContact CG1-CE1 3.69Å; I296-Y305 HydrophobicContact CG2-CE1 4.22Å
297	H	94.7	Very high	94.5	Very high	9 Å²	9	34.9 Å²	34.9	4%	0.042	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.9	112.6	175.9	-175.2	-154.4	0	0	0	109.8	I117 K304 Y306 Y313 R317	I117-H297 HydrophobicContact CD1-CB 4.41Å; I117-H297 HydrophobicContact CG1-CB 4.18Å; H297-K304 HydrophobicContact CB-CB 4.45Å; H297-K304 PolarHBondContact N-O 3.15Å; H297-K304 PolarHBondContact O-N 3.12Å; H297-Y306 HydrophobicContact CB-CD2 4.25Å; H297-Y306 HydrophobicContact CB-CE2 3.78Å; H297-Y313 HydrophobicContact CB-CE2 3.98Å; H297-Y313 PolarHBondContact CE1-OH 2.83Å; H297-Y313 AromaticContact ND1-CE2 3.98Å; H297-Y313 PolarHBondContact ND1-OH 2.76Å; H297-R317 PolarHBondContact CE1-NH1 3.24Å; H297-R317 VanDerWaalsContact CE1-NH1 3.33Å
298	M	93.5	Very high	94.6	Very high	1 Å²	1	35.1 Å²	35.1	1%	0.005	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.2	107.9	173.3	-174.5	171.7	178.2	0	0	109.2	L100 L101 L116 I117 I122 K124 L303	L100-M298 HydrophobicContact CB-CE 4.29Å; L100-M298 WeakPolarHBondContact O-CE 3.27Å; L101-M298 HydrophobicContact CD1-CE 4.44Å; L101-M298 HydrophobicContact CD2-CE 3.6Å; L101-M298 HydrophobicContact CD2-CG 4.13Å; L101-M298 HydrophobicContact CD2-SD 4.33Å; L101-M298 HydrophobicContact CG-CE 3.75Å; L116-M298 HydrophobicContact CD1-CB 4.25Å; I117-M298 PolarHBondContact O-N 3.46Å; I122-M298 HydrophobicContact CD1-CG 4.48Å; I122-M298 WeakPolarHBondContact CD1-O 3.36Å; I122-M298 HydrophobicContact CG1-CE 4.23Å; I122-M298 HydrophobicContact CG1-CG 4.32Å; I122-M298 HydrophobicContact CG2-CB 4.4Å; I122-M298 HydrophobicContact CG2-CE 4.31Å; I122-M298 HydrophobicContact CG2-CG 4Å; I122-M298 HydrophobicContact CG2-SD 3.85Å; I122-M298 WeakPolarHBondContact O-CE 3.44Å; K124-M298 HydrophobicContact CG-SD 4.41Å; M298-L303 HydrophobicContact CB-CD2 3.97Å; M298-L303 HydrophobicContact CG-CD2 4.03Å
299	H	89.9	Confident	94.6	Very high	31 Å²	31	37.1 Å²	37.1	14%	0.144	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.7	142.3	-176.9	-177.6	-96.2	0	0	0	111	K301 K302	H299-K301 VanDerWaalsContact C-N 3.27Å; H299-K301 PolarHBondContact O-N 3.29Å; H299-K302 PolarHBondContact N-O 3.07Å; H299-K302 PolarHBondContact O-N 3Å; H299-K302 VanDerWaalsContact O-O 3.11Å
300	N	87.9	Confident	94.5	Very high	106 Å²	106	36.3 Å²	36.3	57%	0.567	19%	0.185	S	C	*	.	T	Hydrogen-bonded Turn	trans	47.8	45.4	-178	-69.8	-9.4	0	0	0	113.7	K302	N300-K302 PolarHBondContact O-N 3.42Å; N300-K302 VanDerWaalsContact O-N 3.13Å
301	K	91.6	Very high	94.6	Very high	91 Å²	91	39.7 Å²	39.7	40%	0.396	20%	0.199	S	C	.	.	T	Hydrogen-bonded Turn	trans	60.2	17.5	-178.9	-50.6	174.7	174.1	-177.4	0	115.3	E99 L100 L101 S102 H299	E99-K301 HydrophobicContact CG-CD 4.23Å; E99-K301 WeakPolarHBondContact O-CE 3.24Å; E99-K301 IonicContact OE2-NZ 2.83Å; E99-K301 PolarHBondContact OE2-NZ 3.25Å; L100-K301 WeakPolarHBondContact O-CA 3.37Å; L101-K301 WeakPolarHBondContact CA-O 3.12Å; S102-K301 PolarHBondContact N-O 2.95Å; H299-K301 VanDerWaalsContact C-N 3.27Å; H299-K301 PolarHBondContact O-N 3.29Å
302	K	94.2	Very high	94.5	Very high	76 Å²	76	44.6 Å²	44.6	33%	0.33	22%	0.222	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	153	177.3	-62.7	-64.3	-171.5	-177.5	0	110.4	S102 D103 H299 N300	S102-K302 WeakPolarHBondContact O-CD 3.3Å; S102-K302 WeakPolarHBondContact O-CE 3.43Å; S102-K302 PolarHBondContact O-NZ 3.44Å; D103-K302 PolarHBondContact O-NZ 3.32Å; H299-K302 PolarHBondContact N-O 3.07Å; H299-K302 PolarHBondContact O-N 3Å; H299-K302 VanDerWaalsContact O-O 3.11Å; N300-K302 PolarHBondContact O-N 3.42Å; N300-K302 VanDerWaalsContact O-N 3.13Å
303	L	96.4	Very high	94.3	Very high	12 Å²	12	44.5 Å²	44.5	6%	0.063	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.2	123.3	168.1	-60.1	176.4	0	0	0	108.8	L91 L101 T104 L106 L116 L127 I296 M298 Y305	L91-L303 HydrophobicContact CD2-CD1 4.34Å; L101-L303 HydrophobicContact CD1-CD1 4.14Å; L101-L303 HydrophobicContact CD1-CD2 4.32Å; L101-L303 HydrophobicContact CD1-CG 4.21Å; L101-L303 HydrophobicContact CD2-CD2 3.95Å; L101-L303 HydrophobicContact CD2-CG 3.99Å; T104-L303 HydrophobicContact CG2-CB 4.42Å; T104-L303 HydrophobicContact CG2-CD1 4.04Å; T104-L303 HydrophobicContact CG2-CG 3.95Å; T104-L303 PolarHBondContact OG1-N 3.05Å; L106-L303 HydrophobicContact CD1-CD1 4.09Å; L116-L303 HydrophobicContact CD1-CD2 4.49Å; L127-L303 HydrophobicContact CD2-CD1 4.03Å; L127-L303 HydrophobicContact CD2-CD2 3.98Å; I296-L303 HydrophobicContact CG2-CB 4.14Å; I296-L303 HydrophobicContact CG2-CD2 3.93Å; I296-L303 HydrophobicContact CG2-CG 4.46Å; M298-L303 HydrophobicContact CB-CD2 3.97Å; M298-L303 HydrophobicContact CG-CD2 4.03Å; L303-Y305 HydrophobicContact CB-CE2 4.09Å
304	K	94.7	Very high	94.1	Very high	93 Å²	93	45.4 Å²	45.4	40%	0.404	23%	0.226	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	135.7	174.1	-66.5	-176.3	-179.9	-178.3	0	109.5	I296 H297 Y306	I296-K304 CarbonylContact C-O 3.59Å; I296-K304 WeakPolarHBondContact CA-O 3.22Å; H297-K304 HydrophobicContact CB-CB 4.45Å; H297-K304 PolarHBondContact N-O 3.15Å; H297-K304 PolarHBondContact O-N 3.12Å; K304-Y306 HydrophobicContact CB-CE2 3.7Å
305	Y	96.1	Very high	93.9	Very high	65 Å²	65	51.1 Å²	51.1	26%	0.255	25%	0.25	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107	134.3	-176	-63	-94.8	0	0	0	110.6	K105 L106 E107 Y114 I296 L303	K105-Y305 WeakPolarHBondContact O-CE2 3.5Å; K105-Y305 PolarHBondContact O-OH 3.01Å; L106-Y305 WeakPolarHBondContact CA-OH 3.5Å; E107-Y305 HydrophobicContact CB-CE1 4.11Å; E107-Y305 HydrophobicContact CB-CE2 4.44Å; E107-Y305 PolarHBondContact N-OH 2.8Å; E107-Y305 WeakPolarHBondContact O-CE1 3.37Å; Y114-Y305 HydrophobicContact CE1-CD1 4.48Å; I296-Y305 HydrophobicContact CD1-CD1 4.42Å; I296-Y305 HydrophobicContact CD1-CE1 3.77Å; I296-Y305 HydrophobicContact CG1-CD1 3.89Å; I296-Y305 HydrophobicContact CG1-CE1 3.69Å; I296-Y305 HydrophobicContact CG2-CE1 4.22Å; L303-Y305 HydrophobicContact CB-CE2 4.09Å
306	Y	96.4	Very high	93.7	Very high	24 Å²	24	53.6 Å²	53.6	9%	0.094	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	130.2	176.3	-61.1	-98.3	0	0	0	108.3	N294 I295 H297 K304 Y313 T316 L320	N294-Y306 CarbonylContact C-O 3.54Å; N294-Y306 VanDerWaalsContact CA-O 3.31Å; N294-Y306 WeakPolarHBondContact CA-O 3.49Å; I295-Y306 PolarHBondContact N-O 3.34Å; I295-Y306 PolarHBondContact O-N 3.07Å; H297-Y306 HydrophobicContact CB-CD2 4.25Å; H297-Y306 HydrophobicContact CB-CE2 3.78Å; K304-Y306 HydrophobicContact CB-CE2 3.7Å; Y306-Y313 AromaticContact CD1-CD2 3.98Å; Y306-Y313 HydrophobicContact CD1-CD2 3.98Å; Y306-Y313 AromaticContact CD2-CD2 3.61Å; Y306-Y313 HydrophobicContact CD2-CD2 3.61Å; Y306-Y313 AromaticContact CD2-CE2 3.98Å; Y306-Y313 HydrophobicContact CD2-CE2 3.98Å; Y306-Y313 HydrophobicContact CE1-CD2 4.24Å; Y306-Y313 AromaticContact CE2-CD2 3.93Å; Y306-Y313 HydrophobicContact CE2-CD2 3.93Å; Y306-Y313 AromaticContact CE2-CE2 3.84Å; Y306-Y313 HydrophobicContact CE2-CE2 3.84Å; Y306-Y313 AromaticContact CG-CD2 3.65Å; Y306-Y313 HydrophobicContact CG-CD2 3.65Å; Y306-Y313 HydrophobicContact CG-CE2 4.4Å; Y306-T316 HydrophobicContact CD1-CG2 3.91Å; Y306-T316 HydrophobicContact CE1-CG2 4.16Å; Y306-L320 HydrophobicContact CE1-CD1 3.84Å
307	T	95.4	Very high	93.4	Very high	114 Å²	114	55 Å²	55	70%	0.699	27%	0.271	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-82.1	132	172.5	-59.3	0	0	0	0	108.6
308	G	94.2	Very high	93.1	Very high	9 Å²	9	59.7 Å²	59.7	9%	0.093	30%	0.295	C	S	.	.	S	Bend	trans	119.1	178	-177.7	0	0	0	0	0	113.7	T293 N294	T293-G308 CarbonylContact C-O 3.6Å; T293-G308 CarbonylContact O-C 3.58Å; T293-G308 WeakPolarHBondContact O-CA 3.47Å; T293-G308 PolarHBondContact O-N 3.01Å; T293-G308 VanDerWaalsContact O-O 3.11Å; N294-G308 CarbonylContact C-O 3.58Å; N294-G308 WeakPolarHBondContact CA-O 3.23Å; N294-G308 PolarHBondContact N-O 3.33Å
309	N	93.2	Very high	93.1	Very high	41 Å²	41	64 Å²	64	22%	0.219	32%	0.315	C	S	.	.			trans	-77.8	-174.2	174.1	71.3	-1.5	0	0	0	111.5	N289 D311 Q312 Y313	N289-N309 WeakPolarHBondContact OD1-CB 3.38Å; N289-N309 VanDerWaalsContact OD1-CG 3.24Å; N289-N309 PolarHBondContact OD1-ND2 3.39Å; N309-D311 PolarHBondContact OD1-N 3.27Å; N309-Q312 PolarHBondContact O-N 2.93Å; N309-Q312 WeakPolarHBondContact OD1-CB 3.41Å; N309-Q312 VanDerWaalsContact OD1-CG 3.25Å; N309-Q312 WeakPolarHBondContact OD1-CG 3.47Å; N309-Q312 PolarHBondContact OD1-N 3.35Å; N309-Y313 PolarHBondContact O-N 3.09Å
310	Y	93	Very high	93.1	Very high	16 Å²	16	66.7 Å²	66.7	6%	0.063	33%	0.331	C	S	.	.	H	α-helix	trans	-64.1	-42.8	-177.5	-177.8	-89.7	0	0	0	112.6	I117 Q285 L288 N289 Q312 Y313 V314 I549	I117-Y310 HydrophobicContact CD1-CD2 4.44Å; I117-Y310 HydrophobicContact CD1-CE2 4.08Å; Q285-Y310 HydrophobicContact CB-CD1 3.95Å; Q285-Y310 HydrophobicContact CB-CE1 4.14Å; Q285-Y310 HydrophobicContact CG-CD1 3.78Å; Q285-Y310 HydrophobicContact CG-CE1 3.46Å; Q285-Y310 VanDerWaalsContact CG-CE1 3.46Å; Q285-Y310 HydrophobicContact CG-CE2 4.48Å; Q285-Y310 HydrophobicContact CG-CG 4.44Å; Q285-Y310 PolarHBondContact NE2-OH 3.21Å; Q285-Y310 VanDerWaalsContact NE2-OH 3.12Å; L288-Y310 HydrophobicContact CD1-CD2 3.82Å; L288-Y310 HydrophobicContact CD1-CE2 4.41Å; L288-Y310 HydrophobicContact CD1-CG 4.39Å; N289-Y310 WeakPolarHBondContact OD1-CA 3.35Å; N289-Y310 VanDerWaalsContact OD1-CB 3.31Å; N289-Y310 WeakPolarHBondContact OD1-CB 3.5Å; N289-Y310 PolarHBondContact OD1-N 3.41Å; Y310-Q312 VanDerWaalsContact C-N 3.33Å; Y310-Q312 PolarHBondContact O-N 2.95Å; Y310-Y313 AromaticContact CD2-CD1 3.98Å; Y310-Y313 HydrophobicContact CD2-CD1 3.98Å; Y310-Y313 HydrophobicContact CD2-CE1 4.47Å; Y310-Y313 AromaticContact CE2-CD1 3.89Å; Y310-Y313 HydrophobicContact CE2-CD1 3.89Å; Y310-Y313 AromaticContact CE2-CE1 3.94Å; Y310-Y313 HydrophobicContact CE2-CE1 3.94Å; Y310-Y313 WeakPolarHBondContact O-CA 3.45Å; Y310-Y313 VanDerWaalsContact O-CB 3.28Å; Y310-Y313 WeakPolarHBondContact O-CB 3.43Å; Y310-Y313 PolarHBondContact O-N 3.38Å; Y310-Y313 VanDerWaalsContact O-N 3.1Å; Y310-V314 HydrophobicContact CD1-CG2 3.89Å; Y310-V314 HydrophobicContact CE1-CG2 3.28Å; Y310-V314 HydrophobicContact CE2-CG2 4.41Å; Y310-V314 PolarHBondContact O-N 3.42Å; Y310-I549 HydrophobicContact CE2-CD1 3.82Å
311	D	92.9	Very high	93.1	Very high	90 Å²	90	63.9 Å²	63.9	48%	0.481	31%	0.314	S	S	.	.	H	α-helix	trans	-62.3	-41.7	179.2	-68	-10.9	0	0	0	112.1	N289 N309 Y313 V314 K315	N289-D311 PolarHBondContact ND2-OD1 3.35Å; N289-D311 PolarHBondContact ND2-OD2 3.34Å; N289-D311 PolarHBondContact OD1-N 2.91Å; N309-D311 PolarHBondContact OD1-N 3.27Å; D311-Y313 VanDerWaalsContact C-N 3.32Å; D311-V314 PolarHBondContact O-N 2.94Å; D311-K315 PolarHBondContact O-N 2.93Å
312	Q	94.3	Very high	93.1	Very high	104 Å²	104	64.5 Å²	64.5	49%	0.486	32%	0.318	S	S	.	.	H	α-helix	trans	-62.5	-42	174.4	-72.9	170.8	-22.8	0	0	111	N309 Y310 K315 T316	N309-Q312 PolarHBondContact O-N 2.93Å; N309-Q312 WeakPolarHBondContact OD1-CB 3.41Å; N309-Q312 VanDerWaalsContact OD1-CG 3.25Å; N309-Q312 WeakPolarHBondContact OD1-CG 3.47Å; N309-Q312 PolarHBondContact OD1-N 3.35Å; Y310-Q312 VanDerWaalsContact C-N 3.33Å; Y310-Q312 PolarHBondContact O-N 2.95Å; Q312-K315 PolarHBondContact O-N 3.25Å; Q312-T316 WeakPolarHBondContact O-CB 3.41Å; Q312-T316 PolarHBondContact O-N 3.18Å; Q312-T316 PolarHBondContact O-OG1 3.49Å; Q312-T316 VanDerWaalsContact O-OG1 3.05Å
313	Y	94.2	Very high	92.9	Very high	5 Å²	5	65.3 Å²	65.3	2%	0.02	33%	0.326	C	S	.	.	H	α-helix	trans	-57.2	-50.4	172.6	151.9	-99.2	0	0	0	112	I117 I295 H297 Y306 N309 Y310 D311 K315 T316 R317	I117-Y313 HydrophobicContact CD1-CD1 3.71Å; I117-Y313 HydrophobicContact CD1-CD2 4.36Å; I117-Y313 HydrophobicContact CD1-CE1 3.2Å; I117-Y313 HydrophobicContact CD1-CE2 3.9Å; I117-Y313 HydrophobicContact CD1-CG 4.26Å; I117-Y313 WeakPolarHBondContact CD1-OH 3.43Å; I295-Y313 HydrophobicContact CB-CD2 4.45Å; I295-Y313 HydrophobicContact CB-CG 4.21Å; I295-Y313 HydrophobicContact CG1-CG 4.38Å; I295-Y313 HydrophobicContact CG2-CD1 4.26Å; I295-Y313 HydrophobicContact CG2-CD2 3.93Å; I295-Y313 HydrophobicContact CG2-CE2 4.42Å; I295-Y313 HydrophobicContact CG2-CG 3.82Å; H297-Y313 HydrophobicContact CB-CE2 3.98Å; H297-Y313 PolarHBondContact CE1-OH 2.83Å; H297-Y313 AromaticContact ND1-CE2 3.98Å; H297-Y313 PolarHBondContact ND1-OH 2.76Å; Y306-Y313 AromaticContact CD1-CD2 3.98Å; Y306-Y313 HydrophobicContact CD1-CD2 3.98Å; Y306-Y313 AromaticContact CD2-CD2 3.61Å; Y306-Y313 HydrophobicContact CD2-CD2 3.61Å; Y306-Y313 AromaticContact CD2-CE2 3.98Å; Y306-Y313 HydrophobicContact CD2-CE2 3.98Å; Y306-Y313 HydrophobicContact CE1-CD2 4.24Å; Y306-Y313 AromaticContact CE2-CD2 3.93Å; Y306-Y313 HydrophobicContact CE2-CD2 3.93Å; Y306-Y313 AromaticContact CE2-CE2 3.84Å; Y306-Y313 HydrophobicContact CE2-CE2 3.84Å; Y306-Y313 AromaticContact CG-CD2 3.65Å; Y306-Y313 HydrophobicContact CG-CD2 3.65Å; Y306-Y313 HydrophobicContact CG-CE2 4.4Å; N309-Y313 PolarHBondContact O-N 3.09Å; Y310-Y313 AromaticContact CD2-CD1 3.98Å; Y310-Y313 HydrophobicContact CD2-CD1 3.98Å; Y310-Y313 HydrophobicContact CD2-CE1 4.47Å; Y310-Y313 AromaticContact CE2-CD1 3.89Å; Y310-Y313 HydrophobicContact CE2-CD1 3.89Å; Y310-Y313 AromaticContact CE2-CE1 3.94Å; Y310-Y313 HydrophobicContact CE2-CE1 3.94Å; Y310-Y313 WeakPolarHBondContact O-CA 3.45Å; Y310-Y313 VanDerWaalsContact O-CB 3.28Å; Y310-Y313 WeakPolarHBondContact O-CB 3.43Å; Y310-Y313 PolarHBondContact O-N 3.38Å; Y310-Y313 VanDerWaalsContact O-N 3.1Å; D311-Y313 VanDerWaalsContact C-N 3.32Å; Y313-K315 VanDerWaalsContact C-N 3.31Å; Y313-K315 PolarHBondContact O-N 3.26Å; Y313-T316 PolarHBondContact O-N 2.87Å; Y313-R317 HydrophobicContact CD2-CB 4.49Å; Y313-R317 HydrophobicContact CE2-CB 4.16Å; Y313-R317 VanDerWaalsContact O-CB 3.25Å; Y313-R317 WeakPolarHBondContact O-CB 3.07Å; Y313-R317 PolarHBondContact O-N 3.44Å; Y313-R317 VanDerWaalsContact OH-CD 3.23Å; Y313-R317 WeakPolarHBondContact OH-CD 3.13Å; Y313-R317 PolarHBondContact OH-NH1 2.96Å
314	V	91.1	Very high	92.5	Very high	49 Å²	49	67.7 Å²	67.7	30%	0.297	34%	0.337	S	S	.	.	H	α-helix	trans	-58.8	-46.9	-178.6	172.6	0	0	0	0	110.2	Y310 D311 R317 L318	Y310-V314 HydrophobicContact CD1-CG2 3.89Å; Y310-V314 HydrophobicContact CE1-CG2 3.28Å; Y310-V314 HydrophobicContact CE2-CG2 4.41Å; Y310-V314 PolarHBondContact O-N 3.42Å; D311-V314 PolarHBondContact O-N 2.94Å; V314-R317 PolarHBondContact O-N 3.35Å; V314-L318 HydrophobicContact CG1-CD1 4.09Å; V314-L318 WeakPolarHBondContact O-CG 3.39Å; V314-L318 PolarHBondContact O-N 3.43Å
315	K	93.4	Very high	92.3	Very high	134 Å²	134	65.5 Å²	65.5	58%	0.583	33%	0.329	S	S	*	.	H	α-helix	trans	-60.2	-51.4	177.5	-175.7	179.2	176.2	-178.1	0	112	D311 Q312 Y313 R317 L318 E319	D311-K315 PolarHBondContact O-N 2.93Å; Q312-K315 PolarHBondContact O-N 3.25Å; Y313-K315 VanDerWaalsContact C-N 3.31Å; Y313-K315 PolarHBondContact O-N 3.26Å; K315-R317 VanDerWaalsContact C-N 3.28Å; K315-R317 PolarHBondContact O-N 3.46Å; K315-L318 PolarHBondContact O-N 2.85Å; K315-E319 WeakPolarHBondContact CE-OE1 3.4Å; K315-E319 WeakPolarHBondContact O-CG 3.3Å; K315-E319 PolarHBondContact O-N 3.07Å; K315-E319 VanDerWaalsContact O-N 3.09Å
316	T	93.6	Very high	92.1	Very high	53 Å²	53	68 Å²	68	33%	0.325	34%	0.341	S	S	.	.	H	α-helix	trans	-61.9	-37.1	178.8	-62.4	0	0	0	0	111.7	Y306 Q312 Y313 L320	Y306-T316 HydrophobicContact CD1-CG2 3.91Å; Y306-T316 HydrophobicContact CE1-CG2 4.16Å; Q312-T316 WeakPolarHBondContact O-CB 3.41Å; Q312-T316 PolarHBondContact O-N 3.18Å; Q312-T316 PolarHBondContact O-OG1 3.49Å; Q312-T316 VanDerWaalsContact O-OG1 3.05Å; Y313-T316 PolarHBondContact O-N 2.87Å; T316-L320 HydrophobicContact CG2-CD1 3.99Å; T316-L320 HydrophobicContact CG2-CG 4.4Å; T316-L320 WeakPolarHBondContact O-CB 3.39Å; T316-L320 VanDerWaalsContact O-CG 3.24Å; T316-L320 WeakPolarHBondContact O-CG 3.41Å; T316-L320 PolarHBondContact O-N 2.61Å
317	R	90.8	Very high	91.7	Very high	32 Å²	32	74.1 Å²	74.1	12%	0.121	36%	0.364	C	S	.	.	H	α-helix	trans	-63.9	-49	176.8	178	175.5	174.4	-176.5	-4.2	111.2	H297 Y313 V314 K315 E319 L320 E321 D378	H297-R317 PolarHBondContact CE1-NH1 3.24Å; H297-R317 VanDerWaalsContact CE1-NH1 3.33Å; Y313-R317 HydrophobicContact CD2-CB 4.49Å; Y313-R317 HydrophobicContact CE2-CB 4.16Å; Y313-R317 VanDerWaalsContact O-CB 3.25Å; Y313-R317 WeakPolarHBondContact O-CB 3.07Å; Y313-R317 PolarHBondContact O-N 3.44Å; Y313-R317 VanDerWaalsContact OH-CD 3.23Å; Y313-R317 WeakPolarHBondContact OH-CD 3.13Å; Y313-R317 PolarHBondContact OH-NH1 2.96Å; V314-R317 PolarHBondContact O-N 3.35Å; K315-R317 VanDerWaalsContact C-N 3.28Å; K315-R317 PolarHBondContact O-N 3.46Å; R317-E319 VanDerWaalsContact C-N 3.32Å; R317-E319 PolarHBondContact O-N 2.94Å; R317-L320 PolarHBondContact O-N 3.04Å; R317-E321 HydrophobicContact CG-CG 4.34Å; R317-E321 WeakPolarHBondContact CG-OE1 3.34Å; R317-E321 IonicContact CZ-OE1 3.92Å; R317-E321 IonicContact NE-OE1 3.82Å; R317-E321 PolarHBondContact NE-OE1 3.35Å; R317-E321 IonicContact NH2-OE1 3.97Å; R317-E321 PolarHBondContact NH2-OE1 2.81Å; R317-E321 WeakPolarHBondContact O-CB 3.44Å; R317-E321 WeakPolarHBondContact O-CG 3.45Å; R317-E321 PolarHBondContact O-N 3.43Å; R317-D378 IonicContact CZ-OD2 3.61Å; R317-D378 IonicContact NH1-OD2 3.67Å; R317-D378 IonicContact NH2-OD2 2.84Å; R317-D378 PolarHBondContact NH2-OD2 3.01Å
318	L	88.8	Confident	91.4	Very high	107 Å²	107	70.3 Å²	70.3	56%	0.56	34%	0.338	S	S	*	.	H	α-helix	trans	-59	-43.7	178.4	-71.5	172	0	0	0	111.7	V314 K315 L320 E321 E322	V314-L318 HydrophobicContact CG1-CD1 4.09Å; V314-L318 WeakPolarHBondContact O-CG 3.39Å; V314-L318 PolarHBondContact O-N 3.43Å; K315-L318 PolarHBondContact O-N 2.85Å; L318-L320 PolarHBondContact O-N 3.39Å; L318-E321 PolarHBondContact O-N 2.88Å; L318-E322 WeakPolarHBondContact O-CB 3.39Å; L318-E322 PolarHBondContact O-N 2.88Å
319	E	92.9	Very high	91.3	Very high	91 Å²	91	74.7 Å²	74.7	43%	0.425	36%	0.356	S	S	.	.	H	α-helix	trans	-62.7	-42	176.5	-70.4	171.9	-174	0	0	112.2	K315 R317 N323	K315-E319 WeakPolarHBondContact CE-OE1 3.4Å; K315-E319 WeakPolarHBondContact O-CG 3.3Å; K315-E319 PolarHBondContact O-N 3.07Å; K315-E319 VanDerWaalsContact O-N 3.09Å; R317-E319 VanDerWaalsContact C-N 3.32Å; R317-E319 PolarHBondContact O-N 2.94Å; E319-N323 WeakPolarHBondContact O-CB 3.31Å; E319-N323 VanDerWaalsContact O-CG 3.23Å; E319-N323 PolarHBondContact O-N 3.32Å; E319-N323 VanDerWaalsContact O-N 3.07Å; E319-N323 PolarHBondContact O-ND2 2.92Å
320	L	90.1	Very high	91.1	Very high	89 Å²	89	80.1 Å²	80.1	47%	0.466	37%	0.373	S	S	.	.	H	α-helix	trans	-66.6	-41.5	176.6	-73.9	170.9	0	0	0	112.2	Y306 T316 R317 L318 N323 Q324	Y306-L320 HydrophobicContact CE1-CD1 3.84Å; T316-L320 HydrophobicContact CG2-CD1 3.99Å; T316-L320 HydrophobicContact CG2-CG 4.4Å; T316-L320 WeakPolarHBondContact O-CB 3.39Å; T316-L320 VanDerWaalsContact O-CG 3.24Å; T316-L320 WeakPolarHBondContact O-CG 3.41Å; T316-L320 PolarHBondContact O-N 2.61Å; R317-L320 PolarHBondContact O-N 3.04Å; L318-L320 PolarHBondContact O-N 3.39Å; L320-N323 PolarHBondContact O-N 2.73Å; L320-Q324 VanDerWaalsContact O-CB 3.31Å; L320-Q324 WeakPolarHBondContact O-CB 3.4Å; L320-Q324 PolarHBondContact O-N 2.86Å
321	E	88.7	Confident	91	Very high	46 Å²	46	79.9 Å²	79.9	22%	0.215	37%	0.373	C	S	.	.	H	α-helix	trans	-66.3	-41.6	177.8	-75.3	179.4	-179.3	0	0	111.5	R317 L318 N323 Q324 M325 V375	R317-E321 HydrophobicContact CG-CG 4.34Å; R317-E321 WeakPolarHBondContact CG-OE1 3.34Å; R317-E321 IonicContact CZ-OE1 3.92Å; R317-E321 IonicContact NE-OE1 3.82Å; R317-E321 PolarHBondContact NE-OE1 3.35Å; R317-E321 IonicContact NH2-OE1 3.97Å; R317-E321 PolarHBondContact NH2-OE1 2.81Å; R317-E321 WeakPolarHBondContact O-CB 3.44Å; R317-E321 WeakPolarHBondContact O-CG 3.45Å; R317-E321 PolarHBondContact O-N 3.43Å; L318-E321 PolarHBondContact O-N 2.88Å; E321-N323 PolarHBondContact O-N 3.23Å; E321-Q324 PolarHBondContact O-N 3.01Å; E321-M325 WeakPolarHBondContact O-CB 3.42Å; E321-M325 WeakPolarHBondContact O-CG 3.4Å; E321-M325 PolarHBondContact O-N 3.46Å; E321-V375 HydrophobicContact CB-CG1 4.11Å; E321-V375 HydrophobicContact CB-CG2 4.29Å; E321-V375 HydrophobicContact CG-CG1 3.85Å; E321-V375 HydrophobicContact CG-CG2 4.43Å
322	E	89.9	Confident	90.8	Very high	104 Å²	104	78.9 Å²	78.9	49%	0.486	37%	0.365	S	S	.	.	H	α-helix	trans	-61.7	-45.2	175.1	-168	-169.2	167.1	0	0	111.3	L318 M325 K326	L318-E322 WeakPolarHBondContact O-CB 3.39Å; L318-E322 PolarHBondContact O-N 2.88Å; E322-M325 PolarHBondContact O-N 2.84Å; E322-K326 WeakPolarHBondContact O-CG 3.45Å; E322-K326 PolarHBondContact O-N 3.43Å; E322-K326 WeakPolarHBondContact OE1-CE 3.23Å; E322-K326 IonicContact OE1-NZ 3.4Å; E322-K326 PolarHBondContact OE1-NZ 3.36Å
323	N	91.2	Very high	90.6	Very high	93 Å²	93	79.1 Å²	79.1	50%	0.497	37%	0.37	S	S	.	.	H	α-helix	trans	-64.5	-39.9	176.8	-73.8	-34.6	0	0	0	112.1	E319 L320 E321 K326 R327	E319-N323 WeakPolarHBondContact O-CB 3.31Å; E319-N323 VanDerWaalsContact O-CG 3.23Å; E319-N323 PolarHBondContact O-N 3.32Å; E319-N323 VanDerWaalsContact O-N 3.07Å; E319-N323 PolarHBondContact O-ND2 2.92Å; L320-N323 PolarHBondContact O-N 2.73Å; E321-N323 PolarHBondContact O-N 3.23Å; N323-K326 PolarHBondContact O-N 2.81Å; N323-R327 WeakPolarHBondContact O-CB 3.39Å; N323-R327 PolarHBondContact O-N 3.08Å
324	Q	88.7	Confident	90.4	Very high	63 Å²	63	82.2 Å²	82.2	29%	0.294	39%	0.385	S	S	.	.	H	α-helix	trans	-62.6	-43.3	174.3	-175.6	177.8	-16.3	0	0	111.1	L320 E321 R327 F328 T372 E373 V375	L320-Q324 VanDerWaalsContact O-CB 3.31Å; L320-Q324 WeakPolarHBondContact O-CB 3.4Å; L320-Q324 PolarHBondContact O-N 2.86Å; E321-Q324 PolarHBondContact O-N 3.01Å; Q324-R327 PolarHBondContact O-N 2.84Å; Q324-F328 VanDerWaalsContact O-CB 3.32Å; Q324-F328 WeakPolarHBondContact O-CB 3.4Å; Q324-F328 PolarHBondContact O-N 2.95Å; Q324-T372 HydrophobicContact CG-CG2 3.58Å; Q324-E373 PolarHBondContact NE2-O 3.31Å; Q324-V375 HydrophobicContact CB-CG2 3.77Å; Q324-V375 VanDerWaalsContact CD-CG2 3.47Å; Q324-V375 HydrophobicContact CG-CG2 3.69Å
325	M	88.8	Confident	90.3	Very high	47 Å²	47	80.3 Å²	80.3	23%	0.232	37%	0.372	C	S	.	.	H	α-helix	trans	-65.5	-42.2	177	-78.3	-60.7	-67.8	0	0	112.6	E321 E322 R327 F328 H329 R374 V375	E321-M325 WeakPolarHBondContact O-CB 3.42Å; E321-M325 WeakPolarHBondContact O-CG 3.4Å; E321-M325 PolarHBondContact O-N 3.46Å; E322-M325 PolarHBondContact O-N 2.84Å; M325-R327 VanDerWaalsContact C-N 3.35Å; M325-R327 PolarHBondContact O-N 3.37Å; M325-F328 PolarHBondContact O-N 2.88Å; M325-H329 WeakPolarHBondContact CE-NE2 3.45Å; M325-H329 PolarHBondContact O-CD2 3.49Å; M325-H329 PolarHBondContact O-N 3.44Å; M325-R374 HydrophobicContact SD-CG 4.11Å; M325-V375 HydrophobicContact CG-CB 3.81Å; M325-V375 HydrophobicContact CG-CG2 3.69Å; M325-V375 HydrophobicContact SD-CB 3.72Å; M325-V375 HydrophobicContact SD-CG2 3.97Å
326	K	91.8	Very high	90.2	Very high	116 Å²	116	76 Å²	76	50%	0.504	36%	0.362	S	S	.	.	H	α-helix	trans	-59.9	-45.5	173.8	-74.3	172.6	-176.1	164.1	0	111.4	E322 N323 H329 W330	E322-K326 WeakPolarHBondContact O-CG 3.45Å; E322-K326 PolarHBondContact O-N 3.43Å; E322-K326 WeakPolarHBondContact OE1-CE 3.23Å; E322-K326 IonicContact OE1-NZ 3.4Å; E322-K326 PolarHBondContact OE1-NZ 3.36Å; N323-K326 PolarHBondContact O-N 2.81Å; K326-H329 PolarHBondContact O-N 3.16Å; K326-W330 WeakPolarHBondContact O-CB 3.43Å; K326-W330 PolarHBondContact O-N 2.94Å
327	R	88.8	Confident	90	Very high	154 Å²	154	78.5 Å²	78.5	58%	0.581	37%	0.369	S	S	*	.	H	α-helix	trans	-64.4	-43.2	177.1	-174.6	176.4	176.6	167.4	-0.8	111.8	N323 Q324 M325 W330 E331 T372	N323-R327 WeakPolarHBondContact O-CB 3.39Å; N323-R327 PolarHBondContact O-N 3.08Å; Q324-R327 PolarHBondContact O-N 2.84Å; M325-R327 VanDerWaalsContact C-N 3.35Å; M325-R327 PolarHBondContact O-N 3.37Å; R327-W330 PolarHBondContact O-N 3.45Å; R327-E331 HydrophobicContact CG-CG 4.47Å; R327-E331 IonicContact CZ-OE1 3.39Å; R327-E331 IonicContact NE-OE1 2.64Å; R327-E331 PolarHBondContact NE-OE1 2.91Å; R327-E331 IonicContact NH2-OE1 3.53Å; R327-E331 WeakPolarHBondContact O-CB 3.42Å; R327-E331 WeakPolarHBondContact O-CG 3.26Å; R327-E331 PolarHBondContact O-N 2.98Å; R327-T372 WeakPolarHBondContact CD-OG1 3.48Å; R327-T372 PolarHBondContact NE-OG1 2.79Å
328	F	89.4	Confident	89.9	Confident	34 Å²	34	77.6 Å²	77.6	15%	0.149	37%	0.367	C	S	.	.	H	α-helix	trans	-57.4	-51.3	174.5	173.8	-104.4	0	0	0	111.4	Q324 M325 W330 E331 Q332 T372 R374	Q324-F328 VanDerWaalsContact O-CB 3.32Å; Q324-F328 WeakPolarHBondContact O-CB 3.4Å; Q324-F328 PolarHBondContact O-N 2.95Å; M325-F328 PolarHBondContact O-N 2.88Å; F328-W330 VanDerWaalsContact C-N 3.35Å; F328-W330 PolarHBondContact O-N 3.29Å; F328-E331 PolarHBondContact O-N 3.37Å; F328-Q332 HydrophobicContact CD1-CG 4.26Å; F328-Q332 HydrophobicContact CD2-CG 4.14Å; F328-Q332 HydrophobicContact CE1-CG 3.83Å; F328-Q332 HydrophobicContact CE2-CG 3.73Å; F328-Q332 HydrophobicContact CG-CG 4.41Å; F328-Q332 HydrophobicContact CZ-CG 3.56Å; F328-Q332 VanDerWaalsContact O-CG 3.32Å; F328-Q332 WeakPolarHBondContact O-CG 3.28Å; F328-Q332 PolarHBondContact O-N 3.38Å; F328-T372 HydrophobicContact CB-CG2 4.3Å; F328-T372 WeakPolarHBondContact CD2-O 3.38Å; F328-R374 HydrophobicContact CD1-CB 4.35Å; F328-R374 HydrophobicContact CD1-CG 4.35Å; F328-R374 HydrophobicContact CD2-CB 4.33Å; F328-R374 HydrophobicContact CE1-CB 4.03Å; F328-R374 HydrophobicContact CE1-CG 4.05Å; F328-R374 HydrophobicContact CE2-CB 3.99Å; F328-R374 HydrophobicContact CG-CB 4.49Å; F328-R374 HydrophobicContact CZ-CB 3.83Å; F328-R374 HydrophobicContact CZ-CG 4.31Å
329	H	91.4	Very high	90	Very high	100 Å²	100	78.1 Å²	78.1	46%	0.463	37%	0.365	S	S	.	.	H	α-helix	trans	-60.1	-44.2	177.8	-77.4	-57.6	0	0	0	112.3	M325 K326 E331 Q332 D333	M325-H329 WeakPolarHBondContact CE-NE2 3.45Å; M325-H329 PolarHBondContact O-CD2 3.49Å; M325-H329 PolarHBondContact O-N 3.44Å; K326-H329 PolarHBondContact O-N 3.16Å; H329-E331 PolarHBondContact O-N 2.76Å; H329-Q332 PolarHBondContact O-N 3.22Å; H329-D333 WeakPolarHBondContact O-CB 3.3Å; H329-D333 PolarHBondContact O-N 3.21Å
330	W	90.3	Very high	89.8	Confident	155 Å²	155	78.7 Å²	78.7	59%	0.587	37%	0.37	S	S	*	.	H	α-helix	trans	-59.7	-45.4	175.8	-178.3	83.7	0	0	0	112	K326 R327 F328 D333 Q334	K326-W330 WeakPolarHBondContact O-CB 3.43Å; K326-W330 PolarHBondContact O-N 2.94Å; R327-W330 PolarHBondContact O-N 3.45Å; F328-W330 VanDerWaalsContact C-N 3.35Å; F328-W330 PolarHBondContact O-N 3.29Å; W330-D333 PolarHBondContact O-N 3.48Å; W330-Q334 HydrophobicContact CD2-CG 4.23Å; W330-Q334 HydrophobicContact CH2-CG 4.37Å; W330-Q334 HydrophobicContact CZ2-CG 4.09Å; W330-Q334 VanDerWaalsContact O-CG 3.27Å; W330-Q334 WeakPolarHBondContact O-CG 3.26Å; W330-Q334 PolarHBondContact O-N 3.24Å
331	E	89.2	Confident	89.7	Confident	12 Å²	12	76 Å²	76	6%	0.056	35%	0.354	C	S	.	.	H	α-helix	trans	-64.2	-41.5	176.2	-72.4	174.8	-172.9	0	0	111.6	R327 F328 H329 Q334 I335 M366 T372	R327-E331 HydrophobicContact CG-CG 4.47Å; R327-E331 IonicContact CZ-OE1 3.39Å; R327-E331 IonicContact NE-OE1 2.64Å; R327-E331 PolarHBondContact NE-OE1 2.91Å; R327-E331 IonicContact NH2-OE1 3.53Å; R327-E331 WeakPolarHBondContact O-CB 3.42Å; R327-E331 WeakPolarHBondContact O-CG 3.26Å; R327-E331 PolarHBondContact O-N 2.98Å; F328-E331 PolarHBondContact O-N 3.37Å; H329-E331 PolarHBondContact O-N 2.76Å; E331-Q334 PolarHBondContact O-N 3.4Å; E331-I335 WeakPolarHBondContact O-CD1 3.5Å; E331-I335 WeakPolarHBondContact O-CG1 3.24Å; E331-I335 PolarHBondContact O-N 3.03Å; E331-M366 HydrophobicContact CB-CE 4.38Å; E331-T372 PolarHBondContact OE1-OG1 2.62Å; E331-T372 WeakPolarHBondContact OE2-CB 3.46Å; E331-T372 PolarHBondContact OE2-N 3.41Å; E331-T372 PolarHBondContact OE2-OG1 2.94Å
332	Q	89.4	Confident	89.5	Confident	68 Å²	68	75.5 Å²	75.5	32%	0.318	35%	0.353	S	S	.	.	H	α-helix	trans	-64.6	-41.6	176.5	-69.2	-52.5	-49.1	0	0	112.6	F328 H329 I335 A336	F328-Q332 HydrophobicContact CD1-CG 4.26Å; F328-Q332 HydrophobicContact CD2-CG 4.14Å; F328-Q332 HydrophobicContact CE1-CG 3.83Å; F328-Q332 HydrophobicContact CE2-CG 3.73Å; F328-Q332 HydrophobicContact CG-CG 4.41Å; F328-Q332 HydrophobicContact CZ-CG 3.56Å; F328-Q332 VanDerWaalsContact O-CG 3.32Å; F328-Q332 WeakPolarHBondContact O-CG 3.28Å; F328-Q332 PolarHBondContact O-N 3.38Å; H329-Q332 PolarHBondContact O-N 3.22Å; Q332-I335 PolarHBondContact O-N 3.45Å; Q332-A336 WeakPolarHBondContact O-CB 3.44Å; Q332-A336 PolarHBondContact O-N 3.45Å
333	D	91.3	Very high	89.4	Confident	110 Å²	110	74.2 Å²	74.2	59%	0.588	36%	0.36	S	S	*	.	H	α-helix	trans	-66.1	-40.2	176.8	-75.4	-12.6	0	0	0	111.4	H329 W330 A336 H337	H329-D333 WeakPolarHBondContact O-CB 3.3Å; H329-D333 PolarHBondContact O-N 3.21Å; W330-D333 PolarHBondContact O-N 3.48Å; D333-A336 PolarHBondContact O-N 2.93Å; D333-H337 VanDerWaalsContact O-CB 3.28Å; D333-H337 WeakPolarHBondContact O-CB 3.36Å; D333-H337 PolarHBondContact O-N 3.34Å
334	Q	89.5	Confident	89.1	Confident	70 Å²	70	79.5 Å²	79.5	33%	0.327	37%	0.373	S	S	.	.	H	α-helix	trans	-61.2	-46.2	172.8	-72	-62.2	-31.7	0	0	111.2	W330 E331 A336 H337 M338	W330-Q334 HydrophobicContact CD2-CG 4.23Å; W330-Q334 HydrophobicContact CH2-CG 4.37Å; W330-Q334 HydrophobicContact CZ2-CG 4.09Å; W330-Q334 VanDerWaalsContact O-CG 3.27Å; W330-Q334 WeakPolarHBondContact O-CG 3.26Å; W330-Q334 PolarHBondContact O-N 3.24Å; E331-Q334 PolarHBondContact O-N 3.4Å; Q334-A336 PolarHBondContact O-N 3.33Å; Q334-H337 PolarHBondContact O-N 2.88Å; Q334-M338 WeakPolarHBondContact O-CB 3.37Å; Q334-M338 WeakPolarHBondContact O-CG 3.1Å; Q334-M338 PolarHBondContact O-N 3.37Å
335	I	89.5	Confident	88.9	Confident	8 Å²	8	79.9 Å²	79.9	4%	0.041	37%	0.374	C	S	.	.	H	α-helix	trans	-58.8	-48.5	175.7	-69	164.4	0	0	0	110.4	E331 Q332 M338 K339 L363 M366 L371	E331-I335 WeakPolarHBondContact O-CD1 3.5Å; E331-I335 WeakPolarHBondContact O-CG1 3.24Å; E331-I335 PolarHBondContact O-N 3.03Å; Q332-I335 PolarHBondContact O-N 3.45Å; I335-M338 PolarHBondContact O-N 2.96Å; I335-K339 HydrophobicContact CG2-CD 3.83Å; I335-K339 HydrophobicContact CG2-CG 4.28Å; I335-K339 WeakPolarHBondContact O-CB 3.16Å; I335-K339 VanDerWaalsContact O-CG 3.3Å; I335-K339 WeakPolarHBondContact O-CG 3.4Å; I335-K339 PolarHBondContact O-N 2.97Å; I335-L363 HydrophobicContact CB-CD1 4.2Å; I335-L363 HydrophobicContact CG1-CD1 3.78Å; I335-L363 HydrophobicContact CG2-CD1 4.1Å; I335-M366 HydrophobicContact CD1-CE 3.74Å; I335-M366 HydrophobicContact CG1-CE 3.27Å; I335-L371 HydrophobicContact CD1-CD1 3.62Å; I335-L371 HydrophobicContact CD1-CD2 3.81Å; I335-L371 HydrophobicContact CD1-CG 4.39Å
336	A	90.5	Very high	88.3	Confident	43 Å²	43	78.9 Å²	78.9	36%	0.355	38%	0.376	S	S	.	.	H	α-helix	trans	-62	-46.2	-179	0	0	0	0	0	111.2	Q332 D333 Q334 K339 N340	Q332-A336 WeakPolarHBondContact O-CB 3.44Å; Q332-A336 PolarHBondContact O-N 3.45Å; D333-A336 PolarHBondContact O-N 2.93Å; Q334-A336 PolarHBondContact O-N 3.33Å; A336-K339 PolarHBondContact O-N 3.17Å; A336-N340 VanDerWaalsContact O-CB 3.29Å; A336-N340 WeakPolarHBondContact O-CB 3.26Å; A336-N340 PolarHBondContact O-N 3.47Å; A336-N340 PolarHBondContact O-ND2 2.93Å
337	H	89.9	Confident	87.7	Confident	106 Å²	106	82.5 Å²	82.5	49%	0.491	39%	0.394	S	S	.	.	H	α-helix	trans	-63	-43.1	177.4	178.5	-107.9	0	0	0	112.3	D333 Q334 N340 Y341	D333-H337 VanDerWaalsContact O-CB 3.28Å; D333-H337 WeakPolarHBondContact O-CB 3.36Å; D333-H337 PolarHBondContact O-N 3.34Å; Q334-H337 PolarHBondContact O-N 2.88Å; H337-N340 PolarHBondContact O-N 2.92Å; H337-Y341 WeakPolarHBondContact O-CB 3.47Å; H337-Y341 PolarHBondContact O-N 3.15Å
338	M	88.2	Confident	87	Confident	14 Å²	14	77.2 Å²	77.2	7%	0.069	39%	0.387	C	S	.	.	H	α-helix	trans	-65.8	-44.9	176.9	-69.4	171.4	78.3	0	0	111.7	Q334 I335 Y341 I342 K359 T362 L363	Q334-M338 WeakPolarHBondContact O-CB 3.37Å; Q334-M338 WeakPolarHBondContact O-CG 3.1Å; Q334-M338 PolarHBondContact O-N 3.37Å; I335-M338 PolarHBondContact O-N 2.96Å; M338-Y341 PolarHBondContact O-N 3.41Å; M338-I342 WeakPolarHBondContact O-CD1 3.27Å; M338-I342 WeakPolarHBondContact O-CG1 3Å; M338-I342 PolarHBondContact O-N 3.18Å; M338-K359 HydrophobicContact CE-CB 4.08Å; M338-K359 WeakPolarHBondContact CE-O 3.32Å; M338-T362 HydrophobicContact CE-CG2 3.89Å; M338-L363 HydrophobicContact CE-CB 3.73Å; M338-L363 HydrophobicContact SD-CD1 4.48Å
339	K	89.9	Confident	86.4	Confident	118 Å²	118	78.8 Å²	78.8	51%	0.513	40%	0.403	S	S	.	.	H	α-helix	trans	-59.7	-46.5	174.7	-77.3	-180	177.1	177.7	0	111.7	I335 A336 Y341 I342 A343 L363	I335-K339 HydrophobicContact CG2-CD 3.83Å; I335-K339 HydrophobicContact CG2-CG 4.28Å; I335-K339 WeakPolarHBondContact O-CB 3.16Å; I335-K339 VanDerWaalsContact O-CG 3.3Å; I335-K339 WeakPolarHBondContact O-CG 3.4Å; I335-K339 PolarHBondContact O-N 2.97Å; A336-K339 PolarHBondContact O-N 3.17Å; K339-Y341 VanDerWaalsContact C-N 3.32Å; K339-Y341 PolarHBondContact O-N 3.08Å; K339-I342 PolarHBondContact O-N 2.91Å; K339-A343 WeakPolarHBondContact O-CB 3.44Å; K339-A343 PolarHBondContact O-N 3.47Å; K339-L363 HydrophobicContact CG-CD2 4.02Å
340	N	89.7	Confident	86	Confident	102 Å²	102	77.7 Å²	77.7	55%	0.545	41%	0.411	S	S	.	.	H	α-helix	trans	-61.9	-40.2	176.8	-75.3	-24.2	0	0	0	111.9	A336 H337 R344	A336-N340 VanDerWaalsContact O-CB 3.29Å; A336-N340 WeakPolarHBondContact O-CB 3.26Å; A336-N340 PolarHBondContact O-N 3.47Å; A336-N340 PolarHBondContact O-ND2 2.93Å; H337-N340 PolarHBondContact O-N 2.92Å; N340-R344 WeakPolarHBondContact O-CB 3.32Å; N340-R344 VanDerWaalsContact O-CG 3.28Å; N340-R344 WeakPolarHBondContact O-CG 3.36Å; N340-R344 PolarHBondContact O-N 3.42Å
341	Y	86.9	Confident	85.7	Confident	32 Å²	32	77.9 Å²	77.9	13%	0.125	42%	0.416	C	S	.	.	H	α-helix	trans	-65.6	-45.7	176.4	-172.6	-81.9	0	0	0	111.8	H337 M338 K339 A343 R344 F345 Q355 A356 K359	H337-Y341 WeakPolarHBondContact O-CB 3.47Å; H337-Y341 PolarHBondContact O-N 3.15Å; M338-Y341 PolarHBondContact O-N 3.41Å; K339-Y341 VanDerWaalsContact C-N 3.32Å; K339-Y341 PolarHBondContact O-N 3.08Å; Y341-A343 VanDerWaalsContact C-N 3.34Å; Y341-A343 PolarHBondContact O-N 2.98Å; Y341-R344 PolarHBondContact O-N 3.35Å; Y341-F345 HydrophobicContact CD1-CB 4.46Å; Y341-F345 HydrophobicContact CD1-CD2 4.19Å; Y341-F345 AromaticContact CD2-CD2 3.58Å; Y341-F345 HydrophobicContact CD2-CD2 3.58Å; Y341-F345 AromaticContact CD2-CE2 3.87Å; Y341-F345 HydrophobicContact CD2-CE2 3.87Å; Y341-F345 HydrophobicContact CE1-CB 4.13Å; Y341-F345 HydrophobicContact CE1-CD2 4.16Å; Y341-F345 AromaticContact CE2-CD2 3.55Å; Y341-F345 HydrophobicContact CE2-CD2 3.55Å; Y341-F345 AromaticContact CE2-CE2 3.85Å; Y341-F345 HydrophobicContact CE2-CE2 3.85Å; Y341-F345 HydrophobicContact CE2-CG 4.39Å; Y341-F345 AromaticContact CG-CD2 3.92Å; Y341-F345 HydrophobicContact CG-CD2 3.92Å; Y341-F345 AromaticContact CZ-CD2 3.84Å; Y341-F345 WeakPolarHBondContact O-CB 3.28Å; Y341-F345 WeakPolarHBondContact O-CD2 3.43Å; Y341-F345 PolarHBondContact O-N 2.88Å; Y341-Q355 HydrophobicContact CE1-CB 4.28Å; Y341-Q355 PolarHBondContact OH-OE1 3.48Å; Y341-A356 HydrophobicContact CD1-CB 4.39Å; Y341-A356 HydrophobicContact CE1-CB 4.22Å; Y341-K359 HydrophobicContact CD1-CD 3.6Å; Y341-K359 HydrophobicContact CE1-CD 4.08Å; Y341-K359 HydrophobicContact CG-CD 3.89Å; Y341-K359 VanDerWaalsContact CG-NZ 3.29Å
342	I	86.2	Confident	85.4	Confident	37 Å²	37	80 Å²	80	19%	0.19	43%	0.427	C	S	.	.	H	α-helix	trans	-61.2	-44.3	177.1	-66.6	161.3	0	0	0	110.1	M338 K339 R344 G346 E360 L363	M338-I342 WeakPolarHBondContact O-CD1 3.27Å; M338-I342 WeakPolarHBondContact O-CG1 3Å; M338-I342 PolarHBondContact O-N 3.18Å; K339-I342 PolarHBondContact O-N 2.91Å; I342-R344 PolarHBondContact O-N 3.1Å; I342-G346 VanDerWaalsContact O-CA 3.23Å; I342-G346 WeakPolarHBondContact O-CA 3.06Å; I342-G346 PolarHBondContact O-N 3.39Å; I342-E360 HydrophobicContact CD1-CB 3.85Å; I342-E360 HydrophobicContact CD1-CG 4.36Å; I342-E360 HydrophobicContact CG1-CB 4.47Å; I342-L363 HydrophobicContact CD1-CD2 4.38Å
343	A	87	Confident	85.1	Confident	77 Å²	77	77.8 Å²	77.8	64%	0.636	42%	0.42	S	S	*	.	H	α-helix	trans	-63.1	-41.3	177.6	0	0	0	0	0	112.8	K339 Y341	K339-A343 WeakPolarHBondContact O-CB 3.44Å; K339-A343 PolarHBondContact O-N 3.47Å; Y341-A343 VanDerWaalsContact C-N 3.34Å; Y341-A343 PolarHBondContact O-N 2.98Å
344	R	84.8	Confident	84.9	Confident	203 Å²	203	81.6 Å²	81.6	77%	0.766	43%	0.426	S	S	*	.	H	α-helix	trans	-76.6	-36.7	-178.4	-73.5	-179.3	120.9	-176	0.6	113.8	N340 Y341 I342	N340-R344 WeakPolarHBondContact O-CB 3.32Å; N340-R344 VanDerWaalsContact O-CG 3.28Å; N340-R344 WeakPolarHBondContact O-CG 3.36Å; N340-R344 PolarHBondContact O-N 3.42Å; Y341-R344 PolarHBondContact O-N 3.35Å; I342-R344 PolarHBondContact O-N 3.1Å
345	F	84.6	Confident	84.8	Confident	72 Å²	72	82.7 Å²	82.7	32%	0.316	43%	0.432	S	S	.	.	H	α-helix	trans	-117.6	-1.9	-168.3	-61.8	-68.8	0	0	0	114.3	Y341 H347 G348 L352	Y341-F345 HydrophobicContact CD1-CB 4.46Å; Y341-F345 HydrophobicContact CD1-CD2 4.19Å; Y341-F345 AromaticContact CD2-CD2 3.58Å; Y341-F345 HydrophobicContact CD2-CD2 3.58Å; Y341-F345 AromaticContact CD2-CE2 3.87Å; Y341-F345 HydrophobicContact CD2-CE2 3.87Å; Y341-F345 HydrophobicContact CE1-CB 4.13Å; Y341-F345 HydrophobicContact CE1-CD2 4.16Å; Y341-F345 AromaticContact CE2-CD2 3.55Å; Y341-F345 HydrophobicContact CE2-CD2 3.55Å; Y341-F345 AromaticContact CE2-CE2 3.85Å; Y341-F345 HydrophobicContact CE2-CE2 3.85Å; Y341-F345 HydrophobicContact CE2-CG 4.39Å; Y341-F345 AromaticContact CG-CD2 3.92Å; Y341-F345 HydrophobicContact CG-CD2 3.92Å; Y341-F345 AromaticContact CZ-CD2 3.84Å; Y341-F345 WeakPolarHBondContact O-CB 3.28Å; Y341-F345 WeakPolarHBondContact O-CD2 3.43Å; Y341-F345 PolarHBondContact O-N 2.88Å; F345-H347 VanDerWaalsContact C-N 3.28Å; F345-H347 PolarHBondContact O-N 2.86Å; F345-G348 PolarHBondContact O-N 3.38Å; F345-L352 HydrophobicContact CB-CB 4.33Å; F345-L352 HydrophobicContact CD1-CD1 3.98Å; F345-L352 HydrophobicContact CD1-CD2 4.24Å; F345-L352 HydrophobicContact CE1-CD1 4.43Å
346	G	76.1	Confident	84.6	Confident	26 Å²	26	82.4 Å²	82.4	27%	0.268	43%	0.43	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.7	-28.3	-178.5	0	0	0	0	0	114.5	I342	I342-G346 VanDerWaalsContact O-CA 3.23Å; I342-G346 WeakPolarHBondContact O-CA 3.06Å; I342-G346 PolarHBondContact O-N 3.39Å
347	H	79.8	Confident	84.4	Confident	191 Å²	191	86 Å²	86	88%	0.884	44%	0.439	S	S	*	.	T	Hydrogen-bonded Turn	trans	-110.8	15.6	-180	-56.6	-64.5	0	0	0	113.6	F345	F345-H347 VanDerWaalsContact C-N 3.28Å; F345-H347 PolarHBondContact O-N 2.86Å
348	G	74	Confident	84.2	Confident	43 Å²	43	84.4 Å²	84.4	44%	0.443	44%	0.44	S	S	.	.	S	Bend	trans	-92.9	-155.2	-176.1	0	0	0	0	0	115	F345	F345-G348 PolarHBondContact O-N 3.38Å
349	S	76.9	Confident	84.3	Confident	68 Å²	68	86.4 Å²	86.4	48%	0.476	45%	0.449	S	S	.	.			trans	-53.6	149.6	179.8	86.1	0	0	0	0	112.8	K351 L352 A353	S349-K351 PolarHBondContact O-N 3.37Å; S349-L352 WeakPolarHBondContact O-CA 3.34Å; S349-L352 PolarHBondContact O-N 3.02Å; S349-L352 WeakPolarHBondContact OG-CD1 3.5Å; S349-L352 WeakPolarHBondContact OG-CG 3.46Å; S349-A353 PolarHBondContact O-N 3.42Å
350	A	82.1	Confident	84.2	Confident	76 Å²	76	84.8 Å²	84.8	63%	0.628	44%	0.443	S	S	*	.	H	α-helix	trans	-53.6	-33.9	-175.7	0	0	0	0	0	114.2	R354	A350-R354 WeakPolarHBondContact O-CG 3.45Å; A350-R354 PolarHBondContact O-N 3.06Å
351	K	85.4	Confident	84.2	Confident	160 Å²	160	86.7 Å²	86.7	70%	0.696	45%	0.447	S	S	*	.	H	α-helix	trans	-70.1	-41.4	175.9	-172.2	178.3	179.7	-179.3	0	111.8	S349 Q355	S349-K351 PolarHBondContact O-N 3.37Å; K351-Q355 PolarHBondContact O-N 2.75Å
352	L	82.8	Confident	84.3	Confident	57 Å²	57	88.8 Å²	88.8	30%	0.298	46%	0.463	S	S	.	.	H	α-helix	trans	-72	-41.1	179.2	-69.9	168.9	0	0	0	111.6	F345 S349 R354 Q355 A356	F345-L352 HydrophobicContact CB-CB 4.33Å; F345-L352 HydrophobicContact CD1-CD1 3.98Å; F345-L352 HydrophobicContact CD1-CD2 4.24Å; F345-L352 HydrophobicContact CE1-CD1 4.43Å; S349-L352 WeakPolarHBondContact O-CA 3.34Å; S349-L352 PolarHBondContact O-N 3.02Å; S349-L352 WeakPolarHBondContact OG-CD1 3.5Å; S349-L352 WeakPolarHBondContact OG-CG 3.46Å; L352-R354 VanDerWaalsContact C-N 3.35Å; L352-R354 PolarHBondContact O-N 2.9Å; L352-Q355 WeakPolarHBondContact O-CB 3.4Å; L352-Q355 PolarHBondContact O-N 2.79Å; L352-Q355 VanDerWaalsContact O-N 3.11Å; L352-A356 PolarHBondContact O-N 2.66Å
353	A	82.9	Confident	84.4	Confident	20 Å²	20	87.7 Å²	87.7	17%	0.165	46%	0.457	C	S	.	.	H	α-helix	trans	-59.7	-42.6	175.9	0	0	0	0	0	112	S349 Q355 A356 Q357	S349-A353 PolarHBondContact O-N 3.42Å; A353-Q355 PolarHBondContact O-N 3.42Å; A353-A356 PolarHBondContact O-N 2.82Å; A353-Q357 WeakPolarHBondContact O-CG 3.46Å; A353-Q357 PolarHBondContact O-N 3.45Å
354	R	86.6	Confident	84.4	Confident	191 Å²	191	89.5 Å²	89.5	72%	0.721	45%	0.452	S	S	*	.	H	α-helix	trans	-62.6	-39	173.4	-74.9	-178.9	-174.5	175.2	2.9	112.7	A350 L352 S358	A350-R354 WeakPolarHBondContact O-CG 3.45Å; A350-R354 PolarHBondContact O-N 3.06Å; L352-R354 VanDerWaalsContact C-N 3.35Å; L352-R354 PolarHBondContact O-N 2.9Å; R354-S358 PolarHBondContact O-N 3.26Å; R354-S358 VanDerWaalsContact O-N 3.12Å
355	Q	86.8	Confident	84.6	Confident	93 Å²	93	87.4 Å²	87.4	44%	0.435	45%	0.449	S	S	.	.	H	α-helix	trans	-66.5	-38.8	175.5	-73.6	-174.7	5.9	0	0	111.9	Y341 K351 L352 A353 S358 K359	Y341-Q355 HydrophobicContact CE1-CB 4.28Å; Y341-Q355 PolarHBondContact OH-OE1 3.48Å; K351-Q355 PolarHBondContact O-N 2.75Å; L352-Q355 WeakPolarHBondContact O-CB 3.4Å; L352-Q355 PolarHBondContact O-N 2.79Å; L352-Q355 VanDerWaalsContact O-N 3.11Å; A353-Q355 PolarHBondContact O-N 3.42Å; Q355-S358 PolarHBondContact O-N 2.98Å; Q355-K359 PolarHBondContact O-N 2.92Å; Q355-K359 VanDerWaalsContact O-N 3.11Å
356	A	85.1	Confident	84.7	Confident	2 Å²	2	85.8 Å²	85.8	2%	0.017	44%	0.443	C	S	.	.	H	α-helix	trans	-62.9	-47.4	175.6	0	0	0	0	0	111.7	Y341 L352 A353 S358 K359 E360	Y341-A356 HydrophobicContact CD1-CB 4.39Å; Y341-A356 HydrophobicContact CE1-CB 4.22Å; L352-A356 PolarHBondContact O-N 2.66Å; A353-A356 PolarHBondContact O-N 2.82Å; A356-S358 VanDerWaalsContact C-N 3.29Å; A356-S358 PolarHBondContact O-N 2.81Å; A356-K359 PolarHBondContact O-N 3.38Å; A356-E360 PolarHBondContact O-N 3.28Å
357	Q	86.5	Confident	85.1	Confident	117 Å²	117	89.8 Å²	89.8	55%	0.547	46%	0.456	S	S	.	.	H	α-helix	trans	-60.3	-36.1	175.9	-71.8	176.8	-5.2	0	0	112.9	A353 E360 K361	A353-Q357 WeakPolarHBondContact O-CG 3.46Å; A353-Q357 PolarHBondContact O-N 3.45Å; Q357-E360 WeakPolarHBondContact O-CB 3.4Å; Q357-E360 PolarHBondContact O-N 3.28Å; Q357-K361 PolarHBondContact O-N 3.4Å; Q357-K361 VanDerWaalsContact O-N 3.11Å
358	S	87	Confident	85.2	Confident	73 Å²	73	84.9 Å²	84.9	51%	0.51	45%	0.449	S	S	.	.	H	α-helix	trans	-64.6	-46.3	175.2	-173.4	0	0	0	0	111.5	R354 Q355 A356 E360 K361 T362	R354-S358 PolarHBondContact O-N 3.26Å; R354-S358 VanDerWaalsContact O-N 3.12Å; Q355-S358 PolarHBondContact O-N 2.98Å; A356-S358 VanDerWaalsContact C-N 3.29Å; A356-S358 PolarHBondContact O-N 2.81Å; S358-E360 VanDerWaalsContact C-N 3.31Å; S358-E360 PolarHBondContact O-N 2.99Å; S358-K361 PolarHBondContact O-N 2.82Å; S358-T362 PolarHBondContact O-N 3.23Å; S358-T362 VanDerWaalsContact O-N 3.08Å; S358-T362 PolarHBondContact O-OG1 3Å
359	K	88.7	Confident	85.5	Confident	56 Å²	56	87.4 Å²	87.4	24%	0.243	46%	0.459	C	S	.	.	H	α-helix	trans	-62.5	-38.4	174.2	-72.6	-173.5	179.8	179.3	0	111.9	M338 Y341 Q355 A356 K361 T362 L363	M338-K359 HydrophobicContact CE-CB 4.08Å; M338-K359 WeakPolarHBondContact CE-O 3.32Å; Y341-K359 HydrophobicContact CD1-CD 3.6Å; Y341-K359 HydrophobicContact CE1-CD 4.08Å; Y341-K359 HydrophobicContact CG-CD 3.89Å; Y341-K359 VanDerWaalsContact CG-NZ 3.29Å; Q355-K359 PolarHBondContact O-N 2.92Å; Q355-K359 VanDerWaalsContact O-N 3.11Å; A356-K359 PolarHBondContact O-N 3.38Å; K359-K361 VanDerWaalsContact C-N 3.35Å; K359-K361 PolarHBondContact O-N 3.34Å; K359-T362 PolarHBondContact O-N 2.96Å; K359-T362 VanDerWaalsContact O-N 3.17Å; K359-L363 WeakPolarHBondContact O-CB 3.33Å; K359-L363 PolarHBondContact O-N 3.37Å
360	E	88.9	Confident	85.7	Confident	85 Å²	85	86.5 Å²	86.5	40%	0.397	46%	0.46	S	S	.	.	H	α-helix	trans	-58.5	-45.5	176	-172.2	178.3	-173	0	0	111.9	I342 A356 Q357 S358 T362 L363 Q364	I342-E360 HydrophobicContact CD1-CB 3.85Å; I342-E360 HydrophobicContact CD1-CG 4.36Å; I342-E360 HydrophobicContact CG1-CB 4.47Å; A356-E360 PolarHBondContact O-N 3.28Å; Q357-E360 WeakPolarHBondContact O-CB 3.4Å; Q357-E360 PolarHBondContact O-N 3.28Å; S358-E360 VanDerWaalsContact C-N 3.31Å; S358-E360 PolarHBondContact O-N 2.99Å; E360-T362 PolarHBondContact O-N 2.98Å; E360-L363 WeakPolarHBondContact O-CB 3.47Å; E360-L363 PolarHBondContact O-N 3.48Å; E360-Q364 WeakPolarHBondContact O-CG 3.17Å; E360-Q364 PolarHBondContact O-N 3.45Å
361	K	90.1	Very high	85.7	Confident	142 Å²	142	85.8 Å²	85.8	62%	0.617	45%	0.446	S	S	*	.	H	α-helix	trans	-62.4	-40.4	174	-71.1	179.3	-178.9	-179.2	0	112.6	Q357 S358 K359 L363 Q364 K365	Q357-K361 PolarHBondContact O-N 3.4Å; Q357-K361 VanDerWaalsContact O-N 3.11Å; S358-K361 PolarHBondContact O-N 2.82Å; K359-K361 VanDerWaalsContact C-N 3.35Å; K359-K361 PolarHBondContact O-N 3.34Å; K361-L363 VanDerWaalsContact C-N 3.35Å; K361-Q364 PolarHBondContact O-N 3.1Å; K361-K365 WeakPolarHBondContact O-CG 3.49Å; K361-K365 PolarHBondContact O-N 3.01Å
362	T	89.3	Confident	85.5	Confident	76 Å²	76	79.3 Å²	79.3	47%	0.466	42%	0.42	S	S	.	.	H	α-helix	trans	-64.3	-40.7	175.7	-58.2	0	0	0	0	111.4	M338 S358 K359 E360 K365 M366	M338-T362 HydrophobicContact CE-CG2 3.89Å; S358-T362 PolarHBondContact O-N 3.23Å; S358-T362 VanDerWaalsContact O-N 3.08Å; S358-T362 PolarHBondContact O-OG1 3Å; K359-T362 PolarHBondContact O-N 2.96Å; K359-T362 VanDerWaalsContact O-N 3.17Å; E360-T362 PolarHBondContact O-N 2.98Å; T362-K365 PolarHBondContact O-N 3.13Å; T362-M366 WeakPolarHBondContact O-CB 3.43Å; T362-M366 PolarHBondContact O-N 2.8Å
363	L	87.6	Confident	85.2	Confident	14 Å²	14	83.2 Å²	83.2	7%	0.073	44%	0.436	C	S	.	.	H	α-helix	trans	-62.9	-44.8	176.9	-178.7	62	0	0	0	110.6	I335 M338 K339 I342 K359 E360 K361 K365 M366 M367	I335-L363 HydrophobicContact CB-CD1 4.2Å; I335-L363 HydrophobicContact CG1-CD1 3.78Å; I335-L363 HydrophobicContact CG2-CD1 4.1Å; M338-L363 HydrophobicContact CE-CB 3.73Å; M338-L363 HydrophobicContact SD-CD1 4.48Å; K339-L363 HydrophobicContact CG-CD2 4.02Å; I342-L363 HydrophobicContact CD1-CD2 4.38Å; K359-L363 WeakPolarHBondContact O-CB 3.33Å; K359-L363 PolarHBondContact O-N 3.37Å; E360-L363 WeakPolarHBondContact O-CB 3.47Å; E360-L363 PolarHBondContact O-N 3.48Å; K361-L363 VanDerWaalsContact C-N 3.35Å; L363-K365 PolarHBondContact O-N 3.34Å; L363-M366 PolarHBondContact O-N 2.99Å; L363-M367 HydrophobicContact CG-SD 4.22Å; L363-M367 WeakPolarHBondContact O-CG 3.24Å; L363-M367 PolarHBondContact O-N 2.88Å
364	Q	87.7	Confident	85.1	Confident	114 Å²	114	90.1 Å²	90.1	53%	0.533	46%	0.458	S	S	.	.	H	α-helix	trans	-60.1	-42.8	175.7	-73.1	174.1	-1.7	0	0	112.1	E360 K361 M367 A368	E360-Q364 WeakPolarHBondContact O-CG 3.17Å; E360-Q364 PolarHBondContact O-N 3.45Å; K361-Q364 PolarHBondContact O-N 3.1Å; Q364-M367 PolarHBondContact O-N 2.88Å; Q364-A368 VanDerWaalsContact O-CB 3.32Å; Q364-A368 WeakPolarHBondContact O-CB 3.01Å; Q364-A368 PolarHBondContact O-N 2.92Å
365	K	88.9	Confident	84.6	Confident	160 Å²	160	82.2 Å²	82.2	70%	0.696	43%	0.431	S	S	*	.	H	α-helix	trans	-62.7	-42.5	175.1	-74.4	-179.1	-179.9	-174.9	0	112.3	K361 T362 L363 M367 A368 S369	K361-K365 WeakPolarHBondContact O-CG 3.49Å; K361-K365 PolarHBondContact O-N 3.01Å; T362-K365 PolarHBondContact O-N 3.13Å; L363-K365 PolarHBondContact O-N 3.34Å; K365-M367 VanDerWaalsContact C-N 3.33Å; K365-A368 PolarHBondContact O-N 2.97Å; K365-S369 PolarHBondContact O-N 2.75Å; K365-S369 PolarHBondContact O-OG 3.31Å
366	M	85.4	Confident	83.7	Confident	37 Å²	37	83.2 Å²	83.2	18%	0.182	44%	0.443	C	S	.	.	H	α-helix	trans	-65.7	-36.7	178.2	-163	173.6	95.6	0	0	112.1	E331 I335 T362 L363 S369 L371	E331-M366 HydrophobicContact CB-CE 4.38Å; I335-M366 HydrophobicContact CD1-CE 3.74Å; I335-M366 HydrophobicContact CG1-CE 3.27Å; T362-M366 WeakPolarHBondContact O-CB 3.43Å; T362-M366 PolarHBondContact O-N 2.8Å; L363-M366 PolarHBondContact O-N 2.99Å; M366-S369 PolarHBondContact O-OG 3.12Å; M366-L371 HydrophobicContact CE-CD2 3.88Å; M366-L371 HydrophobicContact CG-CD2 4.16Å
367	M	84.9	Confident	82.7	Confident	110 Å²	110	87 Å²	87	54%	0.542	47%	0.47	S	S	.	.	H	α-helix	trans	-69.1	-37.6	172.2	-69	177.2	67.1	0	0	111.8	L363 Q364 K365 G370	L363-M367 HydrophobicContact CG-SD 4.22Å; L363-M367 WeakPolarHBondContact O-CG 3.24Å; L363-M367 PolarHBondContact O-N 2.88Å; Q364-M367 PolarHBondContact O-N 2.88Å; K365-M367 VanDerWaalsContact C-N 3.33Å; M367-G370 PolarHBondContact O-N 3.33Å
368	A	81.6	Confident	81.7	Confident	89 Å²	89	82.9 Å²	82.9	74%	0.736	45%	0.451	S	S	*	.	H	α-helix	trans	-70.4	-29.3	179.2	0	0	0	0	0	113.6	Q364 K365 G370	Q364-A368 VanDerWaalsContact O-CB 3.32Å; Q364-A368 WeakPolarHBondContact O-CB 3.01Å; Q364-A368 PolarHBondContact O-N 2.92Å; K365-A368 PolarHBondContact O-N 2.97Å; A368-G370 PolarHBondContact O-N 3.02Å
369	S	81.1	Confident	80.3	Confident	96 Å²	96	88.1 Å²	88.1	67%	0.671	47%	0.465	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.3	-5	175.8	55.5	0	0	0	0	114.2	K365 M366	K365-S369 PolarHBondContact O-N 2.75Å; K365-S369 PolarHBondContact O-OG 3.31Å; M366-S369 PolarHBondContact O-OG 3.12Å
370	G	79.9	Confident	79.1	Confident	48 Å²	48	91.6 Å²	91.6	50%	0.495	49%	0.491	S	S	.	.			trans	81.2	127.3	-169	0	0	0	0	0	110.7	M367 A368	M367-G370 PolarHBondContact O-N 3.33Å; A368-G370 PolarHBondContact O-N 3.02Å
371	L	81.7	Confident	78.4	Confident	61 Å²	61	89.1 Å²	89.1	32%	0.319	48%	0.48	S	S	.	.	P	Polyproline II helix	trans	-82.5	151.2	172.9	-64.8	173.8	0	0	0	109.5	I335 M366 E373	I335-L371 HydrophobicContact CD1-CD1 3.62Å; I335-L371 HydrophobicContact CD1-CD2 3.81Å; I335-L371 HydrophobicContact CD1-CG 4.39Å; M366-L371 HydrophobicContact CE-CD2 3.88Å; M366-L371 HydrophobicContact CG-CD2 4.16Å; L371-E373 PolarHBondContact O-N 2.91Å
372	T	81.3	Confident	77.9	Confident	24 Å²	24	85.6 Å²	85.6	15%	0.147	47%	0.474	C	S	.	.	P	Polyproline II helix	trans	-58.4	128.4	170	-55.9	0	0	0	0	108.2	Q324 R327 F328 E331	Q324-T372 HydrophobicContact CG-CG2 3.58Å; R327-T372 WeakPolarHBondContact CD-OG1 3.48Å; R327-T372 PolarHBondContact NE-OG1 2.79Å; F328-T372 HydrophobicContact CB-CG2 4.3Å; F328-T372 WeakPolarHBondContact CD2-O 3.38Å; E331-T372 PolarHBondContact OE1-OG1 2.62Å; E331-T372 WeakPolarHBondContact OE2-CB 3.46Å; E331-T372 PolarHBondContact OE2-N 3.41Å; E331-T372 PolarHBondContact OE2-OG1 2.94Å
373	E	77.5	Confident	77.7	Confident	139 Å²	139	82.1 Å²	82.1	65%	0.65	45%	0.452	S	S	*	.	P	Polyproline II helix	trans	-72.3	145.5	175.4	-67.5	-177.9	171.5	0	0	110.1	Q324 L371 V375	Q324-E373 PolarHBondContact NE2-O 3.31Å; L371-E373 PolarHBondContact O-N 2.91Å; E373-V375 PolarHBondContact O-N 2.73Å
374	R	81	Confident	77.7	Confident	166 Å²	166	85 Å²	85	63%	0.626	46%	0.462	S	S	*	.	P	Polyproline II helix	trans	-62.9	132.6	170.2	-176	178.9	178.2	178.1	1.2	108.6	M325 F328 V376	M325-R374 HydrophobicContact SD-CG 4.11Å; F328-R374 HydrophobicContact CD1-CB 4.35Å; F328-R374 HydrophobicContact CD1-CG 4.35Å; F328-R374 HydrophobicContact CD2-CB 4.33Å; F328-R374 HydrophobicContact CE1-CB 4.03Å; F328-R374 HydrophobicContact CE1-CG 4.05Å; F328-R374 HydrophobicContact CE2-CB 3.99Å; F328-R374 HydrophobicContact CG-CB 4.49Å; F328-R374 HydrophobicContact CZ-CB 3.83Å; F328-R374 HydrophobicContact CZ-CG 4.31Å; R374-V376 PolarHBondContact O-N 3.13Å
375	V	75.3	Confident	77.8	Confident	24 Å²	24	79.9 Å²	79.9	15%	0.145	44%	0.438	C	S	.	.			trans	-63.3	113.9	168.7	-177.7	0	0	0	0	107.7	E321 Q324 M325 E373	E321-V375 HydrophobicContact CB-CG1 4.11Å; E321-V375 HydrophobicContact CB-CG2 4.29Å; E321-V375 HydrophobicContact CG-CG1 3.85Å; E321-V375 HydrophobicContact CG-CG2 4.43Å; Q324-V375 HydrophobicContact CB-CG2 3.77Å; Q324-V375 VanDerWaalsContact CD-CG2 3.47Å; Q324-V375 HydrophobicContact CG-CG2 3.69Å; M325-V375 HydrophobicContact CG-CB 3.81Å; M325-V375 HydrophobicContact CG-CG2 3.69Å; M325-V375 HydrophobicContact SD-CB 3.72Å; M325-V375 HydrophobicContact SD-CG2 3.97Å; E373-V375 PolarHBondContact O-N 2.73Å
376	V	67.7	Low	77.7	Confident	115 Å²	115	73.9 Å²	73.9	70%	0.697	42%	0.416	S	S	*	.			trans	-89.9	110.1	165.5	-178	0	0	0	0	104.8	R374	R374-V376 PolarHBondContact O-N 3.13Å
377	S	65	Low	77.7	Confident	81 Å²	81	75.3 Å²	75.3	57%	0.566	43%	0.428	S	S	*	.			trans	-59.6	143.7	169.6	58.9	0	0	0	0	108.5	K379	S377-K379 PolarHBondContact O-N 3.24Å
378	D	65.2	Low	77.8	Confident	30 Å²	30	70.8 Å²	70.8	16%	0.16	41%	0.407	C	S	.	.			trans	-52.1	135	165.2	-66.3	-50.8	0	0	0	107.7	R317 T380	R317-D378 IonicContact CZ-OD2 3.61Å; R317-D378 IonicContact NH1-OD2 3.67Å; R317-D378 IonicContact NH2-OD2 2.84Å; R317-D378 PolarHBondContact NH2-OD2 3.01Å; D378-T380 PolarHBondContact O-N 3.06Å
379	K	56.8	Low	78.1	Confident	184 Å²	184	68.4 Å²	68.4	80%	0.8	39%	0.391	S	S	*	.			trans	-59.6	107.3	179	-79.7	-176	178.9	-179.7	0	107.4	S377 L381	S377-K379 PolarHBondContact O-N 3.24Å; K379-L381 PolarHBondContact O-N 3.41Å; K379-L381 VanDerWaalsContact O-N 3.1Å
380	T	63.9	Low	78.4	Confident	129 Å²	129	73.6 Å²	73.6	79%	0.791	40%	0.402	S	S	*	.			trans	-64.5	114.1	173	49	0	0	0	0	107.2	D378	D378-T380 PolarHBondContact O-N 3.06Å
381	L	75	Confident	78.9	Confident	33 Å²	33	72.1 Å²	72.1	17%	0.173	38%	0.382	C	S	.	.			trans	-69.3	140.4	170.3	-67.1	167.7	0	0	0	107.1	K379 F383 G504 A554	K379-L381 PolarHBondContact O-N 3.41Å; K379-L381 VanDerWaalsContact O-N 3.1Å; L381-F383 HydrophobicContact CB-CE1 4.28Å; L381-G504 VanDerWaalsContact CD2-CA 3.46Å; L381-A554 HydrophobicContact CB-CB 3.83Å; L381-A554 WeakPolarHBondContact O-CB 3.41Å
382	S	78.3	Confident	79.3	Confident	68 Å²	68	73 Å²	73	48%	0.476	39%	0.392	S	S	.	.			trans	-128.2	104	174.3	171.9	0	0	0	0	107.2
383	F	86.5	Confident	79.6	Confident	3 Å²	3	76.5 Å²	76.5	1%	0.013	42%	0.415	C	S	.	.			trans	-79.2	159.6	171.8	-60.2	-24.5	0	0	0	109.7	L381 Y503 R524 L527 T551 A554 L555 A558	L381-F383 HydrophobicContact CB-CE1 4.28Å; F383-Y503 HydrophobicContact CB-CD1 4.28Å; F383-Y503 HydrophobicContact CB-CE1 3.76Å; F383-Y503 AromaticContact CD1-CD1 3.28Å; F383-Y503 HydrophobicContact CD1-CD1 3.28Å; F383-Y503 AromaticContact CD1-CE1 3.7Å; F383-Y503 HydrophobicContact CD1-CE1 3.7Å; F383-Y503 HydrophobicContact CD1-CG 4.03Å; F383-Y503 AromaticContact CE1-CD1 3.63Å; F383-Y503 HydrophobicContact CE1-CD1 3.63Å; F383-Y503 HydrophobicContact CE1-CE1 4.42Å; F383-Y503 HydrophobicContact CE1-CG 4.3Å; F383-Y503 AromaticContact CG-CD1 3.8Å; F383-Y503 HydrophobicContact CG-CD1 3.8Å; F383-Y503 AromaticContact CG-CE1 3.74Å; F383-Y503 HydrophobicContact CG-CE1 3.74Å; F383-Y503 HydrophobicContact CZ-CD1 4.39Å; F383-R524 HydrophobicContact CE1-CG 4.33Å; F383-R524 HydrophobicContact CZ-CG 3.98Å; F383-L527 HydrophobicContact CD2-CD1 4.04Å; F383-L527 HydrophobicContact CE2-CD1 3.64Å; F383-L527 HydrophobicContact CZ-CD1 4.12Å; F383-T551 HydrophobicContact CE2-CG2 3.51Å; F383-T551 HydrophobicContact CZ-CG2 3.44Å; F383-T551 VanDerWaalsContact CZ-CG2 3.44Å; F383-A554 HydrophobicContact CD2-CB 3.98Å; F383-A554 HydrophobicContact CE2-CB 4.09Å; F383-A554 HydrophobicContact CG-CB 4.28Å; F383-L555 HydrophobicContact CD2-CB 4.07Å; F383-L555 HydrophobicContact CD2-CD1 4.46Å; F383-L555 HydrophobicContact CE2-CB 4.28Å; F383-A558 VanDerWaalsContact C-CB 3.48Å; F383-A558 HydrophobicContact CB-CB 3.5Å; F383-A558 WeakPolarHBondContact O-CB 3.46Å
384	Y	86.5	Confident	80.2	Confident	74 Å²	74	73.2 Å²	73.2	29%	0.29	41%	0.405	S	S	.	.			trans	-155	119.6	-176.2	175.2	-105	0	0	0	110.6	P386 P387 R502 Y503	Y384-P386 HydrophobicContact CD1-CG 4.39Å; Y384-P386 HydrophobicContact CE1-CB 4.21Å; Y384-P386 HydrophobicContact CE1-CG 4.07Å; Y384-P387 VanDerWaalsContact OH-CD 3.25Å; Y384-P387 WeakPolarHBondContact OH-CD 3.47Å; Y384-R502 VanDerWaalsContact CB-CZ 3.43Å; Y384-R502 VanDerWaalsContact CG-CZ 3.48Å; Y384-R502 VanDerWaalsContact CG-NH2 3.3Å; Y384-Y503 PolarHBondContact N-OH 3.11Å; Y384-Y503 PolarHBondContact O-OH 2.87Å
385	F	89.4	Confident	80.8	Confident	6 Å²	6	65.3 Å²	65.3	3%	0.026	38%	0.376	C	S	.	.	P	Polyproline II helix	trans	-94.4	120.1	168.8	-67.4	-76.5	0	0	0	109	L530 A531 L538 L555 A558 I559 F562	F385-L530 HydrophobicContact CE1-CD2 4.5Å; F385-L530 HydrophobicContact CE1-CG 4.47Å; F385-A531 HydrophobicContact CD1-CB 3.74Å; F385-A531 HydrophobicContact CE1-CB 3.97Å; F385-L538 HydrophobicContact CE1-CD1 4.06Å; F385-L538 HydrophobicContact CE1-CD2 4.33Å; F385-L538 HydrophobicContact CE2-CD2 4.09Å; F385-L538 HydrophobicContact CZ-CD1 4.4Å; F385-L538 HydrophobicContact CZ-CD2 3.97Å; F385-L555 HydrophobicContact CE2-CD1 4.48Å; F385-A558 HydrophobicContact CD2-CB 3.93Å; F385-A558 HydrophobicContact CE2-CB 4.01Å; F385-I559 HydrophobicContact CE2-CG1 4.4Å; F385-F562 HydrophobicContact CB-CB 4.14Å; F385-F562 HydrophobicContact CB-CD2 3.58Å; F385-F562 HydrophobicContact CB-CE2 4.36Å; F385-F562 HydrophobicContact CB-CG 4.16Å; F385-F562 HydrophobicContact CD2-CB 4.45Å; F385-F562 HydrophobicContact CG-CD2 4.33Å
386	P	86.7	Confident	81.7	Confident	35 Å²	35	64.2 Å²	64.2	23%	0.227	37%	0.369	C	S	.	.	P	Polyproline II helix	trans	-58.7	153.3	175.5	-22.9	33.4	0	0	0	112.4	Y384 C388 A531 N534	Y384-P386 HydrophobicContact CD1-CG 4.39Å; Y384-P386 HydrophobicContact CE1-CB 4.21Å; Y384-P386 HydrophobicContact CE1-CG 4.07Å; P386-C388 PolarHBondContact O-N 3.36Å; P386-A531 WeakPolarHBondContact CD-O 3.19Å; P386-N534 PolarHBondContact O-OD1 2.9Å
387	P	87.1	Confident	83.1	Confident	66 Å²	66	61.4 Å²	61.4	43%	0.429	35%	0.349	S	S	.	.	P	Polyproline II helix	trans	-66.9	129	174.8	27.1	-34.5	0	0	0	110.8	Y384 N534	Y384-P387 VanDerWaalsContact OH-CD 3.25Å; Y384-P387 WeakPolarHBondContact OH-CD 3.47Å; P387-N534 PolarHBondContact O-ND2 3.23Å; P387-N534 PolarHBondContact O-OD1 3.37Å
388	C	86.2	Confident	84.6	Confident	15 Å²	15	57.8 Å²	57.8	10%	0.101	32%	0.323	C	S	.	.			trans	-87.9	-12.3	-176	60.1	0	0	0	0	114.3	P386 N534 P535 H536	P386-C388 PolarHBondContact O-N 3.36Å; C388-N534 VanDerWaalsContact CA-OD1 3.31Å; C388-N534 WeakPolarHBondContact CA-OD1 3.33Å; C388-P535 WeakPolarHBondContact CB-O 3.32Å; C388-H536 HydrophobicContact CB-CB 4.49Å; C388-H536 PolarHBondContact O-CD2 3.09Å; C388-H536 PolarHBondContact O-NE2 3.35Å; C388-H536 VanDerWaalsContact O-NE2 3.12Å
389	G	87.5	Confident	86	Confident	40 Å²	40	59.9 Å²	59.9	41%	0.412	33%	0.332	S	S	.	.			trans	83.5	179.8	-170.4	0	0	0	0	0	112.9
390	K	88.1	Confident	87.9	Confident	205 Å²	205	54.5 Å²	54.5	89%	0.891	31%	0.312	S	S	*	.			trans	-102	137.1	-173.3	-62.9	-173.3	178.1	-174.5	0	112
391	I	90	Very high	89.4	Confident	16 Å²	16	48.4 Å²	48.4	8%	0.082	28%	0.275	C	S	.	.			trans	-120.8	133.5	171.7	-64.1	-177.8	0	0	0	107.4	V395 L422 H457 V460 H536	I391-V395 HydrophobicContact CB-CG2 4.38Å; I391-V395 HydrophobicContact CG2-CG1 4.42Å; I391-V395 HydrophobicContact CG2-CG2 4.04Å; I391-L422 HydrophobicContact CB-CD1 3.97Å; I391-H457 HydrophobicContact CG2-CB 3.96Å; I391-H457 VanDerWaalsContact CG2-CG 3.47Å; I391-H457 WeakPolarHBondContact CG2-ND1 3.32Å; I391-V460 HydrophobicContact CD1-CB 4.16Å; I391-V460 HydrophobicContact CD1-CG2 4.29Å; I391-H536 HydrophobicContact CD1-CB 3.89Å; I391-H536 WeakPolarHBondContact CD1-CD2 3.22Å; I391-H536 VanDerWaalsContact CD1-CG 3.43Å
392	P	89.4	Confident	90.4	Very high	80 Å²	80	47.9 Å²	47.9	52%	0.519	27%	0.274	S	S	.	.	P	Polyproline II helix	trans	-65.7	140	176.9	27.4	-34.2	0	0	0	111.2
393	P	88.8	Confident	91.2	Very high	98 Å²	98	45.1 Å²	45.1	64%	0.636	25%	0.253	S	S	*	.	S	Bend	trans	-67.7	152.7	171.3	30.2	-34.7	0	0	0	110.4	D421	P393-D421 WeakPolarHBondContact CB-OD1 3.44Å
394	P	89.1	Confident	91.5	Very high	69 Å²	69	48.3 Å²	48.3	45%	0.448	27%	0.267	S	S	.	.	P	Polyproline II helix	cis	-82.5	133	-2.1	29.7	-28.8	0	0	0	112	M397 D421	P394-M397 HydrophobicContact CB-CE 3.79Å; P394-M397 HydrophobicContact CG-CE 3.36Å; P394-D421 WeakPolarHBondContact CA-OD1 3.46Å
395	V	93.6	Very high	91.7	Very high	1 Å²	1	50.7 Å²	50.7	1%	0.006	28%	0.277	C	S	.	.	S	Bend	trans	-78.8	-49.7	-178.1	-174.7	0	0	0	0	111.6	I391 I420 D421 L422 H457 V460 M537	I391-V395 HydrophobicContact CB-CG2 4.38Å; I391-V395 HydrophobicContact CG2-CG1 4.42Å; I391-V395 HydrophobicContact CG2-CG2 4.04Å; V395-I420 WeakPolarHBondContact CB-O 3.37Å; V395-D421 PolarHBondContact N-OD1 3.14Å; V395-L422 HydrophobicContact CG2-CG 4.1Å; V395-H457 PolarHBondContact O-N 2.92Å; V395-V460 HydrophobicContact CG1-CB 3.99Å; V395-V460 HydrophobicContact CG1-CG2 3.41Å; V395-V460 VanDerWaalsContact CG1-CG2 3.41Å; V395-M537 HydrophobicContact CB-CE 3.98Å; V395-M537 HydrophobicContact CG1-CE 3.72Å; V395-M537 HydrophobicContact CG1-CG 4.42Å; V395-M537 HydrophobicContact CG2-CE 4.13Å
396	I	95.7	Very high	91.6	Very high	0 Å²	0	54.6 Å²	54.6	0%	0	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.4	125.8	171.6	-52.1	177.7	0	0	0	108.2	G419 I420 L443 I454 R455 K456 I462 M537 F539	I396-G419 CarbonylContact O-C 3.56Å; I396-G419 WeakPolarHBondContact O-CA 3.37Å; I396-I420 HydrophobicContact CB-CB 4.27Å; I396-I420 PolarHBondContact N-O 3.36Å; I396-I420 PolarHBondContact O-N 3.48Å; I396-L443 HydrophobicContact CG2-CD2 3.97Å; I396-I454 HydrophobicContact CG2-CG2 3.93Å; I396-R455 CarbonylContact C-O 3.6Å; I396-R455 WeakPolarHBondContact CA-O 3.34Å; I396-K456 HydrophobicContact CG1-CG 4.27Å; I396-K456 HydrophobicContact CG2-CG 4.25Å; I396-I462 HydrophobicContact CD1-CD1 3.86Å; I396-M537 HydrophobicContact CD1-CG 4.23Å; I396-F539 HydrophobicContact CD1-CZ 3.9Å
397	M	96	Very high	91.5	Very high	56 Å²	56	61.3 Å²	61.3	28%	0.276	33%	0.327	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	125.3	177	-173.1	-174.5	-66.6	0	0	109.8	P394 Q399 I454 R455	P394-M397 HydrophobicContact CB-CE 3.79Å; P394-M397 HydrophobicContact CG-CE 3.36Å; M397-Q399 HydrophobicContact CG-CG 3.86Å; M397-Q399 HydrophobicContact SD-CG 3.93Å; M397-Q399 PolarHBondContact SD-NE2 3.47Å; M397-Q399 VanDerWaalsContact SD-NE2 3.38Å; M397-I454 CarbonylContact O-C 3.52Å; M397-I454 WeakPolarHBondContact O-CA 3.48Å; M397-R455 HydrophobicContact CB-CB 4.39Å; M397-R455 PolarHBondContact N-O 2.89Å; M397-R455 PolarHBondContact O-N 2.8Å
398	V	96.2	Very high	91.3	Very high	5 Å²	5	66 Å²	66	3%	0.03	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	121.1	177.6	-178.2	0	0	0	0	107.7	V401 L416 E417 F418 L443 I454	V398-V401 HydrophobicContact CG1-CB 3.65Å; V398-V401 HydrophobicContact CG1-CG1 4.44Å; V398-V401 HydrophobicContact CG1-CG2 3.56Å; V398-L416 HydrophobicContact CG1-CB 4.11Å; V398-E417 WeakPolarHBondContact O-CA 3.26Å; V398-F418 HydrophobicContact CB-CD1 4.38Å; V398-F418 HydrophobicContact CB-CD2 4.29Å; V398-F418 HydrophobicContact CB-CE1 4.2Å; V398-F418 HydrophobicContact CB-CE2 4.1Å; V398-F418 HydrophobicContact CB-CG 4.43Å; V398-F418 HydrophobicContact CB-CZ 4.04Å; V398-F418 WeakPolarHBondContact CB-O 3.39Å; V398-F418 HydrophobicContact CG1-CE1 4.05Å; V398-F418 HydrophobicContact CG1-CZ 4.15Å; V398-F418 HydrophobicContact CG2-CD2 4.09Å; V398-F418 HydrophobicContact CG2-CE1 4.31Å; V398-F418 HydrophobicContact CG2-CE2 3.53Å; V398-F418 HydrophobicContact CG2-CZ 3.66Å; V398-F418 PolarHBondContact N-O 3.4Å; V398-F418 PolarHBondContact O-N 2.92Å; V398-L443 HydrophobicContact CG2-CD2 3.6Å; V398-I454 HydrophobicContact CG1-CG1 4.47Å; V398-I454 HydrophobicContact CG2-CG1 4.34Å; V398-I454 HydrophobicContact CG2-CG2 4.41Å
399	Q	96	Very high	91.1	Very high	75 Å²	75	66.2 Å²	66.2	35%	0.35	35%	0.352	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	122.9	-177.3	-60.5	-173.2	-54.7	0	0	111.3	M397 V401 G452 M453	M397-Q399 HydrophobicContact CG-CG 3.86Å; M397-Q399 HydrophobicContact SD-CG 3.93Å; M397-Q399 PolarHBondContact SD-NE2 3.47Å; M397-Q399 VanDerWaalsContact SD-NE2 3.38Å; Q399-V401 PolarHBondContact O-N 3.31Å; Q399-V401 VanDerWaalsContact O-N 3.1Å; Q399-G452 WeakPolarHBondContact O-CA 3.44Å; Q399-M453 PolarHBondContact N-O 3.46Å; Q399-M453 PolarHBondContact O-N 2.99Å
400	N	96.2	Very high	91	Very high	71 Å²	71	69.2 Å²	69.2	38%	0.38	37%	0.365	S	S	.	.	E	Extended strand (participates in β ladder)	trans	48.3	35.2	177.8	-60.6	-66.3	0	0	0	113.6	S402 N415 L416 E417 G452	N400-S402 PolarHBondContact O-N 3.09Å; N400-N415 VanDerWaalsContact CA-OD1 3.29Å; N400-N415 WeakPolarHBondContact CA-OD1 3.29Å; N400-N415 VanDerWaalsContact CB-OD1 3.3Å; N400-N415 WeakPolarHBondContact CB-OD1 3.38Å; N400-N415 PolarHBondContact OD1-OD1 3.34Å; N400-L416 PolarHBondContact N-O 3.3Å; N400-L416 VanDerWaalsContact N-O 3.11Å; N400-E417 PolarHBondContact ND2-OE1 3.17Å; N400-E417 PolarHBondContact OD1-OE1 3.03Å; N400-G452 VanDerWaalsContact O-CA 3.29Å; N400-G452 WeakPolarHBondContact O-CA 3.48Å
401	V	95.4	Very high	91.1	Very high	1 Å²	1	61 Å²	61	1%	0.006	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.6	121.5	-171.5	167	0	0	0	0	110.9	V398 Q399 N415 L416 P449 D451 I454	V398-V401 HydrophobicContact CG1-CB 3.65Å; V398-V401 HydrophobicContact CG1-CG1 4.44Å; V398-V401 HydrophobicContact CG1-CG2 3.56Å; Q399-V401 PolarHBondContact O-N 3.31Å; Q399-V401 VanDerWaalsContact O-N 3.1Å; V401-N415 PolarHBondContact O-N 3.14Å; V401-L416 HydrophobicContact CB-CB 4.26Å; V401-L416 PolarHBondContact N-O 3.03Å; V401-L416 WeakPolarHBondContact O-CB 3.26Å; V401-L416 PolarHBondContact O-N 3.31Å; V401-P449 HydrophobicContact CG1-CB 3.74Å; V401-P449 HydrophobicContact CG2-CB 4.32Å; V401-D451 CarbonylContact C-O 3.44Å; V401-D451 VanDerWaalsContact CA-O 3.29Å; V401-D451 WeakPolarHBondContact CA-O 3.39Å; V401-I454 HydrophobicContact CG2-CG1 3.78Å
402	S	95.3	Very high	91.2	Very high	22 Å²	22	61.7 Å²	61.7	15%	0.154	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	145	170.1	-53.7	0	0	0	0	110.3	N400 Y413 N415 T450 D451	N400-S402 PolarHBondContact O-N 3.09Å; S402-Y413 CarbonylContact C-O 3.57Å; S402-Y413 WeakPolarHBondContact CA-O 3.49Å; S402-Y413 WeakPolarHBondContact CB-O 3.43Å; S402-N415 PolarHBondContact OG-N 3Å; S402-T450 WeakPolarHBondContact O-CA 3.42Å; S402-T450 WeakPolarHBondContact O-CB 3.4Å; S402-T450 PolarHBondContact O-N 3.3Å; S402-D451 PolarHBondContact N-O 3.24Å; S402-D451 PolarHBondContact O-N 2.98Å; S402-D451 VanDerWaalsContact O-N 3.15Å
403	F	95.4	Very high	91.4	Very high	10 Å²	10	57.9 Å²	57.9	4%	0.044	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145	133.8	-176.6	-177.7	-100.6	0	0	0	113.6	Y405 C411 I412 Y413 T438 L442 L447 L448	F403-Y405 HydrophobicContact CE1-CD1 4.05Å; F403-Y405 AromaticContact CE1-CD2 3.93Å; F403-Y405 HydrophobicContact CE1-CD2 3.93Å; F403-Y405 HydrophobicContact CE1-CE1 4.04Å; F403-Y405 AromaticContact CE1-CE2 3.93Å; F403-Y405 HydrophobicContact CE1-CE2 3.93Å; F403-Y405 AromaticContact CE1-CG 3.99Å; F403-Y405 HydrophobicContact CE1-CG 3.99Å; F403-Y405 AromaticContact CE1-CZ 3.98Å; F403-Y405 HydrophobicContact CZ-CD1 4.01Å; F403-Y405 HydrophobicContact CZ-CE1 4.13Å; F403-Y405 HydrophobicContact CZ-CG 4.28Å; F403-C411 PolarHBondContact O-SG 3.15Å; F403-C411 VanDerWaalsContact O-SG 3.33Å; F403-I412 HydrophobicContact CD1-CB 4.29Å; F403-I412 HydrophobicContact CD1-CG1 4.36Å; F403-I412 PolarHBondContact O-N 3.36Å; F403-Y413 PolarHBondContact N-O 3.28Å; F403-Y413 PolarHBondContact O-N 3.41Å; F403-T438 HydrophobicContact CD1-CG2 3.53Å; F403-T438 HydrophobicContact CE1-CG2 3.4Å; F403-T438 VanDerWaalsContact CE1-CG2 3.4Å; F403-T438 HydrophobicContact CZ-CG2 4.38Å; F403-L442 HydrophobicContact CB-CD1 3.89Å; F403-L442 HydrophobicContact CB-CD2 4.41Å; F403-L442 HydrophobicContact CD1-CD1 4.35Å; F403-L442 HydrophobicContact CD2-CD1 4.5Å; F403-L442 HydrophobicContact CD2-CD2 3.7Å; F403-L442 HydrophobicContact CE2-CD2 4.16Å; F403-L442 HydrophobicContact CG-CD1 3.98Å; F403-L442 HydrophobicContact CG-CD2 4.03Å; F403-L442 HydrophobicContact CG-CG 4.47Å; F403-L447 HydrophobicContact CE1-CD1 4.14Å; F403-L447 HydrophobicContact CE2-CB 4.18Å; F403-L447 HydrophobicContact CE2-CD1 4.45Å; F403-L447 HydrophobicContact CZ-CB 4.31Å; F403-L447 HydrophobicContact CZ-CD1 3.76Å; F403-L447 HydrophobicContact CZ-CD2 4.3Å; F403-L447 HydrophobicContact CZ-CG 4.35Å; F403-L448 WeakPolarHBondContact CD2-O 3.35Å; F403-L448 WeakPolarHBondContact CE2-O 2.98Å
404	K	93.2	Very high	91.6	Very high	70 Å²	70	56.7 Å²	56.7	30%	0.304	30%	0.3	S	S	.	.			trans	-135.5	143	168.5	59.3	-174.2	179.1	178.1	0	110.4	T406 K407 T450	K404-T406 VanDerWaalsContact CD-O 3.31Å; K404-T406 WeakPolarHBondContact CD-O 3.37Å; K404-T406 WeakPolarHBondContact CG-O 3.39Å; K404-K407 WeakPolarHBondContact CE-O 3.33Å; K404-K407 PolarHBondContact NZ-O 3.1Å; K404-T450 HydrophobicContact CD-CG2 4.47Å; K404-T450 HydrophobicContact CG-CG2 4.11Å; K404-T450 PolarHBondContact N-OG1 3.36Å; K404-T450 VanDerWaalsContact N-OG1 3.15Å
405	Y	90	Very high	91.8	Very high	124 Å²	124	57.5 Å²	57.5	49%	0.486	30%	0.3	S	S	.	.	S	Bend	trans	-69.9	-35.5	178.5	-83	-75.2	0	0	0	113	F403 I412 T438 L447	F403-Y405 HydrophobicContact CE1-CD1 4.05Å; F403-Y405 AromaticContact CE1-CD2 3.93Å; F403-Y405 HydrophobicContact CE1-CD2 3.93Å; F403-Y405 HydrophobicContact CE1-CE1 4.04Å; F403-Y405 AromaticContact CE1-CE2 3.93Å; F403-Y405 HydrophobicContact CE1-CE2 3.93Å; F403-Y405 AromaticContact CE1-CG 3.99Å; F403-Y405 HydrophobicContact CE1-CG 3.99Å; F403-Y405 AromaticContact CE1-CZ 3.98Å; F403-Y405 HydrophobicContact CZ-CD1 4.01Å; F403-Y405 HydrophobicContact CZ-CE1 4.13Å; F403-Y405 HydrophobicContact CZ-CG 4.28Å; Y405-I412 HydrophobicContact CD2-CD1 4.28Å; Y405-I412 HydrophobicContact CD2-CG1 3.91Å; Y405-I412 HydrophobicContact CE2-CD1 4.49Å; Y405-I412 HydrophobicContact CE2-CG1 4.11Å; Y405-T438 HydrophobicContact CE2-CG2 4.01Å; Y405-T438 WeakPolarHBondContact OH-CG2 3.29Å; Y405-T438 PolarHBondContact OH-OG1 3.44Å; Y405-L447 HydrophobicContact CE1-CD1 4.03Å
406	T	88.6	Confident	91.9	Very high	88 Å²	88	57.6 Å²	57.6	54%	0.54	30%	0.301	S	S	.	.	S	Bend	trans	-131.3	154.9	179.7	56.2	0	0	0	0	109.8	K404 D408 G409	K404-T406 VanDerWaalsContact CD-O 3.31Å; K404-T406 WeakPolarHBondContact CD-O 3.37Å; K404-T406 WeakPolarHBondContact CG-O 3.39Å; T406-D408 VanDerWaalsContact C-N 3.27Å; T406-D408 PolarHBondContact O-N 3.44Å; T406-G409 PolarHBondContact O-N 2.94Å; T406-G409 VanDerWaalsContact O-N 3.1Å; T406-G409 WeakPolarHBondContact OG1-CA 3.31Å; T406-G409 PolarHBondContact OG1-N 3.03Å; T406-G409 VanDerWaalsContact OG1-N 3.13Å
407	K	82.8	Confident	91.8	Very high	175 Å²	175	63.3 Å²	63.3	76%	0.761	33%	0.327	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.9	-39.5	-177	-72.1	-175.3	178.3	-180	0	112.6	K404	K404-K407 WeakPolarHBondContact CE-O 3.33Å; K404-K407 PolarHBondContact NZ-O 3.1Å
408	D	84.3	Confident	91.7	Very high	166 Å²	166	62.2 Å²	62.2	89%	0.888	32%	0.321	S	S	*	.	T	Hydrogen-bonded Turn	trans	-100.3	7.7	179.4	-49.7	-52.1	0	0	0	112.4	T406	T406-D408 VanDerWaalsContact C-N 3.27Å; T406-D408 PolarHBondContact O-N 3.44Å
409	G	81.6	Confident	91.6	Very high	18 Å²	18	63.8 Å²	63.8	19%	0.186	34%	0.339	C	S	.	.	S	Bend	trans	-80	163.2	-180	0	0	0	0	0	112.9	T406	T406-G409 PolarHBondContact O-N 2.94Å; T406-G409 VanDerWaalsContact O-N 3.1Å; T406-G409 WeakPolarHBondContact OG1-CA 3.31Å; T406-G409 PolarHBondContact OG1-N 3.03Å; T406-G409 VanDerWaalsContact OG1-N 3.13Å
410	P	86	Confident	91.6	Very high	103 Å²	103	60.2 Å²	60.2	67%	0.669	32%	0.322	S	S	*	.	P	Polyproline II helix	trans	-60.4	140.7	172.5	27.9	-34.1	0	0	0	110	I412	P410-I412 PolarHBondContact O-N 3.31Å
411	C	89	Confident	91.5	Very high	33 Å²	33	58.8 Å²	58.8	22%	0.223	31%	0.314	C	S	.	.	P	Polyproline II helix	trans	-69	131.8	172.2	-149.8	0	0	0	0	109.6	F403 Y413 N414 Q589	F403-C411 PolarHBondContact O-SG 3.15Å; F403-C411 VanDerWaalsContact O-SG 3.33Å; C411-Y413 PolarHBondContact SG-O 3.08Å; C411-N414 WeakPolarHBondContact CB-OD1 3.37Å; C411-N414 PolarHBondContact SG-OD1 3.07Å; C411-Q589 VanDerWaalsContact O-CD 3.26Å; C411-Q589 WeakPolarHBondContact O-CG 3.4Å; C411-Q589 PolarHBondContact O-NE2 2.95Å; C411-Q589 VanDerWaalsContact O-NE2 3.17Å
412	I	91.7	Very high	91.3	Very high	31 Å²	31	59.9 Å²	59.9	16%	0.159	32%	0.32	C	S	.	.	S	Bend	trans	-86.2	-40.5	175.3	-56	-58.7	0	0	0	109.5	F403 Y405 P410 T438 Q589	F403-I412 HydrophobicContact CD1-CB 4.29Å; F403-I412 HydrophobicContact CD1-CG1 4.36Å; F403-I412 PolarHBondContact O-N 3.36Å; Y405-I412 HydrophobicContact CD2-CD1 4.28Å; Y405-I412 HydrophobicContact CD2-CG1 3.91Å; Y405-I412 HydrophobicContact CE2-CD1 4.49Å; Y405-I412 HydrophobicContact CE2-CG1 4.11Å; P410-I412 PolarHBondContact O-N 3.31Å; I412-T438 HydrophobicContact CG2-CG2 4.46Å; I412-Q589 WeakPolarHBondContact O-CA 3.44Å; I412-Q589 WeakPolarHBondContact O-CB 3.37Å
413	Y	94.7	Very high	91.2	Very high	0 Å²	0	64.4 Å²	64.4	0%	0	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.4	136.2	-179.3	-70.3	-58	0	0	0	111.5	S402 F403 C411 L416 G435 L439 L442 C586 Q589 I591	S402-Y413 CarbonylContact C-O 3.57Å; S402-Y413 WeakPolarHBondContact CA-O 3.49Å; S402-Y413 WeakPolarHBondContact CB-O 3.43Å; F403-Y413 PolarHBondContact N-O 3.28Å; F403-Y413 PolarHBondContact O-N 3.41Å; C411-Y413 PolarHBondContact SG-O 3.08Å; Y413-L416 HydrophobicContact CD1-CD1 3.68Å; Y413-L416 HydrophobicContact CD1-CD2 3.97Å; Y413-L416 HydrophobicContact CD1-CG 4.14Å; Y413-L416 HydrophobicContact CD2-CD1 3.88Å; Y413-L416 HydrophobicContact CE1-CD1 4.27Å; Y413-L416 HydrophobicContact CE2-CD1 4.43Å; Y413-L416 HydrophobicContact CG-CD1 3.47Å; Y413-L416 VanDerWaalsContact CG-CD1 3.47Å; Y413-L416 HydrophobicContact CG-CD2 4.47Å; Y413-L416 HydrophobicContact CG-CG 4.12Å; Y413-G435 WeakPolarHBondContact OH-CA 3.4Å; Y413-G435 PolarHBondContact OH-O 2.86Å; Y413-L439 HydrophobicContact CE2-CB 4.11Å; Y413-L439 HydrophobicContact CE2-CD1 4.24Å; Y413-L442 HydrophobicContact CD2-CD1 4.14Å; Y413-C586 PolarHBondContact OH-SG 3.48Å; Y413-Q589 CarbonylContact C-O 3.52Å; Y413-Q589 VanDerWaalsContact CA-O 3.32Å; Y413-Q589 WeakPolarHBondContact CA-O 3.4Å; Y413-I591 HydrophobicContact CE1-CD1 4.09Å; Y413-I591 HydrophobicContact CE1-CG1 3.9Å
414	N	93	Very high	91.1	Very high	72 Å²	72	64.9 Å²	64.9	39%	0.385	35%	0.346	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	125.4	172.3	-63.2	-37.3	0	0	0	109.8	C411 L416 Q589	C411-N414 WeakPolarHBondContact CB-OD1 3.37Å; C411-N414 PolarHBondContact SG-OD1 3.07Å; N414-L416 PolarHBondContact O-N 3.23Å; N414-Q589 PolarHBondContact N-O 3.38Å; N414-Q589 PolarHBondContact ND2-OE1 3.3Å
415	N	93.4	Very high	91.2	Very high	86 Å²	86	62.9 Å²	62.9	46%	0.46	34%	0.337	S	S	.	.	E	Extended strand (participates in β ladder)	trans	50.4	50.4	167.7	-156.3	57.9	0	0	0	115.2	N400 V401 S402	N400-N415 VanDerWaalsContact CA-OD1 3.29Å; N400-N415 WeakPolarHBondContact CA-OD1 3.29Å; N400-N415 VanDerWaalsContact CB-OD1 3.3Å; N400-N415 WeakPolarHBondContact CB-OD1 3.38Å; N400-N415 PolarHBondContact OD1-OD1 3.34Å; V401-N415 PolarHBondContact O-N 3.14Å; S402-N415 PolarHBondContact OG-N 3Å
416	L	94.5	Very high	91.5	Very high	3 Å²	3	57 Å²	57	2%	0.016	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.9	131.9	175.9	-65.9	178.7	0	0	0	111.3	V398 N400 V401 Y413 N414 F418 L439 I591	V398-L416 HydrophobicContact CG1-CB 4.11Å; N400-L416 PolarHBondContact N-O 3.3Å; N400-L416 VanDerWaalsContact N-O 3.11Å; V401-L416 HydrophobicContact CB-CB 4.26Å; V401-L416 PolarHBondContact N-O 3.03Å; V401-L416 WeakPolarHBondContact O-CB 3.26Å; V401-L416 PolarHBondContact O-N 3.31Å; Y413-L416 HydrophobicContact CD1-CD1 3.68Å; Y413-L416 HydrophobicContact CD1-CD2 3.97Å; Y413-L416 HydrophobicContact CD1-CG 4.14Å; Y413-L416 HydrophobicContact CD2-CD1 3.88Å; Y413-L416 HydrophobicContact CE1-CD1 4.27Å; Y413-L416 HydrophobicContact CE2-CD1 4.43Å; Y413-L416 HydrophobicContact CG-CD1 3.47Å; Y413-L416 VanDerWaalsContact CG-CD1 3.47Å; Y413-L416 HydrophobicContact CG-CD2 4.47Å; Y413-L416 HydrophobicContact CG-CG 4.12Å; N414-L416 PolarHBondContact O-N 3.23Å; L416-F418 HydrophobicContact CB-CE1 4.11Å; L416-F418 HydrophobicContact CD1-CE1 4.3Å; L416-L439 HydrophobicContact CD1-CD1 3.91Å; L416-I591 HydrophobicContact CD1-CD1 4.02Å; L416-I591 HydrophobicContact CD2-CB 4.12Å; L416-I591 HydrophobicContact CD2-CD1 4.01Å; L416-I591 HydrophobicContact CD2-CG1 3.93Å
417	E	93.8	Very high	91.9	Very high	120 Å²	120	52.8 Å²	52.8	56%	0.561	29%	0.288	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-136.3	114.7	175	-65.5	-165.1	142.4	0	0	110.5	V398 N400	V398-E417 WeakPolarHBondContact O-CA 3.26Å; N400-E417 PolarHBondContact ND2-OE1 3.17Å; N400-E417 PolarHBondContact OD1-OE1 3.03Å
418	F	95	Very high	92.5	Very high	34 Å²	34	44.5 Å²	44.5	15%	0.149	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-166.4	163.5	172.7	56.8	-93.8	0	0	0	111.2	V398 L416 I420 L439 L443 W584 I591	V398-F418 HydrophobicContact CB-CD1 4.38Å; V398-F418 HydrophobicContact CB-CD2 4.29Å; V398-F418 HydrophobicContact CB-CE1 4.2Å; V398-F418 HydrophobicContact CB-CE2 4.1Å; V398-F418 HydrophobicContact CB-CG 4.43Å; V398-F418 HydrophobicContact CB-CZ 4.04Å; V398-F418 WeakPolarHBondContact CB-O 3.39Å; V398-F418 HydrophobicContact CG1-CE1 4.05Å; V398-F418 HydrophobicContact CG1-CZ 4.15Å; V398-F418 HydrophobicContact CG2-CD2 4.09Å; V398-F418 HydrophobicContact CG2-CE1 4.31Å; V398-F418 HydrophobicContact CG2-CE2 3.53Å; V398-F418 HydrophobicContact CG2-CZ 3.66Å; V398-F418 PolarHBondContact N-O 3.4Å; V398-F418 PolarHBondContact O-N 2.92Å; L416-F418 HydrophobicContact CB-CE1 4.11Å; L416-F418 HydrophobicContact CD1-CE1 4.3Å; F418-I420 HydrophobicContact CD2-CD1 4.34Å; F418-I420 HydrophobicContact CD2-CG1 4.08Å; F418-I420 HydrophobicContact CE2-CD1 3.82Å; F418-I420 HydrophobicContact CE2-CG1 4.08Å; F418-L439 HydrophobicContact CE1-CD1 4.29Å; F418-L439 HydrophobicContact CZ-CD1 3.88Å; F418-L439 HydrophobicContact CZ-CD2 4.46Å; F418-L443 HydrophobicContact CE2-CD2 4.12Å; F418-L443 HydrophobicContact CZ-CD2 4.29Å; F418-W584 HydrophobicContact CB-CH2 3.94Å; F418-W584 HydrophobicContact CB-CZ3 4.38Å; F418-W584 HydrophobicContact CD1-CZ3 4.31Å; F418-W584 AromaticContact CD2-CH2 3.53Å; F418-W584 HydrophobicContact CD2-CH2 3.53Å; F418-W584 AromaticContact CD2-CZ3 3.54Å; F418-W584 HydrophobicContact CD2-CZ3 3.54Å; F418-W584 HydrophobicContact CE2-CH2 4.21Å; F418-W584 AromaticContact CE2-CZ3 3.8Å; F418-W584 HydrophobicContact CE2-CZ3 3.8Å; F418-W584 AromaticContact CG-CH2 3.82Å; F418-W584 HydrophobicContact CG-CH2 3.82Å; F418-W584 AromaticContact CG-CZ3 3.82Å; F418-W584 HydrophobicContact CG-CZ3 3.82Å; F418-W584 HydrophobicContact CZ-CZ3 4.3Å; F418-I591 HydrophobicContact CE1-CD1 3.96Å; F418-I591 HydrophobicContact CZ-CD1 4.44Å
419	G	93.8	Very high	92.9	Very high	38 Å²	38	36.7 Å²	36.7	39%	0.392	21%	0.21	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	150.1	171.4	0	0	0	0	0	111.2	I396	I396-G419 CarbonylContact O-C 3.56Å; I396-G419 WeakPolarHBondContact O-CA 3.37Å
420	I	94.8	Very high	93.3	Very high	0 Å²	0	35.8 Å²	35.8	0%	0	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	126.9	171.2	-57.7	163	0	0	0	107.3	V395 I396 F418 T424 L443 M537 M567 W584	V395-I420 WeakPolarHBondContact CB-O 3.37Å; I396-I420 HydrophobicContact CB-CB 4.27Å; I396-I420 PolarHBondContact N-O 3.36Å; I396-I420 PolarHBondContact O-N 3.48Å; F418-I420 HydrophobicContact CD2-CD1 4.34Å; F418-I420 HydrophobicContact CD2-CG1 4.08Å; F418-I420 HydrophobicContact CE2-CD1 3.82Å; F418-I420 HydrophobicContact CE2-CG1 4.08Å; I420-T424 HydrophobicContact CG2-CG2 4.01Å; I420-L443 HydrophobicContact CD1-CD1 3.61Å; I420-L443 HydrophobicContact CD1-CD2 4.01Å; I420-L443 HydrophobicContact CD1-CG 4.45Å; I420-M537 HydrophobicContact CG2-SD 3.79Å; I420-M567 HydrophobicContact CD1-CG 4.4Å; I420-M567 HydrophobicContact CD1-SD 3.39Å; I420-M567 WeakPolarHBondContact CD1-SD 3.28Å; I420-M567 HydrophobicContact CG1-SD 4.33Å; I420-W584 HydrophobicContact CG1-CH2 4.37Å
421	D	94.4	Very high	93.4	Very high	40 Å²	40	33.1 Å²	33.1	21%	0.214	18%	0.184	C	C	.	.			trans	-124	175.2	-178.6	-71.3	-41.8	0	0	0	111.4	P393 P394 V395 D423 T424 M537	P393-D421 WeakPolarHBondContact CB-OD1 3.44Å; P394-D421 WeakPolarHBondContact CA-OD1 3.46Å; V395-D421 PolarHBondContact N-OD1 3.14Å; D421-D423 VanDerWaalsContact CB-OD1 3.25Å; D421-D423 WeakPolarHBondContact CB-OD1 3.25Å; D421-D423 PolarHBondContact O-N 3.36Å; D421-T424 PolarHBondContact N-OG1 3.1Å; D421-T424 WeakPolarHBondContact O-CB 3.48Å; D421-T424 PolarHBondContact O-N 3.2Å; D421-T424 PolarHBondContact O-OG1 3.29Å; D421-M537 WeakPolarHBondContact O-CE 3.26Å
422	L	92.8	Very high	93.1	Very high	25 Å²	25	34.1 Å²	34.1	13%	0.131	19%	0.187	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.6	-25.7	-176.2	-67.7	175	0	0	0	113.9	I391 V395 R425 H536 M537 G564 G565	I391-L422 HydrophobicContact CB-CD1 3.97Å; V395-L422 HydrophobicContact CG2-CG 4.1Å; L422-R425 PolarHBondContact O-NH1 3.43Å; L422-H536 HydrophobicContact CD2-CB 4Å; L422-H536 VanDerWaalsContact CD2-O 3.28Å; L422-H536 WeakPolarHBondContact CD2-O 3.25Å; L422-M537 HydrophobicContact CD2-CE 3.51Å; L422-M537 HydrophobicContact CG-CE 4.15Å; L422-G564 CarbonylContact O-C 3.46Å; L422-G565 VanDerWaalsContact O-CA 3.26Å; L422-G565 WeakPolarHBondContact O-CA 3.2Å; L422-G565 PolarHBondContact O-N 3.17Å; L422-G565 VanDerWaalsContact O-N 3.1Å
423	D	91.8	Very high	92.7	Very high	116 Å²	116	36.2 Å²	36.2	62%	0.62	22%	0.216	S	C	*	.	T	Hydrogen-bonded Turn	trans	-85.6	-8.4	174.7	60.6	-18.5	0	0	0	113	D421 R425	D421-D423 VanDerWaalsContact CB-OD1 3.25Å; D421-D423 WeakPolarHBondContact CB-OD1 3.25Å; D421-D423 PolarHBondContact O-N 3.36Å; D423-R425 PolarHBondContact O-N 3.12Å
424	T	94.4	Very high	92.4	Very high	21 Å²	21	37.3 Å²	37.3	13%	0.129	23%	0.225	C	C	.	.			trans	-64.9	124.4	179.3	-58.4	0	0	0	0	110.3	I420 D421 V426 M566	I420-T424 HydrophobicContact CG2-CG2 4.01Å; D421-T424 PolarHBondContact N-OG1 3.1Å; D421-T424 WeakPolarHBondContact O-CB 3.48Å; D421-T424 PolarHBondContact O-N 3.2Å; D421-T424 PolarHBondContact O-OG1 3.29Å; T424-V426 HydrophobicContact CG2-CB 4.26Å; T424-V426 HydrophobicContact CG2-CG2 3.39Å; T424-M566 PolarHBondContact O-N 3.3Å
425	R	95.6	Very high	92.3	Very high	28 Å²	28	34.1 Å²	34.1	11%	0.106	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	84.2	175.6	-67.2	-66.2	179	-73.7	0.1	109	L422 D423 F562 G564 M566 Q581 E582	L422-R425 PolarHBondContact O-NH1 3.43Å; D423-R425 PolarHBondContact O-N 3.12Å; R425-F562 PolarHBondContact NH2-O 3.34Å; R425-G564 PolarHBondContact NH1-O 2.91Å; R425-G564 PolarHBondContact NH2-O 2.87Å; R425-M566 HydrophobicContact CB-CE 4.4Å; R425-Q581 HydrophobicContact CB-CB 4.07Å; R425-Q581 HydrophobicContact CB-CG 3.85Å; R425-Q581 HydrophobicContact CG-CG 4.36Å; R425-Q581 PolarHBondContact O-N 3.3Å; R425-E582 PolarHBondContact O-N 3.37Å
426	V	95.8	Very high	92.3	Very high	0 Å²	0	30.6 Å²	30.6	0%	0	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111	134	-171.9	170.5	0	0	0	0	110.5	T424 M566 M567 L568 E582 W584	T424-V426 HydrophobicContact CG2-CB 4.26Å; T424-V426 HydrophobicContact CG2-CG2 3.39Å; V426-M566 PolarHBondContact N-O 3Å; V426-M566 VanDerWaalsContact N-O 3.08Å; V426-M567 HydrophobicContact CG1-CE 4.32Å; V426-M567 CarbonylContact O-C 3.59Å; V426-M567 WeakPolarHBondContact O-CA 3.34Å; V426-L568 PolarHBondContact O-N 3.48Å; V426-E582 CarbonylContact C-O 3.58Å; V426-E582 WeakPolarHBondContact CA-O 3.36Å; V426-E582 HydrophobicContact CG2-CB 4.03Å; V426-W584 HydrophobicContact CB-CD2 4.44Å; V426-W584 HydrophobicContact CG1-CB 3.8Å; V426-W584 HydrophobicContact CG1-CD2 3.46Å; V426-W584 VanDerWaalsContact CG1-CD2 3.46Å; V426-W584 HydrophobicContact CG1-CE3 3.88Å; V426-W584 HydrophobicContact CG1-CG 3.42Å; V426-W584 VanDerWaalsContact CG1-CG 3.42Å; V426-W584 HydrophobicContact CG2-CD2 4.12Å; V426-W584 HydrophobicContact CG2-CG 4.48Å; V426-W584 HydrophobicContact CG2-CH2 4.46Å; V426-W584 HydrophobicContact CG2-CZ2 3.82Å
427	A	96.3	Very high	92.1	Very high	0 Å²	0	32.7 Å²	32.7	0%	0	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100	125.6	159.7	0	0	0	0	0	110.3	L568 I576 A580 E582 I583 W584	A427-L568 CarbonylContact C-O 3.45Å; A427-L568 VanDerWaalsContact CA-O 3.24Å; A427-L568 WeakPolarHBondContact CA-O 3.36Å; A427-I576 HydrophobicContact CB-CB 4.36Å; A427-I576 HydrophobicContact CB-CG1 4.09Å; A427-I576 HydrophobicContact CB-CG2 3.53Å; A427-A580 HydrophobicContact CB-CB 3.55Å; A427-E582 PolarHBondContact N-O 3.08Å; A427-I583 HydrophobicContact CB-CD1 3.81Å; A427-W584 PolarHBondContact O-N 2.84Å
428	L	95.1	Very high	92.1	Very high	0 Å²	0	27.6 Å²	27.6	0%	0	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.7	109.4	177.4	-175.6	72.3	0	0	0	109.5	K436 L439 L568 V569 W584 C586 I591	L428-K436 HydrophobicContact CD2-CB 3.83Å; L428-K436 HydrophobicContact CD2-CG 4.02Å; L428-K436 HydrophobicContact CG-CB 4.44Å; L428-K436 HydrophobicContact CG-CG 4.14Å; L428-L439 HydrophobicContact CD1-CD2 4.19Å; L428-L439 HydrophobicContact CD2-CB 4.36Å; L428-L439 HydrophobicContact CD2-CD2 3.62Å; L428-L568 PolarHBondContact N-O 3.24Å; L428-V569 HydrophobicContact CB-CG2 4.02Å; L428-V569 HydrophobicContact CD2-CG2 4.03Å; L428-V569 HydrophobicContact CG-CG2 4.47Å; L428-W584 CarbonylContact C-O 3.6Å; L428-W584 WeakPolarHBondContact CA-O 3.28Å; L428-W584 HydrophobicContact CD1-CB 3.99Å; L428-C586 HydrophobicContact CD1-CB 3.96Å; L428-C586 HydrophobicContact CG-CB 4.32Å; L428-I591 HydrophobicContact CD1-CG2 4.24Å
429	V	93.5	Very high	92.1	Very high	2 Å²	2	26.1 Å²	26.1	1%	0.012	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	159.9	-177.1	-60	0	0	0	0	111.1	L261 I576 I583 W584 V585 C586 I598 Y601	L261-V429 HydrophobicContact CD1-CB 3.69Å; L261-V429 HydrophobicContact CD1-CG1 3.55Å; V429-I576 HydrophobicContact CG1-CD1 4.17Å; V429-I583 HydrophobicContact CB-CG2 4.42Å; V429-I583 HydrophobicContact CG1-CG2 4.1Å; V429-I583 HydrophobicContact CG2-CG2 3.44Å; V429-I583 VanDerWaalsContact CG2-CG2 3.44Å; V429-W584 WeakPolarHBondContact CG2-O 3.49Å; V429-W584 PolarHBondContact N-O 3.28Å; V429-V585 HydrophobicContact CG2-CB 4.47Å; V429-V585 HydrophobicContact CG2-CG2 4Å; V429-V585 CarbonylContact O-C 3.59Å; V429-V585 WeakPolarHBondContact O-CA 3.46Å; V429-C586 WeakPolarHBondContact O-CB 3.42Å; V429-C586 PolarHBondContact O-N 2.78Å; V429-I598 HydrophobicContact CG1-CD1 4.22Å; V429-Y601 HydrophobicContact CB-CE1 4.18Å; V429-Y601 HydrophobicContact CG2-CD1 4.33Å; V429-Y601 HydrophobicContact CG2-CE1 3.78Å; V429-Y601 HydrophobicContact CG2-CE2 4.45Å
430	G	90.5	Very high	92.2	Very high	0 Å²	0	24.3 Å²	24.3	0%	0	16%	0.157	C	C	.	.			trans	147.5	170.2	177.8	0	0	0	0	0	112.8	K436	G430-K436 PolarHBondContact O-NZ 3.26Å
431	P	87.1	Confident	92.1	Very high	47 Å²	47	27.7 Å²	27.7	31%	0.305	17%	0.172	S	C	.	.			trans	-65.1	159	-173.9	23.9	-31.2	0	0	0	112.1	D260 G433 A434	D260-P431 VanDerWaalsContact OD2-CA 3.3Å; D260-P431 WeakPolarHBondContact OD2-CA 3.35Å; P431-G433 PolarHBondContact O-N 2.76Å; P431-A434 HydrophobicContact CG-CB 4.1Å; P431-A434 WeakPolarHBondContact O-CB 3.37Å; P431-A434 PolarHBondContact O-N 2.95Å; P431-A434 VanDerWaalsContact O-N 3.15Å
432	N	83.6	Confident	92.2	Very high	53 Å²	53	26 Å²	26	28%	0.283	16%	0.162	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66.6	133.2	178.9	-82.3	-7.5	0	0	0	112	R236 H258 D260	R236-N432 PolarHBondContact NH2-ND2 2.92Å; H258-N432 PolarHBondContact O-ND2 3.44Å; D260-N432 HydrophobicContact CB-CB 4.46Å; D260-N432 PolarHBondContact OD2-N 3.35Å
433	G	83	Confident	92.3	Very high	76 Å²	76	24.9 Å²	24.9	78%	0.784	16%	0.156	S	C	*	.	T	Hydrogen-bonded Turn	trans	84	1.5	-173.6	0	0	0	0	0	115	P431 G435	P431-G433 PolarHBondContact O-N 2.76Å; G433-G435 PolarHBondContact O-N 2.9Å; G433-G435 VanDerWaalsContact O-N 3.15Å
434	A	87.7	Confident	92.3	Very high	22 Å²	22	20.8 Å²	20.8	18%	0.182	14%	0.136	C	C	.	.	S	Bend	trans	-66.7	-12.4	178.5	0	0	0	0	0	115	P431 C586	P431-A434 HydrophobicContact CG-CB 4.1Å; P431-A434 WeakPolarHBondContact O-CB 3.37Å; P431-A434 PolarHBondContact O-N 2.95Å; P431-A434 VanDerWaalsContact O-N 3.15Å; A434-C586 HydrophobicContact CB-CB 4.44Å; A434-C586 WeakPolarHBondContact CB-O 3.37Å; A434-C586 PolarHBondContact O-SG 2.75Å
435	G	91	Very high	92.2	Very high	5 Å²	5	21.6 Å²	21.6	5%	0.052	15%	0.148	C	C	.	.	S	Bend	trans	111.9	5	178.5	0	0	0	0	0	115.5	Y413 G433 S437 T438 L439	Y413-G435 WeakPolarHBondContact OH-CA 3.4Å; Y413-G435 PolarHBondContact OH-O 2.86Å; G433-G435 PolarHBondContact O-N 2.9Å; G433-G435 VanDerWaalsContact O-N 3.15Å; G435-S437 PolarHBondContact O-N 2.7Å; G435-T438 CarbonylContact O-C 3.59Å; G435-T438 VanDerWaalsContact O-CA 3.27Å; G435-T438 WeakPolarHBondContact O-CA 3.32Å; G435-T438 WeakPolarHBondContact O-CB 3.37Å; G435-T438 PolarHBondContact O-N 3.12Å; G435-L439 PolarHBondContact O-N 3.2Å
436	K	92.9	Very high	92.1	Very high	13 Å²	13	26 Å²	26	6%	0.057	17%	0.17	C	C	.	.	H	α-helix	trans	-49	-56.8	-176.8	-59.7	176.9	-62.8	-170.1	0	113.7	L428 G430 T438 L439 L440 V569 H571 C586	L428-K436 HydrophobicContact CD2-CB 3.83Å; L428-K436 HydrophobicContact CD2-CG 4.02Å; L428-K436 HydrophobicContact CG-CB 4.44Å; L428-K436 HydrophobicContact CG-CG 4.14Å; G430-K436 PolarHBondContact O-NZ 3.26Å; K436-T438 VanDerWaalsContact C-N 3.25Å; K436-T438 PolarHBondContact O-N 3.39Å; K436-L439 WeakPolarHBondContact O-CB 3.37Å; K436-L439 PolarHBondContact O-N 3.46Å; K436-L440 PolarHBondContact O-N 2.91Å; K436-V569 HydrophobicContact CB-CG1 4.11Å; K436-V569 HydrophobicContact CB-CG2 4.16Å; K436-V569 HydrophobicContact CD-CG1 3.99Å; K436-H571 PolarHBondContact NZ-CE1 3.27Å; K436-C586 HydrophobicContact CG-CB 4Å
437	S	92	Very high	92	Very high	47 Å²	47	27.8 Å²	27.8	33%	0.329	18%	0.18	S	C	.	.	H	α-helix	trans	-65.9	-28.6	175.8	-49.4	0	0	0	0	112.8	G435 L440 K441 D541	G435-S437 PolarHBondContact O-N 2.7Å; S437-L440 PolarHBondContact O-N 3.44Å; S437-K441 VanDerWaalsContact O-CG 3.29Å; S437-K441 WeakPolarHBondContact O-CG 3.44Å; S437-K441 PolarHBondContact O-N 3.22Å; S437-K441 VanDerWaalsContact O-N 3.07Å; S437-D541 WeakPolarHBondContact CB-OD2 3.34Å; S437-D541 PolarHBondContact OG-OD1 2.86Å; S437-D541 PolarHBondContact OG-OD2 3.19Å
438	T	93.1	Very high	91.9	Very high	12 Å²	12	34.7 Å²	34.7	7%	0.074	22%	0.216	C	C	.	.	H	α-helix	trans	-66.2	-40.2	174.3	-49.8	0	0	0	0	111	F403 Y405 I412 G435 K436 K441 L442 L447	F403-T438 HydrophobicContact CD1-CG2 3.53Å; F403-T438 HydrophobicContact CE1-CG2 3.4Å; F403-T438 VanDerWaalsContact CE1-CG2 3.4Å; F403-T438 HydrophobicContact CZ-CG2 4.38Å; Y405-T438 HydrophobicContact CE2-CG2 4.01Å; Y405-T438 WeakPolarHBondContact OH-CG2 3.29Å; Y405-T438 PolarHBondContact OH-OG1 3.44Å; I412-T438 HydrophobicContact CG2-CG2 4.46Å; G435-T438 CarbonylContact O-C 3.59Å; G435-T438 VanDerWaalsContact O-CA 3.27Å; G435-T438 WeakPolarHBondContact O-CA 3.32Å; G435-T438 WeakPolarHBondContact O-CB 3.37Å; G435-T438 PolarHBondContact O-N 3.12Å; K436-T438 VanDerWaalsContact C-N 3.25Å; K436-T438 PolarHBondContact O-N 3.39Å; T438-K441 WeakPolarHBondContact O-CB 3.5Å; T438-K441 PolarHBondContact O-N 2.92Å; T438-L442 HydrophobicContact CG2-CD1 4.39Å; T438-L442 WeakPolarHBondContact O-CG 3.49Å; T438-L442 PolarHBondContact O-N 3.37Å; T438-L447 HydrophobicContact CG2-CD1 3.96Å
439	L	94.8	Very high	91.9	Very high	3 Å²	3	36.3 Å²	36.3	2%	0.016	23%	0.226	C	C	.	.	H	α-helix	trans	-59.3	-48.5	174	-171.4	69.2	0	0	0	111.1	Y413 L416 F418 L428 G435 K436 K441 L442 L443 M567 I591	Y413-L439 HydrophobicContact CE2-CB 4.11Å; Y413-L439 HydrophobicContact CE2-CD1 4.24Å; L416-L439 HydrophobicContact CD1-CD1 3.91Å; F418-L439 HydrophobicContact CE1-CD1 4.29Å; F418-L439 HydrophobicContact CZ-CD1 3.88Å; F418-L439 HydrophobicContact CZ-CD2 4.46Å; L428-L439 HydrophobicContact CD1-CD2 4.19Å; L428-L439 HydrophobicContact CD2-CB 4.36Å; L428-L439 HydrophobicContact CD2-CD2 3.62Å; G435-L439 PolarHBondContact O-N 3.2Å; K436-L439 WeakPolarHBondContact O-CB 3.37Å; K436-L439 PolarHBondContact O-N 3.46Å; L439-K441 VanDerWaalsContact C-N 3.26Å; L439-K441 PolarHBondContact O-N 2.76Å; L439-L442 WeakPolarHBondContact O-CB 3.44Å; L439-L442 PolarHBondContact O-N 2.88Å; L439-L442 VanDerWaalsContact O-N 3.09Å; L439-L443 HydrophobicContact CD2-CD1 4.5Å; L439-L443 HydrophobicContact CG-CD1 4.11Å; L439-L443 HydrophobicContact CG-CG 4.44Å; L439-L443 WeakPolarHBondContact O-CG 3.4Å; L439-L443 PolarHBondContact O-N 2.91Å; L439-M567 HydrophobicContact CD2-CE 3.97Å; L439-I591 HydrophobicContact CD1-CD1 3.51Å; L439-I591 HydrophobicContact CD2-CD1 3.32Å; L439-I591 HydrophobicContact CG-CD1 3.97Å
440	L	95.2	Very high	91.9	Very high	0 Å²	0	39.9 Å²	39.9	0%	0	25%	0.248	C	C	.	.	H	α-helix	trans	-60.9	-37.6	178.2	-60.1	-176.8	0	0	0	111.6	K436 S437 L443 T444 F539 D541 M567 V569	K436-L440 PolarHBondContact O-N 2.91Å; S437-L440 PolarHBondContact O-N 3.44Å; L440-L443 PolarHBondContact O-N 3.06Å; L440-T444 WeakPolarHBondContact O-CB 3.38Å; L440-T444 VanDerWaalsContact O-CG2 3.26Å; L440-T444 WeakPolarHBondContact O-CG2 3.49Å; L440-T444 PolarHBondContact O-N 2.99Å; L440-T444 PolarHBondContact O-OG1 2.84Å; L440-F539 HydrophobicContact CD2-CB 4.07Å; L440-F539 HydrophobicContact CD2-CD1 4.46Å; L440-F539 HydrophobicContact CD2-CD2 4.23Å; L440-F539 HydrophobicContact CD2-CG 4.01Å; L440-D541 HydrophobicContact CD1-CB 3.74Å; L440-M567 HydrophobicContact CD2-CB 4.29Å; L440-M567 HydrophobicContact CD2-SD 4.36Å; L440-V569 HydrophobicContact CD1-CG2 3.94Å
441	K	94.5	Very high	92	Very high	72 Å²	72	45 Å²	45	31%	0.313	28%	0.276	S	S	.	.	H	α-helix	trans	-64.6	-39.2	173.5	-72.7	178.5	178.8	-175.2	0	112.9	S437 T438 L439 T444 G445 E446 L447 R464	S437-K441 VanDerWaalsContact O-CG 3.29Å; S437-K441 WeakPolarHBondContact O-CG 3.44Å; S437-K441 PolarHBondContact O-N 3.22Å; S437-K441 VanDerWaalsContact O-N 3.07Å; T438-K441 WeakPolarHBondContact O-CB 3.5Å; T438-K441 PolarHBondContact O-N 2.92Å; L439-K441 VanDerWaalsContact C-N 3.26Å; L439-K441 PolarHBondContact O-N 2.76Å; K441-T444 WeakPolarHBondContact CA-OG1 3.3Å; K441-T444 PolarHBondContact O-OG1 3.11Å; K441-T444 VanDerWaalsContact O-OG1 3.06Å; K441-G445 PolarHBondContact O-N 2.93Å; K441-E446 HydrophobicContact CB-CB 4.28Å; K441-E446 WeakPolarHBondContact CG-OE2 3.42Å; K441-E446 PolarHBondContact O-N 2.76Å; K441-L447 HydrophobicContact CB-CB 4.32Å; K441-L447 HydrophobicContact CB-CD1 3.59Å; K441-L447 HydrophobicContact CB-CG 3.83Å; K441-L447 HydrophobicContact CD-CD1 3.89Å; K441-L447 HydrophobicContact CD-CG 4.4Å; K441-L447 HydrophobicContact CG-CD1 4.35Å; K441-L447 PolarHBondContact O-N 2.89Å; K441-R464 VanDerWaalsContact CG-NH1 3.31Å
442	L	95	Very high	92.4	Very high	4 Å²	4	44.3 Å²	44.3	2%	0.021	28%	0.276	C	S	.	.	H	α-helix	trans	-65.9	-46	175.3	-73	166.8	0	0	0	111.2	F403 Y413 T438 L439 G445 L447 I454	F403-L442 HydrophobicContact CB-CD1 3.89Å; F403-L442 HydrophobicContact CB-CD2 4.41Å; F403-L442 HydrophobicContact CD1-CD1 4.35Å; F403-L442 HydrophobicContact CD2-CD1 4.5Å; F403-L442 HydrophobicContact CD2-CD2 3.7Å; F403-L442 HydrophobicContact CE2-CD2 4.16Å; F403-L442 HydrophobicContact CG-CD1 3.98Å; F403-L442 HydrophobicContact CG-CD2 4.03Å; F403-L442 HydrophobicContact CG-CG 4.47Å; Y413-L442 HydrophobicContact CD2-CD1 4.14Å; T438-L442 HydrophobicContact CG2-CD1 4.39Å; T438-L442 WeakPolarHBondContact O-CG 3.49Å; T438-L442 PolarHBondContact O-N 3.37Å; L439-L442 WeakPolarHBondContact O-CB 3.44Å; L439-L442 PolarHBondContact O-N 2.88Å; L439-L442 VanDerWaalsContact O-N 3.09Å; L442-G445 PolarHBondContact O-N 3.12Å; L442-G445 VanDerWaalsContact O-N 3.16Å; L442-L447 HydrophobicContact CD2-CB 3.81Å; L442-L447 HydrophobicContact CG-CB 4.25Å; L442-I454 HydrophobicContact CB-CD1 3.88Å; L442-I454 WeakPolarHBondContact O-CD1 3.48Å
443	L	94.8	Very high	92.9	Very high	1 Å²	1	46.3 Å²	46.3	1%	0.005	29%	0.285	C	S	.	.	H	α-helix	trans	-65.7	-41	179.8	-64.8	173.4	0	0	0	112	I396 V398 F418 I420 L439 L440 G445 K456 F539 M567	I396-L443 HydrophobicContact CG2-CD2 3.97Å; V398-L443 HydrophobicContact CG2-CD2 3.6Å; F418-L443 HydrophobicContact CE2-CD2 4.12Å; F418-L443 HydrophobicContact CZ-CD2 4.29Å; I420-L443 HydrophobicContact CD1-CD1 3.61Å; I420-L443 HydrophobicContact CD1-CD2 4.01Å; I420-L443 HydrophobicContact CD1-CG 4.45Å; L439-L443 HydrophobicContact CD2-CD1 4.5Å; L439-L443 HydrophobicContact CG-CD1 4.11Å; L439-L443 HydrophobicContact CG-CG 4.44Å; L439-L443 WeakPolarHBondContact O-CG 3.4Å; L439-L443 PolarHBondContact O-N 2.91Å; L440-L443 PolarHBondContact O-N 3.06Å; L443-G445 VanDerWaalsContact C-N 3.25Å; L443-G445 PolarHBondContact O-N 2.91Å; L443-K456 WeakPolarHBondContact O-CD 3.4Å; L443-K456 PolarHBondContact O-NZ 2.95Å; L443-F539 HydrophobicContact CB-CE2 3.57Å; L443-F539 HydrophobicContact CB-CZ 4.02Å; L443-F539 HydrophobicContact CD1-CE2 4.16Å; L443-F539 HydrophobicContact CD1-CZ 3.99Å; L443-M567 HydrophobicContact CD1-CE 4.4Å; L443-M567 HydrophobicContact CD1-SD 3.49Å; L443-M567 WeakPolarHBondContact CD1-SD 3.32Å
444	T	93.3	Very high	93.6	Very high	30 Å²	30	44.1 Å²	44.1	18%	0.184	26%	0.255	C	S	.	.	H	α-helix	trans	-69	-24.2	174.6	52.2	0	0	0	0	112.7	L440 K441 K456 I462 R464 F539	L440-T444 WeakPolarHBondContact O-CB 3.38Å; L440-T444 VanDerWaalsContact O-CG2 3.26Å; L440-T444 WeakPolarHBondContact O-CG2 3.49Å; L440-T444 PolarHBondContact O-N 2.99Å; L440-T444 PolarHBondContact O-OG1 2.84Å; K441-T444 WeakPolarHBondContact CA-OG1 3.3Å; K441-T444 PolarHBondContact O-OG1 3.11Å; K441-T444 VanDerWaalsContact O-OG1 3.06Å; T444-K456 PolarHBondContact O-NZ 3.42Å; T444-I462 HydrophobicContact CG2-CG2 3.93Å; T444-R464 HydrophobicContact CG2-CB 4.3Å; T444-F539 HydrophobicContact CG2-CD2 3.8Å; T444-F539 HydrophobicContact CG2-CE2 4.17Å
445	G	92.1	Very high	93.9	Very high	38 Å²	38	49.6 Å²	49.6	39%	0.392	27%	0.271	S	S	.	.	T	Hydrogen-bonded Turn	trans	90	11.6	-179.7	0	0	0	0	0	114	K441 L442 L443	K441-G445 PolarHBondContact O-N 2.93Å; L442-G445 PolarHBondContact O-N 3.12Å; L442-G445 VanDerWaalsContact O-N 3.16Å; L443-G445 VanDerWaalsContact C-N 3.25Å; L443-G445 PolarHBondContact O-N 2.91Å
446	E	92.1	Very high	94.1	Very high	120 Å²	120	53.6 Å²	53.6	56%	0.561	29%	0.287	S	S	*	.	S	Bend	trans	-65.9	-30.4	169.5	-71.4	173.3	-149.2	0	0	111.7	K441 R464	K441-E446 HydrophobicContact CB-CB 4.28Å; K441-E446 WeakPolarHBondContact CG-OE2 3.42Å; K441-E446 PolarHBondContact O-N 2.76Å; E446-R464 IonicContact OE1-CZ 3.38Å; E446-R464 IonicContact OE1-NH1 3.48Å; E446-R464 PolarHBondContact OE1-NH1 2.85Å; E446-R464 IonicContact OE2-CZ 2.92Å; E446-R464 IonicContact OE2-NH1 2.73Å; E446-R464 PolarHBondContact OE2-NH1 3.38Å
447	L	94.1	Very high	94.1	Very high	39 Å²	39	55.5 Å²	55.5	20%	0.204	30%	0.296	C	S	.	.	S	Bend	trans	-115.7	140.2	172.6	-66.2	174.8	0	0	0	109.5	F403 Y405 T438 K441 L442	F403-L447 HydrophobicContact CE1-CD1 4.14Å; F403-L447 HydrophobicContact CE2-CB 4.18Å; F403-L447 HydrophobicContact CE2-CD1 4.45Å; F403-L447 HydrophobicContact CZ-CB 4.31Å; F403-L447 HydrophobicContact CZ-CD1 3.76Å; F403-L447 HydrophobicContact CZ-CD2 4.3Å; F403-L447 HydrophobicContact CZ-CG 4.35Å; Y405-L447 HydrophobicContact CE1-CD1 4.03Å; T438-L447 HydrophobicContact CG2-CD1 3.96Å; K441-L447 HydrophobicContact CB-CB 4.32Å; K441-L447 HydrophobicContact CB-CD1 3.59Å; K441-L447 HydrophobicContact CB-CG 3.83Å; K441-L447 HydrophobicContact CD-CD1 3.89Å; K441-L447 HydrophobicContact CD-CG 4.4Å; K441-L447 HydrophobicContact CG-CD1 4.35Å; K441-L447 PolarHBondContact O-N 2.89Å; L442-L447 HydrophobicContact CD2-CB 3.81Å; L442-L447 HydrophobicContact CG-CB 4.25Å
448	L	94.1	Very high	94.1	Very high	144 Å²	144	58 Å²	58	75%	0.754	31%	0.314	S	S	*	.			trans	-91.8	137.2	172.1	-66.7	172.6	0	0	0	109.4	F403	F403-L448 WeakPolarHBondContact CD2-O 3.35Å; F403-L448 WeakPolarHBondContact CE2-O 2.98Å
449	P	94.7	Very high	94	Very high	35 Å²	35	64.1 Å²	64.1	23%	0.227	34%	0.341	C	S	.	.			trans	-61.8	148.5	173.7	29.8	-35.9	0	0	0	110.3	V401 D451	V401-P449 HydrophobicContact CG1-CB 3.74Å; V401-P449 HydrophobicContact CG2-CB 4.32Å; P449-D451 WeakPolarHBondContact CB-O 3.35Å
450	T	93.8	Very high	94	Very high	76 Å²	76	65.1 Å²	65.1	47%	0.466	35%	0.348	S	S	.	.	S	Bend	trans	-75.5	-36.6	174.5	-54.9	0	0	0	0	111	S402 K404	S402-T450 WeakPolarHBondContact O-CA 3.42Å; S402-T450 WeakPolarHBondContact O-CB 3.4Å; S402-T450 PolarHBondContact O-N 3.3Å; K404-T450 HydrophobicContact CD-CG2 4.47Å; K404-T450 HydrophobicContact CG-CG2 4.11Å; K404-T450 PolarHBondContact N-OG1 3.36Å; K404-T450 VanDerWaalsContact N-OG1 3.15Å
451	D	94	Very high	93.9	Very high	109 Å²	109	70.6 Å²	70.6	58%	0.583	37%	0.372	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-143.2	158.7	173.8	-167.6	18.7	0	0	0	109.4	V401 S402 P449	V401-D451 CarbonylContact C-O 3.44Å; V401-D451 VanDerWaalsContact CA-O 3.29Å; V401-D451 WeakPolarHBondContact CA-O 3.39Å; S402-D451 PolarHBondContact N-O 3.24Å; S402-D451 PolarHBondContact O-N 2.98Å; S402-D451 VanDerWaalsContact O-N 3.15Å; P449-D451 WeakPolarHBondContact CB-O 3.35Å
452	G	94.6	Very high	93.9	Very high	31 Å²	31	69 Å²	69	32%	0.32	37%	0.366	S	S	.	.	E	Extended strand (participates in β ladder)	trans	80.2	-171.9	-175.5	0	0	0	0	0	114.3	Q399 N400	Q399-G452 WeakPolarHBondContact O-CA 3.44Å; N400-G452 VanDerWaalsContact O-CA 3.29Å; N400-G452 WeakPolarHBondContact O-CA 3.48Å
453	M	95	Very high	93.8	Very high	95 Å²	95	68.8 Å²	68.8	47%	0.468	37%	0.365	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140	138	-173.1	-169.6	-177.5	-178	0	0	111.9	Q399 R455	Q399-M453 PolarHBondContact N-O 3.46Å; Q399-M453 PolarHBondContact O-N 2.99Å; M453-R455 HydrophobicContact CE-CG 3.58Å; M453-R455 HydrophobicContact CG-CG 4.14Å; M453-R455 HydrophobicContact SD-CG 3.81Å; M453-R455 PolarHBondContact SD-NE 2.82Å
454	I	96.2	Very high	93.8	Very high	30 Å²	30	70 Å²	70	15%	0.154	37%	0.369	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	113.8	168.6	-57.3	177.5	0	0	0	107.9	I396 M397 V398 V401 L442 K456	I396-I454 HydrophobicContact CG2-CG2 3.93Å; M397-I454 CarbonylContact O-C 3.52Å; M397-I454 WeakPolarHBondContact O-CA 3.48Å; V398-I454 HydrophobicContact CG1-CG1 4.47Å; V398-I454 HydrophobicContact CG2-CG1 4.34Å; V398-I454 HydrophobicContact CG2-CG2 4.41Å; V401-I454 HydrophobicContact CG2-CG1 3.78Å; L442-I454 HydrophobicContact CB-CD1 3.88Å; L442-I454 WeakPolarHBondContact O-CD1 3.48Å; I454-K456 HydrophobicContact CG2-CG 4.39Å
455	R	94.9	Very high	93.7	Very high	138 Å²	138	68.8 Å²	68.8	52%	0.521	36%	0.361	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.1	127.5	175.7	-70.5	179.8	180	-176.5	1.9	109.5	I396 M397 M453	I396-R455 CarbonylContact C-O 3.6Å; I396-R455 WeakPolarHBondContact CA-O 3.34Å; M397-R455 HydrophobicContact CB-CB 4.39Å; M397-R455 PolarHBondContact N-O 2.89Å; M397-R455 PolarHBondContact O-N 2.8Å; M453-R455 HydrophobicContact CE-CG 3.58Å; M453-R455 HydrophobicContact CG-CG 4.14Å; M453-R455 HydrophobicContact SD-CG 3.81Å; M453-R455 PolarHBondContact SD-NE 2.82Å
456	K	94.7	Very high	93.5	Very high	88 Å²	88	68.4 Å²	68.4	38%	0.383	35%	0.349	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	140.3	176.4	-67.4	-176.1	-83.1	-166	0	109.3	I396 L443 T444 I454 V460 I462	I396-K456 HydrophobicContact CG1-CG 4.27Å; I396-K456 HydrophobicContact CG2-CG 4.25Å; L443-K456 WeakPolarHBondContact O-CD 3.4Å; L443-K456 PolarHBondContact O-NZ 2.95Å; T444-K456 PolarHBondContact O-NZ 3.42Å; I454-K456 HydrophobicContact CG2-CG 4.39Å; K456-V460 HydrophobicContact CB-CG1 4.1Å; K456-I462 HydrophobicContact CD-CD1 4.01Å
457	H	93.9	Very high	92.8	Very high	53 Å²	53	66.5 Å²	66.5	25%	0.245	34%	0.341	C	S	.	.			trans	-60.4	137.6	170.9	-172.4	-85.6	0	0	0	110.4	I391 V395 H459 V460	I391-H457 HydrophobicContact CG2-CB 3.96Å; I391-H457 VanDerWaalsContact CG2-CG 3.47Å; I391-H457 WeakPolarHBondContact CG2-ND1 3.32Å; V395-H457 PolarHBondContact O-N 2.92Å; H457-H459 AromaticContact CE1-CD2 3.85Å; H457-H459 PolarHBondContact ND1-N 2.8Å; H457-H459 PolarHBondContact O-N 3.24Å; H457-H459 VanDerWaalsContact O-N 3.12Å; H457-V460 HydrophobicContact CB-CB 4.41Å; H457-V460 WeakPolarHBondContact O-CG1 3.27Å; H457-V460 PolarHBondContact O-N 2.79Å; H457-V460 VanDerWaalsContact O-N 3.07Å
458	S	91	Very high	92	Very high	101 Å²	101	69.7 Å²	69.7	71%	0.706	35%	0.354	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.7	-30.3	-171.6	53.6	0	0	0	0	114.6
459	H	91.4	Very high	91.1	Very high	139 Å²	139	63 Å²	63	64%	0.644	32%	0.319	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99.8	4.3	-178.7	-61.5	-68	0	0	0	114.3	H457 K461 H536	H457-H459 AromaticContact CE1-CD2 3.85Å; H457-H459 PolarHBondContact ND1-N 2.8Å; H457-H459 PolarHBondContact O-N 3.24Å; H457-H459 VanDerWaalsContact O-N 3.12Å; H459-K461 PolarHBondContact O-N 3.32Å; H459-H536 PolarHBondContact O-CE1 2.91Å
460	V	93.7	Very high	89.9	Confident	25 Å²	25	62.3 Å²	62.3	15%	0.152	31%	0.313	C	S	.	.			trans	-66.5	134.3	179.2	75.4	0	0	0	0	110.4	I391 V395 K456 H457 I462 H536 M537	I391-V460 HydrophobicContact CD1-CB 4.16Å; I391-V460 HydrophobicContact CD1-CG2 4.29Å; V395-V460 HydrophobicContact CG1-CB 3.99Å; V395-V460 HydrophobicContact CG1-CG2 3.41Å; V395-V460 VanDerWaalsContact CG1-CG2 3.41Å; K456-V460 HydrophobicContact CB-CG1 4.1Å; H457-V460 HydrophobicContact CB-CB 4.41Å; H457-V460 WeakPolarHBondContact O-CG1 3.27Å; H457-V460 PolarHBondContact O-N 2.79Å; H457-V460 VanDerWaalsContact O-N 3.07Å; V460-I462 HydrophobicContact CG1-CG1 4.37Å; V460-I462 HydrophobicContact CG2-CG1 4.26Å; V460-H536 HydrophobicContact CG2-CB 4.17Å; V460-M537 HydrophobicContact CG2-CG 3.91Å
461	K	93.6	Very high	88.9	Confident	115 Å²	115	65.6 Å²	65.6	50%	0.5	32%	0.323	S	S	.	.			trans	-110.5	125.8	169.6	-64.8	-179.6	177.1	-179.6	0	107.7	H459 H536 M537	H459-K461 PolarHBondContact O-N 3.32Å; K461-H536 WeakPolarHBondContact CB-ND1 3.31Å; K461-H536 PolarHBondContact N-ND1 2.78Å; K461-H536 VanDerWaalsContact N-ND1 3.1Å; K461-H536 WeakPolarHBondContact O-CA 3.21Å; K461-H536 PolarHBondContact O-N 3.29Å; K461-M537 PolarHBondContact O-N 2.87Å
462	I	94.7	Very high	88.2	Confident	38 Å²	38	66.4 Å²	66.4	20%	0.195	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	117.1	-179.6	-53.5	176.8	0	0	0	107.4	I396 T444 K456 V460 M537 F539	I396-I462 HydrophobicContact CD1-CD1 3.86Å; T444-I462 HydrophobicContact CG2-CG2 3.93Å; K456-I462 HydrophobicContact CD-CD1 4.01Å; V460-I462 HydrophobicContact CG1-CG1 4.37Å; V460-I462 HydrophobicContact CG2-CG1 4.26Å; I462-M537 CarbonylContact C-O 3.52Å; I462-M537 WeakPolarHBondContact CA-O 3.19Å; I462-M537 HydrophobicContact CB-CB 4.37Å; I462-M537 HydrophobicContact CG1-CB 4.08Å; I462-M537 HydrophobicContact CG2-CB 4.15Å; I462-F539 HydrophobicContact CD1-CE2 4.38Å; I462-F539 HydrophobicContact CG2-CD2 3.54Å; I462-F539 HydrophobicContact CG2-CE2 3.59Å; I462-F539 HydrophobicContact CG2-CG 4.18Å; I462-F539 HydrophobicContact CG2-CZ 4.27Å
463	G	93.7	Very high	87.6	Confident	0 Å²	0	65.1 Å²	65.1	0%	0	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.6	124	169.8	0	0	0	0	0	108.8	L530 P535 M537 L538 F539	G463-L530 VanDerWaalsContact CA-CD1 3.48Å; G463-P535 VanDerWaalsContact N-CB 3.31Å; G463-M537 PolarHBondContact N-O 3.44Å; G463-L538 WeakPolarHBondContact O-CA 3.44Å; G463-F539 PolarHBondContact O-N 3.4Å
464	R	93.3	Very high	87.3	Confident	26 Å²	26	63 Å²	63	10%	0.098	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	121.1	178.6	-177.1	-175.5	176.2	-172.5	0.8	110.9	K441 T444 E446 F539	K441-R464 VanDerWaalsContact CG-NH1 3.31Å; T444-R464 HydrophobicContact CG2-CB 4.3Å; E446-R464 IonicContact OE1-CZ 3.38Å; E446-R464 IonicContact OE1-NH1 3.48Å; E446-R464 PolarHBondContact OE1-NH1 2.85Å; E446-R464 IonicContact OE2-CZ 2.92Å; E446-R464 IonicContact OE2-NH1 2.73Å; E446-R464 PolarHBondContact OE2-NH1 3.38Å; R464-F539 CarbonylContact C-O 3.59Å; R464-F539 VanDerWaalsContact CA-O 3.3Å; R464-F539 WeakPolarHBondContact CA-O 3.28Å; R464-F539 HydrophobicContact CB-CB 4.46Å; R464-F539 HydrophobicContact CG-CB 4.31Å
465	Y	92.3	Very high	86.8	Confident	4 Å²	4	65.3 Å²	65.3	2%	0.016	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.8	131.1	162.1	-170.6	-86.7	0	0	0	108.8	L469 Q470 C523 C526 L527 F539 L540 D541 P543	Y465-L469 HydrophobicContact CD2-CD2 3.99Å; Y465-L469 HydrophobicContact CE2-CD2 4.33Å; Y465-Q470 PolarHBondContact OH-NE2 3.1Å; Y465-C523 PolarHBondContact OH-SG 3.1Å; Y465-C526 HydrophobicContact CD2-CB 4.34Å; Y465-C526 HydrophobicContact CE2-CB 3.77Å; Y465-L527 HydrophobicContact CD2-CD2 4.16Å; Y465-L527 HydrophobicContact CE2-CD2 4.37Å; Y465-F539 PolarHBondContact N-O 3.07Å; Y465-L540 VanDerWaalsContact CB-CD2 3.48Å; Y465-L540 HydrophobicContact CG-CD2 4.35Å; Y465-D541 WeakPolarHBondContact O-CB 3.14Å; Y465-D541 PolarHBondContact O-N 3.46Å; Y465-P543 HydrophobicContact CD1-CB 4.03Å; Y465-P543 HydrophobicContact CE1-CB 4.15Å
466	H	87.1	Confident	86.6	Confident	30 Å²	30	64.7 Å²	64.7	14%	0.139	32%	0.319	C	S	.	.			trans	-138.5	155.3	176.5	69.8	-73	0	0	0	110.7	H468 L469 Q472	H466-H468 VanDerWaalsContact C-N 3.28Å; H466-H468 PolarHBondContact O-N 3.44Å; H466-L469 PolarHBondContact NE2-N 2.89Å; H466-L469 WeakPolarHBondContact O-CB 3.47Å; H466-L469 PolarHBondContact O-N 3.34Å; H466-Q472 PolarHBondContact NE2-NE2 3.31Å
467	Q	78.4	Confident	86.5	Confident	81 Å²	81	62.4 Å²	62.4	38%	0.379	31%	0.31	S	S	.	.	G	3₁₀ helix	trans	-56.1	-39.1	-173.1	-165.8	172.6	16.7	0	0	113.5	L469 N545	Q467-L469 VanDerWaalsContact C-N 3.28Å; Q467-L469 PolarHBondContact O-N 3.21Å; Q467-N545 PolarHBondContact NE2-ND2 3.04Å
468	H	76	Confident	86.4	Confident	105 Å²	105	60 Å²	60	49%	0.486	30%	0.3	S	S	.	.	G	3₁₀ helix	trans	-79.9	0.5	178.5	-59.5	-69.7	0	0	0	114.7	H466 Q470 E471 Q472	H466-H468 VanDerWaalsContact C-N 3.28Å; H466-H468 PolarHBondContact O-N 3.44Å; H468-Q470 PolarHBondContact O-N 2.81Å; H468-E471 IonicContact CE1-OE2 2.76Å; H468-E471 IonicContact CG-OE2 2.75Å; H468-E471 IonicContact ND1-OE1 4Å; H468-E471 IonicContact ND1-OE2 3.59Å; H468-E471 PolarHBondContact ND1-OE2 2.91Å; H468-E471 WeakPolarHBondContact O-CB 3.26Å; H468-E471 PolarHBondContact O-N 3.14Å; H468-Q472 PolarHBondContact O-N 3.37Å
469	L	74.9	Confident	86.5	Confident	4 Å²	4	55.2 Å²	55.2	2%	0.021	27%	0.266	C	S	.	.	G	3₁₀ helix	trans	-61.4	-33.1	-178.3	-172.5	61.9	0	0	0	111.7	Y465 H466 Q467 E471 Q472 L473 C526 W529	Y465-L469 HydrophobicContact CD2-CD2 3.99Å; Y465-L469 HydrophobicContact CE2-CD2 4.33Å; H466-L469 PolarHBondContact NE2-N 2.89Å; H466-L469 WeakPolarHBondContact O-CB 3.47Å; H466-L469 PolarHBondContact O-N 3.34Å; Q467-L469 VanDerWaalsContact C-N 3.28Å; Q467-L469 PolarHBondContact O-N 3.21Å; L469-E471 VanDerWaalsContact C-N 3.28Å; L469-E471 PolarHBondContact O-N 3.03Å; L469-Q472 PolarHBondContact O-N 2.98Å; L469-L473 PolarHBondContact O-N 3.32Å; L469-C526 HydrophobicContact CD2-CB 3.74Å; L469-C526 HydrophobicContact CG-CB 4.23Å; L469-W529 HydrophobicContact CD1-CE3 4.45Å; L469-W529 HydrophobicContact CD1-CH2 4.06Å; L469-W529 HydrophobicContact CD1-CZ3 3.78Å; L469-W529 HydrophobicContact CD2-CE3 4.08Å; L469-W529 HydrophobicContact CD2-CZ3 3.77Å; L469-W529 HydrophobicContact CG-CZ3 4.39Å
470	Q	70.4	Confident	86.5	Confident	20 Å²	20	49.1 Å²	49.1	9%	0.093	24%	0.239	C	C	.	.	G	3₁₀ helix	trans	-66.4	-31.3	177.5	-60.5	-177.4	7	0	0	112.5	Y465 H468 Q472 L473 K522	Y465-Q470 PolarHBondContact OH-NE2 3.1Å; H468-Q470 PolarHBondContact O-N 2.81Å; Q470-Q472 VanDerWaalsContact C-N 3.33Å; Q470-L473 WeakPolarHBondContact O-CB 3.35Å; Q470-L473 PolarHBondContact O-N 2.87Å; Q470-K522 HydrophobicContact CB-CB 4.46Å; Q470-K522 HydrophobicContact CG-CB 4.32Å
471	E	73.3	Confident	86.5	Confident	145 Å²	145	52.9 Å²	52.9	68%	0.678	25%	0.254	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.7	-23.1	178.1	-61.5	172.2	171.8	0	0	111.8	H468 L469 L473	H468-E471 IonicContact CE1-OE2 2.76Å; H468-E471 IonicContact CG-OE2 2.75Å; H468-E471 IonicContact ND1-OE1 4Å; H468-E471 IonicContact ND1-OE2 3.59Å; H468-E471 PolarHBondContact ND1-OE2 2.91Å; H468-E471 WeakPolarHBondContact O-CB 3.26Å; H468-E471 PolarHBondContact O-N 3.14Å; L469-E471 VanDerWaalsContact C-N 3.28Å; L469-E471 PolarHBondContact O-N 3.03Å; E471-L473 VanDerWaalsContact C-N 3.29Å
472	Q	78.5	Confident	86.5	Confident	126 Å²	126	48.5 Å²	48.5	59%	0.589	24%	0.235	S	C	*	.	T	Hydrogen-bonded Turn	trans	-80.6	-10.4	174.5	-65.3	-179.4	0.7	0	0	113.1	H466 H468 L469 Q470 D474	H466-Q472 PolarHBondContact NE2-NE2 3.31Å; H468-Q472 PolarHBondContact O-N 3.37Å; L469-Q472 PolarHBondContact O-N 2.98Å; Q470-Q472 VanDerWaalsContact C-N 3.33Å; Q472-D474 PolarHBondContact O-N 2.98Å
473	L	83.2	Confident	86.3	Confident	5 Å²	5	46.7 Å²	46.7	3%	0.026	23%	0.226	C	C	.	.	S	Bend	trans	-64	135.1	173.2	-64.4	177.7	0	0	0	109.7	L469 Q470 E471 L475 Y482 I514 K522 V525	L469-L473 PolarHBondContact O-N 3.32Å; Q470-L473 WeakPolarHBondContact O-CB 3.35Å; Q470-L473 PolarHBondContact O-N 2.87Å; E471-L473 VanDerWaalsContact C-N 3.29Å; L473-L475 PolarHBondContact O-N 2.76Å; L473-Y482 HydrophobicContact CD2-CD1 4.18Å; L473-Y482 HydrophobicContact CD2-CE1 3.62Å; L473-Y482 HydrophobicContact CD2-CE2 4.02Å; L473-I514 HydrophobicContact CB-CD1 4.44Å; L473-I514 HydrophobicContact CB-CG2 4.13Å; L473-I514 HydrophobicContact CD1-CG2 3.95Å; L473-K522 HydrophobicContact CD1-CB 3.95Å; L473-K522 HydrophobicContact CD1-CG 4.36Å; L473-V525 HydrophobicContact CD1-CB 4.49Å; L473-V525 HydrophobicContact CD2-CG1 4.31Å
474	D	87.4	Confident	86.2	Confident	50 Å²	50	48.6 Å²	48.6	27%	0.267	24%	0.235	S	C	.	.			trans	-69.1	97.6	172.8	-167.1	-24.7	0	0	0	109.2	Q472 D476 L477 Y482 K485	Q472-D474 PolarHBondContact O-N 2.98Å; D474-D476 PolarHBondContact O-N 2.87Å; D474-D476 VanDerWaalsContact O-N 3.15Å; D474-L477 HydrophobicContact CB-CB 4.29Å; D474-L477 HydrophobicContact CB-CD1 3.83Å; D474-L477 HydrophobicContact CB-CG 3.99Å; D474-L477 PolarHBondContact O-N 3.2Å; D474-L477 VanDerWaalsContact O-N 3.12Å; D474-L477 VanDerWaalsContact OD2-CD1 3.27Å; D474-L477 WeakPolarHBondContact OD2-CD1 3.17Å; D474-Y482 HydrophobicContact CB-CD2 4.19Å; D474-K485 IonicContact OD2-NZ 2.71Å; D474-K485 PolarHBondContact OD2-NZ 3.25Å
475	L	87.3	Confident	86.1	Confident	78 Å²	78	53.5 Å²	53.5	41%	0.408	26%	0.257	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.9	-21.2	-169.5	-64.3	-176.5	0	0	0	113.8	L473 I514 R515	L473-L475 PolarHBondContact O-N 2.76Å; L475-I514 HydrophobicContact CD2-CG2 3.97Å; L475-I514 PolarHBondContact O-N 2.69Å; L475-R515 HydrophobicContact CB-CB 4.16Å; L475-R515 WeakPolarHBondContact O-CB 3.49Å; L475-R515 PolarHBondContact O-N 3.37Å
476	D	89.4	Confident	86	Confident	125 Å²	125	55.6 Å²	55.6	67%	0.668	27%	0.271	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.7	-23.2	179.7	-69.3	-36.7	0	0	0	112.6	D474	D474-D476 PolarHBondContact O-N 2.87Å; D474-D476 VanDerWaalsContact O-N 3.15Å
477	L	92.2	Very high	86.1	Confident	40 Å²	40	55.4 Å²	55.4	21%	0.209	27%	0.27	C	S	.	.	S	Bend	trans	-82	153.3	177	-62.5	-177	0	0	0	111.4	D474 E481 K485 I514	D474-L477 HydrophobicContact CB-CB 4.29Å; D474-L477 HydrophobicContact CB-CD1 3.83Å; D474-L477 HydrophobicContact CB-CG 3.99Å; D474-L477 PolarHBondContact O-N 3.2Å; D474-L477 VanDerWaalsContact O-N 3.12Å; D474-L477 VanDerWaalsContact OD2-CD1 3.27Å; D474-L477 WeakPolarHBondContact OD2-CD1 3.17Å; L477-E481 HydrophobicContact CB-CB 4.21Å; L477-E481 HydrophobicContact CD2-CB 4.31Å; L477-K485 HydrophobicContact CD1-CD 3.49Å; L477-K485 VanDerWaalsContact CD1-CD 3.49Å; L477-I514 WeakPolarHBondContact O-CB 3.29Å; L477-I514 WeakPolarHBondContact O-CG1 3.19Å; L477-I514 PolarHBondContact O-N 3.35Å
478	S	93	Very high	86.5	Confident	4 Å²	4	56.2 Å²	56.2	3%	0.028	28%	0.282	C	S	.	.			trans	-76	158	164	64.7	0	0	0	0	111.5	L480 E481 Y482 Q510 V511 S512	S478-L480 PolarHBondContact O-N 3.42Å; S478-L480 VanDerWaalsContact O-N 3.17Å; S478-E481 WeakPolarHBondContact CB-OE2 3.32Å; S478-E481 PolarHBondContact N-OE2 3.28Å; S478-E481 PolarHBondContact O-N 2.84Å; S478-E481 WeakPolarHBondContact OG-CB 3.36Å; S478-E481 VanDerWaalsContact OG-CG 3.23Å; S478-E481 WeakPolarHBondContact OG-CG 3.45Å; S478-E481 PolarHBondContact OG-N 2.91Å; S478-E481 PolarHBondContact OG-OE2 3.31Å; S478-Y482 WeakPolarHBondContact O-CB 3.31Å; S478-Y482 PolarHBondContact O-N 3.49Å; S478-Q510 WeakPolarHBondContact CB-O 3.38Å; S478-V511 VanDerWaalsContact CB-C 3.47Å; S478-V511 WeakPolarHBondContact CB-O 3.45Å; S478-S512 WeakPolarHBondContact CA-O 3.4Å; S478-S512 WeakPolarHBondContact CB-O 3.39Å
479	P	92.5	Very high	87.1	Confident	0 Å²	0	57.2 Å²	57.2	0%	0	29%	0.287	C	S	.	.	H	α-helix	trans	-52.6	-38.3	175.6	-30.2	37	0	0	0	113.7	M483 I500 Q509 S512 I514 L517 V525	P479-M483 WeakPolarHBondContact O-CB 3.34Å; P479-M483 VanDerWaalsContact O-CG 3.3Å; P479-M483 WeakPolarHBondContact O-CG 3.46Å; P479-M483 PolarHBondContact O-N 3.34Å; P479-I500 HydrophobicContact CB-CD1 4.4Å; P479-I500 HydrophobicContact CB-CG2 4.4Å; P479-Q509 WeakPolarHBondContact CD-O 3.48Å; P479-Q509 WeakPolarHBondContact CG-O 3.46Å; P479-S512 VanDerWaalsContact CD-O 3.31Å; P479-S512 WeakPolarHBondContact CD-O 3.35Å; P479-I514 HydrophobicContact CG-CG1 3.98Å; P479-L517 HydrophobicContact CG-CD1 3.56Å; P479-V525 HydrophobicContact CB-CG1 4.31Å; P479-V525 HydrophobicContact CB-CG2 3.88Å; P479-V525 HydrophobicContact CG-CG2 3.81Å
480	L	92.4	Very high	87.6	Confident	11 Å²	11	57.9 Å²	57.9	6%	0.058	29%	0.291	C	S	.	.	H	α-helix	trans	-66.7	-45.4	177.8	-177.7	61.7	0	0	0	111.5	S478 M483 M484 M496 R497 I500 Q510	S478-L480 PolarHBondContact O-N 3.42Å; S478-L480 VanDerWaalsContact O-N 3.17Å; L480-M483 PolarHBondContact O-N 3.49Å; L480-M484 HydrophobicContact CD1-CG 4.5Å; L480-M484 WeakPolarHBondContact O-CB 3.38Å; L480-M484 WeakPolarHBondContact O-CG 3.18Å; L480-M484 PolarHBondContact O-N 3.5Å; L480-M496 HydrophobicContact CD1-CB 3.56Å; L480-R497 HydrophobicContact CD1-CG 3.72Å; L480-R497 HydrophobicContact CD2-CG 3.85Å; L480-R497 HydrophobicContact CG-CG 4.43Å; L480-I500 HydrophobicContact CB-CD1 4.27Å; L480-I500 HydrophobicContact CD1-CD1 4.13Å; L480-Q510 VanDerWaalsContact CB-O 3.24Å; L480-Q510 WeakPolarHBondContact CB-O 3.48Å; L480-Q510 PolarHBondContact N-O 3.37Å
481	E	93.2	Very high	88.3	Confident	104 Å²	104	66 Å²	66	49%	0.486	33%	0.325	S	S	.	.	H	α-helix	trans	-66.6	-39.4	177.4	-71.8	160.9	157.8	0	0	111.9	L477 S478 M484 K485	L477-E481 HydrophobicContact CB-CB 4.21Å; L477-E481 HydrophobicContact CD2-CB 4.31Å; S478-E481 WeakPolarHBondContact CB-OE2 3.32Å; S478-E481 PolarHBondContact N-OE2 3.28Å; S478-E481 PolarHBondContact O-N 2.84Å; S478-E481 WeakPolarHBondContact OG-CB 3.36Å; S478-E481 VanDerWaalsContact OG-CG 3.23Å; S478-E481 WeakPolarHBondContact OG-CG 3.45Å; S478-E481 PolarHBondContact OG-N 2.91Å; S478-E481 PolarHBondContact OG-OE2 3.31Å; E481-M484 PolarHBondContact O-N 2.86Å; E481-K485 VanDerWaalsContact O-CB 3.28Å; E481-K485 WeakPolarHBondContact O-CB 3.49Å; E481-K485 PolarHBondContact O-N 3.12Å
482	Y	93.2	Very high	89	Confident	23 Å²	23	65.6 Å²	65.6	9%	0.09	32%	0.324	C	S	.	.	H	α-helix	trans	-59.6	-50	174.7	176.6	-98.6	0	0	0	111.3	L473 D474 S478 M484 K485 C486 I514 V525 W529	L473-Y482 HydrophobicContact CD2-CD1 4.18Å; L473-Y482 HydrophobicContact CD2-CE1 3.62Å; L473-Y482 HydrophobicContact CD2-CE2 4.02Å; D474-Y482 HydrophobicContact CB-CD2 4.19Å; S478-Y482 WeakPolarHBondContact O-CB 3.31Å; S478-Y482 PolarHBondContact O-N 3.49Å; Y482-M484 VanDerWaalsContact C-N 3.35Å; Y482-M484 PolarHBondContact O-N 3.29Å; Y482-K485 WeakPolarHBondContact O-CB 3.45Å; Y482-K485 PolarHBondContact O-N 2.9Å; Y482-C486 PolarHBondContact O-N 3.45Å; Y482-C486 PolarHBondContact O-SG 3.43Å; Y482-C486 VanDerWaalsContact O-SG 3.35Å; Y482-I514 HydrophobicContact CG-CD1 4.2Å; Y482-V525 HydrophobicContact CD1-CG1 4.13Å; Y482-W529 HydrophobicContact CE1-CG 4.36Å
483	M	91.5	Very high	89.4	Confident	0 Å²	0	65.7 Å²	65.7	0%	0	32%	0.322	C	S	.	.	H	α-helix	trans	-61.8	-41.9	177.2	-73.6	-67.4	-68.5	0	0	112.1	P479 L480 K485 C486 Y487 M496 I500 W529 W532	P479-M483 WeakPolarHBondContact O-CB 3.34Å; P479-M483 VanDerWaalsContact O-CG 3.3Å; P479-M483 WeakPolarHBondContact O-CG 3.46Å; P479-M483 PolarHBondContact O-N 3.34Å; L480-M483 PolarHBondContact O-N 3.49Å; M483-K485 VanDerWaalsContact C-N 3.32Å; M483-K485 PolarHBondContact O-N 2.85Å; M483-C486 PolarHBondContact O-N 2.84Å; M483-Y487 HydrophobicContact CE-CD2 4.14Å; M483-Y487 HydrophobicContact CE-CE2 3.89Å; M483-Y487 WeakPolarHBondContact O-CD2 3.25Å; M483-Y487 PolarHBondContact O-N 3.47Å; M483-Y487 HydrophobicContact SD-CE2 4.28Å; M483-M496 HydrophobicContact CB-CG 4.43Å; M483-M496 HydrophobicContact CB-SD 3.73Å; M483-M496 HydrophobicContact CE-SD 3.74Å; M483-I500 HydrophobicContact CB-CD1 4.22Å; M483-I500 HydrophobicContact CG-CD1 3.85Å; M483-I500 HydrophobicContact CG-CG1 4.08Å; M483-W529 HydrophobicContact SD-CB 3.79Å; M483-W532 HydrophobicContact CE-CB 4.07Å; M483-W532 HydrophobicContact CE-CG 4.31Å
484	M	91.5	Very high	89.7	Confident	39 Å²	39	70 Å²	70	19%	0.192	34%	0.342	C	S	.	.	H	α-helix	trans	-65.9	-32.2	175.8	-69.1	-73.4	-53.1	0	0	112.9	L480 E481 Y482 Y487 I490 K493 M496	L480-M484 HydrophobicContact CD1-CG 4.5Å; L480-M484 WeakPolarHBondContact O-CB 3.38Å; L480-M484 WeakPolarHBondContact O-CG 3.18Å; L480-M484 PolarHBondContact O-N 3.5Å; E481-M484 PolarHBondContact O-N 2.86Å; Y482-M484 VanDerWaalsContact C-N 3.35Å; Y482-M484 PolarHBondContact O-N 3.29Å; M484-Y487 CarbonylContact O-C 3.58Å; M484-I490 WeakPolarHBondContact CE-O 3.4Å; M484-K493 HydrophobicContact CE-CG 4.07Å; M484-K493 HydrophobicContact SD-CG 4.03Å; M484-M496 HydrophobicContact CG-CG 4.38Å; M484-M496 HydrophobicContact SD-CB 4.37Å; M484-M496 HydrophobicContact SD-CG 3.81Å
485	K	91.3	Very high	89.7	Confident	130 Å²	130	71.5 Å²	71.5	57%	0.565	35%	0.347	S	S	*	.	H	α-helix	trans	-70.6	-39.7	175.1	176.5	178.3	171.9	178.7	0	111.5	D474 L477 E481 Y482 M483	D474-K485 IonicContact OD2-NZ 2.71Å; D474-K485 PolarHBondContact OD2-NZ 3.25Å; L477-K485 HydrophobicContact CD1-CD 3.49Å; L477-K485 VanDerWaalsContact CD1-CD 3.49Å; E481-K485 VanDerWaalsContact O-CB 3.28Å; E481-K485 WeakPolarHBondContact O-CB 3.49Å; E481-K485 PolarHBondContact O-N 3.12Å; Y482-K485 WeakPolarHBondContact O-CB 3.45Å; Y482-K485 PolarHBondContact O-N 2.9Å; M483-K485 VanDerWaalsContact C-N 3.32Å; M483-K485 PolarHBondContact O-N 2.85Å
486	C	89.4	Confident	89.8	Confident	47 Å²	47	67.8 Å²	67.8	32%	0.318	33%	0.328	S	S	.	.	H	α-helix	trans	-70.3	-31.4	177.2	-70	0	0	0	0	112.8	Y482 M483 P488	Y482-C486 PolarHBondContact O-N 3.45Å; Y482-C486 PolarHBondContact O-SG 3.43Å; Y482-C486 VanDerWaalsContact O-SG 3.35Å; M483-C486 PolarHBondContact O-N 2.84Å; C486-P488 WeakPolarHBondContact O-CD 3.28Å
487	Y	89.9	Confident	89.9	Confident	26 Å²	26	66.4 Å²	66.4	10%	0.102	31%	0.314	C	S	.	.			trans	-127.1	68.2	-176	-56.2	-70.2	0	0	0	111.6	M483 M484 E489 I490 M496 W529 W532 Q533	M483-Y487 HydrophobicContact CE-CD2 4.14Å; M483-Y487 HydrophobicContact CE-CE2 3.89Å; M483-Y487 WeakPolarHBondContact O-CD2 3.25Å; M483-Y487 PolarHBondContact O-N 3.47Å; M483-Y487 HydrophobicContact SD-CE2 4.28Å; M484-Y487 CarbonylContact O-C 3.58Å; Y487-E489 WeakPolarHBondContact CA-OE2 3.21Å; Y487-E489 WeakPolarHBondContact CB-OE1 3.45Å; Y487-E489 WeakPolarHBondContact CD1-OE1 3.45Å; Y487-E489 PolarHBondContact O-N 2.87Å; Y487-I490 PolarHBondContact O-N 3.36Å; Y487-I490 VanDerWaalsContact O-N 3.11Å; Y487-M496 HydrophobicContact CD2-CE 4.03Å; Y487-M496 HydrophobicContact CG-CE 4.27Å; Y487-W529 AromaticContact CE2-CD1 3.85Å; Y487-W529 PolarHBondContact OH-O 3.31Å; Y487-W529 VanDerWaalsContact OH-O 3.14Å; Y487-W532 AromaticContact CD1-CD1 3.69Å; Y487-W532 AromaticContact CD2-CD1 3.54Å; Y487-W532 HydrophobicContact CD2-CG 4.36Å; Y487-W532 AromaticContact CE1-CD1 3.59Å; Y487-W532 HydrophobicContact CE2-CB 4.12Å; Y487-W532 AromaticContact CE2-CD1 3.43Å; Y487-W532 VanDerWaalsContact CE2-CD1 3.43Å; Y487-W532 HydrophobicContact CE2-CG 4.03Å; Y487-W532 AromaticContact CG-CD1 3.67Å; Y487-W532 AromaticContact CG-NE1 3.88Å; Y487-W532 AromaticContact CZ-CD1 3.46Å; Y487-W532 VanDerWaalsContact CZ-CD1 3.46Å; Y487-Q533 WeakPolarHBondContact OH-CG 3.4Å
488	P	86.7	Confident	89.7	Confident	99 Å²	99	71.5 Å²	71.5	64%	0.643	33%	0.334	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.1	-17	-175.8	28.3	-36.6	0	0	0	114	C486 I490	C486-P488 WeakPolarHBondContact O-CD 3.28Å; P488-I490 PolarHBondContact O-N 3.42Å
489	E	88.7	Confident	89.4	Confident	125 Å²	125	72.5 Å²	72.5	58%	0.584	34%	0.339	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.2	-21.4	173.8	67.6	-74.4	179.3	0	0	112.9	Y487	Y487-E489 WeakPolarHBondContact CA-OE2 3.21Å; Y487-E489 WeakPolarHBondContact CB-OE1 3.45Å; Y487-E489 WeakPolarHBondContact CD1-OE1 3.45Å; Y487-E489 PolarHBondContact O-N 2.87Å
490	I	85	Confident	89.3	Confident	19 Å²	19	72.6 Å²	72.6	10%	0.097	34%	0.339	C	S	.	.			trans	-92.4	110	-178.5	-62.5	169.6	0	0	0	109.1	M484 Y487 P488 M496 W532	M484-I490 WeakPolarHBondContact CE-O 3.4Å; Y487-I490 PolarHBondContact O-N 3.36Å; Y487-I490 VanDerWaalsContact O-N 3.11Å; P488-I490 PolarHBondContact O-N 3.42Å; I490-M496 HydrophobicContact CB-CE 3.94Å; I490-M496 HydrophobicContact CD1-CE 3.14Å; I490-M496 HydrophobicContact CG1-CE 4.08Å; I490-M496 HydrophobicContact CG2-CE 3.93Å; I490-M496 HydrophobicContact CG2-CG 4.32Å; I490-W532 VanDerWaalsContact CD1-CE2 3.45Å; I490-W532 HydrophobicContact CD1-CH2 4.48Å; I490-W532 HydrophobicContact CD1-CZ2 3.26Å
491	K	84.3	Confident	89.2	Confident	189 Å²	189	73.1 Å²	73.1	82%	0.822	35%	0.348	S	S	*	.			trans	-86.1	-26.1	-179.2	-61.4	-175.8	-177.5	178.3	0	112.5	K493	K491-K493 PolarHBondContact O-N 3.25Å
492	E	87.7	Confident	88.8	Confident	138 Å²	138	74.1 Å²	74.1	65%	0.645	35%	0.347	S	S	*	.			trans	-85.3	100.6	-175.8	-66	-166.7	-179.4	0	0	111.5	E494 E495	E492-E494 PolarHBondContact O-N 2.87Å; E492-E494 VanDerWaalsContact O-N 3.12Å; E492-E495 HydrophobicContact CB-CB 4.37Å; E492-E495 PolarHBondContact O-N 3.5Å; E492-E495 VanDerWaalsContact O-N 3.16Å
493	K	87.7	Confident	88.6	Confident	127 Å²	127	73.2 Å²	73.2	55%	0.552	34%	0.343	S	S	*	.	H	α-helix	trans	-55.8	-30.5	174.9	-68.1	-173.8	177.3	-173.9	0	113	M484 K491 E495 M496 R497	M484-K493 HydrophobicContact CE-CG 4.07Å; M484-K493 HydrophobicContact SD-CG 4.03Å; K491-K493 PolarHBondContact O-N 3.25Å; K493-E495 VanDerWaalsContact C-N 3.31Å; K493-E495 PolarHBondContact O-N 3.32Å; K493-M496 PolarHBondContact O-N 3.43Å; K493-R497 WeakPolarHBondContact O-CG 3.23Å; K493-R497 PolarHBondContact O-N 3.48Å
494	E	89.3	Confident	88.3	Confident	97 Å²	97	74 Å²	74	45%	0.453	35%	0.352	S	S	.	.	H	α-helix	trans	-69.5	-29.6	-176.9	-163.4	58.9	-154.4	0	0	112.6	E492 R497 K498	E492-E494 PolarHBondContact O-N 2.87Å; E492-E494 VanDerWaalsContact O-N 3.12Å; E494-R497 PolarHBondContact O-N 3.28Å; E494-R497 WeakPolarHBondContact OE2-CD 3.35Å; E494-R497 IonicContact OE2-NH1 2.79Å; E494-R497 PolarHBondContact OE2-NH1 3.2Å; E494-K498 WeakPolarHBondContact O-CG 3.36Å; E494-K498 PolarHBondContact O-N 3.06Å
495	E	88.3	Confident	88	Confident	80 Å²	80	72.2 Å²	72.2	37%	0.374	34%	0.343	S	S	.	.	H	α-helix	trans	-64.8	-49.2	173.4	-172.7	172	-160.9	0	0	110.6	E492 K493 R497 K498 I499 W532	E492-E495 HydrophobicContact CB-CB 4.37Å; E492-E495 PolarHBondContact O-N 3.5Å; E492-E495 VanDerWaalsContact O-N 3.16Å; K493-E495 VanDerWaalsContact C-N 3.31Å; K493-E495 PolarHBondContact O-N 3.32Å; E495-R497 VanDerWaalsContact C-N 3.31Å; E495-R497 PolarHBondContact O-N 3.1Å; E495-K498 WeakPolarHBondContact O-CB 3.34Å; E495-K498 PolarHBondContact O-N 3.31Å; E495-K498 VanDerWaalsContact O-N 3.08Å; E495-I499 HydrophobicContact CG-CD1 4.23Å; E495-I499 VanDerWaalsContact O-CD1 3.26Å; E495-I499 WeakPolarHBondContact O-CD1 3.46Å; E495-I499 PolarHBondContact O-N 3.34Å; E495-I499 VanDerWaalsContact O-N 3.16Å; E495-W532 HydrophobicContact CG-CH2 4.21Å
496	M	89.1	Confident	87.7	Confident	0 Å²	0	69.6 Å²	69.6	0%	0	34%	0.338	C	S	.	.	H	α-helix	trans	-57.9	-42	174.3	-73.1	-63.3	166.3	0	0	112.7	L480 M483 M484 Y487 I490 K493 K498 I499 I500 W532	L480-M496 HydrophobicContact CD1-CB 3.56Å; M483-M496 HydrophobicContact CB-CG 4.43Å; M483-M496 HydrophobicContact CB-SD 3.73Å; M483-M496 HydrophobicContact CE-SD 3.74Å; M484-M496 HydrophobicContact CG-CG 4.38Å; M484-M496 HydrophobicContact SD-CB 4.37Å; M484-M496 HydrophobicContact SD-CG 3.81Å; Y487-M496 HydrophobicContact CD2-CE 4.03Å; Y487-M496 HydrophobicContact CG-CE 4.27Å; I490-M496 HydrophobicContact CB-CE 3.94Å; I490-M496 HydrophobicContact CD1-CE 3.14Å; I490-M496 HydrophobicContact CG1-CE 4.08Å; I490-M496 HydrophobicContact CG2-CE 3.93Å; I490-M496 HydrophobicContact CG2-CG 4.32Å; K493-M496 PolarHBondContact O-N 3.43Å; M496-K498 VanDerWaalsContact C-N 3.32Å; M496-K498 PolarHBondContact O-N 3.16Å; M496-I499 PolarHBondContact O-N 3.32Å; M496-I499 HydrophobicContact SD-CD1 4.26Å; M496-I500 WeakPolarHBondContact O-CB 3.41Å; M496-I500 WeakPolarHBondContact O-CD1 3.46Å; M496-I500 WeakPolarHBondContact O-CG1 3.43Å; M496-I500 PolarHBondContact O-N 3.24Å; M496-W532 HydrophobicContact CE-CZ2 4.35Å
497	R	90.3	Very high	87.5	Confident	97 Å²	97	70 Å²	70	37%	0.366	35%	0.35	S	S	.	.	H	α-helix	trans	-61.7	-37.5	175.6	-73.2	-173.5	-179.6	166.9	-5.2	113.1	L480 K493 E494 E495 G501 Q510	L480-R497 HydrophobicContact CD1-CG 3.72Å; L480-R497 HydrophobicContact CD2-CG 3.85Å; L480-R497 HydrophobicContact CG-CG 4.43Å; K493-R497 WeakPolarHBondContact O-CG 3.23Å; K493-R497 PolarHBondContact O-N 3.48Å; E494-R497 PolarHBondContact O-N 3.28Å; E494-R497 WeakPolarHBondContact OE2-CD 3.35Å; E494-R497 IonicContact OE2-NH1 2.79Å; E494-R497 PolarHBondContact OE2-NH1 3.2Å; E495-R497 VanDerWaalsContact C-N 3.31Å; E495-R497 PolarHBondContact O-N 3.1Å; R497-G501 WeakPolarHBondContact O-CA 3.49Å; R497-G501 PolarHBondContact O-N 2.84Å; R497-Q510 VanDerWaalsContact CG-OE1 3.23Å; R497-Q510 PolarHBondContact O-NE2 3.24Å
498	K	88.8	Confident	87.3	Confident	147 Å²	147	77.5 Å²	77.5	64%	0.639	38%	0.383	S	S	*	.	H	α-helix	trans	-65.5	-44.4	177.5	-74.6	172	-175.7	174.7	0	111.4	E494 E495 M496 G501 R502	E494-K498 WeakPolarHBondContact O-CG 3.36Å; E494-K498 PolarHBondContact O-N 3.06Å; E495-K498 WeakPolarHBondContact O-CB 3.34Å; E495-K498 PolarHBondContact O-N 3.31Å; E495-K498 VanDerWaalsContact O-N 3.08Å; M496-K498 VanDerWaalsContact C-N 3.32Å; M496-K498 PolarHBondContact O-N 3.16Å; K498-G501 PolarHBondContact O-N 3.1Å; K498-R502 PolarHBondContact O-N 3.48Å
499	I	87.7	Confident	87.2	Confident	25 Å²	25	75.4 Å²	75.4	13%	0.128	37%	0.365	C	S	.	.	H	α-helix	trans	-64.5	-53.8	178.7	-61	139.6	0	0	0	109.7	E495 M496 G501 R502 Y503 A528 W532	E495-I499 HydrophobicContact CG-CD1 4.23Å; E495-I499 VanDerWaalsContact O-CD1 3.26Å; E495-I499 WeakPolarHBondContact O-CD1 3.46Å; E495-I499 PolarHBondContact O-N 3.34Å; E495-I499 VanDerWaalsContact O-N 3.16Å; M496-I499 PolarHBondContact O-N 3.32Å; M496-I499 HydrophobicContact SD-CD1 4.26Å; I499-G501 PolarHBondContact O-N 2.94Å; I499-R502 WeakPolarHBondContact O-CB 3.39Å; I499-R502 PolarHBondContact O-N 3.42Å; I499-Y503 HydrophobicContact CG2-CD2 4.49Å; I499-Y503 HydrophobicContact CG2-CE2 4.43Å; I499-Y503 WeakPolarHBondContact O-CD2 3.22Å; I499-Y503 PolarHBondContact O-N 3.2Å; I499-A528 HydrophobicContact CG2-CB 4.38Å; I499-W532 HydrophobicContact CD1-CD2 3.96Å; I499-W532 HydrophobicContact CD1-CE3 3.23Å; I499-W532 HydrophobicContact CD1-CH2 3.54Å; I499-W532 HydrophobicContact CD1-CZ2 4.24Å; I499-W532 HydrophobicContact CD1-CZ3 3Å; I499-W532 HydrophobicContact CG1-CE3 3.8Å; I499-W532 HydrophobicContact CG1-CZ3 3.62Å; I499-W532 HydrophobicContact CG2-CE3 4.38Å
500	I	89.9	Confident	87.2	Confident	1 Å²	1	70.2 Å²	70.2	1%	0.005	34%	0.341	C	S	.	.	H	α-helix	trans	-56.6	-40.5	177.7	-64.7	166.4	0	0	0	110.8	P479 L480 M483 M496 R502 Y503 L505 Q510	P479-I500 HydrophobicContact CB-CD1 4.4Å; P479-I500 HydrophobicContact CB-CG2 4.4Å; L480-I500 HydrophobicContact CB-CD1 4.27Å; L480-I500 HydrophobicContact CD1-CD1 4.13Å; M483-I500 HydrophobicContact CB-CD1 4.22Å; M483-I500 HydrophobicContact CG-CD1 3.85Å; M483-I500 HydrophobicContact CG-CG1 4.08Å; M496-I500 WeakPolarHBondContact O-CB 3.41Å; M496-I500 WeakPolarHBondContact O-CD1 3.46Å; M496-I500 WeakPolarHBondContact O-CG1 3.43Å; M496-I500 PolarHBondContact O-N 3.24Å; I500-R502 VanDerWaalsContact C-N 3.35Å; I500-R502 PolarHBondContact O-N 3.15Å; I500-Y503 PolarHBondContact O-N 3.34Å; I500-L505 HydrophobicContact CG2-CB 3.53Å; I500-L505 HydrophobicContact CG2-CD1 3.87Å; I500-L505 HydrophobicContact CG2-CG 4.36Å; I500-L505 PolarHBondContact O-N 3.12Å; I500-Q510 HydrophobicContact CG2-CG 3.79Å
501	G	89	Confident	87.5	Confident	23 Å²	23	73.2 Å²	73.2	24%	0.237	36%	0.36	C	S	.	.	H	α-helix	trans	-61.2	-38.1	175.7	0	0	0	0	0	113.8	R497 K498 I499 Y503 G504 L505	R497-G501 WeakPolarHBondContact O-CA 3.49Å; R497-G501 PolarHBondContact O-N 2.84Å; K498-G501 PolarHBondContact O-N 3.1Å; I499-G501 PolarHBondContact O-N 2.94Å; G501-Y503 VanDerWaalsContact C-N 3.27Å; G501-Y503 PolarHBondContact O-N 3.15Å; G501-G504 PolarHBondContact O-N 2.87Å; G501-L505 WeakPolarHBondContact CA-O 3.32Å
502	R	86.1	Confident	87.7	Confident	124 Å²	124	65.7 Å²	65.7	47%	0.468	33%	0.331	S	S	.	.	H	α-helix	trans	-64	-33.5	176.1	-166.9	168.4	-175.5	168.3	-2.6	112	Y384 K498 I499 I500 G504	Y384-R502 VanDerWaalsContact CB-CZ 3.43Å; Y384-R502 VanDerWaalsContact CG-CZ 3.48Å; Y384-R502 VanDerWaalsContact CG-NH2 3.3Å; K498-R502 PolarHBondContact O-N 3.48Å; I499-R502 WeakPolarHBondContact O-CB 3.39Å; I499-R502 PolarHBondContact O-N 3.42Å; I500-R502 VanDerWaalsContact C-N 3.35Å; I500-R502 PolarHBondContact O-N 3.15Å; R502-G504 PolarHBondContact O-N 3.27Å
503	Y	87.5	Confident	87.8	Confident	4 Å²	4	61.1 Å²	61.1	2%	0.016	31%	0.313	C	S	.	.	T	Hydrogen-bonded Turn	trans	-80.6	13.5	172.5	-72.8	-92.8	0	0	0	113.7	F383 Y384 I499 I500 G501 L505 R524 L527 A528 A531	F383-Y503 HydrophobicContact CB-CD1 4.28Å; F383-Y503 HydrophobicContact CB-CE1 3.76Å; F383-Y503 AromaticContact CD1-CD1 3.28Å; F383-Y503 HydrophobicContact CD1-CD1 3.28Å; F383-Y503 AromaticContact CD1-CE1 3.7Å; F383-Y503 HydrophobicContact CD1-CE1 3.7Å; F383-Y503 HydrophobicContact CD1-CG 4.03Å; F383-Y503 AromaticContact CE1-CD1 3.63Å; F383-Y503 HydrophobicContact CE1-CD1 3.63Å; F383-Y503 HydrophobicContact CE1-CE1 4.42Å; F383-Y503 HydrophobicContact CE1-CG 4.3Å; F383-Y503 AromaticContact CG-CD1 3.8Å; F383-Y503 HydrophobicContact CG-CD1 3.8Å; F383-Y503 AromaticContact CG-CE1 3.74Å; F383-Y503 HydrophobicContact CG-CE1 3.74Å; F383-Y503 HydrophobicContact CZ-CD1 4.39Å; Y384-Y503 PolarHBondContact N-OH 3.11Å; Y384-Y503 PolarHBondContact O-OH 2.87Å; I499-Y503 HydrophobicContact CG2-CD2 4.49Å; I499-Y503 HydrophobicContact CG2-CE2 4.43Å; I499-Y503 WeakPolarHBondContact O-CD2 3.22Å; I499-Y503 PolarHBondContact O-N 3.2Å; I500-Y503 PolarHBondContact O-N 3.34Å; G501-Y503 VanDerWaalsContact C-N 3.27Å; G501-Y503 PolarHBondContact O-N 3.15Å; Y503-L505 PolarHBondContact O-N 2.86Å; Y503-R524 VanDerWaalsContact O-CD 3.3Å; Y503-R524 WeakPolarHBondContact O-CD 3.48Å; Y503-L527 HydrophobicContact CD1-CB 3.77Å; Y503-L527 HydrophobicContact CE1-CB 3.66Å; Y503-A528 HydrophobicContact CD1-CB 4.46Å; Y503-A528 HydrophobicContact CD2-CB 3.55Å; Y503-A528 HydrophobicContact CE2-CB 4.1Å; Y503-A528 HydrophobicContact CG-CB 3.79Å; Y503-A531 HydrophobicContact CE2-CB 4.21Å; Y503-A531 WeakPolarHBondContact OH-CB 3.32Å
504	G	85.1	Confident	87.8	Confident	18 Å²	18	55 Å²	55	19%	0.186	29%	0.287	C	S	.	.	T	Hydrogen-bonded Turn	trans	86.3	1.8	170.3	0	0	0	0	0	116	L381 G501 R502	L381-G504 VanDerWaalsContact CD2-CA 3.46Å; G501-G504 PolarHBondContact O-N 2.87Å; R502-G504 PolarHBondContact O-N 3.27Å
505	L	86.6	Confident	87.6	Confident	0 Å²	0	58 Å²	58	0%	0	29%	0.293	C	S	.	.			trans	-89.2	111.8	176.3	-70	163.6	0	0	0	108.7	I500 G501 Y503 Q509 Q510 Q521 R524 V525	I500-L505 HydrophobicContact CG2-CB 3.53Å; I500-L505 HydrophobicContact CG2-CD1 3.87Å; I500-L505 HydrophobicContact CG2-CG 4.36Å; I500-L505 PolarHBondContact O-N 3.12Å; G501-L505 WeakPolarHBondContact CA-O 3.32Å; Y503-L505 PolarHBondContact O-N 2.86Å; L505-Q509 HydrophobicContact CD2-CB 4.14Å; L505-Q510 HydrophobicContact CB-CG 4.47Å; L505-Q510 VanDerWaalsContact O-CG 3.27Å; L505-Q510 WeakPolarHBondContact O-CG 3.49Å; L505-Q510 PolarHBondContact O-NE2 2.83Å; L505-Q521 HydrophobicContact CD2-CB 3.93Å; L505-Q521 HydrophobicContact CD2-CG 4.01Å; L505-R524 HydrophobicContact CD1-CB 4.11Å; L505-R524 HydrophobicContact CG-CB 4.31Å; L505-V525 HydrophobicContact CD1-CB 4.41Å; L505-V525 HydrophobicContact CD1-CG2 3.45Å; L505-V525 VanDerWaalsContact CD1-CG2 3.45Å
506	T	85.3	Confident	87.4	Confident	76 Å²	76	59 Å²	59	47%	0.466	30%	0.301	S	S	.	.			trans	-126.7	152.4	-173.1	61.1	0	0	0	0	113.3	K508 Q509	T506-K508 PolarHBondContact O-N 2.79Å; T506-K508 VanDerWaalsContact O-N 3.12Å; T506-Q509 VanDerWaalsContact N-OE1 3.1Å; T506-Q509 PolarHBondContact O-N 3.02Å; T506-Q509 VanDerWaalsContact O-N 3.11Å
507	G	84.3	Confident	87.1	Confident	55 Å²	55	59.4 Å²	59.4	57%	0.567	30%	0.304	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.8	-116	172.9	0	0	0	0	0	113	Q509 Q510	G507-Q509 PolarHBondContact O-N 3.34Å; G507-Q510 PolarHBondContact O-N 3.07Å
508	K	85.1	Confident	86.6	Confident	183 Å²	183	57.3 Å²	57.3	80%	0.796	30%	0.304	S	S	*	.	H	α-helix	trans	-59.8	-31.5	-176.9	-67.3	-174.8	179.5	-178.6	0	113.2	T506 Q510 V511 S512	T506-K508 PolarHBondContact O-N 2.79Å; T506-K508 VanDerWaalsContact O-N 3.12Å; K508-Q510 VanDerWaalsContact C-N 3.26Å; K508-Q510 PolarHBondContact O-N 2.64Å; K508-V511 VanDerWaalsContact O-CG2 3.3Å; K508-V511 WeakPolarHBondContact O-CG2 3.32Å; K508-V511 PolarHBondContact O-N 3.11Å; K508-S512 WeakPolarHBondContact O-CB 3.48Å; K508-S512 PolarHBondContact O-N 2.98Å; K508-S512 PolarHBondContact O-OG 3.18Å
509	Q	86.1	Confident	86.2	Confident	56 Å²	56	53.6 Å²	53.6	26%	0.262	29%	0.291	S	S	.	.	H	α-helix	trans	-66.7	-28.4	-178.3	-67.7	166.8	-22	0	0	112.8	P479 L505 T506 G507 V511 S512 L517	P479-Q509 WeakPolarHBondContact CD-O 3.48Å; P479-Q509 WeakPolarHBondContact CG-O 3.46Å; L505-Q509 HydrophobicContact CD2-CB 4.14Å; T506-Q509 VanDerWaalsContact N-OE1 3.1Å; T506-Q509 PolarHBondContact O-N 3.02Å; T506-Q509 VanDerWaalsContact O-N 3.11Å; G507-Q509 PolarHBondContact O-N 3.34Å; Q509-V511 VanDerWaalsContact C-N 3.29Å; Q509-S512 WeakPolarHBondContact CA-OG 3.3Å; Q509-S512 PolarHBondContact O-OG 3.21Å; Q509-L517 HydrophobicContact CB-CD2 4.28Å
510	Q	89	Confident	85.8	Confident	16 Å²	16	52.6 Å²	52.6	8%	0.075	29%	0.287	C	S	.	.	H	α-helix	trans	-76	-21.1	179.6	-59.2	-170.3	-9.9	0	0	112.8	S478 L480 R497 I500 L505 G507 K508	S478-Q510 WeakPolarHBondContact CB-O 3.38Å; L480-Q510 VanDerWaalsContact CB-O 3.24Å; L480-Q510 WeakPolarHBondContact CB-O 3.48Å; L480-Q510 PolarHBondContact N-O 3.37Å; R497-Q510 VanDerWaalsContact CG-OE1 3.23Å; R497-Q510 PolarHBondContact O-NE2 3.24Å; I500-Q510 HydrophobicContact CG2-CG 3.79Å; L505-Q510 HydrophobicContact CB-CG 4.47Å; L505-Q510 VanDerWaalsContact O-CG 3.27Å; L505-Q510 WeakPolarHBondContact O-CG 3.49Å; L505-Q510 PolarHBondContact O-NE2 2.83Å; G507-Q510 PolarHBondContact O-N 3.07Å; K508-Q510 VanDerWaalsContact C-N 3.26Å; K508-Q510 PolarHBondContact O-N 2.64Å
511	V	89.9	Confident	85.6	Confident	82 Å²	82	54.2 Å²	54.2	50%	0.497	29%	0.294	S	S	.	.	H	α-helix	trans	-114.8	-11.2	-174.8	-62.6	0	0	0	0	113.1	S478 K508 Q509	S478-V511 VanDerWaalsContact CB-C 3.47Å; S478-V511 WeakPolarHBondContact CB-O 3.45Å; K508-V511 VanDerWaalsContact O-CG2 3.3Å; K508-V511 WeakPolarHBondContact O-CG2 3.32Å; K508-V511 PolarHBondContact O-N 3.11Å; Q509-V511 VanDerWaalsContact C-N 3.29Å
512	S	89.3	Confident	85.5	Confident	30 Å²	30	54.8 Å²	54.8	21%	0.21	29%	0.29	C	S	.	.	S	Bend	trans	-76.8	143.6	172.1	58	0	0	0	0	110.4	S478 P479 K508 Q509	S478-S512 WeakPolarHBondContact CA-O 3.4Å; S478-S512 WeakPolarHBondContact CB-O 3.39Å; P479-S512 VanDerWaalsContact CD-O 3.31Å; P479-S512 WeakPolarHBondContact CD-O 3.35Å; K508-S512 WeakPolarHBondContact O-CB 3.48Å; K508-S512 PolarHBondContact O-N 2.98Å; K508-S512 PolarHBondContact O-OG 3.18Å; Q509-S512 WeakPolarHBondContact CA-OG 3.3Å; Q509-S512 PolarHBondContact O-OG 3.21Å
513	P	88.5	Confident	85.5	Confident	42 Å²	42	48.9 Å²	48.9	27%	0.273	27%	0.268	S	S	.	.			trans	-51.8	140	172.7	-29.1	36.8	0	0	0	112.6	R515 N516	P513-R515 HydrophobicContact CB-CG 3.94Å; P513-R515 PolarHBondContact O-N 3.37Å; P513-N516 WeakPolarHBondContact O-CB 3.33Å; P513-N516 PolarHBondContact O-N 3.29Å
514	I	89.4	Confident	85.5	Confident	0 Å²	0	50.2 Å²	50.2	0%	0	27%	0.273	C	S	.	.	G	3₁₀ helix	trans	-58.7	-30	-177.7	-72.5	164.5	0	0	0	111.5	L473 L475 L477 P479 Y482 N516 L517 K522	L473-I514 HydrophobicContact CB-CD1 4.44Å; L473-I514 HydrophobicContact CB-CG2 4.13Å; L473-I514 HydrophobicContact CD1-CG2 3.95Å; L475-I514 HydrophobicContact CD2-CG2 3.97Å; L475-I514 PolarHBondContact O-N 2.69Å; L477-I514 WeakPolarHBondContact O-CB 3.29Å; L477-I514 WeakPolarHBondContact O-CG1 3.19Å; L477-I514 PolarHBondContact O-N 3.35Å; P479-I514 HydrophobicContact CG-CG1 3.98Å; Y482-I514 HydrophobicContact CG-CD1 4.2Å; I514-N516 PolarHBondContact O-N 2.8Å; I514-N516 VanDerWaalsContact O-N 3.11Å; I514-L517 HydrophobicContact CB-CD1 4.46Å; I514-L517 HydrophobicContact CG1-CD1 4.19Å; I514-L517 WeakPolarHBondContact O-CB 3.35Å; I514-L517 PolarHBondContact O-N 3.17Å; I514-K522 HydrophobicContact CG2-CD 4.48Å; I514-K522 HydrophobicContact CG2-CG 4.06Å
515	R	85.3	Confident	85.7	Confident	158 Å²	158	49.5 Å²	49.5	60%	0.596	27%	0.265	S	S	*	.	G	3₁₀ helix	trans	-56.4	-25.4	173.7	69.6	-175	-177.5	100.8	-4.1	114.8	L475 P513	L475-R515 HydrophobicContact CB-CB 4.16Å; L475-R515 WeakPolarHBondContact O-CB 3.49Å; L475-R515 PolarHBondContact O-N 3.37Å; P513-R515 HydrophobicContact CB-CG 3.94Å; P513-R515 PolarHBondContact O-N 3.37Å
516	N	83.1	Confident	85.9	Confident	101 Å²	101	49.5 Å²	49.5	54%	0.54	27%	0.265	S	S	.	.	G	3₁₀ helix	trans	-90.2	-6.6	179.9	-66.2	-17	0	0	0	112.7	P513 I514	P513-N516 WeakPolarHBondContact O-CB 3.33Å; P513-N516 PolarHBondContact O-N 3.29Å; I514-N516 PolarHBondContact O-N 2.8Å; I514-N516 VanDerWaalsContact O-N 3.11Å
517	L	83.8	Confident	86.2	Confident	10 Å²	10	46 Å²	46	5%	0.052	24%	0.243	C	C	.	.	S	Bend	trans	-81.3	147.3	178	-60.5	-179.4	0	0	0	110.5	P479 Q509 I514 Q521 K522 V525	P479-L517 HydrophobicContact CG-CD1 3.56Å; Q509-L517 HydrophobicContact CB-CD2 4.28Å; I514-L517 HydrophobicContact CB-CD1 4.46Å; I514-L517 HydrophobicContact CG1-CD1 4.19Å; I514-L517 WeakPolarHBondContact O-CB 3.35Å; I514-L517 PolarHBondContact O-N 3.17Å; L517-Q521 VanDerWaalsContact CA-OE1 3.3Å; L517-Q521 HydrophobicContact CB-CB 3.83Å; L517-Q521 HydrophobicContact CD2-CB 4.4Å; L517-Q521 HydrophobicContact CG-CB 4.47Å; L517-K522 HydrophobicContact CB-CG 4.19Å; L517-K522 WeakPolarHBondContact O-CE 3.4Å; L517-V525 HydrophobicContact CD1-CG2 4.14Å
518	S	79.8	Confident	86.5	Confident	53 Å²	53	43.3 Å²	43.3	37%	0.371	22%	0.216	S	C	.	.			trans	-68	160.6	169.4	67.2	0	0	0	0	111.1	G520 Q521 K522	S518-G520 VanDerWaalsContact C-N 3.28Å; S518-G520 PolarHBondContact O-N 3.03Å; S518-Q521 CarbonylContact O-C 3.55Å; S518-Q521 WeakPolarHBondContact O-CA 3.46Å; S518-Q521 WeakPolarHBondContact O-CB 3.4Å; S518-Q521 PolarHBondContact O-N 2.84Å; S518-Q521 WeakPolarHBondContact OG-CG 3.36Å; S518-Q521 PolarHBondContact OG-N 3.31Å; S518-K522 WeakPolarHBondContact O-CG 3.39Å; S518-K522 PolarHBondContact O-N 3.44Å
519	D	78.9	Confident	86.8	Confident	68 Å²	68	37 Å²	37	36%	0.364	19%	0.188	S	C	.	.	H	α-helix	trans	-62.2	-36.4	-179.6	-58.4	-32.6	0	0	0	112.1	Q521 K522 C523 H546	D519-Q521 VanDerWaalsContact C-N 3.3Å; D519-Q521 PolarHBondContact O-N 2.67Å; D519-K522 PolarHBondContact O-N 3.24Å; D519-K522 IonicContact OD1-NZ 2.7Å; D519-K522 PolarHBondContact OD1-NZ 3.36Å; D519-C523 PolarHBondContact O-N 3.47Å; D519-H546 HydrophobicContact CB-CB 3.92Å
520	G	79.9	Confident	87	Confident	4 Å²	4	34.4 Å²	34.4	4%	0.041	18%	0.175	C	C	.	.	H	α-helix	trans	-62.7	-32.6	170.2	0	0	0	0	0	113.7	S518 C523 R524	S518-G520 VanDerWaalsContact C-N 3.28Å; S518-G520 PolarHBondContact O-N 3.03Å; G520-C523 WeakPolarHBondContact O-CB 3.42Å; G520-R524 WeakPolarHBondContact O-CG 3.46Å; G520-R524 PolarHBondContact O-N 2.7Å
521	Q	85.2	Confident	87.1	Confident	36 Å²	36	33.8 Å²	33.8	17%	0.168	17%	0.173	C	C	.	.	H	α-helix	trans	-73.4	-39.6	173	-75.6	167	-7	0	0	111.9	L505 L517 S518 D519 C523 R524 V525	L505-Q521 HydrophobicContact CD2-CB 3.93Å; L505-Q521 HydrophobicContact CD2-CG 4.01Å; L517-Q521 VanDerWaalsContact CA-OE1 3.3Å; L517-Q521 HydrophobicContact CB-CB 3.83Å; L517-Q521 HydrophobicContact CD2-CB 4.4Å; L517-Q521 HydrophobicContact CG-CB 4.47Å; S518-Q521 CarbonylContact O-C 3.55Å; S518-Q521 WeakPolarHBondContact O-CA 3.46Å; S518-Q521 WeakPolarHBondContact O-CB 3.4Å; S518-Q521 PolarHBondContact O-N 2.84Å; S518-Q521 WeakPolarHBondContact OG-CG 3.36Å; S518-Q521 PolarHBondContact OG-N 3.31Å; D519-Q521 VanDerWaalsContact C-N 3.3Å; D519-Q521 PolarHBondContact O-N 2.67Å; Q521-C523 VanDerWaalsContact C-N 3.3Å; Q521-C523 PolarHBondContact O-N 3.47Å; Q521-R524 WeakPolarHBondContact O-CB 3.39Å; Q521-R524 PolarHBondContact O-N 3.19Å; Q521-R524 VanDerWaalsContact O-N 3.13Å; Q521-V525 WeakPolarHBondContact O-CG2 3.15Å; Q521-V525 PolarHBondContact O-N 3.06Å; Q521-V525 VanDerWaalsContact O-N 3.09Å
522	K	87.5	Confident	87.2	Confident	34 Å²	34	33.2 Å²	33.2	15%	0.148	16%	0.162	C	C	.	.	H	α-helix	trans	-61	-40.6	172.9	-64.9	176.6	-165.4	155.2	0	111.4	Q470 L473 I514 L517 S518 D519 R524 V525 C526	Q470-K522 HydrophobicContact CB-CB 4.46Å; Q470-K522 HydrophobicContact CG-CB 4.32Å; L473-K522 HydrophobicContact CD1-CB 3.95Å; L473-K522 HydrophobicContact CD1-CG 4.36Å; I514-K522 HydrophobicContact CG2-CD 4.48Å; I514-K522 HydrophobicContact CG2-CG 4.06Å; L517-K522 HydrophobicContact CB-CG 4.19Å; L517-K522 WeakPolarHBondContact O-CE 3.4Å; S518-K522 WeakPolarHBondContact O-CG 3.39Å; S518-K522 PolarHBondContact O-N 3.44Å; D519-K522 PolarHBondContact O-N 3.24Å; D519-K522 IonicContact OD1-NZ 2.7Å; D519-K522 PolarHBondContact OD1-NZ 3.36Å; K522-R524 VanDerWaalsContact C-N 3.3Å; K522-R524 PolarHBondContact O-N 3.36Å; K522-V525 WeakPolarHBondContact O-CB 3.11Å; K522-V525 PolarHBondContact O-N 3.14Å; K522-V525 VanDerWaalsContact O-N 3.15Å; K522-C526 PolarHBondContact O-N 3.46Å; K522-C526 PolarHBondContact O-SG 2.86Å
523	C	85.8	Confident	87.2	Confident	0 Å²	0	34.5 Å²	34.5	0%	0	16%	0.164	C	C	.	.	H	α-helix	trans	-55.9	-45.2	172	-173.5	0	0	0	0	111.5	Y465 D519 G520 Q521 V525 C526 L527 L547	Y465-C523 PolarHBondContact OH-SG 3.1Å; D519-C523 PolarHBondContact O-N 3.47Å; G520-C523 WeakPolarHBondContact O-CB 3.42Å; Q521-C523 VanDerWaalsContact C-N 3.3Å; Q521-C523 PolarHBondContact O-N 3.47Å; C523-V525 VanDerWaalsContact C-N 3.32Å; C523-V525 PolarHBondContact O-N 2.84Å; C523-C526 WeakPolarHBondContact O-CB 3.44Å; C523-C526 PolarHBondContact O-N 3.49Å; C523-C526 VanDerWaalsContact O-N 3.09Å; C523-L527 WeakPolarHBondContact O-CG 3.14Å; C523-L527 PolarHBondContact O-N 2.91Å; C523-L547 HydrophobicContact CB-CD2 3.76Å; C523-L547 VanDerWaalsContact SG-CD2 3.59Å
524	R	87.6	Confident	87.4	Confident	33 Å²	33	35 Å²	35	13%	0.125	17%	0.165	C	C	.	.	H	α-helix	trans	-62.8	-36.1	177.5	-68.7	166.3	-170	179.4	8	112.6	F383 Y503 L505 G520 Q521 K522 L527 A528 D548 T551	F383-R524 HydrophobicContact CE1-CG 4.33Å; F383-R524 HydrophobicContact CZ-CG 3.98Å; Y503-R524 VanDerWaalsContact O-CD 3.3Å; Y503-R524 WeakPolarHBondContact O-CD 3.48Å; L505-R524 HydrophobicContact CD1-CB 4.11Å; L505-R524 HydrophobicContact CG-CB 4.31Å; G520-R524 WeakPolarHBondContact O-CG 3.46Å; G520-R524 PolarHBondContact O-N 2.7Å; Q521-R524 WeakPolarHBondContact O-CB 3.39Å; Q521-R524 PolarHBondContact O-N 3.19Å; Q521-R524 VanDerWaalsContact O-N 3.13Å; K522-R524 VanDerWaalsContact C-N 3.3Å; K522-R524 PolarHBondContact O-N 3.36Å; R524-L527 PolarHBondContact O-N 3.03Å; R524-A528 WeakPolarHBondContact O-CB 3.49Å; R524-A528 PolarHBondContact O-N 3.46Å; R524-D548 IonicContact NH2-OD1 3.51Å; R524-D548 IonicContact NH2-OD2 3.6Å; R524-T551 PolarHBondContact NH2-OG1 2.86Å
525	V	90.2	Very high	87.6	Confident	2 Å²	2	35 Å²	35	1%	0.012	17%	0.165	C	C	.	.	H	α-helix	trans	-61.4	-46.2	171.4	-177.5	0	0	0	0	110.4	L473 P479 Y482 L505 L517 Q521 K522 C523 L527 A528 W529	L473-V525 HydrophobicContact CD1-CB 4.49Å; L473-V525 HydrophobicContact CD2-CG1 4.31Å; P479-V525 HydrophobicContact CB-CG1 4.31Å; P479-V525 HydrophobicContact CB-CG2 3.88Å; P479-V525 HydrophobicContact CG-CG2 3.81Å; Y482-V525 HydrophobicContact CD1-CG1 4.13Å; L505-V525 HydrophobicContact CD1-CB 4.41Å; L505-V525 HydrophobicContact CD1-CG2 3.45Å; L505-V525 VanDerWaalsContact CD1-CG2 3.45Å; L517-V525 HydrophobicContact CD1-CG2 4.14Å; Q521-V525 WeakPolarHBondContact O-CG2 3.15Å; Q521-V525 PolarHBondContact O-N 3.06Å; Q521-V525 VanDerWaalsContact O-N 3.09Å; K522-V525 WeakPolarHBondContact O-CB 3.11Å; K522-V525 PolarHBondContact O-N 3.14Å; K522-V525 VanDerWaalsContact O-N 3.15Å; C523-V525 VanDerWaalsContact C-N 3.32Å; C523-V525 PolarHBondContact O-N 2.84Å; V525-L527 PolarHBondContact O-N 3.36Å; V525-A528 PolarHBondContact O-N 2.91Å; V525-W529 WeakPolarHBondContact O-CB 3.08Å; V525-W529 PolarHBondContact O-N 3.4Å
526	C	90.7	Very high	88.1	Confident	1 Å²	1	28.6 Å²	28.6	1%	0.007	14%	0.142	C	C	.	.	H	α-helix	trans	-62.8	-41.9	179.1	-64.5	0	0	0	0	112.2	Y465 L469 K522 C523 W529 L530	Y465-C526 HydrophobicContact CD2-CB 4.34Å; Y465-C526 HydrophobicContact CE2-CB 3.77Å; L469-C526 HydrophobicContact CD2-CB 3.74Å; L469-C526 HydrophobicContact CG-CB 4.23Å; K522-C526 PolarHBondContact O-N 3.46Å; K522-C526 PolarHBondContact O-SG 2.86Å; C523-C526 WeakPolarHBondContact O-CB 3.44Å; C523-C526 PolarHBondContact O-N 3.49Å; C523-C526 VanDerWaalsContact O-N 3.09Å; C526-W529 PolarHBondContact O-N 2.85Å; C526-L530 VanDerWaalsContact O-CB 3.28Å; C526-L530 WeakPolarHBondContact O-CB 3.46Å; C526-L530 PolarHBondContact O-N 3.23Å
527	L	90.3	Very high	88.7	Confident	1 Å²	1	23.8 Å²	23.8	1%	0.005	12%	0.116	C	C	.	.	H	α-helix	trans	-65.3	-41.8	176.5	-69.1	173.6	0	0	0	111.7	F383 Y465 Y503 C523 R524 V525 W529 L530 A531 L555	F383-L527 HydrophobicContact CD2-CD1 4.04Å; F383-L527 HydrophobicContact CE2-CD1 3.64Å; F383-L527 HydrophobicContact CZ-CD1 4.12Å; Y465-L527 HydrophobicContact CD2-CD2 4.16Å; Y465-L527 HydrophobicContact CE2-CD2 4.37Å; Y503-L527 HydrophobicContact CD1-CB 3.77Å; Y503-L527 HydrophobicContact CE1-CB 3.66Å; C523-L527 WeakPolarHBondContact O-CG 3.14Å; C523-L527 PolarHBondContact O-N 2.91Å; R524-L527 PolarHBondContact O-N 3.03Å; V525-L527 PolarHBondContact O-N 3.36Å; L527-W529 VanDerWaalsContact C-N 3.34Å; L527-W529 PolarHBondContact O-N 3.02Å; L527-L530 PolarHBondContact O-N 3.25Å; L527-A531 WeakPolarHBondContact O-CB 3.47Å; L527-A531 PolarHBondContact O-N 2.85Å; L527-L555 HydrophobicContact CD1-CD1 4.31Å; L527-L555 HydrophobicContact CD2-CD1 4.06Å
528	A	90.4	Very high	89.2	Confident	0 Å²	0	23.3 Å²	23.3	0%	0	11%	0.113	C	C	.	.	H	α-helix	trans	-61.2	-43.6	174	0	0	0	0	0	111.9	I499 Y503 R524 V525 W532	I499-A528 HydrophobicContact CG2-CB 4.38Å; Y503-A528 HydrophobicContact CD1-CB 4.46Å; Y503-A528 HydrophobicContact CD2-CB 3.55Å; Y503-A528 HydrophobicContact CE2-CB 4.1Å; Y503-A528 HydrophobicContact CG-CB 3.79Å; R524-A528 WeakPolarHBondContact O-CB 3.49Å; R524-A528 PolarHBondContact O-N 3.46Å; V525-A528 PolarHBondContact O-N 2.91Å; A528-W532 PolarHBondContact O-N 2.96Å; A528-W532 VanDerWaalsContact O-N 3.15Å
529	W	91.5	Very high	90	Very high	51 Å²	51	20.8 Å²	20.8	19%	0.193	10%	0.096	C	C	.	.	H	α-helix	trans	-61.7	-43.4	175.3	169.1	80.6	0	0	0	112.3	L469 Y482 M483 Y487 V525 C526 L527 W532	L469-W529 HydrophobicContact CD1-CE3 4.45Å; L469-W529 HydrophobicContact CD1-CH2 4.06Å; L469-W529 HydrophobicContact CD1-CZ3 3.78Å; L469-W529 HydrophobicContact CD2-CE3 4.08Å; L469-W529 HydrophobicContact CD2-CZ3 3.77Å; L469-W529 HydrophobicContact CG-CZ3 4.39Å; Y482-W529 HydrophobicContact CE1-CG 4.36Å; M483-W529 HydrophobicContact SD-CB 3.79Å; Y487-W529 AromaticContact CE2-CD1 3.85Å; Y487-W529 PolarHBondContact OH-O 3.31Å; Y487-W529 VanDerWaalsContact OH-O 3.14Å; V525-W529 WeakPolarHBondContact O-CB 3.08Å; V525-W529 PolarHBondContact O-N 3.4Å; C526-W529 PolarHBondContact O-N 2.85Å; L527-W529 VanDerWaalsContact C-N 3.34Å; L527-W529 PolarHBondContact O-N 3.02Å; W529-W532 PolarHBondContact O-N 2.76Å
530	L	91.7	Very high	90.7	Very high	0 Å²	0	17.5 Å²	17.5	0%	0	8%	0.078	C	C	.	.	H	α-helix	trans	-66.3	-44.3	-179.8	-175.7	61.9	0	0	0	111.8	F385 G463 C526 L527 W532 Q533 L538 L540	F385-L530 HydrophobicContact CE1-CD2 4.5Å; F385-L530 HydrophobicContact CE1-CG 4.47Å; G463-L530 VanDerWaalsContact CA-CD1 3.48Å; C526-L530 VanDerWaalsContact O-CB 3.28Å; C526-L530 WeakPolarHBondContact O-CB 3.46Å; C526-L530 PolarHBondContact O-N 3.23Å; L527-L530 PolarHBondContact O-N 3.25Å; L530-W532 VanDerWaalsContact C-N 3.28Å; L530-W532 PolarHBondContact O-N 2.89Å; L530-Q533 WeakPolarHBondContact O-CB 3.42Å; L530-Q533 PolarHBondContact O-N 2.82Å; L530-L538 HydrophobicContact CD1-CD1 4.4Å; L530-L538 HydrophobicContact CD2-CD1 3.6Å; L530-L538 HydrophobicContact CG-CD1 3.93Å; L530-L540 HydrophobicContact CD2-CD2 4.12Å
531	A	91.1	Very high	91.4	Very high	3 Å²	3	17.9 Å²	17.9	3%	0.025	8%	0.079	C	C	.	.	H	α-helix	trans	-63.9	-34.3	177.8	0	0	0	0	0	112.5	F385 P386 Y503 L527 Q533 N534	F385-A531 HydrophobicContact CD1-CB 3.74Å; F385-A531 HydrophobicContact CE1-CB 3.97Å; P386-A531 WeakPolarHBondContact CD-O 3.19Å; Y503-A531 HydrophobicContact CE2-CB 4.21Å; Y503-A531 WeakPolarHBondContact OH-CB 3.32Å; L527-A531 WeakPolarHBondContact O-CB 3.47Å; L527-A531 PolarHBondContact O-N 2.85Å; A531-Q533 VanDerWaalsContact C-N 3.28Å; A531-Q533 PolarHBondContact O-N 3.05Å; A531-N534 PolarHBondContact O-N 2.9Å
532	W	90.5	Very high	91.5	Very high	70 Å²	70	16.9 Å²	16.9	27%	0.265	8%	0.075	S	C	.	.	H	α-helix	trans	-66.7	-27.2	178.3	-164.7	-102.1	0	0	0	113.8	M483 Y487 I490 E495 M496 I499 A528 W529 L530 N534	M483-W532 HydrophobicContact CE-CB 4.07Å; M483-W532 HydrophobicContact CE-CG 4.31Å; Y487-W532 AromaticContact CD1-CD1 3.69Å; Y487-W532 AromaticContact CD2-CD1 3.54Å; Y487-W532 HydrophobicContact CD2-CG 4.36Å; Y487-W532 AromaticContact CE1-CD1 3.59Å; Y487-W532 HydrophobicContact CE2-CB 4.12Å; Y487-W532 AromaticContact CE2-CD1 3.43Å; Y487-W532 VanDerWaalsContact CE2-CD1 3.43Å; Y487-W532 HydrophobicContact CE2-CG 4.03Å; Y487-W532 AromaticContact CG-CD1 3.67Å; Y487-W532 AromaticContact CG-NE1 3.88Å; Y487-W532 AromaticContact CZ-CD1 3.46Å; Y487-W532 VanDerWaalsContact CZ-CD1 3.46Å; I490-W532 VanDerWaalsContact CD1-CE2 3.45Å; I490-W532 HydrophobicContact CD1-CH2 4.48Å; I490-W532 HydrophobicContact CD1-CZ2 3.26Å; E495-W532 HydrophobicContact CG-CH2 4.21Å; M496-W532 HydrophobicContact CE-CZ2 4.35Å; I499-W532 HydrophobicContact CD1-CD2 3.96Å; I499-W532 HydrophobicContact CD1-CE3 3.23Å; I499-W532 HydrophobicContact CD1-CH2 3.54Å; I499-W532 HydrophobicContact CD1-CZ2 4.24Å; I499-W532 HydrophobicContact CD1-CZ3 3Å; I499-W532 HydrophobicContact CG1-CE3 3.8Å; I499-W532 HydrophobicContact CG1-CZ3 3.62Å; I499-W532 HydrophobicContact CG2-CE3 4.38Å; A528-W532 PolarHBondContact O-N 2.96Å; A528-W532 VanDerWaalsContact O-N 3.15Å; W529-W532 PolarHBondContact O-N 2.76Å; L530-W532 VanDerWaalsContact C-N 3.28Å; L530-W532 PolarHBondContact O-N 2.89Å; W532-N534 PolarHBondContact O-N 2.88Å; W532-N534 VanDerWaalsContact O-N 3.09Å
533	Q	90.3	Very high	91.5	Very high	57 Å²	57	15.3 Å²	15.3	27%	0.266	7%	0.068	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.4	-15.7	176.1	-64	178.5	24.2	0	0	113.1	Y487 L530 A531	Y487-Q533 WeakPolarHBondContact OH-CG 3.4Å; L530-Q533 WeakPolarHBondContact O-CB 3.42Å; L530-Q533 PolarHBondContact O-N 2.82Å; A531-Q533 VanDerWaalsContact C-N 3.28Å; A531-Q533 PolarHBondContact O-N 3.05Å
534	N	91.8	Very high	91.4	Very high	52 Å²	52	16.1 Å²	16.1	28%	0.278	7%	0.073	S	C	.	.			trans	48.3	61.9	-173	-162.5	10.8	0	0	0	111.8	P386 P387 C388 A531 W532	P386-N534 PolarHBondContact O-OD1 2.9Å; P387-N534 PolarHBondContact O-ND2 3.23Å; P387-N534 PolarHBondContact O-OD1 3.37Å; C388-N534 VanDerWaalsContact CA-OD1 3.31Å; C388-N534 WeakPolarHBondContact CA-OD1 3.33Å; A531-N534 PolarHBondContact O-N 2.9Å; W532-N534 PolarHBondContact O-N 2.88Å; W532-N534 VanDerWaalsContact O-N 3.09Å
535	P	94.7	Very high	91.1	Very high	2 Å²	2	15.5 Å²	15.5	1%	0.013	7%	0.072	C	C	.	.			trans	-73.2	150.1	-176.1	32	-35.5	0	0	0	111.8	C388 G463 L538 F562	C388-P535 WeakPolarHBondContact CB-O 3.32Å; G463-P535 VanDerWaalsContact N-CB 3.31Å; P535-L538 HydrophobicContact CG-CD1 4.22Å; P535-F562 WeakPolarHBondContact O-CE2 3.37Å; P535-F562 VanDerWaalsContact O-CZ 3.27Å; P535-F562 WeakPolarHBondContact O-CZ 3.31Å
536	H	95.8	Very high	90.3	Very high	22 Å²	22	19.1 Å²	19.1	10%	0.102	9%	0.089	C	C	.	.	S	Bend	trans	-88.9	-25.8	171.1	-58.8	93.9	0	0	0	112.5	C388 I391 L422 H459 V460 K461 G564 G565	C388-H536 HydrophobicContact CB-CB 4.49Å; C388-H536 PolarHBondContact O-CD2 3.09Å; C388-H536 PolarHBondContact O-NE2 3.35Å; C388-H536 VanDerWaalsContact O-NE2 3.12Å; I391-H536 HydrophobicContact CD1-CB 3.89Å; I391-H536 WeakPolarHBondContact CD1-CD2 3.22Å; I391-H536 VanDerWaalsContact CD1-CG 3.43Å; L422-H536 HydrophobicContact CD2-CB 4Å; L422-H536 VanDerWaalsContact CD2-O 3.28Å; L422-H536 WeakPolarHBondContact CD2-O 3.25Å; H459-H536 PolarHBondContact O-CE1 2.91Å; V460-H536 HydrophobicContact CG2-CB 4.17Å; K461-H536 WeakPolarHBondContact CB-ND1 3.31Å; K461-H536 PolarHBondContact N-ND1 2.78Å; K461-H536 VanDerWaalsContact N-ND1 3.1Å; K461-H536 WeakPolarHBondContact O-CA 3.21Å; K461-H536 PolarHBondContact O-N 3.29Å; H536-G564 CarbonylContact O-C 3.55Å; H536-G564 VanDerWaalsContact O-CA 3.28Å; H536-G564 WeakPolarHBondContact O-CA 3.41Å; H536-G565 PolarHBondContact O-N 3Å
537	M	95	Very high	89.8	Confident	0 Å²	0	19.1 Å²	19.1	0%	0	9%	0.089	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	128.4	175.9	-70.3	-67.6	139.1	0	0	109.2	V395 I396 I420 D421 L422 V460 K461 I462 G463 F539 G565	V395-M537 HydrophobicContact CB-CE 3.98Å; V395-M537 HydrophobicContact CG1-CE 3.72Å; V395-M537 HydrophobicContact CG1-CG 4.42Å; V395-M537 HydrophobicContact CG2-CE 4.13Å; I396-M537 HydrophobicContact CD1-CG 4.23Å; I420-M537 HydrophobicContact CG2-SD 3.79Å; D421-M537 WeakPolarHBondContact O-CE 3.26Å; L422-M537 HydrophobicContact CD2-CE 3.51Å; L422-M537 HydrophobicContact CG-CE 4.15Å; V460-M537 HydrophobicContact CG2-CG 3.91Å; K461-M537 PolarHBondContact O-N 2.87Å; I462-M537 CarbonylContact C-O 3.52Å; I462-M537 WeakPolarHBondContact CA-O 3.19Å; I462-M537 HydrophobicContact CB-CB 4.37Å; I462-M537 HydrophobicContact CG1-CB 4.08Å; I462-M537 HydrophobicContact CG2-CB 4.15Å; G463-M537 PolarHBondContact N-O 3.44Å; M537-F539 HydrophobicContact CB-CE1 4.23Å; M537-F539 HydrophobicContact CB-CZ 4.43Å; M537-G565 CarbonylContact C-O 3.46Å; M537-G565 VanDerWaalsContact CA-O 3.29Å; M537-G565 WeakPolarHBondContact CA-O 3.33Å
538	L	95.1	Very high	89.3	Confident	0 Å²	0	19.4 Å²	19.4	0%	0	9%	0.09	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	111.9	177.7	-165.3	72.9	0	0	0	109.8	F385 G463 L530 P535 L540 I559 F562 G565 M566 M567	F385-L538 HydrophobicContact CE1-CD1 4.06Å; F385-L538 HydrophobicContact CE1-CD2 4.33Å; F385-L538 HydrophobicContact CE2-CD2 4.09Å; F385-L538 HydrophobicContact CZ-CD1 4.4Å; F385-L538 HydrophobicContact CZ-CD2 3.97Å; G463-L538 WeakPolarHBondContact O-CA 3.44Å; L530-L538 HydrophobicContact CD1-CD1 4.4Å; L530-L538 HydrophobicContact CD2-CD1 3.6Å; L530-L538 HydrophobicContact CG-CD1 3.93Å; P535-L538 HydrophobicContact CG-CD1 4.22Å; L538-L540 HydrophobicContact CD1-CD2 4.11Å; L538-L540 HydrophobicContact CD2-CD1 3.79Å; L538-L540 HydrophobicContact CD2-CD2 3.92Å; L538-L540 HydrophobicContact CD2-CG 3.94Å; L538-L540 HydrophobicContact CG-CD1 4.3Å; L538-L540 HydrophobicContact CG-CD2 3.73Å; L538-L540 HydrophobicContact CG-CG 3.88Å; L538-I559 HydrophobicContact CD2-CG1 4.37Å; L538-F562 HydrophobicContact CB-CD1 4.33Å; L538-F562 HydrophobicContact CB-CE1 3.76Å; L538-F562 HydrophobicContact CB-CZ 4.33Å; L538-G565 PolarHBondContact N-O 2.99Å; L538-M566 HydrophobicContact CB-CG 4.44Å; L538-M566 CarbonylContact O-C 3.49Å; L538-M566 VanDerWaalsContact O-CA 3.29Å; L538-M566 WeakPolarHBondContact O-CA 3.41Å; L538-M567 PolarHBondContact O-N 3.06Å
539	F	95.9	Very high	88.8	Confident	0 Å²	0	19.9 Å²	19.9	0%	0	9%	0.093	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	110.6	175.3	-65.7	-15.6	0	0	0	109.3	I396 L440 L443 T444 I462 G463 R464 Y465 M537 M567	I396-F539 HydrophobicContact CD1-CZ 3.9Å; L440-F539 HydrophobicContact CD2-CB 4.07Å; L440-F539 HydrophobicContact CD2-CD1 4.46Å; L440-F539 HydrophobicContact CD2-CD2 4.23Å; L440-F539 HydrophobicContact CD2-CG 4.01Å; L443-F539 HydrophobicContact CB-CE2 3.57Å; L443-F539 HydrophobicContact CB-CZ 4.02Å; L443-F539 HydrophobicContact CD1-CE2 4.16Å; L443-F539 HydrophobicContact CD1-CZ 3.99Å; T444-F539 HydrophobicContact CG2-CD2 3.8Å; T444-F539 HydrophobicContact CG2-CE2 4.17Å; I462-F539 HydrophobicContact CD1-CE2 4.38Å; I462-F539 HydrophobicContact CG2-CD2 3.54Å; I462-F539 HydrophobicContact CG2-CE2 3.59Å; I462-F539 HydrophobicContact CG2-CG 4.18Å; I462-F539 HydrophobicContact CG2-CZ 4.27Å; G463-F539 PolarHBondContact O-N 3.4Å; R464-F539 CarbonylContact C-O 3.59Å; R464-F539 VanDerWaalsContact CA-O 3.3Å; R464-F539 WeakPolarHBondContact CA-O 3.28Å; R464-F539 HydrophobicContact CB-CB 4.46Å; R464-F539 HydrophobicContact CG-CB 4.31Å; Y465-F539 PolarHBondContact N-O 3.07Å; M537-F539 HydrophobicContact CB-CE1 4.23Å; M537-F539 HydrophobicContact CB-CZ 4.43Å; F539-M567 WeakPolarHBondContact CA-O 3.39Å; F539-M567 HydrophobicContact CD1-CB 3.69Å; F539-M567 HydrophobicContact CD1-CG 3.94Å; F539-M567 HydrophobicContact CD1-SD 4.35Å; F539-M567 HydrophobicContact CE1-CB 4.04Å; F539-M567 HydrophobicContact CE1-CG 3.74Å; F539-M567 HydrophobicContact CE1-SD 3.89Å; F539-M567 HydrophobicContact CZ-SD 4.35Å
540	L	94.6	Very high	88.3	Confident	0 Å²	0	20 Å²	20	0%	0	10%	0.096	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	109.4	-176	-58.1	178.2	0	0	0	109.6	Y465 L530 L538 P543 I559 M567 L568 V569	Y465-L540 VanDerWaalsContact CB-CD2 3.48Å; Y465-L540 HydrophobicContact CG-CD2 4.35Å; L530-L540 HydrophobicContact CD2-CD2 4.12Å; L538-L540 HydrophobicContact CD1-CD2 4.11Å; L538-L540 HydrophobicContact CD2-CD1 3.79Å; L538-L540 HydrophobicContact CD2-CD2 3.92Å; L538-L540 HydrophobicContact CD2-CG 3.94Å; L538-L540 HydrophobicContact CG-CD1 4.3Å; L538-L540 HydrophobicContact CG-CD2 3.73Å; L538-L540 HydrophobicContact CG-CG 3.88Å; L540-P543 HydrophobicContact CB-CB 4.36Å; L540-P543 HydrophobicContact CB-CG 3.97Å; L540-P543 HydrophobicContact CD1-CG 4.44Å; L540-I559 HydrophobicContact CD1-CD1 3.41Å; L540-I559 VanDerWaalsContact CD1-CD1 3.41Å; L540-I559 HydrophobicContact CD1-CG1 4.07Å; L540-M567 PolarHBondContact N-O 2.98Å; L540-L568 HydrophobicContact CB-CD1 3.74Å; L540-L568 HydrophobicContact CD1-CD1 4.24Å; L540-V569 PolarHBondContact O-N 2.9Å
541	D	92.8	Very high	87.8	Confident	11 Å²	11	20 Å²	20	6%	0.059	10%	0.096	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.6	103.5	177.4	-158.6	4	0	0	0	110.2	S437 L440 Y465	S437-D541 WeakPolarHBondContact CB-OD2 3.34Å; S437-D541 PolarHBondContact OG-OD1 2.86Å; S437-D541 PolarHBondContact OG-OD2 3.19Å; L440-D541 HydrophobicContact CD1-CB 3.74Å; Y465-D541 WeakPolarHBondContact O-CB 3.14Å; Y465-D541 PolarHBondContact O-N 3.46Å
542	E	88.9	Confident	87.5	Confident	16 Å²	16	20 Å²	20	8%	0.075	10%	0.095	C	C	.	.	S	Bend	trans	49.5	59.6	-177.4	-62.2	-64.4	152.8	0	0	113.9	T544 N545 V569 S570 H571	E542-T544 VanDerWaalsContact C-N 3.26Å; E542-T544 PolarHBondContact O-N 3.31Å; E542-N545 WeakPolarHBondContact CB-ND2 3.26Å; E542-N545 PolarHBondContact O-ND2 2.96Å; E542-V569 VanDerWaalsContact CA-O 3.3Å; E542-V569 WeakPolarHBondContact CA-O 3.49Å; E542-V569 HydrophobicContact CG-CG1 4.47Å; E542-V569 PolarHBondContact N-O 2.66Å; E542-S570 WeakPolarHBondContact OE1-CA 3.24Å; E542-S570 WeakPolarHBondContact OE2-CA 3.44Å; E542-H571 IonicContact OE1-CD2 2.66Å; E542-H571 PolarHBondContact OE1-CD2 2.93Å; E542-H571 IonicContact OE1-CE1 2.84Å; E542-H571 IonicContact OE1-CG 2.82Å; E542-H571 PolarHBondContact OE1-N 2.91Å; E542-H571 IonicContact OE1-NE2 2.83Å; E542-H571 PolarHBondContact OE1-NE2 3.39Å; E542-H571 IonicContact OE2-CD2 2.9Å; E542-H571 PolarHBondContact OE2-CD2 3.39Å; E542-H571 IonicContact OE2-CG 2.92Å; E542-H571 PolarHBondContact OE2-N 2.85Å
543	P	87.6	Confident	87.4	Confident	1 Å²	1	18.4 Å²	18.4	1%	0.006	9%	0.092	C	C	.	.	T	Hydrogen-bonded Turn	trans	-72.5	-16.1	-176.5	33.9	-38.8	0	0	0	113.9	Y465 L540 N545 L547 L555 L568 V569 L575	Y465-P543 HydrophobicContact CD1-CB 4.03Å; Y465-P543 HydrophobicContact CE1-CB 4.15Å; L540-P543 HydrophobicContact CB-CB 4.36Å; L540-P543 HydrophobicContact CB-CG 3.97Å; L540-P543 HydrophobicContact CD1-CG 4.44Å; P543-N545 VanDerWaalsContact C-N 3.34Å; P543-L547 WeakPolarHBondContact O-CD1 3.31Å; P543-L555 HydrophobicContact CB-CD2 3.81Å; P543-L555 HydrophobicContact CG-CD2 4.02Å; P543-L568 HydrophobicContact CG-CD1 3.61Å; P543-V569 WeakPolarHBondContact CD-O 3.46Å; P543-L575 HydrophobicContact CG-CD2 4.15Å
544	T	83.9	Confident	87.3	Confident	17 Å²	17	15.9 Å²	15.9	10%	0.104	8%	0.08	C	C	.	.	T	Hydrogen-bonded Turn	trans	-78.4	-15.7	-176.8	51.3	0	0	0	0	113.7	E542 H546 L547 I552 D572 L575	E542-T544 VanDerWaalsContact C-N 3.26Å; E542-T544 PolarHBondContact O-N 3.31Å; T544-H546 PolarHBondContact O-N 2.82Å; T544-L547 WeakPolarHBondContact O-CB 3.39Å; T544-L547 PolarHBondContact O-N 2.88Å; T544-L547 VanDerWaalsContact O-N 3.1Å; T544-I552 HydrophobicContact CG2-CD1 4.25Å; T544-I552 HydrophobicContact CG2-CG1 4.21Å; T544-I552 HydrophobicContact CG2-CG2 4.28Å; T544-D572 HydrophobicContact CG2-CB 3.94Å; T544-L575 HydrophobicContact CG2-CB 4.36Å; T544-L575 HydrophobicContact CG2-CD2 3.38Å; T544-L575 HydrophobicContact CG2-CG 4.46Å
545	N	79.9	Confident	87.2	Confident	20 Å²	20	13.4 Å²	13.4	11%	0.107	7%	0.067	C	C	.	.	T	Hydrogen-bonded Turn	trans	-56.2	127.3	179	-73.6	-33.6	0	0	0	111	Q467 E542 P543 L547	Q467-N545 PolarHBondContact NE2-ND2 3.04Å; E542-N545 WeakPolarHBondContact CB-ND2 3.26Å; E542-N545 PolarHBondContact O-ND2 2.96Å; P543-N545 VanDerWaalsContact C-N 3.34Å; N545-L547 PolarHBondContact O-N 2.78Å
546	H	74.9	Confident	87.1	Confident	77 Å²	77	13.3 Å²	13.3	36%	0.356	7%	0.066	S	C	.	.	T	Hydrogen-bonded Turn	trans	65.3	9.2	179.3	-42.2	-68.6	0	0	0	115.8	N120 D519 T544	N120-H546 PolarHBondContact ND2-O 2.87Å; D519-H546 HydrophobicContact CB-CB 3.92Å; T544-H546 PolarHBondContact O-N 2.82Å
547	L	79.4	Confident	86.9	Confident	1 Å²	1	16.8 Å²	16.8	1%	0.005	9%	0.086	C	C	.	.			trans	-88.5	140.9	173.5	-66.7	-172.4	0	0	0	111	H283 C523 P543 T544 N545 T551 I552 L555	H283-L547 WeakPolarHBondContact CB-O 3.42Å; H283-L547 PolarHBondContact CD2-O 3.35Å; H283-L547 VanDerWaalsContact CD2-O 3.27Å; H283-L547 PolarHBondContact ND1-O 3.38Å; C523-L547 HydrophobicContact CB-CD2 3.76Å; C523-L547 VanDerWaalsContact SG-CD2 3.59Å; P543-L547 WeakPolarHBondContact O-CD1 3.31Å; T544-L547 WeakPolarHBondContact O-CB 3.39Å; T544-L547 PolarHBondContact O-N 2.88Å; T544-L547 VanDerWaalsContact O-N 3.1Å; N545-L547 PolarHBondContact O-N 2.78Å; L547-T551 HydrophobicContact CB-CG2 4.41Å; L547-T551 HydrophobicContact CD1-CG2 4Å; L547-T551 HydrophobicContact CD2-CG2 3.6Å; L547-T551 HydrophobicContact CG-CG2 4.22Å; L547-I552 HydrophobicContact CB-CD1 4.4Å; L547-I552 HydrophobicContact CB-CG1 3.79Å; L547-I552 HydrophobicContact CD1-CG1 4.45Å; L547-L555 HydrophobicContact CD1-CD2 4.35Å
548	D	79	Confident	86.7	Confident	8 Å²	8	16.8 Å²	16.8	4%	0.043	9%	0.086	C	C	.	.			trans	-75.4	163.9	166.9	55.5	26.9	0	0	0	111.5	N120 H283 R524 E550 T551 I552	N120-D548 PolarHBondContact ND2-N 2.93Å; H283-D548 WeakPolarHBondContact ND1-CA 3.36Å; R524-D548 IonicContact NH2-OD1 3.51Å; R524-D548 IonicContact NH2-OD2 3.6Å; D548-E550 PolarHBondContact O-N 2.97Å; D548-T551 PolarHBondContact O-N 3.26Å; D548-T551 WeakPolarHBondContact OD1-CB 3.41Å; D548-T551 PolarHBondContact OD1-N 3.29Å; D548-T551 PolarHBondContact OD1-OG1 3.35Å; D548-I552 WeakPolarHBondContact O-CG1 3.15Å; D548-I552 PolarHBondContact O-N 3.21Å
549	I	80.6	Confident	86.6	Confident	9 Å²	9	16.8 Å²	16.8	5%	0.046	9%	0.086	C	C	.	.	H	α-helix	trans	-57	-42	-174.3	-67	174	0	0	0	110.4	H283 Q285 L288 Y310 T551 I552 D553	H283-I549 WeakPolarHBondContact O-CG1 3.39Å; Q285-I549 HydrophobicContact CG-CD1 4.34Å; Q285-I549 HydrophobicContact CG-CG2 4.06Å; L288-I549 HydrophobicContact CD1-CD1 4.36Å; Y310-I549 HydrophobicContact CE2-CD1 3.82Å; I549-T551 VanDerWaalsContact C-N 3.34Å; I549-T551 PolarHBondContact O-N 3.46Å; I549-I552 PolarHBondContact O-N 2.88Å; I549-D553 PolarHBondContact O-N 2.9Å
550	E	80.1	Confident	86.5	Confident	55 Å²	55	20.8 Å²	20.8	26%	0.257	11%	0.107	S	C	.	.	H	α-helix	trans	-66.8	-35.7	179.3	-60.3	80.2	-177.8	0	0	112	D548 A554	D548-E550 PolarHBondContact O-N 2.97Å; E550-A554 PolarHBondContact O-N 2.93Å
551	T	81.9	Confident	86.4	Confident	0 Å²	0	26.6 Å²	26.6	0%	0	14%	0.135	C	C	.	.	H	α-helix	trans	-71.9	-34.1	175.2	-56.6	0	0	0	0	112	F383 R524 L547 D548 I549 D553 A554 L555	F383-T551 HydrophobicContact CE2-CG2 3.51Å; F383-T551 HydrophobicContact CZ-CG2 3.44Å; F383-T551 VanDerWaalsContact CZ-CG2 3.44Å; R524-T551 PolarHBondContact NH2-OG1 2.86Å; L547-T551 HydrophobicContact CB-CG2 4.41Å; L547-T551 HydrophobicContact CD1-CG2 4Å; L547-T551 HydrophobicContact CD2-CG2 3.6Å; L547-T551 HydrophobicContact CG-CG2 4.22Å; D548-T551 PolarHBondContact O-N 3.26Å; D548-T551 WeakPolarHBondContact OD1-CB 3.41Å; D548-T551 PolarHBondContact OD1-N 3.29Å; D548-T551 PolarHBondContact OD1-OG1 3.35Å; I549-T551 VanDerWaalsContact C-N 3.34Å; I549-T551 PolarHBondContact O-N 3.46Å; T551-D553 VanDerWaalsContact C-N 3.34Å; T551-A554 PolarHBondContact O-N 2.98Å; T551-L555 WeakPolarHBondContact O-CB 3.41Å; T551-L555 PolarHBondContact O-N 3.44Å
552	I	85.4	Confident	86.4	Confident	2 Å²	2	26.3 Å²	26.3	1%	0.01	13%	0.133	C	C	.	.	H	α-helix	trans	-64	-43.4	174.5	-64.8	169.5	0	0	0	110	H283 T544 L547 D548 I549 L555 A556 L575	H283-I552 HydrophobicContact CB-CD1 4.41Å; T544-I552 HydrophobicContact CG2-CD1 4.25Å; T544-I552 HydrophobicContact CG2-CG1 4.21Å; T544-I552 HydrophobicContact CG2-CG2 4.28Å; L547-I552 HydrophobicContact CB-CD1 4.4Å; L547-I552 HydrophobicContact CB-CG1 3.79Å; L547-I552 HydrophobicContact CD1-CG1 4.45Å; D548-I552 WeakPolarHBondContact O-CG1 3.15Å; D548-I552 PolarHBondContact O-N 3.21Å; I549-I552 PolarHBondContact O-N 2.88Å; I552-L555 WeakPolarHBondContact O-CB 3.18Å; I552-L555 PolarHBondContact O-N 3.37Å; I552-A556 PolarHBondContact O-N 2.94Å; I552-L575 HydrophobicContact CG2-CB 4.25Å; I552-L575 HydrophobicContact CG2-CD1 4.34Å
553	D	87.3	Confident	86.5	Confident	37 Å²	37	31.9 Å²	31.9	20%	0.198	16%	0.159	C	C	.	.	H	α-helix	trans	-61.9	-45.1	175.5	-79.3	-37.4	0	0	0	112.3	I549 T551 L555 A556 D557 R574 Q578	I549-D553 PolarHBondContact O-N 2.9Å; T551-D553 VanDerWaalsContact C-N 3.34Å; D553-L555 PolarHBondContact O-N 2.88Å; D553-A556 PolarHBondContact O-N 3.43Å; D553-A556 VanDerWaalsContact O-N 3.15Å; D553-D557 PolarHBondContact O-N 3.23Å; D553-R574 IonicContact OD1-CZ 2.65Å; D553-R574 IonicContact OD1-NE 3.73Å; D553-R574 IonicContact OD1-NH1 3.3Å; D553-R574 PolarHBondContact OD1-NH1 2.91Å; D553-R574 IonicContact OD1-NH2 2.76Å; D553-R574 PolarHBondContact OD1-NH2 3.46Å; D553-R574 IonicContact OD2-CZ 3.17Å; D553-R574 IonicContact OD2-NH1 3.72Å; D553-R574 PolarHBondContact OD2-NH1 3.11Å; D553-R574 IonicContact OD2-NH2 3.91Å; D553-R574 PolarHBondContact OD2-NH2 2.93Å; D553-Q578 PolarHBondContact OD1-NE2 2.9Å
554	A	88.2	Confident	86.8	Confident	3 Å²	3	31.8 Å²	31.8	3%	0.025	16%	0.158	C	C	.	.	H	α-helix	trans	-59.9	-34.2	175	0	0	0	0	0	112.9	L381 F383 E550 T551 A558	L381-A554 HydrophobicContact CB-CB 3.83Å; L381-A554 WeakPolarHBondContact O-CB 3.41Å; F383-A554 HydrophobicContact CD2-CB 3.98Å; F383-A554 HydrophobicContact CE2-CB 4.09Å; F383-A554 HydrophobicContact CG-CB 4.28Å; E550-A554 PolarHBondContact O-N 2.93Å; T551-A554 PolarHBondContact O-N 2.98Å; A554-A558 WeakPolarHBondContact O-CB 3.37Å; A554-A558 PolarHBondContact O-N 3.38Å
555	L	90.6	Very high	87.3	Confident	0 Å²	0	31 Å²	31	0%	0	15%	0.153	C	C	.	.	H	α-helix	trans	-71.4	-43.4	175	179.3	65.3	0	0	0	111.6	F383 F385 L527 P543 L547 T551 I552 D553 D557 A558 I559	F383-L555 HydrophobicContact CD2-CB 4.07Å; F383-L555 HydrophobicContact CD2-CD1 4.46Å; F383-L555 HydrophobicContact CE2-CB 4.28Å; F385-L555 HydrophobicContact CE2-CD1 4.48Å; L527-L555 HydrophobicContact CD1-CD1 4.31Å; L527-L555 HydrophobicContact CD2-CD1 4.06Å; P543-L555 HydrophobicContact CB-CD2 3.81Å; P543-L555 HydrophobicContact CG-CD2 4.02Å; L547-L555 HydrophobicContact CD1-CD2 4.35Å; T551-L555 WeakPolarHBondContact O-CB 3.41Å; T551-L555 PolarHBondContact O-N 3.44Å; I552-L555 WeakPolarHBondContact O-CB 3.18Å; I552-L555 PolarHBondContact O-N 3.37Å; D553-L555 PolarHBondContact O-N 2.88Å; L555-D557 VanDerWaalsContact C-N 3.34Å; L555-D557 PolarHBondContact O-N 3.4Å; L555-A558 PolarHBondContact O-N 3.4Å; L555-I559 HydrophobicContact CD1-CD1 4Å; L555-I559 HydrophobicContact CD1-CG1 4.24Å; L555-I559 HydrophobicContact CD2-CD1 4.45Å; L555-I559 HydrophobicContact CG-CD1 3.79Å; L555-I559 HydrophobicContact CG-CG1 4.44Å; L555-I559 WeakPolarHBondContact O-CB 3.27Å; L555-I559 VanDerWaalsContact O-CG1 3.24Å; L555-I559 WeakPolarHBondContact O-CG1 3.44Å; L555-I559 PolarHBondContact O-N 2.84Å
556	A	91.9	Very high	88	Confident	0 Å²	0	30 Å²	30	0%	0	15%	0.148	C	C	.	.	H	α-helix	trans	-59	-46.6	177.1	0	0	0	0	0	111.3	I552 D553 A558 I559 N560 L575 Q578 V579	I552-A556 PolarHBondContact O-N 2.94Å; D553-A556 PolarHBondContact O-N 3.43Å; D553-A556 VanDerWaalsContact O-N 3.15Å; A556-A558 PolarHBondContact O-N 3.25Å; A556-I559 PolarHBondContact O-N 3.46Å; A556-N560 WeakPolarHBondContact O-CB 3.35Å; A556-N560 PolarHBondContact O-N 2.91Å; A556-N560 PolarHBondContact O-ND2 2.85Å; A556-L575 HydrophobicContact CB-CD1 3.76Å; A556-Q578 HydrophobicContact CB-CB 4.2Å; A556-V579 HydrophobicContact CB-CG1 3.96Å
557	D	92.2	Very high	89	Confident	95 Å²	95	26.4 Å²	26.4	51%	0.508	13%	0.131	S	C	.	.	H	α-helix	trans	-60.1	-46	177.3	-70.2	-20	0	0	0	111.5	D553 L555 I559 N560 E561	D553-D557 PolarHBondContact O-N 3.23Å; L555-D557 VanDerWaalsContact C-N 3.34Å; L555-D557 PolarHBondContact O-N 3.4Å; D557-I559 VanDerWaalsContact C-N 3.34Å; D557-I559 PolarHBondContact O-N 3.48Å; D557-N560 PolarHBondContact O-N 3.34Å; D557-E561 PolarHBondContact O-N 2.84Å
558	A	91.6	Very high	89.8	Confident	0 Å²	0	26.3 Å²	26.3	0%	0	13%	0.131	C	C	.	.	H	α-helix	trans	-65.7	-35.7	179.8	0	0	0	0	0	113.4	F383 F385 A554 L555 A556 F562	F383-A558 VanDerWaalsContact C-CB 3.48Å; F383-A558 HydrophobicContact CB-CB 3.5Å; F383-A558 WeakPolarHBondContact O-CB 3.46Å; F385-A558 HydrophobicContact CD2-CB 3.93Å; F385-A558 HydrophobicContact CE2-CB 4.01Å; A554-A558 WeakPolarHBondContact O-CB 3.37Å; A554-A558 PolarHBondContact O-N 3.38Å; L555-A558 PolarHBondContact O-N 3.4Å; A556-A558 PolarHBondContact O-N 3.25Å; A558-F562 PolarHBondContact O-N 2.91Å; A558-F562 VanDerWaalsContact O-N 3.15Å
559	I	93.1	Very high	90.5	Very high	0 Å²	0	26 Å²	26	0%	0	13%	0.13	C	C	.	.	H	α-helix	trans	-67.6	-39.2	174.2	-70.9	167.6	0	0	0	110.6	F385 L538 L540 L555 A556 D557 E561 F562 M566 V579	F385-I559 HydrophobicContact CE2-CG1 4.4Å; L538-I559 HydrophobicContact CD2-CG1 4.37Å; L540-I559 HydrophobicContact CD1-CD1 3.41Å; L540-I559 VanDerWaalsContact CD1-CD1 3.41Å; L540-I559 HydrophobicContact CD1-CG1 4.07Å; L555-I559 HydrophobicContact CD1-CD1 4Å; L555-I559 HydrophobicContact CD1-CG1 4.24Å; L555-I559 HydrophobicContact CD2-CD1 4.45Å; L555-I559 HydrophobicContact CG-CD1 3.79Å; L555-I559 HydrophobicContact CG-CG1 4.44Å; L555-I559 WeakPolarHBondContact O-CB 3.27Å; L555-I559 VanDerWaalsContact O-CG1 3.24Å; L555-I559 WeakPolarHBondContact O-CG1 3.44Å; L555-I559 PolarHBondContact O-N 2.84Å; A556-I559 PolarHBondContact O-N 3.46Å; D557-I559 VanDerWaalsContact C-N 3.34Å; D557-I559 PolarHBondContact O-N 3.48Å; I559-E561 VanDerWaalsContact C-N 3.33Å; I559-F562 WeakPolarHBondContact O-CB 3.32Å; I559-F562 PolarHBondContact O-N 2.89Å; I559-M566 HydrophobicContact CD1-SD 4.41Å; I559-M566 HydrophobicContact CG2-CE 4.43Å; I559-M566 HydrophobicContact CG2-CG 4.37Å; I559-M566 HydrophobicContact CG2-SD 3.24Å; I559-M566 WeakPolarHBondContact CG2-SD 3.16Å; I559-V579 HydrophobicContact CB-CB 4.43Å; I559-V579 HydrophobicContact CB-CG1 4.01Å; I559-V579 HydrophobicContact CD1-CG1 4.37Å; I559-V579 HydrophobicContact CG2-CB 3.68Å; I559-V579 HydrophobicContact CG2-CG1 3.82Å; I559-V579 HydrophobicContact CG2-CG2 4.22Å
560	N	93.1	Very high	90.9	Very high	85 Å²	85	25.7 Å²	25.7	46%	0.455	13%	0.128	S	C	.	.	H	α-helix	trans	-68.3	-32.8	178.5	-77.9	-25.7	0	0	0	112.6	A556 D557 F562 Q578	A556-N560 WeakPolarHBondContact O-CB 3.35Å; A556-N560 PolarHBondContact O-N 2.91Å; A556-N560 PolarHBondContact O-ND2 2.85Å; D557-N560 PolarHBondContact O-N 3.34Å; N560-F562 VanDerWaalsContact C-N 3.34Å; N560-Q578 PolarHBondContact ND2-O 3.26Å; N560-Q578 PolarHBondContact OD1-O 2.97Å
561	E	91.9	Very high	91.1	Very high	122 Å²	122	24.5 Å²	24.5	57%	0.57	12%	0.122	S	C	*	.	H	α-helix	trans	-77.1	-17	172.3	-69.9	-175.4	177	0	0	113.6	D557 I559 E563	D557-E561 PolarHBondContact O-N 2.84Å; I559-E561 VanDerWaalsContact C-N 3.33Å; E561-E563 PolarHBondContact O-N 3.32Å
562	F	93.3	Very high	91.3	Very high	4 Å²	4	25 Å²	25	2%	0.018	13%	0.125	C	C	.	.			trans	-70.7	128.1	-178.3	177	-120	0	0	0	111.6	F385 R425 P535 L538 A558 I559 N560 G564	F385-F562 HydrophobicContact CB-CB 4.14Å; F385-F562 HydrophobicContact CB-CD2 3.58Å; F385-F562 HydrophobicContact CB-CE2 4.36Å; F385-F562 HydrophobicContact CB-CG 4.16Å; F385-F562 HydrophobicContact CD2-CB 4.45Å; F385-F562 HydrophobicContact CG-CD2 4.33Å; R425-F562 PolarHBondContact NH2-O 3.34Å; P535-F562 WeakPolarHBondContact O-CE2 3.37Å; P535-F562 VanDerWaalsContact O-CZ 3.27Å; P535-F562 WeakPolarHBondContact O-CZ 3.31Å; L538-F562 HydrophobicContact CB-CD1 4.33Å; L538-F562 HydrophobicContact CB-CE1 3.76Å; L538-F562 HydrophobicContact CB-CZ 4.33Å; A558-F562 PolarHBondContact O-N 2.91Å; A558-F562 VanDerWaalsContact O-N 3.15Å; I559-F562 WeakPolarHBondContact O-CB 3.32Å; I559-F562 PolarHBondContact O-N 2.89Å; N560-F562 VanDerWaalsContact C-N 3.34Å; F562-G564 WeakPolarHBondContact CD1-O 3.33Å; F562-G564 VanDerWaalsContact CE1-CA 3.4Å; F562-G564 VanDerWaalsContact CE1-O 3.27Å; F562-G564 WeakPolarHBondContact CE1-O 3.49Å; F562-G564 VanDerWaalsContact CZ-CA 3.46Å
563	E	91.7	Very high	91.5	Very high	133 Å²	133	25.2 Å²	25.2	62%	0.621	13%	0.126	S	C	*	.			trans	-86.9	-11.1	-176	-63	-174.5	163.5	0	0	114.5	E561	E561-E563 PolarHBondContact O-N 3.32Å
564	G	92.7	Very high	91.4	Very high	0 Å²	0	25.8 Å²	25.8	0%	0	13%	0.125	C	C	.	.	S	Bend	trans	-90.1	175.7	179.9	0	0	0	0	0	113.4	L422 R425 H536 F562	L422-G564 CarbonylContact O-C 3.46Å; R425-G564 PolarHBondContact NH1-O 2.91Å; R425-G564 PolarHBondContact NH2-O 2.87Å; H536-G564 CarbonylContact O-C 3.55Å; H536-G564 VanDerWaalsContact O-CA 3.28Å; H536-G564 WeakPolarHBondContact O-CA 3.41Å; F562-G564 WeakPolarHBondContact CD1-O 3.33Å; F562-G564 VanDerWaalsContact CE1-CA 3.4Å; F562-G564 VanDerWaalsContact CE1-O 3.27Å; F562-G564 WeakPolarHBondContact CE1-O 3.49Å; F562-G564 VanDerWaalsContact CZ-CA 3.46Å
565	G	94.4	Very high	91.5	Very high	0 Å²	0	25.7 Å²	25.7	0%	0	12%	0.124	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.2	149.9	-178.1	0	0	0	0	0	112.3	L422 H536 M537 L538	L422-G565 VanDerWaalsContact O-CA 3.26Å; L422-G565 WeakPolarHBondContact O-CA 3.2Å; L422-G565 PolarHBondContact O-N 3.17Å; L422-G565 VanDerWaalsContact O-N 3.1Å; H536-G565 PolarHBondContact O-N 3Å; M537-G565 CarbonylContact C-O 3.46Å; M537-G565 VanDerWaalsContact CA-O 3.29Å; M537-G565 WeakPolarHBondContact CA-O 3.33Å; L538-G565 PolarHBondContact N-O 2.99Å
566	M	94.9	Very high	91.6	Very high	0 Å²	0	25.7 Å²	25.7	0%	0	12%	0.124	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.8	136.4	-177.4	-175.8	-146	55.3	0	0	112.2	T424 R425 V426 L538 I559 L568 V579	T424-M566 PolarHBondContact O-N 3.3Å; R425-M566 HydrophobicContact CB-CE 4.4Å; V426-M566 PolarHBondContact N-O 3Å; V426-M566 VanDerWaalsContact N-O 3.08Å; L538-M566 HydrophobicContact CB-CG 4.44Å; L538-M566 CarbonylContact O-C 3.49Å; L538-M566 VanDerWaalsContact O-CA 3.29Å; L538-M566 WeakPolarHBondContact O-CA 3.41Å; I559-M566 HydrophobicContact CD1-SD 4.41Å; I559-M566 HydrophobicContact CG2-CE 4.43Å; I559-M566 HydrophobicContact CG2-CG 4.37Å; I559-M566 HydrophobicContact CG2-SD 3.24Å; I559-M566 WeakPolarHBondContact CG2-SD 3.16Å; M566-L568 HydrophobicContact CE-CB 4.15Å; M566-L568 HydrophobicContact SD-CB 4.17Å; M566-V579 HydrophobicContact CE-CB 4.48Å; M566-V579 HydrophobicContact CE-CG2 3.97Å; M566-V579 HydrophobicContact SD-CG2 4.06Å
567	M	96	Very high	91.6	Very high	0 Å²	0	30.6 Å²	30.6	0%	0	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	126	159.9	-62.8	-171.4	75.9	0	0	110.4	I420 V426 L439 L440 L443 L538 F539 L540 W584	I420-M567 HydrophobicContact CD1-CG 4.4Å; I420-M567 HydrophobicContact CD1-SD 3.39Å; I420-M567 WeakPolarHBondContact CD1-SD 3.28Å; I420-M567 HydrophobicContact CG1-SD 4.33Å; V426-M567 HydrophobicContact CG1-CE 4.32Å; V426-M567 CarbonylContact O-C 3.59Å; V426-M567 WeakPolarHBondContact O-CA 3.34Å; L439-M567 HydrophobicContact CD2-CE 3.97Å; L440-M567 HydrophobicContact CD2-CB 4.29Å; L440-M567 HydrophobicContact CD2-SD 4.36Å; L443-M567 HydrophobicContact CD1-CE 4.4Å; L443-M567 HydrophobicContact CD1-SD 3.49Å; L443-M567 WeakPolarHBondContact CD1-SD 3.32Å; L538-M567 PolarHBondContact O-N 3.06Å; F539-M567 WeakPolarHBondContact CA-O 3.39Å; F539-M567 HydrophobicContact CD1-CB 3.69Å; F539-M567 HydrophobicContact CD1-CG 3.94Å; F539-M567 HydrophobicContact CD1-SD 4.35Å; F539-M567 HydrophobicContact CE1-CB 4.04Å; F539-M567 HydrophobicContact CE1-CG 3.74Å; F539-M567 HydrophobicContact CE1-SD 3.89Å; F539-M567 HydrophobicContact CZ-SD 4.35Å; L540-M567 PolarHBondContact N-O 2.98Å; M567-W584 HydrophobicContact CE-CE3 4.14Å; M567-W584 HydrophobicContact CE-CZ3 4.1Å
568	L	95.6	Very high	91.6	Very high	0 Å²	0	29.2 Å²	29.2	0%	0	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	126.2	178.3	176.4	66.5	0	0	0	110.1	V426 A427 L428 L540 P543 M566 L575 I576 V579	V426-L568 PolarHBondContact O-N 3.48Å; A427-L568 CarbonylContact C-O 3.45Å; A427-L568 VanDerWaalsContact CA-O 3.24Å; A427-L568 WeakPolarHBondContact CA-O 3.36Å; L428-L568 PolarHBondContact N-O 3.24Å; L540-L568 HydrophobicContact CB-CD1 3.74Å; L540-L568 HydrophobicContact CD1-CD1 4.24Å; P543-L568 HydrophobicContact CG-CD1 3.61Å; M566-L568 HydrophobicContact CE-CB 4.15Å; M566-L568 HydrophobicContact SD-CB 4.17Å; L568-L575 HydrophobicContact CD1-CD2 4.09Å; L568-L575 HydrophobicContact CD2-CD2 3.87Å; L568-L575 HydrophobicContact CD2-CG 3.85Å; L568-I576 HydrophobicContact CD2-CG1 4.14Å; L568-V579 HydrophobicContact CD2-CG2 3.59Å
569	V	93.6	Very high	91.6	Very high	2 Å²	2	29.4 Å²	29.4	1%	0.012	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	118.4	161.2	-179.4	0	0	0	0	105.8	L428 K436 L440 L540 E542 P543	L428-V569 HydrophobicContact CB-CG2 4.02Å; L428-V569 HydrophobicContact CD2-CG2 4.03Å; L428-V569 HydrophobicContact CG-CG2 4.47Å; K436-V569 HydrophobicContact CB-CG1 4.11Å; K436-V569 HydrophobicContact CB-CG2 4.16Å; K436-V569 HydrophobicContact CD-CG1 3.99Å; L440-V569 HydrophobicContact CD1-CG2 3.94Å; L540-V569 PolarHBondContact O-N 2.9Å; E542-V569 VanDerWaalsContact CA-O 3.3Å; E542-V569 WeakPolarHBondContact CA-O 3.49Å; E542-V569 HydrophobicContact CG-CG1 4.47Å; E542-V569 PolarHBondContact N-O 2.66Å; P543-V569 WeakPolarHBondContact CD-O 3.46Å
570	S	89.4	Confident	91.7	Very high	2 Å²	2	30.2 Å²	30.2	1%	0.014	15%	0.146	C	C	.	.			trans	-151.1	151.7	179.4	-177.3	0	0	0	0	109.5	E542 D572 I576	E542-S570 WeakPolarHBondContact OE1-CA 3.24Å; E542-S570 WeakPolarHBondContact OE2-CA 3.44Å; S570-D572 WeakPolarHBondContact OG-CB 3.34Å; S570-D572 PolarHBondContact OG-N 2.99Å; S570-I576 WeakPolarHBondContact O-CD1 3.23Å
571	H	84.1	Confident	91.7	Very high	30 Å²	30	33.6 Å²	33.6	14%	0.139	16%	0.159	C	C	.	.	S	Bend	trans	-96.3	1.9	166.5	-66	-54.4	0	0	0	113.7	L259 D260 L261 K436 E542	L259-H571 PolarHBondContact O-CD2 3.27Å; L259-H571 PolarHBondContact O-NE2 3.39Å; D260-H571 WeakPolarHBondContact CA-CE1 3.43Å; L261-H571 HydrophobicContact CD2-CB 4.32Å; L261-H571 VanDerWaalsContact CD2-O 3.26Å; L261-H571 WeakPolarHBondContact CD2-O 3.5Å; L261-H571 PolarHBondContact N-ND1 3.46Å; K436-H571 PolarHBondContact NZ-CE1 3.27Å; E542-H571 IonicContact OE1-CD2 2.66Å; E542-H571 PolarHBondContact OE1-CD2 2.93Å; E542-H571 IonicContact OE1-CE1 2.84Å; E542-H571 IonicContact OE1-CG 2.82Å; E542-H571 PolarHBondContact OE1-N 2.91Å; E542-H571 IonicContact OE1-NE2 2.83Å; E542-H571 PolarHBondContact OE1-NE2 3.39Å; E542-H571 IonicContact OE2-CD2 2.9Å; E542-H571 PolarHBondContact OE2-CD2 3.39Å; E542-H571 IonicContact OE2-CG 2.92Å; E542-H571 PolarHBondContact OE2-N 2.85Å
572	D	87.1	Confident	91.8	Very high	10 Å²	10	30.8 Å²	30.8	5%	0.053	15%	0.145	C	C	.	.			trans	-91	105.8	178	-169.8	-20.8	0	0	0	111.7	T544 S570 R574 L575 I576	T544-D572 HydrophobicContact CG2-CB 3.94Å; S570-D572 WeakPolarHBondContact OG-CB 3.34Å; S570-D572 PolarHBondContact OG-N 2.99Å; D572-R574 PolarHBondContact O-N 3.24Å; D572-R574 WeakPolarHBondContact OD1-CB 3.44Å; D572-R574 PolarHBondContact OD1-N 3.08Å; D572-L575 HydrophobicContact CB-CB 4.07Å; D572-L575 PolarHBondContact O-N 2.95Å; D572-L575 PolarHBondContact OD1-N 3.08Å; D572-I576 WeakPolarHBondContact O-CD1 3.42Å; D572-I576 VanDerWaalsContact O-CG1 3.27Å; D572-I576 WeakPolarHBondContact O-CG1 3.28Å; D572-I576 PolarHBondContact O-N 2.98Å; D572-I576 VanDerWaalsContact O-N 3.09Å
573	F	88.3	Confident	91.9	Very high	6 Å²	6	30.8 Å²	30.8	3%	0.026	15%	0.146	C	C	.	.	H	α-helix	trans	-52.6	-39.3	176.3	-77.7	-84.9	0	0	0	113.1	L261 V265 D286 Q577 I598 K602	L261-F573 HydrophobicContact CB-CZ 4.17Å; L261-F573 HydrophobicContact CD2-CD2 4.02Å; L261-F573 HydrophobicContact CD2-CE1 4.28Å; L261-F573 HydrophobicContact CD2-CE2 3.58Å; L261-F573 HydrophobicContact CD2-CZ 3.7Å; L261-F573 HydrophobicContact CG-CZ 4.37Å; V265-F573 HydrophobicContact CG2-CE2 3.87Å; V265-F573 HydrophobicContact CG2-CZ 3.61Å; D286-F573 HydrophobicContact CB-CB 4.19Å; D286-F573 VanDerWaalsContact OD2-CD2 3.28Å; D286-F573 WeakPolarHBondContact OD2-CD2 3.48Å; F573-Q577 VanDerWaalsContact O-CB 3.32Å; F573-Q577 WeakPolarHBondContact O-CB 3.22Å; F573-Q577 PolarHBondContact O-N 3.22Å; F573-I598 HydrophobicContact CD1-CD1 4.27Å; F573-I598 HydrophobicContact CD1-CG1 3.66Å; F573-I598 HydrophobicContact CE1-CD1 4.3Å; F573-I598 HydrophobicContact CE1-CG1 4.14Å; F573-K602 HydrophobicContact CD1-CB 4.1Å; F573-K602 HydrophobicContact CD1-CD 4.13Å; F573-K602 HydrophobicContact CD1-CG 4.37Å; F573-K602 HydrophobicContact CE1-CB 3.55Å; F573-K602 HydrophobicContact CE1-CD 4.04Å; F573-K602 HydrophobicContact CE1-CG 3.82Å; F573-K602 HydrophobicContact CE2-CD 4.46Å; F573-K602 HydrophobicContact CG-CD 4.46Å; F573-K602 HydrophobicContact CZ-CB 4.16Å; F573-K602 HydrophobicContact CZ-CD 4.21Å; F573-K602 HydrophobicContact CZ-CG 3.96Å
574	R	85.6	Confident	92.1	Very high	50 Å²	50	25.5 Å²	25.5	19%	0.189	12%	0.12	C	C	.	.	H	α-helix	trans	-71.8	-48.2	-176.1	-179.7	179.5	176.8	-131.2	8.9	111.1	Q285 D553 D572 I576 Q577 Q578	Q285-R574 VanDerWaalsContact OE1-CD 3.23Å; D553-R574 IonicContact OD1-CZ 2.65Å; D553-R574 IonicContact OD1-NE 3.73Å; D553-R574 IonicContact OD1-NH1 3.3Å; D553-R574 PolarHBondContact OD1-NH1 2.91Å; D553-R574 IonicContact OD1-NH2 2.76Å; D553-R574 PolarHBondContact OD1-NH2 3.46Å; D553-R574 IonicContact OD2-CZ 3.17Å; D553-R574 IonicContact OD2-NH1 3.72Å; D553-R574 PolarHBondContact OD2-NH1 3.11Å; D553-R574 IonicContact OD2-NH2 3.91Å; D553-R574 PolarHBondContact OD2-NH2 2.93Å; D572-R574 PolarHBondContact O-N 3.24Å; D572-R574 WeakPolarHBondContact OD1-CB 3.44Å; D572-R574 PolarHBondContact OD1-N 3.08Å; R574-I576 VanDerWaalsContact C-N 3.27Å; R574-I576 PolarHBondContact O-N 2.64Å; R574-Q577 PolarHBondContact O-N 3.36Å; R574-Q578 HydrophobicContact CG-CG 4.5Å; R574-Q578 WeakPolarHBondContact O-CG 3.37Å; R574-Q578 PolarHBondContact O-N 3.45Å
575	L	90.5	Very high	92.2	Very high	0 Å²	0	25.8 Å²	25.8	0%	0	12%	0.122	C	C	.	.	H	α-helix	trans	-56.7	-48.1	176.7	178.6	64.8	0	0	0	109.7	P543 T544 I552 A556 L568 D572 Q577 Q578 V579	P543-L575 HydrophobicContact CG-CD2 4.15Å; T544-L575 HydrophobicContact CG2-CB 4.36Å; T544-L575 HydrophobicContact CG2-CD2 3.38Å; T544-L575 HydrophobicContact CG2-CG 4.46Å; I552-L575 HydrophobicContact CG2-CB 4.25Å; I552-L575 HydrophobicContact CG2-CD1 4.34Å; A556-L575 HydrophobicContact CB-CD1 3.76Å; L568-L575 HydrophobicContact CD1-CD2 4.09Å; L568-L575 HydrophobicContact CD2-CD2 3.87Å; L568-L575 HydrophobicContact CD2-CG 3.85Å; D572-L575 HydrophobicContact CB-CB 4.07Å; D572-L575 PolarHBondContact O-N 2.95Å; D572-L575 PolarHBondContact OD1-N 3.08Å; L575-Q577 VanDerWaalsContact C-N 3.33Å; L575-Q577 PolarHBondContact O-N 3.25Å; L575-Q578 PolarHBondContact O-N 3.12Å; L575-Q578 VanDerWaalsContact O-N 3.17Å; L575-V579 HydrophobicContact CD1-CG1 4.03Å; L575-V579 WeakPolarHBondContact O-CG2 3.39Å; L575-V579 PolarHBondContact O-N 3.23Å; L575-V579 VanDerWaalsContact O-N 3.12Å
576	I	92.8	Very high	92.2	Very high	1 Å²	1	25.8 Å²	25.8	1%	0.005	12%	0.122	C	C	.	.	H	α-helix	trans	-57.4	-47.2	178.1	-66.6	166.2	0	0	0	111	A427 V429 L568 S570 D572 R574 Q578 V579 A580 I583 I598	A427-I576 HydrophobicContact CB-CB 4.36Å; A427-I576 HydrophobicContact CB-CG1 4.09Å; A427-I576 HydrophobicContact CB-CG2 3.53Å; V429-I576 HydrophobicContact CG1-CD1 4.17Å; L568-I576 HydrophobicContact CD2-CG1 4.14Å; S570-I576 WeakPolarHBondContact O-CD1 3.23Å; D572-I576 WeakPolarHBondContact O-CD1 3.42Å; D572-I576 VanDerWaalsContact O-CG1 3.27Å; D572-I576 WeakPolarHBondContact O-CG1 3.28Å; D572-I576 PolarHBondContact O-N 2.98Å; D572-I576 VanDerWaalsContact O-N 3.09Å; R574-I576 VanDerWaalsContact C-N 3.27Å; R574-I576 PolarHBondContact O-N 2.64Å; I576-Q578 VanDerWaalsContact C-N 3.27Å; I576-Q578 PolarHBondContact O-N 3.04Å; I576-V579 PolarHBondContact O-N 2.82Å; I576-A580 HydrophobicContact CG2-CB 4.08Å; I576-A580 VanDerWaalsContact O-CB 3.23Å; I576-A580 WeakPolarHBondContact O-CB 3.3Å; I576-A580 PolarHBondContact O-N 3.03Å; I576-I583 HydrophobicContact CG2-CD1 3.42Å; I576-I583 VanDerWaalsContact CG2-CD1 3.42Å; I576-I598 HydrophobicContact CB-CG1 4.18Å; I576-I598 HydrophobicContact CD1-CD1 4.21Å; I576-I598 HydrophobicContact CD1-CG1 4.48Å; I576-I598 HydrophobicContact CG2-CB 3.87Å; I576-I598 HydrophobicContact CG2-CD1 3.86Å; I576-I598 HydrophobicContact CG2-CG1 3.68Å; I576-I598 HydrophobicContact CG2-CG2 4.29Å
577	Q	92.1	Very high	92	Very high	103 Å²	103	28.4 Å²	28.4	48%	0.481	13%	0.134	S	C	.	.	H	α-helix	trans	-60.9	-36.7	179.4	-169.2	179	4.5	0	0	112.7	F573 R574 L575 I598	F573-Q577 VanDerWaalsContact O-CB 3.32Å; F573-Q577 WeakPolarHBondContact O-CB 3.22Å; F573-Q577 PolarHBondContact O-N 3.22Å; R574-Q577 PolarHBondContact O-N 3.36Å; L575-Q577 VanDerWaalsContact C-N 3.33Å; L575-Q577 PolarHBondContact O-N 3.25Å; Q577-I598 HydrophobicContact CB-CG2 3.63Å; Q577-I598 HydrophobicContact CG-CG2 4.07Å
578	Q	91	Very high	91.7	Very high	65 Å²	65	36.5 Å²	36.5	30%	0.304	17%	0.169	S	C	.	.	H	α-helix	trans	-75.1	-31.7	-177.8	-74.2	173.1	-39.7	0	0	113.3	D553 A556 N560 R574 L575 I576	D553-Q578 PolarHBondContact OD1-NE2 2.9Å; A556-Q578 HydrophobicContact CB-CB 4.2Å; N560-Q578 PolarHBondContact ND2-O 3.26Å; N560-Q578 PolarHBondContact OD1-O 2.97Å; R574-Q578 HydrophobicContact CG-CG 4.5Å; R574-Q578 WeakPolarHBondContact O-CG 3.37Å; R574-Q578 PolarHBondContact O-N 3.45Å; L575-Q578 PolarHBondContact O-N 3.12Å; L575-Q578 VanDerWaalsContact O-N 3.17Å; I576-Q578 VanDerWaalsContact C-N 3.27Å; I576-Q578 PolarHBondContact O-N 3.04Å
579	V	93.5	Very high	91.6	Very high	5 Å²	5	40.4 Å²	40.4	3%	0.03	19%	0.188	C	C	.	.	H	α-helix	trans	-117.6	-23.3	-168.8	-50.9	0	0	0	0	115.5	A556 I559 M566 L568 L575 I576	A556-V579 HydrophobicContact CB-CG1 3.96Å; I559-V579 HydrophobicContact CB-CB 4.43Å; I559-V579 HydrophobicContact CB-CG1 4.01Å; I559-V579 HydrophobicContact CD1-CG1 4.37Å; I559-V579 HydrophobicContact CG2-CB 3.68Å; I559-V579 HydrophobicContact CG2-CG1 3.82Å; I559-V579 HydrophobicContact CG2-CG2 4.22Å; M566-V579 HydrophobicContact CE-CB 4.48Å; M566-V579 HydrophobicContact CE-CG2 3.97Å; M566-V579 HydrophobicContact SD-CG2 4.06Å; L568-V579 HydrophobicContact CD2-CG2 3.59Å; L575-V579 HydrophobicContact CD1-CG1 4.03Å; L575-V579 WeakPolarHBondContact O-CG2 3.39Å; L575-V579 PolarHBondContact O-N 3.23Å; L575-V579 VanDerWaalsContact O-N 3.12Å; I576-V579 PolarHBondContact O-N 2.82Å
580	A	93.5	Very high	91.6	Very high	17 Å²	17	42.7 Å²	42.7	14%	0.14	20%	0.201	C	C	.	.			trans	-96.1	135.1	-175.7	0	0	0	0	0	111.4	A427 I576 I583	A427-A580 HydrophobicContact CB-CB 3.55Å; I576-A580 HydrophobicContact CG2-CB 4.08Å; I576-A580 VanDerWaalsContact O-CB 3.23Å; I576-A580 WeakPolarHBondContact O-CB 3.3Å; I576-A580 PolarHBondContact O-N 3.03Å; A580-I583 HydrophobicContact CB-CD1 4.17Å
581	Q	93.5	Very high	91.8	Very high	156 Å²	156	43.7 Å²	43.7	73%	0.729	21%	0.206	S	C	*	.	S	Bend	trans	-96.3	-28.8	172.8	-63.7	176.6	5.8	0	0	111.3	R425	R425-Q581 HydrophobicContact CB-CB 4.07Å; R425-Q581 HydrophobicContact CB-CG 3.85Å; R425-Q581 HydrophobicContact CG-CG 4.36Å; R425-Q581 PolarHBondContact O-N 3.3Å
582	E	94.5	Very high	92.3	Very high	62 Å²	62	45.5 Å²	45.5	29%	0.29	22%	0.22	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	140.6	178.1	-57.8	-165.9	174.4	0	0	111	R425 V426 A427 W584 K593	R425-E582 PolarHBondContact O-N 3.37Å; V426-E582 CarbonylContact C-O 3.58Å; V426-E582 WeakPolarHBondContact CA-O 3.36Å; V426-E582 HydrophobicContact CG2-CB 4.03Å; A427-E582 PolarHBondContact N-O 3.08Å; E582-W584 PolarHBondContact OE2-NE1 3.09Å; E582-K593 VanDerWaalsContact CD-CE 3.42Å; E582-K593 IonicContact OE1-NZ 3.03Å; E582-K593 PolarHBondContact OE1-NZ 3.3Å; E582-K593 WeakPolarHBondContact OE2-CD 3.37Å; E582-K593 VanDerWaalsContact OE2-CE 3.28Å; E582-K593 WeakPolarHBondContact OE2-CE 3.12Å; E582-K593 IonicContact OE2-NZ 2.76Å; E582-K593 PolarHBondContact OE2-NZ 3.11Å; E582-K593 VanDerWaalsContact OE2-NZ 3.17Å
583	I	95.6	Very high	92.7	Very high	5 Å²	5	51.1 Å²	51.1	3%	0.026	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	122.3	172.7	-53	-55.2	0	0	0	108	A427 V429 I576 A580 W594 I598	A427-I583 HydrophobicContact CB-CD1 3.81Å; V429-I583 HydrophobicContact CB-CG2 4.42Å; V429-I583 HydrophobicContact CG1-CG2 4.1Å; V429-I583 HydrophobicContact CG2-CG2 3.44Å; V429-I583 VanDerWaalsContact CG2-CG2 3.44Å; I576-I583 HydrophobicContact CG2-CD1 3.42Å; I576-I583 VanDerWaalsContact CG2-CD1 3.42Å; A580-I583 HydrophobicContact CB-CD1 4.17Å; I583-W594 HydrophobicContact CB-CB 3.98Å; I583-W594 HydrophobicContact CG2-CB 4.14Å; I583-W594 WeakPolarHBondContact O-CB 3.24Å; I583-W594 PolarHBondContact O-N 3.45Å; I583-I598 HydrophobicContact CD1-CB 4.12Å; I583-I598 HydrophobicContact CD1-CD1 4.19Å; I583-I598 HydrophobicContact CG1-CB 4.38Å; I583-I598 HydrophobicContact CG1-CD1 4.49Å; I583-I598 HydrophobicContact CG2-CD1 4.45Å
584	W	96.2	Very high	93	Very high	22 Å²	22	53.3 Å²	53.3	8%	0.083	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	123.3	175.1	-73.2	14	0	0	0	109	F418 I420 V426 A427 L428 V429 M567 E582 I591	F418-W584 HydrophobicContact CB-CH2 3.94Å; F418-W584 HydrophobicContact CB-CZ3 4.38Å; F418-W584 HydrophobicContact CD1-CZ3 4.31Å; F418-W584 AromaticContact CD2-CH2 3.53Å; F418-W584 HydrophobicContact CD2-CH2 3.53Å; F418-W584 AromaticContact CD2-CZ3 3.54Å; F418-W584 HydrophobicContact CD2-CZ3 3.54Å; F418-W584 HydrophobicContact CE2-CH2 4.21Å; F418-W584 AromaticContact CE2-CZ3 3.8Å; F418-W584 HydrophobicContact CE2-CZ3 3.8Å; F418-W584 AromaticContact CG-CH2 3.82Å; F418-W584 HydrophobicContact CG-CH2 3.82Å; F418-W584 AromaticContact CG-CZ3 3.82Å; F418-W584 HydrophobicContact CG-CZ3 3.82Å; F418-W584 HydrophobicContact CZ-CZ3 4.3Å; I420-W584 HydrophobicContact CG1-CH2 4.37Å; V426-W584 HydrophobicContact CB-CD2 4.44Å; V426-W584 HydrophobicContact CG1-CB 3.8Å; V426-W584 HydrophobicContact CG1-CD2 3.46Å; V426-W584 VanDerWaalsContact CG1-CD2 3.46Å; V426-W584 HydrophobicContact CG1-CE3 3.88Å; V426-W584 HydrophobicContact CG1-CG 3.42Å; V426-W584 VanDerWaalsContact CG1-CG 3.42Å; V426-W584 HydrophobicContact CG2-CD2 4.12Å; V426-W584 HydrophobicContact CG2-CG 4.48Å; V426-W584 HydrophobicContact CG2-CH2 4.46Å; V426-W584 HydrophobicContact CG2-CZ2 3.82Å; A427-W584 PolarHBondContact O-N 2.84Å; L428-W584 CarbonylContact C-O 3.6Å; L428-W584 WeakPolarHBondContact CA-O 3.28Å; L428-W584 HydrophobicContact CD1-CB 3.99Å; V429-W584 WeakPolarHBondContact CG2-O 3.49Å; V429-W584 PolarHBondContact N-O 3.28Å; M567-W584 HydrophobicContact CE-CE3 4.14Å; M567-W584 HydrophobicContact CE-CZ3 4.1Å; E582-W584 PolarHBondContact OE2-NE1 3.09Å; W584-I591 HydrophobicContact CB-CG2 3.87Å; W584-I591 HydrophobicContact CD2-CG2 4.14Å; W584-I591 HydrophobicContact CE3-CG2 3.74Å; W584-I591 HydrophobicContact CG-CG2 4.24Å
585	V	95	Very high	93.3	Very high	6 Å²	6	57 Å²	57	4%	0.036	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.5	121.1	179.5	-170.2	0	0	0	0	109	V429 E587 I591 T592 W594 Y601	V429-V585 HydrophobicContact CG2-CB 4.47Å; V429-V585 HydrophobicContact CG2-CG2 4Å; V429-V585 CarbonylContact O-C 3.59Å; V429-V585 WeakPolarHBondContact O-CA 3.46Å; V585-E587 HydrophobicContact CG1-CB 4.44Å; V585-E587 HydrophobicContact CG1-CG 3.92Å; V585-I591 WeakPolarHBondContact O-CA 3.3Å; V585-T592 PolarHBondContact N-O 2.75Å; V585-T592 PolarHBondContact O-N 3.08Å; V585-W594 HydrophobicContact CG2-CB 4.01Å; V585-W594 HydrophobicContact CG2-CE3 4.43Å; V585-Y601 HydrophobicContact CG1-CE2 4.49Å; V585-Y601 HydrophobicContact CG2-CD2 4.45Å; V585-Y601 HydrophobicContact CG2-CE2 3.88Å
586	C	93.5	Very high	93.3	Very high	0 Å²	0	58.6 Å²	58.6	0%	0	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.1	98.3	175.4	-175.7	0	0	0	0	109	Y413 L428 V429 A434 K436	Y413-C586 PolarHBondContact OH-SG 3.48Å; L428-C586 HydrophobicContact CD1-CB 3.96Å; L428-C586 HydrophobicContact CG-CB 4.32Å; V429-C586 WeakPolarHBondContact O-CB 3.42Å; V429-C586 PolarHBondContact O-N 2.78Å; A434-C586 HydrophobicContact CB-CB 4.44Å; A434-C586 WeakPolarHBondContact CB-O 3.37Å; A434-C586 PolarHBondContact O-SG 2.75Å; K436-C586 HydrophobicContact CG-CB 4Å
587	E	91.4	Very high	93.3	Very high	55 Å²	55	62.6 Å²	62.6	26%	0.257	32%	0.32	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.1	166	177.3	64.5	167.5	-147.7	0	0	111.3	V585 Q589 T590	V585-E587 HydrophobicContact CG1-CB 4.44Å; V585-E587 HydrophobicContact CG1-CG 3.92Å; E587-Q589 PolarHBondContact O-N 2.78Å; E587-T590 PolarHBondContact N-O 2.83Å; E587-T590 CarbonylContact O-C 3.6Å; E587-T590 WeakPolarHBondContact O-CG2 3.19Å; E587-T590 PolarHBondContact O-N 3.01Å
588	K	89.5	Confident	93.2	Very high	169 Å²	169	57.8 Å²	57.8	74%	0.735	30%	0.297	S	S	*	.	T	Hydrogen-bonded Turn	trans	51	36.3	174	-58.2	171	-176.4	135.6	0	113.8	T590	K588-T590 PolarHBondContact O-N 3.28Å
589	Q	92.1	Very high	93.1	Very high	83 Å²	83	58.1 Å²	58.1	39%	0.388	30%	0.301	S	S	.	.	T	Hydrogen-bonded Turn	trans	62.5	24.1	-179.4	-50.4	169.4	-7.1	0	0	114.4	C411 I412 Y413 N414 E587	C411-Q589 VanDerWaalsContact O-CD 3.26Å; C411-Q589 WeakPolarHBondContact O-CG 3.4Å; C411-Q589 PolarHBondContact O-NE2 2.95Å; C411-Q589 VanDerWaalsContact O-NE2 3.17Å; I412-Q589 WeakPolarHBondContact O-CA 3.44Å; I412-Q589 WeakPolarHBondContact O-CB 3.37Å; Y413-Q589 CarbonylContact C-O 3.52Å; Y413-Q589 VanDerWaalsContact CA-O 3.32Å; Y413-Q589 WeakPolarHBondContact CA-O 3.4Å; N414-Q589 PolarHBondContact N-O 3.38Å; N414-Q589 PolarHBondContact ND2-OE1 3.3Å; E587-Q589 PolarHBondContact O-N 2.78Å
590	T	94.1	Very high	93.1	Very high	49 Å²	49	59.9 Å²	59.9	30%	0.301	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.7	176.2	176.7	-168.4	0	0	0	0	111	E587 K588 T592	E587-T590 PolarHBondContact N-O 2.83Å; E587-T590 CarbonylContact O-C 3.6Å; E587-T590 WeakPolarHBondContact O-CG2 3.19Å; E587-T590 PolarHBondContact O-N 3.01Å; K588-T590 PolarHBondContact O-N 3.28Å; T590-T592 HydrophobicContact CG2-CG2 4.11Å
591	I	94.9	Very high	93	Very high	24 Å²	24	59.4 Å²	59.4	12%	0.123	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	124.3	174.4	-61.2	166.5	0	0	0	107.5	Y413 L416 F418 L428 L439 W584 V585	Y413-I591 HydrophobicContact CE1-CD1 4.09Å; Y413-I591 HydrophobicContact CE1-CG1 3.9Å; L416-I591 HydrophobicContact CD1-CD1 4.02Å; L416-I591 HydrophobicContact CD2-CB 4.12Å; L416-I591 HydrophobicContact CD2-CD1 4.01Å; L416-I591 HydrophobicContact CD2-CG1 3.93Å; F418-I591 HydrophobicContact CE1-CD1 3.96Å; F418-I591 HydrophobicContact CZ-CD1 4.44Å; L428-I591 HydrophobicContact CD1-CG2 4.24Å; L439-I591 HydrophobicContact CD1-CD1 3.51Å; L439-I591 HydrophobicContact CD2-CD1 3.32Å; L439-I591 HydrophobicContact CG-CD1 3.97Å; W584-I591 HydrophobicContact CB-CG2 3.87Å; W584-I591 HydrophobicContact CD2-CG2 4.14Å; W584-I591 HydrophobicContact CE3-CG2 3.74Å; W584-I591 HydrophobicContact CG-CG2 4.24Å; V585-I591 WeakPolarHBondContact O-CA 3.3Å
592	T	94.2	Very high	92.9	Very high	68 Å²	68	52.6 Å²	52.6	42%	0.417	28%	0.279	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	137.6	179.9	53.7	0	0	0	0	110.6	V585 T590 W594	V585-T592 PolarHBondContact N-O 2.75Å; V585-T592 PolarHBondContact O-N 3.08Å; T590-T592 HydrophobicContact CG2-CG2 4.11Å; T592-W594 PolarHBondContact O-N 3.17Å
593	K	94.6	Very high	92.8	Very high	127 Å²	127	55.2 Å²	55.2	55%	0.552	29%	0.291	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-70.7	126.9	174.1	-175.7	171.4	177.4	169.6	0	110.3	E582	E582-K593 VanDerWaalsContact CD-CE 3.42Å; E582-K593 IonicContact OE1-NZ 3.03Å; E582-K593 PolarHBondContact OE1-NZ 3.3Å; E582-K593 WeakPolarHBondContact OE2-CD 3.37Å; E582-K593 VanDerWaalsContact OE2-CE 3.28Å; E582-K593 WeakPolarHBondContact OE2-CE 3.12Å; E582-K593 IonicContact OE2-NZ 2.76Å; E582-K593 PolarHBondContact OE2-NZ 3.11Å; E582-K593 VanDerWaalsContact OE2-NZ 3.17Å
594	W	94.9	Very high	92.6	Very high	53 Å²	53	58.9 Å²	58.9	20%	0.201	31%	0.308	C	S	.	.			trans	-76.5	134.8	172.6	-178.4	-115.2	0	0	0	109.8	I583 V585 T592 G596 D597 Y601 H604	I583-W594 HydrophobicContact CB-CB 3.98Å; I583-W594 HydrophobicContact CG2-CB 4.14Å; I583-W594 WeakPolarHBondContact O-CB 3.24Å; I583-W594 PolarHBondContact O-N 3.45Å; V585-W594 HydrophobicContact CG2-CB 4.01Å; V585-W594 HydrophobicContact CG2-CE3 4.43Å; T592-W594 PolarHBondContact O-N 3.17Å; W594-G596 VanDerWaalsContact C-N 3.3Å; W594-G596 VanDerWaalsContact CD1-C 3.48Å; W594-G596 VanDerWaalsContact CD1-N 3.35Å; W594-G596 PolarHBondContact O-N 3.22Å; W594-D597 PolarHBondContact NE1-O 3.44Å; W594-Y601 AromaticContact CD2-CD2 3.85Å; W594-Y601 HydrophobicContact CD2-CD2 3.85Å; W594-Y601 AromaticContact CE2-CD2 3.89Å; W594-Y601 HydrophobicContact CE3-CD2 4.1Å; W594-Y601 HydrophobicContact CG-CD2 4.28Å; W594-Y601 HydrophobicContact CH2-CD2 4.48Å; W594-Y601 HydrophobicContact CZ2-CD2 4.22Å; W594-Y601 HydrophobicContact CZ3-CD2 4.41Å; W594-H604 HydrophobicContact CH2-CB 3.57Å; W594-H604 AromaticContact CH2-CD2 3.57Å; W594-H604 AromaticContact CH2-CG 3.41Å; W594-H604 VanDerWaalsContact CH2-CG 3.41Å; W594-H604 HydrophobicContact CZ2-CB 3.76Å; W594-H604 AromaticContact CZ3-CD2 3.83Å
595	P	92.1	Very high	92.3	Very high	127 Å²	127	58 Å²	58	83%	0.825	31%	0.305	S	S	*	.	S	Bend	trans	-76.8	-13.4	-176.6	29.6	-35.9	0	0	0	114.3
596	G	91.3	Very high	91.9	Very high	33 Å²	33	59.4 Å²	59.4	34%	0.34	31%	0.31	S	S	.	.	S	Bend	trans	-108.9	-175.2	-178.3	0	0	0	0	0	113.6	W594	W594-G596 VanDerWaalsContact C-N 3.3Å; W594-G596 VanDerWaalsContact CD1-C 3.48Å; W594-G596 VanDerWaalsContact CD1-N 3.35Å; W594-G596 PolarHBondContact O-N 3.22Å
597	D	92.2	Very high	91.7	Very high	85 Å²	85	62 Å²	62	46%	0.455	33%	0.328	S	S	.	.			trans	-81.4	-179.3	166.5	66.9	3.1	0	0	0	111.1	W594 L599 A600 Y601	W594-D597 PolarHBondContact NE1-O 3.44Å; D597-L599 VanDerWaalsContact C-N 3.28Å; D597-L599 PolarHBondContact O-N 3.12Å; D597-L599 PolarHBondContact OD1-N 3.34Å; D597-A600 PolarHBondContact O-N 3.37Å; D597-A600 VanDerWaalsContact OD1-CB 3.28Å; D597-A600 WeakPolarHBondContact OD1-CB 3.26Å; D597-A600 PolarHBondContact OD1-N 3.4Å; D597-Y601 PolarHBondContact O-N 2.88Å
598	I	89.5	Confident	91.4	Very high	3 Å²	3	63 Å²	63	2%	0.015	33%	0.332	C	S	.	.	H	α-helix	trans	-68.7	-26	-179.7	-166.4	63	0	0	0	112.9	V429 F573 I576 Q577 I583 Y601 K602	V429-I598 HydrophobicContact CG1-CD1 4.22Å; F573-I598 HydrophobicContact CD1-CD1 4.27Å; F573-I598 HydrophobicContact CD1-CG1 3.66Å; F573-I598 HydrophobicContact CE1-CD1 4.3Å; F573-I598 HydrophobicContact CE1-CG1 4.14Å; I576-I598 HydrophobicContact CB-CG1 4.18Å; I576-I598 HydrophobicContact CD1-CD1 4.21Å; I576-I598 HydrophobicContact CD1-CG1 4.48Å; I576-I598 HydrophobicContact CG2-CB 3.87Å; I576-I598 HydrophobicContact CG2-CD1 3.86Å; I576-I598 HydrophobicContact CG2-CG1 3.68Å; I576-I598 HydrophobicContact CG2-CG2 4.29Å; Q577-I598 HydrophobicContact CB-CG2 3.63Å; Q577-I598 HydrophobicContact CG-CG2 4.07Å; I583-I598 HydrophobicContact CD1-CB 4.12Å; I583-I598 HydrophobicContact CD1-CD1 4.19Å; I583-I598 HydrophobicContact CG1-CB 4.38Å; I583-I598 HydrophobicContact CG1-CD1 4.49Å; I583-I598 HydrophobicContact CG2-CD1 4.45Å; I598-Y601 HydrophobicContact CD1-CD1 3.93Å; I598-Y601 WeakPolarHBondContact O-CB 3.43Å; I598-Y601 PolarHBondContact O-N 3.18Å; I598-K602 PolarHBondContact O-N 3.01Å
599	L	90.1	Very high	90.9	Very high	72 Å²	72	56.7 Å²	56.7	38%	0.377	31%	0.306	S	S	.	.	H	α-helix	trans	-71.5	-43.8	175.6	-65	-179.6	0	0	0	110.9	D597 Y601 K602 E603	D597-L599 VanDerWaalsContact C-N 3.28Å; D597-L599 PolarHBondContact O-N 3.12Å; D597-L599 PolarHBondContact OD1-N 3.34Å; L599-Y601 PolarHBondContact O-N 3.11Å; L599-K602 WeakPolarHBondContact O-CB 2.95Å; L599-K602 PolarHBondContact O-N 3.28Å; L599-K602 VanDerWaalsContact O-N 3.1Å; L599-E603 PolarHBondContact O-N 3.47Å
600	A	92.2	Very high	90	Very high	42 Å²	42	57 Å²	57	35%	0.347	31%	0.313	S	S	.	.	H	α-helix	trans	-61	-36.1	171.4	0	0	0	0	0	111.4	D597 E603 H604	D597-A600 PolarHBondContact O-N 3.37Å; D597-A600 VanDerWaalsContact OD1-CB 3.28Å; D597-A600 WeakPolarHBondContact OD1-CB 3.26Å; D597-A600 PolarHBondContact OD1-N 3.4Å; A600-E603 PolarHBondContact O-N 2.86Å; A600-H604 WeakPolarHBondContact O-CB 3.48Å; A600-H604 PolarHBondContact O-N 2.92Å
601	Y	92.5	Very high	88.9	Confident	7 Å²	7	60 Å²	60	3%	0.027	33%	0.327	C	S	.	.	H	α-helix	trans	-64.8	-43.2	171.9	-172.8	-112	0	0	0	111.8	L261 V429 V585 W594 D597 I598 L599 E603 H604 L605	L261-Y601 HydrophobicContact CD1-CD1 4.37Å; L261-Y601 HydrophobicContact CD1-CE1 3.92Å; V429-Y601 HydrophobicContact CB-CE1 4.18Å; V429-Y601 HydrophobicContact CG2-CD1 4.33Å; V429-Y601 HydrophobicContact CG2-CE1 3.78Å; V429-Y601 HydrophobicContact CG2-CE2 4.45Å; V585-Y601 HydrophobicContact CG1-CE2 4.49Å; V585-Y601 HydrophobicContact CG2-CD2 4.45Å; V585-Y601 HydrophobicContact CG2-CE2 3.88Å; W594-Y601 AromaticContact CD2-CD2 3.85Å; W594-Y601 HydrophobicContact CD2-CD2 3.85Å; W594-Y601 AromaticContact CE2-CD2 3.89Å; W594-Y601 HydrophobicContact CE3-CD2 4.1Å; W594-Y601 HydrophobicContact CG-CD2 4.28Å; W594-Y601 HydrophobicContact CH2-CD2 4.48Å; W594-Y601 HydrophobicContact CZ2-CD2 4.22Å; W594-Y601 HydrophobicContact CZ3-CD2 4.41Å; D597-Y601 PolarHBondContact O-N 2.88Å; I598-Y601 HydrophobicContact CD1-CD1 3.93Å; I598-Y601 WeakPolarHBondContact O-CB 3.43Å; I598-Y601 PolarHBondContact O-N 3.18Å; L599-Y601 PolarHBondContact O-N 3.11Å; Y601-E603 VanDerWaalsContact C-N 3.32Å; Y601-E603 PolarHBondContact O-N 3.11Å; Y601-H604 WeakPolarHBondContact O-CB 3.45Å; Y601-H604 PolarHBondContact O-N 2.9Å; Y601-H604 VanDerWaalsContact O-N 3.15Å; Y601-L605 HydrophobicContact CD1-CD1 4.1Å; Y601-L605 HydrophobicContact CD1-CG 4.35Å; Y601-L605 HydrophobicContact CE1-CD1 3.69Å; Y601-L605 HydrophobicContact CE1-CD2 4.29Å; Y601-L605 HydrophobicContact CE1-CG 4.07Å; Y601-L605 HydrophobicContact CE2-CD2 4.36Å; Y601-L605 WeakPolarHBondContact O-CG 3.25Å; Y601-L605 PolarHBondContact O-N 3.35Å
602	K	90.8	Very high	87.5	Confident	13 Å²	13	61.7 Å²	61.7	6%	0.057	34%	0.335	C	S	.	.	H	α-helix	trans	-56.7	-45.2	174.6	-170.7	172.8	174.6	168.4	0	111.7	V265 E268 D286 F573 I598 L599 L605 K606	V265-K602 HydrophobicContact CG2-CG 3.98Å; E268-K602 IonicContact OE1-NZ 3.66Å; E268-K602 PolarHBondContact OE1-NZ 2.9Å; E268-K602 WeakPolarHBondContact OE2-CE 3.41Å; E268-K602 IonicContact OE2-NZ 3.11Å; E268-K602 PolarHBondContact OE2-NZ 3.28Å; D286-K602 IonicContact OD1-NZ 3.91Å; D286-K602 PolarHBondContact OD1-NZ 3.42Å; D286-K602 IonicContact OD2-NZ 3.43Å; D286-K602 PolarHBondContact OD2-NZ 3.26Å; F573-K602 HydrophobicContact CD1-CB 4.1Å; F573-K602 HydrophobicContact CD1-CD 4.13Å; F573-K602 HydrophobicContact CD1-CG 4.37Å; F573-K602 HydrophobicContact CE1-CB 3.55Å; F573-K602 HydrophobicContact CE1-CD 4.04Å; F573-K602 HydrophobicContact CE1-CG 3.82Å; F573-K602 HydrophobicContact CE2-CD 4.46Å; F573-K602 HydrophobicContact CG-CD 4.46Å; F573-K602 HydrophobicContact CZ-CB 4.16Å; F573-K602 HydrophobicContact CZ-CD 4.21Å; F573-K602 HydrophobicContact CZ-CG 3.96Å; I598-K602 PolarHBondContact O-N 3.01Å; L599-K602 WeakPolarHBondContact O-CB 2.95Å; L599-K602 PolarHBondContact O-N 3.28Å; L599-K602 VanDerWaalsContact O-N 3.1Å; K602-L605 WeakPolarHBondContact O-CB 3.44Å; K602-L605 PolarHBondContact O-N 3.16Å; K602-K606 WeakPolarHBondContact O-CG 3.43Å; K602-K606 PolarHBondContact O-N 3.35Å
603	E	91.4	Very high	85.7	Confident	117 Å²	117	64.3 Å²	64.3	55%	0.547	34%	0.342	S	S	.	.	H	α-helix	trans	-68.1	-34.1	177.1	-69.1	-58.6	167.4	0	0	113.1	L599 A600 Y601 L605 K606 S607	L599-E603 PolarHBondContact O-N 3.47Å; A600-E603 PolarHBondContact O-N 2.86Å; Y601-E603 VanDerWaalsContact C-N 3.32Å; Y601-E603 PolarHBondContact O-N 3.11Å; E603-L605 VanDerWaalsContact C-N 3.3Å; E603-L605 PolarHBondContact O-N 3.36Å; E603-K606 PolarHBondContact O-N 3.35Å; E603-S607 PolarHBondContact O-N 3.49Å; E603-S607 PolarHBondContact O-OG 3.24Å
604	H	91.9	Very high	83.5	Confident	82 Å²	82	61.6 Å²	61.6	38%	0.38	34%	0.338	S	S	.	.	H	α-helix	trans	-61.1	-40.6	169.8	178.8	58.4	0	0	0	111.8	W594 A600 Y601 S607 K608	W594-H604 HydrophobicContact CH2-CB 3.57Å; W594-H604 AromaticContact CH2-CD2 3.57Å; W594-H604 AromaticContact CH2-CG 3.41Å; W594-H604 VanDerWaalsContact CH2-CG 3.41Å; W594-H604 HydrophobicContact CZ2-CB 3.76Å; W594-H604 AromaticContact CZ3-CD2 3.83Å; A600-H604 WeakPolarHBondContact O-CB 3.48Å; A600-H604 PolarHBondContact O-N 2.92Å; Y601-H604 WeakPolarHBondContact O-CB 3.45Å; Y601-H604 PolarHBondContact O-N 2.9Å; Y601-H604 VanDerWaalsContact O-N 3.15Å; H604-S607 WeakPolarHBondContact CA-OG 3.5Å; H604-S607 PolarHBondContact O-OG 3.05Å; H604-K608 WeakPolarHBondContact O-CB 3.44Å; H604-K608 PolarHBondContact O-N 3.07Å; H604-K608 VanDerWaalsContact O-N 3.1Å
605	L	89.5	Confident	81.2	Confident	4 Å²	4	63.9 Å²	63.9	2%	0.021	35%	0.351	C	S	.	.	H	α-helix	trans	-65.9	-43.7	174.9	-63.9	-175.7	0	0	0	111.5	L261 D262 V265 Y601 K602 E603 K608 L609	L261-L605 HydrophobicContact CB-CD1 3.94Å; D262-L605 VanDerWaalsContact OD1-CD2 3.23Å; D262-L605 WeakPolarHBondContact OD1-CD2 3.36Å; V265-L605 HydrophobicContact CG1-CB 4.42Å; V265-L605 HydrophobicContact CG2-CB 4.44Å; V265-L605 HydrophobicContact CG2-CD1 4.25Å; Y601-L605 HydrophobicContact CD1-CD1 4.1Å; Y601-L605 HydrophobicContact CD1-CG 4.35Å; Y601-L605 HydrophobicContact CE1-CD1 3.69Å; Y601-L605 HydrophobicContact CE1-CD2 4.29Å; Y601-L605 HydrophobicContact CE1-CG 4.07Å; Y601-L605 HydrophobicContact CE2-CD2 4.36Å; Y601-L605 WeakPolarHBondContact O-CG 3.25Å; Y601-L605 PolarHBondContact O-N 3.35Å; K602-L605 WeakPolarHBondContact O-CB 3.44Å; K602-L605 PolarHBondContact O-N 3.16Å; E603-L605 VanDerWaalsContact C-N 3.3Å; E603-L605 PolarHBondContact O-N 3.36Å; L605-K608 PolarHBondContact O-N 3.15Å; L605-L609 WeakPolarHBondContact O-CG 3.35Å; L605-L609 PolarHBondContact O-N 3.49Å; L605-L609 VanDerWaalsContact O-N 3.14Å
606	K	88	Confident	79.2	Confident	35 Å²	35	60.2 Å²	60.2	15%	0.152	32%	0.324	C	S	.	.	H	α-helix	trans	-60.1	-48	176.7	-71.3	-171.7	-177.1	-150.8	0	112.4	V265 E268 E269 K602 E603 K608 L609 V610	V265-K606 HydrophobicContact CG1-CB 4.47Å; V265-K606 HydrophobicContact CG1-CD 4.38Å; V265-K606 HydrophobicContact CG1-CG 3.4Å; E268-K606 IonicContact OE1-NZ 3.76Å; E268-K606 PolarHBondContact OE1-NZ 2.91Å; E268-K606 VanDerWaalsContact OE1-NZ 3.11Å; E269-K606 WeakPolarHBondContact OE1-CE 3.36Å; E269-K606 IonicContact OE1-NZ 2.8Å; E269-K606 PolarHBondContact OE1-NZ 2.99Å; K602-K606 WeakPolarHBondContact O-CG 3.43Å; K602-K606 PolarHBondContact O-N 3.35Å; E603-K606 PolarHBondContact O-N 3.35Å; K606-K608 VanDerWaalsContact C-N 3.33Å; K606-K608 PolarHBondContact O-N 3.09Å; K606-L609 WeakPolarHBondContact O-CB 3.49Å; K606-L609 PolarHBondContact O-N 2.81Å; K606-V610 PolarHBondContact O-N 3.22Å
607	S	88.5	Confident	76.9	Confident	54 Å²	54	61.8 Å²	61.8	38%	0.378	33%	0.327	S	S	.	.	H	α-helix	trans	-61.4	-41.1	178.6	51.3	0	0	0	0	112.4	E603 H604 L609 V610 D611	E603-S607 PolarHBondContact O-N 3.49Å; E603-S607 PolarHBondContact O-OG 3.24Å; H604-S607 WeakPolarHBondContact CA-OG 3.5Å; H604-S607 PolarHBondContact O-OG 3.05Å; S607-L609 VanDerWaalsContact C-N 3.3Å; S607-L609 PolarHBondContact O-N 3.48Å; S607-V610 PolarHBondContact O-N 3.41Å; S607-V610 VanDerWaalsContact O-N 3.17Å; S607-D611 PolarHBondContact O-N 2.88Å
608	K	85.5	Confident	74.4	Confident	77 Å²	77	64.9 Å²	64.9	34%	0.335	34%	0.336	S	S	.	.	H	α-helix	trans	-59.5	-38.8	175.5	-174.1	-177.4	173.2	-167.5	0	112.7	H604 L605 K606 D611 E612	H604-K608 WeakPolarHBondContact O-CB 3.44Å; H604-K608 PolarHBondContact O-N 3.07Å; H604-K608 VanDerWaalsContact O-N 3.1Å; L605-K608 PolarHBondContact O-N 3.15Å; K606-K608 VanDerWaalsContact C-N 3.33Å; K606-K608 PolarHBondContact O-N 3.09Å; K608-D611 PolarHBondContact O-N 3.27Å; K608-E612 WeakPolarHBondContact CE-OE1 3.45Å; K608-E612 WeakPolarHBondContact O-CG 3.22Å; K608-E612 PolarHBondContact O-N 3.17Å; K608-E612 VanDerWaalsContact O-N 3.16Å
609	L	79.1	Confident	71.9	Confident	35 Å²	35	73.6 Å²	73.6	18%	0.183	37%	0.369	C	S	.	.	H	α-helix	trans	-63.9	-42.5	176	-66.1	171.8	0	0	0	111.7	V265 W266 L605 K606 S607 E612 E613	V265-L609 HydrophobicContact CG1-CD1 4.02Å; W266-L609 HydrophobicContact CB-CD1 3.8Å; W266-L609 HydrophobicContact CB-CD2 4.19Å; W266-L609 HydrophobicContact CG-CD1 4.46Å; W266-L609 HydrophobicContact CG-CD2 4.44Å; L605-L609 WeakPolarHBondContact O-CG 3.35Å; L605-L609 PolarHBondContact O-N 3.49Å; L605-L609 VanDerWaalsContact O-N 3.14Å; K606-L609 WeakPolarHBondContact O-CB 3.49Å; K606-L609 PolarHBondContact O-N 2.81Å; S607-L609 VanDerWaalsContact C-N 3.3Å; S607-L609 PolarHBondContact O-N 3.48Å; L609-E612 PolarHBondContact O-N 3.29Å; L609-E613 PolarHBondContact O-N 3.2Å
610	V	73.6	Confident	69.7	Low	91 Å²	91	72.8 Å²	72.8	55%	0.552	37%	0.367	S	S	*	.	H	α-helix	trans	-64.7	-39.2	178.1	178.1	0	0	0	0	111.7	K606 S607 E612 P614	K606-V610 PolarHBondContact O-N 3.22Å; S607-V610 PolarHBondContact O-N 3.41Å; S607-V610 VanDerWaalsContact O-N 3.17Å; V610-E612 VanDerWaalsContact C-N 3.33Å; V610-E612 PolarHBondContact O-N 3Å; V610-P614 WeakPolarHBondContact O-CD 3.47Å
611	D	69.1	Low	67	Low	110 Å²	110	77.5 Å²	77.5	59%	0.588	38%	0.382	S	S	*	.	H	α-helix	trans	-72.3	-24.8	179.2	-74.1	-24.7	0	0	0	113.4	S607 K608 P614	S607-D611 PolarHBondContact O-N 2.88Å; K608-D611 PolarHBondContact O-N 3.27Å; D611-P614 WeakPolarHBondContact O-CD 3.41Å
612	E	65.5	Low	64.1	Low	61 Å²	61	84.4 Å²	84.4	29%	0.285	42%	0.419	S	S	.	.	H	α-helix	trans	-82.7	-26.7	178.2	-75.3	-177.6	180	0	0	113.1	H213 K608 L609 V610 Q615 L616	H213-E612 IonicContact CE1-OE2 2.77Å; H213-E612 PolarHBondContact CE1-OE2 3.21Å; K608-E612 WeakPolarHBondContact CE-OE1 3.45Å; K608-E612 WeakPolarHBondContact O-CG 3.22Å; K608-E612 PolarHBondContact O-N 3.17Å; K608-E612 VanDerWaalsContact O-N 3.16Å; L609-E612 PolarHBondContact O-N 3.29Å; V610-E612 VanDerWaalsContact C-N 3.33Å; V610-E612 PolarHBondContact O-N 3Å; E612-Q615 PolarHBondContact O-N 3.11Å; E612-L616 HydrophobicContact CB-CD1 4.29Å; E612-L616 PolarHBondContact O-N 2.78Å; E612-L616 VanDerWaalsContact O-N 3.1Å
613	E	56.7	Low	61.5	Low	123 Å²	123	92.6 Å²	92.6	58%	0.575	47%	0.47	S	S	*	.	H	α-helix	trans	-51.7	-46	179.2	-80	-171.9	166.3	0	0	114.2	L609 Q615	L609-E613 PolarHBondContact O-N 3.2Å; E613-Q615 VanDerWaalsContact C-N 3.33Å; E613-Q615 PolarHBondContact O-N 2.65Å
614	P	48.4	Very low	60	Low	70 Å²	70	91.4 Å²	91.4	46%	0.455	47%	0.466	S	S	.	.	H	α-helix	trans	-73.9	-20.5	178.8	-13	28	0	0	0	113.8	V610 D611 T617	V610-P614 WeakPolarHBondContact O-CD 3.47Å; D611-P614 WeakPolarHBondContact O-CD 3.41Å; P614-T617 PolarHBondContact O-OG1 3.09Å
615	Q	48.2	Very low	58.3	Low	101 Å²	101	91.8 Å²	91.8	47%	0.472	47%	0.47	S	S	.	.	H	α-helix	trans	-85.7	-32.1	-178.2	-63.6	-170.1	35.9	0	0	111.9	E612 E613 K618 R619	E612-Q615 PolarHBondContact O-N 3.11Å; E613-Q615 VanDerWaalsContact C-N 3.33Å; E613-Q615 PolarHBondContact O-N 2.65Å; Q615-K618 PolarHBondContact O-N 2.95Å; Q615-R619 WeakPolarHBondContact O-CG 3.38Å; Q615-R619 PolarHBondContact O-N 3.31Å
616	L	48.3	Very low	56.6	Low	49 Å²	49	96.7 Å²	96.7	26%	0.257	50%	0.495	S	S	.	.	H	α-helix	trans	-65.2	-37.8	175.3	-84	146.8	0	0	0	112.5	H213 E612 K618 T620	H213-L616 HydrophobicContact CB-CD2 4.37Å; E612-L616 HydrophobicContact CB-CD1 4.29Å; E612-L616 PolarHBondContact O-N 2.78Å; E612-L616 VanDerWaalsContact O-N 3.1Å; L616-K618 VanDerWaalsContact C-N 3.32Å; L616-K618 PolarHBondContact O-N 3.13Å; L616-T620 PolarHBondContact O-OG1 3.3Å
617	T	43.2	Very low	54.8	Low	66 Å²	66	100.4 Å²	100.4	41%	0.405	52%	0.515	S	S	.	.	H	α-helix	trans	-69	-27.6	175.2	52.5	0	0	0	0	112.9	P614 T620 H621	P614-T617 PolarHBondContact O-OG1 3.09Å; T617-T620 PolarHBondContact O-OG1 3.28Å; T617-H621 PolarHBondContact O-CD2 3.28Å; T617-H621 VanDerWaalsContact O-CD2 3.31Å
618	K	39.6	Very low	52.7	Low	150 Å²	150	103.3 Å²	103.3	65%	0.652	52%	0.524	S	S	*	.	H	α-helix	trans	-86.6	-36.4	178.1	-70.2	179.9	-178.9	177.3	0	113.9	Q615 L616 T620 H621	Q615-K618 PolarHBondContact O-N 2.95Å; L616-K618 VanDerWaalsContact C-N 3.32Å; L616-K618 PolarHBondContact O-N 3.13Å; K618-T620 VanDerWaalsContact C-N 3.32Å; K618-T620 PolarHBondContact O-N 3.4Å; K618-H621 PolarHBondContact O-N 3.36Å
619	R	37.8	Very low	50.5	Low	186 Å²	186	105 Å²	105	70%	0.702	54%	0.537	S	S	*	.	H	α-helix	trans	-73	-23.2	-177.7	-76.5	-177.1	178.1	175.7	3.3	113.5	Q615	Q615-R619 WeakPolarHBondContact O-CG 3.38Å; Q615-R619 PolarHBondContact O-N 3.31Å
620	T	43.8	Very low	48.4	Very low	55 Å²	55	110 Å²	110	34%	0.337	56%	0.562	S	S	.	*	S	Bend	trans	-79.4	-19.6	174.5	43.3	0	0	0	0	113.2	L616 T617 K618	L616-T620 PolarHBondContact O-OG1 3.3Å; T617-T620 PolarHBondContact O-OG1 3.28Å; K618-T620 VanDerWaalsContact C-N 3.32Å; K618-T620 PolarHBondContact O-N 3.4Å
621	H	36.5	Very low	46.5	Very low	142 Å²	142	111.5 Å²	111.5	66%	0.657	56%	0.563	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.8	-13.5	176.7	-81.4	-38.9	0	0	0	115.1	T617 K618	T617-H621 PolarHBondContact O-CD2 3.28Å; T617-H621 VanDerWaalsContact O-CD2 3.31Å; K618-H621 PolarHBondContact O-N 3.36Å
622	N	31.4	Very low	44.6	Very low	152 Å²	152	111.6 Å²	111.6	81%	0.813	56%	0.56	S	S	*	*	T	Hydrogen-bonded Turn	trans	-105.9	21	-177.9	-81.9	-10.1	0	0	0	113.7
623	V	35.7	Very low	42.7	Very low	184 Å²	184	116.2 Å²	116.2	100%	1.115	59%	0.585	S	S	*	*			trans	-133.8	0	170.1	-174.2	0	0	0	0	107.2

Retrieved 623 of 623 residues in 302.6 ms (Link to these results)

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