A0A087XEA2_POEFO Loading...

Kelch like family member 3

AlphaFold DB , UniProt , Accession A0A087XEA2, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 612 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	29.6	Very low	31.5	Very low	242 Å²	242	142.2 Å²	142.2	100%	1.192	81%	0.812	S	S	*	*				0	143.9	0	-83.9	179.7	164.3	0	0	108.8
2	P	45.4	Very low	31.2	Very low	116 Å²	116	143.7 Å²	143.7	75%	0.753	82%	0.816	S	S	*	*				-143.4	-179.1	-128.6	42.2	-24.2	0	0	0	116.5
3	A	32	Very low	30.9	Very low	79 Å²	79	138.4 Å²	138.4	65%	0.653	81%	0.812	S	S	*	*			trans	60	154.3	144.9	0	0	0	0	0	118.1
4	V	32.9	Very low	30.6	Very low	128 Å²	128	138.7 Å²	138.7	78%	0.776	82%	0.816	S	S	*	*			cis	-144.8	127.9	41.2	176.6	0	0	0	0	106.5
5	L	32.9	Very low	30.2	Very low	151 Å²	151	136.7 Å²	136.7	79%	0.791	81%	0.812	S	S	*	*				54.8	152.9	82.9	-69.8	162.9	0	0	0	112.8
6	S	30.6	Very low	30.1	Very low	104 Å²	104	138.4 Å²	138.4	73%	0.727	82%	0.815	S	S	*	*			cis	-179.4	156.1	-6	44	0	0	0	0	107.1
7	D	31.2	Very low	29.8	Very low	151 Å²	151	134.7 Å²	134.7	81%	0.807	81%	0.813	S	S	*	*			cis	-174.4	-176.5	-12.1	177.5	37	0	0	0	107.9
8	S	28.7	Very low	29.7	Very low	111 Å²	111	137.7 Å²	137.7	78%	0.776	82%	0.817	S	S	*	*			trans	82.5	142.7	164.7	79.3	0	0	0	0	119.4
9	G	28.5	Very low	29.6	Very low	68 Å²	68	136.7 Å²	136.7	70%	0.701	82%	0.816	S	S	*	*			cis	160.4	146.2	-11.5	0	0	0	0	0	115.3
10	R	27.6	Very low	29.4	Very low	246 Å²	246	139.1 Å²	139.1	93%	0.928	82%	0.823	S	S	*	*			trans	73.2	133.8	176.6	-62.3	178.7	169.4	172.1	-4.3	116.4
11	M	27.3	Very low	29.3	Very low	168 Å²	168	137.2 Å²	137.2	83%	0.828	82%	0.817	S	S	*	*			cis	110.1	142.5	23.6	-87.1	-166.8	166.6	0	0	113
12	D	27.8	Very low	29	Very low	160 Å²	160	131.5 Å²	131.5	86%	0.856	80%	0.8	S	S	*	*			trans	67.7	141.5	174.8	-46.7	-33.6	0	0	0	116.4
13	G	26.9	Very low	28.1	Very low	75 Å²	75	134.2 Å²	134.2	77%	0.773	81%	0.807	S	S	*	*			cis	-173.9	161.2	-2.8	0	0	0	0	0	112.7
14	V	26.7	Very low	27.9	Very low	143 Å²	143	137.6 Å²	137.6	87%	0.867	82%	0.82	S	S	*	*			trans	-43.6	137.6	-177.3	-178	0	0	0	0	116.9
15	S	24.3	Very low	27.5	Very low	108 Å²	108	136.5 Å²	136.5	76%	0.755	82%	0.818	S	S	*	*				172.1	167.6	113.5	-157.5	0	0	0	0	114.9
16	L	28.4	Very low	27.2	Very low	164 Å²	164	137.1 Å²	137.1	86%	0.859	82%	0.821	S	S	*	*			trans	-71.6	151.7	-169.5	-68.7	74.7	0	0	0	114.9
17	G	26.2	Very low	27.1	Very low	76 Å²	76	139.3 Å²	139.3	78%	0.784	83%	0.83	S	S	*	*			trans	-158.6	124.3	163.4	0	0	0	0	0	112.2
18	H	28.1	Very low	26.9	Very low	189 Å²	189	136.7 Å²	136.7	88%	0.875	83%	0.829	S	S	*	*			trans	-68.9	146.1	176.7	-68.9	89.3	0	0	0	112.2
19	C	26.4	Very low	26.9	Very low	118 Å²	118	135.9 Å²	135.9	80%	0.797	83%	0.829	S	S	*	*				179.2	109.7	127.2	-94.2	0	0	0	0	111.7
20	L	27.3	Very low	26.9	Very low	185 Å²	185	138.6 Å²	138.6	97%	0.969	83%	0.834	S	S	*	*			trans	-90	114.7	153	-98.8	79.1	0	0	0	108
21	S	25.5	Very low	26.9	Very low	100 Å²	100	131.7 Å²	131.7	70%	0.699	83%	0.83	S	S	*	*			trans	-160.3	160.9	159	61.7	0	0	0	0	110.6
22	C	24.8	Very low	27.1	Very low	121 Å²	121	128.5 Å²	128.5	82%	0.818	82%	0.824	S	S	*	*			trans	78.1	91.7	179.7	-57.4	0	0	0	0	116.8
23	L	26	Very low	27.4	Very low	173 Å²	173	126.8 Å²	126.8	91%	0.906	82%	0.822	S	S	*	*				-172.3	90.2	129.6	-102.6	164	0	0	0	110.9
24	T	27.1	Very low	27.5	Very low	150 Å²	150	132 Å²	132	92%	0.92	83%	0.825	S	S	*	*			trans	-167.3	116.9	153.1	17.6	0	0	0	0	109.5
25	S	26	Very low	28.8	Very low	106 Å²	106	129.8 Å²	129.8	74%	0.741	81%	0.814	S	S	*	*			trans	-153.8	151.8	165.6	70.3	0	0	0	0	109.6
26	L	26.2	Very low	28.9	Very low	163 Å²	163	132 Å²	132	85%	0.853	82%	0.817	S	S	*	*			trans	83.6	85.1	175.5	-58.8	152.8	0	0	0	116.6
27	V	28.3	Very low	28.8	Very low	151 Å²	151	130.6 Å²	130.6	92%	0.915	82%	0.82	S	S	*	*				-130.4	144.1	129	-177.5	0	0	0	0	107.5
28	A	27.8	Very low	29.2	Very low	95 Å²	95	131.9 Å²	131.9	79%	0.785	82%	0.823	S	S	*	*	P	Polyproline II helix	trans	-86.3	165.2	-171.3	0	0	0	0	0	113.9
29	A	26.8	Very low	29.3	Very low	94 Å²	94	127.3 Å²	127.3	78%	0.777	82%	0.818	S	S	*	*	P	Polyproline II helix	trans	-78.7	154.4	-179.1	0	0	0	0	0	113.9
30	P	28.8	Very low	29.7	Very low	126 Å²	126	129.4 Å²	129.4	82%	0.818	82%	0.821	S	S	*	*	P	Polyproline II helix	trans	-86.6	160.1	158.2	34.7	-30.5	0	0	0	112
31	A	28	Very low	29.9	Very low	100 Å²	100	126.2 Å²	126.2	83%	0.826	82%	0.815	S	S	*	*	P	Polyproline II helix	trans	-85.7	168	-174.1	0	0	0	0	0	114.3
32	S	31.6	Very low	30.4	Very low	101 Å²	101	130.8 Å²	130.8	71%	0.706	83%	0.825	S	S	*	*	P	Polyproline II helix	trans	-63.7	148.4	-178.5	51.6	0	0	0	0	116
33	P	34.5	Very low	31.4	Very low	125 Å²	125	134.3 Å²	134.3	81%	0.812	83%	0.829	S	S	*	*	P	Polyproline II helix	trans	-84.6	147.5	155.3	34.5	-30.7	0	0	0	111.7
34	H	28.8	Very low	31.8	Very low	184 Å²	184	133.2 Å²	133.2	85%	0.852	82%	0.824	S	S	*	*	P	Polyproline II helix	trans	-96.7	169.5	171.5	-104.4	-38.4	0	0	0	111.4
35	P	53.8	Low	32.4	Very low	97 Å²	97	130.7 Å²	130.7	63%	0.63	81%	0.813	S	S	*	*	P	Polyproline II helix	trans	-102.4	157.3	-149.9	39.5	-37.3	0	0	0	114.7
36	N	27.2	Very low	33.5	Very low	153 Å²	153	130.7 Å²	130.7	82%	0.818	82%	0.82	S	S	*	*				165.3	126.2	121.4	-89.6	-14.8	0	0	0	111.1
37	C	25.9	Very low	34.3	Very low	135 Å²	135	130.7 Å²	130.7	91%	0.912	82%	0.82	S	S	*	*			trans	-148.1	109.6	136.2	-110.2	0	0	0	0	106.8
38	A	34.8	Very low	35.2	Very low	103 Å²	103	127.4 Å²	127.4	85%	0.851	82%	0.817	S	S	*	*			trans	-76	143.9	172.2	0	0	0	0	0	109.4
39	A	30.7	Very low	36.4	Very low	93 Å²	93	125.3 Å²	125.3	77%	0.769	80%	0.804	S	S	*	*			trans	-136.4	131.2	159.9	0	0	0	0	0	107.1
40	D	33.3	Very low	38	Very low	162 Å²	162	128.3 Å²	128.3	87%	0.866	81%	0.806	S	S	*	*			trans	-60.4	146.7	-163.4	-53.2	-65.4	0	0	0	114.6
41	S	32.1	Very low	39.9	Very low	119 Å²	119	131.1 Å²	131.1	83%	0.832	81%	0.808	S	S	*	*			trans	-152.9	106.3	139.2	25.6	0	0	0	0	109.6
42	E	36.4	Very low	42.1	Very low	195 Å²	195	132.4 Å²	132.4	91%	0.911	81%	0.805	S	S	*	*			trans	-68	166.6	157.7	-73.1	-172.2	142.9	0	0	110
43	E	45.2	Very low	44.2	Very low	195 Å²	195	135.3 Å²	135.3	91%	0.911	81%	0.805	S	S	*	*			trans	-62.8	138.2	-162.2	-54.2	175.5	132.9	0	0	114.6
44	D	34.7	Very low	46.5	Very low	150 Å²	150	133.9 Å²	133.9	80%	0.802	79%	0.791	S	S	*	*			trans	-149.2	138	133.5	-143.4	-25.8	0	0	0	113.9
45	S	39	Very low	48.9	Very low	97 Å²	97	132.5 Å²	132.5	68%	0.678	79%	0.785	S	S	*	*			trans	21.3	116.4	164.5	44.3	0	0	0	0	122.7	N47	S45-N47 PolarHBondContact O-N 3.42Å
46	A	48.8	Very low	50.5	Low	107 Å²	107	131 Å²	131	88%	0.884	77%	0.774	S	S	*	*			trans	7.9	101	143.2	0	0	0	0	0	119.3
47	N	43.8	Very low	53.4	Low	163 Å²	163	129.8 Å²	129.8	87%	0.872	76%	0.763	S	S	*	*			trans	-145.7	127.4	148.4	-143.2	-10.5	0	0	0	111.3	S45 G49	S45-N47 PolarHBondContact O-N 3.42Å; N47-G49 PolarHBondContact O-N 2.88Å
48	G	46.6	Very low	56.2	Low	82 Å²	82	128.7 Å²	128.7	85%	0.845	75%	0.746	S	S	*	*			trans	-78.4	55.3	-172.7	0	0	0	0	0	114.2
49	G	53.1	Low	58.6	Low	50 Å²	50	132.6 Å²	132.6	52%	0.515	74%	0.739	S	S	.	*			trans	-81.8	126.4	-178.3	0	0	0	0	0	113.4	N47 H51	N47-G49 PolarHBondContact O-N 2.88Å; G49-H51 PolarHBondContact O-N 3.32Å
50	I	61.8	Low	61.4	Low	157 Å²	157	134.4 Å²	134.4	81%	0.805	73%	0.729	S	S	*	*			trans	-80.7	104.1	166.5	-54.6	177.5	0	0	0	108.4	T52	I50-T52 HydrophobicContact CG2-CG2 3.91Å; I50-T52 PolarHBondContact O-N 3.42Å
51	H	67.3	Low	64.1	Low	186 Å²	186	128.4 Å²	128.4	86%	0.861	70%	0.702	S	S	*	*			trans	-76.2	116.7	172.1	-71.6	-93	0	0	0	110.4	G49	G49-H51 PolarHBondContact O-N 3.32Å
52	T	75.2	Confident	66.9	Low	126 Å²	126	126.1 Å²	126.1	77%	0.773	68%	0.677	S	S	*	*			trans	-117.9	129.6	176.3	56.6	0	0	0	0	110.8	I50	I50-T52 HydrophobicContact CG2-CG2 3.91Å; I50-T52 PolarHBondContact O-N 3.42Å
53	F	76.4	Confident	69.4	Low	162 Å²	162	122.2 Å²	122.2	71%	0.711	66%	0.659	S	S	*	*			trans	-111.1	110.4	179	-176.3	-107.2	0	0	0	110.7	Q55 M58	F53-Q55 HydrophobicContact CD1-CG 3.9Å; F53-Q55 HydrophobicContact CE1-CG 3.76Å; F53-Q55 PolarHBondContact O-N 2.68Å; F53-M58 HydrophobicContact CZ-CE 4.27Å
54	N	82.4	Confident	71.6	Confident	95 Å²	95	117.9 Å²	117.9	51%	0.508	64%	0.641	S	S	.	*			trans	-94.7	96.6	179.5	-176.5	-10.5	0	0	0	111.3	T56 H57	N54-T56 PolarHBondContact O-N 2.92Å; N54-T56 PolarHBondContact OD1-N 3.37Å; N54-T56 PolarHBondContact OD1-OG1 3.33Å; N54-H57 HydrophobicContact CB-CB 4.23Å; N54-H57 WeakPolarHBondContact O-CB 3.37Å; N54-H57 PolarHBondContact O-N 3.39Å
55	Q	79.5	Confident	74.4	Confident	155 Å²	155	113.2 Å²	113.2	72%	0.724	62%	0.616	S	S	*	*	T	Hydrogen-bonded Turn	trans	-54.3	-25.3	178.3	-67.1	179.5	-5.5	0	0	114.3	F53	F53-Q55 HydrophobicContact CD1-CG 3.9Å; F53-Q55 HydrophobicContact CE1-CG 3.76Å; F53-Q55 PolarHBondContact O-N 2.68Å
56	T	85.8	Confident	76.9	Confident	65 Å²	65	110.3 Å²	110.3	40%	0.399	59%	0.593	S	S	.	*	H	α-helix	trans	-86.1	-13	-179	71.4	0	0	0	0	114.2	N54 R59 K60	N54-T56 PolarHBondContact O-N 2.92Å; N54-T56 PolarHBondContact OD1-N 3.37Å; N54-T56 PolarHBondContact OD1-OG1 3.33Å; T56-R59 PolarHBondContact O-N 2.76Å; T56-K60 WeakPolarHBondContact O-CG 3.14Å; T56-K60 PolarHBondContact O-N 3.08Å; T56-K60 VanDerWaalsContact O-N 3.14Å
57	H	88.1	Confident	79	Confident	129 Å²	129	109 Å²	109	60%	0.597	57%	0.571	S	S	*	*	H	α-helix	trans	-63	-49.6	-172.7	178.6	66.5	0	0	0	112.2	N54 R59 K60 A61	N54-H57 HydrophobicContact CB-CB 4.23Å; N54-H57 WeakPolarHBondContact O-CB 3.37Å; N54-H57 PolarHBondContact O-N 3.39Å; H57-R59 PolarHBondContact O-N 3.09Å; H57-K60 PolarHBondContact O-N 2.6Å; H57-A61 PolarHBondContact O-N 3.23Å
58	M	85.4	Confident	81.2	Confident	111 Å²	111	103.2 Å²	103.2	55%	0.547	54%	0.54	S	S	.	.	H	α-helix	trans	-60.5	-45	-179.6	-62.2	-179.6	-70.5	0	0	111.7	F53 K60 A61 F62	F53-M58 HydrophobicContact CZ-CE 4.27Å; M58-K60 PolarHBondContact O-N 3.09Å; M58-A61 WeakPolarHBondContact O-CB 3.25Å; M58-A61 PolarHBondContact O-N 3.41Å; M58-F62 WeakPolarHBondContact O-CD2 3.21Å; M58-F62 PolarHBondContact O-N 3.31Å
59	R	86.1	Confident	83.5	Confident	185 Å²	185	100.7 Å²	100.7	70%	0.698	50%	0.504	S	S	*	.	H	α-helix	trans	-60.4	-43.9	178.2	-169.2	179.6	-62.9	169.4	0.9	112.1	T56 H57 A61 F62 Q63	T56-R59 PolarHBondContact O-N 2.76Å; H57-R59 PolarHBondContact O-N 3.09Å; R59-A61 VanDerWaalsContact C-N 3.35Å; R59-F62 PolarHBondContact O-N 3.31Å; R59-Q63 WeakPolarHBondContact O-CB 3.44Å; R59-Q63 VanDerWaalsContact O-CG 3.28Å; R59-Q63 WeakPolarHBondContact O-CG 3.26Å; R59-Q63 PolarHBondContact O-N 2.74Å
60	K	87.9	Confident	85.2	Confident	132 Å²	132	102.3 Å²	102.3	57%	0.574	51%	0.508	S	S	*	.	H	α-helix	trans	-65.6	-36.6	176.6	-71.5	177.6	179.7	178.6	0	112.5	T56 H57 M58 L64	T56-K60 WeakPolarHBondContact O-CG 3.14Å; T56-K60 PolarHBondContact O-N 3.08Å; T56-K60 VanDerWaalsContact O-N 3.14Å; H57-K60 PolarHBondContact O-N 2.6Å; M58-K60 PolarHBondContact O-N 3.09Å; K60-L64 WeakPolarHBondContact O-CB 3.41Å; K60-L64 PolarHBondContact O-N 3.25Å
61	A	89.8	Confident	86.6	Confident	36 Å²	36	101.6 Å²	101.6	30%	0.298	50%	0.499	S	S	.	.	H	α-helix	trans	-65.3	-46.7	176	0	0	0	0	0	111.7	H57 M58 R59 L64 M65	H57-A61 PolarHBondContact O-N 3.23Å; M58-A61 WeakPolarHBondContact O-CB 3.25Å; M58-A61 PolarHBondContact O-N 3.41Å; R59-A61 VanDerWaalsContact C-N 3.35Å; A61-L64 PolarHBondContact O-N 3.08Å; A61-M65 WeakPolarHBondContact O-CG 3.37Å; A61-M65 PolarHBondContact O-N 3.15Å
62	F	90.9	Very high	87.7	Confident	71 Å²	71	99.5 Å²	99.5	31%	0.311	49%	0.49	S	S	.	.	H	α-helix	trans	-64.6	-40.1	176.4	-89.3	-94.3	0	0	0	113	M58 R59 L64 M65 N66 V92	M58-F62 WeakPolarHBondContact O-CD2 3.21Å; M58-F62 PolarHBondContact O-N 3.31Å; R59-F62 PolarHBondContact O-N 3.31Å; F62-L64 PolarHBondContact O-N 2.9Å; F62-M65 HydrophobicContact CB-CE 4.38Å; F62-M65 HydrophobicContact CD1-CE 4Å; F62-M65 HydrophobicContact CD2-CE 3.75Å; F62-M65 HydrophobicContact CE1-CE 4.19Å; F62-M65 HydrophobicContact CE2-CE 3.95Å; F62-M65 HydrophobicContact CG-CE 3.78Å; F62-M65 HydrophobicContact CZ-CE 4.17Å; F62-M65 PolarHBondContact O-N 3.25Å; F62-N66 PolarHBondContact O-N 3.48Å; F62-V92 HydrophobicContact CE1-CG1 3.97Å
63	Q	90.4	Very high	88.3	Confident	112 Å²	112	98.4 Å²	98.4	52%	0.523	48%	0.477	S	S	.	.	H	α-helix	trans	-56.5	-47.3	171.1	-75.5	172.3	-23.6	0	0	111.8	R59 M65 N66 D67	R59-Q63 WeakPolarHBondContact O-CB 3.44Å; R59-Q63 VanDerWaalsContact O-CG 3.28Å; R59-Q63 WeakPolarHBondContact O-CG 3.26Å; R59-Q63 PolarHBondContact O-N 2.74Å; Q63-M65 PolarHBondContact O-N 2.87Å; Q63-N66 WeakPolarHBondContact O-CB 3.49Å; Q63-N66 PolarHBondContact O-N 3.22Å; Q63-D67 PolarHBondContact O-N 3.02Å
64	L	91.6	Very high	89	Confident	104 Å²	104	97.1 Å²	97.1	55%	0.545	48%	0.477	S	S	.	.	H	α-helix	trans	-64.8	-37.4	177	-176	63.8	0	0	0	112.6	K60 A61 F62 N66 D67 L68	K60-L64 WeakPolarHBondContact O-CB 3.41Å; K60-L64 PolarHBondContact O-N 3.25Å; A61-L64 PolarHBondContact O-N 3.08Å; F62-L64 PolarHBondContact O-N 2.9Å; L64-N66 VanDerWaalsContact C-N 3.31Å; L64-N66 PolarHBondContact O-N 2.73Å; L64-D67 WeakPolarHBondContact O-CB 3.43Å; L64-D67 PolarHBondContact O-N 3.46Å; L64-L68 HydrophobicContact CG-CD1 4.5Å; L64-L68 WeakPolarHBondContact O-CG 3.34Å; L64-L68 PolarHBondContact O-N 3.08Å
65	M	92.5	Very high	89.3	Confident	53 Å²	53	94.5 Å²	94.5	26%	0.261	47%	0.465	S	S	.	.	H	α-helix	trans	-65.8	-33.6	174.8	-71.3	-173.8	-71.1	0	0	112.1	A61 F62 Q63 R69 V92 Y134	A61-M65 WeakPolarHBondContact O-CG 3.37Å; A61-M65 PolarHBondContact O-N 3.15Å; F62-M65 HydrophobicContact CB-CE 4.38Å; F62-M65 HydrophobicContact CD1-CE 4Å; F62-M65 HydrophobicContact CD2-CE 3.75Å; F62-M65 HydrophobicContact CE1-CE 4.19Å; F62-M65 HydrophobicContact CE2-CE 3.95Å; F62-M65 HydrophobicContact CG-CE 3.78Å; F62-M65 HydrophobicContact CZ-CE 4.17Å; F62-M65 PolarHBondContact O-N 3.25Å; Q63-M65 PolarHBondContact O-N 2.87Å; M65-R69 WeakPolarHBondContact O-CB 3.37Å; M65-R69 PolarHBondContact O-N 3.05Å; M65-V92 HydrophobicContact SD-CG2 3.76Å; M65-Y134 HydrophobicContact CB-CD1 4.25Å; M65-Y134 HydrophobicContact CB-CE1 4.11Å
66	N	92.3	Very high	89.9	Confident	36 Å²	36	90.7 Å²	90.7	19%	0.193	45%	0.45	C	S	.	.	H	α-helix	trans	-70.4	-40.8	172.9	-162.5	29.2	0	0	0	112.1	F62 Q63 L64 L68 R69 S70 Y134	F62-N66 PolarHBondContact O-N 3.48Å; Q63-N66 WeakPolarHBondContact O-CB 3.49Å; Q63-N66 PolarHBondContact O-N 3.22Å; L64-N66 VanDerWaalsContact C-N 3.31Å; L64-N66 PolarHBondContact O-N 2.73Å; N66-L68 VanDerWaalsContact C-N 3.29Å; N66-L68 PolarHBondContact O-N 3.04Å; N66-R69 WeakPolarHBondContact O-CB 3.5Å; N66-R69 PolarHBondContact O-N 3.44Å; N66-R69 PolarHBondContact OD1-NE 3.18Å; N66-R69 VanDerWaalsContact OD1-NE 3.13Å; N66-R69 PolarHBondContact OD1-NH2 3.26Å; N66-S70 PolarHBondContact O-N 3.23Å; N66-S70 PolarHBondContact O-OG 3.32Å; N66-Y134 HydrophobicContact CB-CD1 4.11Å; N66-Y134 HydrophobicContact CB-CG 4.46Å
67	D	91.4	Very high	90.2	Very high	80 Å²	80	87.9 Å²	87.9	43%	0.428	43%	0.433	S	S	.	.	H	α-helix	trans	-60.4	-38	173.3	-81.3	-4.6	0	0	0	112.2	Q63 L64 S70 K71	Q63-D67 PolarHBondContact O-N 3.02Å; L64-D67 WeakPolarHBondContact O-CB 3.43Å; L64-D67 PolarHBondContact O-N 3.46Å; D67-S70 PolarHBondContact O-OG 3.25Å; D67-K71 WeakPolarHBondContact O-CD 3.25Å; D67-K71 WeakPolarHBondContact O-CG 3.34Å; D67-K71 PolarHBondContact O-N 3.49Å
68	L	91.8	Very high	90.5	Very high	41 Å²	41	84.6 Å²	84.6	22%	0.215	42%	0.418	C	S	.	.	H	α-helix	trans	-67.7	-45.5	174	-71.2	168.4	0	0	0	111.3	L64 N66 S70 K71 Q72 M73 L74	L64-L68 HydrophobicContact CG-CD1 4.5Å; L64-L68 WeakPolarHBondContact O-CG 3.34Å; L64-L68 PolarHBondContact O-N 3.08Å; N66-L68 VanDerWaalsContact C-N 3.29Å; N66-L68 PolarHBondContact O-N 3.04Å; L68-S70 PolarHBondContact O-N 3.16Å; L68-K71 CarbonylContact O-C 3.42Å; L68-K71 PolarHBondContact O-N 3Å; L68-K71 VanDerWaalsContact O-N 3.15Å; L68-Q72 PolarHBondContact O-N 2.74Å; L68-Q72 VanDerWaalsContact O-N 3.16Å; L68-M73 HydrophobicContact CB-CB 4.34Å; L68-M73 HydrophobicContact CD2-CB 3.79Å; L68-M73 HydrophobicContact CD2-CE 4.18Å; L68-M73 PolarHBondContact O-N 3.14Å; L68-L74 HydrophobicContact CD1-CD1 4.49Å
69	R	93.1	Very high	90.8	Very high	28 Å²	28	79.3 Å²	79.3	11%	0.106	39%	0.392	C	S	.	.	H	α-helix	trans	-57	-47.8	176.6	-174.9	-173.8	65	118.4	-1.7	112	M65 N66 K71 Q72 P87 D131 Y134	M65-R69 WeakPolarHBondContact O-CB 3.37Å; M65-R69 PolarHBondContact O-N 3.05Å; N66-R69 WeakPolarHBondContact O-CB 3.5Å; N66-R69 PolarHBondContact O-N 3.44Å; N66-R69 PolarHBondContact OD1-NE 3.18Å; N66-R69 VanDerWaalsContact OD1-NE 3.13Å; N66-R69 PolarHBondContact OD1-NH2 3.26Å; R69-K71 PolarHBondContact O-N 3.28Å; R69-Q72 PolarHBondContact O-N 3Å; R69-P87 WeakPolarHBondContact CD-O 3.39Å; R69-P87 VanDerWaalsContact CG-O 3.24Å; R69-P87 WeakPolarHBondContact CG-O 3.45Å; R69-D131 IonicContact CZ-OD1 3.16Å; R69-D131 IonicContact NH1-OD1 2.74Å; R69-D131 PolarHBondContact NH1-OD1 2.92Å; R69-D131 IonicContact NH2-OD1 2.7Å; R69-D131 PolarHBondContact NH2-OD1 3.22Å; R69-Y134 HydrophobicContact CB-CE1 4.26Å
70	S	90.5	Very high	91.1	Very high	85 Å²	85	71.4 Å²	71.4	59%	0.594	36%	0.364	S	S	*	.	H	α-helix	trans	-62.8	-27.2	179.6	66.1	0	0	0	0	113.5	N66 D67 L68	N66-S70 PolarHBondContact O-N 3.23Å; N66-S70 PolarHBondContact O-OG 3.32Å; D67-S70 PolarHBondContact O-OG 3.25Å; L68-S70 PolarHBondContact O-N 3.16Å
71	K	90.9	Very high	91.3	Very high	141 Å²	141	65.2 Å²	65.2	61%	0.613	34%	0.337	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.6	4.3	174.5	-66.1	167	-170.9	155.3	0	113.3	D67 L68 R69 M73	D67-K71 WeakPolarHBondContact O-CD 3.25Å; D67-K71 WeakPolarHBondContact O-CG 3.34Å; D67-K71 PolarHBondContact O-N 3.49Å; L68-K71 CarbonylContact O-C 3.42Å; L68-K71 PolarHBondContact O-N 3Å; L68-K71 VanDerWaalsContact O-N 3.15Å; R69-K71 PolarHBondContact O-N 3.28Å; K71-M73 HydrophobicContact CB-CG 3.84Å; K71-M73 PolarHBondContact O-N 3.05Å
72	Q	90.3	Very high	91.2	Very high	142 Å²	142	67 Å²	67	66%	0.664	36%	0.36	S	S	*	.	T	Hydrogen-bonded Turn	trans	54.2	28.5	-174	-56.9	-176.8	-12.1	0	0	113.6	L68 R69 P87	L68-Q72 PolarHBondContact O-N 2.74Å; L68-Q72 VanDerWaalsContact O-N 3.16Å; R69-Q72 PolarHBondContact O-N 3Å; Q72-P87 HydrophobicContact CG-CG 4.15Å
73	M	87.7	Confident	91	Very high	104 Å²	104	69.5 Å²	69.5	51%	0.512	39%	0.386	S	S	.	.			trans	-89.6	129.3	179.6	-70.3	-99.3	-67.6	0	0	109.7	L68 K71 C75 H89	L68-M73 HydrophobicContact CB-CB 4.34Å; L68-M73 HydrophobicContact CD2-CB 3.79Å; L68-M73 HydrophobicContact CD2-CE 4.18Å; L68-M73 PolarHBondContact O-N 3.14Å; K71-M73 HydrophobicContact CB-CG 3.84Å; K71-M73 PolarHBondContact O-N 3.05Å; M73-C75 PolarHBondContact O-N 2.96Å; M73-C75 VanDerWaalsContact O-N 3.16Å; M73-H89 PolarHBondContact O-NE2 2.95Å
74	L	90.1	Very high	91.1	Very high	135 Å²	135	64.9 Å²	64.9	71%	0.707	37%	0.365	S	S	*	.	S	Bend	trans	63.3	7.3	178.6	-52.5	176.8	0	0	0	116.1	L68 D76 H89	L68-L74 HydrophobicContact CD1-CD1 4.49Å; L74-D76 PolarHBondContact O-N 3.33Å; L74-H89 PolarHBondContact O-CD2 2.93Å; L74-H89 VanDerWaalsContact O-CD2 3.23Å
75	C	89.6	Confident	91.2	Very high	39 Å²	39	64.7 Å²	64.7	26%	0.264	36%	0.361	S	S	.	.			trans	-63.2	123.5	171.9	-60.5	0	0	0	0	110.7	M73 P87 A88	M73-C75 PolarHBondContact O-N 2.96Å; M73-C75 VanDerWaalsContact O-N 3.16Å; C75-P87 HydrophobicContact CB-CB 4.24Å; C75-A88 WeakPolarHBondContact CA-O 3.38Å; C75-A88 WeakPolarHBondContact CB-O 3.49Å
76	D	91.8	Very high	91.3	Very high	76 Å²	76	62.2 Å²	62.2	41%	0.406	35%	0.349	S	S	.	.			trans	-114.2	4.4	-175.8	63	-10.1	0	0	0	112.8	L74 A88 H89 R90	L74-D76 PolarHBondContact O-N 3.33Å; D76-A88 PolarHBondContact N-O 3.18Å; D76-H89 VanDerWaalsContact OD1-CA 3.25Å; D76-H89 WeakPolarHBondContact OD1-CA 3.44Å; D76-R90 PolarHBondContact O-NE 3.47Å; D76-R90 WeakPolarHBondContact OD1-CG 3.36Å; D76-R90 PolarHBondContact OD1-N 2.96Å; D76-R90 WeakPolarHBondContact OD2-CB 3.18Å; D76-R90 WeakPolarHBondContact OD2-CD 3.4Å
77	V	92.5	Very high	91.4	Very high	5 Å²	5	62 Å²	62	3%	0.03	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.5	146.1	169.1	65.9	0	0	0	0	111.4	L79 A88 R90 L93 F104 V116	V77-L79 HydrophobicContact CG2-CD2 4.12Å; V77-A88 HydrophobicContact CG1-CB 4.18Å; V77-A88 PolarHBondContact N-O 3.26Å; V77-A88 PolarHBondContact O-N 3.45Å; V77-A88 VanDerWaalsContact O-O 3.14Å; V77-R90 HydrophobicContact CB-CG 3.75Å; V77-R90 HydrophobicContact CG1-CG 3.67Å; V77-L93 HydrophobicContact CG1-CD1 4.01Å; V77-F104 HydrophobicContact CG1-CZ 4.21Å; V77-F104 HydrophobicContact CG2-CE1 4.23Å; V77-F104 HydrophobicContact CG2-CZ 4.16Å; V77-V116 HydrophobicContact CG2-CB 4.46Å; V77-V116 HydrophobicContact CG2-CG2 3.94Å
78	Q	93.2	Very high	91.5	Very high	61 Å²	61	58.1 Å²	58.1	29%	0.285	33%	0.329	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	112	170.5	-168.7	175.5	19.8	0	0	108.7	E85 Q114 Q115 V116	Q78-E85 HydrophobicContact CG-CB 4.27Å; Q78-E85 VanDerWaalsContact NE2-CD 3.3Å; Q78-E85 PolarHBondContact NE2-OE2 3.42Å; Q78-Q114 PolarHBondContact N-O 2.97Å; Q78-Q115 WeakPolarHBondContact O-CA 3.45Å; Q78-V116 PolarHBondContact O-N 3.41Å
79	L	93.6	Very high	91.6	Very high	0 Å²	0	57 Å²	57	0%	0	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.9	140.3	174.2	-56.1	-178.9	0	0	0	109.5	V77 E85 V86 L93 F100 V116 L126 V130	V77-L79 HydrophobicContact CG2-CD2 4.12Å; L79-E85 CarbonylContact O-C 3.57Å; L79-E85 WeakPolarHBondContact O-CA 3.49Å; L79-V86 HydrophobicContact CB-CB 4.46Å; L79-V86 PolarHBondContact N-O 2.95Å; L79-V86 PolarHBondContact O-N 3.39Å; L79-L93 HydrophobicContact CD1-CD1 3.93Å; L79-L93 HydrophobicContact CG-CD1 4.38Å; L79-F100 HydrophobicContact CD1-CE1 3.96Å; L79-F100 HydrophobicContact CD1-CE2 4.49Å; L79-F100 HydrophobicContact CD1-CZ 3.69Å; L79-F100 HydrophobicContact CD2-CE1 4.16Å; L79-V116 CarbonylContact C-O 3.5Å; L79-V116 WeakPolarHBondContact CA-O 3.32Å; L79-V116 HydrophobicContact CD2-CB 4.1Å; L79-V116 HydrophobicContact CD2-CG1 4.46Å; L79-L126 HydrophobicContact CB-CD2 4.06Å; L79-L126 HydrophobicContact CD1-CD1 4.35Å; L79-V130 HydrophobicContact CD1-CG2 3.96Å
80	V	92.3	Very high	91.6	Very high	19 Å²	19	57.4 Å²	57.4	12%	0.115	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	128.2	-179.5	-175	0	0	0	0	109.8	V84 E85 Q115 V116 E117 I118	V80-V84 WeakPolarHBondContact CA-O 3.32Å; V80-E85 HydrophobicContact CG2-CG 4.33Å; V80-Q115 HydrophobicContact CG2-CG 3.45Å; V80-Q115 VanDerWaalsContact CG2-CG 3.45Å; V80-V116 PolarHBondContact N-O 3.15Å; V80-E117 CarbonylContact O-C 3.57Å; V80-E117 WeakPolarHBondContact O-CA 3.34Å; V80-I118 PolarHBondContact O-N 3.35Å
81	A	91.7	Very high	91.7	Very high	2 Å²	2	58.5 Å²	58.5	2%	0.017	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.3	107.6	171.4	0	0	0	0	0	108.9	S83 V84 V121 L126	A81-S83 PolarHBondContact O-N 2.93Å; A81-V84 PolarHBondContact N-O 3.41Å; A81-V84 PolarHBondContact O-N 2.98Å; A81-V121 WeakPolarHBondContact CB-O 3.5Å; A81-L126 HydrophobicContact CB-CB 4.26Å; A81-L126 HydrophobicContact CB-CD2 3.58Å
82	G	86.7	Confident	91.8	Very high	74 Å²	74	52.1 Å²	52.1	76%	0.763	30%	0.3	S	S	*	.	T	Hydrogen-bonded Turn	trans	59.4	-116.7	-171.7	0	0	0	0	0	111.8
83	S	87.6	Confident	91.9	Very high	123 Å²	123	45.3 Å²	45.3	86%	0.86	27%	0.268	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.9	1	177.1	57.4	0	0	0	0	114.2	A81	A81-S83 PolarHBondContact O-N 2.93Å
84	V	92.9	Very high	92.2	Very high	15 Å²	15	41.4 Å²	41.4	9%	0.091	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.2	119.9	-177.8	-175.4	0	0	0	0	110.3	V80 A81 V86 G123	V80-V84 WeakPolarHBondContact CA-O 3.32Å; A81-V84 PolarHBondContact N-O 3.41Å; A81-V84 PolarHBondContact O-N 2.98Å; V84-V86 HydrophobicContact CG1-CG2 4.06Å; V84-G123 WeakPolarHBondContact CG1-O 3.49Å
85	E	93.1	Very high	92.3	Very high	99 Å²	99	38.8 Å²	38.8	46%	0.463	25%	0.25	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.6	136.8	171.2	-54.4	-174.1	149.4	0	0	110.1	Q78 L79 V80	Q78-E85 HydrophobicContact CG-CB 4.27Å; Q78-E85 VanDerWaalsContact NE2-CD 3.3Å; Q78-E85 PolarHBondContact NE2-OE2 3.42Å; L79-E85 CarbonylContact O-C 3.57Å; L79-E85 WeakPolarHBondContact O-CA 3.49Å; V80-E85 HydrophobicContact CG2-CG 4.33Å
86	V	94.1	Very high	92.4	Very high	2 Å²	2	39.3 Å²	39.3	1%	0.012	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	104	-178.9	-171.9	0	0	0	0	109.2	L79 V84 R127 V130	L79-V86 HydrophobicContact CB-CB 4.46Å; L79-V86 PolarHBondContact N-O 2.95Å; L79-V86 PolarHBondContact O-N 3.39Å; V84-V86 HydrophobicContact CG1-CG2 4.06Å; V86-R127 HydrophobicContact CG2-CB 4.14Å; V86-V130 HydrophobicContact CG1-CB 3.98Å; V86-V130 HydrophobicContact CG1-CG1 3.79Å; V86-V130 HydrophobicContact CG1-CG2 4.12Å
87	P	94.1	Very high	92.6	Very high	30 Å²	30	35.7 Å²	35.7	20%	0.195	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.4	138.9	174.7	30.8	-34	0	0	0	110.2	R69 Q72 C75	R69-P87 WeakPolarHBondContact CD-O 3.39Å; R69-P87 VanDerWaalsContact CG-O 3.24Å; R69-P87 WeakPolarHBondContact CG-O 3.45Å; Q72-P87 HydrophobicContact CG-CG 4.15Å; C75-P87 HydrophobicContact CB-CB 4.24Å
88	A	94.6	Very high	92.6	Very high	0 Å²	0	39 Å²	39	0%	0	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.8	175.4	-176.6	0	0	0	0	0	112.3	C75 D76 V77 L93 V130	C75-A88 WeakPolarHBondContact CA-O 3.38Å; C75-A88 WeakPolarHBondContact CB-O 3.49Å; D76-A88 PolarHBondContact N-O 3.18Å; V77-A88 HydrophobicContact CG1-CB 4.18Å; V77-A88 PolarHBondContact N-O 3.26Å; V77-A88 PolarHBondContact O-N 3.45Å; V77-A88 VanDerWaalsContact O-O 3.14Å; A88-L93 HydrophobicContact CB-CD1 3.7Å; A88-L93 HydrophobicContact CB-CD2 4.37Å; A88-L93 HydrophobicContact CB-CG 4.09Å; A88-V130 HydrophobicContact CB-CG1 4.46Å
89	H	94.2	Very high	92.6	Very high	17 Å²	17	39 Å²	39	8%	0.079	25%	0.254	C	S	.	.			trans	-109.8	122.7	174.2	-54	81.5	0	0	0	109.6	M73 L74 D76 V91 V92 L93 Y134	M73-H89 PolarHBondContact O-NE2 2.95Å; L74-H89 PolarHBondContact O-CD2 2.93Å; L74-H89 VanDerWaalsContact O-CD2 3.23Å; D76-H89 VanDerWaalsContact OD1-CA 3.25Å; D76-H89 WeakPolarHBondContact OD1-CA 3.44Å; H89-V91 VanDerWaalsContact C-N 3.27Å; H89-V91 HydrophobicContact CB-CG1 4.45Å; H89-V91 PolarHBondContact O-N 2.93Å; H89-V92 HydrophobicContact CB-CB 4.32Å; H89-V92 HydrophobicContact CB-CG2 3.91Å; H89-V92 PolarHBondContact O-N 3.38Å; H89-V92 VanDerWaalsContact O-N 3.08Å; H89-L93 PolarHBondContact O-N 3.49Å; H89-L93 VanDerWaalsContact O-N 3.09Å; H89-Y134 WeakPolarHBondContact CB-OH 3.45Å; H89-Y134 PolarHBondContact N-OH 3.23Å; H89-Y134 AromaticContact ND1-CE1 3.86Å; H89-Y134 AromaticContact ND1-CZ 3.78Å; H89-Y134 PolarHBondContact ND1-OH 2.92Å
90	R	92.3	Very high	92.5	Very high	37 Å²	37	39 Å²	39	14%	0.14	25%	0.254	C	S	.	.	H	α-helix	trans	-53.1	-43	-179	-71.5	165.1	160.2	-93.6	-5.8	112.2	D76 V77 V92 L93 A94 F104 E110 S111 A113	D76-R90 PolarHBondContact O-NE 3.47Å; D76-R90 WeakPolarHBondContact OD1-CG 3.36Å; D76-R90 PolarHBondContact OD1-N 2.96Å; D76-R90 WeakPolarHBondContact OD2-CB 3.18Å; D76-R90 WeakPolarHBondContact OD2-CD 3.4Å; V77-R90 HydrophobicContact CB-CG 3.75Å; V77-R90 HydrophobicContact CG1-CG 3.67Å; R90-V92 PolarHBondContact O-N 2.93Å; R90-L93 PolarHBondContact O-N 3.34Å; R90-A94 WeakPolarHBondContact O-CB 3.34Å; R90-A94 PolarHBondContact O-N 3.26Å; R90-F104 HydrophobicContact CB-CD2 3.92Å; R90-F104 HydrophobicContact CB-CE2 4.21Å; R90-F104 HydrophobicContact CB-CG 4.3Å; R90-F104 HydrophobicContact CG-CD1 4.33Å; R90-F104 HydrophobicContact CG-CD2 4.07Å; R90-F104 HydrophobicContact CG-CE1 4.34Å; R90-F104 HydrophobicContact CG-CE2 4.09Å; R90-F104 HydrophobicContact CG-CG 4.2Å; R90-F104 HydrophobicContact CG-CZ 4.23Å; R90-F104 VanDerWaalsContact NH1-CD1 3.26Å; R90-E110 PolarHBondContact NH2-O 3.09Å; R90-S111 PolarHBondContact NH1-O 3.35Å; R90-S111 PolarHBondContact NH2-O 2.64Å; R90-A113 PolarHBondContact NH2-O 2.83Å
91	V	92.1	Very high	92.4	Very high	107 Å²	107	40.3 Å²	40.3	65%	0.648	26%	0.263	S	S	*	.	H	α-helix	trans	-63.7	-37.5	179.7	67	0	0	0	0	113	H89 A95	H89-V91 VanDerWaalsContact C-N 3.27Å; H89-V91 HydrophobicContact CB-CG1 4.45Å; H89-V91 PolarHBondContact O-N 2.93Å; V91-A95 VanDerWaalsContact O-CB 3.26Å; V91-A95 WeakPolarHBondContact O-CB 3.49Å; V91-A95 PolarHBondContact O-N 2.99Å
92	V	93.3	Very high	92.3	Very high	7 Å²	7	43.1 Å²	43.1	4%	0.042	29%	0.286	C	S	.	.	H	α-helix	trans	-74.9	-43.6	-180	-175.7	0	0	0	0	110.1	F62 M65 H89 R90 A95 C96 I133 Y134	F62-V92 HydrophobicContact CE1-CG1 3.97Å; M65-V92 HydrophobicContact SD-CG2 3.76Å; H89-V92 HydrophobicContact CB-CB 4.32Å; H89-V92 HydrophobicContact CB-CG2 3.91Å; H89-V92 PolarHBondContact O-N 3.38Å; H89-V92 VanDerWaalsContact O-N 3.08Å; R90-V92 PolarHBondContact O-N 2.93Å; V92-A95 PolarHBondContact O-N 2.98Å; V92-C96 PolarHBondContact O-N 3.42Å; V92-I133 HydrophobicContact CG1-CG2 3.87Å; V92-Y134 HydrophobicContact CB-CE1 4.21Å; V92-Y134 HydrophobicContact CB-CE2 4.42Å; V92-Y134 HydrophobicContact CG1-CD1 4.29Å; V92-Y134 HydrophobicContact CG1-CD2 4.41Å; V92-Y134 HydrophobicContact CG1-CE1 3.86Å; V92-Y134 HydrophobicContact CG1-CE2 4Å; V92-Y134 HydrophobicContact CG2-CE1 4.15Å
93	L	93.3	Very high	92.4	Very high	0 Å²	0	40.3 Å²	40.3	0%	0	25%	0.254	C	S	.	.	H	α-helix	trans	-59.5	-47.3	174.2	-67.8	178.4	0	0	0	111.6	V77 L79 A88 H89 R90 A95 C96 S97 F100 F104 V130 I133	V77-L93 HydrophobicContact CG1-CD1 4.01Å; L79-L93 HydrophobicContact CD1-CD1 3.93Å; L79-L93 HydrophobicContact CG-CD1 4.38Å; A88-L93 HydrophobicContact CB-CD1 3.7Å; A88-L93 HydrophobicContact CB-CD2 4.37Å; A88-L93 HydrophobicContact CB-CG 4.09Å; H89-L93 PolarHBondContact O-N 3.49Å; H89-L93 VanDerWaalsContact O-N 3.09Å; R90-L93 PolarHBondContact O-N 3.34Å; L93-A95 PolarHBondContact O-N 3.45Å; L93-C96 PolarHBondContact O-N 2.92Å; L93-S97 WeakPolarHBondContact O-CB 3.43Å; L93-S97 PolarHBondContact O-N 3.2Å; L93-F100 HydrophobicContact CB-CB 3.87Å; L93-F100 HydrophobicContact CB-CD2 3.85Å; L93-F100 HydrophobicContact CB-CG 3.92Å; L93-F100 HydrophobicContact CD1-CG 4.49Å; L93-F100 HydrophobicContact CD2-CD2 4.03Å; L93-F100 HydrophobicContact CD2-CE2 4.02Å; L93-F100 HydrophobicContact CG-CD2 4.35Å; L93-F104 HydrophobicContact CB-CE2 3.95Å; L93-F104 HydrophobicContact CD1-CE2 3.85Å; L93-F104 HydrophobicContact CD1-CZ 4.14Å; L93-V130 HydrophobicContact CD2-CG1 4.44Å; L93-V130 HydrophobicContact CD2-CG2 4.31Å; L93-I133 HydrophobicContact CD2-CD1 3.77Å; L93-I133 HydrophobicContact CD2-CG2 4.34Å
94	A	92.8	Very high	92.5	Very high	22 Å²	22	35.6 Å²	35.6	18%	0.182	22%	0.218	C	C	.	.	H	α-helix	trans	-66.5	-32.6	179	0	0	0	0	0	113.5	R90 C96 C101	R90-A94 WeakPolarHBondContact O-CB 3.34Å; R90-A94 PolarHBondContact O-N 3.26Å; A94-C96 VanDerWaalsContact C-N 3.33Å; A94-C101 HydrophobicContact CB-CB 4.12Å; A94-C101 WeakPolarHBondContact O-CB 3.35Å
95	A	92.4	Very high	92.2	Very high	79 Å²	79	40.2 Å²	40.2	65%	0.653	25%	0.246	S	C	*	.	H	α-helix	trans	-70	-29.5	177	0	0	0	0	0	113.2	V91 V92 L93	V91-A95 VanDerWaalsContact O-CB 3.26Å; V91-A95 WeakPolarHBondContact O-CB 3.49Å; V91-A95 PolarHBondContact O-N 2.99Å; V92-A95 PolarHBondContact O-N 2.98Å; L93-A95 PolarHBondContact O-N 3.45Å
96	C	92.1	Very high	91.6	Very high	50 Å²	50	36.7 Å²	36.7	34%	0.338	24%	0.236	S	C	.	.	H	α-helix	trans	-106.7	-11.6	-174.4	-62.8	0	0	0	0	114.5	V92 L93 A94 I133 L157	V92-C96 PolarHBondContact O-N 3.42Å; L93-C96 PolarHBondContact O-N 2.92Å; A94-C96 VanDerWaalsContact C-N 3.33Å; C96-I133 HydrophobicContact CB-CB 4.44Å; C96-I133 HydrophobicContact CB-CG1 4.11Å; C96-I133 HydrophobicContact CB-CG2 3.82Å; C96-L157 WeakPolarHBondContact O-CD2 3.41Å
97	S	94.9	Very high	90.6	Very high	1 Å²	1	44.3 Å²	44.3	1%	0.007	28%	0.277	C	S	.	.			trans	-137.7	119.4	-179.5	165.5	0	0	0	0	110.6	L93 Y99 F100 C101 L155	L93-S97 WeakPolarHBondContact O-CB 3.43Å; L93-S97 PolarHBondContact O-N 3.2Å; S97-Y99 PolarHBondContact O-N 3.44Å; S97-Y99 PolarHBondContact OG-N 3.02Å; S97-F100 PolarHBondContact O-N 3.49Å; S97-F100 PolarHBondContact OG-N 2.96Å; S97-C101 WeakPolarHBondContact O-CB 3.32Å; S97-C101 PolarHBondContact O-N 3.21Å; S97-L155 PolarHBondContact OG-O 2.95Å
98	P	93.5	Very high	89.7	Confident	75 Å²	75	47.5 Å²	47.5	49%	0.487	29%	0.29	S	S	.	.	H	α-helix	trans	-65.8	-26	175.9	-15	27	0	0	0	112.7	C101 A102 Q156	P98-C101 WeakPolarHBondContact O-CB 3.48Å; P98-C101 PolarHBondContact O-N 3.46Å; P98-A102 WeakPolarHBondContact O-CB 3.49Å; P98-A102 PolarHBondContact O-N 2.99Å; P98-Q156 HydrophobicContact CG-CB 4.46Å
99	Y	92.6	Very high	88.7	Confident	60 Å²	60	51.9 Å²	51.9	24%	0.235	32%	0.321	C	S	.	.	H	α-helix	trans	-61.2	-52.4	171.3	174.4	-91.3	0	0	0	111.4	S97 C101 A102 M103 I118 L154 L155	S97-Y99 PolarHBondContact O-N 3.44Å; S97-Y99 PolarHBondContact OG-N 3.02Å; Y99-C101 VanDerWaalsContact C-N 3.31Å; Y99-C101 PolarHBondContact O-N 3.23Å; Y99-A102 PolarHBondContact O-N 2.95Å; Y99-M103 HydrophobicContact CD1-CE 4.42Å; Y99-M103 HydrophobicContact CE1-CE 3.45Å; Y99-M103 VanDerWaalsContact CE1-CE 3.45Å; Y99-M103 WeakPolarHBondContact O-CB 3.49Å; Y99-M103 PolarHBondContact O-N 3.4Å; Y99-M103 VanDerWaalsContact OH-CE 3.32Å; Y99-M103 WeakPolarHBondContact OH-CE 3.47Å; Y99-I118 HydrophobicContact CE1-CD1 4.39Å; Y99-L154 WeakPolarHBondContact CD2-O 3.28Å; Y99-L155 HydrophobicContact CD1-CD2 3.55Å; Y99-L155 HydrophobicContact CE1-CD2 3.55Å; Y99-L155 HydrophobicContact CG-CD2 4.33Å
100	F	92.5	Very high	87.8	Confident	0 Å²	0	54.6 Å²	54.6	0%	0	33%	0.334	C	S	.	.	H	α-helix	trans	-67.7	-31.8	176.5	-70.9	-52.5	0	0	0	112.4	L79 L93 S97 M103 F104 I118 I133 L155	L79-F100 HydrophobicContact CD1-CE1 3.96Å; L79-F100 HydrophobicContact CD1-CE2 4.49Å; L79-F100 HydrophobicContact CD1-CZ 3.69Å; L79-F100 HydrophobicContact CD2-CE1 4.16Å; L93-F100 HydrophobicContact CB-CB 3.87Å; L93-F100 HydrophobicContact CB-CD2 3.85Å; L93-F100 HydrophobicContact CB-CG 3.92Å; L93-F100 HydrophobicContact CD1-CG 4.49Å; L93-F100 HydrophobicContact CD2-CD2 4.03Å; L93-F100 HydrophobicContact CD2-CE2 4.02Å; L93-F100 HydrophobicContact CG-CD2 4.35Å; S97-F100 PolarHBondContact O-N 3.49Å; S97-F100 PolarHBondContact OG-N 2.96Å; F100-M103 HydrophobicContact CD1-SD 4.16Å; F100-M103 PolarHBondContact O-N 3.42Å; F100-F104 HydrophobicContact CB-CD2 4.17Å; F100-F104 HydrophobicContact CB-CE2 3.89Å; F100-F104 HydrophobicContact CD1-CE2 4.05Å; F100-F104 HydrophobicContact CD1-CZ 4.08Å; F100-F104 HydrophobicContact CG-CE2 4.23Å; F100-F104 WeakPolarHBondContact O-CB 3.4Å; F100-F104 WeakPolarHBondContact O-CD2 3.37Å; F100-F104 WeakPolarHBondContact O-CG 3.39Å; F100-F104 PolarHBondContact O-N 3.26Å; F100-I118 HydrophobicContact CE1-CD1 4.45Å; F100-I133 HydrophobicContact CD2-CD1 4.5Å; F100-I133 HydrophobicContact CE2-CD1 4.36Å; F100-L155 HydrophobicContact CE1-CD2 4.26Å; F100-L155 HydrophobicContact CE2-CD1 4.12Å; F100-L155 HydrophobicContact CE2-CD2 4.13Å; F100-L155 HydrophobicContact CZ-CD1 4.08Å; F100-L155 HydrophobicContact CZ-CD2 3.71Å; F100-L155 HydrophobicContact CZ-CG 4.47Å
101	C	90.6	Very high	87	Confident	47 Å²	47	53.8 Å²	53.8	32%	0.318	33%	0.334	S	S	.	.	H	α-helix	trans	-59.6	-53.4	172.7	-167.8	0	0	0	0	111.3	A94 S97 P98 Y99 M103 F104 T105	A94-C101 HydrophobicContact CB-CB 4.12Å; A94-C101 WeakPolarHBondContact O-CB 3.35Å; S97-C101 WeakPolarHBondContact O-CB 3.32Å; S97-C101 PolarHBondContact O-N 3.21Å; P98-C101 WeakPolarHBondContact O-CB 3.48Å; P98-C101 PolarHBondContact O-N 3.46Å; Y99-C101 VanDerWaalsContact C-N 3.31Å; Y99-C101 PolarHBondContact O-N 3.23Å; C101-M103 VanDerWaalsContact C-N 3.32Å; C101-M103 PolarHBondContact O-N 2.95Å; C101-F104 PolarHBondContact O-N 3.41Å; C101-T105 WeakPolarHBondContact O-CB 3.44Å; C101-T105 WeakPolarHBondContact O-CG2 3.42Å; C101-T105 PolarHBondContact O-N 2.91Å; C101-T105 PolarHBondContact O-OG1 3.16Å
102	A	89	Confident	86.3	Confident	60 Å²	60	57 Å²	57	50%	0.496	34%	0.339	S	S	.	.	H	α-helix	trans	-61.4	-38.7	177.5	0	0	0	0	0	112.5	P98 Y99 G106	P98-A102 WeakPolarHBondContact O-CB 3.49Å; P98-A102 PolarHBondContact O-N 2.99Å; Y99-A102 PolarHBondContact O-N 2.95Å; A102-G106 PolarHBondContact O-N 3.15Å; A102-G106 VanDerWaalsContact O-N 3.09Å
103	M	89.1	Confident	85.8	Confident	16 Å²	16	58.2 Å²	58.2	8%	0.079	35%	0.35	C	S	.	.	H	α-helix	trans	-64.1	-42.4	177.3	-179.4	-177.7	-78.4	0	0	113.1	Y99 F100 C101 E110 V116 I118	Y99-M103 HydrophobicContact CD1-CE 4.42Å; Y99-M103 HydrophobicContact CE1-CE 3.45Å; Y99-M103 VanDerWaalsContact CE1-CE 3.45Å; Y99-M103 WeakPolarHBondContact O-CB 3.49Å; Y99-M103 PolarHBondContact O-N 3.4Å; Y99-M103 VanDerWaalsContact OH-CE 3.32Å; Y99-M103 WeakPolarHBondContact OH-CE 3.47Å; F100-M103 HydrophobicContact CD1-SD 4.16Å; F100-M103 PolarHBondContact O-N 3.42Å; C101-M103 VanDerWaalsContact C-N 3.32Å; C101-M103 PolarHBondContact O-N 2.95Å; M103-E110 HydrophobicContact CG-CB 4Å; M103-V116 HydrophobicContact CE-CG1 4.28Å; M103-V116 HydrophobicContact SD-CG1 3.77Å; M103-I118 HydrophobicContact CE-CD1 4.13Å
104	F	89.3	Confident	85.4	Confident	24 Å²	24	66.1 Å²	66.1	11%	0.105	39%	0.387	C	S	.	.	H	α-helix	trans	-91.8	-19.3	-174.9	-60	-37.1	0	0	0	114.4	V77 R90 L93 F100 C101	V77-F104 HydrophobicContact CG1-CZ 4.21Å; V77-F104 HydrophobicContact CG2-CE1 4.23Å; V77-F104 HydrophobicContact CG2-CZ 4.16Å; R90-F104 HydrophobicContact CB-CD2 3.92Å; R90-F104 HydrophobicContact CB-CE2 4.21Å; R90-F104 HydrophobicContact CB-CG 4.3Å; R90-F104 HydrophobicContact CG-CD1 4.33Å; R90-F104 HydrophobicContact CG-CD2 4.07Å; R90-F104 HydrophobicContact CG-CE1 4.34Å; R90-F104 HydrophobicContact CG-CE2 4.09Å; R90-F104 HydrophobicContact CG-CG 4.2Å; R90-F104 HydrophobicContact CG-CZ 4.23Å; R90-F104 VanDerWaalsContact NH1-CD1 3.26Å; L93-F104 HydrophobicContact CB-CE2 3.95Å; L93-F104 HydrophobicContact CD1-CE2 3.85Å; L93-F104 HydrophobicContact CD1-CZ 4.14Å; F100-F104 HydrophobicContact CB-CD2 4.17Å; F100-F104 HydrophobicContact CB-CE2 3.89Å; F100-F104 HydrophobicContact CD1-CE2 4.05Å; F100-F104 HydrophobicContact CD1-CZ 4.08Å; F100-F104 HydrophobicContact CG-CE2 4.23Å; F100-F104 WeakPolarHBondContact O-CB 3.4Å; F100-F104 WeakPolarHBondContact O-CD2 3.37Å; F100-F104 WeakPolarHBondContact O-CG 3.39Å; F100-F104 PolarHBondContact O-N 3.26Å; C101-F104 PolarHBondContact O-N 3.41Å
105	T	85.9	Confident	85.3	Confident	111 Å²	111	70.4 Å²	70.4	68%	0.681	40%	0.403	S	S	*	.	H	α-helix	trans	-99.4	-13.5	176.5	62.8	0	0	0	0	114.1	C101	C101-T105 WeakPolarHBondContact O-CB 3.44Å; C101-T105 WeakPolarHBondContact O-CG2 3.42Å; C101-T105 PolarHBondContact O-N 2.91Å; C101-T105 PolarHBondContact O-OG1 3.16Å
106	G	80.5	Confident	85.2	Confident	26 Å²	26	66.8 Å²	66.8	27%	0.268	37%	0.373	S	S	.	.	S	Bend	trans	-83.3	165.7	175.4	0	0	0	0	0	114.2	A102 M108 S111	A102-G106 PolarHBondContact O-N 3.15Å; A102-G106 VanDerWaalsContact O-N 3.09Å; G106-M108 PolarHBondContact O-N 3.45Å; G106-M108 VanDerWaalsContact O-N 3.08Å; G106-S111 WeakPolarHBondContact O-CB 3.41Å; G106-S111 PolarHBondContact O-OG 3.32Å
107	D	73.9	Confident	85.1	Confident	161 Å²	161	69.7 Å²	69.7	86%	0.861	38%	0.381	S	S	*	.	S	Bend	trans	-76	14	-179.2	-76.4	-51.2	0	0	0	115.2
108	M	75.8	Confident	84.9	Confident	97 Å²	97	69.9 Å²	69.9	48%	0.478	38%	0.382	S	S	.	.	S	Bend	trans	-72.9	158.5	-178.3	-61.8	-171.2	-67.9	0	0	112.1	G106 E110 S111	G106-M108 PolarHBondContact O-N 3.45Å; G106-M108 VanDerWaalsContact O-N 3.08Å; M108-E110 PolarHBondContact O-N 3.39Å; M108-S111 VanDerWaalsContact O-CB 3.25Å; M108-S111 WeakPolarHBondContact O-CB 3.42Å; M108-S111 PolarHBondContact O-N 3.19Å; M108-S111 VanDerWaalsContact O-N 3.09Å; M108-S111 PolarHBondContact O-OG 3.22Å
109	S	71.9	Confident	84.3	Confident	93 Å²	93	75.9 Å²	75.9	65%	0.65	40%	0.395	S	S	*	.	G	3₁₀ helix	trans	-54.3	-38.2	178.7	20.8	0	0	0	0	113.5	S111 K112 A113	S109-S111 PolarHBondContact O-N 3.26Å; S109-K112 PolarHBondContact O-N 2.84Å; S109-K112 VanDerWaalsContact O-N 3.08Å; S109-A113 PolarHBondContact O-N 2.9Å
110	E	76.1	Confident	83.9	Confident	74 Å²	74	80.6 Å²	80.6	35%	0.346	42%	0.42	S	S	.	.	G	3₁₀ helix	trans	-62.8	-28.2	-178.9	-66.3	82.9	162.1	0	0	111.6	R90 M103 M108 K112 A113 V116	R90-E110 PolarHBondContact NH2-O 3.09Å; M103-E110 HydrophobicContact CG-CB 4Å; M108-E110 PolarHBondContact O-N 3.39Å; E110-K112 PolarHBondContact O-N 2.94Å; E110-K112 VanDerWaalsContact O-N 3.15Å; E110-A113 PolarHBondContact O-N 3.16Å; E110-V116 HydrophobicContact CB-CG2 4.45Å; E110-V116 HydrophobicContact CG-CG1 4.33Å
111	S	75.1	Confident	83.7	Confident	19 Å²	19	81.2 Å²	81.2	13%	0.133	42%	0.423	C	S	.	.	G	3₁₀ helix	trans	-60.3	-23.6	173.8	73.3	0	0	0	0	113.1	R90 G106 M108 S109	R90-S111 PolarHBondContact NH1-O 3.35Å; R90-S111 PolarHBondContact NH2-O 2.64Å; G106-S111 WeakPolarHBondContact O-CB 3.41Å; G106-S111 PolarHBondContact O-OG 3.32Å; M108-S111 VanDerWaalsContact O-CB 3.25Å; M108-S111 WeakPolarHBondContact O-CB 3.42Å; M108-S111 PolarHBondContact O-N 3.19Å; M108-S111 VanDerWaalsContact O-N 3.09Å; M108-S111 PolarHBondContact O-OG 3.22Å; S109-S111 PolarHBondContact O-N 3.26Å
112	K	77	Confident	83.7	Confident	174 Å²	174	82.8 Å²	82.8	76%	0.757	43%	0.428	S	S	*	.	T	Hydrogen-bonded Turn	trans	-117.7	-5.7	-177.1	-68.8	161.7	-169.4	162.6	0	113.7	S109 E110	S109-K112 PolarHBondContact O-N 2.84Å; S109-K112 VanDerWaalsContact O-N 3.08Å; E110-K112 PolarHBondContact O-N 2.94Å; E110-K112 VanDerWaalsContact O-N 3.15Å
113	A	84.4	Confident	83.8	Confident	33 Å²	33	80.1 Å²	80.1	27%	0.273	41%	0.407	S	S	.	.			trans	-77.6	137.8	179.2	0	0	0	0	0	112	R90 S109 E110 Q115 V116	R90-A113 PolarHBondContact NH2-O 2.83Å; S109-A113 PolarHBondContact O-N 2.9Å; E110-A113 PolarHBondContact O-N 3.16Å; A113-Q115 VanDerWaalsContact C-N 3.33Å; A113-Q115 WeakPolarHBondContact CB-O 3.29Å; A113-V116 HydrophobicContact CB-CG2 4.35Å
114	Q	83.8	Confident	84	Confident	167 Å²	167	84.2 Å²	84.2	78%	0.78	43%	0.426	S	S	*	.	S	Bend	trans	-73.8	-27.3	170	-76.8	-168.2	-27.1	0	0	112.4	Q78	Q78-Q114 PolarHBondContact N-O 2.97Å
115	Q	90.1	Very high	84.2	Confident	111 Å²	111	83.5 Å²	83.5	52%	0.519	42%	0.424	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	129.8	-179.6	-163.3	176.9	35.6	0	0	109.1	Q78 V80 A113	Q78-Q115 WeakPolarHBondContact O-CA 3.45Å; V80-Q115 HydrophobicContact CG2-CG 3.45Å; V80-Q115 VanDerWaalsContact CG2-CG 3.45Å; A113-Q115 VanDerWaalsContact C-N 3.33Å; A113-Q115 WeakPolarHBondContact CB-O 3.29Å
116	V	90.4	Very high	84.6	Confident	4 Å²	4	78.2 Å²	78.2	2%	0.024	39%	0.391	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	122.9	-177.5	178.5	0	0	0	0	109.6	V77 Q78 L79 V80 M103 E110 A113 I118	V77-V116 HydrophobicContact CG2-CB 4.46Å; V77-V116 HydrophobicContact CG2-CG2 3.94Å; Q78-V116 PolarHBondContact O-N 3.41Å; L79-V116 CarbonylContact C-O 3.5Å; L79-V116 WeakPolarHBondContact CA-O 3.32Å; L79-V116 HydrophobicContact CD2-CB 4.1Å; L79-V116 HydrophobicContact CD2-CG1 4.46Å; V80-V116 PolarHBondContact N-O 3.15Å; M103-V116 HydrophobicContact CE-CG1 4.28Å; M103-V116 HydrophobicContact SD-CG1 3.77Å; E110-V116 HydrophobicContact CB-CG2 4.45Å; E110-V116 HydrophobicContact CG-CG1 4.33Å; A113-V116 HydrophobicContact CB-CG2 4.35Å; V116-I118 HydrophobicContact CG1-CD1 4.21Å
117	E	90.3	Very high	85.3	Confident	110 Å²	110	81.6 Å²	81.6	51%	0.514	40%	0.396	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.8	124.7	-177.6	-168.6	-168.7	176.6	0	0	111.2	V80 R119	V80-E117 CarbonylContact O-C 3.57Å; V80-E117 WeakPolarHBondContact O-CA 3.34Å; E117-R119 HydrophobicContact CG-CG 3.95Å; E117-R119 IonicContact OE1-NE 3.22Å; E117-R119 PolarHBondContact OE1-NE 3.17Å; E117-R119 IonicContact OE2-CZ 3.21Å; E117-R119 IonicContact OE2-NE 2.87Å; E117-R119 PolarHBondContact OE2-NE 3.36Å; E117-R119 IonicContact OE2-NH2 2.7Å; E117-R119 PolarHBondContact OE2-NH2 2.8Å
118	I	90.3	Very high	86.2	Confident	5 Å²	5	77.5 Å²	77.5	3%	0.026	37%	0.37	C	S	.	.			trans	-106.3	101.3	175.3	-52.4	-59.4	0	0	0	108.2	V80 Y99 F100 M103 V116 V121 L126	V80-I118 PolarHBondContact O-N 3.35Å; Y99-I118 HydrophobicContact CE1-CD1 4.39Å; F100-I118 HydrophobicContact CE1-CD1 4.45Å; M103-I118 HydrophobicContact CE-CD1 4.13Å; V116-I118 HydrophobicContact CG1-CD1 4.21Å; I118-V121 HydrophobicContact CG2-CB 3.92Å; I118-V121 HydrophobicContact CG2-CG2 3.69Å; I118-L126 HydrophobicContact CB-CD2 4.31Å; I118-L126 HydrophobicContact CG1-CD2 4.22Å
119	R	81.9	Confident	87.2	Confident	202 Å²	202	72.9 Å²	72.9	76%	0.762	35%	0.348	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.2	-16.5	-167.3	-68.4	-176	175.5	157.4	7.6	116	E117	E117-R119 HydrophobicContact CG-CG 3.95Å; E117-R119 IonicContact OE1-NE 3.22Å; E117-R119 PolarHBondContact OE1-NE 3.17Å; E117-R119 IonicContact OE2-CZ 3.21Å; E117-R119 IonicContact OE2-NE 2.87Å; E117-R119 PolarHBondContact OE2-NE 3.36Å; E117-R119 IonicContact OE2-NH2 2.7Å; E117-R119 PolarHBondContact OE2-NH2 2.8Å
120	E	83.8	Confident	88.2	Confident	159 Å²	159	68.4 Å²	68.4	74%	0.743	32%	0.317	S	S	*	.	T	Hydrogen-bonded Turn	trans	-107.6	10.3	-173.1	-63.9	-176.5	174	0	0	113.5	L154	E120-L154 HydrophobicContact CB-CD2 3.89Å
121	V	89.6	Confident	89.1	Confident	12 Å²	12	67.3 Å²	67.3	7%	0.073	31%	0.313	C	S	.	.	S	Bend	trans	-128.6	136	-176.2	-176.1	0	0	0	0	110.2	A81 I118 T125 L126 A151 L154	A81-V121 WeakPolarHBondContact CB-O 3.5Å; I118-V121 HydrophobicContact CG2-CB 3.92Å; I118-V121 HydrophobicContact CG2-CG2 3.69Å; V121-T125 HydrophobicContact CG1-CG2 4.28Å; V121-L126 HydrophobicContact CG1-CB 3.86Å; V121-A151 HydrophobicContact CB-CB 4.38Å; V121-A151 HydrophobicContact CG1-CB 3.61Å; V121-A151 HydrophobicContact CG2-CB 3.93Å; V121-L154 HydrophobicContact CG2-CD2 3.73Å
122	D	90.6	Very high	90.1	Very high	80 Å²	80	68.3 Å²	68.3	43%	0.428	31%	0.314	S	S	.	.			trans	-64	143.6	170.5	154.7	66.6	0	0	0	111.5	Q124 T125 L126	D122-Q124 PolarHBondContact O-N 3.45Å; D122-Q124 PolarHBondContact OD1-N 2.8Å; D122-Q124 WeakPolarHBondContact OD2-CA 3.24Å; D122-Q124 WeakPolarHBondContact OD2-CB 3.41Å; D122-Q124 PolarHBondContact OD2-N 3.39Å; D122-T125 WeakPolarHBondContact O-CB 3.44Å; D122-T125 PolarHBondContact O-N 2.81Å; D122-T125 WeakPolarHBondContact OD2-CB 3.49Å; D122-T125 PolarHBondContact OD2-N 2.89Å; D122-T125 PolarHBondContact OD2-OG1 2.74Å; D122-L126 PolarHBondContact O-N 3.13Å
123	G	90.9	Very high	90.9	Very high	5 Å²	5	60.4 Å²	60.4	5%	0.052	28%	0.28	C	S	.	.	H	α-helix	trans	-61.7	-36.2	-176.7	0	0	0	0	0	115.3	V84 R127	V84-G123 WeakPolarHBondContact CG1-O 3.49Å; G123-R127 WeakPolarHBondContact O-CB 3.45Å; G123-R127 PolarHBondContact O-N 3.11Å; G123-R127 VanDerWaalsContact O-N 3.11Å
124	Q	92.4	Very high	91.3	Very high	102 Å²	102	59 Å²	59	48%	0.477	27%	0.268	S	S	.	.	H	α-helix	trans	-75	-35.8	176.5	-57.9	-59.9	-21.5	0	0	111.4	D122 R127 K128	D122-Q124 PolarHBondContact O-N 3.45Å; D122-Q124 PolarHBondContact OD1-N 2.8Å; D122-Q124 WeakPolarHBondContact OD2-CA 3.24Å; D122-Q124 WeakPolarHBondContact OD2-CB 3.41Å; D122-Q124 PolarHBondContact OD2-N 3.39Å; Q124-R127 WeakPolarHBondContact O-CB 3.47Å; Q124-R127 PolarHBondContact O-N 3.25Å; Q124-K128 PolarHBondContact O-N 2.9Å
125	T	93.8	Very high	91.7	Very high	9 Å²	9	53.8 Å²	53.8	6%	0.055	25%	0.247	C	C	.	.	H	α-helix	trans	-65.2	-45.6	175.4	-54.9	0	0	0	0	110.9	V121 D122 R127 K128 L129 V147 L148 A151	V121-T125 HydrophobicContact CG1-CG2 4.28Å; D122-T125 WeakPolarHBondContact O-CB 3.44Å; D122-T125 PolarHBondContact O-N 2.81Å; D122-T125 WeakPolarHBondContact OD2-CB 3.49Å; D122-T125 PolarHBondContact OD2-N 2.89Å; D122-T125 PolarHBondContact OD2-OG1 2.74Å; T125-R127 VanDerWaalsContact C-N 3.31Å; T125-R127 PolarHBondContact O-N 3.03Å; T125-K128 PolarHBondContact O-N 2.79Å; T125-L129 HydrophobicContact CG2-CD1 4.33Å; T125-L129 WeakPolarHBondContact O-CG 3.45Å; T125-L129 PolarHBondContact O-N 2.7Å; T125-V147 WeakPolarHBondContact OG1-CG2 3.48Å; T125-L148 HydrophobicContact CG2-CB 4.48Å; T125-L148 HydrophobicContact CG2-CD1 3.97Å; T125-A151 HydrophobicContact CG2-CB 3.65Å
126	L	94.8	Very high	91.8	Very high	0 Å²	0	52.2 Å²	52.2	0%	0	25%	0.253	C	S	.	.	H	α-helix	trans	-58.7	-44	173	-178.6	62.1	0	0	0	111	L79 A81 I118 V121 D122 L129 V130 L155	L79-L126 HydrophobicContact CB-CD2 4.06Å; L79-L126 HydrophobicContact CD1-CD1 4.35Å; A81-L126 HydrophobicContact CB-CB 4.26Å; A81-L126 HydrophobicContact CB-CD2 3.58Å; I118-L126 HydrophobicContact CB-CD2 4.31Å; I118-L126 HydrophobicContact CG1-CD2 4.22Å; V121-L126 HydrophobicContact CG1-CB 3.86Å; D122-L126 PolarHBondContact O-N 3.13Å; L126-L129 PolarHBondContact O-N 3.42Å; L126-V130 HydrophobicContact CD1-CG2 4.33Å; L126-V130 WeakPolarHBondContact O-CG2 3.41Å; L126-V130 PolarHBondContact O-N 2.87Å; L126-L155 HydrophobicContact CD1-CD1 3.83Å
127	R	93.8	Very high	91.8	Very high	96 Å²	96	59.4 Å²	59.4	36%	0.362	29%	0.287	S	S	.	.	H	α-helix	trans	-59.2	-49.4	174.8	178.6	176.2	-69.1	165.8	-6.2	111.8	V86 G123 Q124 T125 L129 V130 D131	V86-R127 HydrophobicContact CG2-CB 4.14Å; G123-R127 WeakPolarHBondContact O-CB 3.45Å; G123-R127 PolarHBondContact O-N 3.11Å; G123-R127 VanDerWaalsContact O-N 3.11Å; Q124-R127 WeakPolarHBondContact O-CB 3.47Å; Q124-R127 PolarHBondContact O-N 3.25Å; T125-R127 VanDerWaalsContact C-N 3.31Å; T125-R127 PolarHBondContact O-N 3.03Å; R127-L129 VanDerWaalsContact C-N 3.33Å; R127-L129 PolarHBondContact O-N 2.7Å; R127-V130 PolarHBondContact O-N 3.22Å; R127-D131 WeakPolarHBondContact CG-OD2 3.39Å; R127-D131 WeakPolarHBondContact O-CB 3.4Å; R127-D131 PolarHBondContact O-N 2.88Å
128	K	94.2	Very high	92	Very high	75 Å²	75	56.3 Å²	56.3	33%	0.326	27%	0.273	S	S	.	.	H	α-helix	trans	-57.3	-42.4	176.5	-77.7	-172.1	170.3	-162.1	0	112.6	Q124 T125 D131 Y132 N144	Q124-K128 PolarHBondContact O-N 2.9Å; T125-K128 PolarHBondContact O-N 2.79Å; K128-D131 PolarHBondContact O-N 3.28Å; K128-Y132 WeakPolarHBondContact O-CB 3.42Å; K128-Y132 PolarHBondContact O-N 3.28Å; K128-N144 PolarHBondContact NZ-ND2 3.03Å; K128-N144 VanDerWaalsContact NZ-ND2 3.16Å
129	L	95.5	Very high	92.2	Very high	0 Å²	0	62.5 Å²	62.5	0%	0	30%	0.302	C	S	.	.	H	α-helix	trans	-69.2	-37.4	178.4	-69	175	0	0	0	112.5	T125 L126 R127 I133 I138 L148 A151 A152 L155 L157 V160	T125-L129 HydrophobicContact CG2-CD1 4.33Å; T125-L129 WeakPolarHBondContact O-CG 3.45Å; T125-L129 PolarHBondContact O-N 2.7Å; L126-L129 PolarHBondContact O-N 3.42Å; R127-L129 VanDerWaalsContact C-N 3.33Å; R127-L129 PolarHBondContact O-N 2.7Å; L129-I133 WeakPolarHBondContact O-CG1 3.45Å; L129-I133 PolarHBondContact O-N 2.95Å; L129-I133 VanDerWaalsContact O-N 3.15Å; L129-I138 HydrophobicContact CD2-CD1 3.99Å; L129-L148 HydrophobicContact CD1-CD1 4.37Å; L129-L148 HydrophobicContact CD2-CD1 3.54Å; L129-L148 HydrophobicContact CG-CD1 3.86Å; L129-A151 HydrophobicContact CD1-CB 3.58Å; L129-A152 HydrophobicContact CD2-CB 4.19Å; L129-L155 HydrophobicContact CB-CD1 4.36Å; L129-L155 HydrophobicContact CD1-CD1 3.91Å; L129-L157 HydrophobicContact CB-CD1 3.98Å; L129-L157 HydrophobicContact CD2-CD1 3.86Å; L129-L157 HydrophobicContact CG-CD1 4.34Å; L129-V160 HydrophobicContact CD2-CB 4.44Å; L129-V160 HydrophobicContact CD2-CG1 3.88Å; L129-V160 HydrophobicContact CD2-CG2 4.3Å
130	V	94.5	Very high	92.7	Very high	0 Å²	0	54 Å²	54	0%	0	27%	0.272	C	S	.	.	H	α-helix	trans	-69	-40.4	171.8	175.7	0	0	0	0	110.9	L79 V86 A88 L93 L126 R127 Y132 I133 Y134	L79-V130 HydrophobicContact CD1-CG2 3.96Å; V86-V130 HydrophobicContact CG1-CB 3.98Å; V86-V130 HydrophobicContact CG1-CG1 3.79Å; V86-V130 HydrophobicContact CG1-CG2 4.12Å; A88-V130 HydrophobicContact CB-CG1 4.46Å; L93-V130 HydrophobicContact CD2-CG1 4.44Å; L93-V130 HydrophobicContact CD2-CG2 4.31Å; L126-V130 HydrophobicContact CD1-CG2 4.33Å; L126-V130 WeakPolarHBondContact O-CG2 3.41Å; L126-V130 PolarHBondContact O-N 2.87Å; R127-V130 PolarHBondContact O-N 3.22Å; V130-Y132 VanDerWaalsContact C-N 3.33Å; V130-Y132 PolarHBondContact O-N 3.37Å; V130-I133 WeakPolarHBondContact O-CB 3.49Å; V130-I133 PolarHBondContact O-N 2.83Å; V130-I133 VanDerWaalsContact O-N 3.17Å; V130-Y134 HydrophobicContact CG1-CD2 4.29Å; V130-Y134 HydrophobicContact CG1-CE2 4.16Å; V130-Y134 VanDerWaalsContact O-CD2 3.32Å; V130-Y134 WeakPolarHBondContact O-CD2 3.43Å; V130-Y134 PolarHBondContact O-N 2.93Å
131	D	94.2	Very high	93.2	Very high	50 Å²	50	48.3 Å²	48.3	27%	0.267	25%	0.249	S	C	.	.	H	α-helix	trans	-59.9	-45.8	176.1	-68	-24.8	0	0	0	110.4	R69 R127 K128 I133 Y134 T135	R69-D131 IonicContact CZ-OD1 3.16Å; R69-D131 IonicContact NH1-OD1 2.74Å; R69-D131 PolarHBondContact NH1-OD1 2.92Å; R69-D131 IonicContact NH2-OD1 2.7Å; R69-D131 PolarHBondContact NH2-OD1 3.22Å; R127-D131 WeakPolarHBondContact CG-OD2 3.39Å; R127-D131 WeakPolarHBondContact O-CB 3.4Å; R127-D131 PolarHBondContact O-N 2.88Å; K128-D131 PolarHBondContact O-N 3.28Å; D131-I133 VanDerWaalsContact C-N 3.33Å; D131-I133 PolarHBondContact O-N 2.99Å; D131-Y134 PolarHBondContact O-N 3.38Å; D131-T135 PolarHBondContact O-N 3.38Å; D131-T135 PolarHBondContact O-OG1 3.08Å
132	Y	95.1	Very high	93.1	Very high	40 Å²	40	54.3 Å²	54.3	16%	0.157	28%	0.276	C	S	.	.	H	α-helix	trans	-54.7	-41.7	172.5	168.4	-98.4	0	0	0	113.4	K128 V130 Y134 T135 A136 I138 D159 V160	K128-Y132 WeakPolarHBondContact O-CB 3.42Å; K128-Y132 PolarHBondContact O-N 3.28Å; V130-Y132 VanDerWaalsContact C-N 3.33Å; V130-Y132 PolarHBondContact O-N 3.37Å; Y132-Y134 PolarHBondContact O-N 2.78Å; Y132-Y134 VanDerWaalsContact O-N 3.16Å; Y132-T135 PolarHBondContact O-N 2.84Å; Y132-A136 VanDerWaalsContact O-CA 3.29Å; Y132-A136 WeakPolarHBondContact O-CA 3.48Å; Y132-A136 PolarHBondContact O-N 3.03Å; Y132-I138 HydrophobicContact CD2-CB 3.8Å; Y132-I138 HydrophobicContact CD2-CG2 4.08Å; Y132-I138 HydrophobicContact CE2-CG2 4.41Å; Y132-I138 HydrophobicContact CG-CB 4.3Å; Y132-I138 HydrophobicContact CG-CD1 4.39Å; Y132-D159 WeakPolarHBondContact OH-CB 3.43Å; Y132-V160 HydrophobicContact CD1-CG2 3.54Å; Y132-V160 HydrophobicContact CD2-CG2 4.19Å; Y132-V160 HydrophobicContact CE1-CG2 3.42Å; Y132-V160 VanDerWaalsContact CE1-CG2 3.42Å; Y132-V160 HydrophobicContact CE2-CG2 4.08Å; Y132-V160 HydrophobicContact CG-CG2 3.93Å
133	I	94.5	Very high	93	Very high	8 Å²	8	57.9 Å²	57.9	4%	0.041	30%	0.295	C	S	.	.	H	α-helix	trans	-58.7	-27.8	176.1	-74.3	167.8	0	0	0	112.2	V92 L93 C96 F100 L129 V130 D131 L157	V92-I133 HydrophobicContact CG1-CG2 3.87Å; L93-I133 HydrophobicContact CD2-CD1 3.77Å; L93-I133 HydrophobicContact CD2-CG2 4.34Å; C96-I133 HydrophobicContact CB-CB 4.44Å; C96-I133 HydrophobicContact CB-CG1 4.11Å; C96-I133 HydrophobicContact CB-CG2 3.82Å; F100-I133 HydrophobicContact CD2-CD1 4.5Å; F100-I133 HydrophobicContact CE2-CD1 4.36Å; L129-I133 WeakPolarHBondContact O-CG1 3.45Å; L129-I133 PolarHBondContact O-N 2.95Å; L129-I133 VanDerWaalsContact O-N 3.15Å; V130-I133 WeakPolarHBondContact O-CB 3.49Å; V130-I133 PolarHBondContact O-N 2.83Å; V130-I133 VanDerWaalsContact O-N 3.17Å; D131-I133 VanDerWaalsContact C-N 3.33Å; D131-I133 PolarHBondContact O-N 2.99Å; I133-L157 HydrophobicContact CD1-CD1 4.32Å; I133-L157 HydrophobicContact CD1-CD2 4.21Å; I133-L157 HydrophobicContact CG1-CD1 4.48Å; I133-L157 HydrophobicContact CG1-CD2 4.09Å
134	Y	93.4	Very high	93.1	Very high	5 Å²	5	58.3 Å²	58.3	2%	0.02	30%	0.296	C	S	.	.	H	α-helix	trans	-98.2	-28	179.4	-76.7	-98.6	0	0	0	114.2	M65 N66 R69 H89 V92 V130 D131 Y132	M65-Y134 HydrophobicContact CB-CD1 4.25Å; M65-Y134 HydrophobicContact CB-CE1 4.11Å; N66-Y134 HydrophobicContact CB-CD1 4.11Å; N66-Y134 HydrophobicContact CB-CG 4.46Å; R69-Y134 HydrophobicContact CB-CE1 4.26Å; H89-Y134 WeakPolarHBondContact CB-OH 3.45Å; H89-Y134 PolarHBondContact N-OH 3.23Å; H89-Y134 AromaticContact ND1-CE1 3.86Å; H89-Y134 AromaticContact ND1-CZ 3.78Å; H89-Y134 PolarHBondContact ND1-OH 2.92Å; V92-Y134 HydrophobicContact CB-CE1 4.21Å; V92-Y134 HydrophobicContact CB-CE2 4.42Å; V92-Y134 HydrophobicContact CG1-CD1 4.29Å; V92-Y134 HydrophobicContact CG1-CD2 4.41Å; V92-Y134 HydrophobicContact CG1-CE1 3.86Å; V92-Y134 HydrophobicContact CG1-CE2 4Å; V92-Y134 HydrophobicContact CG2-CE1 4.15Å; V130-Y134 HydrophobicContact CG1-CD2 4.29Å; V130-Y134 HydrophobicContact CG1-CE2 4.16Å; V130-Y134 VanDerWaalsContact O-CD2 3.32Å; V130-Y134 WeakPolarHBondContact O-CD2 3.43Å; V130-Y134 PolarHBondContact O-N 2.93Å; D131-Y134 PolarHBondContact O-N 3.38Å; Y132-Y134 PolarHBondContact O-N 2.78Å; Y132-Y134 VanDerWaalsContact O-N 3.16Å
135	T	92.2	Very high	93.1	Very high	56 Å²	56	53.7 Å²	53.7	34%	0.344	28%	0.275	S	S	.	.	H	α-helix	trans	-102.4	-24.6	-176.1	61.1	0	0	0	0	114.2	D131 Y132 E137	D131-T135 PolarHBondContact O-N 3.38Å; D131-T135 PolarHBondContact O-OG1 3.08Å; Y132-T135 PolarHBondContact O-N 2.84Å; T135-E137 PolarHBondContact O-N 3.35Å; T135-E137 PolarHBondContact OG1-N 2.89Å; T135-E137 PolarHBondContact OG1-O 3.32Å
136	A	90.8	Very high	92.9	Very high	79 Å²	79	59.9 Å²	59.9	65%	0.653	30%	0.303	S	S	*	.	S	Bend	trans	58.5	19.2	-162.3	0	0	0	0	0	114.7	Y132	Y132-A136 VanDerWaalsContact O-CA 3.29Å; Y132-A136 WeakPolarHBondContact O-CA 3.48Å; Y132-A136 PolarHBondContact O-N 3.03Å
137	E	92.1	Very high	92.8	Very high	154 Å²	154	63.3 Å²	63.3	72%	0.72	32%	0.324	S	S	*	.			trans	-116.3	132.7	179.5	-67.3	176.9	177.3	0	0	110.1	T135	T135-E137 PolarHBondContact O-N 3.35Å; T135-E137 PolarHBondContact OG1-N 2.89Å; T135-E137 PolarHBondContact OG1-O 3.32Å
138	I	94.4	Very high	92.8	Very high	46 Å²	46	58.9 Å²	58.9	24%	0.236	31%	0.307	C	S	.	.			trans	-144.9	141.8	174.4	-159.1	162.7	0	0	0	111.8	L129 Y132 L148 V160	L129-I138 HydrophobicContact CD2-CD1 3.99Å; Y132-I138 HydrophobicContact CD2-CB 3.8Å; Y132-I138 HydrophobicContact CD2-CG2 4.08Å; Y132-I138 HydrophobicContact CE2-CG2 4.41Å; Y132-I138 HydrophobicContact CG-CB 4.3Å; Y132-I138 HydrophobicContact CG-CD1 4.39Å; I138-L148 HydrophobicContact CD1-CD1 3.98Å; I138-L148 HydrophobicContact CD1-CD2 4.03Å; I138-L148 HydrophobicContact CG1-CD2 4.41Å; I138-V160 HydrophobicContact CD1-CG1 3.73Å; I138-V160 HydrophobicContact CD1-CG2 3.99Å; I138-V160 HydrophobicContact CG2-CG2 4.42Å
139	E	92.8	Very high	92.8	Very high	135 Å²	135	55.3 Å²	55.3	63%	0.631	29%	0.292	S	S	*	.			trans	-109.3	113.3	-179.8	-174.9	-172.1	-156.9	0	0	109.9	T141 N144	E139-T141 HydrophobicContact CG-CG2 4.02Å; E139-N144 PolarHBondContact O-ND2 3.34Å
140	V	93.9	Very high	92.6	Very high	23 Å²	23	57 Å²	57	14%	0.139	30%	0.303	C	S	.	.			trans	-96.5	128.6	175.6	-173.9	0	0	0	0	109.2	V145 L148 V163 F167	V140-V145 HydrophobicContact CG1-CB 3.9Å; V140-V145 HydrophobicContact CG1-CG2 3.86Å; V140-L148 HydrophobicContact CG2-CD2 4Å; V140-V163 HydrophobicContact CG2-CG1 3.86Å; V140-F167 HydrophobicContact CB-CG 4.46Å; V140-F167 HydrophobicContact CG1-CB 3.9Å; V140-F167 HydrophobicContact CG1-CD1 3.84Å; V140-F167 HydrophobicContact CG1-CD2 4.32Å; V140-F167 HydrophobicContact CG1-CE1 4.49Å; V140-F167 HydrophobicContact CG1-CG 3.74Å
141	T	92.9	Very high	92.5	Very high	40 Å²	40	57.1 Å²	57.1	25%	0.245	30%	0.304	C	S	.	.			trans	-136.7	162.1	-179.6	68.2	0	0	0	0	110.3	E139 D143 N144 V145	E139-T141 HydrophobicContact CG-CG2 4.02Å; T141-D143 VanDerWaalsContact C-N 3.26Å; T141-D143 PolarHBondContact O-N 3.31Å; T141-N144 PolarHBondContact N-ND2 3.25Å; T141-N144 PolarHBondContact N-OD1 2.78Å; T141-N144 VanDerWaalsContact N-OD1 3.15Å; T141-N144 PolarHBondContact O-N 3.11Å; T141-N144 PolarHBondContact O-OD1 2.9Å; T141-N144 VanDerWaalsContact OG1-CG 3.31Å; T141-N144 PolarHBondContact OG1-ND2 3.44Å; T141-V145 PolarHBondContact O-N 3.06Å
142	E	88.2	Confident	92.5	Very high	138 Å²	138	54.8 Å²	54.8	65%	0.645	29%	0.291	S	S	*	.	H	α-helix	trans	-53.3	-43.3	178	-63	178.4	-160.5	0	0	112.2	N144 F167	E142-N144 VanDerWaalsContact C-N 3.29Å; E142-N144 PolarHBondContact O-N 3.07Å; E142-F167 HydrophobicContact CG-CE1 4.31Å; E142-F167 HydrophobicContact CG-CZ 3.94Å
143	D	89.2	Confident	92.3	Very high	154 Å²	154	54.5 Å²	54.5	82%	0.824	30%	0.296	S	S	*	.	H	α-helix	trans	-66.6	-25.6	178.7	-51.6	-70.7	0	0	0	114.1	T141	T141-D143 VanDerWaalsContact C-N 3.26Å; T141-D143 PolarHBondContact O-N 3.31Å
144	N	92.6	Very high	92.2	Very high	14 Å²	14	56.7 Å²	56.7	8%	0.075	31%	0.307	C	S	.	.	H	α-helix	trans	-108.6	-24.5	-169.1	83.3	39.7	0	0	0	114.3	K128 E139 T141 E142 Q146 V147 L148	K128-N144 PolarHBondContact NZ-ND2 3.03Å; K128-N144 VanDerWaalsContact NZ-ND2 3.16Å; E139-N144 PolarHBondContact O-ND2 3.34Å; T141-N144 PolarHBondContact N-ND2 3.25Å; T141-N144 PolarHBondContact N-OD1 2.78Å; T141-N144 VanDerWaalsContact N-OD1 3.15Å; T141-N144 PolarHBondContact O-N 3.11Å; T141-N144 PolarHBondContact O-OD1 2.9Å; T141-N144 VanDerWaalsContact OG1-CG 3.31Å; T141-N144 PolarHBondContact OG1-ND2 3.44Å; E142-N144 VanDerWaalsContact C-N 3.29Å; E142-N144 PolarHBondContact O-N 3.07Å; N144-Q146 VanDerWaalsContact C-N 3.26Å; N144-Q146 PolarHBondContact O-N 3.12Å; N144-V147 VanDerWaalsContact O-CG2 3.23Å; N144-V147 WeakPolarHBondContact O-CG2 3.48Å; N144-V147 PolarHBondContact O-N 3.27Å; N144-V147 VanDerWaalsContact O-N 3.15Å; N144-L148 WeakPolarHBondContact O-CB 3.46Å; N144-L148 PolarHBondContact O-N 3.28Å
145	V	92.2	Very high	92.2	Very high	5 Å²	5	56.4 Å²	56.4	3%	0.03	31%	0.306	C	S	.	.	H	α-helix	trans	-61.3	-33.1	-172.2	68.4	0	0	0	0	113.2	V140 T141 V147 L148 L149 C164 F167 L168	V140-V145 HydrophobicContact CG1-CB 3.9Å; V140-V145 HydrophobicContact CG1-CG2 3.86Å; T141-V145 PolarHBondContact O-N 3.06Å; V145-V147 PolarHBondContact O-N 3.35Å; V145-L148 PolarHBondContact O-N 3.36Å; V145-L149 WeakPolarHBondContact O-CB 3.42Å; V145-L149 PolarHBondContact O-N 2.98Å; V145-C164 HydrophobicContact CG2-CB 3.96Å; V145-F167 HydrophobicContact CB-CD1 4.24Å; V145-F167 HydrophobicContact CB-CE1 4.45Å; V145-F167 HydrophobicContact CG1-CD1 4.32Å; V145-F167 HydrophobicContact CG1-CE1 4.22Å; V145-F167 HydrophobicContact CG2-CD1 4.15Å; V145-L168 HydrophobicContact CG1-CD2 3.86Å; V145-L168 HydrophobicContact CG2-CD1 4.06Å; V145-L168 HydrophobicContact CG2-CD2 4.1Å; V145-L168 HydrophobicContact CG2-CG 3.85Å
146	Q	89.9	Confident	92.3	Very high	139 Å²	139	57.9 Å²	57.9	65%	0.65	31%	0.309	S	S	*	.	H	α-helix	trans	-66.3	-33.7	179.5	-65.9	-172.4	-0.5	0	0	113.5	N144 P150	N144-Q146 VanDerWaalsContact C-N 3.26Å; N144-Q146 PolarHBondContact O-N 3.12Å; Q146-P150 WeakPolarHBondContact O-CD 3.39Å; Q146-P150 VanDerWaalsContact O-CG 3.27Å; Q146-P150 WeakPolarHBondContact O-CG 3.46Å
147	V	92.6	Very high	92.4	Very high	73 Å²	73	54.4 Å²	54.4	44%	0.442	28%	0.279	S	S	.	.	H	α-helix	trans	-93.2	-28.2	176.2	-66.2	0	0	0	0	112.2	T125 N144 V145 A151	T125-V147 WeakPolarHBondContact OG1-CG2 3.48Å; N144-V147 VanDerWaalsContact O-CG2 3.23Å; N144-V147 WeakPolarHBondContact O-CG2 3.48Å; N144-V147 PolarHBondContact O-N 3.27Å; N144-V147 VanDerWaalsContact O-N 3.15Å; V145-V147 PolarHBondContact O-N 3.35Å; V147-A151 WeakPolarHBondContact O-CB 3.47Å; V147-A151 PolarHBondContact O-N 3.47Å
148	L	94.3	Very high	92.4	Very high	2 Å²	2	51.6 Å²	51.6	1%	0.01	27%	0.267	C	S	.	.	H	α-helix	trans	-74.7	-45	-176.7	-174.3	63.1	0	0	0	113	T125 L129 I138 V140 N144 V145 A151 A152 V160	T125-L148 HydrophobicContact CG2-CB 4.48Å; T125-L148 HydrophobicContact CG2-CD1 3.97Å; L129-L148 HydrophobicContact CD1-CD1 4.37Å; L129-L148 HydrophobicContact CD2-CD1 3.54Å; L129-L148 HydrophobicContact CG-CD1 3.86Å; I138-L148 HydrophobicContact CD1-CD1 3.98Å; I138-L148 HydrophobicContact CD1-CD2 4.03Å; I138-L148 HydrophobicContact CG1-CD2 4.41Å; V140-L148 HydrophobicContact CG2-CD2 4Å; N144-L148 WeakPolarHBondContact O-CB 3.46Å; N144-L148 PolarHBondContact O-N 3.28Å; V145-L148 PolarHBondContact O-N 3.36Å; L148-A151 PolarHBondContact O-N 3Å; L148-A152 VanDerWaalsContact O-CB 3.28Å; L148-A152 WeakPolarHBondContact O-CB 3.41Å; L148-A152 PolarHBondContact O-N 3.42Å; L148-V160 HydrophobicContact CD1-CG1 4.37Å; L148-V160 HydrophobicContact CD2-CG1 4.36Å; L148-V160 HydrophobicContact CG-CG1 4.18Å
149	L	92.9	Very high	92.3	Very high	1 Å²	1	54.8 Å²	54.8	1%	0.005	29%	0.285	C	S	.	.	H	α-helix	trans	-61.9	-45.1	-178.7	-178.2	152.3	0	0	0	112.9	V145 A152 S153 C164 L168 F183 H187	V145-L149 WeakPolarHBondContact O-CB 3.42Å; V145-L149 PolarHBondContact O-N 2.98Å; L149-A152 PolarHBondContact O-N 3.25Å; L149-S153 WeakPolarHBondContact O-CB 3.28Å; L149-S153 PolarHBondContact O-N 2.85Å; L149-C164 HydrophobicContact CB-CB 3.91Å; L149-C164 HydrophobicContact CD1-CB 3.82Å; L149-C164 HydrophobicContact CG-CB 4.2Å; L149-L168 HydrophobicContact CD1-CD1 4.11Å; L149-F183 HydrophobicContact CB-CE1 4.19Å; L149-F183 HydrophobicContact CB-CZ 4.3Å; L149-F183 HydrophobicContact CD1-CE1 4.14Å; L149-F183 HydrophobicContact CD2-CE1 3.95Å; L149-F183 HydrophobicContact CD2-CZ 4.24Å; L149-F183 HydrophobicContact CG-CE1 4.32Å; L149-H187 HydrophobicContact CD2-CB 3.58Å
150	P	91.8	Very high	92.4	Very high	35 Å²	35	48.4 Å²	48.4	23%	0.227	26%	0.255	C	S	.	.	H	α-helix	trans	-64.9	-42.3	177.5	-22.1	35.1	0	0	0	111.9	Q146 S153 L154 F183	Q146-P150 WeakPolarHBondContact O-CD 3.39Å; Q146-P150 VanDerWaalsContact O-CG 3.27Å; Q146-P150 WeakPolarHBondContact O-CG 3.46Å; P150-S153 WeakPolarHBondContact O-CB 3.37Å; P150-S153 PolarHBondContact O-N 3.39Å; P150-L154 WeakPolarHBondContact O-CB 3.41Å; P150-L154 PolarHBondContact O-N 3.32Å; P150-F183 HydrophobicContact CG-CE2 4.3Å; P150-F183 HydrophobicContact CG-CZ 4.08Å
151	A	93.3	Very high	92.4	Very high	3 Å²	3	49.9 Å²	49.9	3%	0.025	26%	0.258	C	S	.	.	H	α-helix	trans	-65	-41.2	178	0	0	0	0	0	112.6	V121 T125 L129 V147 L148 S153 L154 L155	V121-A151 HydrophobicContact CB-CB 4.38Å; V121-A151 HydrophobicContact CG1-CB 3.61Å; V121-A151 HydrophobicContact CG2-CB 3.93Å; T125-A151 HydrophobicContact CG2-CB 3.65Å; L129-A151 HydrophobicContact CD1-CB 3.58Å; V147-A151 WeakPolarHBondContact O-CB 3.47Å; V147-A151 PolarHBondContact O-N 3.47Å; L148-A151 PolarHBondContact O-N 3Å; A151-S153 VanDerWaalsContact C-N 3.34Å; A151-L154 PolarHBondContact O-N 3.02Å; A151-L155 WeakPolarHBondContact O-CB 3.42Å; A151-L155 WeakPolarHBondContact O-CG 3.47Å; A151-L155 PolarHBondContact O-N 3.27Å
152	A	93.8	Very high	92.3	Very high	0 Å²	0	51.7 Å²	51.7	0%	0	26%	0.264	C	S	.	.	H	α-helix	trans	-64.1	-38.5	173.6	0	0	0	0	0	111.9	L129 L148 L149 Q156 L157 V160	L129-A152 HydrophobicContact CD2-CB 4.19Å; L148-A152 VanDerWaalsContact O-CB 3.28Å; L148-A152 WeakPolarHBondContact O-CB 3.41Å; L148-A152 PolarHBondContact O-N 3.42Å; L149-A152 PolarHBondContact O-N 3.25Å; A152-Q156 PolarHBondContact O-N 3.42Å; A152-L157 HydrophobicContact CB-CB 4.45Å; A152-L157 PolarHBondContact O-N 3.2Å; A152-V160 HydrophobicContact CB-CB 3.92Å; A152-V160 HydrophobicContact CB-CG1 3.67Å
153	S	91.1	Very high	92.5	Very high	35 Å²	35	48.1 Å²	48.1	25%	0.245	25%	0.251	C	S	.	.	H	α-helix	trans	-64.6	-46.6	175	-161.3	0	0	0	0	111.7	L149 P150 A151 Q156	L149-S153 WeakPolarHBondContact O-CB 3.28Å; L149-S153 PolarHBondContact O-N 2.85Å; P150-S153 WeakPolarHBondContact O-CB 3.37Å; P150-S153 PolarHBondContact O-N 3.39Å; A151-S153 VanDerWaalsContact C-N 3.34Å; S153-Q156 PolarHBondContact O-N 3.48Å; S153-Q156 VanDerWaalsContact O-N 3.11Å
154	L	92.2	Very high	92.7	Very high	53 Å²	53	40.8 Å²	40.8	28%	0.277	21%	0.212	S	C	.	.	H	α-helix	trans	-61.2	-48.1	177.5	-179.5	69.1	0	0	0	112.2	Y99 E120 V121 P150 A151 Q156	Y99-L154 WeakPolarHBondContact CD2-O 3.28Å; E120-L154 HydrophobicContact CB-CD2 3.89Å; V121-L154 HydrophobicContact CG2-CD2 3.73Å; P150-L154 WeakPolarHBondContact O-CB 3.41Å; P150-L154 PolarHBondContact O-N 3.32Å; A151-L154 PolarHBondContact O-N 3.02Å; L154-Q156 PolarHBondContact O-N 2.94Å
155	L	93	Very high	92.7	Very high	0 Å²	0	40.8 Å²	40.8	0%	0	21%	0.213	C	C	.	.	T	Hydrogen-bonded Turn	trans	-77.8	4.5	176.8	-59.3	-175.1	0	0	0	113.2	S97 Y99 F100 L126 L129 A151 L157	S97-L155 PolarHBondContact OG-O 2.95Å; Y99-L155 HydrophobicContact CD1-CD2 3.55Å; Y99-L155 HydrophobicContact CE1-CD2 3.55Å; Y99-L155 HydrophobicContact CG-CD2 4.33Å; F100-L155 HydrophobicContact CE1-CD2 4.26Å; F100-L155 HydrophobicContact CE2-CD1 4.12Å; F100-L155 HydrophobicContact CE2-CD2 4.13Å; F100-L155 HydrophobicContact CZ-CD1 4.08Å; F100-L155 HydrophobicContact CZ-CD2 3.71Å; F100-L155 HydrophobicContact CZ-CG 4.47Å; L126-L155 HydrophobicContact CD1-CD1 3.83Å; L129-L155 HydrophobicContact CB-CD1 4.36Å; L129-L155 HydrophobicContact CD1-CD1 3.91Å; A151-L155 WeakPolarHBondContact O-CB 3.42Å; A151-L155 WeakPolarHBondContact O-CG 3.47Å; A151-L155 PolarHBondContact O-N 3.27Å; L155-L157 VanDerWaalsContact C-N 3.26Å; L155-L157 HydrophobicContact CB-CD1 4.25Å; L155-L157 HydrophobicContact CB-CG 4.32Å; L155-L157 PolarHBondContact O-N 3.24Å
156	Q	93.5	Very high	92.6	Very high	86 Å²	86	45.3 Å²	45.3	40%	0.402	23%	0.234	S	C	.	.	T	Hydrogen-bonded Turn	trans	56.6	32.6	177.1	-59.5	-178.5	3.8	0	0	114.9	P98 A152 S153 L154 M158	P98-Q156 HydrophobicContact CG-CB 4.46Å; A152-Q156 PolarHBondContact O-N 3.42Å; S153-Q156 PolarHBondContact O-N 3.48Å; S153-Q156 VanDerWaalsContact O-N 3.11Å; L154-Q156 PolarHBondContact O-N 2.94Å; Q156-M158 HydrophobicContact CB-CE 4.05Å; Q156-M158 HydrophobicContact CG-CE 4.42Å; Q156-M158 PolarHBondContact O-N 2.83Å
157	L	94.4	Very high	92.8	Very high	7 Å²	7	41 Å²	41	4%	0.037	21%	0.213	C	C	.	.			trans	-86	80.3	175.4	-65.6	170.7	0	0	0	109.8	C96 L129 I133 A152 L155 D159 V160 R161	C96-L157 WeakPolarHBondContact O-CD2 3.41Å; L129-L157 HydrophobicContact CB-CD1 3.98Å; L129-L157 HydrophobicContact CD2-CD1 3.86Å; L129-L157 HydrophobicContact CG-CD1 4.34Å; I133-L157 HydrophobicContact CD1-CD1 4.32Å; I133-L157 HydrophobicContact CD1-CD2 4.21Å; I133-L157 HydrophobicContact CG1-CD1 4.48Å; I133-L157 HydrophobicContact CG1-CD2 4.09Å; A152-L157 HydrophobicContact CB-CB 4.45Å; A152-L157 PolarHBondContact O-N 3.2Å; L155-L157 VanDerWaalsContact C-N 3.26Å; L155-L157 HydrophobicContact CB-CD1 4.25Å; L155-L157 HydrophobicContact CB-CG 4.32Å; L155-L157 PolarHBondContact O-N 3.24Å; L157-D159 PolarHBondContact O-N 3.38Å; L157-V160 HydrophobicContact CB-CB 4.31Å; L157-V160 HydrophobicContact CB-CG2 4.25Å; L157-V160 PolarHBondContact O-N 3.35Å; L157-R161 PolarHBondContact O-N 3.02Å; L157-R161 VanDerWaalsContact O-N 3.08Å
158	M	91.6	Very high	92.8	Very high	94 Å²	94	38.2 Å²	38.2	46%	0.463	20%	0.196	S	C	.	.	H	α-helix	trans	-62.7	-36	-170.9	-65.5	-62.4	135.5	0	0	113.8	Q156 R161 Q162	Q156-M158 HydrophobicContact CB-CE 4.05Å; Q156-M158 HydrophobicContact CG-CE 4.42Å; Q156-M158 PolarHBondContact O-N 2.83Å; M158-R161 WeakPolarHBondContact O-CB 3.48Å; M158-R161 PolarHBondContact O-N 3.2Å; M158-Q162 WeakPolarHBondContact O-CB 2.97Å; M158-Q162 PolarHBondContact O-N 3.2Å
159	D	92.8	Very high	92.6	Very high	114 Å²	114	42.4 Å²	42.4	61%	0.61	22%	0.215	S	C	*	.	H	α-helix	trans	-63.9	-43.3	178.1	-60.5	-45.3	0	0	0	111.5	Y132 L157 Q162 V163	Y132-D159 WeakPolarHBondContact OH-CB 3.43Å; L157-D159 PolarHBondContact O-N 3.38Å; D159-Q162 PolarHBondContact O-N 3.19Å; D159-V163 WeakPolarHBondContact O-CG2 3.36Å; D159-V163 PolarHBondContact O-N 2.88Å
160	V	94.2	Very high	92.4	Very high	0 Å²	0	46.1 Å²	46.1	0%	0	24%	0.241	C	C	.	.	H	α-helix	trans	-63.5	-44.2	174.5	178.3	0	0	0	0	110.8	L129 Y132 I138 L148 A152 L157 Q162 V163 C164	L129-V160 HydrophobicContact CD2-CB 4.44Å; L129-V160 HydrophobicContact CD2-CG1 3.88Å; L129-V160 HydrophobicContact CD2-CG2 4.3Å; Y132-V160 HydrophobicContact CD1-CG2 3.54Å; Y132-V160 HydrophobicContact CD2-CG2 4.19Å; Y132-V160 HydrophobicContact CE1-CG2 3.42Å; Y132-V160 VanDerWaalsContact CE1-CG2 3.42Å; Y132-V160 HydrophobicContact CE2-CG2 4.08Å; Y132-V160 HydrophobicContact CG-CG2 3.93Å; I138-V160 HydrophobicContact CD1-CG1 3.73Å; I138-V160 HydrophobicContact CD1-CG2 3.99Å; I138-V160 HydrophobicContact CG2-CG2 4.42Å; L148-V160 HydrophobicContact CD1-CG1 4.37Å; L148-V160 HydrophobicContact CD2-CG1 4.36Å; L148-V160 HydrophobicContact CG-CG1 4.18Å; A152-V160 HydrophobicContact CB-CB 3.92Å; A152-V160 HydrophobicContact CB-CG1 3.67Å; L157-V160 HydrophobicContact CB-CB 4.31Å; L157-V160 HydrophobicContact CB-CG2 4.25Å; L157-V160 PolarHBondContact O-N 3.35Å; V160-Q162 VanDerWaalsContact C-N 3.27Å; V160-Q162 PolarHBondContact O-N 3.42Å; V160-V163 PolarHBondContact O-N 3.36Å; V160-C164 PolarHBondContact O-N 2.97Å; V160-C164 PolarHBondContact O-SG 2.82Å
161	R	93.2	Very high	92.3	Very high	54 Å²	54	48.4 Å²	48.4	20%	0.204	25%	0.249	C	C	.	.	H	α-helix	trans	-57.1	-42.7	175.7	-178	-172.6	179.5	-163.6	3.9	111.2	L157 M158 C164 C165 H187 T188 C189	L157-R161 PolarHBondContact O-N 3.02Å; L157-R161 VanDerWaalsContact O-N 3.08Å; M158-R161 WeakPolarHBondContact O-CB 3.48Å; M158-R161 PolarHBondContact O-N 3.2Å; R161-C164 PolarHBondContact O-N 3.09Å; R161-C165 PolarHBondContact O-N 3.07Å; R161-C165 PolarHBondContact O-SG 3Å; R161-H187 PolarHBondContact NH2-O 3.1Å; R161-T188 PolarHBondContact NH2-O 2.93Å; R161-C189 PolarHBondContact NE-SG 3.22Å; R161-C189 VanDerWaalsContact NE-SG 3.44Å; R161-C189 PolarHBondContact NH2-SG 3.38Å
162	Q	91.6	Very high	92.2	Very high	78 Å²	78	49.4 Å²	49.4	36%	0.364	25%	0.253	S	S	.	.	H	α-helix	trans	-63.9	-49	178.7	-177.6	60.2	24.3	0	0	111.5	M158 D159 V160 C164 C165 E166	M158-Q162 WeakPolarHBondContact O-CB 2.97Å; M158-Q162 PolarHBondContact O-N 3.2Å; D159-Q162 PolarHBondContact O-N 3.19Å; V160-Q162 VanDerWaalsContact C-N 3.27Å; V160-Q162 PolarHBondContact O-N 3.42Å; Q162-C164 VanDerWaalsContact C-N 3.3Å; Q162-C164 PolarHBondContact O-N 2.86Å; Q162-C165 WeakPolarHBondContact O-CB 3.31Å; Q162-C165 PolarHBondContact O-N 3.2Å; Q162-E166 WeakPolarHBondContact CG-OE1 3.41Å; Q162-E166 PolarHBondContact NE2-OE1 3.44Å; Q162-E166 WeakPolarHBondContact O-CG 3.37Å; Q162-E166 PolarHBondContact O-N 3.38Å
163	V	93	Very high	92	Very high	64 Å²	64	54.1 Å²	54.1	39%	0.388	28%	0.275	S	S	.	.	H	α-helix	trans	-60.7	-38.3	176.9	177.2	0	0	0	0	111.5	V140 D159 V160 E166 F167	V140-V163 HydrophobicContact CG2-CG1 3.86Å; D159-V163 WeakPolarHBondContact O-CG2 3.36Å; D159-V163 PolarHBondContact O-N 2.88Å; V160-V163 PolarHBondContact O-N 3.36Å; V163-E166 PolarHBondContact O-N 3.48Å; V163-F167 WeakPolarHBondContact O-CB 3.16Å; V163-F167 PolarHBondContact O-N 3.47Å
164	C	93.4	Very high	91.8	Very high	0 Å²	0	52.8 Å²	52.8	0%	0	27%	0.266	C	S	.	.	H	α-helix	trans	-64.8	-38.5	173.3	-67.2	0	0	0	0	112.9	V145 L149 V160 R161 Q162 L168	V145-C164 HydrophobicContact CG2-CB 3.96Å; L149-C164 HydrophobicContact CB-CB 3.91Å; L149-C164 HydrophobicContact CD1-CB 3.82Å; L149-C164 HydrophobicContact CG-CB 4.2Å; V160-C164 PolarHBondContact O-N 2.97Å; V160-C164 PolarHBondContact O-SG 2.82Å; R161-C164 PolarHBondContact O-N 3.09Å; Q162-C164 VanDerWaalsContact C-N 3.3Å; Q162-C164 PolarHBondContact O-N 2.86Å; C164-L168 WeakPolarHBondContact O-CG 3.36Å; C164-L168 PolarHBondContact O-N 3.07Å
165	C	91.8	Very high	91.7	Very high	14 Å²	14	54 Å²	54	10%	0.095	28%	0.276	C	S	.	.	H	α-helix	trans	-66	-43.1	174.7	-71.5	0	0	0	0	112.1	R161 Q162 L168 Q169	R161-C165 PolarHBondContact O-N 3.07Å; R161-C165 PolarHBondContact O-SG 3Å; Q162-C165 WeakPolarHBondContact O-CB 3.31Å; Q162-C165 PolarHBondContact O-N 3.2Å; C165-L168 PolarHBondContact O-N 3.07Å; C165-Q169 WeakPolarHBondContact O-CB 3.46Å; C165-Q169 PolarHBondContact O-N 2.93Å
166	E	90.5	Very high	91.6	Very high	100 Å²	100	56.3 Å²	56.3	47%	0.467	29%	0.288	S	S	.	.	H	α-helix	trans	-64.2	-41.2	177.1	-72.3	170.8	-171.4	0	0	111.8	Q162 V163 Q169 S170	Q162-E166 WeakPolarHBondContact CG-OE1 3.41Å; Q162-E166 PolarHBondContact NE2-OE1 3.44Å; Q162-E166 WeakPolarHBondContact O-CG 3.37Å; Q162-E166 PolarHBondContact O-N 3.38Å; V163-E166 PolarHBondContact O-N 3.48Å; E166-Q169 PolarHBondContact O-N 3.19Å; E166-S170 PolarHBondContact O-N 3.06Å
167	F	93.3	Very high	91.6	Very high	48 Å²	48	52.2 Å²	52.2	21%	0.211	27%	0.269	C	S	.	.	H	α-helix	trans	-58.7	-51.8	172.3	-179.5	-96.1	0	0	0	111.4	V140 E142 V145 V163 Q169 S170 Q171	V140-F167 HydrophobicContact CB-CG 4.46Å; V140-F167 HydrophobicContact CG1-CB 3.9Å; V140-F167 HydrophobicContact CG1-CD1 3.84Å; V140-F167 HydrophobicContact CG1-CD2 4.32Å; V140-F167 HydrophobicContact CG1-CE1 4.49Å; V140-F167 HydrophobicContact CG1-CG 3.74Å; E142-F167 HydrophobicContact CG-CE1 4.31Å; E142-F167 HydrophobicContact CG-CZ 3.94Å; V145-F167 HydrophobicContact CB-CD1 4.24Å; V145-F167 HydrophobicContact CB-CE1 4.45Å; V145-F167 HydrophobicContact CG1-CD1 4.32Å; V145-F167 HydrophobicContact CG1-CE1 4.22Å; V145-F167 HydrophobicContact CG2-CD1 4.15Å; V163-F167 WeakPolarHBondContact O-CB 3.16Å; V163-F167 PolarHBondContact O-N 3.47Å; F167-Q169 VanDerWaalsContact C-N 3.29Å; F167-Q169 PolarHBondContact O-N 2.76Å; F167-S170 PolarHBondContact O-N 3.48Å; F167-S170 VanDerWaalsContact O-N 3.1Å; F167-S170 PolarHBondContact O-OG 3.15Å; F167-Q171 HydrophobicContact CE1-CG 4.19Å; F167-Q171 HydrophobicContact CE2-CG 4.48Å; F167-Q171 HydrophobicContact CZ-CG 4.12Å; F167-Q171 WeakPolarHBondContact O-CG 3.27Å; F167-Q171 PolarHBondContact O-N 2.95Å
168	L	92.6	Very high	91.4	Very high	15 Å²	15	52.1 Å²	52.1	8%	0.079	27%	0.269	C	S	.	.	H	α-helix	trans	-61.8	-36	178.1	-71.4	172.1	0	0	0	112.7	V145 L149 C164 C165 S170 Q171 L172 I180 F183 L192	V145-L168 HydrophobicContact CG1-CD2 3.86Å; V145-L168 HydrophobicContact CG2-CD1 4.06Å; V145-L168 HydrophobicContact CG2-CD2 4.1Å; V145-L168 HydrophobicContact CG2-CG 3.85Å; L149-L168 HydrophobicContact CD1-CD1 4.11Å; C164-L168 WeakPolarHBondContact O-CG 3.36Å; C164-L168 PolarHBondContact O-N 3.07Å; C165-L168 PolarHBondContact O-N 3.07Å; L168-S170 VanDerWaalsContact C-N 3.35Å; L168-Q171 PolarHBondContact O-N 2.88Å; L168-L172 PolarHBondContact O-N 3.15Å; L168-I180 HydrophobicContact CB-CG2 4.34Å; L168-I180 HydrophobicContact CD2-CG1 4.46Å; L168-F183 HydrophobicContact CD1-CD1 3.94Å; L168-F183 HydrophobicContact CD1-CE1 3.88Å; L168-L192 HydrophobicContact CB-CD1 4.05Å; L168-L192 HydrophobicContact CB-CD2 3.89Å; L168-L192 HydrophobicContact CD1-CD2 3.68Å; L168-L192 HydrophobicContact CG-CD2 4.45Å
169	Q	89.9	Confident	91.4	Very high	89 Å²	89	49 Å²	49	42%	0.416	26%	0.261	S	S	.	.	H	α-helix	trans	-64.6	-38.2	174.4	179.6	171.1	-8.8	0	0	112	C165 E166 F167 Q171 L172 L192 Q195	C165-Q169 WeakPolarHBondContact O-CB 3.46Å; C165-Q169 PolarHBondContact O-N 2.93Å; E166-Q169 PolarHBondContact O-N 3.19Å; F167-Q169 VanDerWaalsContact C-N 3.29Å; F167-Q169 PolarHBondContact O-N 2.76Å; Q169-Q171 PolarHBondContact O-N 2.77Å; Q169-L172 HydrophobicContact CG-CD1 4.43Å; Q169-L192 HydrophobicContact CB-CD1 4.18Å; Q169-Q195 HydrophobicContact CG-CG 4.1Å
170	S	88.9	Confident	91.3	Very high	79 Å²	79	44.4 Å²	44.4	55%	0.552	24%	0.236	S	C	*	.	H	α-helix	trans	-68.3	-19.4	175.7	79.5	0	0	0	0	114.2	E166 F167 L168	E166-S170 PolarHBondContact O-N 3.06Å; F167-S170 PolarHBondContact O-N 3.48Å; F167-S170 VanDerWaalsContact O-N 3.1Å; F167-S170 PolarHBondContact O-OG 3.15Å; L168-S170 VanDerWaalsContact C-N 3.35Å
171	Q	90.6	Very high	91.3	Very high	84 Å²	84	45.5 Å²	45.5	39%	0.393	24%	0.24	S	C	.	.	T	Hydrogen-bonded Turn	trans	-106.1	16.7	-177.4	-60	-52.3	-46.4	0	0	113.6	F167 L168 Q169 H173 N176	F167-Q171 HydrophobicContact CE1-CG 4.19Å; F167-Q171 HydrophobicContact CE2-CG 4.48Å; F167-Q171 HydrophobicContact CZ-CG 4.12Å; F167-Q171 WeakPolarHBondContact O-CG 3.27Å; F167-Q171 PolarHBondContact O-N 2.95Å; L168-Q171 PolarHBondContact O-N 2.88Å; Q169-Q171 PolarHBondContact O-N 2.77Å; Q171-H173 PolarHBondContact O-N 3.5Å; Q171-N176 PolarHBondContact O-ND2 3.04Å; Q171-N176 PolarHBondContact O-OD1 2.72Å
172	L	90.6	Very high	91.1	Very high	23 Å²	23	45.1 Å²	45.1	12%	0.12	25%	0.248	C	C	.	.			trans	-65.4	120.9	176	-77	170	0	0	0	111.4	L168 Q169 C177 I180 Q195 A196 Y199	L168-L172 PolarHBondContact O-N 3.15Å; Q169-L172 HydrophobicContact CG-CD1 4.43Å; L172-C177 HydrophobicContact CD2-CB 4.15Å; L172-I180 HydrophobicContact CD2-CB 4.29Å; L172-I180 HydrophobicContact CD2-CD1 4.05Å; L172-I180 HydrophobicContact CD2-CG2 4.01Å; L172-Q195 HydrophobicContact CD1-CG 3.98Å; L172-A196 HydrophobicContact CD2-CB 3.91Å; L172-Y199 HydrophobicContact CB-CD2 4.13Å; L172-Y199 HydrophobicContact CB-CE2 4.2Å; L172-Y199 HydrophobicContact CB-CG 4.29Å; L172-Y199 HydrophobicContact CD1-CD2 4.47Å; L172-Y199 HydrophobicContact CD1-CG 4.48Å; L172-Y199 PolarHBondContact O-OH 2.75Å
173	H	89.9	Confident	91	Very high	99 Å²	99	43.3 Å²	43.3	46%	0.458	24%	0.239	S	C	.	.			trans	-137.8	151.7	-180	-171.5	-103.8	0	0	0	109.9	Q171 T175 N176 C177	Q171-H173 PolarHBondContact O-N 3.5Å; H173-T175 PolarHBondContact ND1-OG1 2.9Å; H173-T175 PolarHBondContact O-N 2.91Å; H173-N176 PolarHBondContact N-OD1 3.21Å; H173-N176 PolarHBondContact O-N 3.16Å; H173-N176 PolarHBondContact O-OD1 2.92Å; H173-C177 WeakPolarHBondContact O-CB 3.4Å; H173-C177 PolarHBondContact O-N 3.49Å
174	P	87.8	Confident	91	Very high	8 Å²	8	40.3 Å²	40.3	5%	0.052	22%	0.221	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.8	-21.6	-176.9	-27.6	37.7	0	0	0	114.7	Y199 H203 E206 V207	P174-Y199 WeakPolarHBondContact CD-OH 3.36Å; P174-Y199 HydrophobicContact CG-CE1 4.27Å; P174-H203 HydrophobicContact CG-CB 4.22Å; P174-E206 HydrophobicContact CB-CB 3.7Å; P174-E206 HydrophobicContact CG-CB 4.06Å; P174-V207 HydrophobicContact CB-CG2 4.07Å
175	T	89.3	Confident	90.8	Very high	79 Å²	79	45 Å²	45	49%	0.485	25%	0.246	S	C	.	.	T	Hydrogen-bonded Turn	trans	-89.5	-11.4	179.1	63.2	0	0	0	0	115.4	H173	H173-T175 PolarHBondContact ND1-OG1 2.9Å; H173-T175 PolarHBondContact O-N 2.91Å
176	N	90.7	Very high	90.6	Very high	47 Å²	47	50.4 Å²	50.4	25%	0.251	27%	0.273	S	S	.	.	T	Hydrogen-bonded Turn	trans	-126.6	-9.8	-177.5	73.2	7	0	0	0	113.6	Q171 H173 L178 G179 I180 E212	Q171-N176 PolarHBondContact O-ND2 3.04Å; Q171-N176 PolarHBondContact O-OD1 2.72Å; H173-N176 PolarHBondContact N-OD1 3.21Å; H173-N176 PolarHBondContact O-N 3.16Å; H173-N176 PolarHBondContact O-OD1 2.92Å; N176-L178 PolarHBondContact O-N 3.11Å; N176-G179 PolarHBondContact O-N 3.38Å; N176-I180 HydrophobicContact CB-CD1 4.44Å; N176-I180 WeakPolarHBondContact O-CG1 3.23Å; N176-I180 PolarHBondContact O-N 3.02Å; N176-E212 WeakPolarHBondContact CA-OE2 3.16Å
177	C	92.6	Very high	90.5	Very high	0 Å²	0	47.4 Å²	47.4	0%	0	26%	0.259	C	S	.	.	H	α-helix	trans	-64.6	-26.3	-172.8	67.1	0	0	0	0	113.1	L172 H173 R181 Y199 V207	L172-C177 HydrophobicContact CD2-CB 4.15Å; H173-C177 WeakPolarHBondContact O-CB 3.4Å; H173-C177 PolarHBondContact O-N 3.49Å; C177-R181 WeakPolarHBondContact O-CB 3.37Å; C177-R181 PolarHBondContact O-N 3.5Å; C177-Y199 HydrophobicContact CB-CD1 3.78Å; C177-Y199 HydrophobicContact CB-CE1 4.27Å; C177-V207 VanDerWaalsContact SG-CG2 3.56Å
178	L	92	Very high	90.2	Very high	6 Å²	6	50 Å²	50	3%	0.031	28%	0.279	C	S	.	.	H	α-helix	trans	-77.2	-40.2	176	-62.4	175.5	0	0	0	110.8	N176 R181 A182 A200 V207 E212 F213 L216	N176-L178 PolarHBondContact O-N 3.11Å; L178-R181 PolarHBondContact O-N 2.75Å; L178-A182 WeakPolarHBondContact O-CB 3.47Å; L178-A182 PolarHBondContact O-N 2.91Å; L178-A200 HydrophobicContact CD2-CB 4.2Å; L178-V207 HydrophobicContact CD1-CG1 3.58Å; L178-V207 HydrophobicContact CD2-CG1 4.07Å; L178-V207 HydrophobicContact CG-CG1 3.76Å; L178-E212 HydrophobicContact CB-CB 4.09Å; L178-E212 WeakPolarHBondContact CB-OE2 3.17Å; L178-E212 HydrophobicContact CD1-CB 4.11Å; L178-E212 PolarHBondContact N-OE2 2.94Å; L178-F213 HydrophobicContact CD1-CB 3.85Å; L178-F213 HydrophobicContact CD1-CD2 4.35Å; L178-L216 HydrophobicContact CD1-CD1 3.93Å; L178-L216 HydrophobicContact CD1-CD2 4.44Å; L178-L216 HydrophobicContact CD1-CG 4.27Å; L178-L216 HydrophobicContact CD2-CD1 4.26Å
179	G	90.5	Very high	90.1	Very high	29 Å²	29	49.5 Å²	49.5	30%	0.299	28%	0.277	S	S	.	.	H	α-helix	trans	-58.5	-50.4	169	0	0	0	0	0	112.4	N176 R181 A182 F183 E212	N176-G179 PolarHBondContact O-N 3.38Å; G179-R181 VanDerWaalsContact C-N 3.34Å; G179-R181 PolarHBondContact O-N 3.05Å; G179-A182 PolarHBondContact O-N 2.79Å; G179-F183 WeakPolarHBondContact O-CB 3.4Å; G179-F183 PolarHBondContact O-N 3.34Å; G179-E212 PolarHBondContact N-OE2 3.02Å
180	I	91.9	Very high	90	Very high	16 Å²	16	50 Å²	50	8%	0.082	29%	0.286	C	S	.	.	H	α-helix	trans	-61.6	-41.2	177.2	-66.7	171.7	0	0	0	111.1	L168 L172 N176 F183 A184 L192 A196	L168-I180 HydrophobicContact CB-CG2 4.34Å; L168-I180 HydrophobicContact CD2-CG1 4.46Å; L172-I180 HydrophobicContact CD2-CB 4.29Å; L172-I180 HydrophobicContact CD2-CD1 4.05Å; L172-I180 HydrophobicContact CD2-CG2 4.01Å; N176-I180 HydrophobicContact CB-CD1 4.44Å; N176-I180 WeakPolarHBondContact O-CG1 3.23Å; N176-I180 PolarHBondContact O-N 3.02Å; I180-F183 PolarHBondContact O-N 3.44Å; I180-A184 VanDerWaalsContact O-CB 3.3Å; I180-A184 WeakPolarHBondContact O-CB 3.24Å; I180-A184 PolarHBondContact O-N 3.39Å; I180-L192 HydrophobicContact CG2-CD1 4.02Å; I180-L192 HydrophobicContact CG2-CD2 4.21Å; I180-L192 HydrophobicContact CG2-CG 4.16Å; I180-A196 HydrophobicContact CG2-CB 4.26Å
181	R	92.8	Very high	90	Very high	24 Å²	24	52.5 Å²	52.5	9%	0.091	29%	0.289	C	S	.	.	H	α-helix	trans	-60.2	-47.2	174.1	176.8	-172.5	155.4	-171.4	-3.9	111.7	C177 L178 G179 A184 D185 L193 A196	C177-R181 WeakPolarHBondContact O-CB 3.37Å; C177-R181 PolarHBondContact O-N 3.5Å; L178-R181 PolarHBondContact O-N 2.75Å; G179-R181 VanDerWaalsContact C-N 3.34Å; G179-R181 PolarHBondContact O-N 3.05Å; R181-A184 PolarHBondContact O-N 3.02Å; R181-D185 PolarHBondContact O-N 3.34Å; R181-L193 HydrophobicContact CG-CD1 3.8Å; R181-L193 WeakPolarHBondContact O-CD1 3.43Å; R181-A196 HydrophobicContact CB-CB 3.83Å
182	A	89.3	Confident	90	Very high	45 Å²	45	48.7 Å²	48.7	37%	0.372	27%	0.271	S	S	.	.	H	α-helix	trans	-66	-39	178.8	0	0	0	0	0	112.3	L178 G179 D185 L186	L178-A182 WeakPolarHBondContact O-CB 3.47Å; L178-A182 PolarHBondContact O-N 2.91Å; G179-A182 PolarHBondContact O-N 2.79Å; A182-D185 PolarHBondContact O-N 3.33Å; A182-L186 WeakPolarHBondContact O-CB 3.5Å; A182-L186 PolarHBondContact O-N 2.86Å
183	F	90.2	Very high	90.1	Very high	40 Å²	40	49.6 Å²	49.6	18%	0.175	28%	0.276	C	S	.	.	H	α-helix	trans	-64.4	-41.7	174.4	-174	-105.4	0	0	0	112	L149 P150 L168 G179 I180 L186 H187	L149-F183 HydrophobicContact CB-CE1 4.19Å; L149-F183 HydrophobicContact CB-CZ 4.3Å; L149-F183 HydrophobicContact CD1-CE1 4.14Å; L149-F183 HydrophobicContact CD2-CE1 3.95Å; L149-F183 HydrophobicContact CD2-CZ 4.24Å; L149-F183 HydrophobicContact CG-CE1 4.32Å; P150-F183 HydrophobicContact CG-CE2 4.3Å; P150-F183 HydrophobicContact CG-CZ 4.08Å; L168-F183 HydrophobicContact CD1-CD1 3.94Å; L168-F183 HydrophobicContact CD1-CE1 3.88Å; G179-F183 WeakPolarHBondContact O-CB 3.4Å; G179-F183 PolarHBondContact O-N 3.34Å; I180-F183 PolarHBondContact O-N 3.44Å; F183-L186 PolarHBondContact O-N 2.87Å; F183-H187 AromaticContact CD2-CD2 3.64Å; F183-H187 AromaticContact CD2-NE2 3.68Å; F183-H187 AromaticContact CE1-CD2 3.98Å; F183-H187 AromaticContact CE2-CD2 3.43Å; F183-H187 VanDerWaalsContact CE2-CD2 3.43Å; F183-H187 WeakPolarHBondContact CE2-CD2 3.33Å; F183-H187 AromaticContact CE2-NE2 3.31Å; F183-H187 VanDerWaalsContact CE2-NE2 3.31Å; F183-H187 WeakPolarHBondContact CE2-NE2 3.35Å; F183-H187 AromaticContact CZ-CD2 3.61Å; F183-H187 AromaticContact CZ-NE2 3.87Å; F183-H187 PolarHBondContact O-CD2 2.99Å; F183-H187 PolarHBondContact O-N 3.42Å; F183-H187 VanDerWaalsContact O-N 3.1Å
184	A	91.9	Very high	90	Very high	1 Å²	1	48.3 Å²	48.3	1%	0.008	28%	0.279	C	S	.	.	H	α-helix	trans	-65.9	-35.9	176	0	0	0	0	0	112.8	I180 R181 T188 C189 L192 L193	I180-A184 VanDerWaalsContact O-CB 3.3Å; I180-A184 WeakPolarHBondContact O-CB 3.24Å; I180-A184 PolarHBondContact O-N 3.39Å; R181-A184 PolarHBondContact O-N 3.02Å; A184-T188 PolarHBondContact O-N 2.96Å; A184-T188 VanDerWaalsContact O-N 3.07Å; A184-C189 HydrophobicContact CB-CB 4.24Å; A184-C189 PolarHBondContact O-N 2.7Å; A184-L192 HydrophobicContact CB-CB 4.05Å; A184-L192 HydrophobicContact CB-CD2 3.93Å; A184-L192 HydrophobicContact CB-CG 3.85Å; A184-L193 HydrophobicContact CB-CB 3.89Å
185	D	89.8	Confident	90	Very high	99 Å²	99	51.7 Å²	51.7	53%	0.529	29%	0.294	S	S	.	.	H	α-helix	trans	-64.1	-51.8	173.6	-159.7	22	0	0	0	110.8	R181 A182 H187 T188 L193	R181-D185 PolarHBondContact O-N 3.34Å; A182-D185 PolarHBondContact O-N 3.33Å; D185-H187 VanDerWaalsContact C-N 3.27Å; D185-H187 PolarHBondContact O-N 2.88Å; D185-T188 PolarHBondContact O-N 2.87Å; D185-L193 HydrophobicContact CB-CD1 3.91Å; D185-L193 HydrophobicContact CB-CD2 4.41Å
186	L	87.7	Confident	90.1	Very high	128 Å²	128	48 Å²	48	67%	0.67	27%	0.271	S	S	*	.	H	α-helix	trans	-55.3	-38.7	178.8	-176.8	63.5	0	0	0	113.1	A182 F183	A182-L186 WeakPolarHBondContact O-CB 3.5Å; A182-L186 PolarHBondContact O-N 2.86Å; F183-L186 PolarHBondContact O-N 2.87Å
187	H	87.6	Confident	90.1	Very high	36 Å²	36	47.3 Å²	47.3	17%	0.167	27%	0.266	C	S	.	.	T	Hydrogen-bonded Turn	trans	-100.2	15.5	179.4	-57.8	-54.7	0	0	0	114	L149 R161 F183 D185 C189	L149-H187 HydrophobicContact CD2-CB 3.58Å; R161-H187 PolarHBondContact NH2-O 3.1Å; F183-H187 AromaticContact CD2-CD2 3.64Å; F183-H187 AromaticContact CD2-NE2 3.68Å; F183-H187 AromaticContact CE1-CD2 3.98Å; F183-H187 AromaticContact CE2-CD2 3.43Å; F183-H187 VanDerWaalsContact CE2-CD2 3.43Å; F183-H187 WeakPolarHBondContact CE2-CD2 3.33Å; F183-H187 AromaticContact CE2-NE2 3.31Å; F183-H187 VanDerWaalsContact CE2-NE2 3.31Å; F183-H187 WeakPolarHBondContact CE2-NE2 3.35Å; F183-H187 AromaticContact CZ-CD2 3.61Å; F183-H187 AromaticContact CZ-NE2 3.87Å; F183-H187 PolarHBondContact O-CD2 2.99Å; F183-H187 PolarHBondContact O-N 3.42Å; F183-H187 VanDerWaalsContact O-N 3.1Å; D185-H187 VanDerWaalsContact C-N 3.27Å; D185-H187 PolarHBondContact O-N 2.88Å; H187-C189 PolarHBondContact O-N 2.67Å; H187-C189 VanDerWaalsContact O-N 3.09Å; H187-C189 PolarHBondContact O-SG 3.35Å
188	T	88.4	Confident	89.8	Confident	103 Å²	103	48.7 Å²	48.7	63%	0.632	28%	0.277	S	S	*	.	T	Hydrogen-bonded Turn	trans	54.6	31.9	173.3	-18.9	0	0	0	0	113.5	R161 A184 D185 T190	R161-T188 PolarHBondContact NH2-O 2.93Å; A184-T188 PolarHBondContact O-N 2.96Å; A184-T188 VanDerWaalsContact O-N 3.07Å; D185-T188 PolarHBondContact O-N 2.87Å; T188-T190 VanDerWaalsContact C-N 3.34Å; T188-T190 PolarHBondContact O-N 2.52Å; T188-T190 VanDerWaalsContact O-N 3.12Å
189	C	89.4	Confident	89.7	Confident	5 Å²	5	50.2 Å²	50.2	3%	0.034	28%	0.283	C	S	.	.			trans	-86	74.1	179.7	-70.3	0	0	0	0	109.6	R161 A184 H187 Q191 L192 L193	R161-C189 PolarHBondContact NE-SG 3.22Å; R161-C189 VanDerWaalsContact NE-SG 3.44Å; R161-C189 PolarHBondContact NH2-SG 3.38Å; A184-C189 HydrophobicContact CB-CB 4.24Å; A184-C189 PolarHBondContact O-N 2.7Å; H187-C189 PolarHBondContact O-N 2.67Å; H187-C189 VanDerWaalsContact O-N 3.09Å; H187-C189 PolarHBondContact O-SG 3.35Å; C189-Q191 VanDerWaalsContact C-N 3.31Å; C189-Q191 PolarHBondContact O-N 3.26Å; C189-L192 HydrophobicContact CB-CB 4.22Å; C189-L192 PolarHBondContact O-N 3.08Å; C189-L193 WeakPolarHBondContact O-CB 3.46Å; C189-L193 PolarHBondContact O-N 3.36Å
190	T	88.6	Confident	89.6	Confident	100 Å²	100	48.8 Å²	48.8	61%	0.613	27%	0.269	S	S	*	.	H	α-helix	trans	-54.3	-38.4	-170.5	53.8	0	0	0	0	114.6	T188 S194	T188-T190 VanDerWaalsContact C-N 3.34Å; T188-T190 PolarHBondContact O-N 2.52Å; T188-T190 VanDerWaalsContact O-N 3.12Å; T190-S194 WeakPolarHBondContact O-CB 3.46Å; T190-S194 PolarHBondContact O-N 3.34Å; T190-S194 PolarHBondContact O-OG 3.47Å
191	Q	88.3	Confident	89.4	Confident	131 Å²	131	48.4 Å²	48.4	61%	0.612	27%	0.266	S	S	*	.	H	α-helix	trans	-65	-55.9	176.4	-71.1	-178.1	-13.3	0	0	111.5	C189 L193 S194 Q195	C189-Q191 VanDerWaalsContact C-N 3.31Å; C189-Q191 PolarHBondContact O-N 3.26Å; Q191-L193 VanDerWaalsContact C-N 3.28Å; Q191-L193 PolarHBondContact O-N 2.8Å; Q191-S194 PolarHBondContact O-N 3.1Å; Q191-S194 VanDerWaalsContact O-N 3.11Å; Q191-S194 PolarHBondContact O-OG 3.34Å; Q191-Q195 PolarHBondContact O-N 3.28Å
192	L	91.5	Very high	89	Confident	3 Å²	3	49.5 Å²	49.5	2%	0.016	27%	0.272	C	S	.	.	H	α-helix	trans	-58.6	-40.1	177.4	-178.6	63.9	0	0	0	111.8	L168 Q169 I180 A184 C189 Q195 A196	L168-L192 HydrophobicContact CB-CD1 4.05Å; L168-L192 HydrophobicContact CB-CD2 3.89Å; L168-L192 HydrophobicContact CD1-CD2 3.68Å; L168-L192 HydrophobicContact CG-CD2 4.45Å; Q169-L192 HydrophobicContact CB-CD1 4.18Å; I180-L192 HydrophobicContact CG2-CD1 4.02Å; I180-L192 HydrophobicContact CG2-CD2 4.21Å; I180-L192 HydrophobicContact CG2-CG 4.16Å; A184-L192 HydrophobicContact CB-CB 4.05Å; A184-L192 HydrophobicContact CB-CD2 3.93Å; A184-L192 HydrophobicContact CB-CG 3.85Å; C189-L192 HydrophobicContact CB-CB 4.22Å; C189-L192 PolarHBondContact O-N 3.08Å; L192-Q195 PolarHBondContact O-N 3.02Å; L192-A196 VanDerWaalsContact O-CB 3.28Å; L192-A196 WeakPolarHBondContact O-CB 3.33Å; L192-A196 PolarHBondContact O-N 2.92Å
193	L	91.5	Very high	88.8	Confident	42 Å²	42	49.3 Å²	49.3	22%	0.22	26%	0.264	C	S	.	.	H	α-helix	trans	-58.7	-47.9	174.7	176.6	63.2	0	0	0	111.3	R181 A184 D185 C189 Q191 H197	R181-L193 HydrophobicContact CG-CD1 3.8Å; R181-L193 WeakPolarHBondContact O-CD1 3.43Å; A184-L193 HydrophobicContact CB-CB 3.89Å; D185-L193 HydrophobicContact CB-CD1 3.91Å; D185-L193 HydrophobicContact CB-CD2 4.41Å; C189-L193 WeakPolarHBondContact O-CB 3.46Å; C189-L193 PolarHBondContact O-N 3.36Å; Q191-L193 VanDerWaalsContact C-N 3.28Å; Q191-L193 PolarHBondContact O-N 2.8Å; L193-H197 VanDerWaalsContact O-CB 3.24Å; L193-H197 WeakPolarHBondContact O-CB 3.43Å; L193-H197 PolarHBondContact O-N 2.68Å
194	S	88.6	Confident	88.7	Confident	73 Å²	73	47.4 Å²	47.4	51%	0.51	26%	0.255	S	S	.	.	H	α-helix	trans	-64.9	-39.2	178.8	72	0	0	0	0	112.4	T190 Q191 H197 A198	T190-S194 WeakPolarHBondContact O-CB 3.46Å; T190-S194 PolarHBondContact O-N 3.34Å; T190-S194 PolarHBondContact O-OG 3.47Å; Q191-S194 PolarHBondContact O-N 3.1Å; Q191-S194 VanDerWaalsContact O-N 3.11Å; Q191-S194 PolarHBondContact O-OG 3.34Å; S194-H197 PolarHBondContact O-N 2.97Å; S194-A198 WeakPolarHBondContact O-CB 3.42Å; S194-A198 PolarHBondContact O-N 3.26Å
195	Q	87.6	Confident	88.4	Confident	79 Å²	79	49 Å²	49	37%	0.369	27%	0.267	S	S	.	.	H	α-helix	trans	-70.8	-45.6	179.4	-171.3	64	19.3	0	0	111.8	Q169 L172 Q191 L192 H197 A198 Y199	Q169-Q195 HydrophobicContact CG-CG 4.1Å; L172-Q195 HydrophobicContact CD1-CG 3.98Å; Q191-Q195 PolarHBondContact O-N 3.28Å; L192-Q195 PolarHBondContact O-N 3.02Å; Q195-H197 VanDerWaalsContact C-N 3.3Å; Q195-H197 PolarHBondContact O-N 3.47Å; Q195-A198 PolarHBondContact O-N 3.26Å; Q195-Y199 WeakPolarHBondContact O-CB 3.3Å; Q195-Y199 PolarHBondContact O-N 2.97Å
196	A	91.7	Very high	88.2	Confident	0 Å²	0	49.2 Å²	49.2	0%	0	27%	0.265	C	S	.	.	H	α-helix	trans	-64.6	-35	175.8	0	0	0	0	0	111.8	L172 I180 R181 L192 A200	L172-A196 HydrophobicContact CD2-CB 3.91Å; I180-A196 HydrophobicContact CG2-CB 4.26Å; R181-A196 HydrophobicContact CB-CB 3.83Å; L192-A196 VanDerWaalsContact O-CB 3.28Å; L192-A196 WeakPolarHBondContact O-CB 3.33Å; L192-A196 PolarHBondContact O-N 2.92Å; A196-A200 WeakPolarHBondContact O-CB 3.25Å; A196-A200 PolarHBondContact O-N 3.03Å
197	H	90.1	Very high	88.3	Confident	33 Å²	33	43.1 Å²	43.1	15%	0.153	23%	0.233	C	C	.	.	H	α-helix	trans	-66	-47.2	172.3	-167.6	-63.4	0	0	0	112.1	L193 S194 Q195 Y199 A200 E201	L193-H197 VanDerWaalsContact O-CB 3.24Å; L193-H197 WeakPolarHBondContact O-CB 3.43Å; L193-H197 PolarHBondContact O-N 2.68Å; S194-H197 PolarHBondContact O-N 2.97Å; Q195-H197 VanDerWaalsContact C-N 3.3Å; Q195-H197 PolarHBondContact O-N 3.47Å; H197-Y199 VanDerWaalsContact C-N 3.33Å; H197-Y199 PolarHBondContact O-N 3.25Å; H197-A200 PolarHBondContact O-N 2.93Å; H197-E201 IonicContact CE1-OE1 3.35Å; H197-E201 PolarHBondContact CE1-OE1 2.56Å; H197-E201 IonicContact ND1-OE1 2.67Å; H197-E201 IonicContact ND1-OE2 3.99Å; H197-E201 WeakPolarHBondContact O-CG 3.41Å; H197-E201 PolarHBondContact O-N 2.68Å
198	A	87.4	Confident	88.4	Confident	29 Å²	29	42.4 Å²	42.4	24%	0.24	23%	0.231	C	C	.	.	H	α-helix	trans	-62	-40.8	177.5	0	0	0	0	0	111.8	S194 Q195 E201 Q202	S194-A198 WeakPolarHBondContact O-CB 3.42Å; S194-A198 PolarHBondContact O-N 3.26Å; Q195-A198 PolarHBondContact O-N 3.26Å; A198-E201 PolarHBondContact O-N 2.91Å; A198-Q202 WeakPolarHBondContact O-CG 3.28Å; A198-Q202 PolarHBondContact O-N 3.39Å
199	Y	88.3	Confident	88.4	Confident	38 Å²	38	45.2 Å²	45.2	15%	0.149	24%	0.237	C	C	.	.	H	α-helix	trans	-60.8	-44.7	174.4	-170.3	-84.1	0	0	0	111.9	L172 P174 C177 Q195 H197 E201 Q202 H203	L172-Y199 HydrophobicContact CB-CD2 4.13Å; L172-Y199 HydrophobicContact CB-CE2 4.2Å; L172-Y199 HydrophobicContact CB-CG 4.29Å; L172-Y199 HydrophobicContact CD1-CD2 4.47Å; L172-Y199 HydrophobicContact CD1-CG 4.48Å; L172-Y199 PolarHBondContact O-OH 2.75Å; P174-Y199 WeakPolarHBondContact CD-OH 3.36Å; P174-Y199 HydrophobicContact CG-CE1 4.27Å; C177-Y199 HydrophobicContact CB-CD1 3.78Å; C177-Y199 HydrophobicContact CB-CE1 4.27Å; Q195-Y199 WeakPolarHBondContact O-CB 3.3Å; Q195-Y199 PolarHBondContact O-N 2.97Å; H197-Y199 VanDerWaalsContact C-N 3.33Å; H197-Y199 PolarHBondContact O-N 3.25Å; Y199-E201 VanDerWaalsContact C-N 3.29Å; Y199-E201 PolarHBondContact O-N 3.39Å; Y199-Q202 PolarHBondContact O-N 3.44Å; Y199-Q202 VanDerWaalsContact O-N 3.15Å; Y199-H203 AromaticContact CD2-CD2 3.97Å; Y199-H203 HydrophobicContact CE1-CB 4.21Å; Y199-H203 AromaticContact CE1-CD2 3.77Å; Y199-H203 AromaticContact CE2-CD2 3.67Å; Y199-H203 AromaticContact CE2-NE2 3.84Å; Y199-H203 AromaticContact CZ-CD2 3.56Å; Y199-H203 AromaticContact CZ-NE2 3.95Å; Y199-H203 PolarHBondContact O-N 2.85Å
200	A	89.6	Confident	88.3	Confident	0 Å²	0	45.6 Å²	45.6	0%	0	24%	0.239	C	C	.	.	H	α-helix	trans	-65.3	-29.4	176.4	0	0	0	0	0	113.4	L178 A196 H197 F204	L178-A200 HydrophobicContact CD2-CB 4.2Å; A196-A200 WeakPolarHBondContact O-CB 3.25Å; A196-A200 PolarHBondContact O-N 3.03Å; H197-A200 PolarHBondContact O-N 2.93Å; A200-F204 WeakPolarHBondContact O-CA 3.4Å; A200-F204 PolarHBondContact O-N 3.11Å
201	E	88.1	Confident	88.1	Confident	7 Å²	7	49 Å²	49	3%	0.033	25%	0.248	C	C	.	.	H	α-helix	trans	-71.8	-38	171	-67.7	178.3	144.9	0	0	112.1	H197 A198 Y199 L224 S227 R229 L230 T231	H197-E201 IonicContact CE1-OE1 3.35Å; H197-E201 PolarHBondContact CE1-OE1 2.56Å; H197-E201 IonicContact ND1-OE1 2.67Å; H197-E201 IonicContact ND1-OE2 3.99Å; H197-E201 WeakPolarHBondContact O-CG 3.41Å; H197-E201 PolarHBondContact O-N 2.68Å; A198-E201 PolarHBondContact O-N 2.91Å; Y199-E201 VanDerWaalsContact C-N 3.29Å; Y199-E201 PolarHBondContact O-N 3.39Å; E201-L224 HydrophobicContact CG-CD1 4.13Å; E201-S227 WeakPolarHBondContact OE1-CB 3.45Å; E201-S227 PolarHBondContact OE1-OG 3.21Å; E201-R229 VanDerWaalsContact CD-NH2 3.35Å; E201-R229 IonicContact OE1-CZ 2.68Å; E201-R229 IonicContact OE1-NE 3.11Å; E201-R229 PolarHBondContact OE1-NE 2.76Å; E201-R229 IonicContact OE1-NH2 3.4Å; E201-R229 PolarHBondContact OE1-NH2 3.35Å; E201-R229 IonicContact OE2-CZ 3.43Å; E201-R229 IonicContact OE2-NE 3.39Å; E201-R229 PolarHBondContact OE2-NE 2.69Å; E201-R229 IonicContact OE2-NH2 2.75Å; E201-R229 PolarHBondContact OE2-NH2 3.2Å; E201-R229 VanDerWaalsContact OE2-NH2 3.11Å; E201-L230 HydrophobicContact CB-CD2 4.13Å; E201-L230 HydrophobicContact CG-CD2 4.04Å; E201-L230 WeakPolarHBondContact O-CA 3.42Å; E201-T231 PolarHBondContact O-N 2.8Å
202	Q	84.3	Confident	88.1	Confident	47 Å²	47	46 Å²	46	22%	0.22	24%	0.235	C	C	.	.	H	α-helix	trans	-74.9	-37.2	-179	-72.6	171.8	-0.1	0	0	113.5	A198 Y199 T231	A198-Q202 WeakPolarHBondContact O-CG 3.28Å; A198-Q202 PolarHBondContact O-N 3.39Å; Y199-Q202 PolarHBondContact O-N 3.44Å; Y199-Q202 VanDerWaalsContact O-N 3.15Å; Q202-T231 WeakPolarHBondContact O-CB 3.43Å
203	H	84.5	Confident	88.1	Confident	41 Å²	41	45.9 Å²	45.9	19%	0.19	23%	0.234	C	C	.	.	T	Hydrogen-bonded Turn	trans	-103.6	20.6	-179.3	-69.5	-84.8	0	0	0	113.3	P174 Y199 S205 E206 V207	P174-H203 HydrophobicContact CG-CB 4.22Å; Y199-H203 AromaticContact CD2-CD2 3.97Å; Y199-H203 HydrophobicContact CE1-CB 4.21Å; Y199-H203 AromaticContact CE1-CD2 3.77Å; Y199-H203 AromaticContact CE2-CD2 3.67Å; Y199-H203 AromaticContact CE2-NE2 3.84Å; Y199-H203 AromaticContact CZ-CD2 3.56Å; Y199-H203 AromaticContact CZ-NE2 3.95Å; Y199-H203 PolarHBondContact O-N 2.85Å; H203-S205 PolarHBondContact O-N 3.3Å; H203-E206 IonicContact ND1-OE1 2.67Å; H203-E206 PolarHBondContact ND1-OE1 3.27Å; H203-E206 VanDerWaalsContact ND1-OE1 3.12Å; H203-E206 PolarHBondContact O-N 2.76Å; H203-V207 HydrophobicContact CB-CG2 4.27Å; H203-V207 WeakPolarHBondContact O-CG2 3.43Å; H203-V207 PolarHBondContact O-N 3.47Å
204	F	88.9	Confident	88	Confident	0 Å²	0	45.5 Å²	45.5	0%	0	23%	0.232	C	C	.	.	H	α-helix	trans	-47.9	-42.1	-172.1	-178.2	-95.1	0	0	0	113.8	A200 E206 V207 V208 L224 I225 L230 V232 V238 A241	A200-F204 WeakPolarHBondContact O-CA 3.4Å; A200-F204 PolarHBondContact O-N 3.11Å; F204-E206 PolarHBondContact O-N 2.78Å; F204-V207 PolarHBondContact O-N 2.77Å; F204-V208 HydrophobicContact CD1-CG1 4.01Å; F204-V208 HydrophobicContact CD2-CG1 4.05Å; F204-V208 HydrophobicContact CE1-CG1 3.63Å; F204-V208 HydrophobicContact CE2-CG1 3.66Å; F204-V208 HydrophobicContact CG-CG1 4.23Å; F204-V208 HydrophobicContact CZ-CG1 3.44Å; F204-V208 VanDerWaalsContact CZ-CG1 3.44Å; F204-V208 WeakPolarHBondContact O-CG1 3.39Å; F204-V208 WeakPolarHBondContact O-CG2 3.49Å; F204-V208 PolarHBondContact O-N 2.8Å; F204-L224 HydrophobicContact CD2-CD1 4.46Å; F204-L224 HydrophobicContact CD2-CD2 3.85Å; F204-L224 HydrophobicContact CD2-CG 3.92Å; F204-L224 HydrophobicContact CE2-CD2 3.72Å; F204-L224 HydrophobicContact CE2-CG 3.81Å; F204-I225 HydrophobicContact CE2-CG2 4.37Å; F204-I225 HydrophobicContact CZ-CG2 4.14Å; F204-L230 HydrophobicContact CB-CD2 4.22Å; F204-L230 HydrophobicContact CD2-CD1 4.27Å; F204-L230 HydrophobicContact CD2-CD2 3.71Å; F204-L230 HydrophobicContact CE2-CD1 4.22Å; F204-L230 HydrophobicContact CE2-CD2 4.3Å; F204-L230 HydrophobicContact CG-CD1 4.46Å; F204-L230 HydrophobicContact CG-CD2 4.05Å; F204-L230 HydrophobicContact CZ-CD1 4.35Å; F204-V232 HydrophobicContact CB-CG1 4.46Å; F204-V232 HydrophobicContact CD1-CG1 3.48Å; F204-V232 VanDerWaalsContact CD1-CG1 3.48Å; F204-V232 HydrophobicContact CE1-CG1 4.11Å; F204-V232 HydrophobicContact CG-CG1 4.31Å; F204-V238 HydrophobicContact CE1-CG2 4.2Å; F204-A241 HydrophobicContact CE1-CB 4.2Å; F204-A241 HydrophobicContact CZ-CB 4.01Å
205	S	85.3	Confident	87.9	Confident	36 Å²	36	44.8 Å²	44.8	25%	0.252	24%	0.236	S	C	.	.	H	α-helix	trans	-63	-23.7	-178.8	-59.2	0	0	0	0	114.4	H203 Q209	H203-S205 PolarHBondContact O-N 3.3Å; S205-Q209 PolarHBondContact O-NE2 3.29Å
206	E	85.8	Confident	88	Confident	103 Å²	103	41.8 Å²	41.8	48%	0.481	22%	0.222	S	C	.	.	H	α-helix	trans	-92.8	-43.3	174.7	-62.2	172.7	-104.4	0	0	110.4	P174 H203 F204 V208 Q209	P174-E206 HydrophobicContact CB-CB 3.7Å; P174-E206 HydrophobicContact CG-CB 4.06Å; H203-E206 IonicContact ND1-OE1 2.67Å; H203-E206 PolarHBondContact ND1-OE1 3.27Å; H203-E206 VanDerWaalsContact ND1-OE1 3.12Å; H203-E206 PolarHBondContact O-N 2.76Å; F204-E206 PolarHBondContact O-N 2.78Å; E206-V208 VanDerWaalsContact C-N 3.3Å; E206-V208 PolarHBondContact O-N 3.46Å; E206-Q209 WeakPolarHBondContact O-CB 3.25Å; E206-Q209 PolarHBondContact O-N 3.03Å
207	V	89.9	Confident	88	Confident	0 Å²	0	44.3 Å²	44.3	0%	0	24%	0.24	C	C	.	.	H	α-helix	trans	-56.8	-39.9	-179.7	174.7	0	0	0	0	112.3	P174 C177 L178 H203 F204 Q209 S210	P174-V207 HydrophobicContact CB-CG2 4.07Å; C177-V207 VanDerWaalsContact SG-CG2 3.56Å; L178-V207 HydrophobicContact CD1-CG1 3.58Å; L178-V207 HydrophobicContact CD2-CG1 4.07Å; L178-V207 HydrophobicContact CG-CG1 3.76Å; H203-V207 HydrophobicContact CB-CG2 4.27Å; H203-V207 WeakPolarHBondContact O-CG2 3.43Å; H203-V207 PolarHBondContact O-N 3.47Å; F204-V207 PolarHBondContact O-N 2.77Å; V207-Q209 PolarHBondContact O-N 3.44Å; V207-Q209 VanDerWaalsContact O-N 3.13Å; V207-S210 WeakPolarHBondContact O-CB 3.32Å; V207-S210 PolarHBondContact O-N 2.95Å; V207-S210 PolarHBondContact O-OG 2.82Å
208	V	89.4	Confident	88	Confident	21 Å²	21	44.5 Å²	44.5	13%	0.127	24%	0.242	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68	-9.3	179.4	-62.5	0	0	0	0	114.7	F204 E206 F213 A241	F204-V208 HydrophobicContact CD1-CG1 4.01Å; F204-V208 HydrophobicContact CD2-CG1 4.05Å; F204-V208 HydrophobicContact CE1-CG1 3.63Å; F204-V208 HydrophobicContact CE2-CG1 3.66Å; F204-V208 HydrophobicContact CG-CG1 4.23Å; F204-V208 HydrophobicContact CZ-CG1 3.44Å; F204-V208 VanDerWaalsContact CZ-CG1 3.44Å; F204-V208 WeakPolarHBondContact O-CG1 3.39Å; F204-V208 WeakPolarHBondContact O-CG2 3.49Å; F204-V208 PolarHBondContact O-N 2.8Å; E206-V208 VanDerWaalsContact C-N 3.3Å; E206-V208 PolarHBondContact O-N 3.46Å; V208-F213 HydrophobicContact CB-CD1 4.16Å; V208-F213 HydrophobicContact CB-CE1 4.22Å; V208-F213 HydrophobicContact CB-CG 4.43Å; V208-F213 HydrophobicContact CG1-CD1 4.31Å; V208-F213 HydrophobicContact CG1-CD2 4.17Å; V208-F213 HydrophobicContact CG1-CE1 4.11Å; V208-F213 HydrophobicContact CG1-CE2 3.97Å; V208-F213 HydrophobicContact CG1-CG 4.35Å; V208-F213 HydrophobicContact CG1-CZ 3.94Å; V208-A241 HydrophobicContact CB-CB 3.82Å; V208-A241 HydrophobicContact CG1-CB 3.53Å; V208-A241 HydrophobicContact CG2-CB 4.24Å
209	Q	87.4	Confident	88.1	Confident	161 Å²	161	50.8 Å²	50.8	75%	0.752	27%	0.267	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.9	-11.2	174.4	-53.3	178.2	41	0	0	112.2	S205 E206 V207	S205-Q209 PolarHBondContact O-NE2 3.29Å; E206-Q209 WeakPolarHBondContact O-CB 3.25Å; E206-Q209 PolarHBondContact O-N 3.03Å; V207-Q209 PolarHBondContact O-N 3.44Å; V207-Q209 VanDerWaalsContact O-N 3.13Å
210	S	88	Confident	88.1	Confident	13 Å²	13	51.8 Å²	51.8	9%	0.091	27%	0.272	C	S	.	.	S	Bend	trans	-77.5	151.9	178.6	72.4	0	0	0	0	112.6	V207 E212 F213	V207-S210 WeakPolarHBondContact O-CB 3.32Å; V207-S210 PolarHBondContact O-N 2.95Å; V207-S210 PolarHBondContact O-OG 2.82Å; S210-E212 VanDerWaalsContact C-N 3.28Å; S210-E212 PolarHBondContact O-N 3.11Å; S210-F213 PolarHBondContact O-N 2.95Å; S210-F213 PolarHBondContact OG-N 2.83Å
211	E	85.3	Confident	88.2	Confident	171 Å²	171	51.8 Å²	51.8	80%	0.799	27%	0.272	S	S	*	.	H	α-helix	trans	-67.7	-28.7	171.1	-63.7	-168.4	163.4	0	0	112.2	F213 L214 G215	E211-F213 PolarHBondContact O-N 3.43Å; E211-L214 PolarHBondContact O-N 3.23Å; E211-G215 PolarHBondContact O-N 2.91Å
212	E	87.9	Confident	88.4	Confident	70 Å²	70	53 Å²	53	33%	0.327	28%	0.281	S	S	.	.	H	α-helix	trans	-56.2	-39.5	175	-64.2	-162.6	153	0	0	111.7	N176 L178 G179 S210 L214 G215 L216	N176-E212 WeakPolarHBondContact CA-OE2 3.16Å; L178-E212 HydrophobicContact CB-CB 4.09Å; L178-E212 WeakPolarHBondContact CB-OE2 3.17Å; L178-E212 HydrophobicContact CD1-CB 4.11Å; L178-E212 PolarHBondContact N-OE2 2.94Å; G179-E212 PolarHBondContact N-OE2 3.02Å; S210-E212 VanDerWaalsContact C-N 3.28Å; S210-E212 PolarHBondContact O-N 3.11Å; E212-L214 VanDerWaalsContact C-N 3.34Å; E212-L214 PolarHBondContact O-N 2.89Å; E212-G215 PolarHBondContact O-N 3.02Å; E212-L216 PolarHBondContact O-N 2.87Å
213	F	91.3	Very high	88.6	Confident	0 Å²	0	53.3 Å²	53.3	0%	0	29%	0.289	C	S	.	.	H	α-helix	trans	-62.8	-38.9	177.2	178.6	-102.8	0	0	0	112.4	L178 V208 S210 E211 G215 L216 V221 L224 A241 W245	L178-F213 HydrophobicContact CD1-CB 3.85Å; L178-F213 HydrophobicContact CD1-CD2 4.35Å; V208-F213 HydrophobicContact CB-CD1 4.16Å; V208-F213 HydrophobicContact CB-CE1 4.22Å; V208-F213 HydrophobicContact CB-CG 4.43Å; V208-F213 HydrophobicContact CG1-CD1 4.31Å; V208-F213 HydrophobicContact CG1-CD2 4.17Å; V208-F213 HydrophobicContact CG1-CE1 4.11Å; V208-F213 HydrophobicContact CG1-CE2 3.97Å; V208-F213 HydrophobicContact CG1-CG 4.35Å; V208-F213 HydrophobicContact CG1-CZ 3.94Å; S210-F213 PolarHBondContact O-N 2.95Å; S210-F213 PolarHBondContact OG-N 2.83Å; E211-F213 PolarHBondContact O-N 3.43Å; F213-G215 VanDerWaalsContact C-N 3.27Å; F213-G215 PolarHBondContact O-N 3.42Å; F213-L216 HydrophobicContact CD2-CD1 3.76Å; F213-L216 HydrophobicContact CE2-CD1 4.23Å; F213-L216 WeakPolarHBondContact O-CB 3.33Å; F213-L216 WeakPolarHBondContact O-CG 3.32Å; F213-L216 PolarHBondContact O-N 2.87Å; F213-V221 HydrophobicContact CE2-CG1 4.49Å; F213-V221 HydrophobicContact CE2-CG2 4.46Å; F213-V221 HydrophobicContact CZ-CG1 4.28Å; F213-L224 HydrophobicContact CE2-CD2 4.28Å; F213-A241 HydrophobicContact CE1-CB 4.15Å; F213-A241 WeakPolarHBondContact CE1-O 3.36Å; F213-A241 HydrophobicContact CZ-CB 4.1Å; F213-W245 HydrophobicContact CE1-CB 4.01Å; F213-W245 HydrophobicContact CZ-CB 4.49Å
214	L	88.7	Confident	88.8	Confident	34 Å²	34	51.4 Å²	51.4	18%	0.178	28%	0.28	C	S	.	.	H	α-helix	trans	-69.4	-26.5	179.2	-58.1	176.6	0	0	0	112.3	E211 E212 Y248 R253	E211-L214 PolarHBondContact O-N 3.23Å; E212-L214 VanDerWaalsContact C-N 3.34Å; E212-L214 PolarHBondContact O-N 2.89Å; L214-Y248 HydrophobicContact CB-CD1 4.26Å; L214-Y248 HydrophobicContact CB-CD2 3.95Å; L214-Y248 HydrophobicContact CB-CE1 4.46Å; L214-Y248 HydrophobicContact CB-CE2 4.15Å; L214-Y248 HydrophobicContact CB-CG 3.99Å; L214-Y248 HydrophobicContact CD1-CD2 3.72Å; L214-Y248 HydrophobicContact CD1-CE2 4.07Å; L214-Y248 HydrophobicContact CD1-CG 4.41Å; L214-Y248 HydrophobicContact CG-CD2 4.32Å; L214-R253 PolarHBondContact O-NH1 3.23Å; L214-R253 PolarHBondContact O-NH2 3.33Å
215	G	87.8	Confident	88.9	Confident	58 Å²	58	51.4 Å²	51.4	60%	0.598	28%	0.28	S	S	*	.	H	α-helix	trans	-77.2	-13.1	174.3	0	0	0	0	0	115.4	E211 E212 F213	E211-G215 PolarHBondContact O-N 2.91Å; E212-G215 PolarHBondContact O-N 3.02Å; F213-G215 VanDerWaalsContact C-N 3.27Å; F213-G215 PolarHBondContact O-N 3.42Å
216	L	89.8	Confident	89.2	Confident	15 Å²	15	51.9 Å²	51.9	8%	0.079	28%	0.284	C	S	.	.			trans	-63	148.3	-177.6	-67.8	-178.8	0	0	0	113.3	L178 E212 F213 Q220 V221 W245	L178-L216 HydrophobicContact CD1-CD1 3.93Å; L178-L216 HydrophobicContact CD1-CD2 4.44Å; L178-L216 HydrophobicContact CD1-CG 4.27Å; L178-L216 HydrophobicContact CD2-CD1 4.26Å; E212-L216 PolarHBondContact O-N 2.87Å; F213-L216 HydrophobicContact CD2-CD1 3.76Å; F213-L216 HydrophobicContact CE2-CD1 4.23Å; F213-L216 WeakPolarHBondContact O-CB 3.33Å; F213-L216 WeakPolarHBondContact O-CG 3.32Å; F213-L216 PolarHBondContact O-N 2.87Å; L216-Q220 HydrophobicContact CB-CB 4.24Å; L216-Q220 HydrophobicContact CD1-CB 4.49Å; L216-Q220 HydrophobicContact CD2-CB 4.16Å; L216-V221 HydrophobicContact CB-CG2 3.61Å; L216-V221 HydrophobicContact CD1-CG2 4.08Å; L216-W245 WeakPolarHBondContact O-CZ2 3.46Å; L216-W245 PolarHBondContact O-NE1 3.49Å
217	S	90.4	Very high	89.2	Confident	53 Å²	53	47.6 Å²	47.6	37%	0.371	27%	0.265	S	S	.	.			trans	-74.2	160.9	170.4	69.3	0	0	0	0	112.7	Q219 Q220 V221	S217-Q219 VanDerWaalsContact C-N 3.27Å; S217-Q219 PolarHBondContact O-N 3.07Å; S217-Q220 PolarHBondContact O-N 2.83Å; S217-Q220 VanDerWaalsContact O-N 3.11Å; S217-Q220 VanDerWaalsContact OG-CD 3.28Å; S217-Q220 WeakPolarHBondContact OG-CG 3.4Å; S217-Q220 PolarHBondContact OG-N 3.03Å; S217-Q220 PolarHBondContact OG-OE1 2.99Å; S217-V221 PolarHBondContact O-N 2.83Å
218	L	89.6	Confident	88.8	Confident	37 Å²	37	51.4 Å²	51.4	19%	0.194	29%	0.286	C	S	.	.	H	α-helix	trans	-51	-44.6	177.1	176.7	63.5	0	0	0	113.2	V221 S222 W245 F256 L260	L218-V221 PolarHBondContact O-N 3.18Å; L218-S222 WeakPolarHBondContact O-CB 3.21Å; L218-S222 PolarHBondContact O-N 3.34Å; L218-W245 HydrophobicContact CB-CH2 4.32Å; L218-W245 HydrophobicContact CD1-CH2 4.33Å; L218-F256 HydrophobicContact CD1-CB 3.62Å; L218-F256 HydrophobicContact CD1-CD1 4.46Å; L218-F256 HydrophobicContact CD1-CD2 4.27Å; L218-F256 HydrophobicContact CD1-CG 3.87Å; L218-F256 HydrophobicContact CD2-CB 4.18Å; L218-F256 HydrophobicContact CD2-CD1 3.42Å; L218-F256 VanDerWaalsContact CD2-CD1 3.42Å; L218-F256 HydrophobicContact CD2-CD2 4.15Å; L218-F256 HydrophobicContact CD2-CE1 3.77Å; L218-F256 HydrophobicContact CD2-CE2 4.45Å; L218-F256 HydrophobicContact CD2-CG 3.64Å; L218-F256 HydrophobicContact CD2-CZ 4.28Å; L218-F256 HydrophobicContact CG-CG 4.27Å; L218-L260 HydrophobicContact CD1-CD1 4.18Å; L218-L260 HydrophobicContact CD1-CD2 3.91Å; L218-L260 HydrophobicContact CD1-CG 3.97Å
219	Q	89.4	Confident	88.4	Confident	162 Å²	162	55.9 Å²	55.9	76%	0.757	30%	0.3	S	S	*	.	H	α-helix	trans	-65.9	-40.9	-178.4	-70.6	-179.9	-16.3	0	0	111.4	S217 S223	S217-Q219 VanDerWaalsContact C-N 3.27Å; S217-Q219 PolarHBondContact O-N 3.07Å; Q219-S223 WeakPolarHBondContact O-CB 3.41Å; Q219-S223 PolarHBondContact O-N 2.65Å
220	Q	89.4	Confident	88.2	Confident	58 Å²	58	48.3 Å²	48.3	27%	0.271	27%	0.265	S	S	.	.	H	α-helix	trans	-67.3	-40.6	178.6	-70.9	162.2	-43.8	0	0	112	L216 S217 L224	L216-Q220 HydrophobicContact CB-CB 4.24Å; L216-Q220 HydrophobicContact CD1-CB 4.49Å; L216-Q220 HydrophobicContact CD2-CB 4.16Å; S217-Q220 PolarHBondContact O-N 2.83Å; S217-Q220 VanDerWaalsContact O-N 3.11Å; S217-Q220 VanDerWaalsContact OG-CD 3.28Å; S217-Q220 WeakPolarHBondContact OG-CG 3.4Å; S217-Q220 PolarHBondContact OG-N 3.03Å; S217-Q220 PolarHBondContact OG-OE1 2.99Å; Q220-L224 WeakPolarHBondContact O-CB 3.34Å; Q220-L224 PolarHBondContact O-N 2.79Å; Q220-L224 VanDerWaalsContact O-N 3.15Å
221	V	91.7	Very high	87.6	Confident	0 Å²	0	50.1 Å²	50.1	0%	0	28%	0.275	C	S	.	.	H	α-helix	trans	-68.8	-50	175.8	-179.8	0	0	0	0	111	F213 L216 S217 L218 S223 L224 I225 W245 L260	F213-V221 HydrophobicContact CE2-CG1 4.49Å; F213-V221 HydrophobicContact CE2-CG2 4.46Å; F213-V221 HydrophobicContact CZ-CG1 4.28Å; L216-V221 HydrophobicContact CB-CG2 3.61Å; L216-V221 HydrophobicContact CD1-CG2 4.08Å; S217-V221 PolarHBondContact O-N 2.83Å; L218-V221 PolarHBondContact O-N 3.18Å; V221-S223 VanDerWaalsContact C-N 3.32Å; V221-S223 PolarHBondContact O-N 2.58Å; V221-L224 PolarHBondContact O-N 2.88Å; V221-I225 HydrophobicContact CG1-CG2 4.19Å; V221-I225 WeakPolarHBondContact O-CG1 3.19Å; V221-I225 PolarHBondContact O-N 2.86Å; V221-W245 HydrophobicContact CG2-CD2 4.17Å; V221-W245 HydrophobicContact CG2-CG 4.16Å; V221-W245 HydrophobicContact CG2-CZ2 4.37Å; V221-L260 HydrophobicContact CB-CD2 4.38Å; V221-L260 HydrophobicContact CG1-CD2 3.93Å
222	S	91.1	Very high	87.2	Confident	32 Å²	32	43.5 Å²	43.5	22%	0.224	25%	0.247	C	C	.	.	H	α-helix	trans	-55.5	-45.4	176.5	164.9	0	0	0	0	111.6	L218 L224 S226 H263	L218-S222 WeakPolarHBondContact O-CB 3.21Å; L218-S222 PolarHBondContact O-N 3.34Å; S222-L224 VanDerWaalsContact C-N 3.27Å; S222-L224 PolarHBondContact O-N 3.33Å; S222-S226 WeakPolarHBondContact O-CB 3.31Å; S222-S226 PolarHBondContact O-N 2.66Å; S222-S226 PolarHBondContact O-OG 3.45Å; S222-H263 PolarHBondContact OG-NE2 3.18Å
223	S	88.8	Confident	86.3	Confident	55 Å²	55	45 Å²	45	39%	0.385	27%	0.265	S	S	.	.	H	α-helix	trans	-62	-30.7	175	-177.2	0	0	0	0	113.5	Q219 V221 S226	Q219-S223 WeakPolarHBondContact O-CB 3.41Å; Q219-S223 PolarHBondContact O-N 2.65Å; V221-S223 VanDerWaalsContact C-N 3.32Å; V221-S223 PolarHBondContact O-N 2.58Å; S223-S226 PolarHBondContact O-OG 3.18Å
224	L	89.5	Confident	85.6	Confident	0 Å²	0	47.7 Å²	47.7	0%	0	28%	0.282	C	S	.	.	H	α-helix	trans	-80	-52.7	178	-170.1	62.3	0	0	0	110.6	E201 F204 F213 Q220 V221 S222 S226 S227 L230	E201-L224 HydrophobicContact CG-CD1 4.13Å; F204-L224 HydrophobicContact CD2-CD1 4.46Å; F204-L224 HydrophobicContact CD2-CD2 3.85Å; F204-L224 HydrophobicContact CD2-CG 3.92Å; F204-L224 HydrophobicContact CE2-CD2 3.72Å; F204-L224 HydrophobicContact CE2-CG 3.81Å; F213-L224 HydrophobicContact CE2-CD2 4.28Å; Q220-L224 WeakPolarHBondContact O-CB 3.34Å; Q220-L224 PolarHBondContact O-N 2.79Å; Q220-L224 VanDerWaalsContact O-N 3.15Å; V221-L224 PolarHBondContact O-N 2.88Å; S222-L224 VanDerWaalsContact C-N 3.27Å; S222-L224 PolarHBondContact O-N 3.33Å; L224-S226 VanDerWaalsContact C-N 3.3Å; L224-S226 PolarHBondContact O-N 3.44Å; L224-S227 WeakPolarHBondContact O-CB 3.24Å; L224-S227 PolarHBondContact O-N 3.07Å; L224-L230 HydrophobicContact CD1-CD2 3.99Å; L224-L230 HydrophobicContact CG-CD2 4.25Å; L224-L230 WeakPolarHBondContact O-CD1 3.4Å; L224-L230 WeakPolarHBondContact O-CD2 3.12Å
225	I	91.3	Very high	85.4	Confident	0 Å²	0	46.9 Å²	46.9	0%	0	28%	0.277	C	S	.	.	H	α-helix	trans	-68.9	-23.5	-176.7	69.2	169.8	0	0	0	114	F204 V221 S227 V238 L260 H263 R319	F204-I225 HydrophobicContact CE2-CG2 4.37Å; F204-I225 HydrophobicContact CZ-CG2 4.14Å; V221-I225 HydrophobicContact CG1-CG2 4.19Å; V221-I225 WeakPolarHBondContact O-CG1 3.19Å; V221-I225 PolarHBondContact O-N 2.86Å; I225-S227 VanDerWaalsContact C-N 3.33Å; I225-V238 HydrophobicContact CB-CG1 4.01Å; I225-V238 HydrophobicContact CG2-CG1 4.11Å; I225-L260 HydrophobicContact CD1-CB 3.99Å; I225-L260 HydrophobicContact CD1-CD2 3.67Å; I225-L260 HydrophobicContact CD1-CG 4.45Å; I225-L260 WeakPolarHBondContact CD1-O 3.46Å; I225-L260 HydrophobicContact CG1-CD2 4.5Å; I225-H263 HydrophobicContact CD1-CB 3.93Å; I225-H263 HydrophobicContact CG1-CB 3.81Å; I225-R319 PolarHBondContact O-NH1 3.06Å; I225-R319 PolarHBondContact O-NH2 2.67Å
226	S	90.3	Very high	85.4	Confident	46 Å²	46	45.9 Å²	45.9	32%	0.322	26%	0.257	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.6	-22.4	175.2	55.1	0	0	0	0	113.4	S222 S223 L224 D228	S222-S226 WeakPolarHBondContact O-CB 3.31Å; S222-S226 PolarHBondContact O-N 2.66Å; S222-S226 PolarHBondContact O-OG 3.45Å; S223-S226 PolarHBondContact O-OG 3.18Å; L224-S226 VanDerWaalsContact C-N 3.3Å; L224-S226 PolarHBondContact O-N 3.44Å; S226-D228 PolarHBondContact O-N 2.96Å
227	S	86.8	Confident	85.2	Confident	14 Å²	14	48.9 Å²	48.9	10%	0.098	27%	0.269	C	S	.	.			trans	-63.9	126.2	-172.8	-174.2	0	0	0	0	113.2	E201 L224 I225 R229 R319	E201-S227 WeakPolarHBondContact OE1-CB 3.45Å; E201-S227 PolarHBondContact OE1-OG 3.21Å; L224-S227 WeakPolarHBondContact O-CB 3.24Å; L224-S227 PolarHBondContact O-N 3.07Å; I225-S227 VanDerWaalsContact C-N 3.33Å; S227-R229 PolarHBondContact O-N 3.17Å; S227-R229 PolarHBondContact OG-N 3Å; S227-R229 VanDerWaalsContact OG-N 3.16Å; S227-R319 PolarHBondContact O-NH1 2.9Å
228	D	81.2	Confident	85.1	Confident	80 Å²	80	46.4 Å²	46.4	43%	0.428	25%	0.251	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60	-19.7	168.4	-79.4	-57.6	0	0	0	112.9	S226 R265 T320	S226-D228 PolarHBondContact O-N 2.96Å; D228-R265 IonicContact OD1-CZ 3.79Å; D228-R265 IonicContact OD1-NH1 3.69Å; D228-R265 PolarHBondContact OD1-NH1 3.45Å; D228-R265 IonicContact OD1-NH2 2.77Å; D228-R265 PolarHBondContact OD1-NH2 2.85Å; D228-T320 CarbonylContact O-C 3.45Å; D228-T320 PolarHBondContact O-N 2.69Å; D228-T320 VanDerWaalsContact O-O 3.06Å
229	R	80.7	Confident	85.2	Confident	115 Å²	115	44.8 Å²	44.8	43%	0.434	24%	0.243	S	C	.	.	T	Hydrogen-bonded Turn	trans	-86.3	-1.9	-172.4	-59	-174.1	-57.9	-100.9	-7.9	114.8	E201 S227 T231 P321 V322	E201-R229 VanDerWaalsContact CD-NH2 3.35Å; E201-R229 IonicContact OE1-CZ 2.68Å; E201-R229 IonicContact OE1-NE 3.11Å; E201-R229 PolarHBondContact OE1-NE 2.76Å; E201-R229 IonicContact OE1-NH2 3.4Å; E201-R229 PolarHBondContact OE1-NH2 3.35Å; E201-R229 IonicContact OE2-CZ 3.43Å; E201-R229 IonicContact OE2-NE 3.39Å; E201-R229 PolarHBondContact OE2-NE 2.69Å; E201-R229 IonicContact OE2-NH2 2.75Å; E201-R229 PolarHBondContact OE2-NH2 3.2Å; E201-R229 VanDerWaalsContact OE2-NH2 3.11Å; S227-R229 PolarHBondContact O-N 3.17Å; S227-R229 PolarHBondContact OG-N 3Å; S227-R229 VanDerWaalsContact OG-N 3.16Å; R229-T231 PolarHBondContact O-N 3.26Å; R229-P321 WeakPolarHBondContact O-CA 3.41Å; R229-V322 HydrophobicContact CB-CG2 4.21Å; R229-V322 HydrophobicContact CG-CG2 3.87Å
230	L	82.7	Confident	85.2	Confident	1 Å²	1	40.5 Å²	40.5	1%	0.005	22%	0.223	C	C	.	.			trans	-63	128.4	-179.8	-62.6	179.6	0	0	0	112.2	E201 F204 L224 V232 V238	E201-L230 HydrophobicContact CB-CD2 4.13Å; E201-L230 HydrophobicContact CG-CD2 4.04Å; E201-L230 WeakPolarHBondContact O-CA 3.42Å; F204-L230 HydrophobicContact CB-CD2 4.22Å; F204-L230 HydrophobicContact CD2-CD1 4.27Å; F204-L230 HydrophobicContact CD2-CD2 3.71Å; F204-L230 HydrophobicContact CE2-CD1 4.22Å; F204-L230 HydrophobicContact CE2-CD2 4.3Å; F204-L230 HydrophobicContact CG-CD1 4.46Å; F204-L230 HydrophobicContact CG-CD2 4.05Å; F204-L230 HydrophobicContact CZ-CD1 4.35Å; L224-L230 HydrophobicContact CD1-CD2 3.99Å; L224-L230 HydrophobicContact CG-CD2 4.25Å; L224-L230 WeakPolarHBondContact O-CD1 3.4Å; L224-L230 WeakPolarHBondContact O-CD2 3.12Å; L230-V232 PolarHBondContact O-N 3.38Å; L230-V238 HydrophobicContact CD1-CG2 4.47Å
231	T	76.8	Confident	85.2	Confident	51 Å²	51	37.9 Å²	37.9	31%	0.313	21%	0.211	S	C	.	.			trans	-88	97.8	171.7	-58.1	0	0	0	0	109.4	E201 Q202 R229	E201-T231 PolarHBondContact O-N 2.8Å; Q202-T231 WeakPolarHBondContact O-CB 3.43Å; R229-T231 PolarHBondContact O-N 3.26Å
232	V	76.7	Confident	85.3	Confident	33 Å²	33	37.9 Å²	37.9	20%	0.2	21%	0.211	C	C	.	.			trans	-128.2	142.4	175.9	-70.2	0	0	0	0	110.5	F204 L230 V238	F204-V232 HydrophobicContact CB-CG1 4.46Å; F204-V232 HydrophobicContact CD1-CG1 3.48Å; F204-V232 VanDerWaalsContact CD1-CG1 3.48Å; F204-V232 HydrophobicContact CE1-CG1 4.11Å; F204-V232 HydrophobicContact CG-CG1 4.31Å; L230-V232 PolarHBondContact O-N 3.38Å; V232-V238 HydrophobicContact CB-CG2 4.5Å; V232-V238 HydrophobicContact CG1-CG2 4.02Å; V232-V238 HydrophobicContact CG2-CG2 4.08Å
233	S	68.4	Low	85.3	Confident	102 Å²	102	37 Å²	37	71%	0.713	20%	0.203	S	C	*	.	S	Bend	trans	-73.1	-38.8	177.8	51.4	0	0	0	0	112.5
234	T	75.8	Confident	85.4	Confident	56 Å²	56	36.6 Å²	36.6	34%	0.344	20%	0.201	S	C	.	.			trans	-140	149.9	171	60.4	0	0	0	0	109.8	E236 K237	T234-E236 PolarHBondContact O-N 2.68Å; T234-E236 WeakPolarHBondContact OG1-CB 3.4Å; T234-E236 PolarHBondContact OG1-OE2 2.99Å; T234-K237 WeakPolarHBondContact O-CB 3.48Å; T234-K237 PolarHBondContact O-N 3.32Å; T234-K237 VanDerWaalsContact O-N 3.08Å
235	E	85.8	Confident	85.6	Confident	17 Å²	17	36.8 Å²	36.8	8%	0.079	20%	0.202	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66.2	-16.4	175.3	-173.6	72.7	-170.4	0	0	112	K237 V238 F239 V264 R265 L269 R319	E235-K237 PolarHBondContact O-N 2.89Å; E235-V238 WeakPolarHBondContact O-CB 3.28Å; E235-V238 PolarHBondContact O-N 2.88Å; E235-F239 PolarHBondContact O-N 2.89Å; E235-F239 VanDerWaalsContact O-N 3.09Å; E235-V264 HydrophobicContact CG-CG1 4.32Å; E235-R265 HydrophobicContact CG-CB 3.82Å; E235-R265 WeakPolarHBondContact OE1-CG 3.46Å; E235-R265 PolarHBondContact OE1-N 2.75Å; E235-L269 HydrophobicContact CB-CD1 3.56Å; E235-L269 HydrophobicContact CG-CD1 3.52Å; E235-R319 IonicContact OE1-CZ 3.53Å; E235-R319 IonicContact OE1-NE 2.59Å; E235-R319 IonicContact OE1-NH2 2.78Å; E235-R319 PolarHBondContact OE1-NH2 3.31Å; E235-R319 IonicContact OE2-CZ 2.8Å; E235-R319 IonicContact OE2-NE 2.98Å; E235-R319 PolarHBondContact OE2-NE 3.38Å; E235-R319 IonicContact OE2-NH2 3.21Å; E235-R319 PolarHBondContact OE2-NH2 3.28Å
236	E	86.6	Confident	85.5	Confident	37 Å²	37	36.8 Å²	36.8	17%	0.173	20%	0.202	C	C	.	.	H	α-helix	trans	-52.6	-34.7	168.3	-56.8	167.5	165.2	0	0	111.3	T234 V238 F239 E240 L269 S270 Y273	T234-E236 PolarHBondContact O-N 2.68Å; T234-E236 WeakPolarHBondContact OG1-CB 3.4Å; T234-E236 PolarHBondContact OG1-OE2 2.99Å; E236-V238 PolarHBondContact O-N 3.23Å; E236-F239 WeakPolarHBondContact O-CB 3.38Å; E236-F239 PolarHBondContact O-N 2.81Å; E236-E240 WeakPolarHBondContact O-CB 3.16Å; E236-E240 VanDerWaalsContact O-CG 3.32Å; E236-E240 WeakPolarHBondContact O-CG 3.39Å; E236-E240 PolarHBondContact O-N 3.12Å; E236-L269 HydrophobicContact CG-CD2 4.38Å; E236-L269 HydrophobicContact CG-CG 3.92Å; E236-S270 PolarHBondContact OE1-OG 2.81Å; E236-S270 VanDerWaalsContact OE1-OG 3.07Å; E236-Y273 HydrophobicContact CB-CD2 4.19Å; E236-Y273 HydrophobicContact CB-CE1 4.25Å; E236-Y273 HydrophobicContact CB-CE2 3.74Å; E236-Y273 HydrophobicContact CG-CD1 4.08Å; E236-Y273 HydrophobicContact CG-CD2 3.69Å; E236-Y273 HydrophobicContact CG-CE1 4.19Å; E236-Y273 HydrophobicContact CG-CE2 3.8Å; E236-Y273 HydrophobicContact CG-CG 3.84Å; E236-Y273 WeakPolarHBondContact OE1-CB 3.4Å; E236-Y273 WeakPolarHBondContact OE1-CD2 3.28Å
237	K	85.4	Confident	85.5	Confident	78 Å²	78	39.4 Å²	39.4	34%	0.339	21%	0.207	S	C	.	.	H	α-helix	trans	-68	-33.3	175.6	-65.7	-69.7	152.1	-153.4	0	113.5	T234 E235 E240 A241	T234-K237 WeakPolarHBondContact O-CB 3.48Å; T234-K237 PolarHBondContact O-N 3.32Å; T234-K237 VanDerWaalsContact O-N 3.08Å; E235-K237 PolarHBondContact O-N 2.89Å; K237-E240 IonicContact NZ-OE1 2.65Å; K237-E240 IonicContact NZ-OE2 2.89Å; K237-E240 PolarHBondContact NZ-OE2 2.76Å; K237-A241 WeakPolarHBondContact O-CB 3.37Å; K237-A241 PolarHBondContact O-N 3.33Å
238	V	89.9	Confident	85.7	Confident	0 Å²	0	46 Å²	46	0%	0	23%	0.231	C	C	.	.	H	α-helix	trans	-71.1	-39.3	174.9	-170.9	0	0	0	0	110	F204 I225 L230 V232 E235 E236 A241 M242 V264	F204-V238 HydrophobicContact CE1-CG2 4.2Å; I225-V238 HydrophobicContact CB-CG1 4.01Å; I225-V238 HydrophobicContact CG2-CG1 4.11Å; L230-V238 HydrophobicContact CD1-CG2 4.47Å; V232-V238 HydrophobicContact CB-CG2 4.5Å; V232-V238 HydrophobicContact CG1-CG2 4.02Å; V232-V238 HydrophobicContact CG2-CG2 4.08Å; E235-V238 WeakPolarHBondContact O-CB 3.28Å; E235-V238 PolarHBondContact O-N 2.88Å; E236-V238 PolarHBondContact O-N 3.23Å; V238-A241 PolarHBondContact O-N 3.48Å; V238-M242 PolarHBondContact O-N 2.82Å; V238-V264 HydrophobicContact CG1-CG2 4.32Å
239	F	90.4	Very high	86.1	Confident	3 Å²	3	44.7 Å²	44.7	1%	0.013	22%	0.224	C	C	.	.	H	α-helix	trans	-62.3	-47.7	173.1	-178.8	-97.4	0	0	0	112.1	E235 E236 A241 M242 I243 V264 L266 Y273 I277 V278 I284	E235-F239 PolarHBondContact O-N 2.89Å; E235-F239 VanDerWaalsContact O-N 3.09Å; E236-F239 WeakPolarHBondContact O-CB 3.38Å; E236-F239 PolarHBondContact O-N 2.81Å; F239-A241 VanDerWaalsContact C-N 3.35Å; F239-A241 PolarHBondContact O-N 2.98Å; F239-M242 HydrophobicContact CD2-CE 3.63Å; F239-M242 HydrophobicContact CE2-CE 3.71Å; F239-M242 PolarHBondContact O-N 3Å; F239-I243 HydrophobicContact CD1-CG1 4.21Å; F239-I243 HydrophobicContact CE1-CD1 4.48Å; F239-I243 HydrophobicContact CE1-CG1 3.79Å; F239-I243 HydrophobicContact CE2-CD1 4.43Å; F239-I243 HydrophobicContact CE2-CG1 4.24Å; F239-I243 HydrophobicContact CZ-CD1 4.04Å; F239-I243 HydrophobicContact CZ-CG1 3.8Å; F239-I243 VanDerWaalsContact O-CG1 3.32Å; F239-I243 WeakPolarHBondContact O-CG1 3.34Å; F239-I243 PolarHBondContact O-N 3.15Å; F239-V264 HydrophobicContact CB-CG1 4.06Å; F239-V264 HydrophobicContact CD2-CG1 4.36Å; F239-L266 HydrophobicContact CD2-CD2 4.1Å; F239-Y273 AromaticContact CD1-CE1 3.92Å; F239-Y273 HydrophobicContact CD1-CE1 3.92Å; F239-Y273 HydrophobicContact CE1-CE1 4.36Å; F239-I277 HydrophobicContact CE1-CG2 4.39Å; F239-V278 HydrophobicContact CD1-CG2 4.32Å; F239-V278 HydrophobicContact CD2-CG2 4.47Å; F239-V278 HydrophobicContact CE1-CG2 3.95Å; F239-V278 HydrophobicContact CE2-CG1 3.88Å; F239-V278 HydrophobicContact CE2-CG2 4.11Å; F239-V278 HydrophobicContact CZ-CB 4.19Å; F239-V278 HydrophobicContact CZ-CG1 3.95Å; F239-V278 HydrophobicContact CZ-CG2 3.84Å; F239-I284 HydrophobicContact CE2-CD1 3.67Å; F239-I284 HydrophobicContact CZ-CD1 3.62Å
240	E	90	Very high	86.3	Confident	73 Å²	73	44.8 Å²	44.8	34%	0.341	23%	0.228	S	C	.	.	H	α-helix	trans	-60	-42.3	177.1	-75.4	165.9	-166.5	0	0	112.3	E236 K237 I243 S244 Y273	E236-E240 WeakPolarHBondContact O-CB 3.16Å; E236-E240 VanDerWaalsContact O-CG 3.32Å; E236-E240 WeakPolarHBondContact O-CG 3.39Å; E236-E240 PolarHBondContact O-N 3.12Å; K237-E240 IonicContact NZ-OE1 2.65Å; K237-E240 IonicContact NZ-OE2 2.89Å; K237-E240 PolarHBondContact NZ-OE2 2.76Å; E240-I243 PolarHBondContact O-N 2.87Å; E240-S244 PolarHBondContact O-N 2.93Å; E240-S244 PolarHBondContact O-OG 3.08Å; E240-Y273 VanDerWaalsContact CG-OH 3.26Å; E240-Y273 WeakPolarHBondContact CG-OH 3.17Å; E240-Y273 PolarHBondContact OE1-OH 2.93Å
241	A	90.4	Very high	86.4	Confident	3 Å²	3	50.3 Å²	50.3	3%	0.025	26%	0.263	C	S	.	.	H	α-helix	trans	-64.8	-40.2	176.6	0	0	0	0	0	113.1	F204 V208 F213 K237 V238 F239 I243 S244 W245	F204-A241 HydrophobicContact CE1-CB 4.2Å; F204-A241 HydrophobicContact CZ-CB 4.01Å; V208-A241 HydrophobicContact CB-CB 3.82Å; V208-A241 HydrophobicContact CG1-CB 3.53Å; V208-A241 HydrophobicContact CG2-CB 4.24Å; F213-A241 HydrophobicContact CE1-CB 4.15Å; F213-A241 WeakPolarHBondContact CE1-O 3.36Å; F213-A241 HydrophobicContact CZ-CB 4.1Å; K237-A241 WeakPolarHBondContact O-CB 3.37Å; K237-A241 PolarHBondContact O-N 3.33Å; V238-A241 PolarHBondContact O-N 3.48Å; F239-A241 VanDerWaalsContact C-N 3.35Å; F239-A241 PolarHBondContact O-N 2.98Å; A241-I243 VanDerWaalsContact C-N 3.35Å; A241-S244 PolarHBondContact O-OG 3.16Å; A241-W245 WeakPolarHBondContact O-CB 3.43Å; A241-W245 PolarHBondContact O-N 3.17Å; A241-W245 VanDerWaalsContact O-N 3.13Å
242	M	92.9	Very high	86.9	Confident	0 Å²	0	51.4 Å²	51.4	0%	0	27%	0.27	C	S	.	.	H	α-helix	trans	-60.8	-46.2	171.9	174.2	-170.7	67.2	0	0	110.8	V238 F239 W245 I246 M257 L260 M261 V264	V238-M242 PolarHBondContact O-N 2.82Å; F239-M242 HydrophobicContact CD2-CE 3.63Å; F239-M242 HydrophobicContact CE2-CE 3.71Å; F239-M242 PolarHBondContact O-N 3Å; M242-W245 PolarHBondContact O-N 3.11Å; M242-I246 HydrophobicContact CG-CD1 3.9Å; M242-I246 VanDerWaalsContact O-CG1 3.32Å; M242-I246 WeakPolarHBondContact O-CG1 3.45Å; M242-I246 PolarHBondContact O-N 2.79Å; M242-I246 VanDerWaalsContact O-N 3.07Å; M242-M257 HydrophobicContact CE-CE 3.48Å; M242-M257 VanDerWaalsContact CE-CE 3.48Å; M242-M257 HydrophobicContact CE-SD 4.39Å; M242-M257 HydrophobicContact SD-CE 4.12Å; M242-L260 HydrophobicContact CG-CB 3.82Å; M242-L260 HydrophobicContact CG-CD1 4.36Å; M242-L260 HydrophobicContact SD-CB 3.76Å; M242-M261 HydrophobicContact CE-CB 4.49Å; M242-M261 HydrophobicContact SD-CB 4.02Å; M242-V264 HydrophobicContact CE-CG2 4.26Å; M242-V264 HydrophobicContact SD-CG2 3.89Å
243	I	90.9	Very high	87.5	Confident	12 Å²	12	51.1 Å²	51.1	6%	0.062	27%	0.265	C	S	.	.	H	α-helix	trans	-67.4	-38.5	-177.9	-68.9	-67	0	0	0	111.9	F239 E240 A241 K247 M257 E281 L283	F239-I243 HydrophobicContact CD1-CG1 4.21Å; F239-I243 HydrophobicContact CE1-CD1 4.48Å; F239-I243 HydrophobicContact CE1-CG1 3.79Å; F239-I243 HydrophobicContact CE2-CD1 4.43Å; F239-I243 HydrophobicContact CE2-CG1 4.24Å; F239-I243 HydrophobicContact CZ-CD1 4.04Å; F239-I243 HydrophobicContact CZ-CG1 3.8Å; F239-I243 VanDerWaalsContact O-CG1 3.32Å; F239-I243 WeakPolarHBondContact O-CG1 3.34Å; F239-I243 PolarHBondContact O-N 3.15Å; E240-I243 PolarHBondContact O-N 2.87Å; A241-I243 VanDerWaalsContact C-N 3.35Å; I243-K247 HydrophobicContact CG2-CD 3.69Å; I243-K247 VanDerWaalsContact CG2-CE 3.45Å; I243-K247 HydrophobicContact CG2-CG 4.36Å; I243-K247 VanDerWaalsContact CG2-NZ 3.3Å; I243-K247 VanDerWaalsContact O-CB 3.32Å; I243-K247 WeakPolarHBondContact O-CB 3.29Å; I243-K247 VanDerWaalsContact O-CG 3.28Å; I243-K247 WeakPolarHBondContact O-CG 3.34Å; I243-K247 PolarHBondContact O-N 3.03Å; I243-M257 HydrophobicContact CD1-CE 4.12Å; I243-M257 HydrophobicContact CD1-SD 4.36Å; I243-E281 HydrophobicContact CD1-CG 4.06Å; I243-L283 HydrophobicContact CD1-CD1 4.07Å
244	S	90.9	Very high	88.3	Confident	47 Å²	47	50.3 Å²	50.3	33%	0.329	25%	0.253	S	S	.	.	H	α-helix	trans	-65.6	-45.1	176	66.7	0	0	0	0	111.7	E240 A241 I246 K247 Y248	E240-S244 PolarHBondContact O-N 2.93Å; E240-S244 PolarHBondContact O-OG 3.08Å; A241-S244 PolarHBondContact O-OG 3.16Å; S244-I246 VanDerWaalsContact C-N 3.35Å; S244-I246 PolarHBondContact O-N 2.83Å; S244-K247 PolarHBondContact O-N 2.72Å; S244-Y248 PolarHBondContact O-N 3.5Å; S244-Y248 VanDerWaalsContact O-N 3.11Å
245	W	93.6	Very high	88.9	Confident	5 Å²	5	54.5 Å²	54.5	2%	0.019	27%	0.268	C	S	.	.	H	α-helix	trans	-61.3	-40.2	177.1	-174.9	88.3	0	0	0	112.5	F213 L216 L218 V221 A241 M242 R253 F256 L260	F213-W245 HydrophobicContact CE1-CB 4.01Å; F213-W245 HydrophobicContact CZ-CB 4.49Å; L216-W245 WeakPolarHBondContact O-CZ2 3.46Å; L216-W245 PolarHBondContact O-NE1 3.49Å; L218-W245 HydrophobicContact CB-CH2 4.32Å; L218-W245 HydrophobicContact CD1-CH2 4.33Å; V221-W245 HydrophobicContact CG2-CD2 4.17Å; V221-W245 HydrophobicContact CG2-CG 4.16Å; V221-W245 HydrophobicContact CG2-CZ2 4.37Å; A241-W245 WeakPolarHBondContact O-CB 3.43Å; A241-W245 PolarHBondContact O-N 3.17Å; A241-W245 VanDerWaalsContact O-N 3.13Å; M242-W245 PolarHBondContact O-N 3.11Å; W245-R253 HydrophobicContact CE3-CB 4.41Å; W245-R253 HydrophobicContact CE3-CG 4.38Å; W245-R253 HydrophobicContact CH2-CB 4.33Å; W245-R253 HydrophobicContact CH2-CG 3.8Å; W245-R253 HydrophobicContact CZ2-CG 4.36Å; W245-R253 HydrophobicContact CZ3-CB 3.87Å; W245-R253 HydrophobicContact CZ3-CG 3.8Å; W245-R253 WeakPolarHBondContact O-CD 3.42Å; W245-R253 PolarHBondContact O-NH1 3.38Å; W245-F256 HydrophobicContact CH2-CD2 4.28Å; W245-L260 HydrophobicContact CE3-CD1 3.66Å; W245-L260 HydrophobicContact CZ3-CD1 3.59Å
246	I	90.3	Very high	88.9	Confident	0 Å²	0	55.9 Å²	55.9	0%	0	27%	0.274	C	S	.	.	H	α-helix	trans	-71.6	-39.3	176.7	-65.2	171.6	0	0	0	111.5	M242 S244 Y248 D249 K250 R253 M257 L260 L283	M242-I246 HydrophobicContact CG-CD1 3.9Å; M242-I246 VanDerWaalsContact O-CG1 3.32Å; M242-I246 WeakPolarHBondContact O-CG1 3.45Å; M242-I246 PolarHBondContact O-N 2.79Å; M242-I246 VanDerWaalsContact O-N 3.07Å; S244-I246 VanDerWaalsContact C-N 3.35Å; S244-I246 PolarHBondContact O-N 2.83Å; I246-Y248 VanDerWaalsContact C-N 3.27Å; I246-Y248 PolarHBondContact O-N 3.08Å; I246-D249 CarbonylContact O-C 3.58Å; I246-K250 VanDerWaalsContact O-CA 3.32Å; I246-K250 WeakPolarHBondContact O-CA 3.47Å; I246-K250 PolarHBondContact O-N 2.99Å; I246-R253 HydrophobicContact CG2-CB 4.39Å; I246-M257 HydrophobicContact CD1-CB 4.06Å; I246-M257 HydrophobicContact CD1-CG 4.32Å; I246-M257 HydrophobicContact CD1-SD 3.34Å; I246-M257 WeakPolarHBondContact CD1-SD 3.4Å; I246-L260 HydrophobicContact CD1-CD1 4.07Å; I246-L260 HydrophobicContact CG1-CD1 4.16Å; I246-L283 HydrophobicContact CG2-CD1 4.18Å
247	K	89.6	Confident	89	Confident	101 Å²	101	54.3 Å²	54.3	44%	0.439	27%	0.267	S	S	.	.	H	α-helix	trans	-67	-26.1	-179.9	-77.9	174.4	179.1	167.8	0	113.1	I243 S244 E281 L283	I243-K247 HydrophobicContact CG2-CD 3.69Å; I243-K247 VanDerWaalsContact CG2-CE 3.45Å; I243-K247 HydrophobicContact CG2-CG 4.36Å; I243-K247 VanDerWaalsContact CG2-NZ 3.3Å; I243-K247 VanDerWaalsContact O-CB 3.32Å; I243-K247 WeakPolarHBondContact O-CB 3.29Å; I243-K247 VanDerWaalsContact O-CG 3.28Å; I243-K247 WeakPolarHBondContact O-CG 3.34Å; I243-K247 PolarHBondContact O-N 3.03Å; S244-K247 PolarHBondContact O-N 2.72Å; K247-E281 WeakPolarHBondContact CE-OE1 3.43Å; K247-E281 IonicContact NZ-OE1 3.02Å; K247-E281 PolarHBondContact NZ-OE1 2.75Å; K247-E281 IonicContact NZ-OE2 3.18Å; K247-E281 PolarHBondContact NZ-OE2 3.05Å; K247-L283 HydrophobicContact CG-CD1 4.2Å
248	Y	90.8	Very high	89.1	Confident	151 Å²	151	51.8 Å²	51.8	59%	0.592	26%	0.259	S	S	*	.	H	α-helix	trans	-61.5	-45.6	177.8	-176.1	-98.8	0	0	0	113.6	L214 S244 I246	L214-Y248 HydrophobicContact CB-CD1 4.26Å; L214-Y248 HydrophobicContact CB-CD2 3.95Å; L214-Y248 HydrophobicContact CB-CE1 4.46Å; L214-Y248 HydrophobicContact CB-CE2 4.15Å; L214-Y248 HydrophobicContact CB-CG 3.99Å; L214-Y248 HydrophobicContact CD1-CD2 3.72Å; L214-Y248 HydrophobicContact CD1-CE2 4.07Å; L214-Y248 HydrophobicContact CD1-CG 4.41Å; L214-Y248 HydrophobicContact CG-CD2 4.32Å; S244-Y248 PolarHBondContact O-N 3.5Å; S244-Y248 VanDerWaalsContact O-N 3.11Å; I246-Y248 VanDerWaalsContact C-N 3.27Å; I246-Y248 PolarHBondContact O-N 3.08Å
249	D	88.8	Confident	89.1	Confident	54 Å²	54	57.6 Å²	57.6	29%	0.289	28%	0.284	S	S	.	.	T	Hydrogen-bonded Turn	trans	-129.4	69.8	172	-175.8	8.3	0	0	0	110.2	I246 P251 T252 R253	I246-D249 CarbonylContact O-C 3.58Å; D249-P251 VanDerWaalsContact C-CD 3.47Å; D249-P251 VanDerWaalsContact OD1-CD 3.31Å; D249-P251 WeakPolarHBondContact OD1-CD 3.19Å; D249-P251 WeakPolarHBondContact OD1-CG 3.21Å; D249-T252 PolarHBondContact O-N 3.39Å; D249-T252 PolarHBondContact OD1-OG1 2.98Å; D249-T252 WeakPolarHBondContact OD2-CG2 3.41Å; D249-T252 PolarHBondContact OD2-OG1 3.15Å; D249-R253 HydrophobicContact CB-CG 4.18Å; D249-R253 VanDerWaalsContact O-CB 3.26Å; D249-R253 WeakPolarHBondContact O-CB 3.42Å; D249-R253 WeakPolarHBondContact O-CG 3.17Å; D249-R253 PolarHBondContact O-N 2.92Å
250	K	85.7	Confident	89	Confident	117 Å²	117	57.4 Å²	57.4	51%	0.509	28%	0.283	S	S	.	.	H	α-helix	trans	-51.4	-45.9	-176.5	-173.4	177	179.4	178.6	0	115	I246 L254	I246-K250 VanDerWaalsContact O-CA 3.32Å; I246-K250 WeakPolarHBondContact O-CA 3.47Å; I246-K250 PolarHBondContact O-N 2.99Å; K250-L254 HydrophobicContact CG-CD1 4.45Å; K250-L254 WeakPolarHBondContact O-CB 3.41Å; K250-L254 PolarHBondContact O-N 3.44Å
251	P	84.2	Confident	88.9	Confident	116 Å²	116	54 Å²	54	75%	0.753	27%	0.267	S	S	*	.	H	α-helix	trans	-68.9	-33.7	-174.6	26.3	-34.6	0	0	0	113.5	D249	D249-P251 VanDerWaalsContact C-CD 3.47Å; D249-P251 VanDerWaalsContact OD1-CD 3.31Å; D249-P251 WeakPolarHBondContact OD1-CD 3.19Å; D249-P251 WeakPolarHBondContact OD1-CG 3.21Å
252	T	87.2	Confident	88.9	Confident	74 Å²	74	58.5 Å²	58.5	45%	0.454	29%	0.288	S	S	.	.	H	α-helix	trans	-88.2	-37.1	179.1	74.6	0	0	0	0	112.2	D249	D249-T252 PolarHBondContact O-N 3.39Å; D249-T252 PolarHBondContact OD1-OG1 2.98Å; D249-T252 WeakPolarHBondContact OD2-CG2 3.41Å; D249-T252 PolarHBondContact OD2-OG1 3.15Å
253	R	90.3	Very high	88.8	Confident	27 Å²	27	61 Å²	61	10%	0.102	30%	0.299	C	S	.	.	H	α-helix	trans	-84.5	-12.3	-171.4	-61.5	176.7	-179.3	-172.1	-3.4	114.3	L214 W245 I246 D249 E255 F256	L214-R253 PolarHBondContact O-NH1 3.23Å; L214-R253 PolarHBondContact O-NH2 3.33Å; W245-R253 HydrophobicContact CE3-CB 4.41Å; W245-R253 HydrophobicContact CE3-CG 4.38Å; W245-R253 HydrophobicContact CH2-CB 4.33Å; W245-R253 HydrophobicContact CH2-CG 3.8Å; W245-R253 HydrophobicContact CZ2-CG 4.36Å; W245-R253 HydrophobicContact CZ3-CB 3.87Å; W245-R253 HydrophobicContact CZ3-CG 3.8Å; W245-R253 WeakPolarHBondContact O-CD 3.42Å; W245-R253 PolarHBondContact O-NH1 3.38Å; I246-R253 HydrophobicContact CG2-CB 4.39Å; D249-R253 HydrophobicContact CB-CG 4.18Å; D249-R253 VanDerWaalsContact O-CB 3.26Å; D249-R253 WeakPolarHBondContact O-CB 3.42Å; D249-R253 WeakPolarHBondContact O-CG 3.17Å; D249-R253 PolarHBondContact O-N 2.92Å; R253-E255 VanDerWaalsContact C-N 3.28Å; R253-E255 PolarHBondContact O-N 3.26Å; R253-F256 PolarHBondContact O-N 3.44Å; R253-F256 VanDerWaalsContact O-N 3.11Å
254	L	85.9	Confident	88.8	Confident	85 Å²	85	60.5 Å²	60.5	45%	0.445	30%	0.296	S	S	.	.	G	3₁₀ helix	trans	-56.8	-38.6	-178.6	-158.4	87.6	0	0	0	113	K250 F256 M257 L283	K250-L254 HydrophobicContact CG-CD1 4.45Å; K250-L254 WeakPolarHBondContact O-CB 3.41Å; K250-L254 PolarHBondContact O-N 3.44Å; L254-F256 PolarHBondContact O-N 3.24Å; L254-M257 VanDerWaalsContact O-CB 3.31Å; L254-M257 WeakPolarHBondContact O-CB 3.43Å; L254-M257 PolarHBondContact O-N 3.5Å; L254-L283 HydrophobicContact CD1-CD2 3.73Å
255	E	86.6	Confident	88.6	Confident	144 Å²	144	58.9 Å²	58.9	67%	0.673	28%	0.283	S	S	*	.	G	3₁₀ helix	trans	-66.9	-21.8	-178.6	61.7	171.8	-164.2	0	0	113.3	R253	R253-E255 VanDerWaalsContact C-N 3.28Å; R253-E255 PolarHBondContact O-N 3.26Å
256	F	87.6	Confident	88.4	Confident	47 Å²	47	58.6 Å²	58.6	21%	0.206	28%	0.282	C	S	.	.	G	3₁₀ helix	trans	-88.3	-8.2	179.6	-52	-45.6	0	0	0	114	L218 W245 R253 L254 P258 K259 L260	L218-F256 HydrophobicContact CD1-CB 3.62Å; L218-F256 HydrophobicContact CD1-CD1 4.46Å; L218-F256 HydrophobicContact CD1-CD2 4.27Å; L218-F256 HydrophobicContact CD1-CG 3.87Å; L218-F256 HydrophobicContact CD2-CB 4.18Å; L218-F256 HydrophobicContact CD2-CD1 3.42Å; L218-F256 VanDerWaalsContact CD2-CD1 3.42Å; L218-F256 HydrophobicContact CD2-CD2 4.15Å; L218-F256 HydrophobicContact CD2-CE1 3.77Å; L218-F256 HydrophobicContact CD2-CE2 4.45Å; L218-F256 HydrophobicContact CD2-CG 3.64Å; L218-F256 HydrophobicContact CD2-CZ 4.28Å; L218-F256 HydrophobicContact CG-CG 4.27Å; W245-F256 HydrophobicContact CH2-CD2 4.28Å; R253-F256 PolarHBondContact O-N 3.44Å; R253-F256 VanDerWaalsContact O-N 3.11Å; L254-F256 PolarHBondContact O-N 3.24Å; F256-P258 VanDerWaalsContact C-CD 3.49Å; F256-K259 PolarHBondContact O-N 2.98Å; F256-K259 VanDerWaalsContact O-N 3.07Å; F256-L260 PolarHBondContact O-N 3.16Å; F256-L260 VanDerWaalsContact O-N 3.15Å
257	M	87	Confident	88.1	Confident	4 Å²	4	58.7 Å²	58.7	2%	0.02	28%	0.283	C	S	.	.	H	α-helix	trans	-47	-48.2	179.8	179	80.3	-156	0	0	113.1	M242 I243 I246 L254 K259 L260 M261 I284	M242-M257 HydrophobicContact CE-CE 3.48Å; M242-M257 VanDerWaalsContact CE-CE 3.48Å; M242-M257 HydrophobicContact CE-SD 4.39Å; M242-M257 HydrophobicContact SD-CE 4.12Å; I243-M257 HydrophobicContact CD1-CE 4.12Å; I243-M257 HydrophobicContact CD1-SD 4.36Å; I246-M257 HydrophobicContact CD1-CB 4.06Å; I246-M257 HydrophobicContact CD1-CG 4.32Å; I246-M257 HydrophobicContact CD1-SD 3.34Å; I246-M257 WeakPolarHBondContact CD1-SD 3.4Å; L254-M257 VanDerWaalsContact O-CB 3.31Å; L254-M257 WeakPolarHBondContact O-CB 3.43Å; L254-M257 PolarHBondContact O-N 3.5Å; M257-K259 PolarHBondContact O-N 2.81Å; M257-L260 PolarHBondContact O-N 2.86Å; M257-M261 HydrophobicContact CE-CB 4.4Å; M257-M261 HydrophobicContact CE-CG 4.45Å; M257-M261 HydrophobicContact CE-SD 3.63Å; M257-M261 VanDerWaalsContact O-CB 3.3Å; M257-M261 WeakPolarHBondContact O-CB 3.46Å; M257-M261 PolarHBondContact O-N 3.17Å; M257-I284 HydrophobicContact CE-CD1 4.11Å; M257-I284 HydrophobicContact CE-CG1 3.72Å
258	P	88.3	Confident	87.7	Confident	25 Å²	25	56.7 Å²	56.7	16%	0.162	28%	0.276	C	S	.	.	H	α-helix	trans	-65.4	-37.3	-178.6	-21.9	35.7	0	0	0	113.4	F256 M261 E262 N287 T289	F256-P258 VanDerWaalsContact C-CD 3.49Å; P258-M261 PolarHBondContact O-N 2.72Å; P258-E262 PolarHBondContact O-N 3.23Å; P258-E262 VanDerWaalsContact O-N 3.09Å; P258-N287 WeakPolarHBondContact CG-ND2 3.5Å; P258-T289 HydrophobicContact CB-CG2 4.14Å
259	K	89	Confident	87.4	Confident	121 Å²	121	49.7 Å²	49.7	53%	0.526	25%	0.249	S	C	.	.	H	α-helix	trans	-68.4	-35.5	-179.3	-65.8	-179.4	178.3	176.2	0	111.9	F256 M257 H263	F256-K259 PolarHBondContact O-N 2.98Å; F256-K259 VanDerWaalsContact O-N 3.07Å; M257-K259 PolarHBondContact O-N 2.81Å; K259-H263 PolarHBondContact O-CD2 2.79Å
260	L	89.6	Confident	87	Confident	0 Å²	0	49.7 Å²	49.7	0%	0	25%	0.253	C	S	.	.	H	α-helix	trans	-75.9	-41.1	176	-67.2	170.9	0	0	0	111.2	L218 V221 I225 M242 W245 I246 F256 M257 E262 H263	L218-L260 HydrophobicContact CD1-CD1 4.18Å; L218-L260 HydrophobicContact CD1-CD2 3.91Å; L218-L260 HydrophobicContact CD1-CG 3.97Å; V221-L260 HydrophobicContact CB-CD2 4.38Å; V221-L260 HydrophobicContact CG1-CD2 3.93Å; I225-L260 HydrophobicContact CD1-CB 3.99Å; I225-L260 HydrophobicContact CD1-CD2 3.67Å; I225-L260 HydrophobicContact CD1-CG 4.45Å; I225-L260 WeakPolarHBondContact CD1-O 3.46Å; I225-L260 HydrophobicContact CG1-CD2 4.5Å; M242-L260 HydrophobicContact CG-CB 3.82Å; M242-L260 HydrophobicContact CG-CD1 4.36Å; M242-L260 HydrophobicContact SD-CB 3.76Å; W245-L260 HydrophobicContact CE3-CD1 3.66Å; W245-L260 HydrophobicContact CZ3-CD1 3.59Å; I246-L260 HydrophobicContact CD1-CD1 4.07Å; I246-L260 HydrophobicContact CG1-CD1 4.16Å; F256-L260 PolarHBondContact O-N 3.16Å; F256-L260 VanDerWaalsContact O-N 3.15Å; M257-L260 PolarHBondContact O-N 2.86Å; L260-E262 VanDerWaalsContact C-N 3.25Å; L260-E262 PolarHBondContact O-N 3.33Å; L260-H263 PolarHBondContact O-N 2.77Å; L260-H263 VanDerWaalsContact O-N 3.12Å
261	M	88.4	Confident	86.7	Confident	0 Å²	0	53 Å²	53	0%	0	26%	0.263	C	S	.	.	H	α-helix	trans	-65.3	-27.1	-179.8	-165.2	166.1	-179.8	0	0	113.1	M242 M257 P258 H263 V264 L266 V278 I284 C290 F293	M242-M261 HydrophobicContact CE-CB 4.49Å; M242-M261 HydrophobicContact SD-CB 4.02Å; M257-M261 HydrophobicContact CE-CB 4.4Å; M257-M261 HydrophobicContact CE-CG 4.45Å; M257-M261 HydrophobicContact CE-SD 3.63Å; M257-M261 VanDerWaalsContact O-CB 3.3Å; M257-M261 WeakPolarHBondContact O-CB 3.46Å; M257-M261 PolarHBondContact O-N 3.17Å; P258-M261 PolarHBondContact O-N 2.72Å; M261-H263 PolarHBondContact O-N 3.31Å; M261-V264 PolarHBondContact O-N 2.89Å; M261-V264 VanDerWaalsContact O-N 3.13Å; M261-L266 HydrophobicContact CE-CD1 3.38Å; M261-L266 HydrophobicContact CG-CD1 4.1Å; M261-V278 HydrophobicContact CE-CG1 4.45Å; M261-I284 HydrophobicContact CE-CD1 3.81Å; M261-I284 HydrophobicContact CE-CG1 4.16Å; M261-I284 HydrophobicContact CE-CG2 4.33Å; M261-I284 HydrophobicContact SD-CD1 4.41Å; M261-I284 HydrophobicContact SD-CG1 4.34Å; M261-C290 HydrophobicContact CE-CB 4.07Å; M261-C290 VanDerWaalsContact CE-O 3.31Å; M261-C290 WeakPolarHBondContact CE-O 2.91Å; M261-C290 HydrophobicContact SD-CB 3.45Å; M261-C290 WeakPolarHBondContact SD-CB 3.36Å; M261-C290 VanDerWaalsContact SD-SG 3.61Å; M261-F293 HydrophobicContact CB-CD2 4.17Å; M261-F293 HydrophobicContact CB-CE2 4.38Å; M261-F293 HydrophobicContact CE-CB 4.46Å; M261-F293 HydrophobicContact CG-CD2 3.92Å; M261-F293 HydrophobicContact SD-CD2 4.38Å
262	E	89.7	Confident	86.5	Confident	99 Å²	99	51.9 Å²	51.9	46%	0.463	25%	0.251	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57	-31.8	172.5	-177.6	168.1	-160	0	0	113.3	P258 L260 F293 R315	P258-E262 PolarHBondContact O-N 3.23Å; P258-E262 VanDerWaalsContact O-N 3.09Å; L260-E262 VanDerWaalsContact C-N 3.25Å; L260-E262 PolarHBondContact O-N 3.33Å; E262-F293 HydrophobicContact CB-CE2 4.27Å; E262-F293 HydrophobicContact CB-CZ 3.85Å; E262-F293 HydrophobicContact CG-CZ 4.23Å; E262-R315 WeakPolarHBondContact O-CD 3.46Å; E262-R315 WeakPolarHBondContact O-CG 3.32Å; E262-R315 PolarHBondContact O-NH1 2.82Å
263	H	90.4	Very high	86.3	Confident	53 Å²	53	49.7 Å²	49.7	25%	0.245	23%	0.234	C	C	.	.	T	Hydrogen-bonded Turn	trans	-91	-5.4	180	-57.7	-45.9	0	0	0	114.2	S222 I225 K259 L260 M261 R319	S222-H263 PolarHBondContact OG-NE2 3.18Å; I225-H263 HydrophobicContact CD1-CB 3.93Å; I225-H263 HydrophobicContact CG1-CB 3.81Å; K259-H263 PolarHBondContact O-CD2 2.79Å; L260-H263 PolarHBondContact O-N 2.77Å; L260-H263 VanDerWaalsContact O-N 3.12Å; M261-H263 PolarHBondContact O-N 3.31Å; H263-R319 PolarHBondContact O-NH2 3.05Å
264	V	90.4	Very high	86.1	Confident	0 Å²	0	48.6 Å²	48.6	0%	0	23%	0.23	C	C	.	.	S	Bend	trans	-90.7	127.2	175.4	-175.8	0	0	0	0	109.2	E235 V238 F239 M242 M261 L266 R315	E235-V264 HydrophobicContact CG-CG1 4.32Å; V238-V264 HydrophobicContact CG1-CG2 4.32Å; F239-V264 HydrophobicContact CB-CG1 4.06Å; F239-V264 HydrophobicContact CD2-CG1 4.36Å; M242-V264 HydrophobicContact CE-CG2 4.26Å; M242-V264 HydrophobicContact SD-CG2 3.89Å; M261-V264 PolarHBondContact O-N 2.89Å; M261-V264 VanDerWaalsContact O-N 3.13Å; V264-L266 HydrophobicContact CG1-CD2 3.88Å; V264-L266 HydrophobicContact CG1-CG 4.31Å; V264-L266 PolarHBondContact O-N 2.74Å; V264-R315 WeakPolarHBondContact O-CD 3.38Å
265	R	88.4	Confident	86.1	Confident	13 Å²	13	47.3 Å²	47.3	5%	0.049	23%	0.226	C	C	.	.			trans	-85.2	60.4	-172.6	-51	-177.1	-168.3	-149	-4.8	111.4	D228 E235 P267 L268 R315 R317	D228-R265 IonicContact OD1-CZ 3.79Å; D228-R265 IonicContact OD1-NH1 3.69Å; D228-R265 PolarHBondContact OD1-NH1 3.45Å; D228-R265 IonicContact OD1-NH2 2.77Å; D228-R265 PolarHBondContact OD1-NH2 2.85Å; E235-R265 HydrophobicContact CG-CB 3.82Å; E235-R265 WeakPolarHBondContact OE1-CG 3.46Å; E235-R265 PolarHBondContact OE1-N 2.75Å; R265-P267 VanDerWaalsContact C-N 3.29Å; R265-P267 VanDerWaalsContact O-N 3.13Å; R265-L268 HydrophobicContact CB-CB 4.46Å; R265-L268 HydrophobicContact CB-CD1 3.79Å; R265-L268 HydrophobicContact CB-CG 4.12Å; R265-L268 WeakPolarHBondContact O-CB 3.47Å; R265-L268 PolarHBondContact O-N 2.97Å; R265-R315 WeakPolarHBondContact CB-O 3.13Å; R265-R317 VanDerWaalsContact CD-O 3.31Å; R265-R317 WeakPolarHBondContact CD-O 3.37Å; R265-R317 PolarHBondContact NH1-O 2.67Å
266	L	87.4	Confident	86	Confident	0 Å²	0	46.7 Å²	46.7	0%	0	22%	0.221	C	C	.	.	G	3₁₀ helix	trans	-46.6	-38.5	-178.8	-61.7	175.8	0	0	0	115.3	F239 M261 V264 L268 L269 L274 V278 F293 A297	F239-L266 HydrophobicContact CD2-CD2 4.1Å; M261-L266 HydrophobicContact CE-CD1 3.38Å; M261-L266 HydrophobicContact CG-CD1 4.1Å; V264-L266 HydrophobicContact CG1-CD2 3.88Å; V264-L266 HydrophobicContact CG1-CG 4.31Å; V264-L266 PolarHBondContact O-N 2.74Å; L266-L268 PolarHBondContact O-N 3.36Å; L266-L268 VanDerWaalsContact O-N 3.08Å; L266-L269 HydrophobicContact CD2-CD2 4.08Å; L266-L269 PolarHBondContact O-N 2.89Å; L266-L269 VanDerWaalsContact O-N 3.14Å; L266-L274 HydrophobicContact CB-CD2 4.42Å; L266-L274 HydrophobicContact CD2-CD2 4.45Å; L266-V278 HydrophobicContact CD2-CG1 4.38Å; L266-F293 HydrophobicContact CD1-CB 3.83Å; L266-A297 HydrophobicContact CB-CB 3.74Å
267	P	85.2	Confident	86	Confident	1 Å²	1	48 Å²	48	1%	0.006	23%	0.229	C	C	.	.	G	3₁₀ helix	trans	-59.8	-14	173.6	-25.4	35.5	0	0	0	115.8	R265 A297 Y300 R315 T316	R265-P267 VanDerWaalsContact C-N 3.29Å; R265-P267 VanDerWaalsContact O-N 3.13Å; P267-A297 HydrophobicContact CG-CB 4.27Å; P267-Y300 HydrophobicContact CB-CD1 3.62Å; P267-Y300 HydrophobicContact CB-CD2 4.38Å; P267-Y300 HydrophobicContact CB-CE1 4.14Å; P267-Y300 HydrophobicContact CB-CG 3.75Å; P267-Y300 WeakPolarHBondContact O-CD1 3.3Å; P267-Y300 WeakPolarHBondContact O-CE1 3.4Å; P267-R315 WeakPolarHBondContact CD-O 3.48Å; P267-R315 HydrophobicContact CG-CB 4.19Å; P267-T316 HydrophobicContact CB-CG2 3.89Å; P267-T316 HydrophobicContact CG-CG2 3.92Å
268	L	81.1	Confident	85.9	Confident	59 Å²	59	47.9 Å²	47.9	31%	0.309	23%	0.228	S	C	.	.	G	3₁₀ helix	trans	-101	-2.4	179.5	-53.4	-179.1	0	0	0	113.4	R265 L266 P318	R265-L268 HydrophobicContact CB-CB 4.46Å; R265-L268 HydrophobicContact CB-CD1 3.79Å; R265-L268 HydrophobicContact CB-CG 4.12Å; R265-L268 WeakPolarHBondContact O-CB 3.47Å; R265-L268 PolarHBondContact O-N 2.97Å; L266-L268 PolarHBondContact O-N 3.36Å; L266-L268 VanDerWaalsContact O-N 3.08Å; L268-P318 HydrophobicContact CD1-CB 4.34Å; L268-P318 HydrophobicContact CD1-CG 4.3Å; L268-P318 HydrophobicContact CD2-CG 4.44Å
269	L	83.9	Confident	85.8	Confident	4 Å²	4	50.4 Å²	50.4	2%	0.021	24%	0.238	C	C	.	.	S	Bend	trans	-73.3	162.5	173.4	-89.5	64.1	0	0	0	110.4	E235 E236 L266 Y273 L274 V278 H301	E235-L269 HydrophobicContact CB-CD1 3.56Å; E235-L269 HydrophobicContact CG-CD1 3.52Å; E236-L269 HydrophobicContact CG-CD2 4.38Å; E236-L269 HydrophobicContact CG-CG 3.92Å; L266-L269 HydrophobicContact CD2-CD2 4.08Å; L266-L269 PolarHBondContact O-N 2.89Å; L266-L269 VanDerWaalsContact O-N 3.14Å; L269-Y273 HydrophobicContact CD2-CD1 3.76Å; L269-Y273 HydrophobicContact CD2-CE1 4.05Å; L269-L274 HydrophobicContact CB-CD1 4.43Å; L269-L274 HydrophobicContact CB-CD2 4.01Å; L269-L274 HydrophobicContact CB-CG 3.93Å; L269-L274 HydrophobicContact CD2-CD2 4.1Å; L269-V278 HydrophobicContact CD2-CG2 3.95Å; L269-H301 PolarHBondContact O-CE1 2.59Å; L269-H301 PolarHBondContact O-NE2 3.24Å
270	S	80.3	Confident	85.6	Confident	54 Å²	54	50.1 Å²	50.1	38%	0.378	24%	0.239	S	C	.	.			trans	-71.6	143.5	172	67.5	0	0	0	0	110.8	E236 D272 Y273 L274	E236-S270 PolarHBondContact OE1-OG 2.81Å; E236-S270 VanDerWaalsContact OE1-OG 3.07Å; S270-D272 PolarHBondContact O-N 3.01Å; S270-Y273 PolarHBondContact O-N 2.97Å; S270-Y273 VanDerWaalsContact O-N 3.08Å; S270-Y273 WeakPolarHBondContact OG-CB 3.4Å; S270-Y273 PolarHBondContact OG-N 3.3Å; S270-L274 PolarHBondContact O-N 3.43Å
271	R	80.8	Confident	85.4	Confident	187 Å²	187	52 Å²	52	71%	0.706	25%	0.248	S	C	*	.	H	α-helix	trans	-54.4	-39.4	176.9	176.8	-178.4	170.9	-172.3	-3.4	111.8	L274 V275	R271-L274 PolarHBondContact O-N 3.05Å; R271-V275 PolarHBondContact O-N 3.06Å
272	D	79.7	Confident	85	Confident	93 Å²	93	54.7 Å²	54.7	50%	0.497	27%	0.27	S	S	.	.	H	α-helix	trans	-63.8	-42.4	178.1	-93.1	46.3	0	0	0	112.1	S270 K276	S270-D272 PolarHBondContact O-N 3.01Å; D272-K276 HydrophobicContact CB-CD 4.49Å; D272-K276 WeakPolarHBondContact O-CB 3.3Å; D272-K276 VanDerWaalsContact O-CG 3.27Å; D272-K276 WeakPolarHBondContact O-CG 3.32Å; D272-K276 PolarHBondContact O-N 3.33Å; D272-K276 IonicContact OD2-NZ 2.65Å; D272-K276 PolarHBondContact OD2-NZ 3.35Å
273	Y	83.4	Confident	84.5	Confident	28 Å²	28	50.6 Å²	50.6	11%	0.11	25%	0.251	C	S	.	.	H	α-helix	trans	-69.3	-40.2	177.9	-166.1	-74.4	0	0	0	111.7	E236 F239 E240 L269 S270 V275 I277 V278	E236-Y273 HydrophobicContact CB-CD2 4.19Å; E236-Y273 HydrophobicContact CB-CE1 4.25Å; E236-Y273 HydrophobicContact CB-CE2 3.74Å; E236-Y273 HydrophobicContact CG-CD1 4.08Å; E236-Y273 HydrophobicContact CG-CD2 3.69Å; E236-Y273 HydrophobicContact CG-CE1 4.19Å; E236-Y273 HydrophobicContact CG-CE2 3.8Å; E236-Y273 HydrophobicContact CG-CG 3.84Å; E236-Y273 WeakPolarHBondContact OE1-CB 3.4Å; E236-Y273 WeakPolarHBondContact OE1-CD2 3.28Å; F239-Y273 AromaticContact CD1-CE1 3.92Å; F239-Y273 HydrophobicContact CD1-CE1 3.92Å; F239-Y273 HydrophobicContact CE1-CE1 4.36Å; E240-Y273 VanDerWaalsContact CG-OH 3.26Å; E240-Y273 WeakPolarHBondContact CG-OH 3.17Å; E240-Y273 PolarHBondContact OE1-OH 2.93Å; L269-Y273 HydrophobicContact CD2-CD1 3.76Å; L269-Y273 HydrophobicContact CD2-CE1 4.05Å; S270-Y273 PolarHBondContact O-N 2.97Å; S270-Y273 VanDerWaalsContact O-N 3.08Å; S270-Y273 WeakPolarHBondContact OG-CB 3.4Å; S270-Y273 PolarHBondContact OG-N 3.3Å; Y273-V275 VanDerWaalsContact C-N 3.35Å; Y273-V275 PolarHBondContact O-N 2.84Å; Y273-I277 HydrophobicContact CD1-CB 3.91Å; Y273-I277 HydrophobicContact CD1-CG1 4.22Å; Y273-I277 HydrophobicContact CD1-CG2 4.4Å; Y273-I277 HydrophobicContact CD2-CG1 4.07Å; Y273-I277 HydrophobicContact CE1-CB 3.82Å; Y273-I277 HydrophobicContact CE1-CG1 4.28Å; Y273-I277 HydrophobicContact CE1-CG2 3.78Å; Y273-I277 HydrophobicContact CE2-CG1 4.14Å; Y273-I277 HydrophobicContact CG-CB 4.31Å; Y273-I277 HydrophobicContact CG-CG1 4.11Å; Y273-I277 WeakPolarHBondContact O-CA 3.5Å; Y273-I277 WeakPolarHBondContact O-CB 3.42Å; Y273-I277 PolarHBondContact O-N 2.99Å; Y273-V278 HydrophobicContact CD1-CG2 3.79Å; Y273-V278 HydrophobicContact CE1-CG2 3.9Å; Y273-V278 PolarHBondContact O-N 2.98Å
274	L	85.6	Confident	84	Confident	4 Å²	4	48.2 Å²	48.2	2%	0.021	24%	0.24	C	C	.	.	I	π-helix	trans	-57.5	-45.3	176	-73.1	170.6	0	0	0	112.1	L266 L269 S270 R271 V278 E279 L294 A297 H301	L266-L274 HydrophobicContact CB-CD2 4.42Å; L266-L274 HydrophobicContact CD2-CD2 4.45Å; L269-L274 HydrophobicContact CB-CD1 4.43Å; L269-L274 HydrophobicContact CB-CD2 4.01Å; L269-L274 HydrophobicContact CB-CG 3.93Å; L269-L274 HydrophobicContact CD2-CD2 4.1Å; S270-L274 PolarHBondContact O-N 3.43Å; R271-L274 PolarHBondContact O-N 3.05Å; L274-V278 HydrophobicContact CD2-CB 4.32Å; L274-V278 HydrophobicContact CD2-CG1 4.5Å; L274-V278 HydrophobicContact CD2-CG2 4.13Å; L274-V278 WeakPolarHBondContact O-CB 3.48Å; L274-V278 PolarHBondContact O-N 2.98Å; L274-E279 WeakPolarHBondContact O-CB 3.45Å; L274-E279 PolarHBondContact O-N 2.72Å; L274-L294 HydrophobicContact CB-CD1 4.39Å; L274-L294 HydrophobicContact CD2-CD1 3.94Å; L274-A297 HydrophobicContact CD1-CB 4.04Å; L274-A297 HydrophobicContact CD2-CB 4.29Å; L274-H301 VanDerWaalsContact CD1-CD2 3.47Å; L274-H301 WeakPolarHBondContact CD1-CD2 3.22Å; L274-H301 VanDerWaalsContact CD1-NE2 3.3Å; L274-H301 WeakPolarHBondContact CD1-NE2 3.44Å
275	V	84.5	Confident	83.4	Confident	57 Å²	57	52.1 Å²	52.1	35%	0.345	26%	0.257	S	S	.	.	I	π-helix	trans	-78.9	-42.1	-179.2	177.3	0	0	0	0	112.4	R271 Y273 M298	R271-V275 PolarHBondContact O-N 3.06Å; Y273-V275 VanDerWaalsContact C-N 3.35Å; Y273-V275 PolarHBondContact O-N 2.84Å; V275-M298 HydrophobicContact CG2-CE 4.45Å
276	K	85.6	Confident	82.9	Confident	132 Å²	132	58.1 Å²	58.1	57%	0.574	29%	0.29	S	S	*	.	I	π-helix	trans	-81.4	-27.2	-173.6	-67	169.2	178.1	168	0	113.9	D272	D272-K276 HydrophobicContact CB-CD 4.49Å; D272-K276 WeakPolarHBondContact O-CB 3.3Å; D272-K276 VanDerWaalsContact O-CG 3.27Å; D272-K276 WeakPolarHBondContact O-CG 3.32Å; D272-K276 PolarHBondContact O-N 3.33Å; D272-K276 IonicContact OD2-NZ 2.65Å; D272-K276 PolarHBondContact OD2-NZ 3.35Å
277	I	86.6	Confident	82.8	Confident	75 Å²	75	60.1 Å²	60.1	39%	0.385	30%	0.301	S	S	.	.	I	π-helix	trans	-118.8	-56.4	-172.3	-50	-62.2	0	0	0	111	F239 Y273 E280 E281	F239-I277 HydrophobicContact CE1-CG2 4.39Å; Y273-I277 HydrophobicContact CD1-CB 3.91Å; Y273-I277 HydrophobicContact CD1-CG1 4.22Å; Y273-I277 HydrophobicContact CD1-CG2 4.4Å; Y273-I277 HydrophobicContact CD2-CG1 4.07Å; Y273-I277 HydrophobicContact CE1-CB 3.82Å; Y273-I277 HydrophobicContact CE1-CG1 4.28Å; Y273-I277 HydrophobicContact CE1-CG2 3.78Å; Y273-I277 HydrophobicContact CE2-CG1 4.14Å; Y273-I277 HydrophobicContact CG-CB 4.31Å; Y273-I277 HydrophobicContact CG-CG1 4.11Å; Y273-I277 WeakPolarHBondContact O-CA 3.5Å; Y273-I277 WeakPolarHBondContact O-CB 3.42Å; Y273-I277 PolarHBondContact O-N 2.99Å; I277-E280 PolarHBondContact O-N 3.3Å; I277-E281 WeakPolarHBondContact O-CB 3.29Å; I277-E281 PolarHBondContact O-N 2.88Å
278	V	85.6	Confident	82.8	Confident	0 Å²	0	65.6 Å²	65.6	0%	0	33%	0.33	C	S	.	.	I	π-helix	trans	-71.6	-42.9	-171.6	-174.2	0	0	0	0	112	F239 M261 L266 L269 Y273 L274 I284 L294	F239-V278 HydrophobicContact CD1-CG2 4.32Å; F239-V278 HydrophobicContact CD2-CG2 4.47Å; F239-V278 HydrophobicContact CE1-CG2 3.95Å; F239-V278 HydrophobicContact CE2-CG1 3.88Å; F239-V278 HydrophobicContact CE2-CG2 4.11Å; F239-V278 HydrophobicContact CZ-CB 4.19Å; F239-V278 HydrophobicContact CZ-CG1 3.95Å; F239-V278 HydrophobicContact CZ-CG2 3.84Å; M261-V278 HydrophobicContact CE-CG1 4.45Å; L266-V278 HydrophobicContact CD2-CG1 4.38Å; L269-V278 HydrophobicContact CD2-CG2 3.95Å; Y273-V278 HydrophobicContact CD1-CG2 3.79Å; Y273-V278 HydrophobicContact CE1-CG2 3.9Å; Y273-V278 PolarHBondContact O-N 2.98Å; L274-V278 HydrophobicContact CD2-CB 4.32Å; L274-V278 HydrophobicContact CD2-CG1 4.5Å; L274-V278 HydrophobicContact CD2-CG2 4.13Å; L274-V278 WeakPolarHBondContact O-CB 3.48Å; L274-V278 PolarHBondContact O-N 2.98Å; V278-I284 HydrophobicContact CG1-CD1 3.62Å; V278-I284 WeakPolarHBondContact O-CD1 3.47Å; V278-L294 HydrophobicContact CB-CD1 4.47Å; V278-L294 HydrophobicContact CG1-CD1 4.08Å
279	E	85.4	Confident	83.1	Confident	79 Å²	79	66 Å²	66	37%	0.369	34%	0.335	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.7	-35.8	175.6	-175.3	171	-164.2	0	0	112	L274 K285 L294	L274-E279 WeakPolarHBondContact O-CB 3.45Å; L274-E279 PolarHBondContact O-N 2.72Å; E279-K285 WeakPolarHBondContact O-CE 3.45Å; E279-K285 WeakPolarHBondContact O-CG 3.47Å; E279-L294 HydrophobicContact CB-CD2 4.03Å; E279-L294 HydrophobicContact CG-CD2 4.31Å
280	E	85.4	Confident	83.2	Confident	115 Å²	115	65.8 Å²	65.8	54%	0.537	33%	0.334	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.2	-24.7	-178.1	-79.4	-56.8	127.3	0	0	114.6	I277 A282 K285	I277-E280 PolarHBondContact O-N 3.3Å; E280-A282 PolarHBondContact O-N 3.19Å; E280-K285 IonicContact OE1-NZ 2.81Å; E280-K285 PolarHBondContact OE1-NZ 2.91Å; E280-K285 IonicContact OE2-NZ 3.59Å; E280-K285 PolarHBondContact OE2-NZ 3.43Å
281	E	86.3	Confident	83.5	Confident	39 Å²	39	66.9 Å²	66.9	18%	0.182	33%	0.332	C	S	.	.			trans	-60.5	118.7	-179.1	-178.8	65.3	-121.9	0	0	112.2	I243 K247 I277 L283 I284 K285	I243-E281 HydrophobicContact CD1-CG 4.06Å; K247-E281 WeakPolarHBondContact CE-OE1 3.43Å; K247-E281 IonicContact NZ-OE1 3.02Å; K247-E281 PolarHBondContact NZ-OE1 2.75Å; K247-E281 IonicContact NZ-OE2 3.18Å; K247-E281 PolarHBondContact NZ-OE2 3.05Å; I277-E281 WeakPolarHBondContact O-CB 3.29Å; I277-E281 PolarHBondContact O-N 2.88Å; E281-L283 HydrophobicContact CG-CB 4.2Å; E281-L283 HydrophobicContact CG-CG 4.39Å; E281-L283 PolarHBondContact O-N 2.8Å; E281-I284 HydrophobicContact CB-CD1 4.37Å; E281-I284 PolarHBondContact O-N 3.37Å; E281-K285 PolarHBondContact O-N 3.01Å
282	A	79.8	Confident	83.8	Confident	56 Å²	56	62.6 Å²	62.6	46%	0.463	32%	0.323	S	S	.	.	H	α-helix	trans	-61.8	-21	-172.8	0	0	0	0	0	114.2	E280 I284 N286	E280-A282 PolarHBondContact O-N 3.19Å; A282-I284 VanDerWaalsContact C-N 3.35Å; A282-N286 PolarHBondContact O-ND2 3.32Å
283	L	78.2	Confident	84.2	Confident	14 Å²	14	59.2 Å²	59.2	7%	0.073	30%	0.304	C	S	.	.	H	α-helix	trans	-68.5	-34.2	174.6	-57	178.1	0	0	0	111.9	I243 I246 K247 L254 E281	I243-L283 HydrophobicContact CD1-CD1 4.07Å; I246-L283 HydrophobicContact CG2-CD1 4.18Å; K247-L283 HydrophobicContact CG-CD1 4.2Å; L254-L283 HydrophobicContact CD1-CD2 3.73Å; E281-L283 HydrophobicContact CG-CB 4.2Å; E281-L283 HydrophobicContact CG-CG 4.39Å; E281-L283 PolarHBondContact O-N 2.8Å
284	I	79.7	Confident	84.3	Confident	2 Å²	2	58.5 Å²	58.5	1%	0.01	30%	0.302	C	S	.	.	H	α-helix	trans	-84.7	-39.1	-176.9	-67.9	170.1	0	0	0	110.8	F239 M257 M261 V278 E281 A282 N286 N287 C290	F239-I284 HydrophobicContact CE2-CD1 3.67Å; F239-I284 HydrophobicContact CZ-CD1 3.62Å; M257-I284 HydrophobicContact CE-CD1 4.11Å; M257-I284 HydrophobicContact CE-CG1 3.72Å; M261-I284 HydrophobicContact CE-CD1 3.81Å; M261-I284 HydrophobicContact CE-CG1 4.16Å; M261-I284 HydrophobicContact CE-CG2 4.33Å; M261-I284 HydrophobicContact SD-CD1 4.41Å; M261-I284 HydrophobicContact SD-CG1 4.34Å; V278-I284 HydrophobicContact CG1-CD1 3.62Å; V278-I284 WeakPolarHBondContact O-CD1 3.47Å; E281-I284 HydrophobicContact CB-CD1 4.37Å; E281-I284 PolarHBondContact O-N 3.37Å; A282-I284 VanDerWaalsContact C-N 3.35Å; I284-N286 PolarHBondContact O-N 2.81Å; I284-N287 PolarHBondContact O-N 2.92Å; I284-N287 VanDerWaalsContact O-N 3.11Å; I284-C290 HydrophobicContact CG1-CB 4.45Å; I284-C290 HydrophobicContact CG2-CB 4.11Å
285	K	78.7	Confident	84.4	Confident	82 Å²	82	63.2 Å²	63.2	36%	0.357	33%	0.326	S	S	.	.	H	α-helix	trans	-54.6	-26	176.1	-69	-172.3	176.9	-179.8	0	113.6	E279 E280 E281 K291	E279-K285 WeakPolarHBondContact O-CE 3.45Å; E279-K285 WeakPolarHBondContact O-CG 3.47Å; E280-K285 IonicContact OE1-NZ 2.81Å; E280-K285 PolarHBondContact OE1-NZ 2.91Å; E280-K285 IonicContact OE2-NZ 3.59Å; E280-K285 PolarHBondContact OE2-NZ 3.43Å; E281-K285 PolarHBondContact O-N 3.01Å; K285-K291 WeakPolarHBondContact O-CE 3.19Å; K285-K291 PolarHBondContact O-NZ 3.35Å
286	N	78.8	Confident	84.5	Confident	140 Å²	140	62.1 Å²	62.1	75%	0.749	32%	0.317	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97	-1.3	-176.4	-67.2	-31.9	0	0	0	115.1	A282 I284	A282-N286 PolarHBondContact O-ND2 3.32Å; I284-N286 PolarHBondContact O-N 2.81Å
287	N	83.6	Confident	84.5	Confident	41 Å²	41	55.8 Å²	55.8	22%	0.219	29%	0.29	C	S	.	.			trans	-126.6	122.4	-176.5	-172.2	-62.7	0	0	0	111.8	P258 I284 T289 C290 K291	P258-N287 WeakPolarHBondContact CG-ND2 3.5Å; I284-N287 PolarHBondContact O-N 2.92Å; I284-N287 VanDerWaalsContact O-N 3.11Å; N287-T289 PolarHBondContact OD1-N 3.09Å; N287-T289 VanDerWaalsContact OD1-N 3.12Å; N287-C290 HydrophobicContact CB-CB 3.96Å; N287-C290 PolarHBondContact O-N 3.12Å; N287-C290 PolarHBondContact OD1-N 3Å; N287-C290 VanDerWaalsContact OD1-N 3.15Å; N287-C290 PolarHBondContact OD1-SG 3.44Å; N287-K291 PolarHBondContact O-N 2.76Å
288	N	85.9	Confident	84.4	Confident	116 Å²	116	55.8 Å²	55.8	62%	0.62	29%	0.289	S	S	*	.	H	α-helix	trans	-68.5	-42.8	-174.6	-67.9	-16.2	0	0	0	112.8	C290 K291 D292	N288-C290 PolarHBondContact O-N 2.8Å; N288-K291 WeakPolarHBondContact O-CA 3.33Å; N288-K291 WeakPolarHBondContact O-CB 3.42Å; N288-K291 PolarHBondContact O-N 3.07Å; N288-D292 PolarHBondContact O-N 3.14Å
289	T	87.1	Confident	84.3	Confident	67 Å²	67	62 Å²	62	41%	0.411	32%	0.316	S	S	.	.	H	α-helix	trans	-62.2	-34.7	177.7	-48.4	0	0	0	0	111.9	P258 N287 K291 D292 F293	P258-T289 HydrophobicContact CB-CG2 4.14Å; N287-T289 PolarHBondContact OD1-N 3.09Å; N287-T289 VanDerWaalsContact OD1-N 3.12Å; T289-K291 VanDerWaalsContact C-N 3.31Å; T289-K291 PolarHBondContact O-N 3.05Å; T289-D292 PolarHBondContact O-N 2.81Å; T289-F293 HydrophobicContact CG2-CE2 4Å; T289-F293 HydrophobicContact CG2-CZ 4.27Å; T289-F293 WeakPolarHBondContact O-CD2 3.4Å; T289-F293 PolarHBondContact O-N 2.96Å
290	C	85.9	Confident	84.1	Confident	0 Å²	0	59.8 Å²	59.8	0%	0	30%	0.304	C	S	.	.	H	α-helix	trans	-66.3	-33.2	174.4	-60.8	0	0	0	0	112.3	M261 I284 N287 N288 L294	M261-C290 HydrophobicContact CE-CB 4.07Å; M261-C290 VanDerWaalsContact CE-O 3.31Å; M261-C290 WeakPolarHBondContact CE-O 2.91Å; M261-C290 HydrophobicContact SD-CB 3.45Å; M261-C290 WeakPolarHBondContact SD-CB 3.36Å; M261-C290 VanDerWaalsContact SD-SG 3.61Å; I284-C290 HydrophobicContact CG1-CB 4.45Å; I284-C290 HydrophobicContact CG2-CB 4.11Å; N287-C290 HydrophobicContact CB-CB 3.96Å; N287-C290 PolarHBondContact O-N 3.12Å; N287-C290 PolarHBondContact OD1-N 3Å; N287-C290 VanDerWaalsContact OD1-N 3.15Å; N287-C290 PolarHBondContact OD1-SG 3.44Å; N288-C290 PolarHBondContact O-N 2.8Å; C290-L294 PolarHBondContact O-N 3.21Å
291	K	86.5	Confident	83.8	Confident	78 Å²	78	56.7 Å²	56.7	34%	0.339	29%	0.29	S	S	.	.	H	α-helix	trans	-70.4	-37.1	172.4	-65.7	170.5	-174.8	167	0	112	K285 N287 N288 T289 F293 L294 I295	K285-K291 WeakPolarHBondContact O-CE 3.19Å; K285-K291 PolarHBondContact O-NZ 3.35Å; N287-K291 PolarHBondContact O-N 2.76Å; N288-K291 WeakPolarHBondContact O-CA 3.33Å; N288-K291 WeakPolarHBondContact O-CB 3.42Å; N288-K291 PolarHBondContact O-N 3.07Å; T289-K291 VanDerWaalsContact C-N 3.31Å; T289-K291 PolarHBondContact O-N 3.05Å; K291-F293 VanDerWaalsContact C-N 3.31Å; K291-F293 PolarHBondContact O-N 3.14Å; K291-L294 WeakPolarHBondContact O-CB 3.37Å; K291-L294 PolarHBondContact O-N 3.25Å; K291-L294 VanDerWaalsContact O-N 3.12Å; K291-I295 VanDerWaalsContact O-CG1 3.25Å; K291-I295 WeakPolarHBondContact O-CG1 3.42Å; K291-I295 PolarHBondContact O-N 3.42Å
292	D	88.1	Confident	83.5	Confident	97 Å²	97	62 Å²	62	52%	0.519	32%	0.318	S	S	.	.	H	α-helix	trans	-60.3	-41.4	177	-62.3	-36.8	0	0	0	111.3	N288 T289 I295 E296	N288-D292 PolarHBondContact O-N 3.14Å; T289-D292 PolarHBondContact O-N 2.81Å; D292-I295 PolarHBondContact O-N 2.96Å; D292-E296 PolarHBondContact O-N 3.45Å
293	F	87.6	Confident	83.3	Confident	22 Å²	22	61.1 Å²	61.1	10%	0.096	31%	0.306	C	S	.	.	H	α-helix	trans	-66.4	-35.8	172.9	-61.8	-48.5	0	0	0	113.4	M261 E262 L266 T289 K291 E296 A297	M261-F293 HydrophobicContact CB-CD2 4.17Å; M261-F293 HydrophobicContact CB-CE2 4.38Å; M261-F293 HydrophobicContact CE-CB 4.46Å; M261-F293 HydrophobicContact CG-CD2 3.92Å; M261-F293 HydrophobicContact SD-CD2 4.38Å; E262-F293 HydrophobicContact CB-CE2 4.27Å; E262-F293 HydrophobicContact CB-CZ 3.85Å; E262-F293 HydrophobicContact CG-CZ 4.23Å; L266-F293 HydrophobicContact CD1-CB 3.83Å; T289-F293 HydrophobicContact CG2-CE2 4Å; T289-F293 HydrophobicContact CG2-CZ 4.27Å; T289-F293 WeakPolarHBondContact O-CD2 3.4Å; T289-F293 PolarHBondContact O-N 2.96Å; K291-F293 VanDerWaalsContact C-N 3.31Å; K291-F293 PolarHBondContact O-N 3.14Å; F293-E296 WeakPolarHBondContact O-CB 3.4Å; F293-E296 PolarHBondContact O-N 3.26Å; F293-A297 PolarHBondContact O-N 3.15Å; F293-A297 VanDerWaalsContact O-N 3.11Å
294	L	86.6	Confident	82.8	Confident	13 Å²	13	63.5 Å²	63.5	7%	0.068	32%	0.322	C	S	.	.	H	α-helix	trans	-66.3	-40.4	173.5	-178.1	60.8	0	0	0	111.3	L274 V278 E279 C290 K291 A297 M298	L274-L294 HydrophobicContact CB-CD1 4.39Å; L274-L294 HydrophobicContact CD2-CD1 3.94Å; V278-L294 HydrophobicContact CB-CD1 4.47Å; V278-L294 HydrophobicContact CG1-CD1 4.08Å; E279-L294 HydrophobicContact CB-CD2 4.03Å; E279-L294 HydrophobicContact CG-CD2 4.31Å; C290-L294 PolarHBondContact O-N 3.21Å; K291-L294 WeakPolarHBondContact O-CB 3.37Å; K291-L294 PolarHBondContact O-N 3.25Å; K291-L294 VanDerWaalsContact O-N 3.12Å; L294-A297 PolarHBondContact O-N 3.07Å; L294-M298 HydrophobicContact CD1-CG 4.49Å; L294-M298 HydrophobicContact CG-SD 4.38Å; L294-M298 WeakPolarHBondContact O-CG 3.39Å; L294-M298 PolarHBondContact O-N 3.07Å
295	I	86.3	Confident	81.7	Confident	103 Å²	103	67 Å²	67	53%	0.528	35%	0.351	S	S	.	.	H	α-helix	trans	-64.5	-39.4	175.5	-67.6	162.3	0	0	0	110.9	K291 D292 M298 K299	K291-I295 VanDerWaalsContact O-CG1 3.25Å; K291-I295 WeakPolarHBondContact O-CG1 3.42Å; K291-I295 PolarHBondContact O-N 3.42Å; D292-I295 PolarHBondContact O-N 2.96Å; I295-M298 PolarHBondContact O-N 2.83Å; I295-K299 VanDerWaalsContact O-CB 3.25Å; I295-K299 WeakPolarHBondContact O-CB 3.38Å; I295-K299 PolarHBondContact O-N 3.48Å
296	E	86.9	Confident	80.5	Confident	33 Å²	33	68 Å²	68	15%	0.154	36%	0.36	C	S	.	.	H	α-helix	trans	-56.4	-49.9	171.4	-174.9	-173	174.1	0	0	111.2	D292 F293 K299 Y300 T313 R315	D292-E296 PolarHBondContact O-N 3.45Å; F293-E296 WeakPolarHBondContact O-CB 3.4Å; F293-E296 PolarHBondContact O-N 3.26Å; E296-K299 PolarHBondContact O-N 3.12Å; E296-Y300 PolarHBondContact O-N 3.07Å; E296-T313 WeakPolarHBondContact OE1-CB 3.36Å; E296-T313 WeakPolarHBondContact OE1-CG2 3.37Å; E296-T313 PolarHBondContact OE1-OG1 2.95Å; E296-R315 IonicContact OE1-NE 2.92Å; E296-R315 IonicContact OE1-NH2 2.73Å; E296-R315 IonicContact OE2-CZ 3.01Å; E296-R315 VanDerWaalsContact OE2-CZ 3.27Å; E296-R315 IonicContact OE2-NE 3.24Å; E296-R315 PolarHBondContact OE2-NE 3.39Å; E296-R315 IonicContact OE2-NH2 2.68Å; E296-R315 PolarHBondContact OE2-NH2 3.38Å
297	A	84.8	Confident	79.5	Confident	0 Å²	0	65 Å²	65	0%	0	34%	0.342	C	S	.	.	H	α-helix	trans	-63.3	-46.5	178.9	0	0	0	0	0	112.6	L266 P267 L274 F293 L294 K299 Y300 H301	L266-A297 HydrophobicContact CB-CB 3.74Å; P267-A297 HydrophobicContact CG-CB 4.27Å; L274-A297 HydrophobicContact CD1-CB 4.04Å; L274-A297 HydrophobicContact CD2-CB 4.29Å; F293-A297 PolarHBondContact O-N 3.15Å; F293-A297 VanDerWaalsContact O-N 3.11Å; L294-A297 PolarHBondContact O-N 3.07Å; A297-K299 VanDerWaalsContact C-N 3.33Å; A297-K299 PolarHBondContact O-N 2.72Å; A297-Y300 WeakPolarHBondContact O-CB 3.24Å; A297-Y300 PolarHBondContact O-N 3.07Å; A297-Y300 VanDerWaalsContact O-N 3.17Å; A297-H301 PolarHBondContact O-CD2 3.41Å; A297-H301 PolarHBondContact O-N 2.78Å; A297-H301 VanDerWaalsContact O-N 3.1Å
298	M	84.8	Confident	78.7	Confident	75 Å²	75	67 Å²	67	37%	0.369	35%	0.346	S	S	.	.	H	α-helix	trans	-61	-41.8	176.2	-68.2	-177.3	95.2	0	0	111.6	V275 L294 I295 Y300 H301 L302	V275-M298 HydrophobicContact CG2-CE 4.45Å; L294-M298 HydrophobicContact CD1-CG 4.49Å; L294-M298 HydrophobicContact CG-SD 4.38Å; L294-M298 WeakPolarHBondContact O-CG 3.39Å; L294-M298 PolarHBondContact O-N 3.07Å; I295-M298 PolarHBondContact O-N 2.83Å; M298-Y300 VanDerWaalsContact C-N 3.32Å; M298-Y300 PolarHBondContact O-N 2.77Å; M298-H301 PolarHBondContact O-N 3.5Å; M298-L302 WeakPolarHBondContact O-CG 3.49Å; M298-L302 PolarHBondContact O-N 3.2Å
299	K	84.3	Confident	77.5	Confident	129 Å²	129	66.9 Å²	66.9	56%	0.561	34%	0.342	S	S	*	.	H	α-helix	trans	-61.8	-38.5	175.3	-174.6	-179.6	179.6	-176.7	0	112.1	I295 E296 A297 L302 L303 I311	I295-K299 VanDerWaalsContact O-CB 3.25Å; I295-K299 WeakPolarHBondContact O-CB 3.38Å; I295-K299 PolarHBondContact O-N 3.48Å; E296-K299 PolarHBondContact O-N 3.12Å; A297-K299 VanDerWaalsContact C-N 3.33Å; A297-K299 PolarHBondContact O-N 2.72Å; K299-L302 PolarHBondContact O-N 3.36Å; K299-L303 PolarHBondContact O-N 2.9Å; K299-I311 HydrophobicContact CD-CD1 4.38Å; K299-I311 HydrophobicContact CG-CD1 4.29Å
300	Y	81.2	Confident	76.2	Confident	34 Å²	34	69.3 Å²	69.3	13%	0.133	35%	0.352	C	S	.	.	H	α-helix	trans	-63.6	-39.9	175.4	-178.6	-98.6	0	0	0	112.7	P267 E296 A297 M298 L303 R308 I311 T316	P267-Y300 HydrophobicContact CB-CD1 3.62Å; P267-Y300 HydrophobicContact CB-CD2 4.38Å; P267-Y300 HydrophobicContact CB-CE1 4.14Å; P267-Y300 HydrophobicContact CB-CG 3.75Å; P267-Y300 WeakPolarHBondContact O-CD1 3.3Å; P267-Y300 WeakPolarHBondContact O-CE1 3.4Å; E296-Y300 PolarHBondContact O-N 3.07Å; A297-Y300 WeakPolarHBondContact O-CB 3.24Å; A297-Y300 PolarHBondContact O-N 3.07Å; A297-Y300 VanDerWaalsContact O-N 3.17Å; M298-Y300 VanDerWaalsContact C-N 3.32Å; M298-Y300 PolarHBondContact O-N 2.77Å; Y300-L303 PolarHBondContact O-N 2.86Å; Y300-R308 HydrophobicContact CD2-CB 4.39Å; Y300-R308 HydrophobicContact CD2-CG 4.4Å; Y300-R308 HydrophobicContact CE2-CB 3.69Å; Y300-R308 HydrophobicContact CE2-CG 4.04Å; Y300-I311 HydrophobicContact CD2-CB 4.5Å; Y300-T316 HydrophobicContact CD2-CG2 3.61Å; Y300-T316 HydrophobicContact CE2-CG2 3.73Å; Y300-T316 HydrophobicContact CG-CG2 4.31Å
301	H	79.4	Confident	75.4	Confident	50 Å²	50	70.8 Å²	70.8	23%	0.231	36%	0.359	C	S	.	.	H	α-helix	trans	-71.3	-27.9	174.2	-68.9	-65.9	0	0	0	114.1	L269 L274 A297 M298 L303	L269-H301 PolarHBondContact O-CE1 2.59Å; L269-H301 PolarHBondContact O-NE2 3.24Å; L274-H301 VanDerWaalsContact CD1-CD2 3.47Å; L274-H301 WeakPolarHBondContact CD1-CD2 3.22Å; L274-H301 VanDerWaalsContact CD1-NE2 3.3Å; L274-H301 WeakPolarHBondContact CD1-NE2 3.44Å; A297-H301 PolarHBondContact O-CD2 3.41Å; A297-H301 PolarHBondContact O-N 2.78Å; A297-H301 VanDerWaalsContact O-N 3.1Å; M298-H301 PolarHBondContact O-N 3.5Å; H301-L303 VanDerWaalsContact C-N 3.3Å
302	L	80.3	Confident	74.4	Confident	149 Å²	149	75.5 Å²	75.5	78%	0.78	38%	0.38	S	S	*	.	H	α-helix	trans	-72.4	-20.9	175.1	-72.2	169.5	0	0	0	113.1	M298 K299	M298-L302 WeakPolarHBondContact O-CG 3.49Å; M298-L302 PolarHBondContact O-N 3.2Å; K299-L302 PolarHBondContact O-N 3.36Å
303	L	75.7	Confident	73.8	Confident	39 Å²	39	72.9 Å²	72.9	20%	0.204	37%	0.368	C	S	.	.	S	Bend	trans	-75.8	136.1	173.3	-71.3	175.9	0	0	0	111.3	K299 Y300 H301 R308 I311	K299-L303 PolarHBondContact O-N 2.9Å; Y300-L303 PolarHBondContact O-N 2.86Å; H301-L303 VanDerWaalsContact C-N 3.3Å; L303-R308 HydrophobicContact CB-CG 4.17Å; L303-R308 PolarHBondContact O-NE 2.81Å; L303-R308 VanDerWaalsContact O-NE 3.17Å; L303-R308 PolarHBondContact O-NH2 2.88Å; L303-I311 HydrophobicContact CD1-CD1 3.55Å; L303-I311 HydrophobicContact CD1-CG1 3.82Å
304	P	66.7	Low	73	Confident	63 Å²	63	77.9 Å²	77.9	41%	0.409	40%	0.395	S	S	.	.			trans	-63.8	153.1	171.5	31.2	-35.5	0	0	0	110.1	D306 Q307 R308	P304-D306 VanDerWaalsContact C-OD1 3.28Å; P304-D306 WeakPolarHBondContact CB-OD1 3.44Å; P304-D306 VanDerWaalsContact CG-OD1 3.28Å; P304-D306 WeakPolarHBondContact CG-OD1 3.32Å; P304-D306 PolarHBondContact O-N 2.76Å; P304-Q307 HydrophobicContact CG-CB 4.15Å; P304-Q307 HydrophobicContact CG-CG 4.23Å; P304-Q307 PolarHBondContact O-N 3.06Å; P304-R308 PolarHBondContact O-N 3.03Å
305	A	57	Low	72.7	Confident	75 Å²	75	79 Å²	79	62%	0.62	40%	0.399	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.7	-32.2	-164.1	0	0	0	0	0	113.6	Q307	A305-Q307 VanDerWaalsContact C-N 3.29Å; A305-Q307 PolarHBondContact O-N 2.77Å
306	D	52.1	Low	72.3	Confident	103 Å²	103	74.8 Å²	74.8	55%	0.551	38%	0.377	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.3	-30.8	172.9	64.2	-41.9	0	0	0	113.1	P304 H309	P304-D306 VanDerWaalsContact C-OD1 3.28Å; P304-D306 WeakPolarHBondContact CB-OD1 3.44Å; P304-D306 VanDerWaalsContact CG-OD1 3.28Å; P304-D306 WeakPolarHBondContact CG-OD1 3.32Å; P304-D306 PolarHBondContact O-N 2.76Å; D306-H309 PolarHBondContact O-CE1 3.27Å; D306-H309 PolarHBondContact O-ND1 3.21Å
307	Q	59.5	Low	71.6	Confident	79 Å²	79	81 Å²	81	37%	0.369	40%	0.4	S	S	.	.	T	Hydrogen-bonded Turn	trans	-100.3	-6.5	-173.6	-73.5	167.4	43.2	0	0	114.7	P304 A305 H309 L310	P304-Q307 HydrophobicContact CG-CB 4.15Å; P304-Q307 HydrophobicContact CG-CG 4.23Å; P304-Q307 PolarHBondContact O-N 3.06Å; A305-Q307 VanDerWaalsContact C-N 3.29Å; A305-Q307 PolarHBondContact O-N 2.77Å; Q307-H309 PolarHBondContact O-N 2.81Å; Q307-H309 VanDerWaalsContact O-N 3.13Å; Q307-L310 HydrophobicContact CB-CD1 4.09Å; Q307-L310 HydrophobicContact CG-CD1 4.28Å; Q307-L310 VanDerWaalsContact O-CB 3.29Å; Q307-L310 WeakPolarHBondContact O-CB 3.44Å; Q307-L310 VanDerWaalsContact O-CG 3.3Å; Q307-L310 WeakPolarHBondContact O-CG 3.37Å; Q307-L310 PolarHBondContact O-N 3.06Å
308	R	65.2	Low	70.9	Confident	81 Å²	81	85.3 Å²	85.3	31%	0.306	43%	0.428	S	S	.	.	G	3₁₀ helix	trans	-59.2	-27	-179.2	-73	178.7	-172.4	168.1	2.1	113.8	Y300 L303 P304 L310 I311	Y300-R308 HydrophobicContact CD2-CB 4.39Å; Y300-R308 HydrophobicContact CD2-CG 4.4Å; Y300-R308 HydrophobicContact CE2-CB 3.69Å; Y300-R308 HydrophobicContact CE2-CG 4.04Å; L303-R308 HydrophobicContact CB-CG 4.17Å; L303-R308 PolarHBondContact O-NE 2.81Å; L303-R308 VanDerWaalsContact O-NE 3.17Å; L303-R308 PolarHBondContact O-NH2 2.88Å; P304-R308 PolarHBondContact O-N 3.03Å; R308-L310 PolarHBondContact O-N 3.07Å; R308-L310 VanDerWaalsContact O-N 3.11Å; R308-I311 PolarHBondContact O-N 3.41Å
309	H	61.7	Low	70.3	Confident	115 Å²	115	83 Å²	83	53%	0.532	42%	0.415	S	S	.	.	G	3₁₀ helix	trans	-64.4	-10.4	175.8	74.3	-93.2	0	0	0	114.6	D306 Q307 K312	D306-H309 PolarHBondContact O-CE1 3.27Å; D306-H309 PolarHBondContact O-ND1 3.21Å; Q307-H309 PolarHBondContact O-N 2.81Å; Q307-H309 VanDerWaalsContact O-N 3.13Å; H309-K312 WeakPolarHBondContact O-CE 3.4Å; H309-K312 WeakPolarHBondContact O-CG 3.48Å
310	L	60.1	Low	69.4	Low	117 Å²	117	81.6 Å²	81.6	61%	0.613	42%	0.417	S	S	*	.	G	3₁₀ helix	trans	-78.3	-24.7	177.1	-62.4	173.4	0	0	0	112.7	Q307 R308	Q307-L310 HydrophobicContact CB-CD1 4.09Å; Q307-L310 HydrophobicContact CG-CD1 4.28Å; Q307-L310 VanDerWaalsContact O-CB 3.29Å; Q307-L310 WeakPolarHBondContact O-CB 3.44Å; Q307-L310 VanDerWaalsContact O-CG 3.3Å; Q307-L310 WeakPolarHBondContact O-CG 3.37Å; Q307-L310 PolarHBondContact O-N 3.06Å; R308-L310 PolarHBondContact O-N 3.07Å; R308-L310 VanDerWaalsContact O-N 3.11Å
311	I	68.8	Low	68.5	Low	32 Å²	32	82.5 Å²	82.5	16%	0.164	43%	0.427	C	S	.	.			trans	-95.7	98	171.8	-55.5	-177.8	0	0	0	108.1	K299 Y300 L303 R308 T313 T316	K299-I311 HydrophobicContact CD-CD1 4.38Å; K299-I311 HydrophobicContact CG-CD1 4.29Å; Y300-I311 HydrophobicContact CD2-CB 4.5Å; L303-I311 HydrophobicContact CD1-CD1 3.55Å; L303-I311 HydrophobicContact CD1-CG1 3.82Å; R308-I311 PolarHBondContact O-N 3.41Å; I311-T313 HydrophobicContact CG2-CG2 4.34Å; I311-T316 HydrophobicContact CB-CG2 4.42Å; I311-T316 HydrophobicContact CG2-CG2 3.88Å; I311-T316 PolarHBondContact O-OG1 3.38Å
312	K	65.5	Low	67.3	Low	176 Å²	176	83.9 Å²	83.9	77%	0.765	44%	0.439	S	S	*	.			trans	-105.1	88.7	176.6	-63.1	-174.7	-177	179.1	0	109.9	H309	H309-K312 WeakPolarHBondContact O-CE 3.4Å; H309-K312 WeakPolarHBondContact O-CG 3.48Å
313	T	74.5	Confident	66.2	Low	43 Å²	43	79.8 Å²	79.8	26%	0.264	42%	0.422	S	S	.	.			trans	-120.3	159.2	167.5	62.4	0	0	0	0	107.9	E296 I311 R315 T316	E296-T313 WeakPolarHBondContact OE1-CB 3.36Å; E296-T313 WeakPolarHBondContact OE1-CG2 3.37Å; E296-T313 PolarHBondContact OE1-OG1 2.95Å; I311-T313 HydrophobicContact CG2-CG2 4.34Å; T313-R315 PolarHBondContact O-N 3.02Å; T313-R315 VanDerWaalsContact O-N 3.14Å; T313-T316 PolarHBondContact N-OG1 3.23Å; T313-T316 PolarHBondContact O-N 2.84Å; T313-T316 PolarHBondContact O-OG1 3.2Å
314	D	70.8	Confident	65.7	Low	127 Å²	127	80.1 Å²	80.1	68%	0.679	42%	0.424	S	S	*	.	G	3₁₀ helix	trans	-62.6	-24.8	-179.9	-59.4	-49.6	0	0	0	112	T316 R317	D314-T316 VanDerWaalsContact C-N 3.34Å; D314-T316 PolarHBondContact O-N 2.9Å; D314-R317 PolarHBondContact O-N 2.92Å
315	R	82.1	Confident	66.2	Low	37 Å²	37	78.8 Å²	78.8	14%	0.14	42%	0.415	C	S	.	.	G	3₁₀ helix	trans	-71.1	-16.6	172.5	-69.5	-178.7	-67.4	-77.7	-0.6	114.9	E262 V264 R265 P267 E296 T313	E262-R315 WeakPolarHBondContact O-CD 3.46Å; E262-R315 WeakPolarHBondContact O-CG 3.32Å; E262-R315 PolarHBondContact O-NH1 2.82Å; V264-R315 WeakPolarHBondContact O-CD 3.38Å; R265-R315 WeakPolarHBondContact CB-O 3.13Å; P267-R315 WeakPolarHBondContact CD-O 3.48Å; P267-R315 HydrophobicContact CG-CB 4.19Å; E296-R315 IonicContact OE1-NE 2.92Å; E296-R315 IonicContact OE1-NH2 2.73Å; E296-R315 IonicContact OE2-CZ 3.01Å; E296-R315 VanDerWaalsContact OE2-CZ 3.27Å; E296-R315 IonicContact OE2-NE 3.24Å; E296-R315 PolarHBondContact OE2-NE 3.39Å; E296-R315 IonicContact OE2-NH2 2.68Å; E296-R315 PolarHBondContact OE2-NH2 3.38Å; T313-R315 PolarHBondContact O-N 3.02Å; T313-R315 VanDerWaalsContact O-N 3.14Å
316	T	77.9	Confident	67.6	Low	13 Å²	13	78.5 Å²	78.5	8%	0.08	40%	0.4	C	S	.	.	G	3₁₀ helix	trans	-93.7	-1.8	175.2	59.2	0	0	0	0	113.8	P267 Y300 I311 T313 D314	P267-T316 HydrophobicContact CB-CG2 3.89Å; P267-T316 HydrophobicContact CG-CG2 3.92Å; Y300-T316 HydrophobicContact CD2-CG2 3.61Å; Y300-T316 HydrophobicContact CE2-CG2 3.73Å; Y300-T316 HydrophobicContact CG-CG2 4.31Å; I311-T316 HydrophobicContact CB-CG2 4.42Å; I311-T316 HydrophobicContact CG2-CG2 3.88Å; I311-T316 PolarHBondContact O-OG1 3.38Å; T313-T316 PolarHBondContact N-OG1 3.23Å; T313-T316 PolarHBondContact O-N 2.84Å; T313-T316 PolarHBondContact O-OG1 3.2Å; D314-T316 VanDerWaalsContact C-N 3.34Å; D314-T316 PolarHBondContact O-N 2.9Å
317	R	71.8	Confident	69.6	Low	165 Å²	165	73.7 Å²	73.7	62%	0.623	38%	0.375	S	S	*	.	S	Bend	trans	-100.2	122.4	-179	-54.9	-178.9	81.7	-172.2	2.2	110.1	R265 D314	R265-R317 VanDerWaalsContact CD-O 3.31Å; R265-R317 WeakPolarHBondContact CD-O 3.37Å; R265-R317 PolarHBondContact NH1-O 2.67Å; D314-R317 PolarHBondContact O-N 2.92Å
318	P	68.8	Low	71.4	Confident	90 Å²	90	70 Å²	70	58%	0.584	36%	0.357	S	S	*	.	P	Polyproline II helix	trans	-54.8	147.7	174.1	-26.9	35.8	0	0	0	112.7	L268	L268-P318 HydrophobicContact CD1-CB 4.34Å; L268-P318 HydrophobicContact CD1-CG 4.3Å; L268-P318 HydrophobicContact CD2-CG 4.44Å
319	R	73.9	Confident	72.9	Confident	27 Å²	27	66.2 Å²	66.2	10%	0.102	34%	0.343	C	S	.	.	P	Polyproline II helix	trans	-61	141.8	171.3	-70.2	-174.7	-165	-91.1	-3.1	109.3	I225 S227 E235 H263 P321	I225-R319 PolarHBondContact O-NH1 3.06Å; I225-R319 PolarHBondContact O-NH2 2.67Å; S227-R319 PolarHBondContact O-NH1 2.9Å; E235-R319 IonicContact OE1-CZ 3.53Å; E235-R319 IonicContact OE1-NE 2.59Å; E235-R319 IonicContact OE1-NH2 2.78Å; E235-R319 PolarHBondContact OE1-NH2 3.31Å; E235-R319 IonicContact OE2-CZ 2.8Å; E235-R319 IonicContact OE2-NE 2.98Å; E235-R319 PolarHBondContact OE2-NE 3.38Å; E235-R319 IonicContact OE2-NH2 3.21Å; E235-R319 PolarHBondContact OE2-NH2 3.28Å; H263-R319 PolarHBondContact O-NH2 3.05Å; R319-P321 WeakPolarHBondContact O-CD 3.16Å
320	T	64.7	Low	74.7	Confident	99 Å²	99	60.7 Å²	60.7	61%	0.607	32%	0.318	S	S	*	.			trans	-111.9	78.6	171	55.4	0	0	0	0	107.1	D228	D228-T320 CarbonylContact O-C 3.45Å; D228-T320 PolarHBondContact O-N 2.69Å; D228-T320 VanDerWaalsContact O-O 3.06Å
321	P	61.2	Low	76.5	Confident	53 Å²	53	55.4 Å²	55.4	34%	0.344	29%	0.29	S	S	.	.			trans	-49.5	147.4	172.2	19.9	-31.1	0	0	0	109.7	R229 R319 S323	R229-P321 WeakPolarHBondContact O-CA 3.41Å; R319-P321 WeakPolarHBondContact O-CD 3.16Å; P321-S323 PolarHBondContact O-N 3.13Å
322	V	55.4	Low	77.9	Confident	78 Å²	78	53.9 Å²	53.9	47%	0.473	28%	0.282	S	S	.	.			trans	-64.1	96.2	162.1	176.3	0	0	0	0	104.7	R229 I324	R229-V322 HydrophobicContact CB-CG2 4.21Å; R229-V322 HydrophobicContact CG-CG2 3.87Å; V322-I324 PolarHBondContact O-N 3.03Å; V322-I324 VanDerWaalsContact O-N 3.08Å
323	S	57.3	Low	79.5	Confident	63 Å²	63	45.5 Å²	45.5	44%	0.441	25%	0.246	S	C	.	.			trans	-51.8	123.6	175.7	55.5	0	0	0	0	106.2	P321	P321-S323 PolarHBondContact O-N 3.13Å
324	I	64.8	Low	80.5	Confident	47 Å²	47	44.9 Å²	44.9	24%	0.241	24%	0.24	C	C	.	.			trans	-44	122.8	166	-60.2	170.6	0	0	0	105	V322 K326 D609 K610	V322-I324 PolarHBondContact O-N 3.03Å; V322-I324 VanDerWaalsContact O-N 3.08Å; I324-K326 PolarHBondContact O-N 3.4Å; I324-K326 VanDerWaalsContact O-N 3.17Å; I324-D609 HydrophobicContact CB-CB 3.93Å; I324-D609 HydrophobicContact CG2-CB 3.87Å; I324-K610 WeakPolarHBondContact CG2-O 3.46Å
325	P	77.6	Confident	81.6	Confident	34 Å²	34	40.4 Å²	40.4	22%	0.221	22%	0.221	C	C	.	.			trans	-52.9	130.1	-169.9	18.1	-30.3	0	0	0	108.3	Q348 K610	P325-Q348 VanDerWaalsContact CB-CD 3.43Å; P325-Q348 HydrophobicContact CB-CG 4.03Å; P325-K610 HydrophobicContact CG-CB 4.08Å; P325-K610 HydrophobicContact CG-CD 4.05Å; P325-K610 WeakPolarHBondContact O-CA 3.36Å; P325-K610 WeakPolarHBondContact O-CB 3.4Å; P325-K610 PolarHBondContact O-N 3.28Å
326	K	86.9	Confident	81.9	Confident	69 Å²	69	43.7 Å²	43.7	30%	0.3	25%	0.246	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.4	151.6	-174.2	-71.5	177.2	-175.7	-64.7	0	110.4	I324 F347 I560 V607 I608 D609	I324-K326 PolarHBondContact O-N 3.4Å; I324-K326 VanDerWaalsContact O-N 3.17Å; K326-F347 VanDerWaalsContact O-CD2 3.28Å; K326-F347 WeakPolarHBondContact O-CD2 3.5Å; K326-I560 HydrophobicContact CB-CD1 3.55Å; K326-I560 HydrophobicContact CB-CG1 4.4Å; K326-I560 HydrophobicContact CD-CD1 4.28Å; K326-I560 HydrophobicContact CD-CG1 4.25Å; K326-V607 HydrophobicContact CB-CG1 3.86Å; K326-V607 HydrophobicContact CD-CG1 3.93Å; K326-V607 HydrophobicContact CG-CG1 4.24Å; K326-I608 CarbonylContact C-O 3.59Å; K326-I608 WeakPolarHBondContact CA-O 3.38Å; K326-D609 WeakPolarHBondContact CG-OD1 3.17Å; K326-D609 IonicContact NZ-OD1 3.21Å; K326-D609 PolarHBondContact NZ-OD1 3.48Å
327	V	93.5	Very high	82.6	Confident	3 Å²	3	50.1 Å²	50.1	2%	0.018	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	150.6	172.6	-62.8	0	0	0	0	110.7	I329 Y345 D346 V607 I608 K610	V327-I329 HydrophobicContact CG2-CD1 4Å; V327-Y345 WeakPolarHBondContact CA-O 3.33Å; V327-D346 HydrophobicContact CG1-CB 4.47Å; V327-V607 WeakPolarHBondContact O-CA 3.4Å; V327-I608 HydrophobicContact CG2-CD1 4.15Å; V327-I608 HydrophobicContact CG2-CG1 3.55Å; V327-I608 PolarHBondContact N-O 3.46Å; V327-I608 PolarHBondContact O-N 2.77Å; V327-K610 HydrophobicContact CG1-CB 3.87Å; V327-K610 HydrophobicContact CG1-CD 4.34Å; V327-K610 HydrophobicContact CG1-CG 4.01Å
328	M	96.6	Very high	83.9	Confident	0 Å²	0	42.4 Å²	42.4	0%	0	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	116.3	-179.5	169.8	179.3	64.5	0	0	109.6	V330 C344 Y345 F347 W352 I567 V605	M328-V330 HydrophobicContact CG-CG2 4.36Å; M328-C344 CarbonylContact O-C 3.59Å; M328-C344 WeakPolarHBondContact O-CA 3.33Å; M328-Y345 HydrophobicContact CE-CD1 3.88Å; M328-Y345 HydrophobicContact CE-CG 3.96Å; M328-Y345 PolarHBondContact N-O 2.71Å; M328-Y345 PolarHBondContact O-N 3.33Å; M328-F347 HydrophobicContact CB-CE2 3.5Å; M328-F347 HydrophobicContact CB-CZ 3.65Å; M328-F347 HydrophobicContact CE-CZ 4.31Å; M328-F347 HydrophobicContact SD-CZ 4.31Å; M328-W352 HydrophobicContact CE-CH2 3.68Å; M328-W352 HydrophobicContact CE-CZ2 4.11Å; M328-W352 HydrophobicContact CE-CZ3 4.49Å; M328-I567 HydrophobicContact CE-CG1 4.12Å; M328-I567 HydrophobicContact SD-CD1 3.66Å; M328-I567 HydrophobicContact SD-CG1 3.47Å; M328-I567 WeakPolarHBondContact SD-CG1 3.36Å; M328-V605 HydrophobicContact CG-CG1 3.68Å; M328-V605 HydrophobicContact SD-CG1 4.1Å
329	I	97.9	Very high	85.2	Confident	2 Å²	2	39.9 Å²	39.9	1%	0.01	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.3	122.6	-179.5	-49.6	-57.9	0	0	0	109.3	V327 V331 V342 E343 C344 V374 V605 A606 I608	V327-I329 HydrophobicContact CG2-CD1 4Å; I329-V331 HydrophobicContact CG2-CG2 3.78Å; I329-V342 HydrophobicContact CG2-CG1 3.43Å; I329-V342 VanDerWaalsContact CG2-CG1 3.43Å; I329-E343 CarbonylContact C-O 3.57Å; I329-C344 HydrophobicContact CD1-CB 3.73Å; I329-C344 VanDerWaalsContact CD1-SG 3.53Å; I329-V374 HydrophobicContact CB-CG2 4.44Å; I329-V374 HydrophobicContact CG1-CG2 4.29Å; I329-V605 WeakPolarHBondContact O-CA 3.41Å; I329-A606 PolarHBondContact N-O 3.35Å; I329-A606 PolarHBondContact O-N 3.23Å; I329-I608 HydrophobicContact CD1-CD1 4.04Å; I329-I608 HydrophobicContact CD1-CG1 4.31Å; I329-I608 HydrophobicContact CG1-CD1 3.81Å; I329-I608 HydrophobicContact CG1-CG1 3.9Å
330	V	98.4	Very high	86.4	Confident	0 Å²	0	43.3 Å²	43.3	0%	0	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	106.1	178.8	-173.4	0	0	0	0	109.1	M328 V342 E343 W352 I567 M596 A603 V605	M328-V330 HydrophobicContact CG-CG2 4.36Å; V330-V342 WeakPolarHBondContact O-CA 3.43Å; V330-E343 HydrophobicContact CB-CB 4.49Å; V330-E343 PolarHBondContact N-O 3.09Å; V330-E343 PolarHBondContact O-N 3.06Å; V330-W352 HydrophobicContact CB-CZ3 4.4Å; V330-W352 HydrophobicContact CG2-CH2 3.78Å; V330-W352 HydrophobicContact CG2-CZ3 3.62Å; V330-I567 HydrophobicContact CG1-CG2 4.19Å; V330-I567 HydrophobicContact CG2-CG2 3.9Å; V330-M596 HydrophobicContact CG1-SD 3.95Å; V330-M596 HydrophobicContact CG2-SD 4.41Å; V330-A603 HydrophobicContact CG1-CB 3.83Å; V330-V605 HydrophobicContact CB-CG2 4.49Å; V330-V605 HydrophobicContact CG1-CG2 4.21Å; V330-V605 HydrophobicContact CG2-CG2 4.13Å
331	V	98.6	Very high	88	Confident	6 Å²	6	39.6 Å²	39.6	4%	0.036	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.5	113.8	-166.5	179.3	0	0	0	0	111	I329 V342 L358 V367 V374 A376 W399 G604	I329-V331 HydrophobicContact CG2-CG2 3.78Å; V331-V342 HydrophobicContact CG1-CG2 4.49Å; V331-V342 HydrophobicContact CG2-CG1 4.1Å; V331-L358 HydrophobicContact CG1-CD1 3.79Å; V331-L358 HydrophobicContact CG1-CD2 3.87Å; V331-L358 HydrophobicContact CG1-CG 4.03Å; V331-V367 HydrophobicContact CB-CG1 4.26Å; V331-V367 HydrophobicContact CB-CG2 4.06Å; V331-V367 HydrophobicContact CG1-CG2 4.26Å; V331-V367 HydrophobicContact CG2-CG1 3.93Å; V331-V374 HydrophobicContact CG2-CG1 4.06Å; V331-A376 HydrophobicContact CG1-CB 4.16Å; V331-W399 HydrophobicContact CG1-CH2 3.87Å; V331-W399 HydrophobicContact CG1-CZ2 4.14Å; V331-W399 HydrophobicContact CG2-CH2 4.22Å; V331-W399 HydrophobicContact CG2-CZ2 4.41Å; V331-G604 PolarHBondContact N-O 2.86Å; V331-G604 PolarHBondContact O-N 2.96Å
332	G	98.1	Very high	89.7	Confident	0 Å²	0	37.1 Å²	37.1	0%	0	20%	0.201	C	C	.	.			trans	61.1	-136.6	172.5	0	0	0	0	0	113.3	S341 R600 A603	G332-S341 WeakPolarHBondContact CA-O 3.36Å; G332-S341 PolarHBondContact N-O 3.1Å; G332-S341 VanDerWaalsContact N-O 3.09Å; G332-R600 PolarHBondContact O-NH1 3.41Å; G332-A603 WeakPolarHBondContact O-CB 3.32Å
333	G	97.8	Very high	91.8	Very high	0 Å²	0	33.4 Å²	33.4	0%	0	18%	0.178	C	C	.	.			trans	109.8	-167.4	-179.4	0	0	0	0	0	113.5	A338 I339 R362 C363 S601	G333-A338 WeakPolarHBondContact O-CA 3.19Å; G333-I339 WeakPolarHBondContact O-CG1 3.41Å; G333-I339 PolarHBondContact O-N 3.12Å; G333-R362 PolarHBondContact N-O 2.85Å; G333-C363 VanDerWaalsContact C-CB 3.43Å; G333-C363 WeakPolarHBondContact O-CB 3.49Å; G333-S601 CarbonylContact C-O 3.53Å; G333-S601 WeakPolarHBondContact CA-O 3.18Å
334	Q	97.1	Very high	93.6	Very high	30 Å²	30	31 Å²	31	14%	0.14	16%	0.162	C	C	.	.	B	Isolated β-bridge	trans	-109.9	121.1	-179.9	-70.6	-159.4	-121.2	0	0	110.9	P336 K337 C363 R364 N575 R600 S601 Y602	Q334-P336 PolarHBondContact NE2-O 2.84Å; Q334-K337 WeakPolarHBondContact CA-O 3.11Å; Q334-C363 HydrophobicContact CG-CB 3.61Å; Q334-R364 VanDerWaalsContact OE1-CZ 3.25Å; Q334-N575 PolarHBondContact O-ND2 2.93Å; Q334-R600 WeakPolarHBondContact O-CA 3.39Å; Q334-S601 PolarHBondContact N-O 2.82Å; Q334-S601 PolarHBondContact O-N 2.65Å; Q334-Y602 HydrophobicContact CG-CD2 4.42Å; Q334-Y602 VanDerWaalsContact OE1-CD2 3.26Å
335	A	93.6	Very high	95.1	Very high	33 Å²	33	29.4 Å²	29.4	27%	0.273	15%	0.152	S	C	.	.	S	Bend	trans	-147.5	71.2	176.4	0	0	0	0	0	112.8	K337 I339	A335-K337 PolarHBondContact N-O 2.76Å; A335-I339 HydrophobicContact CB-CD1 4.17Å; A335-I339 HydrophobicContact CB-CG2 4.2Å
336	P	87.9	Confident	95.7	Very high	105 Å²	105	28 Å²	28	68%	0.682	14%	0.143	S	C	*	.	S	Bend	cis	-83.4	-12.7	-20.1	34.7	-34.5	0	0	0	112.6	Q334	Q334-P336 PolarHBondContact NE2-O 2.84Å
337	K	93.8	Very high	95.7	Very high	149 Å²	149	26.8 Å²	26.8	65%	0.648	14%	0.138	S	C	*	.	S	Bend	trans	-88.1	170.1	170.3	-64.6	-175.9	-179.8	179.7	0	110.2	Q334 A335 I339	Q334-K337 WeakPolarHBondContact CA-O 3.11Å; A335-K337 PolarHBondContact N-O 2.76Å; K337-I339 PolarHBondContact O-N 3.05Å
338	A	97	Very high	95.2	Very high	2 Å²	2	33.4 Å²	33.4	2%	0.017	17%	0.169	C	C	.	.	B	Isolated β-bridge	trans	-63.2	133	178.2	0	0	0	0	0	111.1	G333 R361 C363 S382	G333-A338 WeakPolarHBondContact O-CA 3.19Å; A338-R361 HydrophobicContact CB-CB 4.17Å; A338-R361 WeakPolarHBondContact O-CD 3.38Å; A338-C363 HydrophobicContact CB-CB 4.06Å; A338-S382 VanDerWaalsContact CB-OG 3.25Å; A338-S382 WeakPolarHBondContact CB-OG 3.42Å; A338-S382 PolarHBondContact N-OG 2.98Å
339	I	97.7	Very high	94.5	Very high	38 Å²	38	37.9 Å²	37.9	20%	0.195	19%	0.189	C	C	.	.	B	Isolated β-bridge	trans	-111.1	168.6	-179.3	55.3	170	0	0	0	112.1	G333 A335 K337 R361 R362	G333-I339 WeakPolarHBondContact O-CG1 3.41Å; G333-I339 PolarHBondContact O-N 3.12Å; A335-I339 HydrophobicContact CB-CD1 4.17Å; A335-I339 HydrophobicContact CB-CG2 4.2Å; K337-I339 PolarHBondContact O-N 3.05Å; I339-R361 WeakPolarHBondContact O-CA 3.33Å; I339-R362 PolarHBondContact O-N 3.11Å
340	R	98.1	Very high	93.9	Very high	99 Å²	99	40.8 Å²	40.8	37%	0.374	21%	0.205	S	C	.	.			trans	-98.9	-28.8	172.9	-64.3	176.4	68.9	-142.2	4.7	113.1	V342 D357 L358 R361	R340-V342 PolarHBondContact O-N 3.24Å; R340-D357 VanDerWaalsContact C-OD1 3.24Å; R340-D357 HydrophobicContact CB-CB 4.31Å; R340-D357 WeakPolarHBondContact CB-OD2 3.35Å; R340-D357 IonicContact CZ-OD2 2.74Å; R340-D357 VanDerWaalsContact CZ-OD2 3.24Å; R340-D357 IonicContact NE-OD2 3.77Å; R340-D357 IonicContact NH1-OD2 3.57Å; R340-D357 PolarHBondContact NH1-OD2 3.44Å; R340-D357 IonicContact NH2-OD2 2.66Å; R340-L358 HydrophobicContact CB-CB 4.44Å; R340-L358 VanDerWaalsContact CZ-O 3.22Å; R340-L358 PolarHBondContact NE-O 2.98Å; R340-L358 PolarHBondContact NH2-O 3.26Å; R340-L358 WeakPolarHBondContact O-CB 3.44Å; R340-L358 PolarHBondContact O-N 3.22Å; R340-R361 HydrophobicContact CG-CB 4.43Å; R340-R361 HydrophobicContact CG-CG 3.76Å
341	S	98.1	Very high	93.4	Very high	21 Å²	21	47.6 Å²	47.6	15%	0.147	23%	0.231	C	C	.	.			trans	-51.2	130.4	-173.4	157.6	0	0	0	0	112.7	G332 Q354 D357 R600	G332-S341 WeakPolarHBondContact CA-O 3.36Å; G332-S341 PolarHBondContact N-O 3.1Å; G332-S341 VanDerWaalsContact N-O 3.09Å; S341-Q354 PolarHBondContact OG-NE2 2.76Å; S341-Q354 PolarHBondContact OG-OE1 2.9Å; S341-D357 WeakPolarHBondContact CA-OD1 3.31Å; S341-D357 PolarHBondContact N-OD1 2.95Å; S341-D357 VanDerWaalsContact N-OD1 3.12Å; S341-R600 PolarHBondContact O-NH1 2.75Å; S341-R600 PolarHBondContact OG-NH2 2.82Å
342	V	98.4	Very high	93.2	Very high	0 Å²	0	48.9 Å²	48.9	0%	0	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	119.4	173.3	-173.4	0	0	0	0	107	I329 V330 V331 R340 Q354 V355 A356 L358 W399	I329-V342 HydrophobicContact CG2-CG1 3.43Å; I329-V342 VanDerWaalsContact CG2-CG1 3.43Å; V330-V342 WeakPolarHBondContact O-CA 3.43Å; V331-V342 HydrophobicContact CG1-CG2 4.49Å; V331-V342 HydrophobicContact CG2-CG1 4.1Å; R340-V342 PolarHBondContact O-N 3.24Å; V342-Q354 PolarHBondContact O-OE1 2.92Å; V342-V355 HydrophobicContact CB-CG2 3.76Å; V342-V355 HydrophobicContact CG1-CG2 3.46Å; V342-V355 VanDerWaalsContact CG1-CG2 3.46Å; V342-V355 PolarHBondContact O-N 3.13Å; V342-V355 VanDerWaalsContact O-N 3.07Å; V342-A356 WeakPolarHBondContact CG2-O 3.39Å; V342-L358 HydrophobicContact CG2-CG 3.96Å; V342-W399 HydrophobicContact CG1-CZ2 4.48Å; V342-W399 HydrophobicContact CG2-CZ2 3.85Å
343	E	97.8	Very high	92.9	Very high	1 Å²	1	52.6 Å²	52.6	1%	0.005	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	134.8	178.1	-83.2	-179.2	-126.1	0	0	109.7	I329 V330 W352 Y353 Q354 S597 R600	I329-E343 CarbonylContact C-O 3.57Å; V330-E343 HydrophobicContact CB-CB 4.49Å; V330-E343 PolarHBondContact N-O 3.09Å; V330-E343 PolarHBondContact O-N 3.06Å; E343-W352 HydrophobicContact CB-CE3 3.8Å; E343-W352 HydrophobicContact CB-CZ3 4Å; E343-Y353 CarbonylContact C-O 3.57Å; E343-Y353 WeakPolarHBondContact CA-O 3.43Å; E343-Q354 PolarHBondContact OE1-NE2 2.92Å; E343-S597 WeakPolarHBondContact OE1-CB 3.3Å; E343-S597 PolarHBondContact OE1-OG 3.06Å; E343-S597 PolarHBondContact OE2-N 2.96Å; E343-R600 IonicContact OE1-CZ 3.27Å; E343-R600 IonicContact OE1-NE 2.76Å; E343-R600 IonicContact OE1-NH2 2.9Å; E343-R600 PolarHBondContact OE1-NH2 2.89Å
344	C	96.8	Very high	92.8	Very high	13 Å²	13	57.6 Å²	57.6	9%	0.088	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	124.9	175.2	177.5	0	0	0	0	108.4	M328 I329 W352 Y353 V355	M328-C344 CarbonylContact O-C 3.59Å; M328-C344 WeakPolarHBondContact O-CA 3.33Å; I329-C344 HydrophobicContact CD1-CB 3.73Å; I329-C344 VanDerWaalsContact CD1-SG 3.53Å; C344-W352 CarbonylContact O-C 3.44Å; C344-W352 WeakPolarHBondContact O-CA 3.34Å; C344-Y353 PolarHBondContact N-O 2.63Å; C344-Y353 PolarHBondContact O-N 2.77Å; C344-V355 HydrophobicContact CB-CG1 3.59Å; C344-V355 HydrophobicContact CB-CG2 4.46Å
345	Y	96.3	Very high	92.7	Very high	12 Å²	12	57.4 Å²	57.4	5%	0.047	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	123.5	172	-179.8	-103.3	0	0	0	110.4	V327 M328 F347 D350 W352 I592 T594	V327-Y345 WeakPolarHBondContact CA-O 3.33Å; M328-Y345 HydrophobicContact CE-CD1 3.88Å; M328-Y345 HydrophobicContact CE-CG 3.96Å; M328-Y345 PolarHBondContact N-O 2.71Å; M328-Y345 PolarHBondContact O-N 3.33Å; Y345-F347 AromaticContact CD1-CD1 3.95Å; Y345-F347 HydrophobicContact CD1-CD1 3.95Å; Y345-F347 AromaticContact CD1-CD2 3.94Å; Y345-F347 HydrophobicContact CD1-CD2 3.94Å; Y345-F347 AromaticContact CD1-CE1 3.89Å; Y345-F347 HydrophobicContact CD1-CE1 3.89Å; Y345-F347 AromaticContact CD1-CE2 3.93Å; Y345-F347 HydrophobicContact CD1-CE2 3.93Å; Y345-F347 AromaticContact CD1-CG 3.97Å; Y345-F347 HydrophobicContact CD1-CG 3.97Å; Y345-F347 AromaticContact CD1-CZ 3.89Å; Y345-F347 HydrophobicContact CD1-CZ 3.89Å; Y345-F347 HydrophobicContact CE1-CB 4.39Å; Y345-F347 AromaticContact CE1-CD1 3.56Å; Y345-F347 HydrophobicContact CE1-CD1 3.56Å; Y345-F347 HydrophobicContact CE1-CD2 4.27Å; Y345-F347 AromaticContact CE1-CE1 3.8Å; Y345-F347 HydrophobicContact CE1-CE1 3.8Å; Y345-F347 AromaticContact CE1-CG 3.81Å; Y345-F347 HydrophobicContact CE1-CG 3.81Å; Y345-F347 HydrophobicContact CE1-CZ 4.28Å; Y345-D350 PolarHBondContact OH-OD1 3.03Å; Y345-D350 VanDerWaalsContact OH-OD1 3.05Å; Y345-W352 AromaticContact CD2-CD1 3.85Å; Y345-W352 AromaticContact CD2-CD2 3.81Å; Y345-W352 HydrophobicContact CD2-CD2 3.81Å; Y345-W352 AromaticContact CD2-CE2 3.51Å; Y345-W352 HydrophobicContact CD2-CE3 4.43Å; Y345-W352 HydrophobicContact CD2-CG 4.05Å; Y345-W352 AromaticContact CD2-CZ2 3.97Å; Y345-W352 HydrophobicContact CD2-CZ2 3.97Å; Y345-W352 AromaticContact CD2-NE1 3.5Å; Y345-W352 AromaticContact CE2-NE1 3.92Å; Y345-W352 HydrophobicContact CG-CD2 4.34Å; Y345-W352 HydrophobicContact CG-CH2 4.44Å; Y345-W352 HydrophobicContact CG-CZ2 4.15Å; Y345-I592 HydrophobicContact CD2-CD1 4.42Å; Y345-I592 HydrophobicContact CE2-CD1 3.96Å; Y345-T594 WeakPolarHBondContact CE2-OG1 3.5Å
346	D	89.1	Confident	92.9	Very high	4 Å²	4	56.8 Å²	56.8	2%	0.021	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.8	121.9	172.3	-167.8	-61	0	0	0	110.6	V327 Q348 E349 D350 R351 Y353 K610	V327-D346 HydrophobicContact CG1-CB 4.47Å; D346-Q348 WeakPolarHBondContact OD1-CA 3.33Å; D346-Q348 WeakPolarHBondContact OD1-CB 3.47Å; D346-Q348 PolarHBondContact OD1-N 2.93Å; D346-E349 HydrophobicContact CB-CB 4.09Å; D346-E349 HydrophobicContact CB-CG 4.49Å; D346-E349 PolarHBondContact OD1-N 3.35Å; D346-D350 WeakPolarHBondContact O-CA 3.33Å; D346-D350 PolarHBondContact O-N 3.05Å; D346-R351 PolarHBondContact N-O 2.7Å; D346-R351 PolarHBondContact O-N 3.18Å; D346-Y353 HydrophobicContact CB-CD2 4.47Å; D346-Y353 HydrophobicContact CB-CE2 4.17Å; D346-K610 WeakPolarHBondContact OD2-CD 3.49Å; D346-K610 WeakPolarHBondContact OD2-CE 3.21Å; D346-K610 IonicContact OD2-NZ 2.7Å; D346-K610 PolarHBondContact OD2-NZ 3.36Å
347	F	86.6	Confident	93.4	Very high	45 Å²	45	54.9 Å²	54.9	20%	0.197	25%	0.253	C	S	.	.	T	Hydrogen-bonded Turn	trans	-80.2	-17.3	-177.4	-67.1	-96.6	0	0	0	114	K326 M328 Y345 I560 Y565	K326-F347 VanDerWaalsContact O-CD2 3.28Å; K326-F347 WeakPolarHBondContact O-CD2 3.5Å; M328-F347 HydrophobicContact CB-CE2 3.5Å; M328-F347 HydrophobicContact CB-CZ 3.65Å; M328-F347 HydrophobicContact CE-CZ 4.31Å; M328-F347 HydrophobicContact SD-CZ 4.31Å; Y345-F347 AromaticContact CD1-CD1 3.95Å; Y345-F347 HydrophobicContact CD1-CD1 3.95Å; Y345-F347 AromaticContact CD1-CD2 3.94Å; Y345-F347 HydrophobicContact CD1-CD2 3.94Å; Y345-F347 AromaticContact CD1-CE1 3.89Å; Y345-F347 HydrophobicContact CD1-CE1 3.89Å; Y345-F347 AromaticContact CD1-CE2 3.93Å; Y345-F347 HydrophobicContact CD1-CE2 3.93Å; Y345-F347 AromaticContact CD1-CG 3.97Å; Y345-F347 HydrophobicContact CD1-CG 3.97Å; Y345-F347 AromaticContact CD1-CZ 3.89Å; Y345-F347 HydrophobicContact CD1-CZ 3.89Å; Y345-F347 HydrophobicContact CE1-CB 4.39Å; Y345-F347 AromaticContact CE1-CD1 3.56Å; Y345-F347 HydrophobicContact CE1-CD1 3.56Å; Y345-F347 HydrophobicContact CE1-CD2 4.27Å; Y345-F347 AromaticContact CE1-CE1 3.8Å; Y345-F347 HydrophobicContact CE1-CE1 3.8Å; Y345-F347 AromaticContact CE1-CG 3.81Å; Y345-F347 HydrophobicContact CE1-CG 3.81Å; Y345-F347 HydrophobicContact CE1-CZ 4.28Å; F347-I560 HydrophobicContact CD1-CD1 4.27Å; F347-I560 HydrophobicContact CD2-CD1 3.71Å; F347-I560 HydrophobicContact CE1-CD1 4.14Å; F347-I560 HydrophobicContact CE1-CG2 3.89Å; F347-I560 HydrophobicContact CE2-CD1 3.51Å; F347-I560 HydrophobicContact CG-CD1 4.08Å; F347-I560 HydrophobicContact CZ-CD1 3.76Å; F347-I560 HydrophobicContact CZ-CG2 3.83Å; F347-Y565 HydrophobicContact CD1-CE1 4.48Å; F347-Y565 HydrophobicContact CE1-CD1 4.25Å; F347-Y565 AromaticContact CE1-CE1 3.71Å; F347-Y565 HydrophobicContact CE1-CE1 3.71Å; F347-Y565 HydrophobicContact CE1-CE2 4.08Å; F347-Y565 AromaticContact CE1-CZ 3.63Å
348	Q	83.4	Confident	93.6	Very high	142 Å²	142	47.8 Å²	47.8	66%	0.664	22%	0.222	S	C	*	.	T	Hydrogen-bonded Turn	trans	-86.3	-37.2	174.3	-64.4	-170.7	-44.2	0	0	111.2	P325 D346	P325-Q348 VanDerWaalsContact CB-CD 3.43Å; P325-Q348 HydrophobicContact CB-CG 4.03Å; D346-Q348 WeakPolarHBondContact OD1-CA 3.33Å; D346-Q348 WeakPolarHBondContact OD1-CB 3.47Å; D346-Q348 PolarHBondContact OD1-N 2.93Å
349	E	82.5	Confident	93.6	Very high	93 Å²	93	51 Å²	51	44%	0.435	24%	0.243	S	C	.	.	T	Hydrogen-bonded Turn	trans	-91.9	-8.7	-177.5	-59.9	174.3	-154.5	0	0	113.5	D346 R351 Y353 K610	D346-E349 HydrophobicContact CB-CB 4.09Å; D346-E349 HydrophobicContact CB-CG 4.49Å; D346-E349 PolarHBondContact OD1-N 3.35Å; E349-R351 VanDerWaalsContact C-N 3.29Å; E349-R351 HydrophobicContact CB-CB 4.27Å; E349-R351 PolarHBondContact O-N 3.1Å; E349-Y353 WeakPolarHBondContact OE2-CE2 3.41Å; E349-Y353 VanDerWaalsContact OE2-CZ 3.31Å; E349-Y353 PolarHBondContact OE2-OH 2.93Å; E349-K610 IonicContact OE1-NZ 2.72Å; E349-K610 PolarHBondContact OE1-NZ 2.75Å
350	D	83.7	Confident	93.5	Very high	64 Å²	64	51.4 Å²	51.4	34%	0.342	25%	0.249	S	C	.	.	T	Hydrogen-bonded Turn	trans	50.3	49.7	-175.9	-175.2	6.4	0	0	0	111.4	Y345 D346 P593 T594	Y345-D350 PolarHBondContact OH-OD1 3.03Å; Y345-D350 VanDerWaalsContact OH-OD1 3.05Å; D346-D350 WeakPolarHBondContact O-CA 3.33Å; D346-D350 PolarHBondContact O-N 3.05Å; D350-P593 WeakPolarHBondContact OD1-CG 3.39Å; D350-P593 WeakPolarHBondContact OD2-CG 3.47Å; D350-T594 WeakPolarHBondContact O-CG2 3.44Å; D350-T594 PolarHBondContact O-OG1 3.24Å; D350-T594 WeakPolarHBondContact OD1-CG2 3.34Å; D350-T594 PolarHBondContact OD1-OG1 3.11Å
351	R	88.1	Confident	93.5	Very high	143 Å²	143	53.6 Å²	53.6	54%	0.54	26%	0.257	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.8	142.2	-168.5	-171.2	161.8	175.2	-158.5	4.1	113.9	D346 E349 Y353	D346-R351 PolarHBondContact N-O 2.7Å; D346-R351 PolarHBondContact O-N 3.18Å; E349-R351 VanDerWaalsContact C-N 3.29Å; E349-R351 HydrophobicContact CB-CB 4.27Å; E349-R351 PolarHBondContact O-N 3.1Å; R351-Y353 HydrophobicContact CB-CE2 4.04Å; R351-Y353 WeakPolarHBondContact CD-OH 3.06Å; R351-Y353 HydrophobicContact CG-CE1 4.28Å; R351-Y353 HydrophobicContact CG-CE2 4.03Å
352	W	94.5	Very high	93.5	Very high	33 Å²	33	52.9 Å²	52.9	13%	0.125	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.9	134.8	172.9	-66.5	92.7	0	0	0	111.8	M328 V330 E343 C344 Y345 V579 I592 T594 M596	M328-W352 HydrophobicContact CE-CH2 3.68Å; M328-W352 HydrophobicContact CE-CZ2 4.11Å; M328-W352 HydrophobicContact CE-CZ3 4.49Å; V330-W352 HydrophobicContact CB-CZ3 4.4Å; V330-W352 HydrophobicContact CG2-CH2 3.78Å; V330-W352 HydrophobicContact CG2-CZ3 3.62Å; E343-W352 HydrophobicContact CB-CE3 3.8Å; E343-W352 HydrophobicContact CB-CZ3 4Å; C344-W352 CarbonylContact O-C 3.44Å; C344-W352 WeakPolarHBondContact O-CA 3.34Å; Y345-W352 AromaticContact CD2-CD1 3.85Å; Y345-W352 AromaticContact CD2-CD2 3.81Å; Y345-W352 HydrophobicContact CD2-CD2 3.81Å; Y345-W352 AromaticContact CD2-CE2 3.51Å; Y345-W352 HydrophobicContact CD2-CE3 4.43Å; Y345-W352 HydrophobicContact CD2-CG 4.05Å; Y345-W352 AromaticContact CD2-CZ2 3.97Å; Y345-W352 HydrophobicContact CD2-CZ2 3.97Å; Y345-W352 AromaticContact CD2-NE1 3.5Å; Y345-W352 AromaticContact CE2-NE1 3.92Å; Y345-W352 HydrophobicContact CG-CD2 4.34Å; Y345-W352 HydrophobicContact CG-CH2 4.44Å; Y345-W352 HydrophobicContact CG-CZ2 4.15Å; W352-V579 HydrophobicContact CH2-CG2 4.28Å; W352-V579 HydrophobicContact CZ2-CG2 3.84Å; W352-I592 HydrophobicContact CZ2-CD1 4.13Å; W352-T594 PolarHBondContact NE1-O 2.79Å; W352-M596 HydrophobicContact CD2-CG 4.22Å; W352-M596 HydrophobicContact CE3-CG 4.18Å; W352-M596 HydrophobicContact CH2-CG 3.39Å; W352-M596 HydrophobicContact CH2-SD 4.07Å; W352-M596 HydrophobicContact CZ2-CG 3.46Å; W352-M596 VanDerWaalsContact CZ2-CG 3.46Å; W352-M596 HydrophobicContact CZ3-CG 3.78Å; W352-M596 HydrophobicContact CZ3-SD 4.44Å
353	Y	92.2	Very high	93.5	Very high	77 Å²	77	53 Å²	53	30%	0.302	25%	0.252	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	146.4	175.7	-65	-73.2	0	0	0	109.7	E343 C344 D346 E349 R351	E343-Y353 CarbonylContact C-O 3.57Å; E343-Y353 WeakPolarHBondContact CA-O 3.43Å; C344-Y353 PolarHBondContact N-O 2.63Å; C344-Y353 PolarHBondContact O-N 2.77Å; D346-Y353 HydrophobicContact CB-CD2 4.47Å; D346-Y353 HydrophobicContact CB-CE2 4.17Å; E349-Y353 WeakPolarHBondContact OE2-CE2 3.41Å; E349-Y353 VanDerWaalsContact OE2-CZ 3.31Å; E349-Y353 PolarHBondContact OE2-OH 2.93Å; R351-Y353 HydrophobicContact CB-CE2 4.04Å; R351-Y353 WeakPolarHBondContact CD-OH 3.06Å; R351-Y353 HydrophobicContact CG-CE1 4.28Å; R351-Y353 HydrophobicContact CG-CE2 4.03Å
354	Q	95.1	Very high	93.5	Very high	105 Å²	105	55.6 Å²	55.6	49%	0.491	26%	0.262	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.3	134	162.7	-64.7	-72.6	-33.2	0	0	107.6	S341 V342 E343	S341-Q354 PolarHBondContact OG-NE2 2.76Å; S341-Q354 PolarHBondContact OG-OE1 2.9Å; V342-Q354 PolarHBondContact O-OE1 2.92Å; E343-Q354 PolarHBondContact OE1-NE2 2.92Å
355	V	96.3	Very high	93.6	Very high	26 Å²	26	55.8 Å²	55.8	16%	0.158	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113	-175	170	-61.8	0	0	0	0	108.8	V342 C344 D357	V342-V355 HydrophobicContact CB-CG2 3.76Å; V342-V355 HydrophobicContact CG1-CG2 3.46Å; V342-V355 VanDerWaalsContact CG1-CG2 3.46Å; V342-V355 PolarHBondContact O-N 3.13Å; V342-V355 VanDerWaalsContact O-N 3.07Å; C344-V355 HydrophobicContact CB-CG1 3.59Å; C344-V355 HydrophobicContact CB-CG2 4.46Å; V355-D357 PolarHBondContact O-N 3.09Å
356	A	97.2	Very high	93.7	Very high	21 Å²	21	55.4 Å²	55.4	17%	0.174	26%	0.264	C	S	.	.	P	Polyproline II helix	trans	-52.4	125.1	-175.9	0	0	0	0	0	113	V342 Y392 D397 W399	V342-A356 WeakPolarHBondContact CG2-O 3.39Å; A356-Y392 HydrophobicContact CB-CE2 4.23Å; A356-D397 WeakPolarHBondContact CB-O 3.3Å; A356-D397 WeakPolarHBondContact CB-OD1 3.4Å; A356-D397 PolarHBondContact N-OD1 2.87Å; A356-W399 PolarHBondContact O-NE1 3.31Å
357	D	98.4	Very high	94.2	Very high	65 Å²	65	56 Å²	56	35%	0.348	27%	0.268	S	S	.	.	P	Polyproline II helix	trans	-57.5	136.9	175.3	-125.1	17.5	0	0	0	110.5	R340 S341 V355	R340-D357 VanDerWaalsContact C-OD1 3.24Å; R340-D357 HydrophobicContact CB-CB 4.31Å; R340-D357 WeakPolarHBondContact CB-OD2 3.35Å; R340-D357 IonicContact CZ-OD2 2.74Å; R340-D357 VanDerWaalsContact CZ-OD2 3.24Å; R340-D357 IonicContact NE-OD2 3.77Å; R340-D357 IonicContact NH1-OD2 3.57Å; R340-D357 PolarHBondContact NH1-OD2 3.44Å; R340-D357 IonicContact NH2-OD2 2.66Å; S341-D357 WeakPolarHBondContact CA-OD1 3.31Å; S341-D357 PolarHBondContact N-OD1 2.95Å; S341-D357 VanDerWaalsContact N-OD1 3.12Å; V355-D357 PolarHBondContact O-N 3.09Å
358	L	98.3	Very high	94.7	Very high	0 Å²	0	54.7 Å²	54.7	0%	0	26%	0.263	C	S	.	.	P	Polyproline II helix	trans	-51.4	146.7	172.4	-80.3	161.9	0	0	0	111.6	V331 R340 V342 S360 R362 A376 W399	V331-L358 HydrophobicContact CG1-CD1 3.79Å; V331-L358 HydrophobicContact CG1-CD2 3.87Å; V331-L358 HydrophobicContact CG1-CG 4.03Å; R340-L358 HydrophobicContact CB-CB 4.44Å; R340-L358 VanDerWaalsContact CZ-O 3.22Å; R340-L358 PolarHBondContact NE-O 2.98Å; R340-L358 PolarHBondContact NH2-O 3.26Å; R340-L358 WeakPolarHBondContact O-CB 3.44Å; R340-L358 PolarHBondContact O-N 3.22Å; V342-L358 HydrophobicContact CG2-CG 3.96Å; L358-S360 VanDerWaalsContact CB-O 3.29Å; L358-S360 WeakPolarHBondContact CB-O 3.45Å; L358-S360 PolarHBondContact O-N 3.28Å; L358-S360 VanDerWaalsContact O-N 3.1Å; L358-R362 HydrophobicContact CD1-CB 3.76Å; L358-A376 HydrophobicContact CD2-CB 4.13Å; L358-W399 HydrophobicContact CD2-CD2 4.08Å; L358-W399 HydrophobicContact CD2-CE3 4.05Å; L358-W399 HydrophobicContact CD2-CH2 3.6Å; L358-W399 HydrophobicContact CD2-CZ2 3.62Å; L358-W399 HydrophobicContact CD2-CZ3 3.81Å; L358-W399 HydrophobicContact CG-CZ2 4.14Å
359	P	97.4	Very high	95.2	Very high	69 Å²	69	49.7 Å²	49.7	45%	0.448	24%	0.244	S	C	.	.	S	Bend	trans	-56.3	-31.4	176.3	-26.6	35.3	0	0	0	113.5	D390 W399	P359-D390 HydrophobicContact CG-CB 4.41Å; P359-W399 HydrophobicContact CG-CB 3.67Å; P359-W399 HydrophobicContact CG-CG 4.3Å
360	S	95.3	Very high	95.5	Very high	47 Å²	47	45.8 Å²	45.8	33%	0.329	23%	0.227	S	C	.	.	S	Bend	trans	-139.6	159.2	177.2	63.5	0	0	0	0	111.7	L358 R362	L358-S360 VanDerWaalsContact CB-O 3.29Å; L358-S360 WeakPolarHBondContact CB-O 3.45Å; L358-S360 PolarHBondContact O-N 3.28Å; L358-S360 VanDerWaalsContact O-N 3.1Å; S360-R362 PolarHBondContact O-N 3.27Å
361	R	97.7	Very high	95.4	Very high	144 Å²	144	46.9 Å²	46.9	54%	0.543	24%	0.244	S	C	.	.			trans	-61.9	128.4	176.1	-69	173.6	-173.5	-143.4	3.4	109.2	A338 I339 R340 N381	A338-R361 HydrophobicContact CB-CB 4.17Å; A338-R361 WeakPolarHBondContact O-CD 3.38Å; I339-R361 WeakPolarHBondContact O-CA 3.33Å; R340-R361 HydrophobicContact CG-CB 4.43Å; R340-R361 HydrophobicContact CG-CG 3.76Å; R361-N381 WeakPolarHBondContact O-CA 3.15Å; R361-N381 WeakPolarHBondContact O-CB 3.21Å
362	R	98.3	Very high	95.1	Very high	7 Å²	7	42.2 Å²	42.2	3%	0.026	24%	0.241	C	C	.	.	B	Isolated β-bridge	trans	-144	133.4	-174.9	-158.5	-175.2	-78	-117.5	10.3	111	G333 I339 L358 S360 A365 A376 G378 T388 D390	G333-R362 PolarHBondContact N-O 2.85Å; I339-R362 PolarHBondContact O-N 3.11Å; L358-R362 HydrophobicContact CD1-CB 3.76Å; S360-R362 PolarHBondContact O-N 3.27Å; R362-A365 HydrophobicContact CG-CB 3.98Å; R362-A376 PolarHBondContact NH1-O 2.95Å; R362-G378 WeakPolarHBondContact CD-O 3.33Å; R362-G378 WeakPolarHBondContact CG-O 3.34Å; R362-G378 PolarHBondContact NH1-O 3.2Å; R362-T388 PolarHBondContact NH1-O 2.93Å; R362-T388 PolarHBondContact NH2-OG1 3.45Å; R362-D390 IonicContact CZ-OD2 2.77Å; R362-D390 IonicContact NE-OD2 3.76Å; R362-D390 IonicContact NH2-OD1 3.85Å; R362-D390 IonicContact NH2-OD2 3.56Å; R362-D390 PolarHBondContact NH2-OD2 2.82Å
363	C	98.2	Very high	94.9	Very high	2 Å²	2	45 Å²	45	1%	0.014	25%	0.251	C	S	.	.	B	Isolated β-bridge	trans	-139.6	167.1	166.8	67.6	0	0	0	0	109	G333 Q334 A338 A365 G379 F380	G333-C363 VanDerWaalsContact C-CB 3.43Å; G333-C363 WeakPolarHBondContact O-CB 3.49Å; Q334-C363 HydrophobicContact CG-CB 3.61Å; A338-C363 HydrophobicContact CB-CB 4.06Å; C363-A365 PolarHBondContact O-N 3.41Å; C363-A365 VanDerWaalsContact O-N 3.14Å; C363-G379 CarbonylContact O-C 3.53Å; C363-G379 WeakPolarHBondContact O-CA 3.41Å; C363-F380 PolarHBondContact N-O 2.77Å; C363-F380 PolarHBondContact O-N 3.09Å; C363-F380 PolarHBondContact SG-O 3.33Å
364	R	98.5	Very high	95.2	Very high	56 Å²	56	41.3 Å²	41.3	21%	0.211	24%	0.237	C	C	.	.	S	Bend	trans	60.8	23.4	176	-51.7	169	-177.5	-164.7	-2.8	113.1	Q334 G379 T411 Y602	Q334-R364 VanDerWaalsContact OE1-CZ 3.25Å; R364-G379 WeakPolarHBondContact O-CA 3.43Å; R364-T411 HydrophobicContact CB-CG2 3.78Å; R364-T411 HydrophobicContact CG-CG2 3.89Å; R364-T411 PolarHBondContact O-N 2.95Å; R364-Y602 HydrophobicContact CB-CD1 4.3Å; R364-Y602 HydrophobicContact CG-CD1 3.59Å; R364-Y602 HydrophobicContact CG-CD2 4.13Å; R364-Y602 HydrophobicContact CG-CE1 4.15Å; R364-Y602 HydrophobicContact CG-CG 3.55Å; R364-Y602 PolarHBondContact N-O 3.44Å
365	A	98.6	Very high	95.4	Very high	16 Å²	16	36.6 Å²	36.6	13%	0.132	21%	0.214	C	C	.	.			trans	-85	151.6	174.7	0	0	0	0	0	109.7	R362 C363 V367 V377 G378	R362-A365 HydrophobicContact CG-CB 3.98Å; C363-A365 PolarHBondContact O-N 3.41Å; C363-A365 VanDerWaalsContact O-N 3.14Å; A365-V367 HydrophobicContact CB-CG2 4.49Å; A365-V377 VanDerWaalsContact CA-O 3.32Å; A365-V377 WeakPolarHBondContact CA-O 3.41Å; A365-V377 WeakPolarHBondContact CB-O 3.35Å; A365-G378 WeakPolarHBondContact CB-O 3.35Å
366	G	98.5	Very high	95.5	Very high	4 Å²	4	35.3 Å²	35.3	4%	0.041	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.2	137.7	160	0	0	0	0	0	108.4	V377	G366-V377 PolarHBondContact N-O 3.07Å; G366-V377 WeakPolarHBondContact O-CB 3.46Å; G366-V377 PolarHBondContact O-N 3.4Å
367	V	98.6	Very high	95.6	Very high	18 Å²	18	34.3 Å²	34.3	11%	0.109	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.3	133.4	177.9	173.5	0	0	0	0	109	V331 A365 V374 Y375 A376 A606	V331-V367 HydrophobicContact CB-CG1 4.26Å; V331-V367 HydrophobicContact CB-CG2 4.06Å; V331-V367 HydrophobicContact CG1-CG2 4.26Å; V331-V367 HydrophobicContact CG2-CG1 3.93Å; A365-V367 HydrophobicContact CB-CG2 4.49Å; V367-V374 HydrophobicContact CG1-CG1 3.6Å; V367-Y375 VanDerWaalsContact CA-O 3.28Å; V367-Y375 WeakPolarHBondContact CA-O 3.33Å; V367-A376 HydrophobicContact CG2-CB 4.45Å; V367-A606 HydrophobicContact CG1-CB 4.06Å
368	V	97.8	Very high	95.6	Very high	16 Å²	16	31.2 Å²	31.2	10%	0.097	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-156.6	150.2	-171.5	66.5	0	0	0	0	110.9	V370 Y375 A414 V416 L421	V368-V370 HydrophobicContact CG1-CG2 4.45Å; V368-Y375 PolarHBondContact N-O 2.73Å; V368-Y375 PolarHBondContact O-N 2.75Å; V368-A414 HydrophobicContact CG1-CB 4.31Å; V368-V416 HydrophobicContact CG2-CG2 3.32Å; V368-L421 HydrophobicContact CG1-CD1 3.5Å; V368-L421 VanDerWaalsContact CG1-CD1 3.5Å; V368-L421 HydrophobicContact CG1-CG 3.85Å
369	S	94.6	Very high	95.6	Very high	38 Å²	38	31.2 Å²	31.2	27%	0.266	18%	0.182	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.8	126.9	174.2	-177.4	0	0	0	0	110.5	R373 V416 V607	S369-R373 CarbonylContact C-O 3.57Å; S369-R373 WeakPolarHBondContact CA-O 3.39Å; S369-V416 VanDerWaalsContact O-CG2 3.24Å; S369-V416 WeakPolarHBondContact O-CG2 3.43Å; S369-V607 WeakPolarHBondContact CB-O 3.44Å; S369-V607 PolarHBondContact OG-O 3.27Å
370	V	88.6	Confident	95.6	Very high	11 Å²	11	29.4 Å²	29.4	7%	0.067	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	124.9	173.3	-177.3	0	0	0	0	107.9	V368 G372 R373 Y375 V416 L421	V368-V370 HydrophobicContact CG1-CG2 4.45Å; V370-G372 VanDerWaalsContact C-N 3.26Å; V370-G372 PolarHBondContact O-N 3Å; V370-G372 VanDerWaalsContact O-N 3.17Å; V370-R373 PolarHBondContact N-O 2.7Å; V370-R373 PolarHBondContact O-N 2.74Å; V370-Y375 HydrophobicContact CB-CD2 3.95Å; V370-Y375 HydrophobicContact CB-CE2 3.77Å; V370-Y375 HydrophobicContact CG2-CD2 4.04Å; V370-Y375 HydrophobicContact CG2-CE2 4.26Å; V370-V416 HydrophobicContact CG2-CG1 4.34Å; V370-V416 HydrophobicContact CG2-CG2 3.65Å; V370-L421 HydrophobicContact CG2-CB 4.26Å; V370-L421 HydrophobicContact CG2-CD1 4.09Å
371	A	81.4	Confident	95.6	Very high	86 Å²	86	29.4 Å²	29.4	71%	0.711	16%	0.163	S	C	*	.	T	Hydrogen-bonded Turn	trans	47.4	44.9	177.8	0	0	0	0	0	114	R373	A371-R373 VanDerWaalsContact C-N 3.29Å; A371-R373 PolarHBondContact O-N 2.83Å
372	G	82.1	Confident	95.3	Very high	45 Å²	45	24.7 Å²	24.7	46%	0.464	15%	0.153	S	C	.	.	T	Hydrogen-bonded Turn	trans	78.1	0.4	179.8	0	0	0	0	0	115.8	V370	V370-G372 VanDerWaalsContact C-N 3.26Å; V370-G372 PolarHBondContact O-N 3Å; V370-G372 VanDerWaalsContact O-N 3.17Å
373	R	90.8	Very high	95	Very high	92 Å²	92	28.9 Å²	28.9	35%	0.347	18%	0.183	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	143.7	-179.7	-63.1	-176.9	-179	176.9	0.7	111.8	S369 V370 A371 Y375 V391 Y392	S369-R373 CarbonylContact C-O 3.57Å; S369-R373 WeakPolarHBondContact CA-O 3.39Å; V370-R373 PolarHBondContact N-O 2.7Å; V370-R373 PolarHBondContact O-N 2.74Å; A371-R373 VanDerWaalsContact C-N 3.29Å; A371-R373 PolarHBondContact O-N 2.83Å; R373-Y375 HydrophobicContact CB-CE2 4.14Å; R373-V391 HydrophobicContact CB-CG1 3.82Å; R373-Y392 WeakPolarHBondContact CA-O 3.49Å; R373-Y392 WeakPolarHBondContact CB-O 3.3Å
374	V	98.1	Very high	94.8	Very high	0 Å²	0	33.5 Å²	33.5	0%	0	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.3	120.1	179.5	-177.1	0	0	0	0	110.3	I329 V331 V367 V391 Y392 A606 I608	I329-V374 HydrophobicContact CB-CG2 4.44Å; I329-V374 HydrophobicContact CG1-CG2 4.29Å; V331-V374 HydrophobicContact CG2-CG1 4.06Å; V367-V374 HydrophobicContact CG1-CG1 3.6Å; V374-V391 WeakPolarHBondContact O-CA 3.4Å; V374-Y392 HydrophobicContact CB-CD1 4.35Å; V374-Y392 HydrophobicContact CG2-CD1 4.33Å; V374-Y392 PolarHBondContact N-O 3.48Å; V374-Y392 VanDerWaalsContact N-O 3.1Å; V374-Y392 PolarHBondContact O-N 2.79Å; V374-A606 HydrophobicContact CB-CB 4.38Å; V374-A606 HydrophobicContact CG1-CB 3.7Å; V374-A606 HydrophobicContact CG2-CB 3.84Å; V374-I608 HydrophobicContact CG2-CG2 3.49Å; V374-I608 VanDerWaalsContact CG2-CG2 3.49Å
375	Y	98.6	Very high	94.8	Very high	5 Å²	5	34 Å²	34	2%	0.02	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.2	127	177	-77	-108.9	0	0	0	110	V367 V368 V370 R373 V389 V391 L421 Y439	V367-Y375 VanDerWaalsContact CA-O 3.28Å; V367-Y375 WeakPolarHBondContact CA-O 3.33Å; V368-Y375 PolarHBondContact N-O 2.73Å; V368-Y375 PolarHBondContact O-N 2.75Å; V370-Y375 HydrophobicContact CB-CD2 3.95Å; V370-Y375 HydrophobicContact CB-CE2 3.77Å; V370-Y375 HydrophobicContact CG2-CD2 4.04Å; V370-Y375 HydrophobicContact CG2-CE2 4.26Å; R373-Y375 HydrophobicContact CB-CE2 4.14Å; Y375-V389 HydrophobicContact CD1-CG1 4.01Å; Y375-V391 HydrophobicContact CD1-CG2 3.56Å; Y375-V391 HydrophobicContact CD2-CG1 4.06Å; Y375-V391 HydrophobicContact CE1-CB 4.39Å; Y375-V391 HydrophobicContact CE1-CG1 4.18Å; Y375-V391 HydrophobicContact CE1-CG2 3.31Å; Y375-V391 HydrophobicContact CE2-CG1 3.67Å; Y375-V391 HydrophobicContact CE2-CG2 4.34Å; Y375-V391 HydrophobicContact CG-CG1 4.44Å; Y375-V391 HydrophobicContact CG-CG2 4.15Å; Y375-L421 HydrophobicContact CD1-CD1 3.73Å; Y375-L421 HydrophobicContact CD2-CD1 4.4Å; Y375-L421 HydrophobicContact CG-CD1 3.65Å; Y375-Y439 HydrophobicContact CE1-CD1 4.3Å; Y375-Y439 AromaticContact CE1-CE1 3.66Å; Y375-Y439 HydrophobicContact CE1-CE1 3.66Å
376	A	98.7	Very high	94.7	Very high	0 Å²	0	34.7 Å²	34.7	0%	0	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	109	171	0	0	0	0	0	109.7	V331 L358 R362 V367 V389 D390 W399	V331-A376 HydrophobicContact CG1-CB 4.16Å; L358-A376 HydrophobicContact CD2-CB 4.13Å; R362-A376 PolarHBondContact NH1-O 2.95Å; V367-A376 HydrophobicContact CG2-CB 4.45Å; A376-V389 WeakPolarHBondContact O-CA 3.38Å; A376-D390 PolarHBondContact N-O 2.83Å; A376-D390 PolarHBondContact O-N 3.15Å; A376-W399 HydrophobicContact CB-CH2 4.01Å; A376-W399 HydrophobicContact CB-CZ3 3.8Å
377	V	98.8	Very high	94.6	Very high	0 Å²	0	39.6 Å²	39.6	0%	0	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	115.5	-163.1	-172.8	0	0	0	0	110.3	A365 G366 V389 M405 L412 A414 L421 A423 W446	A365-V377 VanDerWaalsContact CA-O 3.32Å; A365-V377 WeakPolarHBondContact CA-O 3.41Å; A365-V377 WeakPolarHBondContact CB-O 3.35Å; G366-V377 PolarHBondContact N-O 3.07Å; G366-V377 WeakPolarHBondContact O-CB 3.46Å; G366-V377 PolarHBondContact O-N 3.4Å; V377-V389 HydrophobicContact CG1-CG2 4.36Å; V377-V389 HydrophobicContact CG2-CG1 4.29Å; V377-M405 HydrophobicContact CG1-CE 3.95Å; V377-M405 HydrophobicContact CG1-CG 4.42Å; V377-M405 HydrophobicContact CG1-SD 3.51Å; V377-M405 VanDerWaalsContact CG1-SD 3.51Å; V377-L412 HydrophobicContact CG1-CD1 4.02Å; V377-A414 HydrophobicContact CG2-CB 4.48Å; V377-L421 HydrophobicContact CG2-CD1 4.12Å; V377-L421 HydrophobicContact CG2-CD2 4.13Å; V377-A423 HydrophobicContact CG1-CB 4.25Å; V377-W446 HydrophobicContact CG1-CH2 3.92Å; V377-W446 HydrophobicContact CG1-CZ2 4.2Å
378	G	98.6	Very high	94.6	Very high	0 Å²	0	40.8 Å²	40.8	0%	0	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	58.7	-141.2	179.8	0	0	0	0	0	114	R362 A365 E386 T388	R362-G378 WeakPolarHBondContact CD-O 3.33Å; R362-G378 WeakPolarHBondContact CG-O 3.34Å; R362-G378 PolarHBondContact NH1-O 3.2Å; A365-G378 WeakPolarHBondContact CB-O 3.35Å; G378-E386 WeakPolarHBondContact CA-O 3.29Å; G378-T388 WeakPolarHBondContact CA-O 3.33Å; G378-T388 PolarHBondContact N-O 3.13Å
379	G	98.4	Very high	94.7	Very high	0 Å²	0	40 Å²	40	0%	0	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	107.9	-151.5	178	0	0	0	0	0	113.6	C363 R364 R385 E386 R409 S410	C363-G379 CarbonylContact O-C 3.53Å; C363-G379 WeakPolarHBondContact O-CA 3.41Å; R364-G379 WeakPolarHBondContact O-CA 3.43Å; G379-R385 CarbonylContact O-C 3.53Å; G379-R385 WeakPolarHBondContact O-CA 3.45Å; G379-E386 PolarHBondContact O-N 3.08Å; G379-R409 PolarHBondContact N-O 3.24Å; G379-S410 WeakPolarHBondContact O-CB 3.47Å
380	F	98.3	Very high	94.8	Very high	31 Å²	31	38.9 Å²	38.9	14%	0.136	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.5	127.2	-173.1	179.7	-114	0	0	0	110.5	C363 S382 L384 R385	C363-F380 PolarHBondContact N-O 2.77Å; C363-F380 PolarHBondContact O-N 3.09Å; C363-F380 PolarHBondContact SG-O 3.33Å; F380-S382 VanDerWaalsContact CE1-CA 3.42Å; F380-S382 WeakPolarHBondContact CZ-O 3.21Å; F380-L384 WeakPolarHBondContact CA-O 3.25Å; F380-L384 WeakPolarHBondContact CD2-O 3.21Å; F380-R385 HydrophobicContact CD2-CG 4.35Å
381	N	94.1	Very high	95.3	Very high	46 Å²	46	38.6 Å²	38.6	25%	0.246	22%	0.219	C	C	.	.			trans	-96.6	21	-174.3	63.2	13.4	0	0	0	114.8	R361 S383 L384 E386	R361-N381 WeakPolarHBondContact O-CA 3.15Å; R361-N381 WeakPolarHBondContact O-CB 3.21Å; N381-S383 VanDerWaalsContact C-N 3.26Å; N381-S383 PolarHBondContact OD1-N 3.05Å; N381-L384 PolarHBondContact N-O 3.32Å; N381-L384 PolarHBondContact OD1-N 3.5Å; N381-L384 PolarHBondContact OD1-O 3.49Å; N381-E386 PolarHBondContact ND2-OE1 3.29Å
382	S	91.8	Very high	96.1	Very high	46 Å²	46	34.9 Å²	34.9	32%	0.322	19%	0.186	S	C	.	.	S	Bend	trans	77.6	-11.9	-165.9	-45.9	0	0	0	0	116	A338 F380	A338-S382 VanDerWaalsContact CB-OG 3.25Å; A338-S382 WeakPolarHBondContact CB-OG 3.42Å; A338-S382 PolarHBondContact N-OG 2.98Å; F380-S382 VanDerWaalsContact CE1-CA 3.42Å; F380-S382 WeakPolarHBondContact CZ-O 3.21Å
383	S	91.7	Very high	96.5	Very high	95 Å²	95	33.9 Å²	33.9	66%	0.664	17%	0.17	S	C	*	.	S	Bend	trans	-122	-54.9	179.4	-60	0	0	0	0	112.6	N381	N381-S383 VanDerWaalsContact C-N 3.26Å; N381-S383 PolarHBondContact OD1-N 3.05Å
384	L	94.3	Very high	96.3	Very high	99 Å²	99	29.9 Å²	29.9	52%	0.518	16%	0.158	S	C	.	.	S	Bend	trans	-124.8	155.9	-174.6	-64.6	177.4	0	0	0	111.4	F380 N381	F380-L384 WeakPolarHBondContact CA-O 3.25Å; F380-L384 WeakPolarHBondContact CD2-O 3.21Å; N381-L384 PolarHBondContact N-O 3.32Å; N381-L384 PolarHBondContact OD1-N 3.5Å; N381-L384 PolarHBondContact OD1-O 3.49Å
385	R	97.6	Very high	95.5	Very high	67 Å²	67	33.8 Å²	33.8	25%	0.253	19%	0.19	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.6	131.6	170.2	-78.4	72.8	177.4	-167.1	-2.4	107.8	G379 F380 R408 S410	G379-R385 CarbonylContact O-C 3.53Å; G379-R385 WeakPolarHBondContact O-CA 3.45Å; F380-R385 HydrophobicContact CD2-CG 4.35Å; R385-R408 HydrophobicContact CB-CB 4.27Å; R385-R408 WeakPolarHBondContact O-CD 3.3Å; R385-R408 WeakPolarHBondContact O-CG 3.29Å; R385-R408 PolarHBondContact O-NH1 3.04Å; R385-S410 WeakPolarHBondContact CG-OG 3.33Å
386	E	96.4	Very high	94.7	Very high	30 Å²	30	40.9 Å²	40.9	14%	0.14	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.1	156.4	-172.3	-64.4	-52.1	149.9	0	0	113.5	G378 G379 N381 R408 R409	G378-E386 WeakPolarHBondContact CA-O 3.29Å; G379-E386 PolarHBondContact O-N 3.08Å; N381-E386 PolarHBondContact ND2-OE1 3.29Å; E386-R408 IonicContact OE1-NH1 2.78Å; E386-R408 IonicContact OE2-NH1 2.67Å; E386-R408 PolarHBondContact OE2-NH1 3.01Å; E386-R409 PolarHBondContact O-N 3.21Å
387	R	98.1	Very high	94.3	Very high	106 Å²	106	44.5 Å²	44.5	40%	0.4	24%	0.237	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	-0.8	169.3	67.3	179	-160.4	102	1.1	112.5	S404 M405 E407 R408	R387-S404 CarbonylContact O-C 3.45Å; R387-S404 VanDerWaalsContact O-CA 3.32Å; R387-S404 WeakPolarHBondContact O-CA 3.37Å; R387-S404 WeakPolarHBondContact O-CB 3.32Å; R387-M405 HydrophobicContact CB-CB 4.19Å; R387-M405 WeakPolarHBondContact CD-O 3.26Å; R387-M405 PolarHBondContact NH1-O 2.82Å; R387-M405 PolarHBondContact O-N 2.86Å; R387-E407 VanDerWaalsContact CB-O 3.25Å; R387-E407 WeakPolarHBondContact CB-O 3.43Å; R387-R408 HydrophobicContact CB-CG 4.22Å
388	T	98.4	Very high	94.1	Very high	43 Å²	43	50.3 Å²	50.3	26%	0.264	26%	0.264	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.7	150.9	-176.5	54.1	0	0	0	0	111.5	R362 G378	R362-T388 PolarHBondContact NH1-O 2.93Å; R362-T388 PolarHBondContact NH2-OG1 3.45Å; G378-T388 WeakPolarHBondContact CA-O 3.33Å; G378-T388 PolarHBondContact N-O 3.13Å
389	V	98.6	Very high	94.1	Very high	1 Å²	1	52.1 Å²	52.1	1%	0.006	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.9	118.3	179.6	-173.7	0	0	0	0	107.4	Y375 A376 V377 A402 A403 M405 W446	Y375-V389 HydrophobicContact CD1-CG1 4.01Å; A376-V389 WeakPolarHBondContact O-CA 3.38Å; V377-V389 HydrophobicContact CG1-CG2 4.36Å; V377-V389 HydrophobicContact CG2-CG1 4.29Å; V389-A402 HydrophobicContact CB-CB 4.19Å; V389-A402 HydrophobicContact CG1-CB 4.08Å; V389-A402 PolarHBondContact O-N 3.44Å; V389-A403 WeakPolarHBondContact CG2-O 3.41Å; V389-M405 HydrophobicContact CG2-CG 4.27Å; V389-W446 HydrophobicContact CG2-CZ2 3.76Å
390	D	98.5	Very high	94.1	Very high	14 Å²	14	55.1 Å²	55.1	8%	0.075	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	146.4	174	-58.6	-32.9	0	0	0	108.6	P359 R362 A376 W399 S400	P359-D390 HydrophobicContact CG-CB 4.41Å; R362-D390 IonicContact CZ-OD2 2.77Å; R362-D390 IonicContact NE-OD2 3.76Å; R362-D390 IonicContact NH2-OD1 3.85Å; R362-D390 IonicContact NH2-OD2 3.56Å; R362-D390 PolarHBondContact NH2-OD2 2.82Å; A376-D390 PolarHBondContact N-O 2.83Å; A376-D390 PolarHBondContact O-N 3.15Å; D390-W399 HydrophobicContact CB-CE3 3.6Å; D390-W399 HydrophobicContact CB-CZ3 4Å; D390-S400 CarbonylContact C-O 3.57Å; D390-S400 WeakPolarHBondContact CA-O 3.42Å
391	V	98.3	Very high	94	Very high	5 Å²	5	57.9 Å²	57.9	3%	0.03	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	123.4	-177.3	-171.6	0	0	0	0	109.5	R373 V374 Y375 W399 S400 A402	R373-V391 HydrophobicContact CB-CG1 3.82Å; V374-V391 WeakPolarHBondContact O-CA 3.4Å; Y375-V391 HydrophobicContact CD1-CG2 3.56Å; Y375-V391 HydrophobicContact CD2-CG1 4.06Å; Y375-V391 HydrophobicContact CE1-CB 4.39Å; Y375-V391 HydrophobicContact CE1-CG1 4.18Å; Y375-V391 HydrophobicContact CE1-CG2 3.31Å; Y375-V391 HydrophobicContact CE2-CG1 3.67Å; Y375-V391 HydrophobicContact CE2-CG2 4.34Å; Y375-V391 HydrophobicContact CG-CG1 4.44Å; Y375-V391 HydrophobicContact CG-CG2 4.15Å; V391-W399 CarbonylContact O-C 3.57Å; V391-W399 WeakPolarHBondContact O-CA 3.45Å; V391-S400 PolarHBondContact N-O 3.41Å; V391-S400 PolarHBondContact O-N 3.07Å; V391-S400 PolarHBondContact O-OG 3.33Å; V391-A402 HydrophobicContact CG2-CB 3.63Å
392	Y	98.2	Very high	94.2	Very high	7 Å²	7	56.4 Å²	56.4	3%	0.027	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.8	125.7	177.7	177.4	-110.5	0	0	0	111	A356 R373 V374 D397 Q398 W399 I608	A356-Y392 HydrophobicContact CB-CE2 4.23Å; R373-Y392 WeakPolarHBondContact CA-O 3.49Å; R373-Y392 WeakPolarHBondContact CB-O 3.3Å; V374-Y392 HydrophobicContact CB-CD1 4.35Å; V374-Y392 HydrophobicContact CG2-CD1 4.33Å; V374-Y392 PolarHBondContact N-O 3.48Å; V374-Y392 VanDerWaalsContact N-O 3.1Å; V374-Y392 PolarHBondContact O-N 2.79Å; Y392-D397 WeakPolarHBondContact CE2-OD1 3.37Å; Y392-D397 PolarHBondContact OH-OD1 3.26Å; Y392-D397 VanDerWaalsContact OH-OD1 3.05Å; Y392-Q398 WeakPolarHBondContact CA-O 3.46Å; Y392-W399 AromaticContact CD2-CD1 3.99Å; Y392-W399 HydrophobicContact CD2-CD2 4.18Å; Y392-W399 AromaticContact CD2-CE2 3.8Å; Y392-W399 HydrophobicContact CD2-CG 4.3Å; Y392-W399 HydrophobicContact CD2-CZ2 4.25Å; Y392-W399 AromaticContact CD2-NE1 3.66Å; Y392-W399 HydrophobicContact CG-CD2 4.43Å; Y392-W399 HydrophobicContact CG-CZ2 4.12Å; Y392-I608 HydrophobicContact CE1-CD1 4.35Å
393	D	89.8	Confident	94.5	Very high	24 Å²	24	55.4 Å²	55.4	13%	0.128	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99	104	170	-174.2	-11.7	0	0	0	108.8	A395 R396 D397 Q398	D393-A395 VanDerWaalsContact C-N 3.26Å; D393-A395 PolarHBondContact O-N 3.21Å; D393-A395 PolarHBondContact OD1-N 3.02Å; D393-R396 HydrophobicContact CB-CB 4.35Å; D393-R396 PolarHBondContact O-N 2.85Å; D393-R396 VanDerWaalsContact O-N 3.14Å; D393-R396 WeakPolarHBondContact OD2-CD 3.31Å; D393-R396 IonicContact OD2-CZ 3.94Å; D393-R396 IonicContact OD2-NE 3.87Å; D393-R396 IonicContact OD2-NH1 3.23Å; D393-R396 PolarHBondContact OD2-NH1 3.11Å; D393-D397 PolarHBondContact O-N 3.27Å; D393-D397 VanDerWaalsContact O-N 3.07Å; D393-Q398 PolarHBondContact N-O 3.03Å; D393-Q398 PolarHBondContact O-N 2.82Å
394	G	87.6	Confident	94.8	Very high	9 Å²	9	52.9 Å²	52.9	9%	0.093	29%	0.291	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62.9	-29.6	-177.5	0	0	0	0	0	113.7	R396 P611	G394-R396 PolarHBondContact O-N 3.37Å; G394-P611 VanDerWaalsContact C-CG 3.46Å; G394-P611 WeakPolarHBondContact O-CB 3.31Å; G394-P611 WeakPolarHBondContact O-CG 3.19Å
395	A	81.7	Confident	95	Very high	82 Å²	82	48.1 Å²	48.1	68%	0.678	27%	0.266	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.3	-14.5	178.4	0	0	0	0	0	113.3	D393	D393-A395 VanDerWaalsContact C-N 3.26Å; D393-A395 PolarHBondContact O-N 3.21Å; D393-A395 PolarHBondContact OD1-N 3.02Å
396	R	82	Confident	95.1	Very high	153 Å²	153	50 Å²	50	58%	0.577	28%	0.278	S	S	*	.	T	Hydrogen-bonded Turn	trans	-115.4	-3.6	179.2	-66.7	-176.3	171.6	77.1	9.8	113.7	D393 G394 Q398	D393-R396 HydrophobicContact CB-CB 4.35Å; D393-R396 PolarHBondContact O-N 2.85Å; D393-R396 VanDerWaalsContact O-N 3.14Å; D393-R396 WeakPolarHBondContact OD2-CD 3.31Å; D393-R396 IonicContact OD2-CZ 3.94Å; D393-R396 IonicContact OD2-NE 3.87Å; D393-R396 IonicContact OD2-NH1 3.23Å; D393-R396 PolarHBondContact OD2-NH1 3.11Å; G394-R396 PolarHBondContact O-N 3.37Å; R396-Q398 VanDerWaalsContact C-N 3.27Å; R396-Q398 HydrophobicContact CB-CB 4.11Å; R396-Q398 HydrophobicContact CB-CG 4.47Å; R396-Q398 WeakPolarHBondContact O-CG 3.42Å; R396-Q398 PolarHBondContact O-N 3.49Å; R396-Q398 PolarHBondContact O-NE2 2.89Å
397	D	90	Very high	95.1	Very high	77 Å²	77	51 Å²	51	41%	0.412	28%	0.283	S	S	.	.	T	Hydrogen-bonded Turn	trans	43.6	51.4	-167.1	-169.5	25.8	0	0	0	112.1	A356 Y392 D393	A356-D397 WeakPolarHBondContact CB-O 3.3Å; A356-D397 WeakPolarHBondContact CB-OD1 3.4Å; A356-D397 PolarHBondContact N-OD1 2.87Å; Y392-D397 WeakPolarHBondContact CE2-OD1 3.37Å; Y392-D397 PolarHBondContact OH-OD1 3.26Å; Y392-D397 VanDerWaalsContact OH-OD1 3.05Å; D393-D397 PolarHBondContact O-N 3.27Å; D393-D397 VanDerWaalsContact O-N 3.07Å
398	Q	94.8	Very high	95.1	Very high	122 Å²	122	50.9 Å²	50.9	57%	0.57	28%	0.282	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-140.1	140.7	-169.9	-85.9	167.7	56.3	0	0	113.5	Y392 D393 R396	Y392-Q398 WeakPolarHBondContact CA-O 3.46Å; D393-Q398 PolarHBondContact N-O 3.03Å; D393-Q398 PolarHBondContact O-N 2.82Å; R396-Q398 VanDerWaalsContact C-N 3.27Å; R396-Q398 HydrophobicContact CB-CB 4.11Å; R396-Q398 HydrophobicContact CB-CG 4.47Å; R396-Q398 WeakPolarHBondContact O-CG 3.42Å; R396-Q398 PolarHBondContact O-N 3.49Å; R396-Q398 PolarHBondContact O-NE2 2.89Å
399	W	98.5	Very high	95.1	Very high	37 Å²	37	48.9 Å²	48.9	14%	0.14	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.4	139.9	171.7	-70.8	93.1	0	0	0	111.6	V331 V342 A356 L358 P359 A376 D390 V391 Y392	V331-W399 HydrophobicContact CG1-CH2 3.87Å; V331-W399 HydrophobicContact CG1-CZ2 4.14Å; V331-W399 HydrophobicContact CG2-CH2 4.22Å; V331-W399 HydrophobicContact CG2-CZ2 4.41Å; V342-W399 HydrophobicContact CG1-CZ2 4.48Å; V342-W399 HydrophobicContact CG2-CZ2 3.85Å; A356-W399 PolarHBondContact O-NE1 3.31Å; L358-W399 HydrophobicContact CD2-CD2 4.08Å; L358-W399 HydrophobicContact CD2-CE3 4.05Å; L358-W399 HydrophobicContact CD2-CH2 3.6Å; L358-W399 HydrophobicContact CD2-CZ2 3.62Å; L358-W399 HydrophobicContact CD2-CZ3 3.81Å; L358-W399 HydrophobicContact CG-CZ2 4.14Å; P359-W399 HydrophobicContact CG-CB 3.67Å; P359-W399 HydrophobicContact CG-CG 4.3Å; A376-W399 HydrophobicContact CB-CH2 4.01Å; A376-W399 HydrophobicContact CB-CZ3 3.8Å; D390-W399 HydrophobicContact CB-CE3 3.6Å; D390-W399 HydrophobicContact CB-CZ3 4Å; V391-W399 CarbonylContact O-C 3.57Å; V391-W399 WeakPolarHBondContact O-CA 3.45Å; Y392-W399 AromaticContact CD2-CD1 3.99Å; Y392-W399 HydrophobicContact CD2-CD2 4.18Å; Y392-W399 AromaticContact CD2-CE2 3.8Å; Y392-W399 HydrophobicContact CD2-CG 4.3Å; Y392-W399 HydrophobicContact CD2-CZ2 4.25Å; Y392-W399 AromaticContact CD2-NE1 3.66Å; Y392-W399 HydrophobicContact CG-CD2 4.43Å; Y392-W399 HydrophobicContact CG-CZ2 4.12Å
400	S	96.9	Very high	95.1	Very high	64 Å²	64	48.9 Å²	48.9	45%	0.448	27%	0.27	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.4	155.2	175.5	59.1	0	0	0	0	110.5	D390 V391	D390-S400 CarbonylContact C-O 3.57Å; D390-S400 WeakPolarHBondContact CA-O 3.42Å; V391-S400 PolarHBondContact N-O 3.41Å; V391-S400 PolarHBondContact O-N 3.07Å; V391-S400 PolarHBondContact O-OG 3.33Å
401	A	97.8	Very high	95.1	Very high	88 Å²	88	48.9 Å²	48.9	73%	0.727	27%	0.27	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-86.7	132.8	177.6	0	0	0	0	0	111.1
402	A	97.3	Very high	95.2	Very high	15 Å²	15	49.1 Å²	49.1	12%	0.124	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.9	174.8	165.7	0	0	0	0	0	110.9	V389 V391 S404	V389-A402 HydrophobicContact CB-CB 4.19Å; V389-A402 HydrophobicContact CG1-CB 4.08Å; V389-A402 PolarHBondContact O-N 3.44Å; V391-A402 HydrophobicContact CG2-CB 3.63Å; A402-S404 PolarHBondContact O-N 2.83Å
403	A	98.2	Very high	95.2	Very high	26 Å²	26	49 Å²	49	22%	0.215	27%	0.272	C	S	.	.	P	Polyproline II helix	trans	-55.4	134.8	172.8	0	0	0	0	0	111.1	V389 Y439 N444 W446	V389-A403 WeakPolarHBondContact CG2-O 3.41Å; A403-Y439 HydrophobicContact CB-CE2 4.3Å; A403-N444 WeakPolarHBondContact CB-O 3.22Å; A403-N444 VanDerWaalsContact CB-OD1 3.31Å; A403-N444 WeakPolarHBondContact CB-OD1 3.33Å; A403-N444 PolarHBondContact N-OD1 3.22Å; A403-W446 PolarHBondContact O-NE1 3.34Å
404	S	98.6	Very high	95.6	Very high	41 Å²	41	48.6 Å²	48.6	29%	0.287	27%	0.273	S	S	.	.	P	Polyproline II helix	trans	-75.3	141.9	176	-67.2	0	0	0	0	110.9	R387 A402	R387-S404 CarbonylContact O-C 3.45Å; R387-S404 VanDerWaalsContact O-CA 3.32Å; R387-S404 WeakPolarHBondContact O-CA 3.37Å; R387-S404 WeakPolarHBondContact O-CB 3.32Å; A402-S404 PolarHBondContact O-N 2.83Å
405	M	98.7	Very high	96.1	Very high	0 Å²	0	48.6 Å²	48.6	0%	0	27%	0.271	C	S	.	.	P	Polyproline II helix	trans	-52.3	157.7	170.9	-73.5	-178.6	-57.3	0	0	112.1	V377 R387 V389 E407 R409 L412 A423 E437 W446	V377-M405 HydrophobicContact CG1-CE 3.95Å; V377-M405 HydrophobicContact CG1-CG 4.42Å; V377-M405 HydrophobicContact CG1-SD 3.51Å; V377-M405 VanDerWaalsContact CG1-SD 3.51Å; R387-M405 HydrophobicContact CB-CB 4.19Å; R387-M405 WeakPolarHBondContact CD-O 3.26Å; R387-M405 PolarHBondContact NH1-O 2.82Å; R387-M405 PolarHBondContact O-N 2.86Å; V389-M405 HydrophobicContact CG2-CG 4.27Å; M405-E407 WeakPolarHBondContact CB-O 3.36Å; M405-R409 HydrophobicContact CE-CB 3.93Å; M405-R409 HydrophobicContact CE-CG 4.1Å; M405-R409 HydrophobicContact SD-CB 4.5Å; M405-R409 HydrophobicContact SD-CG 4.22Å; M405-L412 HydrophobicContact SD-CD1 4.31Å; M405-A423 HydrophobicContact SD-CB 3.63Å; M405-E437 WeakPolarHBondContact CA-OE2 3.34Å; M405-E437 VanDerWaalsContact CB-OE2 3.32Å; M405-E437 WeakPolarHBondContact CB-OE2 3.32Å; M405-E437 HydrophobicContact CG-CG 4.4Å; M405-W446 HydrophobicContact CB-CD2 4.5Å; M405-W446 HydrophobicContact CG-CD2 3.79Å; M405-W446 HydrophobicContact CG-CE3 4.03Å; M405-W446 HydrophobicContact CG-CG 4.49Å; M405-W446 HydrophobicContact CG-CH2 3.7Å; M405-W446 HydrophobicContact CG-CZ2 3.49Å; M405-W446 VanDerWaalsContact CG-CZ2 3.49Å; M405-W446 HydrophobicContact CG-CZ3 3.99Å; M405-W446 HydrophobicContact SD-CH2 4.06Å; M405-W446 HydrophobicContact SD-CZ2 4.32Å; M405-W446 HydrophobicContact SD-CZ3 4.41Å
406	Q	98.3	Very high	96.9	Very high	105 Å²	105	46.6 Å²	46.6	49%	0.491	25%	0.251	S	S	.	.	S	Bend	trans	-69.4	-43.8	173.6	-55.5	-159.9	30.1	0	0	110.7	E437 W446 F448	Q406-E437 PolarHBondContact N-OE2 3.43Å; Q406-W446 HydrophobicContact CG-CB 4.34Å; Q406-W446 PolarHBondContact NE2-O 3.26Å; Q406-F448 HydrophobicContact CB-CE2 3.93Å; Q406-F448 HydrophobicContact CB-CZ 3.89Å; Q406-F448 HydrophobicContact CG-CE2 4.28Å
407	E	96.8	Very high	97.4	Very high	52 Å²	52	40.2 Å²	40.2	24%	0.243	23%	0.228	C	C	.	.	S	Bend	trans	-101.8	152.3	176.9	-76.1	-173.3	131.9	0	0	113.5	R387 M405 R409 T435 E437 F448	R387-E407 VanDerWaalsContact CB-O 3.25Å; R387-E407 WeakPolarHBondContact CB-O 3.43Å; M405-E407 WeakPolarHBondContact CB-O 3.36Å; E407-R409 IonicContact OE2-CZ 3.17Å; E407-R409 IonicContact OE2-NH2 3.57Å; E407-R409 PolarHBondContact OE2-NH2 2.83Å; E407-T435 WeakPolarHBondContact OE2-CB 3.32Å; E407-T435 PolarHBondContact OE2-OG1 3.13Å; E407-E437 PolarHBondContact N-OE1 3.38Å; E407-F448 HydrophobicContact CG-CZ 4.1Å
408	R	98.6	Very high	97.4	Very high	104 Å²	104	39.9 Å²	39.9	39%	0.392	24%	0.243	S	C	.	.			trans	-72.5	128.5	165.6	-69.2	173.6	179.1	-81.8	-0.5	108.1	R385 E386 R387 N428	R385-R408 HydrophobicContact CB-CB 4.27Å; R385-R408 WeakPolarHBondContact O-CD 3.3Å; R385-R408 WeakPolarHBondContact O-CG 3.29Å; R385-R408 PolarHBondContact O-NH1 3.04Å; E386-R408 IonicContact OE1-NH1 2.78Å; E386-R408 IonicContact OE2-NH1 2.67Å; E386-R408 PolarHBondContact OE2-NH1 3.01Å; R387-R408 HydrophobicContact CB-CG 4.22Å; R408-N428 HydrophobicContact CB-CB 4.48Å; R408-N428 WeakPolarHBondContact O-CA 3.48Å; R408-N428 WeakPolarHBondContact O-CB 3.01Å
409	R	98.8	Very high	97.1	Very high	0 Å²	0	40.3 Å²	40.3	0%	0	25%	0.245	C	C	.	.			trans	-135	126.1	-179.4	-57.9	-173.2	-176.7	-89.4	-9.5	110.6	G379 E386 M405 E407 L412 G425 L433 T435 E437	G379-R409 PolarHBondContact N-O 3.24Å; E386-R409 PolarHBondContact O-N 3.21Å; M405-R409 HydrophobicContact CE-CB 3.93Å; M405-R409 HydrophobicContact CE-CG 4.1Å; M405-R409 HydrophobicContact SD-CB 4.5Å; M405-R409 HydrophobicContact SD-CG 4.22Å; E407-R409 IonicContact OE2-CZ 3.17Å; E407-R409 IonicContact OE2-NH2 3.57Å; E407-R409 PolarHBondContact OE2-NH2 2.83Å; R409-L412 HydrophobicContact CB-CB 4.18Å; R409-L412 HydrophobicContact CB-CD1 3.89Å; R409-L412 HydrophobicContact CB-CD2 4.08Å; R409-L412 HydrophobicContact CB-CG 4.28Å; R409-G425 PolarHBondContact NH1-O 2.76Å; R409-L433 HydrophobicContact CG-CD1 3.91Å; R409-T435 PolarHBondContact NH1-O 2.66Å; R409-T435 PolarHBondContact NH1-OG1 2.85Å; R409-T435 VanDerWaalsContact NH1-OG1 3.16Å; R409-T435 PolarHBondContact NH2-OG1 3.42Å; R409-T435 VanDerWaalsContact NH2-OG1 3.08Å; R409-E437 IonicContact CZ-OE1 2.74Å; R409-E437 VanDerWaalsContact CZ-OE1 3.23Å; R409-E437 IonicContact NE-OE1 3.24Å; R409-E437 PolarHBondContact NE-OE1 3.11Å; R409-E437 IonicContact NH2-OE1 3.48Å; R409-E437 PolarHBondContact NH2-OE1 3.2Å
410	S	98.6	Very high	96.8	Very high	1 Å²	1	41.5 Å²	41.5	1%	0.007	25%	0.254	C	S	.	.	B	Isolated β-bridge	trans	-126	151	165.2	63.8	0	0	0	0	109.6	G379 R385 L412 G426 F427	G379-S410 WeakPolarHBondContact O-CB 3.47Å; R385-S410 WeakPolarHBondContact CG-OG 3.33Å; S410-L412 PolarHBondContact O-N 2.93Å; S410-G426 CarbonylContact O-C 3.58Å; S410-G426 VanDerWaalsContact O-CA 3.25Å; S410-G426 WeakPolarHBondContact O-CA 3.39Å; S410-F427 PolarHBondContact N-O 3.22Å; S410-F427 PolarHBondContact O-N 3.36Å; S410-F427 PolarHBondContact OG-O 2.84Å
411	T	98.6	Very high	96.9	Very high	14 Å²	14	38.5 Å²	38.5	9%	0.086	23%	0.233	C	C	.	.	S	Bend	trans	57.6	29.9	-175.7	69.4	0	0	0	0	113.1	R364 S458 V459 Y602	R364-T411 HydrophobicContact CB-CG2 3.78Å; R364-T411 HydrophobicContact CG-CG2 3.89Å; R364-T411 PolarHBondContact O-N 2.95Å; T411-S458 VanDerWaalsContact CB-N 3.35Å; T411-S458 WeakPolarHBondContact O-CA 3.34Å; T411-S458 PolarHBondContact O-N 3.21Å; T411-S458 PolarHBondContact OG1-N 3.37Å; T411-S458 VanDerWaalsContact OG1-N 3.1Å; T411-V459 PolarHBondContact O-N 3.47Å; T411-Y602 HydrophobicContact CG2-CD1 4.36Å; T411-Y602 HydrophobicContact CG2-CE1 3.9Å
412	L	98.8	Very high	97	Very high	10 Å²	10	34.8 Å²	34.8	5%	0.052	20%	0.2	C	C	.	.			trans	-78.7	159.8	170.7	71.1	165.5	0	0	0	111.2	V377 M405 R409 S410 A423 V424	V377-L412 HydrophobicContact CG1-CD1 4.02Å; M405-L412 HydrophobicContact SD-CD1 4.31Å; R409-L412 HydrophobicContact CB-CB 4.18Å; R409-L412 HydrophobicContact CB-CD1 3.89Å; R409-L412 HydrophobicContact CB-CD2 4.08Å; R409-L412 HydrophobicContact CB-CG 4.28Å; S410-L412 PolarHBondContact O-N 2.93Å; L412-A423 HydrophobicContact CD1-CB 3.76Å; L412-V424 WeakPolarHBondContact CA-O 3.32Å; L412-V424 WeakPolarHBondContact CB-O 3.31Å
413	G	98.8	Very high	97.1	Very high	5 Å²	5	34 Å²	34	5%	0.052	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.5	148.4	158.3	0	0	0	0	0	110.9	V424	G413-V424 PolarHBondContact N-O 3.17Å; G413-V424 PolarHBondContact O-N 2.88Å
414	A	98.6	Very high	97.1	Very high	16 Å²	16	32.8 Å²	32.8	13%	0.132	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.4	137.8	164.3	0	0	0	0	0	110.4	V368 V377 Y422 V461	V368-A414 HydrophobicContact CG1-CB 4.31Å; V377-A414 HydrophobicContact CG2-CB 4.48Å; A414-Y422 VanDerWaalsContact CA-O 3.27Å; A414-Y422 WeakPolarHBondContact CA-O 3.47Å; A414-V461 WeakPolarHBondContact O-CG2 3.33Å
415	A	98.4	Very high	97.1	Very high	8 Å²	8	30.9 Å²	30.9	7%	0.066	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.9	160.2	-179	0	0	0	0	0	111.1	L421 Y422 V461 V463 L468	A415-L421 WeakPolarHBondContact O-CA 3.46Å; A415-Y422 PolarHBondContact N-O 2.99Å; A415-Y422 PolarHBondContact O-N 3.14Å; A415-V461 HydrophobicContact CB-CG2 3.94Å; A415-V463 HydrophobicContact CB-CG2 3.94Å; A415-L468 HydrophobicContact CB-CD1 3.73Å
416	V	97.6	Very high	97.1	Very high	41 Å²	41	30.9 Å²	30.9	25%	0.248	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	131.4	169.9	-158.6	0	0	0	0	109.3	V368 S369 V370 G418 L420 V463	V368-V416 HydrophobicContact CG2-CG2 3.32Å; S369-V416 VanDerWaalsContact O-CG2 3.24Å; S369-V416 WeakPolarHBondContact O-CG2 3.43Å; V370-V416 HydrophobicContact CG2-CG1 4.34Å; V370-V416 HydrophobicContact CG2-CG2 3.65Å; V416-G418 WeakPolarHBondContact CG1-O 3.47Å; V416-L420 WeakPolarHBondContact CA-O 3.35Å; V416-L420 WeakPolarHBondContact CG1-O 3.48Å; V416-V463 WeakPolarHBondContact O-CG2 3.11Å
417	L	93.9	Very high	97.1	Very high	18 Å²	18	28.2 Å²	28.2	9%	0.094	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	115.9	170.2	171.1	58.4	0	0	0	108.2	E419 L420 Y422 V463 G466 L468 Y488 P490	L417-E419 PolarHBondContact O-N 2.8Å; L417-L420 PolarHBondContact N-O 2.8Å; L417-L420 PolarHBondContact O-N 2.8Å; L417-Y422 HydrophobicContact CB-CD2 3.99Å; L417-Y422 HydrophobicContact CB-CE2 3.69Å; L417-Y422 HydrophobicContact CD2-CE2 4.28Å; L417-Y422 HydrophobicContact CG-CE2 4.29Å; L417-V463 HydrophobicContact CB-CG1 4.41Å; L417-V463 HydrophobicContact CB-CG2 4.19Å; L417-V463 HydrophobicContact CD1-CG1 3.81Å; L417-G466 VanDerWaalsContact CD1-O 3.32Å; L417-G466 WeakPolarHBondContact CD1-O 3.45Å; L417-L468 HydrophobicContact CD2-CB 4.01Å; L417-Y488 HydrophobicContact CD2-CD1 4.34Å; L417-P490 HydrophobicContact CD2-CB 4.1Å; L417-P490 HydrophobicContact CD2-CG 3.86Å
418	G	88.6	Confident	97.1	Very high	71 Å²	71	27.7 Å²	27.7	73%	0.732	16%	0.156	S	C	*	.	T	Hydrogen-bonded Turn	trans	65.3	-125.9	-164.8	0	0	0	0	0	110.9	V416	V416-G418 WeakPolarHBondContact CG1-O 3.47Å
419	E	88.1	Confident	97	Very high	131 Å²	131	24.2 Å²	24.2	61%	0.612	15%	0.153	S	C	*	.	T	Hydrogen-bonded Turn	trans	-97.2	3.3	173.2	-62	179.2	139.1	0	0	113.1	L417 K442	L417-E419 PolarHBondContact O-N 2.8Å; E419-K442 IonicContact OE1-NZ 2.84Å; E419-K442 PolarHBondContact OE1-NZ 2.83Å; E419-K442 IonicContact OE2-NZ 2.75Å; E419-K442 PolarHBondContact OE2-NZ 2.94Å
420	L	94.3	Very high	96.9	Very high	61 Å²	61	29.2 Å²	29.2	32%	0.319	19%	0.188	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	137.6	-169.4	-63.9	-180	0	0	0	111.8	V416 L417 Y422 V438	V416-L420 WeakPolarHBondContact CA-O 3.35Å; V416-L420 WeakPolarHBondContact CG1-O 3.48Å; L417-L420 PolarHBondContact N-O 2.8Å; L417-L420 PolarHBondContact O-N 2.8Å; L420-Y422 HydrophobicContact CB-CD2 4.47Å; L420-Y422 HydrophobicContact CB-CE2 3.82Å; L420-V438 HydrophobicContact CB-CG2 3.61Å; L420-V438 HydrophobicContact CD1-CG2 3.97Å; L420-V438 HydrophobicContact CG-CG2 4.26Å
421	L	98.5	Very high	96.8	Very high	1 Å²	1	33.2 Å²	33.2	1%	0.005	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.3	123.2	178.1	178.3	167.1	0	0	0	109.4	V368 V370 Y375 V377 A415 V438 Y439 W446	V368-L421 HydrophobicContact CG1-CD1 3.5Å; V368-L421 VanDerWaalsContact CG1-CD1 3.5Å; V368-L421 HydrophobicContact CG1-CG 3.85Å; V370-L421 HydrophobicContact CG2-CB 4.26Å; V370-L421 HydrophobicContact CG2-CD1 4.09Å; Y375-L421 HydrophobicContact CD1-CD1 3.73Å; Y375-L421 HydrophobicContact CD2-CD1 4.4Å; Y375-L421 HydrophobicContact CG-CD1 3.65Å; V377-L421 HydrophobicContact CG2-CD1 4.12Å; V377-L421 HydrophobicContact CG2-CD2 4.13Å; A415-L421 WeakPolarHBondContact O-CA 3.46Å; L421-V438 CarbonylContact O-C 3.53Å; L421-V438 WeakPolarHBondContact O-CA 3.15Å; L421-Y439 HydrophobicContact CB-CD1 4.35Å; L421-Y439 PolarHBondContact N-O 2.78Å; L421-Y439 VanDerWaalsContact N-O 3.16Å; L421-Y439 PolarHBondContact O-N 2.7Å; L421-W446 HydrophobicContact CD2-CH2 3.39Å; L421-W446 HydrophobicContact CD2-CZ2 4.19Å; L421-W446 HydrophobicContact CD2-CZ3 4.06Å
422	Y	98.8	Very high	96.8	Very high	10 Å²	10	32.8 Å²	32.8	4%	0.039	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.5	133.4	179.5	-71.7	-104	0	0	0	111.1	A414 A415 L417 L420 V436 V438 V449 L468 Y488	A414-Y422 VanDerWaalsContact CA-O 3.27Å; A414-Y422 WeakPolarHBondContact CA-O 3.47Å; A415-Y422 PolarHBondContact N-O 2.99Å; A415-Y422 PolarHBondContact O-N 3.14Å; L417-Y422 HydrophobicContact CB-CD2 3.99Å; L417-Y422 HydrophobicContact CB-CE2 3.69Å; L417-Y422 HydrophobicContact CD2-CE2 4.28Å; L417-Y422 HydrophobicContact CG-CE2 4.29Å; L420-Y422 HydrophobicContact CB-CD2 4.47Å; L420-Y422 HydrophobicContact CB-CE2 3.82Å; Y422-V436 HydrophobicContact CD1-CG1 4.13Å; Y422-V438 HydrophobicContact CD1-CB 4.07Å; Y422-V438 HydrophobicContact CD1-CG2 4.04Å; Y422-V438 HydrophobicContact CD2-CG2 3.93Å; Y422-V438 HydrophobicContact CE1-CB 3.95Å; Y422-V438 HydrophobicContact CE1-CG2 3.78Å; Y422-V438 HydrophobicContact CE2-CG2 3.64Å; Y422-V438 HydrophobicContact CG-CB 4.48Å; Y422-V438 HydrophobicContact CG-CG2 4.11Å; Y422-V449 HydrophobicContact CD1-CG2 4.42Å; Y422-V449 HydrophobicContact CE1-CG1 4.4Å; Y422-V449 HydrophobicContact CE1-CG2 4.25Å; Y422-L468 HydrophobicContact CD1-CD2 3.85Å; Y422-L468 HydrophobicContact CD2-CD2 4.49Å; Y422-L468 HydrophobicContact CG-CD2 3.79Å; Y422-Y488 HydrophobicContact CE1-CD1 4.36Å; Y422-Y488 AromaticContact CE1-CE1 3.67Å; Y422-Y488 HydrophobicContact CE1-CE1 3.67Å
423	A	98.9	Very high	96.8	Very high	0 Å²	0	32.6 Å²	32.6	0%	0	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	107.1	172.2	0	0	0	0	0	109.6	V377 M405 L412 V436 E437 W446	V377-A423 HydrophobicContact CG1-CB 4.25Å; M405-A423 HydrophobicContact SD-CB 3.63Å; L412-A423 HydrophobicContact CD1-CB 3.76Å; A423-V436 WeakPolarHBondContact O-CA 3.33Å; A423-E437 HydrophobicContact CB-CG 3.96Å; A423-E437 PolarHBondContact N-O 3.19Å; A423-E437 PolarHBondContact O-N 3.04Å; A423-W446 HydrophobicContact CB-CH2 3.79Å; A423-W446 HydrophobicContact CB-CZ3 3.58Å
424	V	98.9	Very high	96.8	Very high	0 Å²	0	33.8 Å²	33.8	0%	0	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	115.8	-164.5	-175.9	0	0	0	0	111	L412 G413 G426 V436 M452 V459 V461 L468 A470 W495	L412-V424 WeakPolarHBondContact CA-O 3.32Å; L412-V424 WeakPolarHBondContact CB-O 3.31Å; G413-V424 PolarHBondContact N-O 3.17Å; G413-V424 PolarHBondContact O-N 2.88Å; V424-G426 PolarHBondContact O-N 3.04Å; V424-V436 HydrophobicContact CG1-CG2 4.15Å; V424-V436 HydrophobicContact CG2-CG1 4.06Å; V424-M452 HydrophobicContact CG1-CE 3.91Å; V424-M452 HydrophobicContact CG1-SD 3.5Å; V424-M452 VanDerWaalsContact CG1-SD 3.5Å; V424-V459 WeakPolarHBondContact O-CG1 3.46Å; V424-V461 HydrophobicContact CB-CG1 3.88Å; V424-V461 HydrophobicContact CG1-CG1 4Å; V424-V461 HydrophobicContact CG2-CG1 4.03Å; V424-L468 HydrophobicContact CG2-CD2 3.92Å; V424-A470 HydrophobicContact CG1-CB 4.15Å; V424-W495 HydrophobicContact CG1-CH2 4.15Å; V424-W495 HydrophobicContact CG1-CZ2 4.35Å
425	G	98.8	Very high	96.8	Very high	0 Å²	0	34.3 Å²	34.3	0%	0	22%	0.215	C	C	.	.			trans	60.6	-133	173	0	0	0	0	0	113.8	R409 L433 T435	R409-G425 PolarHBondContact NH1-O 2.76Å; G425-L433 WeakPolarHBondContact CA-O 3.24Å; G425-T435 PolarHBondContact N-O 2.82Å; G425-T435 VanDerWaalsContact N-O 3.13Å
426	G	98.7	Very high	96.8	Very high	0 Å²	0	34 Å²	34	0%	0	21%	0.212	C	C	.	.			trans	94.1	-157.3	-175.8	0	0	0	0	0	113.7	S410 V424 G432 L433 R456	S410-G426 CarbonylContact O-C 3.58Å; S410-G426 VanDerWaalsContact O-CA 3.25Å; S410-G426 WeakPolarHBondContact O-CA 3.39Å; V424-G426 PolarHBondContact O-N 3.04Å; G426-G432 CarbonylContact O-C 3.46Å; G426-G432 WeakPolarHBondContact O-CA 3.4Å; G426-L433 PolarHBondContact O-N 3.27Å; G426-R456 PolarHBondContact N-O 3.42Å
427	F	98.6	Very high	96.8	Very high	49 Å²	49	32 Å²	32	22%	0.215	20%	0.2	C	C	.	.	B	Isolated β-bridge	trans	-138.1	125.6	-176.2	-178.2	-98.8	0	0	0	110.5	S410 G429 I431	S410-F427 PolarHBondContact N-O 3.22Å; S410-F427 PolarHBondContact O-N 3.36Å; S410-F427 PolarHBondContact OG-O 2.84Å; F427-G429 WeakPolarHBondContact CE1-O 3.32Å; F427-G429 WeakPolarHBondContact CZ-O 3.43Å; F427-I431 WeakPolarHBondContact CA-O 3.35Å; F427-I431 WeakPolarHBondContact CD2-O 3.5Å
428	N	97.4	Very high	97.1	Very high	41 Å²	41	31.7 Å²	31.7	22%	0.219	20%	0.199	C	C	.	.			trans	-87.8	-9.9	-172.5	67.9	7.7	0	0	0	115.3	R408 S430 I431 L433	R408-N428 HydrophobicContact CB-CB 4.48Å; R408-N428 WeakPolarHBondContact O-CA 3.48Å; R408-N428 WeakPolarHBondContact O-CB 3.01Å; N428-S430 PolarHBondContact OD1-N 2.83Å; N428-I431 PolarHBondContact N-O 3.03Å; N428-I431 VanDerWaalsContact N-O 3.16Å; N428-I431 PolarHBondContact OD1-N 3.22Å; N428-I431 PolarHBondContact OD1-O 3.23Å; N428-L433 HydrophobicContact CB-CD1 4.24Å; N428-L433 HydrophobicContact CB-CD2 4.24Å; N428-L433 HydrophobicContact CB-CG 4.44Å
429	G	95.9	Very high	97.5	Very high	32 Å²	32	28.8 Å²	28.8	33%	0.33	17%	0.166	S	C	.	.	S	Bend	trans	122.2	-28.7	-171.4	0	0	0	0	0	112.8	F427	F427-G429 WeakPolarHBondContact CE1-O 3.32Å; F427-G429 WeakPolarHBondContact CZ-O 3.43Å
430	S	95.8	Very high	97.8	Very high	105 Å²	105	24 Å²	24	73%	0.734	15%	0.146	S	C	*	.	S	Bend	trans	-119	-45.3	-177.6	-54.5	0	0	0	0	112.5	N428	N428-S430 PolarHBondContact OD1-N 2.83Å
431	I	97.1	Very high	97.7	Very high	84 Å²	84	24.4 Å²	24.4	43%	0.431	15%	0.147	S	C	.	.	S	Bend	trans	-134.1	156.1	-177.1	61	169.5	0	0	0	112.1	F427 N428 L433	F427-I431 WeakPolarHBondContact CA-O 3.35Å; F427-I431 WeakPolarHBondContact CD2-O 3.5Å; N428-I431 PolarHBondContact N-O 3.03Å; N428-I431 VanDerWaalsContact N-O 3.16Å; N428-I431 PolarHBondContact OD1-N 3.22Å; N428-I431 PolarHBondContact OD1-O 3.23Å; I431-L433 HydrophobicContact CG1-CD2 4.4Å
432	G	97.9	Very high	97.3	Very high	6 Å²	6	31.9 Å²	31.9	6%	0.062	18%	0.179	C	C	.	.	B	Isolated β-bridge	trans	-71.2	144.9	163	0	0	0	0	0	110.3	G426 R455	G426-G432 CarbonylContact O-C 3.46Å; G426-G432 WeakPolarHBondContact O-CA 3.4Å; G432-R455 WeakPolarHBondContact O-CD 3.31Å
433	L	98.7	Very high	97.1	Very high	6 Å²	6	35.1 Å²	35.1	3%	0.031	20%	0.2	C	C	.	.			trans	-104.6	141.8	-174.1	-60	176.4	0	0	0	111	R409 G425 G426 N428 I431 R455 R456	R409-L433 HydrophobicContact CG-CD1 3.91Å; G425-L433 WeakPolarHBondContact CA-O 3.24Å; G426-L433 PolarHBondContact O-N 3.27Å; N428-L433 HydrophobicContact CB-CD1 4.24Å; N428-L433 HydrophobicContact CB-CD2 4.24Å; N428-L433 HydrophobicContact CB-CG 4.44Å; I431-L433 HydrophobicContact CG1-CD2 4.4Å; L433-R455 WeakPolarHBondContact O-CA 3.35Å; L433-R456 PolarHBondContact O-N 3.15Å
434	S	98.7	Very high	96.9	Very high	29 Å²	29	38.7 Å²	38.7	20%	0.203	22%	0.22	C	C	.	.			trans	-104.2	-12.1	161.2	53.4	0	0	0	0	112.4	S451 M452 T454	S434-S451 CarbonylContact O-C 3.56Å; S434-S451 WeakPolarHBondContact O-CA 3.43Å; S434-S451 WeakPolarHBondContact O-CB 3.36Å; S434-M452 VanDerWaalsContact CB-O 3.31Å; S434-M452 WeakPolarHBondContact CB-O 3.42Å; S434-M452 PolarHBondContact O-N 2.99Å; S434-T454 WeakPolarHBondContact CB-O 3.48Å
435	T	98.8	Very high	96.8	Very high	28 Å²	28	44.7 Å²	44.7	17%	0.172	25%	0.247	C	C	.	.			trans	-60.6	146.6	176.8	54.9	0	0	0	0	111.1	E407 R409 G425 F448	E407-T435 WeakPolarHBondContact OE2-CB 3.32Å; E407-T435 PolarHBondContact OE2-OG1 3.13Å; R409-T435 PolarHBondContact NH1-O 2.66Å; R409-T435 PolarHBondContact NH1-OG1 2.85Å; R409-T435 VanDerWaalsContact NH1-OG1 3.16Å; R409-T435 PolarHBondContact NH2-OG1 3.42Å; R409-T435 VanDerWaalsContact NH2-OG1 3.08Å; G425-T435 PolarHBondContact N-O 2.82Å; G425-T435 VanDerWaalsContact N-O 3.13Å; T435-F448 HydrophobicContact CG2-CE1 4.41Å
436	V	98.9	Very high	96.8	Very high	0 Å²	0	45.6 Å²	45.6	0%	0	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132	132.9	175.6	-176.2	0	0	0	0	107.4	Y422 A423 V424 V449 M452 W495	Y422-V436 HydrophobicContact CD1-CG1 4.13Å; A423-V436 WeakPolarHBondContact O-CA 3.33Å; V424-V436 HydrophobicContact CG1-CG2 4.15Å; V424-V436 HydrophobicContact CG2-CG1 4.06Å; V436-V449 HydrophobicContact CB-CG2 3.73Å; V436-V449 HydrophobicContact CG1-CG2 3.63Å; V436-V449 PolarHBondContact O-N 2.92Å; V436-M452 HydrophobicContact CG2-CG 4.09Å; V436-W495 HydrophobicContact CG1-CZ2 4.46Å; V436-W495 HydrophobicContact CG2-CZ2 3.81Å
437	E	98.6	Very high	96.8	Very high	0 Å²	0	48.6 Å²	48.6	0%	0	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	147.6	175	58.3	-170.2	117.9	0	0	110.5	M405 Q406 E407 R409 A423 W446 S447 F448	M405-E437 WeakPolarHBondContact CA-OE2 3.34Å; M405-E437 VanDerWaalsContact CB-OE2 3.32Å; M405-E437 WeakPolarHBondContact CB-OE2 3.32Å; M405-E437 HydrophobicContact CG-CG 4.4Å; Q406-E437 PolarHBondContact N-OE2 3.43Å; E407-E437 PolarHBondContact N-OE1 3.38Å; R409-E437 IonicContact CZ-OE1 2.74Å; R409-E437 VanDerWaalsContact CZ-OE1 3.23Å; R409-E437 IonicContact NE-OE1 3.24Å; R409-E437 PolarHBondContact NE-OE1 3.11Å; R409-E437 IonicContact NH2-OE1 3.48Å; R409-E437 PolarHBondContact NH2-OE1 3.2Å; A423-E437 HydrophobicContact CB-CG 3.96Å; A423-E437 PolarHBondContact N-O 3.19Å; A423-E437 PolarHBondContact O-N 3.04Å; E437-W446 HydrophobicContact CB-CE3 3.99Å; E437-W446 HydrophobicContact CB-CZ3 4.49Å; E437-W446 HydrophobicContact CG-CE3 3.6Å; E437-W446 HydrophobicContact CG-CZ3 3.83Å; E437-S447 CarbonylContact C-O 3.57Å; E437-S447 WeakPolarHBondContact CA-O 3.33Å; E437-S447 WeakPolarHBondContact CB-O 3.37Å; E437-F448 HydrophobicContact CB-CD1 4.07Å; E437-F448 HydrophobicContact CB-CE1 4.31Å
438	V	98.5	Very high	96.8	Very high	11 Å²	11	50.6 Å²	50.6	7%	0.067	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	138.9	-175	69	0	0	0	0	110	L420 L421 Y422 W446 S447 V449	L420-V438 HydrophobicContact CB-CG2 3.61Å; L420-V438 HydrophobicContact CD1-CG2 3.97Å; L420-V438 HydrophobicContact CG-CG2 4.26Å; L421-V438 CarbonylContact O-C 3.53Å; L421-V438 WeakPolarHBondContact O-CA 3.15Å; Y422-V438 HydrophobicContact CD1-CB 4.07Å; Y422-V438 HydrophobicContact CD1-CG2 4.04Å; Y422-V438 HydrophobicContact CD2-CG2 3.93Å; Y422-V438 HydrophobicContact CE1-CB 3.95Å; Y422-V438 HydrophobicContact CE1-CG2 3.78Å; Y422-V438 HydrophobicContact CE2-CG2 3.64Å; Y422-V438 HydrophobicContact CG-CB 4.48Å; Y422-V438 HydrophobicContact CG-CG2 4.11Å; V438-W446 VanDerWaalsContact O-CA 3.32Å; V438-W446 WeakPolarHBondContact O-CA 3.49Å; V438-S447 VanDerWaalsContact CG1-OG 3.3Å; V438-S447 WeakPolarHBondContact CG1-OG 3.44Å; V438-S447 PolarHBondContact N-O 3.02Å; V438-S447 PolarHBondContact O-N 3.27Å; V438-V449 HydrophobicContact CB-CG1 4.09Å; V438-V449 HydrophobicContact CG1-CG1 3.59Å
439	Y	98.6	Very high	96.9	Very high	11 Å²	11	49.8 Å²	49.8	4%	0.043	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	132.4	-178.5	174.3	-101.5	0	0	0	111.3	Y375 A403 L421 Q441 N444 E445 W446	Y375-Y439 HydrophobicContact CE1-CD1 4.3Å; Y375-Y439 AromaticContact CE1-CE1 3.66Å; Y375-Y439 HydrophobicContact CE1-CE1 3.66Å; A403-Y439 HydrophobicContact CB-CE2 4.3Å; L421-Y439 HydrophobicContact CB-CD1 4.35Å; L421-Y439 PolarHBondContact N-O 2.78Å; L421-Y439 VanDerWaalsContact N-O 3.16Å; L421-Y439 PolarHBondContact O-N 2.7Å; Y439-Q441 HydrophobicContact CE1-CB 4.08Å; Y439-N444 PolarHBondContact OH-OD1 3.41Å; Y439-E445 WeakPolarHBondContact CA-O 3.28Å; Y439-E445 WeakPolarHBondContact CD2-O 3.45Å; Y439-W446 AromaticContact CD2-CD1 3.8Å; Y439-W446 HydrophobicContact CD2-CD2 4.12Å; Y439-W446 AromaticContact CD2-CE2 3.72Å; Y439-W446 HydrophobicContact CD2-CG 4.18Å; Y439-W446 HydrophobicContact CD2-CZ2 4.27Å; Y439-W446 AromaticContact CD2-NE1 3.49Å; Y439-W446 HydrophobicContact CG-CD2 4.35Å; Y439-W446 AromaticContact CG-CE2 3.98Å; Y439-W446 HydrophobicContact CG-CZ2 4.12Å
440	S	94.3	Very high	97	Very high	29 Å²	29	49.1 Å²	49.1	20%	0.203	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	118	170.8	170.3	0	0	0	0	110.1	K442 T443 N444 E445	S440-K442 PolarHBondContact O-N 2.98Å; S440-K442 PolarHBondContact OG-N 3.43Å; S440-T443 WeakPolarHBondContact CB-OG1 3.44Å; S440-T443 PolarHBondContact O-N 3.26Å; S440-T443 PolarHBondContact OG-N 3.36Å; S440-T443 PolarHBondContact OG-OG1 3.12Å; S440-N444 WeakPolarHBondContact O-CA 3.43Å; S440-N444 PolarHBondContact O-N 3.11Å; S440-E445 PolarHBondContact N-O 3.17Å; S440-E445 VanDerWaalsContact N-O 3.14Å
441	Q	91.1	Very high	97.1	Very high	71 Å²	71	46.9 Å²	46.9	33%	0.332	25%	0.252	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.2	-26.4	173.5	-172.8	179.7	5.2	0	0	112.4	Y439	Y439-Q441 HydrophobicContact CE1-CB 4.08Å
442	K	90.5	Very high	97.2	Very high	157 Å²	157	43.1 Å²	43.1	68%	0.683	23%	0.233	S	C	*	.	T	Hydrogen-bonded Turn	trans	-73.1	-33.8	-178	-70.4	173	177.6	165.6	0	112.7	E419 S440	E419-K442 IonicContact OE1-NZ 2.84Å; E419-K442 PolarHBondContact OE1-NZ 2.83Å; E419-K442 IonicContact OE2-NZ 2.75Å; E419-K442 PolarHBondContact OE2-NZ 2.94Å; S440-K442 PolarHBondContact O-N 2.98Å; S440-K442 PolarHBondContact OG-N 3.43Å
443	T	93.7	Very high	97.3	Very high	79 Å²	79	47.3 Å²	47.3	49%	0.485	25%	0.254	S	S	.	.	T	Hydrogen-bonded Turn	trans	-102.6	-16.9	176.4	57.9	0	0	0	0	113.2	S440 E445	S440-T443 WeakPolarHBondContact CB-OG1 3.44Å; S440-T443 PolarHBondContact O-N 3.26Å; S440-T443 PolarHBondContact OG-N 3.36Å; S440-T443 PolarHBondContact OG-OG1 3.12Å; T443-E445 VanDerWaalsContact C-N 3.31Å
444	N	95.4	Very high	97.3	Very high	75 Å²	75	48.2 Å²	48.2	40%	0.401	26%	0.26	S	S	.	.	T	Hydrogen-bonded Turn	trans	56.1	44.5	-169.6	-174.4	41.5	0	0	0	111.7	A403 Y439 S440	A403-N444 WeakPolarHBondContact CB-O 3.22Å; A403-N444 VanDerWaalsContact CB-OD1 3.31Å; A403-N444 WeakPolarHBondContact CB-OD1 3.33Å; A403-N444 PolarHBondContact N-OD1 3.22Å; Y439-N444 PolarHBondContact OH-OD1 3.41Å; S440-N444 WeakPolarHBondContact O-CA 3.43Å; S440-N444 PolarHBondContact O-N 3.11Å
445	E	97.5	Very high	97.3	Very high	125 Å²	125	52 Å²	52	58%	0.584	27%	0.27	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-130.2	154.1	-177.9	-68	177.6	144.9	0	0	111.8	Y439 S440 T443	Y439-E445 WeakPolarHBondContact CA-O 3.28Å; Y439-E445 WeakPolarHBondContact CD2-O 3.45Å; S440-E445 PolarHBondContact N-O 3.17Å; S440-E445 VanDerWaalsContact N-O 3.14Å; T443-E445 VanDerWaalsContact C-N 3.31Å
446	W	98.8	Very high	97.3	Very high	20 Å²	20	50.7 Å²	50.7	8%	0.076	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	129.5	174.6	-73.8	92.8	0	0	0	110.4	V377 V389 A403 M405 Q406 L421 A423 E437 V438 Y439	V377-W446 HydrophobicContact CG1-CH2 3.92Å; V377-W446 HydrophobicContact CG1-CZ2 4.2Å; V389-W446 HydrophobicContact CG2-CZ2 3.76Å; A403-W446 PolarHBondContact O-NE1 3.34Å; M405-W446 HydrophobicContact CB-CD2 4.5Å; M405-W446 HydrophobicContact CG-CD2 3.79Å; M405-W446 HydrophobicContact CG-CE3 4.03Å; M405-W446 HydrophobicContact CG-CG 4.49Å; M405-W446 HydrophobicContact CG-CH2 3.7Å; M405-W446 HydrophobicContact CG-CZ2 3.49Å; M405-W446 VanDerWaalsContact CG-CZ2 3.49Å; M405-W446 HydrophobicContact CG-CZ3 3.99Å; M405-W446 HydrophobicContact SD-CH2 4.06Å; M405-W446 HydrophobicContact SD-CZ2 4.32Å; M405-W446 HydrophobicContact SD-CZ3 4.41Å; Q406-W446 HydrophobicContact CG-CB 4.34Å; Q406-W446 PolarHBondContact NE2-O 3.26Å; L421-W446 HydrophobicContact CD2-CH2 3.39Å; L421-W446 HydrophobicContact CD2-CZ2 4.19Å; L421-W446 HydrophobicContact CD2-CZ3 4.06Å; A423-W446 HydrophobicContact CB-CH2 3.79Å; A423-W446 HydrophobicContact CB-CZ3 3.58Å; E437-W446 HydrophobicContact CB-CE3 3.99Å; E437-W446 HydrophobicContact CB-CZ3 4.49Å; E437-W446 HydrophobicContact CG-CE3 3.6Å; E437-W446 HydrophobicContact CG-CZ3 3.83Å; V438-W446 VanDerWaalsContact O-CA 3.32Å; V438-W446 WeakPolarHBondContact O-CA 3.49Å; Y439-W446 AromaticContact CD2-CD1 3.8Å; Y439-W446 HydrophobicContact CD2-CD2 4.12Å; Y439-W446 AromaticContact CD2-CE2 3.72Å; Y439-W446 HydrophobicContact CD2-CG 4.18Å; Y439-W446 HydrophobicContact CD2-CZ2 4.27Å; Y439-W446 AromaticContact CD2-NE1 3.49Å; Y439-W446 HydrophobicContact CG-CD2 4.35Å; Y439-W446 AromaticContact CG-CE2 3.98Å; Y439-W446 HydrophobicContact CG-CZ2 4.12Å
447	S	98.3	Very high	97.2	Very high	62 Å²	62	51.3 Å²	51.3	43%	0.434	27%	0.266	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	151.8	171.6	55.5	0	0	0	0	111.2	E437 V438	E437-S447 CarbonylContact C-O 3.57Å; E437-S447 WeakPolarHBondContact CA-O 3.33Å; E437-S447 WeakPolarHBondContact CB-O 3.37Å; V438-S447 VanDerWaalsContact CG1-OG 3.3Å; V438-S447 WeakPolarHBondContact CG1-OG 3.44Å; V438-S447 PolarHBondContact N-O 3.02Å; V438-S447 PolarHBondContact O-N 3.27Å
448	F	98.8	Very high	97.2	Very high	92 Å²	92	52 Å²	52	40%	0.404	27%	0.271	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77	146.1	169.7	-73.2	-72.9	0	0	0	110.9	Q406 E407 T435 E437	Q406-F448 HydrophobicContact CB-CE2 3.93Å; Q406-F448 HydrophobicContact CB-CZ 3.89Å; Q406-F448 HydrophobicContact CG-CE2 4.28Å; E407-F448 HydrophobicContact CG-CZ 4.1Å; T435-F448 HydrophobicContact CG2-CE1 4.41Å; E437-F448 HydrophobicContact CB-CD1 4.07Å; E437-F448 HydrophobicContact CB-CE1 4.31Å
449	V	98.6	Very high	97.3	Very high	23 Å²	23	52 Å²	52	14%	0.139	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	-176.6	166.5	-61	0	0	0	0	108.9	Y422 V436 V438 S451 Y488	Y422-V449 HydrophobicContact CD1-CG2 4.42Å; Y422-V449 HydrophobicContact CE1-CG1 4.4Å; Y422-V449 HydrophobicContact CE1-CG2 4.25Å; V436-V449 HydrophobicContact CB-CG2 3.73Å; V436-V449 HydrophobicContact CG1-CG2 3.63Å; V436-V449 PolarHBondContact O-N 2.92Å; V438-V449 HydrophobicContact CB-CG1 4.09Å; V438-V449 HydrophobicContact CG1-CG1 3.59Å; V449-S451 PolarHBondContact O-N 3.47Å; V449-Y488 HydrophobicContact CG2-CE2 4.4Å
450	A	98.7	Very high	97.3	Very high	18 Å²	18	51.9 Å²	51.9	15%	0.149	27%	0.273	C	S	.	.	P	Polyproline II helix	trans	-52.1	135.6	175.1	0	0	0	0	0	111.9	Y488 D493 W495	A450-Y488 HydrophobicContact CB-CE2 4.4Å; A450-D493 WeakPolarHBondContact CB-O 3.39Å; A450-D493 WeakPolarHBondContact CB-OD1 3.4Å; A450-D493 PolarHBondContact N-OD1 3.26Å; A450-D493 PolarHBondContact N-OD2 2.89Å; A450-W495 VanDerWaalsContact O-CD1 3.28Å; A450-W495 PolarHBondContact O-NE1 2.75Å
451	S	98.8	Very high	97.5	Very high	58 Å²	58	51.3 Å²	51.3	41%	0.406	27%	0.269	S	S	.	.	P	Polyproline II helix	trans	-79.3	148.7	176.5	-62.3	0	0	0	0	110.6	S434 V449 W495	S434-S451 CarbonylContact O-C 3.56Å; S434-S451 WeakPolarHBondContact O-CA 3.43Å; S434-S451 WeakPolarHBondContact O-CB 3.36Å; V449-S451 PolarHBondContact O-N 3.47Å; S451-W495 VanDerWaalsContact C-CD1 3.46Å
452	M	98.9	Very high	97.8	Very high	6 Å²	6	48.2 Å²	48.2	3%	0.03	26%	0.256	C	S	.	.	P	Polyproline II helix	trans	-59.6	153.4	170.3	-63.6	176.9	-62	0	0	110.9	V424 S434 V436 T454 R456 A470 W495	V424-M452 HydrophobicContact CG1-CE 3.91Å; V424-M452 HydrophobicContact CG1-SD 3.5Å; V424-M452 VanDerWaalsContact CG1-SD 3.5Å; S434-M452 VanDerWaalsContact CB-O 3.31Å; S434-M452 WeakPolarHBondContact CB-O 3.42Å; S434-M452 PolarHBondContact O-N 2.99Å; V436-M452 HydrophobicContact CG2-CG 4.09Å; M452-T454 VanDerWaalsContact C-N 3.31Å; M452-T454 WeakPolarHBondContact CB-O 3.15Å; M452-R456 HydrophobicContact CE-CB 4.06Å; M452-R456 HydrophobicContact CE-CG 4.14Å; M452-R456 HydrophobicContact SD-CG 4.29Å; M452-A470 HydrophobicContact SD-CB 3.53Å; M452-A470 VanDerWaalsContact SD-CB 3.53Å; M452-W495 HydrophobicContact CB-CD2 4.47Å; M452-W495 HydrophobicContact CG-CD2 3.68Å; M452-W495 HydrophobicContact CG-CE3 4.04Å; M452-W495 HydrophobicContact CG-CG 4.19Å; M452-W495 HydrophobicContact CG-CH2 4.16Å; M452-W495 HydrophobicContact CG-CZ2 3.84Å; M452-W495 HydrophobicContact CG-CZ3 4.26Å; M452-W495 HydrophobicContact SD-CH2 4.36Å; M452-W495 HydrophobicContact SD-CZ2 4.46Å
453	N	98.6	Very high	98.2	Very high	94 Å²	94	42.7 Å²	42.7	50%	0.503	24%	0.235	S	C	.	.	S	Bend	trans	-66.7	-34.5	174.9	-61.6	-89.2	0	0	0	111.4	E486 W495 Y497	N453-E486 VanDerWaalsContact CB-OE2 3.26Å; N453-E486 WeakPolarHBondContact CB-OE2 3.49Å; N453-E486 PolarHBondContact N-OE2 2.86Å; N453-E486 PolarHBondContact ND2-OE2 3.27Å; N453-W495 PolarHBondContact ND2-O 3.3Å; N453-Y497 HydrophobicContact CB-CE2 3.63Å; N453-Y497 VanDerWaalsContact CB-OH 3.26Å; N453-Y497 WeakPolarHBondContact CB-OH 3.35Å
454	T	98.6	Very high	98.3	Very high	25 Å²	25	39.1 Å²	39.1	15%	0.153	21%	0.213	C	C	.	.	S	Bend	trans	-114	147.9	176.6	-69.1	0	0	0	0	111.8	S434 M452 R456 D475 L482 E486 Y497	S434-T454 WeakPolarHBondContact CB-O 3.48Å; M452-T454 VanDerWaalsContact C-N 3.31Å; M452-T454 WeakPolarHBondContact CB-O 3.15Å; T454-R456 HydrophobicContact CG2-CG 4.38Å; T454-D475 HydrophobicContact CG2-CB 4.01Å; T454-L482 HydrophobicContact CG2-CD1 3.59Å; T454-L482 HydrophobicContact CG2-CD2 4.24Å; T454-E486 PolarHBondContact N-OE1 3.38Å; T454-Y497 PolarHBondContact OG1-OH 2.92Å
455	R	98.6	Very high	98	Very high	108 Å²	108	40.7 Å²	40.7	41%	0.408	22%	0.221	S	C	.	.			trans	-76.8	129.3	171.5	-63.9	167.2	-178.5	164.1	2.4	109.5	G432 L433 D475	G432-R455 WeakPolarHBondContact O-CD 3.31Å; L433-R455 WeakPolarHBondContact O-CA 3.35Å; R455-D475 WeakPolarHBondContact O-CA 3.49Å; R455-D475 WeakPolarHBondContact O-CB 3.44Å
456	R	98.8	Very high	97.8	Very high	0 Å²	0	36.7 Å²	36.7	0%	0	21%	0.213	C	C	.	.			trans	-132.4	102.3	-174	-52.9	-179.9	176.7	-95.5	-1.9	110.9	G426 L433 M452 T454 V459 G472 L482 T484 E486	G426-R456 PolarHBondContact N-O 3.42Å; L433-R456 PolarHBondContact O-N 3.15Å; M452-R456 HydrophobicContact CE-CB 4.06Å; M452-R456 HydrophobicContact CE-CG 4.14Å; M452-R456 HydrophobicContact SD-CG 4.29Å; T454-R456 HydrophobicContact CG2-CG 4.38Å; R456-V459 HydrophobicContact CB-CB 3.7Å; R456-V459 HydrophobicContact CB-CG1 4.31Å; R456-V459 HydrophobicContact CB-CG2 3.72Å; R456-V459 HydrophobicContact CG-CG2 4.4Å; R456-G472 PolarHBondContact NH1-O 3.24Å; R456-L482 HydrophobicContact CG-CD1 3.94Å; R456-T484 PolarHBondContact NH1-O 2.81Å; R456-T484 PolarHBondContact NH1-OG1 2.87Å; R456-T484 PolarHBondContact NH2-OG1 3.26Å; R456-E486 IonicContact CZ-OE1 2.76Å; R456-E486 VanDerWaalsContact CZ-OE1 3.24Å; R456-E486 IonicContact NE-OE1 2.69Å; R456-E486 PolarHBondContact NE-OE1 3.12Å; R456-E486 IonicContact NH2-OE1 3.18Å; R456-E486 PolarHBondContact NH2-OE1 3.29Å
457	S	98.7	Very high	97.7	Very high	13 Å²	13	38 Å²	38	9%	0.091	22%	0.22	C	C	.	.	B	Isolated β-bridge	trans	-95.1	155.2	162.8	67.6	0	0	0	0	110.8	V459 G473 Y474	S457-V459 PolarHBondContact O-N 2.74Å; S457-G473 CarbonylContact O-C 3.54Å; S457-G473 VanDerWaalsContact O-CA 3.29Å; S457-G473 WeakPolarHBondContact O-CA 3.22Å; S457-Y474 PolarHBondContact N-O 2.99Å; S457-Y474 PolarHBondContact O-N 3.26Å; S457-Y474 PolarHBondContact OG-O 3.44Å
458	S	98.6	Very high	97.7	Very high	16 Å²	16	35.1 Å²	35.1	11%	0.112	20%	0.199	C	C	.	.	S	Bend	trans	51.8	40.8	-169.1	-52.8	0	0	0	0	112.4	T411 G473 G507	T411-S458 VanDerWaalsContact CB-N 3.35Å; T411-S458 WeakPolarHBondContact O-CA 3.34Å; T411-S458 PolarHBondContact O-N 3.21Å; T411-S458 PolarHBondContact OG1-N 3.37Å; T411-S458 VanDerWaalsContact OG1-N 3.1Å; S458-G473 WeakPolarHBondContact O-CA 3.47Å; S458-G507 WeakPolarHBondContact O-CA 3.36Å; S458-G507 PolarHBondContact O-N 3.02Å
459	V	98.9	Very high	97.7	Very high	10 Å²	10	30.9 Å²	30.9	6%	0.061	18%	0.181	C	C	.	.			trans	-86.8	135.2	-178.2	66.6	0	0	0	0	110.4	T411 V424 R456 S457 A470	T411-V459 PolarHBondContact O-N 3.47Å; V424-V459 WeakPolarHBondContact O-CG1 3.46Å; R456-V459 HydrophobicContact CB-CB 3.7Å; R456-V459 HydrophobicContact CB-CG1 4.31Å; R456-V459 HydrophobicContact CB-CG2 3.72Å; R456-V459 HydrophobicContact CG-CG2 4.4Å; S457-V459 PolarHBondContact O-N 2.74Å; V459-A470 HydrophobicContact CG2-CB 4.22Å
460	G	98.8	Very high	97.7	Very high	8 Å²	8	29.8 Å²	29.8	8%	0.082	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.8	149.1	168.6	0	0	0	0	0	110.2	V471	G460-V471 PolarHBondContact N-O 2.81Å; G460-V471 PolarHBondContact O-N 2.95Å
461	V	98.9	Very high	97.7	Very high	18 Å²	18	29 Å²	29	11%	0.109	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.7	153.1	-179.2	-66	0	0	0	0	111.7	A414 A415 V424 L468 Y469 V510	A414-V461 WeakPolarHBondContact O-CG2 3.33Å; A415-V461 HydrophobicContact CB-CG2 3.94Å; V424-V461 HydrophobicContact CB-CG1 3.88Å; V424-V461 HydrophobicContact CG1-CG1 4Å; V424-V461 HydrophobicContact CG2-CG1 4.03Å; V461-L468 HydrophobicContact CB-CD1 4.19Å; V461-Y469 WeakPolarHBondContact CA-O 3.4Å; V461-Y469 WeakPolarHBondContact CB-O 3.35Å; V461-V510 WeakPolarHBondContact O-CG1 3.4Å
462	G	98.5	Very high	97.7	Very high	6 Å²	6	26.2 Å²	26.2	6%	0.062	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-154.1	159.1	173.6	0	0	0	0	0	110.8	Y469	G462-Y469 PolarHBondContact N-O 3.08Å; G462-Y469 PolarHBondContact O-N 2.86Å
463	V	98.4	Very high	97.7	Very high	40 Å²	40	25.9 Å²	25.9	24%	0.242	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	124	-179.3	168.6	0	0	0	0	109.7	A415 V416 L417 K467 L468	A415-V463 HydrophobicContact CB-CG2 3.94Å; V416-V463 WeakPolarHBondContact O-CG2 3.11Å; L417-V463 HydrophobicContact CB-CG1 4.41Å; L417-V463 HydrophobicContact CB-CG2 4.19Å; L417-V463 HydrophobicContact CD1-CG1 3.81Å; V463-K467 VanDerWaalsContact CA-O 3.24Å; V463-K467 WeakPolarHBondContact CA-O 3.19Å; V463-L468 HydrophobicContact CG2-CB 4.05Å; V463-L468 HydrophobicContact CG2-CD1 3.7Å; V463-L468 HydrophobicContact CG2-CG 4.5Å
464	V	94.8	Very high	97.7	Very high	4 Å²	4	25.1 Å²	25.1	2%	0.024	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.1	137.5	-179.2	-164.9	0	0	0	0	108.2	G466 K467 Y469 V512 G515 L517 P537	V464-G466 PolarHBondContact O-N 3.14Å; V464-K467 PolarHBondContact N-O 3.08Å; V464-K467 PolarHBondContact O-N 3.05Å; V464-Y469 HydrophobicContact CB-CD2 4.47Å; V464-Y469 HydrophobicContact CB-CE2 3.91Å; V464-Y469 HydrophobicContact CG2-CD2 4.28Å; V464-Y469 HydrophobicContact CG2-CE2 4.16Å; V464-V512 HydrophobicContact CG2-CB 4.41Å; V464-V512 HydrophobicContact CG2-CG1 3.83Å; V464-V512 HydrophobicContact CG2-CG2 3.66Å; V464-G515 VanDerWaalsContact CG1-O 3.22Å; V464-G515 WeakPolarHBondContact CG1-O 3.2Å; V464-L517 HydrophobicContact CG2-CB 4.08Å; V464-P537 HydrophobicContact CB-CG 4.22Å; V464-P537 HydrophobicContact CG1-CG 3.93Å
465	D	90.3	Very high	97.7	Very high	108 Å²	108	24.7 Å²	24.7	58%	0.578	13%	0.134	S	C	*	.	T	Hydrogen-bonded Turn	trans	47.5	34.9	175.2	-62.6	-6.4	0	0	0	115.2	K467 Q538	D465-K467 VanDerWaalsContact C-N 3.34Å; D465-Q538 PolarHBondContact OD2-NE2 3.36Å; D465-Q538 VanDerWaalsContact OD2-NE2 3.08Å
466	G	91.7	Very high	97.5	Very high	41 Å²	41	21.4 Å²	21.4	42%	0.423	13%	0.133	S	C	.	.	T	Hydrogen-bonded Turn	trans	78.4	12.6	-179.8	0	0	0	0	0	115.1	L417 V464	L417-G466 VanDerWaalsContact CD1-O 3.32Å; L417-G466 WeakPolarHBondContact CD1-O 3.45Å; V464-G466 PolarHBondContact O-N 3.14Å
467	K	96.8	Very high	97.3	Very high	49 Å²	49	24.5 Å²	24.5	21%	0.213	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	148.2	175.4	-55.3	-64.6	-175.1	172.8	0	110.9	V463 V464 D465 Y469 E487 D489	V463-K467 VanDerWaalsContact CA-O 3.24Å; V463-K467 WeakPolarHBondContact CA-O 3.19Å; V464-K467 PolarHBondContact N-O 3.08Å; V464-K467 PolarHBondContact O-N 3.05Å; D465-K467 VanDerWaalsContact C-N 3.34Å; K467-Y469 HydrophobicContact CB-CE2 3.79Å; K467-E487 HydrophobicContact CB-CG 3.73Å; K467-E487 HydrophobicContact CD-CG 4.33Å; K467-E487 WeakPolarHBondContact CD-OE1 3.47Å; K467-E487 HydrophobicContact CG-CG 4.11Å; K467-E487 WeakPolarHBondContact CG-OE1 3.4Å; K467-D489 HydrophobicContact CD-CB 4.35Å; K467-D489 IonicContact NZ-OD1 3.56Å; K467-D489 PolarHBondContact NZ-OD1 2.9Å; K467-D489 IonicContact NZ-OD2 3.96Å; K467-D489 PolarHBondContact NZ-OD2 3.34Å
468	L	98.9	Very high	97.2	Very high	0 Å²	0	26.5 Å²	26.5	0%	0	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	126.1	177.4	165.3	67.2	0	0	0	110	A415 L417 Y422 V424 V461 V463 E487 Y488 W495	A415-L468 HydrophobicContact CB-CD1 3.73Å; L417-L468 HydrophobicContact CD2-CB 4.01Å; Y422-L468 HydrophobicContact CD1-CD2 3.85Å; Y422-L468 HydrophobicContact CD2-CD2 4.49Å; Y422-L468 HydrophobicContact CG-CD2 3.79Å; V424-L468 HydrophobicContact CG2-CD2 3.92Å; V461-L468 HydrophobicContact CB-CD1 4.19Å; V463-L468 HydrophobicContact CG2-CB 4.05Å; V463-L468 HydrophobicContact CG2-CD1 3.7Å; V463-L468 HydrophobicContact CG2-CG 4.5Å; L468-E487 CarbonylContact O-C 3.54Å; L468-Y488 HydrophobicContact CB-CD1 4.24Å; L468-Y488 HydrophobicContact CD2-CD1 4.35Å; L468-Y488 PolarHBondContact N-O 3.09Å; L468-Y488 WeakPolarHBondContact O-CB 3.47Å; L468-Y488 PolarHBondContact O-N 2.88Å; L468-W495 HydrophobicContact CD2-CH2 4.1Å; L468-W495 HydrophobicContact CD2-CZ2 4.3Å; L468-W495 HydrophobicContact CG-CH2 4.03Å
469	Y	98.9	Very high	97.1	Very high	4 Å²	4	35.2 Å²	35.2	2%	0.016	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	134.9	-178.2	-63.7	-90.6	0	0	0	111.4	V461 G462 V464 K467 E486 E487 V498 L517 F535	V461-Y469 WeakPolarHBondContact CA-O 3.4Å; V461-Y469 WeakPolarHBondContact CB-O 3.35Å; G462-Y469 PolarHBondContact N-O 3.08Å; G462-Y469 PolarHBondContact O-N 2.86Å; V464-Y469 HydrophobicContact CB-CD2 4.47Å; V464-Y469 HydrophobicContact CB-CE2 3.91Å; V464-Y469 HydrophobicContact CG2-CD2 4.28Å; V464-Y469 HydrophobicContact CG2-CE2 4.16Å; K467-Y469 HydrophobicContact CB-CE2 3.79Å; Y469-E486 CarbonylContact C-O 3.59Å; Y469-E486 VanDerWaalsContact CA-O 3.32Å; Y469-E486 WeakPolarHBondContact CA-O 3.41Å; Y469-E487 HydrophobicContact CD1-CB 3.95Å; Y469-E487 HydrophobicContact CD1-CG 4.18Å; Y469-E487 HydrophobicContact CE1-CB 3.64Å; Y469-E487 HydrophobicContact CE1-CG 3.59Å; Y469-E487 VanDerWaalsContact CE1-OE2 3.3Å; Y469-E487 WeakPolarHBondContact CE1-OE2 3.24Å; Y469-E487 VanDerWaalsContact CZ-OE2 3.3Å; Y469-E487 PolarHBondContact OH-OE2 3.1Å; Y469-V498 HydrophobicContact CD1-CG2 4.48Å; Y469-V498 HydrophobicContact CE1-CG1 4.4Å; Y469-L517 HydrophobicContact CD1-CD2 4.19Å; Y469-L517 HydrophobicContact CD2-CD2 4.16Å; Y469-L517 HydrophobicContact CG-CD2 3.69Å; Y469-F535 HydrophobicContact CD1-CE1 4.36Å; Y469-F535 AromaticContact CE1-CE1 3.79Å; Y469-F535 HydrophobicContact CE1-CE1 3.79Å
470	A	98.9	Very high	97.1	Very high	0 Å²	0	38.8 Å²	38.8	0%	0	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	107.7	172.3	0	0	0	0	0	109.9	V424 M452 V459 V485 E486 W495	V424-A470 HydrophobicContact CG1-CB 4.15Å; M452-A470 HydrophobicContact SD-CB 3.53Å; M452-A470 VanDerWaalsContact SD-CB 3.53Å; V459-A470 HydrophobicContact CG2-CB 4.22Å; A470-V485 WeakPolarHBondContact O-CA 3.3Å; A470-E486 PolarHBondContact N-O 3.31Å; A470-E486 PolarHBondContact O-N 2.78Å; A470-E486 VanDerWaalsContact O-N 3.08Å; A470-W495 HydrophobicContact CB-CE3 4.49Å; A470-W495 HydrophobicContact CB-CH2 3.84Å; A470-W495 HydrophobicContact CB-CZ3 3.56Å
471	V	98.9	Very high	97.1	Very high	0 Å²	0	38.8 Å²	38.8	0%	0	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	118.6	-165.9	-176.7	0	0	0	0	110.5	G460 G473 V485 M501 V510 L517 A519 W542	G460-V471 PolarHBondContact N-O 2.81Å; G460-V471 PolarHBondContact O-N 2.95Å; V471-G473 PolarHBondContact O-N 2.87Å; V471-V485 HydrophobicContact CB-CG1 4.48Å; V471-V485 HydrophobicContact CB-CG2 4.45Å; V471-V485 HydrophobicContact CG1-CG2 4.02Å; V471-V485 HydrophobicContact CG2-CG1 3.95Å; V471-M501 HydrophobicContact CG1-CE 3.79Å; V471-M501 HydrophobicContact CG1-SD 3.47Å; V471-M501 WeakPolarHBondContact CG1-SD 3.25Å; V471-V510 HydrophobicContact CB-CG2 3.95Å; V471-V510 HydrophobicContact CG1-CG2 4.14Å; V471-V510 HydrophobicContact CG2-CG1 4.07Å; V471-V510 HydrophobicContact CG2-CG2 4.35Å; V471-L517 HydrophobicContact CG2-CD2 3.75Å; V471-L517 HydrophobicContact CG2-CG 4.41Å; V471-A519 HydrophobicContact CG1-CB 4.06Å; V471-W542 HydrophobicContact CG1-CH2 4.24Å
472	G	98.8	Very high	97.1	Very high	0 Å²	0	38.5 Å²	38.5	0%	0	22%	0.216	C	C	.	.			trans	58.5	-132.3	174.2	0	0	0	0	0	113.2	R456 L482 T484	R456-G472 PolarHBondContact NH1-O 3.24Å; G472-L482 WeakPolarHBondContact CA-O 3.3Å; G472-T484 PolarHBondContact N-O 3.39Å
473	G	98.8	Very high	97.1	Very high	0 Å²	0	39.2 Å²	39.2	0%	0	22%	0.22	C	C	.	.			trans	94.1	-159.1	-172.5	0	0	0	0	0	112.8	S457 S458 V471 C481 L482 R505	S457-G473 CarbonylContact O-C 3.54Å; S457-G473 VanDerWaalsContact O-CA 3.29Å; S457-G473 WeakPolarHBondContact O-CA 3.22Å; S458-G473 WeakPolarHBondContact O-CA 3.47Å; V471-G473 PolarHBondContact O-N 2.87Å; G473-C481 CarbonylContact O-C 3.52Å; G473-C481 WeakPolarHBondContact O-CA 3.32Å; G473-L482 PolarHBondContact O-N 3.43Å; G473-R505 PolarHBondContact N-O 3.4Å
474	Y	98.8	Very high	97.1	Very high	77 Å²	77	38.8 Å²	38.8	30%	0.302	22%	0.217	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.4	128.3	-179.8	178.6	-94.6	0	0	0	110.3	S457 R479 Q480	S457-Y474 PolarHBondContact N-O 2.99Å; S457-Y474 PolarHBondContact O-N 3.26Å; S457-Y474 PolarHBondContact OG-O 3.44Å; Y474-R479 WeakPolarHBondContact OH-CA 3.26Å; Y474-Q480 WeakPolarHBondContact CA-O 3.32Å; Y474-Q480 WeakPolarHBondContact CD2-O 3.28Å
475	D	98.4	Very high	97.3	Very high	17 Å²	17	38.6 Å²	38.6	9%	0.091	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96	118.3	170.1	169.9	36.4	0	0	0	110.3	T454 R455 A477 S478 R479 Q480 L482	T454-D475 HydrophobicContact CG2-CB 4.01Å; R455-D475 WeakPolarHBondContact O-CA 3.49Å; R455-D475 WeakPolarHBondContact O-CB 3.44Å; D475-A477 VanDerWaalsContact C-N 3.3Å; D475-A477 PolarHBondContact O-N 2.86Å; D475-A477 WeakPolarHBondContact OD1-CB 3.47Å; D475-A477 PolarHBondContact OD1-N 2.94Å; D475-S478 VanDerWaalsContact OD2-CB 3.23Å; D475-S478 WeakPolarHBondContact OD2-CB 3.32Å; D475-S478 PolarHBondContact OD2-N 3.04Å; D475-S478 PolarHBondContact OD2-OG 2.84Å; D475-R479 WeakPolarHBondContact O-CA 3.48Å; D475-R479 PolarHBondContact O-N 2.67Å; D475-Q480 PolarHBondContact N-O 2.78Å; D475-Q480 PolarHBondContact O-N 2.86Å; D475-L482 HydrophobicContact CB-CD1 4.24Å; D475-L482 HydrophobicContact CB-CD2 4.13Å; D475-L482 HydrophobicContact CB-CG 4.47Å
476	G	94.8	Very high	97.8	Very high	38 Å²	38	33.4 Å²	33.4	39%	0.392	19%	0.189	S	C	.	.	T	Hydrogen-bonded Turn	trans	-72.4	-15.8	176.4	0	0	0	0	0	115
477	A	94.8	Very high	98.1	Very high	66 Å²	66	33.7 Å²	33.7	55%	0.545	18%	0.179	S	C	.	.	T	Hydrogen-bonded Turn	trans	-76.9	-53.9	177.4	0	0	0	0	0	111.4	D475 R479	D475-A477 VanDerWaalsContact C-N 3.3Å; D475-A477 PolarHBondContact O-N 2.86Å; D475-A477 WeakPolarHBondContact OD1-CB 3.47Å; D475-A477 PolarHBondContact OD1-N 2.94Å; A477-R479 VanDerWaalsContact C-N 3.33Å
478	S	96.1	Very high	98.2	Very high	55 Å²	55	31.6 Å²	31.6	39%	0.385	17%	0.17	S	C	.	.	T	Hydrogen-bonded Turn	trans	-77.5	-16.6	173.5	61.1	0	0	0	0	113.7	D475	D475-S478 VanDerWaalsContact OD2-CB 3.23Å; D475-S478 WeakPolarHBondContact OD2-CB 3.32Å; D475-S478 PolarHBondContact OD2-N 3.04Å; D475-S478 PolarHBondContact OD2-OG 2.84Å
479	R	97	Very high	98.1	Very high	199 Å²	199	33.4 Å²	33.4	75%	0.751	18%	0.179	S	C	*	.	T	Hydrogen-bonded Turn	trans	61.1	40.7	-173	-56.8	-178.2	174.7	-171.9	-1.4	113.3	Y474 D475 A477	Y474-R479 WeakPolarHBondContact OH-CA 3.26Å; D475-R479 WeakPolarHBondContact O-CA 3.48Å; D475-R479 PolarHBondContact O-N 2.67Å; A477-R479 VanDerWaalsContact C-N 3.33Å
480	Q	98	Very high	98	Very high	85 Å²	85	35.6 Å²	35.6	40%	0.397	19%	0.194	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	143.2	-174.8	-65.5	-174.3	12.5	0	0	112.7	Y474 D475	Y474-Q480 WeakPolarHBondContact CA-O 3.32Å; Y474-Q480 WeakPolarHBondContact CD2-O 3.28Å; D475-Q480 PolarHBondContact N-O 2.78Å; D475-Q480 PolarHBondContact O-N 2.86Å
481	C	98.7	Very high	97.8	Very high	7 Å²	7	41.9 Å²	41.9	5%	0.047	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.2	142.1	159.1	-54.3	0	0	0	0	108.5	G473 R504 D524	G473-C481 CarbonylContact O-C 3.52Å; G473-C481 WeakPolarHBondContact O-CA 3.32Å; C481-R504 HydrophobicContact CB-CB 4.13Å; C481-R504 VanDerWaalsContact O-CD 3.3Å; C481-R504 WeakPolarHBondContact O-CD 3.48Å; C481-R504 VanDerWaalsContact O-CG 3.3Å; C481-R504 WeakPolarHBondContact O-CG 3.48Å; C481-R504 PolarHBondContact O-NH1 2.88Å; C481-D524 HydrophobicContact CB-CB 4.47Å; C481-D524 WeakPolarHBondContact CB-OD1 3.34Å
482	L	98.9	Very high	97.7	Very high	12 Å²	12	45 Å²	45	6%	0.063	25%	0.254	C	S	.	.			trans	-103.2	138.5	-167.8	-59.3	171.4	0	0	0	111.9	T454 R456 G472 G473 D475 R504 R505	T454-L482 HydrophobicContact CG2-CD1 3.59Å; T454-L482 HydrophobicContact CG2-CD2 4.24Å; R456-L482 HydrophobicContact CG-CD1 3.94Å; G472-L482 WeakPolarHBondContact CA-O 3.3Å; G473-L482 PolarHBondContact O-N 3.43Å; D475-L482 HydrophobicContact CB-CD1 4.24Å; D475-L482 HydrophobicContact CB-CD2 4.13Å; D475-L482 HydrophobicContact CB-CG 4.47Å; L482-R504 WeakPolarHBondContact O-CA 3.15Å; L482-R505 PolarHBondContact O-N 3.17Å
483	S	98.8	Very high	97.7	Very high	22 Å²	22	48 Å²	48	15%	0.154	27%	0.27	C	S	.	.			trans	-91.5	-27.5	162.5	47.2	0	0	0	0	111.8	D500 M501	S483-D500 VanDerWaalsContact CB-OD2 3.26Å; S483-D500 WeakPolarHBondContact CB-OD2 3.39Å; S483-D500 PolarHBondContact OG-OD2 2.76Å; S483-M501 WeakPolarHBondContact O-CB 3.27Å; S483-M501 WeakPolarHBondContact O-CE 3.39Å; S483-M501 PolarHBondContact O-N 3.35Å
484	T	98.9	Very high	97.7	Very high	30 Å²	30	53.3 Å²	53.3	18%	0.184	30%	0.295	C	S	.	.			trans	-61.4	148	-176.7	66.2	0	0	0	0	111.9	R456 G472 Y497 D500	R456-T484 PolarHBondContact NH1-O 2.81Å; R456-T484 PolarHBondContact NH1-OG1 2.87Å; R456-T484 PolarHBondContact NH2-OG1 3.26Å; G472-T484 PolarHBondContact N-O 3.39Å; T484-Y497 HydrophobicContact CG2-CE1 4.49Å; T484-D500 WeakPolarHBondContact CA-OD1 3.42Å; T484-D500 WeakPolarHBondContact CG2-OD1 3.42Å; T484-D500 WeakPolarHBondContact CG2-OD2 3.34Å; T484-D500 PolarHBondContact N-OD2 2.74Å
485	V	98.9	Very high	97.7	Very high	0 Å²	0	50.1 Å²	50.1	0%	0	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.2	141.3	177.6	-178.1	0	0	0	0	108.3	A470 V471 Y497 V498 M501 W542	A470-V485 WeakPolarHBondContact O-CA 3.3Å; V471-V485 HydrophobicContact CB-CG1 4.48Å; V471-V485 HydrophobicContact CB-CG2 4.45Å; V471-V485 HydrophobicContact CG1-CG2 4.02Å; V471-V485 HydrophobicContact CG2-CG1 3.95Å; V485-Y497 WeakPolarHBondContact O-CA 3.43Å; V485-V498 HydrophobicContact CB-CG2 3.74Å; V485-V498 HydrophobicContact CG1-CG2 3.62Å; V485-V498 PolarHBondContact O-N 2.9Å; V485-M501 HydrophobicContact CG2-CE 4.18Å; V485-M501 HydrophobicContact CG2-CG 3.95Å; V485-M501 HydrophobicContact CG2-SD 4.43Å; V485-W542 HydrophobicContact CG1-CZ2 4.47Å; V485-W542 HydrophobicContact CG2-CZ2 3.84Å
486	E	98.9	Very high	97.7	Very high	0 Å²	0	53.1 Å²	53.1	0%	0	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	140.5	177.4	-66.5	171	-112.6	0	0	110.4	N453 T454 R456 Y469 A470 W495 C496 Y497	N453-E486 VanDerWaalsContact CB-OE2 3.26Å; N453-E486 WeakPolarHBondContact CB-OE2 3.49Å; N453-E486 PolarHBondContact N-OE2 2.86Å; N453-E486 PolarHBondContact ND2-OE2 3.27Å; T454-E486 PolarHBondContact N-OE1 3.38Å; R456-E486 IonicContact CZ-OE1 2.76Å; R456-E486 VanDerWaalsContact CZ-OE1 3.24Å; R456-E486 IonicContact NE-OE1 2.69Å; R456-E486 PolarHBondContact NE-OE1 3.12Å; R456-E486 IonicContact NH2-OE1 3.18Å; R456-E486 PolarHBondContact NH2-OE1 3.29Å; Y469-E486 CarbonylContact C-O 3.59Å; Y469-E486 VanDerWaalsContact CA-O 3.32Å; Y469-E486 WeakPolarHBondContact CA-O 3.41Å; A470-E486 PolarHBondContact N-O 3.31Å; A470-E486 PolarHBondContact O-N 2.78Å; A470-E486 VanDerWaalsContact O-N 3.08Å; E486-W495 HydrophobicContact CB-CE3 3.65Å; E486-W495 HydrophobicContact CB-CZ3 4.21Å; E486-C496 CarbonylContact C-O 3.57Å; E486-C496 VanDerWaalsContact CA-O 3.23Å; E486-C496 WeakPolarHBondContact CA-O 3.47Å; E486-Y497 HydrophobicContact CG-CD1 3.54Å; E486-Y497 HydrophobicContact CG-CE1 3.58Å; E486-Y497 HydrophobicContact CG-CG 4.22Å
487	E	98.9	Very high	97.9	Very high	46 Å²	46	56.7 Å²	56.7	22%	0.215	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	135.4	171.1	-176.8	-174.1	116.8	0	0	109.5	K467 L468 Y469 W495 C496 V498	K467-E487 HydrophobicContact CB-CG 3.73Å; K467-E487 HydrophobicContact CD-CG 4.33Å; K467-E487 WeakPolarHBondContact CD-OE1 3.47Å; K467-E487 HydrophobicContact CG-CG 4.11Å; K467-E487 WeakPolarHBondContact CG-OE1 3.4Å; L468-E487 CarbonylContact O-C 3.54Å; Y469-E487 HydrophobicContact CD1-CB 3.95Å; Y469-E487 HydrophobicContact CD1-CG 4.18Å; Y469-E487 HydrophobicContact CE1-CB 3.64Å; Y469-E487 HydrophobicContact CE1-CG 3.59Å; Y469-E487 VanDerWaalsContact CE1-OE2 3.3Å; Y469-E487 WeakPolarHBondContact CE1-OE2 3.24Å; Y469-E487 VanDerWaalsContact CZ-OE2 3.3Å; Y469-E487 PolarHBondContact OH-OE2 3.1Å; E487-W495 CarbonylContact O-C 3.54Å; E487-W495 VanDerWaalsContact O-CA 3.29Å; E487-W495 WeakPolarHBondContact O-CA 3.42Å; E487-C496 PolarHBondContact N-O 2.86Å; E487-C496 PolarHBondContact O-N 2.99Å; E487-V498 HydrophobicContact CB-CG1 3.68Å
488	Y	98.9	Very high	98.1	Very high	6 Å²	6	54.5 Å²	54.5	2%	0.024	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	127.5	171.2	176.4	-106.5	0	0	0	111.2	L417 Y422 V449 A450 L468 P490 D493 Q494 W495	L417-Y488 HydrophobicContact CD2-CD1 4.34Å; Y422-Y488 HydrophobicContact CE1-CD1 4.36Å; Y422-Y488 AromaticContact CE1-CE1 3.67Å; Y422-Y488 HydrophobicContact CE1-CE1 3.67Å; V449-Y488 HydrophobicContact CG2-CE2 4.4Å; A450-Y488 HydrophobicContact CB-CE2 4.4Å; L468-Y488 HydrophobicContact CB-CD1 4.24Å; L468-Y488 HydrophobicContact CD2-CD1 4.35Å; L468-Y488 PolarHBondContact N-O 3.09Å; L468-Y488 WeakPolarHBondContact O-CB 3.47Å; L468-Y488 PolarHBondContact O-N 2.88Å; Y488-P490 HydrophobicContact CE1-CB 3.84Å; Y488-D493 WeakPolarHBondContact CE2-OD1 3.42Å; Y488-D493 PolarHBondContact OH-OD1 2.89Å; Y488-Q494 WeakPolarHBondContact CA-O 3.44Å; Y488-Q494 WeakPolarHBondContact CD2-O 3.19Å; Y488-W495 AromaticContact CD2-CD1 3.75Å; Y488-W495 HydrophobicContact CD2-CD2 4.07Å; Y488-W495 AromaticContact CD2-CE2 3.67Å; Y488-W495 HydrophobicContact CD2-CG 4.14Å; Y488-W495 HydrophobicContact CD2-CZ2 4.19Å; Y488-W495 AromaticContact CD2-NE1 3.44Å; Y488-W495 HydrophobicContact CG-CD2 4.31Å; Y488-W495 AromaticContact CG-CE2 3.92Å; Y488-W495 HydrophobicContact CG-CZ2 4.02Å
489	D	97.6	Very high	98.2	Very high	38 Å²	38	53.2 Å²	53.2	20%	0.203	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.9	112.8	168.9	-173.5	-0.2	0	0	0	110.5	K467 V491 S492 D493 Q494	K467-D489 HydrophobicContact CD-CB 4.35Å; K467-D489 IonicContact NZ-OD1 3.56Å; K467-D489 PolarHBondContact NZ-OD1 2.9Å; K467-D489 IonicContact NZ-OD2 3.96Å; K467-D489 PolarHBondContact NZ-OD2 3.34Å; D489-V491 PolarHBondContact O-N 3.23Å; D489-V491 WeakPolarHBondContact OD1-CB 3.41Å; D489-V491 PolarHBondContact OD1-N 2.85Å; D489-S492 WeakPolarHBondContact CB-OG 3.29Å; D489-D493 WeakPolarHBondContact O-CA 3.44Å; D489-D493 PolarHBondContact O-N 2.75Å; D489-Q494 PolarHBondContact N-O 3.07Å; D489-Q494 PolarHBondContact O-N 2.95Å
490	P	95.2	Very high	98.3	Very high	49 Å²	49	47.3 Å²	47.3	32%	0.318	26%	0.262	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.8	-16.8	176.9	32	-39.1	0	0	0	113.4	L417 Y488	L417-P490 HydrophobicContact CD2-CB 4.1Å; L417-P490 HydrophobicContact CD2-CG 3.86Å; Y488-P490 HydrophobicContact CE1-CB 3.84Å
491	V	95.3	Very high	98.3	Very high	132 Å²	132	43.6 Å²	43.6	80%	0.8	24%	0.244	S	C	*	.	T	Hydrogen-bonded Turn	trans	-80.3	-40.9	-178.7	-178.2	0	0	0	0	111.3	D489	D489-V491 PolarHBondContact O-N 3.23Å; D489-V491 WeakPolarHBondContact OD1-CB 3.41Å; D489-V491 PolarHBondContact OD1-N 2.85Å
492	S	97.2	Very high	98.3	Very high	65 Å²	65	46.9 Å²	46.9	46%	0.455	27%	0.268	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.6	-10.9	176	62.5	0	0	0	0	113.9	D489	D489-S492 WeakPolarHBondContact CB-OG 3.29Å
493	D	98.2	Very high	98.2	Very high	64 Å²	64	48.2 Å²	48.2	34%	0.342	28%	0.276	S	S	.	.	T	Hydrogen-bonded Turn	trans	49.9	59.3	-169.1	-173.6	29.4	0	0	0	111.2	A450 Y488 D489	A450-D493 WeakPolarHBondContact CB-O 3.39Å; A450-D493 WeakPolarHBondContact CB-OD1 3.4Å; A450-D493 PolarHBondContact N-OD1 3.26Å; A450-D493 PolarHBondContact N-OD2 2.89Å; Y488-D493 WeakPolarHBondContact CE2-OD1 3.42Å; Y488-D493 PolarHBondContact OH-OD1 2.89Å; D489-D493 WeakPolarHBondContact O-CA 3.44Å; D489-D493 PolarHBondContact O-N 2.75Å
494	Q	98.6	Very high	98.2	Very high	111 Å²	111	51.2 Å²	51.2	52%	0.519	28%	0.284	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.7	151.2	-178.6	-68.7	-63.3	-65.8	0	0	111.8	Y488 D489	Y488-Q494 WeakPolarHBondContact CA-O 3.44Å; Y488-Q494 WeakPolarHBondContact CD2-O 3.19Å; D489-Q494 PolarHBondContact N-O 3.07Å; D489-Q494 PolarHBondContact O-N 2.95Å
495	W	98.9	Very high	98.2	Very high	10 Å²	10	49.8 Å²	49.8	4%	0.038	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	128.5	170.9	-72.5	90.3	0	0	0	110.9	V424 V436 A450 S451 M452 N453 L468 A470 E486 E487 Y488	V424-W495 HydrophobicContact CG1-CH2 4.15Å; V424-W495 HydrophobicContact CG1-CZ2 4.35Å; V436-W495 HydrophobicContact CG1-CZ2 4.46Å; V436-W495 HydrophobicContact CG2-CZ2 3.81Å; A450-W495 VanDerWaalsContact O-CD1 3.28Å; A450-W495 PolarHBondContact O-NE1 2.75Å; S451-W495 VanDerWaalsContact C-CD1 3.46Å; M452-W495 HydrophobicContact CB-CD2 4.47Å; M452-W495 HydrophobicContact CG-CD2 3.68Å; M452-W495 HydrophobicContact CG-CE3 4.04Å; M452-W495 HydrophobicContact CG-CG 4.19Å; M452-W495 HydrophobicContact CG-CH2 4.16Å; M452-W495 HydrophobicContact CG-CZ2 3.84Å; M452-W495 HydrophobicContact CG-CZ3 4.26Å; M452-W495 HydrophobicContact SD-CH2 4.36Å; M452-W495 HydrophobicContact SD-CZ2 4.46Å; N453-W495 PolarHBondContact ND2-O 3.3Å; L468-W495 HydrophobicContact CD2-CH2 4.1Å; L468-W495 HydrophobicContact CD2-CZ2 4.3Å; L468-W495 HydrophobicContact CG-CH2 4.03Å; A470-W495 HydrophobicContact CB-CE3 4.49Å; A470-W495 HydrophobicContact CB-CH2 3.84Å; A470-W495 HydrophobicContact CB-CZ3 3.56Å; E486-W495 HydrophobicContact CB-CE3 3.65Å; E486-W495 HydrophobicContact CB-CZ3 4.21Å; E487-W495 CarbonylContact O-C 3.54Å; E487-W495 VanDerWaalsContact O-CA 3.29Å; E487-W495 WeakPolarHBondContact O-CA 3.42Å; Y488-W495 AromaticContact CD2-CD1 3.75Å; Y488-W495 HydrophobicContact CD2-CD2 4.07Å; Y488-W495 AromaticContact CD2-CE2 3.67Å; Y488-W495 HydrophobicContact CD2-CG 4.14Å; Y488-W495 HydrophobicContact CD2-CZ2 4.19Å; Y488-W495 AromaticContact CD2-NE1 3.44Å; Y488-W495 HydrophobicContact CG-CD2 4.31Å; Y488-W495 AromaticContact CG-CE2 3.92Å; Y488-W495 HydrophobicContact CG-CZ2 4.02Å
496	C	98.6	Very high	98.2	Very high	80 Å²	80	49.9 Å²	49.9	54%	0.541	28%	0.276	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	144.5	177.1	-71.1	0	0	0	0	110.6	E486 E487	E486-C496 CarbonylContact C-O 3.57Å; E486-C496 VanDerWaalsContact CA-O 3.23Å; E486-C496 WeakPolarHBondContact CA-O 3.47Å; E487-C496 PolarHBondContact N-O 2.86Å; E487-C496 PolarHBondContact O-N 2.99Å
497	Y	98.9	Very high	98.2	Very high	114 Å²	114	50.2 Å²	50.2	45%	0.447	28%	0.279	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.6	135.9	170	-69.8	-77	0	0	0	110.9	N453 T454 T484 V485 E486	N453-Y497 HydrophobicContact CB-CE2 3.63Å; N453-Y497 VanDerWaalsContact CB-OH 3.26Å; N453-Y497 WeakPolarHBondContact CB-OH 3.35Å; T454-Y497 PolarHBondContact OG1-OH 2.92Å; T484-Y497 HydrophobicContact CG2-CE1 4.49Å; V485-Y497 WeakPolarHBondContact O-CA 3.43Å; E486-Y497 HydrophobicContact CG-CD1 3.54Å; E486-Y497 HydrophobicContact CG-CE1 3.58Å; E486-Y497 HydrophobicContact CG-CG 4.22Å
498	V	98.8	Very high	98.2	Very high	20 Å²	20	48.5 Å²	48.5	12%	0.121	27%	0.273	C	S	.	.			trans	-107	-173.2	168.5	-62.4	0	0	0	0	109.4	Y469 V485 E487 D500 F535	Y469-V498 HydrophobicContact CD1-CG2 4.48Å; Y469-V498 HydrophobicContact CE1-CG1 4.4Å; V485-V498 HydrophobicContact CB-CG2 3.74Å; V485-V498 HydrophobicContact CG1-CG2 3.62Å; V485-V498 PolarHBondContact O-N 2.9Å; E487-V498 HydrophobicContact CB-CG1 3.68Å; V498-D500 PolarHBondContact O-N 3.23Å; V498-F535 HydrophobicContact CB-CE2 4.49Å; V498-F535 HydrophobicContact CB-CZ 4.02Å; V498-F535 HydrophobicContact CG2-CE2 4.42Å; V498-F535 HydrophobicContact CG2-CZ 4.03Å
499	A	98.7	Very high	98.2	Very high	27 Å²	27	48.3 Å²	48.3	22%	0.223	27%	0.273	C	S	.	.	P	Polyproline II helix	trans	-56.2	135.2	178.9	0	0	0	0	0	112.1	F535 N540 W542	A499-F535 HydrophobicContact CB-CE2 4.25Å; A499-N540 VanDerWaalsContact CB-O 3.29Å; A499-N540 WeakPolarHBondContact CB-O 3.47Å; A499-N540 WeakPolarHBondContact CB-OD1 3.26Å; A499-N540 PolarHBondContact N-OD1 3.46Å; A499-W542 PolarHBondContact O-NE1 2.83Å
500	D	98.8	Very high	98.3	Very high	76 Å²	76	47.3 Å²	47.3	41%	0.406	27%	0.268	S	S	.	.	P	Polyproline II helix	trans	-65	142.9	173.6	-99.1	53.2	0	0	0	111.1	S483 T484 V498	S483-D500 VanDerWaalsContact CB-OD2 3.26Å; S483-D500 WeakPolarHBondContact CB-OD2 3.39Å; S483-D500 PolarHBondContact OG-OD2 2.76Å; T484-D500 WeakPolarHBondContact CA-OD1 3.42Å; T484-D500 WeakPolarHBondContact CG2-OD1 3.42Å; T484-D500 WeakPolarHBondContact CG2-OD2 3.34Å; T484-D500 PolarHBondContact N-OD2 2.74Å; V498-D500 PolarHBondContact O-N 3.23Å
501	M	98.8	Very high	98.4	Very high	7 Å²	7	45.4 Å²	45.4	3%	0.034	26%	0.257	C	S	.	.	P	Polyproline II helix	trans	-60.9	149.7	165.8	-71.5	-178.9	-65.3	0	0	110.6	V471 S483 V485 T503 R505 A519 E533 W542	V471-M501 HydrophobicContact CG1-CE 3.79Å; V471-M501 HydrophobicContact CG1-SD 3.47Å; V471-M501 WeakPolarHBondContact CG1-SD 3.25Å; S483-M501 WeakPolarHBondContact O-CB 3.27Å; S483-M501 WeakPolarHBondContact O-CE 3.39Å; S483-M501 PolarHBondContact O-N 3.35Å; V485-M501 HydrophobicContact CG2-CE 4.18Å; V485-M501 HydrophobicContact CG2-CG 3.95Å; V485-M501 HydrophobicContact CG2-SD 4.43Å; M501-T503 WeakPolarHBondContact CB-O 3.49Å; M501-T503 PolarHBondContact O-N 3.5Å; M501-R505 HydrophobicContact CE-CB 4.12Å; M501-R505 HydrophobicContact CE-CG 4.29Å; M501-R505 HydrophobicContact SD-CG 4.33Å; M501-A519 HydrophobicContact SD-CB 3.68Å; M501-E533 WeakPolarHBondContact CA-OE2 3.29Å; M501-E533 HydrophobicContact CG-CG 4.4Å; M501-W542 HydrophobicContact CG-CD2 3.92Å; M501-W542 HydrophobicContact CG-CE3 4.21Å; M501-W542 HydrophobicContact CG-CH2 3.96Å; M501-W542 HydrophobicContact CG-CZ2 3.67Å; M501-W542 HydrophobicContact CG-CZ3 4.22Å; M501-W542 HydrophobicContact SD-CH2 4.28Å; M501-W542 HydrophobicContact SD-CZ2 4.44Å
502	S	98.3	Very high	98.5	Very high	76 Å²	76	41.2 Å²	41.2	53%	0.531	23%	0.232	S	C	.	.	S	Bend	trans	-56.6	-24.2	175.3	62.6	0	0	0	0	113.7	E533	S502-E533 WeakPolarHBondContact CB-OE2 3.16Å; S502-E533 PolarHBondContact N-OE2 3.2Å; S502-E533 PolarHBondContact OG-OE1 3.4Å; S502-E533 PolarHBondContact OG-OE2 3.01Å
503	T	98.1	Very high	98.4	Very high	39 Å²	39	38.9 Å²	38.9	24%	0.239	21%	0.214	C	C	.	.	S	Bend	trans	-144.3	158.6	179	65.5	0	0	0	0	112.8	M501 R529	M501-T503 WeakPolarHBondContact CB-O 3.49Å; M501-T503 PolarHBondContact O-N 3.5Å; T503-R529 VanDerWaalsContact CB-CZ 3.49Å; T503-R529 PolarHBondContact OG1-NE 3.03Å
504	R	98.8	Very high	97.9	Very high	85 Å²	85	39.5 Å²	39.5	32%	0.321	24%	0.236	S	C	.	.			trans	-71.6	132.1	175	-65.5	168.4	-180	-93.2	7.2	111.3	C481 L482 D524 R529	C481-R504 HydrophobicContact CB-CB 4.13Å; C481-R504 VanDerWaalsContact O-CD 3.3Å; C481-R504 WeakPolarHBondContact O-CD 3.48Å; C481-R504 VanDerWaalsContact O-CG 3.3Å; C481-R504 WeakPolarHBondContact O-CG 3.48Å; C481-R504 PolarHBondContact O-NH1 2.88Å; L482-R504 WeakPolarHBondContact O-CA 3.15Å; R504-D524 HydrophobicContact CB-CB 4.2Å; R504-D524 WeakPolarHBondContact CD-OD2 3.3Å; R504-R529 PolarHBondContact O-NE 2.89Å; R504-R529 PolarHBondContact O-NH2 3.48Å
505	R	98.8	Very high	97.5	Very high	0 Å²	0	35.9 Å²	35.9	0%	0	23%	0.228	C	C	.	.			trans	-140.6	100.3	-178	-53	-179	-178.1	-101.1	5.1	112.1	G473 L482 M501 A508 G521 S531 E533	G473-R505 PolarHBondContact N-O 3.4Å; L482-R505 PolarHBondContact O-N 3.17Å; M501-R505 HydrophobicContact CE-CB 4.12Å; M501-R505 HydrophobicContact CE-CG 4.29Å; M501-R505 HydrophobicContact SD-CG 4.33Å; R505-A508 HydrophobicContact CB-CB 4.03Å; R505-G521 WeakPolarHBondContact CD-O 3.32Å; R505-G521 PolarHBondContact NH1-O 3.11Å; R505-S531 PolarHBondContact NH1-O 3.49Å; R505-S531 PolarHBondContact NH2-OG 3.22Å; R505-E533 IonicContact CZ-OE1 3.23Å; R505-E533 IonicContact NE-OE1 2.74Å; R505-E533 PolarHBondContact NE-OE1 3.03Å; R505-E533 IonicContact NH2-OE1 3.87Å; R505-E533 PolarHBondContact NH2-OE1 3.43Å
506	S	98.8	Very high	97.4	Very high	3 Å²	3	37.1 Å²	37.1	2%	0.021	24%	0.235	C	C	.	.	B	Isolated β-bridge	trans	-85	141.5	160.1	169.1	0	0	0	0	109.5	A508 G522 H523	S506-A508 VanDerWaalsContact C-N 3.28Å; S506-A508 PolarHBondContact O-N 3.27Å; S506-G522 CarbonylContact O-C 3.54Å; S506-G522 WeakPolarHBondContact O-CA 3.34Å; S506-H523 WeakPolarHBondContact CB-NE2 3.02Å; S506-H523 PolarHBondContact N-O 3.11Å; S506-H523 PolarHBondContact O-CD2 3.3Å; S506-H523 PolarHBondContact O-N 3.19Å; S506-H523 PolarHBondContact OG-NE2 3.38Å; S506-H523 VanDerWaalsContact OG-NE2 3.11Å
507	G	98.5	Very high	97.4	Very high	6 Å²	6	33.3 Å²	33.3	6%	0.062	21%	0.209	C	C	.	.	S	Bend	trans	62.7	32	177.8	0	0	0	0	0	114	S458 G522 R553 N554	S458-G507 WeakPolarHBondContact O-CA 3.36Å; S458-G507 PolarHBondContact O-N 3.02Å; G507-G522 WeakPolarHBondContact O-CA 3.49Å; G507-R553 WeakPolarHBondContact O-CA 3.49Å; G507-N554 PolarHBondContact O-N 3.25Å
508	A	98.7	Very high	97.4	Very high	10 Å²	10	28.1 Å²	28.1	8%	0.083	19%	0.189	C	C	.	.			trans	-65.4	141	170.8	0	0	0	0	0	110.4	R505 S506 V510	R505-A508 HydrophobicContact CB-CB 4.03Å; S506-A508 VanDerWaalsContact C-N 3.28Å; S506-A508 PolarHBondContact O-N 3.27Å; A508-V510 HydrophobicContact CB-CG2 4.22Å
509	G	98.6	Very high	97.4	Very high	3 Å²	3	27.1 Å²	27.1	3%	0.031	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.8	126.4	162.4	0	0	0	0	0	108.7	A520	G509-A520 PolarHBondContact N-O 2.76Å; G509-A520 PolarHBondContact O-N 2.83Å
510	V	98.8	Very high	97.4	Very high	17 Å²	17	26 Å²	26	10%	0.103	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	135.1	-177.1	177	0	0	0	0	109.9	V461 V471 A508 L517 Y518	V461-V510 WeakPolarHBondContact O-CG1 3.4Å; V471-V510 HydrophobicContact CB-CG2 3.95Å; V471-V510 HydrophobicContact CG1-CG2 4.14Å; V471-V510 HydrophobicContact CG2-CG1 4.07Å; V471-V510 HydrophobicContact CG2-CG2 4.35Å; A508-V510 HydrophobicContact CB-CG2 4.22Å; V510-L517 HydrophobicContact CG1-CD1 3.63Å; V510-L517 HydrophobicContact CG1-CG 4.43Å; V510-Y518 WeakPolarHBondContact CA-O 3.28Å
511	G	98.1	Very high	97.4	Very high	8 Å²	8	22.4 Å²	22.4	8%	0.082	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-157.7	166.3	179.7	0	0	0	0	0	111.8	Y518	G511-Y518 PolarHBondContact N-O 3.12Å; G511-Y518 PolarHBondContact O-N 2.88Å
512	V	97.8	Very high	97.4	Very high	44 Å²	44	22 Å²	22	27%	0.267	15%	0.153	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	128.3	-174.6	175.1	0	0	0	0	109.4	V464 L516 L517 A559	V464-V512 HydrophobicContact CG2-CB 4.41Å; V464-V512 HydrophobicContact CG2-CG1 3.83Å; V464-V512 HydrophobicContact CG2-CG2 3.66Å; V512-L516 WeakPolarHBondContact CA-O 3.37Å; V512-L517 HydrophobicContact CG2-CD1 3.74Å; V512-A559 WeakPolarHBondContact O-CB 3.44Å
513	L	95.3	Very high	97.4	Very high	17 Å²	17	19.6 Å²	19.6	9%	0.089	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143	124.5	179	172.6	62.9	0	0	0	110.1	G515 L516 Y518 A559 L564 P584	L513-G515 VanDerWaalsContact C-N 3.33Å; L513-G515 PolarHBondContact O-N 3.1Å; L513-L516 PolarHBondContact N-O 3.48Å; L513-L516 PolarHBondContact O-N 2.9Å; L513-L516 VanDerWaalsContact O-N 3.15Å; L513-Y518 HydrophobicContact CB-CD2 4.21Å; L513-Y518 HydrophobicContact CB-CE2 3.75Å; L513-Y518 HydrophobicContact CG-CE2 4.49Å; L513-A559 HydrophobicContact CB-CB 4.24Å; L513-A559 HydrophobicContact CD1-CB 4.35Å; L513-L564 HydrophobicContact CD2-CB 3.88Å; L513-P584 HydrophobicContact CD2-CG 3.85Å
514	G	87.3	Confident	97.4	Very high	77 Å²	77	20.5 Å²	20.5	79%	0.794	14%	0.136	S	C	*	.	T	Hydrogen-bonded Turn	trans	63.6	33.3	176.2	0	0	0	0	0	114.5	L516	G514-L516 VanDerWaalsContact C-N 3.27Å; G514-L516 PolarHBondContact O-N 3.41Å
515	G	91.1	Very high	97.3	Very high	35 Å²	35	18.3 Å²	18.3	36%	0.361	14%	0.141	S	C	.	.	T	Hydrogen-bonded Turn	trans	76.2	10.6	-175.9	0	0	0	0	0	114.4	V464 L513	V464-G515 VanDerWaalsContact CG1-O 3.22Å; V464-G515 WeakPolarHBondContact CG1-O 3.2Å; L513-G515 VanDerWaalsContact C-N 3.33Å; L513-G515 PolarHBondContact O-N 3.1Å
516	L	95.9	Very high	97.1	Very high	35 Å²	35	24.5 Å²	24.5	18%	0.183	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	146.3	179.1	-58	177	0	0	0	111.2	V512 L513 G514 Y518 V534 D536	V512-L516 WeakPolarHBondContact CA-O 3.37Å; L513-L516 PolarHBondContact N-O 3.48Å; L513-L516 PolarHBondContact O-N 2.9Å; L513-L516 VanDerWaalsContact O-N 3.15Å; G514-L516 VanDerWaalsContact C-N 3.27Å; G514-L516 PolarHBondContact O-N 3.41Å; L516-Y518 HydrophobicContact CB-CE2 3.89Å; L516-Y518 WeakPolarHBondContact O-CD2 3.25Å; L516-V534 HydrophobicContact CB-CG2 3.55Å; L516-V534 HydrophobicContact CD1-CG2 4.01Å; L516-V534 HydrophobicContact CG-CG2 4.34Å; L516-D536 HydrophobicContact CD2-CB 3.76Å
517	L	98.6	Very high	97.1	Very high	0 Å²	0	29.3 Å²	29.3	0%	0	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.1	122.4	-178.1	178.5	72.5	0	0	0	110.1	V464 Y469 V471 V510 V512 V534 F535 W542	V464-L517 HydrophobicContact CG2-CB 4.08Å; Y469-L517 HydrophobicContact CD1-CD2 4.19Å; Y469-L517 HydrophobicContact CD2-CD2 4.16Å; Y469-L517 HydrophobicContact CG-CD2 3.69Å; V471-L517 HydrophobicContact CG2-CD2 3.75Å; V471-L517 HydrophobicContact CG2-CG 4.41Å; V510-L517 HydrophobicContact CG1-CD1 3.63Å; V510-L517 HydrophobicContact CG1-CG 4.43Å; V512-L517 HydrophobicContact CG2-CD1 3.74Å; L517-V534 CarbonylContact O-C 3.49Å; L517-V534 WeakPolarHBondContact O-CA 3.43Å; L517-F535 HydrophobicContact CB-CB 4.22Å; L517-F535 HydrophobicContact CB-CD1 4.39Å; L517-F535 HydrophobicContact CD2-CD1 4.3Å; L517-F535 PolarHBondContact N-O 2.59Å; L517-F535 VanDerWaalsContact N-O 3.09Å; L517-F535 PolarHBondContact O-N 3.22Å; L517-W542 HydrophobicContact CD2-CH2 4.49Å
518	Y	98.9	Very high	97.1	Very high	5 Å²	5	29.7 Å²	29.7	2%	0.02	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	136.5	-176.4	-69.1	-104.7	0	0	0	111.2	V510 G511 L513 L516 V532 V534 L564 Y582	V510-Y518 WeakPolarHBondContact CA-O 3.28Å; G511-Y518 PolarHBondContact N-O 3.12Å; G511-Y518 PolarHBondContact O-N 2.88Å; L513-Y518 HydrophobicContact CB-CD2 4.21Å; L513-Y518 HydrophobicContact CB-CE2 3.75Å; L513-Y518 HydrophobicContact CG-CE2 4.49Å; L516-Y518 HydrophobicContact CB-CE2 3.89Å; L516-Y518 WeakPolarHBondContact O-CD2 3.25Å; Y518-V532 HydrophobicContact CD1-CG1 4.37Å; Y518-V534 HydrophobicContact CD1-CB 3.8Å; Y518-V534 HydrophobicContact CD1-CG2 3.87Å; Y518-V534 HydrophobicContact CD2-CG2 3.89Å; Y518-V534 HydrophobicContact CE1-CB 3.74Å; Y518-V534 HydrophobicContact CE1-CG1 4.49Å; Y518-V534 HydrophobicContact CE1-CG2 3.63Å; Y518-V534 HydrophobicContact CE2-CG2 3.64Å; Y518-V534 HydrophobicContact CG-CB 4.27Å; Y518-V534 HydrophobicContact CG-CG2 3.99Å; Y518-L564 HydrophobicContact CD1-CD2 3.95Å; Y518-L564 HydrophobicContact CD2-CD2 4.26Å; Y518-L564 HydrophobicContact CG-CD2 3.67Å; Y518-Y582 HydrophobicContact CE1-CD1 4.04Å; Y518-Y582 AromaticContact CE1-CE1 3.59Å; Y518-Y582 HydrophobicContact CE1-CE1 3.59Å
519	A	98.9	Very high	97.1	Very high	0 Å²	0	30.9 Å²	30.9	0%	0	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	98.2	172.4	0	0	0	0	0	109.8	V471 M501 V532 E533 W542	V471-A519 HydrophobicContact CG1-CB 4.06Å; M501-A519 HydrophobicContact SD-CB 3.68Å; A519-V532 WeakPolarHBondContact O-CA 3.33Å; A519-E533 HydrophobicContact CB-CG 4.15Å; A519-E533 PolarHBondContact N-O 2.93Å; A519-E533 PolarHBondContact O-N 3.18Å; A519-W542 HydrophobicContact CB-CH2 3.98Å; A519-W542 HydrophobicContact CB-CZ3 3.79Å
520	A	98.8	Very high	97.1	Very high	3 Å²	3	34.7 Å²	34.7	3%	0.025	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.4	123.6	-176.8	0	0	0	0	0	111.9	G509 G522 V532 M548 V566	G509-A520 PolarHBondContact N-O 2.76Å; G509-A520 PolarHBondContact O-N 2.83Å; A520-G522 PolarHBondContact O-N 3.49Å; A520-V532 HydrophobicContact CB-CG1 4.18Å; A520-V532 HydrophobicContact CB-CG2 4.07Å; A520-M548 HydrophobicContact CB-CE 4.38Å; A520-M548 HydrophobicContact CB-SD 4.11Å; A520-V566 HydrophobicContact CB-CG2 4.08Å
521	G	98.8	Very high	97.1	Very high	0 Å²	0	35 Å²	35	0%	0	23%	0.228	C	C	.	.			trans	62.5	-126.5	173	0	0	0	0	0	113.9	R505 R529 S531 R552	R505-G521 WeakPolarHBondContact CD-O 3.32Å; R505-G521 PolarHBondContact NH1-O 3.11Å; G521-R529 WeakPolarHBondContact CA-O 3.25Å; G521-S531 PolarHBondContact N-O 3.08Å; G521-R552 CarbonylContact C-O 3.58Å; G521-R552 WeakPolarHBondContact CA-O 3.19Å
522	G	98.8	Very high	97.1	Very high	0 Å²	0	34.7 Å²	34.7	0%	0	22%	0.224	C	C	.	.			trans	80.7	-169.2	-168.8	0	0	0	0	0	112.2	S506 G507 A520 R529 R552	S506-G522 CarbonylContact O-C 3.54Å; S506-G522 WeakPolarHBondContact O-CA 3.34Å; G507-G522 WeakPolarHBondContact O-CA 3.49Å; A520-G522 PolarHBondContact O-N 3.49Å; G522-R529 WeakPolarHBondContact O-CB 3.4Å; G522-R529 PolarHBondContact O-N 3.01Å; G522-R552 PolarHBondContact N-O 2.98Å
523	H	98.8	Very high	97.2	Very high	25 Å²	25	32.6 Å²	32.6	12%	0.116	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.8	160.1	-178.1	74.2	103.8	0	0	0	114	S506 G525 L527 V528 R553	S506-H523 WeakPolarHBondContact CB-NE2 3.02Å; S506-H523 PolarHBondContact N-O 3.11Å; S506-H523 PolarHBondContact O-CD2 3.3Å; S506-H523 PolarHBondContact O-N 3.19Å; S506-H523 PolarHBondContact OG-NE2 3.38Å; S506-H523 VanDerWaalsContact OG-NE2 3.11Å; H523-G525 PolarHBondContact ND1-O 2.85Å; H523-L527 CarbonylContact C-O 3.51Å; H523-L527 WeakPolarHBondContact CA-O 3.45Å; H523-L527 WeakPolarHBondContact CB-O 3.45Å; H523-V528 HydrophobicContact CB-CG2 4.1Å; H523-R553 HydrophobicContact CB-CB 4.44Å; H523-R553 WeakPolarHBondContact CD2-CD 3.4Å
524	D	98.4	Very high	97.3	Very high	57 Å²	57	31.9 Å²	31.9	31%	0.305	21%	0.208	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	106.5	165.7	-169	10.9	0	0	0	109	C481 R504 L527	C481-D524 HydrophobicContact CB-CB 4.47Å; C481-D524 WeakPolarHBondContact CB-OD1 3.34Å; R504-D524 HydrophobicContact CB-CB 4.2Å; R504-D524 WeakPolarHBondContact CD-OD2 3.3Å; D524-L527 PolarHBondContact N-O 3.31Å; D524-L527 WeakPolarHBondContact O-CB 3.47Å; D524-L527 PolarHBondContact O-N 3.02Å
525	G	95.6	Very high	97.9	Very high	40 Å²	40	28.3 Å²	28.3	41%	0.412	17%	0.17	S	C	.	.	T	Hydrogen-bonded Turn	trans	56.4	-123.4	-168	0	0	0	0	0	111.3	H523	H523-G525 PolarHBondContact ND1-O 2.85Å
526	P	95.4	Very high	98.2	Very high	129 Å²	129	29.2 Å²	29.2	84%	0.838	17%	0.167	S	C	*	.	T	Hydrogen-bonded Turn	trans	-79.3	-14.2	176.6	34.2	-35.6	0	0	0	114.1	V528	P526-V528 PolarHBondContact O-N 2.94Å
527	L	98	Very high	98.2	Very high	104 Å²	104	28.8 Å²	28.8	55%	0.545	17%	0.166	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-80	101.3	-175.4	178.8	64.7	0	0	0	110.5	H523 D524	H523-L527 CarbonylContact C-O 3.51Å; H523-L527 WeakPolarHBondContact CA-O 3.45Å; H523-L527 WeakPolarHBondContact CB-O 3.45Å; D524-L527 PolarHBondContact N-O 3.31Å; D524-L527 WeakPolarHBondContact O-CB 3.47Å; D524-L527 PolarHBondContact O-N 3.02Å
528	V	98.7	Very high	98	Very high	14 Å²	14	36.1 Å²	36.1	9%	0.085	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.4	138.4	171.7	-171.4	0	0	0	0	110.1	H523 P526 C551 R553 D571	H523-V528 HydrophobicContact CB-CG2 4.1Å; P526-V528 PolarHBondContact O-N 2.94Å; V528-C551 HydrophobicContact CB-CB 4.32Å; V528-C551 HydrophobicContact CG1-CB 4.04Å; V528-C551 PolarHBondContact O-SG 3.45Å; V528-R553 HydrophobicContact CG1-CB 4.06Å; V528-R553 HydrophobicContact CG1-CG 3.89Å; V528-R553 HydrophobicContact CG2-CG 4.19Å; V528-D571 WeakPolarHBondContact CG2-O 3.35Å
529	R	98.6	Very high	97.8	Very high	35 Å²	35	38.6 Å²	38.6	13%	0.132	22%	0.219	C	C	.	.			trans	-103.2	146.1	-171.8	-58.6	179.3	-176.7	-71.8	-6.5	111.8	T503 R504 G521 G522 C551 R552	T503-R529 VanDerWaalsContact CB-CZ 3.49Å; T503-R529 PolarHBondContact OG1-NE 3.03Å; R504-R529 PolarHBondContact O-NE 2.89Å; R504-R529 PolarHBondContact O-NH2 3.48Å; G521-R529 WeakPolarHBondContact CA-O 3.25Å; G522-R529 WeakPolarHBondContact O-CB 3.4Å; G522-R529 PolarHBondContact O-N 3.01Å; R529-C551 WeakPolarHBondContact O-CA 3.36Å; R529-R552 PolarHBondContact O-N 3.18Å
530	K	98.6	Very high	97.8	Very high	84 Å²	84	42.3 Å²	42.3	37%	0.365	24%	0.238	S	C	.	.			trans	-104	-14.8	160.4	65.4	-174.8	-177.9	91.2	0	113.5	D547 M548 M550	K530-D547 HydrophobicContact CD-CB 4.38Å; K530-D547 WeakPolarHBondContact CE-OD2 3.32Å; K530-D547 HydrophobicContact CG-CB 4.05Å; K530-D547 IonicContact NZ-OD2 2.67Å; K530-D547 PolarHBondContact NZ-OD2 2.99Å; K530-M548 HydrophobicContact CB-CB 4.33Å; K530-M548 WeakPolarHBondContact O-CB 3.43Å; K530-M548 PolarHBondContact O-N 2.62Å; K530-M550 VanDerWaalsContact CB-O 3.32Å; K530-M550 WeakPolarHBondContact CB-O 3.47Å
531	S	98.8	Very high	97.8	Very high	24 Å²	24	45.7 Å²	45.7	17%	0.168	26%	0.259	C	S	.	.			trans	-64.9	148.9	-179.8	62	0	0	0	0	112.3	R505 G521 D547	R505-S531 PolarHBondContact NH1-O 3.49Å; R505-S531 PolarHBondContact NH2-OG 3.22Å; G521-S531 PolarHBondContact N-O 3.08Å; S531-D547 WeakPolarHBondContact CA-OD1 3.23Å; S531-D547 WeakPolarHBondContact CB-OD1 3.44Å
532	V	98.9	Very high	97.8	Very high	0 Å²	0	47.4 Å²	47.4	0%	0	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.6	136.4	-179.5	-174.3	0	0	0	0	108.4	Y518 A519 A520 V545 M548 W589	Y518-V532 HydrophobicContact CD1-CG1 4.37Å; A519-V532 WeakPolarHBondContact O-CA 3.33Å; A520-V532 HydrophobicContact CB-CG1 4.18Å; A520-V532 HydrophobicContact CB-CG2 4.07Å; V532-V545 HydrophobicContact CB-CG2 3.67Å; V532-V545 HydrophobicContact CG1-CG2 3.62Å; V532-V545 PolarHBondContact O-N 2.96Å; V532-V545 VanDerWaalsContact O-N 3.07Å; V532-M548 HydrophobicContact CG2-CE 4.41Å; V532-M548 HydrophobicContact CG2-CG 3.77Å; V532-M548 HydrophobicContact CG2-SD 4.39Å; V532-W589 HydrophobicContact CB-CZ2 4.43Å; V532-W589 HydrophobicContact CG1-CZ2 4.26Å; V532-W589 HydrophobicContact CG2-CZ2 3.74Å
533	E	98.7	Very high	97.8	Very high	1 Å²	1	53.9 Å²	53.9	1%	0.005	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	149.3	172.5	54.3	-163.8	118.9	0	0	110.3	M501 S502 R505 A519 W542 R543 L544	M501-E533 WeakPolarHBondContact CA-OE2 3.29Å; M501-E533 HydrophobicContact CG-CG 4.4Å; S502-E533 WeakPolarHBondContact CB-OE2 3.16Å; S502-E533 PolarHBondContact N-OE2 3.2Å; S502-E533 PolarHBondContact OG-OE1 3.4Å; S502-E533 PolarHBondContact OG-OE2 3.01Å; R505-E533 IonicContact CZ-OE1 3.23Å; R505-E533 IonicContact NE-OE1 2.74Å; R505-E533 PolarHBondContact NE-OE1 3.03Å; R505-E533 IonicContact NH2-OE1 3.87Å; R505-E533 PolarHBondContact NH2-OE1 3.43Å; A519-E533 HydrophobicContact CB-CG 4.15Å; A519-E533 PolarHBondContact N-O 2.93Å; A519-E533 PolarHBondContact O-N 3.18Å; E533-W542 HydrophobicContact CB-CE3 3.86Å; E533-W542 HydrophobicContact CB-CZ3 4.42Å; E533-W542 HydrophobicContact CG-CD2 4.43Å; E533-W542 HydrophobicContact CG-CE3 3.58Å; E533-W542 HydrophobicContact CG-CZ3 3.89Å; E533-R543 CarbonylContact C-O 3.06Å; E533-R543 VanDerWaalsContact CA-O 3.3Å; E533-R543 WeakPolarHBondContact CA-O 3.38Å; E533-L544 HydrophobicContact CB-CD2 4.25Å
534	V	98.8	Very high	97.8	Very high	1 Å²	1	57.9 Å²	57.9	1%	0.006	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	134.4	-179.3	64.6	0	0	0	0	109.6	L516 L517 Y518 W542 R543 V545	L516-V534 HydrophobicContact CB-CG2 3.55Å; L516-V534 HydrophobicContact CD1-CG2 4.01Å; L516-V534 HydrophobicContact CG-CG2 4.34Å; L517-V534 CarbonylContact O-C 3.49Å; L517-V534 WeakPolarHBondContact O-CA 3.43Å; Y518-V534 HydrophobicContact CD1-CB 3.8Å; Y518-V534 HydrophobicContact CD1-CG2 3.87Å; Y518-V534 HydrophobicContact CD2-CG2 3.89Å; Y518-V534 HydrophobicContact CE1-CB 3.74Å; Y518-V534 HydrophobicContact CE1-CG1 4.49Å; Y518-V534 HydrophobicContact CE1-CG2 3.63Å; Y518-V534 HydrophobicContact CE2-CG2 3.64Å; Y518-V534 HydrophobicContact CG-CB 4.27Å; Y518-V534 HydrophobicContact CG-CG2 3.99Å; V534-W542 WeakPolarHBondContact O-CA 3.47Å; V534-R543 HydrophobicContact CG1-CG 3.52Å; V534-R543 PolarHBondContact N-O 3.23Å; V534-R543 PolarHBondContact O-N 2.75Å; V534-V545 HydrophobicContact CB-CG1 4.36Å; V534-V545 HydrophobicContact CG1-CG1 3.65Å
535	F	98.8	Very high	97.8	Very high	2 Å²	2	55.7 Å²	55.7	1%	0.009	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	134.1	177.5	179.8	-110.1	0	0	0	110.5	Y469 V498 A499 L517 P537 N540 T541 W542	Y469-F535 HydrophobicContact CD1-CE1 4.36Å; Y469-F535 AromaticContact CE1-CE1 3.79Å; Y469-F535 HydrophobicContact CE1-CE1 3.79Å; V498-F535 HydrophobicContact CB-CE2 4.49Å; V498-F535 HydrophobicContact CB-CZ 4.02Å; V498-F535 HydrophobicContact CG2-CE2 4.42Å; V498-F535 HydrophobicContact CG2-CZ 4.03Å; A499-F535 HydrophobicContact CB-CE2 4.25Å; L517-F535 HydrophobicContact CB-CB 4.22Å; L517-F535 HydrophobicContact CB-CD1 4.39Å; L517-F535 HydrophobicContact CD2-CD1 4.3Å; L517-F535 PolarHBondContact N-O 2.59Å; L517-F535 VanDerWaalsContact N-O 3.09Å; L517-F535 PolarHBondContact O-N 3.22Å; F535-P537 HydrophobicContact CD1-CG 3.99Å; F535-P537 HydrophobicContact CE1-CB 4.06Å; F535-P537 HydrophobicContact CE1-CG 3.89Å; F535-N540 WeakPolarHBondContact CE2-OD1 3.44Å; F535-N540 WeakPolarHBondContact CZ-OD1 3.35Å; F535-T541 WeakPolarHBondContact CA-O 3.3Å; F535-T541 WeakPolarHBondContact CD2-O 3.48Å; F535-W542 HydrophobicContact CB-CD2 3.7Å; F535-W542 HydrophobicContact CB-CE3 3.69Å; F535-W542 HydrophobicContact CB-CG 4.46Å; F535-W542 HydrophobicContact CB-CH2 3.58Å; F535-W542 HydrophobicContact CB-CZ2 3.55Å; F535-W542 HydrophobicContact CB-CZ3 3.65Å; F535-W542 AromaticContact CD2-CD1 3.8Å; F535-W542 HydrophobicContact CD2-CD2 4.07Å; F535-W542 AromaticContact CD2-CE2 3.67Å; F535-W542 HydrophobicContact CD2-CG 4.13Å; F535-W542 HydrophobicContact CD2-CZ2 4.15Å; F535-W542 AromaticContact CD2-NE1 3.5Å; F535-W542 HydrophobicContact CG-CD2 4.33Å; F535-W542 AromaticContact CG-CE2 3.92Å; F535-W542 HydrophobicContact CG-CH2 4.45Å; F535-W542 AromaticContact CG-CZ2 3.97Å; F535-W542 HydrophobicContact CG-CZ2 3.97Å
536	D	97.9	Very high	97.9	Very high	55 Å²	55	56 Å²	56	29%	0.294	30%	0.296	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	111.1	168.3	174.9	3.6	0	0	0	108.7	L516 Q538 S539 N540 T541	L516-D536 HydrophobicContact CD2-CB 3.76Å; D536-Q538 PolarHBondContact O-N 3.38Å; D536-Q538 WeakPolarHBondContact OD1-CB 3.47Å; D536-Q538 PolarHBondContact OD1-N 2.85Å; D536-S539 WeakPolarHBondContact CB-OG 3.19Å; D536-S539 VanDerWaalsContact CG-OG 3.3Å; D536-S539 PolarHBondContact O-N 2.99Å; D536-S539 PolarHBondContact O-OG 3.07Å; D536-S539 PolarHBondContact OD2-OG 2.75Å; D536-N540 WeakPolarHBondContact O-CA 3.33Å; D536-N540 PolarHBondContact O-N 2.68Å; D536-T541 PolarHBondContact N-O 3.22Å; D536-T541 PolarHBondContact O-N 2.78Å
537	P	94.6	Very high	98.1	Very high	26 Å²	26	53.2 Å²	53.2	17%	0.169	27%	0.274	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60.8	-29.5	176.6	-24.8	35.1	0	0	0	114.2	V464 F535 N540	V464-P537 HydrophobicContact CB-CG 4.22Å; V464-P537 HydrophobicContact CG1-CG 3.93Å; F535-P537 HydrophobicContact CD1-CG 3.99Å; F535-P537 HydrophobicContact CE1-CB 4.06Å; F535-P537 HydrophobicContact CE1-CG 3.89Å; P537-N540 PolarHBondContact O-N 2.9Å
538	Q	94.3	Very high	98.1	Very high	153 Å²	153	48.4 Å²	48.4	72%	0.715	25%	0.249	S	C	*	.	T	Hydrogen-bonded Turn	trans	-73.2	-36.4	-175.5	-60.5	-68.1	-28.8	0	0	111.4	D465 D536	D465-Q538 PolarHBondContact OD2-NE2 3.36Å; D465-Q538 VanDerWaalsContact OD2-NE2 3.08Å; D536-Q538 PolarHBondContact O-N 3.38Å; D536-Q538 WeakPolarHBondContact OD1-CB 3.47Å; D536-Q538 PolarHBondContact OD1-N 2.85Å
539	S	96.3	Very high	98.1	Very high	58 Å²	58	52 Å²	52	41%	0.406	27%	0.268	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.5	-15.2	173.3	62	0	0	0	0	113.8	D536 T541	D536-S539 WeakPolarHBondContact CB-OG 3.19Å; D536-S539 VanDerWaalsContact CG-OG 3.3Å; D536-S539 PolarHBondContact O-N 2.99Å; D536-S539 PolarHBondContact O-OG 3.07Å; D536-S539 PolarHBondContact OD2-OG 2.75Å; S539-T541 VanDerWaalsContact C-N 3.33Å; S539-T541 PolarHBondContact OG-N 2.68Å; S539-T541 PolarHBondContact OG-OG1 3.08Å
540	N	97.9	Very high	97.9	Very high	77 Å²	77	53.5 Å²	53.5	41%	0.412	28%	0.277	S	S	.	.	T	Hydrogen-bonded Turn	trans	51.5	49.5	-167.7	-174.2	23.7	0	0	0	111.6	A499 F535 D536 P537	A499-N540 VanDerWaalsContact CB-O 3.29Å; A499-N540 WeakPolarHBondContact CB-O 3.47Å; A499-N540 WeakPolarHBondContact CB-OD1 3.26Å; A499-N540 PolarHBondContact N-OD1 3.46Å; F535-N540 WeakPolarHBondContact CE2-OD1 3.44Å; F535-N540 WeakPolarHBondContact CZ-OD1 3.35Å; D536-N540 WeakPolarHBondContact O-CA 3.33Å; D536-N540 PolarHBondContact O-N 2.68Å; P537-N540 PolarHBondContact O-N 2.9Å
541	T	98.5	Very high	97.9	Very high	75 Å²	75	51.7 Å²	51.7	46%	0.46	27%	0.274	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133	146.7	179.1	59.5	0	0	0	0	113.1	F535 D536 S539	F535-T541 WeakPolarHBondContact CA-O 3.3Å; F535-T541 WeakPolarHBondContact CD2-O 3.48Å; D536-T541 PolarHBondContact N-O 3.22Å; D536-T541 PolarHBondContact O-N 2.78Å; S539-T541 VanDerWaalsContact C-N 3.33Å; S539-T541 PolarHBondContact OG-N 2.68Å; S539-T541 PolarHBondContact OG-OG1 3.08Å
542	W	98.8	Very high	97.9	Very high	36 Å²	36	50.6 Å²	50.6	14%	0.136	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.8	143.3	167.7	-70	92	0	0	0	110.8	V471 V485 A499 M501 L517 A519 E533 V534 F535	V471-W542 HydrophobicContact CG1-CH2 4.24Å; V485-W542 HydrophobicContact CG1-CZ2 4.47Å; V485-W542 HydrophobicContact CG2-CZ2 3.84Å; A499-W542 PolarHBondContact O-NE1 2.83Å; M501-W542 HydrophobicContact CG-CD2 3.92Å; M501-W542 HydrophobicContact CG-CE3 4.21Å; M501-W542 HydrophobicContact CG-CH2 3.96Å; M501-W542 HydrophobicContact CG-CZ2 3.67Å; M501-W542 HydrophobicContact CG-CZ3 4.22Å; M501-W542 HydrophobicContact SD-CH2 4.28Å; M501-W542 HydrophobicContact SD-CZ2 4.44Å; L517-W542 HydrophobicContact CD2-CH2 4.49Å; A519-W542 HydrophobicContact CB-CH2 3.98Å; A519-W542 HydrophobicContact CB-CZ3 3.79Å; E533-W542 HydrophobicContact CB-CE3 3.86Å; E533-W542 HydrophobicContact CB-CZ3 4.42Å; E533-W542 HydrophobicContact CG-CD2 4.43Å; E533-W542 HydrophobicContact CG-CE3 3.58Å; E533-W542 HydrophobicContact CG-CZ3 3.89Å; V534-W542 WeakPolarHBondContact O-CA 3.47Å; F535-W542 HydrophobicContact CB-CD2 3.7Å; F535-W542 HydrophobicContact CB-CE3 3.69Å; F535-W542 HydrophobicContact CB-CG 4.46Å; F535-W542 HydrophobicContact CB-CH2 3.58Å; F535-W542 HydrophobicContact CB-CZ2 3.55Å; F535-W542 HydrophobicContact CB-CZ3 3.65Å; F535-W542 AromaticContact CD2-CD1 3.8Å; F535-W542 HydrophobicContact CD2-CD2 4.07Å; F535-W542 AromaticContact CD2-CE2 3.67Å; F535-W542 HydrophobicContact CD2-CG 4.13Å; F535-W542 HydrophobicContact CD2-CZ2 4.15Å; F535-W542 AromaticContact CD2-NE1 3.5Å; F535-W542 HydrophobicContact CG-CD2 4.33Å; F535-W542 AromaticContact CG-CE2 3.92Å; F535-W542 HydrophobicContact CG-CH2 4.45Å; F535-W542 AromaticContact CG-CZ2 3.97Å; F535-W542 HydrophobicContact CG-CZ2 3.97Å
543	R	98.6	Very high	97.9	Very high	136 Å²	136	52.9 Å²	52.9	51%	0.513	28%	0.275	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.7	149.7	166.5	64.7	-177.4	-179.5	82.2	-1.2	110.7	E533 V534	E533-R543 CarbonylContact C-O 3.06Å; E533-R543 VanDerWaalsContact CA-O 3.3Å; E533-R543 WeakPolarHBondContact CA-O 3.38Å; V534-R543 HydrophobicContact CG1-CG 3.52Å; V534-R543 PolarHBondContact N-O 3.23Å; V534-R543 PolarHBondContact O-N 2.75Å
544	L	98.6	Very high	97.9	Very high	109 Å²	109	53.4 Å²	53.4	57%	0.571	28%	0.278	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-70.3	149.4	170.8	-68.9	167.2	0	0	0	110.4	E533	E533-L544 HydrophobicContact CB-CD2 4.25Å
545	V	98.6	Very high	97.9	Very high	11 Å²	11	54 Å²	54	7%	0.067	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	175.6	163.2	-63.7	0	0	0	0	107.9	V532 V534 Y582 D587	V532-V545 HydrophobicContact CB-CG2 3.67Å; V532-V545 HydrophobicContact CG1-CG2 3.62Å; V532-V545 PolarHBondContact O-N 2.96Å; V532-V545 VanDerWaalsContact O-N 3.07Å; V534-V545 HydrophobicContact CB-CG1 4.36Å; V534-V545 HydrophobicContact CG1-CG1 3.65Å; V545-Y582 HydrophobicContact CB-CE2 4.21Å; V545-Y582 HydrophobicContact CG2-CE2 4.29Å; V545-D587 WeakPolarHBondContact CB-OD1 3.49Å
546	S	98.4	Very high	97.9	Very high	45 Å²	45	54.3 Å²	54.3	32%	0.315	29%	0.287	S	S	.	.	P	Polyproline II helix	trans	-55.1	141.4	179.2	-82.3	0	0	0	0	112.8	D587 W589	S546-D587 VanDerWaalsContact CB-O 3.25Å; S546-D587 WeakPolarHBondContact CB-O 3.21Å; S546-D587 WeakPolarHBondContact CB-OD1 3.36Å; S546-D587 WeakPolarHBondContact CB-OD2 3.29Å; S546-D587 PolarHBondContact N-OD1 3.28Å; S546-D587 PolarHBondContact N-OD2 2.85Å; S546-D587 VanDerWaalsContact OG-CG 3.28Å; S546-D587 PolarHBondContact OG-O 2.73Å; S546-D587 PolarHBondContact OG-OD2 2.98Å; S546-W589 VanDerWaalsContact O-CD1 3.27Å; S546-W589 PolarHBondContact O-NE1 3.05Å
547	D	98.8	Very high	97.9	Very high	71 Å²	71	52.8 Å²	52.8	38%	0.38	28%	0.279	S	S	.	.	P	Polyproline II helix	trans	-61.6	145.3	177.2	-79.6	-5.6	0	0	0	111.6	K530 S531 W589	K530-D547 HydrophobicContact CD-CB 4.38Å; K530-D547 WeakPolarHBondContact CE-OD2 3.32Å; K530-D547 HydrophobicContact CG-CB 4.05Å; K530-D547 IonicContact NZ-OD2 2.67Å; K530-D547 PolarHBondContact NZ-OD2 2.99Å; S531-D547 WeakPolarHBondContact CA-OD1 3.23Å; S531-D547 WeakPolarHBondContact CB-OD1 3.44Å; D547-W589 VanDerWaalsContact C-CD1 3.44Å
548	M	98.8	Very high	98	Very high	4 Å²	4	52.2 Å²	52.2	2%	0.02	28%	0.276	C	S	.	.	P	Polyproline II helix	trans	-58.6	156.3	163.3	-69.2	-178.9	-60.5	0	0	111.3	A520 K530 V532 M550 R552 V566 W589	A520-M548 HydrophobicContact CB-CE 4.38Å; A520-M548 HydrophobicContact CB-SD 4.11Å; K530-M548 HydrophobicContact CB-CB 4.33Å; K530-M548 WeakPolarHBondContact O-CB 3.43Å; K530-M548 PolarHBondContact O-N 2.62Å; V532-M548 HydrophobicContact CG2-CE 4.41Å; V532-M548 HydrophobicContact CG2-CG 3.77Å; V532-M548 HydrophobicContact CG2-SD 4.39Å; M548-M550 WeakPolarHBondContact CB-O 3.32Å; M548-M550 PolarHBondContact O-N 2.73Å; M548-R552 HydrophobicContact CE-CB 3.98Å; M548-R552 HydrophobicContact CE-CG 4.22Å; M548-R552 HydrophobicContact SD-CG 4.41Å; M548-V566 HydrophobicContact SD-CB 4.21Å; M548-V566 HydrophobicContact SD-CG1 3.93Å; M548-V566 HydrophobicContact SD-CG2 4.03Å; M548-W589 HydrophobicContact CB-CD2 4.47Å; M548-W589 HydrophobicContact CG-CD2 3.82Å; M548-W589 HydrophobicContact CG-CE3 4.06Å; M548-W589 HydrophobicContact CG-CG 4.46Å; M548-W589 HydrophobicContact CG-CH2 4.03Å; M548-W589 HydrophobicContact CG-CZ2 3.76Å; M548-W589 HydrophobicContact CG-CZ3 4.16Å; M548-W589 HydrophobicContact SD-CH2 4.39Å
549	N	97.9	Very high	98	Very high	90 Å²	90	46.7 Å²	46.7	48%	0.481	26%	0.256	S	S	.	.	S	Bend	trans	-62.6	-33.4	173.7	-65.9	-84.9	0	0	0	111.7	E580 W589	N549-E580 WeakPolarHBondContact CB-OE2 3.32Å; N549-E580 PolarHBondContact N-OE2 3.03Å; N549-E580 PolarHBondContact ND2-OE2 2.78Å; N549-W589 VanDerWaalsContact ND2-CB 3.33Å; N549-W589 WeakPolarHBondContact ND2-CB 3.41Å; N549-W589 PolarHBondContact ND2-O 2.81Å
550	M	95.8	Very high	97.8	Very high	66 Å²	66	44.3 Å²	44.3	33%	0.325	24%	0.239	S	C	.	.	S	Bend	trans	-124.1	150.5	-176.8	-53.8	-170	76.2	0	0	111.8	K530 M548 R552 L576 S578 E580	K530-M550 VanDerWaalsContact CB-O 3.32Å; K530-M550 WeakPolarHBondContact CB-O 3.47Å; M548-M550 WeakPolarHBondContact CB-O 3.32Å; M548-M550 PolarHBondContact O-N 2.73Å; M550-R552 HydrophobicContact CB-CG 4.35Å; M550-R552 PolarHBondContact O-N 2.94Å; M550-L576 HydrophobicContact CB-CD1 4.37Å; M550-L576 HydrophobicContact CE-CD1 4.33Å; M550-L576 HydrophobicContact CE-CD2 3.74Å; M550-L576 HydrophobicContact SD-CD1 4.37Å; M550-S578 PolarHBondContact SD-OG 2.95Å; M550-E580 PolarHBondContact N-OE1 2.92Å
551	C	98.4	Very high	97.2	Very high	45 Å²	45	46.4 Å²	46.4	30%	0.304	25%	0.25	S	S	.	.			trans	-69.8	128.9	165.2	-72.1	0	0	0	0	109.1	V528 R529 D571	V528-C551 HydrophobicContact CB-CB 4.32Å; V528-C551 HydrophobicContact CG1-CB 4.04Å; V528-C551 PolarHBondContact O-SG 3.45Å; R529-C551 WeakPolarHBondContact O-CA 3.36Å; C551-D571 WeakPolarHBondContact O-CB 3.4Å
552	R	98.8	Very high	96.6	Very high	2 Å²	2	45 Å²	45	1%	0.008	25%	0.25	C	S	.	.			trans	-139.3	131.2	-178.1	-55.5	-174.4	-177.9	-103.4	1.1	110.7	G521 G522 R529 M548 M550 A555 G568 L576 S578 E580	G521-R552 CarbonylContact C-O 3.58Å; G521-R552 WeakPolarHBondContact CA-O 3.19Å; G522-R552 PolarHBondContact N-O 2.98Å; R529-R552 PolarHBondContact O-N 3.18Å; M548-R552 HydrophobicContact CE-CB 3.98Å; M548-R552 HydrophobicContact CE-CG 4.22Å; M548-R552 HydrophobicContact SD-CG 4.41Å; M550-R552 HydrophobicContact CB-CG 4.35Å; M550-R552 PolarHBondContact O-N 2.94Å; R552-A555 HydrophobicContact CB-CB 4.33Å; R552-G568 PolarHBondContact NH1-O 3.18Å; R552-L576 HydrophobicContact CG-CD1 3.86Å; R552-S578 PolarHBondContact NH1-O 2.9Å; R552-S578 PolarHBondContact NH1-OG 2.92Å; R552-S578 PolarHBondContact NH2-OG 2.89Å; R552-E580 IonicContact CZ-OE1 3.73Å; R552-E580 IonicContact NE-OE1 3.12Å; R552-E580 PolarHBondContact NE-OE1 2.91Å; R552-E580 IonicContact NH2-OE1 2.71Å; R552-E580 PolarHBondContact NH2-OE1 3.21Å
553	R	98.5	Very high	96.4	Very high	48 Å²	48	44.7 Å²	44.7	18%	0.181	25%	0.251	C	S	.	.	B	Isolated β-bridge	trans	-123.3	162.8	156.7	57.8	166.8	-171.7	-149.2	-7.3	109.2	G507 H523 V528 A555 G569 D570	G507-R553 WeakPolarHBondContact O-CA 3.49Å; H523-R553 HydrophobicContact CB-CB 4.44Å; H523-R553 WeakPolarHBondContact CD2-CD 3.4Å; V528-R553 HydrophobicContact CG1-CB 4.06Å; V528-R553 HydrophobicContact CG1-CG 3.89Å; V528-R553 HydrophobicContact CG2-CG 4.19Å; R553-A555 PolarHBondContact O-N 2.95Å; R553-A555 VanDerWaalsContact O-N 3.09Å; R553-G569 CarbonylContact O-C 3.42Å; R553-G569 VanDerWaalsContact O-CA 3.22Å; R553-G569 WeakPolarHBondContact O-CA 3.49Å; R553-D570 VanDerWaalsContact CG-O 3.3Å; R553-D570 WeakPolarHBondContact CG-O 3.4Å; R553-D570 IonicContact CZ-OD1 2.7Å; R553-D570 PolarHBondContact N-O 3.43Å; R553-D570 IonicContact NE-OD1 3.58Å; R553-D570 PolarHBondContact NE-OD1 2.74Å; R553-D570 IonicContact NE-OD2 3.55Å; R553-D570 PolarHBondContact NE-OD2 3.42Å; R553-D570 IonicContact NH2-OD1 3.13Å; R553-D570 PolarHBondContact NH2-OD1 2.84Å; R553-D570 PolarHBondContact O-N 3.16Å
554	N	98.6	Very high	96.4	Very high	11 Å²	11	38.2 Å²	38.2	6%	0.059	23%	0.227	C	C	.	.	S	Bend	trans	57.3	26.8	175.7	-45.7	-51.8	0	0	0	113.4	G507 D570 Y602	G507-N554 PolarHBondContact O-N 3.25Å; N554-D570 PolarHBondContact ND2-OD2 3.28Å; N554-Y602 HydrophobicContact CB-CD1 3.65Å; N554-Y602 HydrophobicContact CB-CD2 3.95Å; N554-Y602 HydrophobicContact CB-CE1 3.69Å; N554-Y602 HydrophobicContact CB-CE2 3.98Å; N554-Y602 HydrophobicContact CB-CG 3.8Å; N554-Y602 WeakPolarHBondContact ND2-CE2 3.19Å; N554-Y602 PolarHBondContact ND2-OH 3.42Å; N554-Y602 PolarHBondContact O-N 3Å; N554-Y602 WeakPolarHBondContact OD1-CE1 3.43Å; N554-Y602 PolarHBondContact OD1-OH 2.85Å
555	A	98.6	Very high	96.4	Very high	14 Å²	14	34.1 Å²	34.1	12%	0.116	20%	0.204	C	C	.	.			trans	-83.2	148.9	175.6	0	0	0	0	0	110.3	R552 R553 V566 I567	R552-A555 HydrophobicContact CB-CB 4.33Å; R553-A555 PolarHBondContact O-N 2.95Å; R553-A555 VanDerWaalsContact O-N 3.09Å; A555-V566 HydrophobicContact CB-CG1 3.61Å; A555-I567 WeakPolarHBondContact CA-O 3.46Å; A555-I567 WeakPolarHBondContact CB-O 3.38Å
556	G	98.4	Very high	96.4	Very high	9 Å²	9	33.7 Å²	33.7	9%	0.093	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.5	150.4	167.5	0	0	0	0	0	110.5	V566 I567	G556-V566 WeakPolarHBondContact O-CA 3.46Å; G556-I567 PolarHBondContact N-O 2.59Å; G556-I567 WeakPolarHBondContact O-CD1 3.39Å; G556-I567 PolarHBondContact O-N 3.16Å
557	V	98.6	Very high	96.4	Very high	22 Å²	22	31.7 Å²	31.7	13%	0.133	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.2	138	178	178.2	0	0	0	0	110.1	L564 Y565 V566	V557-L564 HydrophobicContact CG1-CD1 3.61Å; V557-L564 HydrophobicContact CG1-CD2 4.44Å; V557-L564 HydrophobicContact CG1-CG 4.01Å; V557-Y565 VanDerWaalsContact CA-O 3.29Å; V557-Y565 WeakPolarHBondContact CA-O 3.42Å; V557-V566 HydrophobicContact CG2-CB 4.48Å; V557-V566 HydrophobicContact CG2-CG1 4.28Å; V557-V566 HydrophobicContact CG2-CG2 4.03Å
558	C	97.5	Very high	96.4	Very high	14 Å²	14	28.3 Å²	28.3	10%	0.095	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.9	155	172.2	61	0	0	0	0	111.3	Y565 V605 V607	C558-Y565 PolarHBondContact N-O 2.78Å; C558-Y565 VanDerWaalsContact N-O 3.16Å; C558-Y565 PolarHBondContact O-N 3.18Å; C558-V605 HydrophobicContact CB-CG1 4.14Å; C558-V607 HydrophobicContact CB-CG2 3.73Å
559	A	94.6	Very high	96.4	Very high	37 Å²	37	28.2 Å²	28.2	31%	0.306	17%	0.169	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	137.6	173.1	0	0	0	0	0	111	V512 L513 L563 L564	V512-A559 WeakPolarHBondContact O-CB 3.44Å; L513-A559 HydrophobicContact CB-CB 4.24Å; L513-A559 HydrophobicContact CD1-CB 4.35Å; A559-L563 VanDerWaalsContact CA-O 3.3Å; A559-L563 WeakPolarHBondContact CA-O 3.44Å; A559-L564 HydrophobicContact CB-CD1 4.24Å
560	I	90.6	Very high	96.4	Very high	9 Å²	9	24.5 Å²	24.5	5%	0.046	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-154.2	138.4	-179.9	178	177.1	0	0	0	108.9	K326 F347 G562 L563 Y565 V607	K326-I560 HydrophobicContact CB-CD1 3.55Å; K326-I560 HydrophobicContact CB-CG1 4.4Å; K326-I560 HydrophobicContact CD-CD1 4.28Å; K326-I560 HydrophobicContact CD-CG1 4.25Å; F347-I560 HydrophobicContact CD1-CD1 4.27Å; F347-I560 HydrophobicContact CD2-CD1 3.71Å; F347-I560 HydrophobicContact CE1-CD1 4.14Å; F347-I560 HydrophobicContact CE1-CG2 3.89Å; F347-I560 HydrophobicContact CE2-CD1 3.51Å; F347-I560 HydrophobicContact CG-CD1 4.08Å; F347-I560 HydrophobicContact CZ-CD1 3.76Å; F347-I560 HydrophobicContact CZ-CG2 3.83Å; I560-G562 PolarHBondContact O-N 3.13Å; I560-G562 VanDerWaalsContact O-N 3.08Å; I560-L563 PolarHBondContact N-O 2.8Å; I560-L563 PolarHBondContact O-N 3.48Å; I560-Y565 HydrophobicContact CG2-CD2 3.45Å; I560-Y565 VanDerWaalsContact CG2-CD2 3.45Å; I560-Y565 HydrophobicContact CG2-CE2 3.28Å; I560-Y565 HydrophobicContact CG2-CG 4.46Å; I560-V607 HydrophobicContact CD1-CG1 4.26Å
561	N	85.1	Confident	96.5	Very high	121 Å²	121	24 Å²	24	65%	0.647	15%	0.148	S	C	*	.	T	Hydrogen-bonded Turn	trans	50	37.1	174.4	-59.3	-7.9	0	0	0	114.9	L563	N561-L563 VanDerWaalsContact C-N 3.34Å
562	G	86.9	Confident	96.2	Very high	45 Å²	45	23.7 Å²	23.7	46%	0.464	15%	0.152	S	C	.	.	T	Hydrogen-bonded Turn	trans	81.2	7.6	179.5	0	0	0	0	0	115.3	I560 P584	I560-G562 PolarHBondContact O-N 3.13Å; I560-G562 VanDerWaalsContact O-N 3.08Å; G562-P584 WeakPolarHBondContact O-CD 3.42Å
563	L	95	Very high	95.9	Very high	30 Å²	30	29 Å²	29	16%	0.157	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	151.4	-178.3	-57.3	173.6	0	0	0	110.8	A559 I560 N561 Y565 F581 Y582 N583	A559-L563 VanDerWaalsContact CA-O 3.3Å; A559-L563 WeakPolarHBondContact CA-O 3.44Å; I560-L563 PolarHBondContact N-O 2.8Å; I560-L563 PolarHBondContact O-N 3.48Å; N561-L563 VanDerWaalsContact C-N 3.34Å; L563-Y565 HydrophobicContact CB-CD2 4.32Å; L563-Y565 HydrophobicContact CB-CE2 3.69Å; L563-Y565 HydrophobicContact CD1-CE2 4.33Å; L563-F581 HydrophobicContact CB-CD2 4.44Å; L563-F581 HydrophobicContact CD1-CD2 3.77Å; L563-F581 HydrophobicContact CD1-CE2 3.97Å; L563-F581 HydrophobicContact CD2-CD2 4.21Å; L563-F581 HydrophobicContact CG-CD2 4.37Å; L563-Y582 WeakPolarHBondContact CA-O 3.05Å; L563-N583 HydrophobicContact CD2-CB 3.62Å
564	L	98.4	Very high	95.8	Very high	0 Å²	0	30.4 Å²	30.4	0%	0	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	116.6	176.8	-176.3	78.4	0	0	0	109.5	L513 Y518 V557 A559 F581 Y582 W589	L513-L564 HydrophobicContact CD2-CB 3.88Å; Y518-L564 HydrophobicContact CD1-CD2 3.95Å; Y518-L564 HydrophobicContact CD2-CD2 4.26Å; Y518-L564 HydrophobicContact CG-CD2 3.67Å; V557-L564 HydrophobicContact CG1-CD1 3.61Å; V557-L564 HydrophobicContact CG1-CD2 4.44Å; V557-L564 HydrophobicContact CG1-CG 4.01Å; A559-L564 HydrophobicContact CB-CD1 4.24Å; L564-F581 CarbonylContact O-C 3.56Å; L564-F581 VanDerWaalsContact O-CA 3.24Å; L564-F581 WeakPolarHBondContact O-CA 3.31Å; L564-Y582 PolarHBondContact N-O 2.79Å; L564-Y582 VanDerWaalsContact N-O 3.12Å; L564-Y582 PolarHBondContact O-N 3.02Å; L564-W589 HydrophobicContact CD2-CH2 4.39Å
565	Y	98.6	Very high	95.7	Very high	22 Å²	22	32.3 Å²	32.3	9%	0.086	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.2	140.2	-179	-70.3	-107.8	0	0	0	110.8	F347 V557 C558 I560 L563 V579 E580 F581 I592	F347-Y565 HydrophobicContact CD1-CE1 4.48Å; F347-Y565 HydrophobicContact CE1-CD1 4.25Å; F347-Y565 AromaticContact CE1-CE1 3.71Å; F347-Y565 HydrophobicContact CE1-CE1 3.71Å; F347-Y565 HydrophobicContact CE1-CE2 4.08Å; F347-Y565 AromaticContact CE1-CZ 3.63Å; V557-Y565 VanDerWaalsContact CA-O 3.29Å; V557-Y565 WeakPolarHBondContact CA-O 3.42Å; C558-Y565 PolarHBondContact N-O 2.78Å; C558-Y565 VanDerWaalsContact N-O 3.16Å; C558-Y565 PolarHBondContact O-N 3.18Å; I560-Y565 HydrophobicContact CG2-CD2 3.45Å; I560-Y565 VanDerWaalsContact CG2-CD2 3.45Å; I560-Y565 HydrophobicContact CG2-CE2 3.28Å; I560-Y565 HydrophobicContact CG2-CG 4.46Å; L563-Y565 HydrophobicContact CB-CD2 4.32Å; L563-Y565 HydrophobicContact CB-CE2 3.69Å; L563-Y565 HydrophobicContact CD1-CE2 4.33Å; Y565-V579 HydrophobicContact CD1-CG1 4.08Å; Y565-E580 CarbonylContact C-O 3.56Å; Y565-E580 WeakPolarHBondContact CA-O 3.39Å; Y565-F581 HydrophobicContact CD1-CB 3.64Å; Y565-F581 HydrophobicContact CD1-CG 4.49Å; Y565-F581 HydrophobicContact CD2-CB 4.05Å; Y565-F581 HydrophobicContact CE1-CB 3.61Å; Y565-F581 HydrophobicContact CE1-CD1 4Å; Y565-F581 HydrophobicContact CE1-CG 4.01Å; Y565-F581 HydrophobicContact CE2-CB 4.02Å; Y565-F581 HydrophobicContact CG-CB 3.85Å; Y565-I592 HydrophobicContact CD1-CG2 4.37Å; Y565-I592 HydrophobicContact CE1-CG2 3.93Å
566	V	98.8	Very high	95.7	Very high	2 Å²	2	32.2 Å²	32.2	1%	0.012	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	116.3	174.1	-176.6	0	0	0	0	109	A520 M548 A555 G556 V557 V579 E580 W589	A520-V566 HydrophobicContact CB-CG2 4.08Å; M548-V566 HydrophobicContact SD-CB 4.21Å; M548-V566 HydrophobicContact SD-CG1 3.93Å; M548-V566 HydrophobicContact SD-CG2 4.03Å; A555-V566 HydrophobicContact CB-CG1 3.61Å; G556-V566 WeakPolarHBondContact O-CA 3.46Å; V557-V566 HydrophobicContact CG2-CB 4.48Å; V557-V566 HydrophobicContact CG2-CG1 4.28Å; V557-V566 HydrophobicContact CG2-CG2 4.03Å; V566-V579 WeakPolarHBondContact O-CA 3.32Å; V566-V579 WeakPolarHBondContact O-CG1 3.36Å; V566-E580 HydrophobicContact CB-CG 4.49Å; V566-E580 PolarHBondContact N-O 3.31Å; V566-E580 PolarHBondContact O-N 2.67Å; V566-E580 VanDerWaalsContact O-N 3.11Å; V566-W589 HydrophobicContact CB-CH2 4.49Å; V566-W589 HydrophobicContact CB-CZ3 4.17Å; V566-W589 HydrophobicContact CG2-CH2 3.41Å; V566-W589 VanDerWaalsContact CG2-CH2 3.41Å; V566-W589 HydrophobicContact CG2-CZ3 3.52Å
567	I	98.6	Very high	95.7	Very high	4 Å²	4	33.7 Å²	33.7	2%	0.021	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	117.5	-165.3	-58.8	75.5	0	0	0	109.8	M328 V330 A555 G556 G569 V579 M596 V605	M328-I567 HydrophobicContact CE-CG1 4.12Å; M328-I567 HydrophobicContact SD-CD1 3.66Å; M328-I567 HydrophobicContact SD-CG1 3.47Å; M328-I567 WeakPolarHBondContact SD-CG1 3.36Å; V330-I567 HydrophobicContact CG1-CG2 4.19Å; V330-I567 HydrophobicContact CG2-CG2 3.9Å; A555-I567 WeakPolarHBondContact CA-O 3.46Å; A555-I567 WeakPolarHBondContact CB-O 3.38Å; G556-I567 PolarHBondContact N-O 2.59Å; G556-I567 WeakPolarHBondContact O-CD1 3.39Å; G556-I567 PolarHBondContact O-N 3.16Å; I567-G569 PolarHBondContact O-N 2.83Å; I567-V579 HydrophobicContact CB-CG2 4.25Å; I567-V579 HydrophobicContact CG1-CG1 3.93Å; I567-V579 HydrophobicContact CG1-CG2 4.25Å; I567-V579 HydrophobicContact CG2-CG2 3.9Å; I567-M596 HydrophobicContact CG2-CE 3.84Å; I567-M596 HydrophobicContact CG2-SD 3.69Å; I567-V605 HydrophobicContact CB-CG2 3.99Å; I567-V605 HydrophobicContact CD1-CG1 4Å; I567-V605 HydrophobicContact CD1-CG2 4.22Å; I567-V605 HydrophobicContact CG1-CG1 4.33Å; I567-V605 HydrophobicContact CG1-CG2 4.07Å; I567-V605 HydrophobicContact CG2-CG2 4.18Å
568	G	98.4	Very high	95.7	Very high	0 Å²	0	33.2 Å²	33.2	0%	0	22%	0.22	C	C	.	.			trans	58.6	-127.4	172.7	0	0	0	0	0	113.2	R552 L576 S578	R552-G568 PolarHBondContact NH1-O 3.18Å; G568-L576 VanDerWaalsContact CA-O 3.28Å; G568-L576 WeakPolarHBondContact CA-O 3.45Å; G568-S578 PolarHBondContact N-O 2.84Å
569	G	98.4	Very high	95.7	Very high	1 Å²	1	32.6 Å²	32.6	1%	0.01	22%	0.216	C	C	.	.			trans	91.7	-166.9	-172.3	0	0	0	0	0	112.2	R553 I567 N575 L576 R600 S601	R553-G569 CarbonylContact O-C 3.42Å; R553-G569 VanDerWaalsContact O-CA 3.22Å; R553-G569 WeakPolarHBondContact O-CA 3.49Å; I567-G569 PolarHBondContact O-N 2.83Å; G569-N575 CarbonylContact O-C 3.47Å; G569-N575 WeakPolarHBondContact O-CA 3.39Å; G569-L576 PolarHBondContact O-N 2.79Å; G569-R600 PolarHBondContact N-O 2.89Å; G569-S601 VanDerWaalsContact C-CB 3.48Å
570	D	98.3	Very high	95.9	Very high	12 Å²	12	30.8 Å²	30.8	6%	0.064	20%	0.201	C	C	.	.	B	Isolated β-bridge	trans	-131.2	149.6	170.5	74.5	102.7	0	0	0	111.9	R553 N554 G572 C574	R553-D570 VanDerWaalsContact CG-O 3.3Å; R553-D570 WeakPolarHBondContact CG-O 3.4Å; R553-D570 IonicContact CZ-OD1 2.7Å; R553-D570 PolarHBondContact N-O 3.43Å; R553-D570 IonicContact NE-OD1 3.58Å; R553-D570 PolarHBondContact NE-OD1 2.74Å; R553-D570 IonicContact NE-OD2 3.55Å; R553-D570 PolarHBondContact NE-OD2 3.42Å; R553-D570 IonicContact NH2-OD1 3.13Å; R553-D570 PolarHBondContact NH2-OD1 2.84Å; R553-D570 PolarHBondContact O-N 3.16Å; N554-D570 PolarHBondContact ND2-OD2 3.28Å; D570-G572 PolarHBondContact OD1-N 3.36Å; D570-C574 VanDerWaalsContact CA-O 3.24Å; D570-C574 WeakPolarHBondContact CA-O 3.17Å; D570-C574 WeakPolarHBondContact CB-O 3.17Å
571	D	96.9	Very high	96.3	Very high	56 Å²	56	32.5 Å²	32.5	30%	0.299	21%	0.208	S	C	.	.			trans	-91.7	2.4	-179.4	66.3	6.7	0	0	0	113.5	V528 C551 S573 C574	V528-D571 WeakPolarHBondContact CG2-O 3.35Å; C551-D571 WeakPolarHBondContact O-CB 3.4Å; D571-S573 WeakPolarHBondContact OD1-CA 3.18Å; D571-S573 WeakPolarHBondContact OD1-CB 3.33Å; D571-S573 PolarHBondContact OD1-N 3.26Å; D571-C574 PolarHBondContact N-O 3.16Å; D571-C574 PolarHBondContact OD1-N 3.14Å
572	G	93.3	Very high	96.9	Very high	39 Å²	39	27 Å²	27	40%	0.402	18%	0.178	S	C	.	.	S	Bend	trans	108.2	-25	-169.7	0	0	0	0	0	113.9	D570	D570-G572 PolarHBondContact OD1-N 3.36Å
573	S	92.6	Very high	97.2	Very high	113 Å²	113	27 Å²	27	79%	0.79	17%	0.168	S	C	*	.	S	Bend	trans	-123.1	-43.1	-175.5	-52	0	0	0	0	112.8	D571	D571-S573 WeakPolarHBondContact OD1-CA 3.18Å; D571-S573 WeakPolarHBondContact OD1-CB 3.33Å; D571-S573 PolarHBondContact OD1-N 3.26Å
574	C	95.2	Very high	97	Very high	77 Å²	77	27.8 Å²	27.8	52%	0.52	18%	0.175	S	C	.	.	S	Bend	trans	-130.3	145.3	-172.7	-67	0	0	0	0	111.6	D570 D571	D570-C574 VanDerWaalsContact CA-O 3.24Å; D570-C574 WeakPolarHBondContact CA-O 3.17Å; D570-C574 WeakPolarHBondContact CB-O 3.17Å; D571-C574 PolarHBondContact N-O 3.16Å; D571-C574 PolarHBondContact OD1-N 3.14Å
575	N	97.8	Very high	96.7	Very high	51 Å²	51	35.9 Å²	35.9	27%	0.273	22%	0.215	S	C	.	.	B	Isolated β-bridge	trans	-77.8	136.4	168	-62.6	-30.1	0	0	0	109.5	Q334 G569 G599 S601	Q334-N575 PolarHBondContact O-ND2 2.93Å; G569-N575 CarbonylContact O-C 3.47Å; G569-N575 WeakPolarHBondContact O-CA 3.39Å; N575-G599 VanDerWaalsContact CB-C 3.47Å; N575-G599 VanDerWaalsContact CB-O 3.29Å; N575-G599 WeakPolarHBondContact CB-O 3.4Å; N575-S601 WeakPolarHBondContact OD1-CB 3.25Å; N575-S601 PolarHBondContact OD1-OG 2.88Å
576	L	98.1	Very high	96.4	Very high	13 Å²	13	38.5 Å²	38.5	7%	0.068	23%	0.233	C	C	.	.			trans	-95.2	138	-175.3	-54.8	177.4	0	0	0	111	M550 R552 G568 G569 G599 R600	M550-L576 HydrophobicContact CB-CD1 4.37Å; M550-L576 HydrophobicContact CE-CD1 4.33Å; M550-L576 HydrophobicContact CE-CD2 3.74Å; M550-L576 HydrophobicContact SD-CD1 4.37Å; R552-L576 HydrophobicContact CG-CD1 3.86Å; G568-L576 VanDerWaalsContact CA-O 3.28Å; G568-L576 WeakPolarHBondContact CA-O 3.45Å; G569-L576 PolarHBondContact O-N 2.79Å; L576-G599 VanDerWaalsContact C-CA 3.44Å; L576-G599 WeakPolarHBondContact O-CA 3.36Å; L576-R600 PolarHBondContact O-N 2.86Å
577	S	97.7	Very high	96.2	Very high	40 Å²	40	41.4 Å²	41.4	28%	0.28	25%	0.248	S	C	.	.			trans	-94.2	-12.5	170.6	52.8	0	0	0	0	112.9	M596	S577-M596 PolarHBondContact O-N 3.34Å
578	S	98.1	Very high	96	Very high	12 Å²	12	47.7 Å²	47.7	8%	0.084	28%	0.276	C	S	.	.			trans	-77.8	148.4	-176.3	59.8	0	0	0	0	112.8	M550 R552 G568 N595	M550-S578 PolarHBondContact SD-OG 2.95Å; R552-S578 PolarHBondContact NH1-O 2.9Å; R552-S578 PolarHBondContact NH1-OG 2.92Å; R552-S578 PolarHBondContact NH2-OG 2.89Å; G568-S578 PolarHBondContact N-O 2.84Å; S578-N595 VanDerWaalsContact CA-OD1 3.25Å; S578-N595 WeakPolarHBondContact CA-OD1 3.39Å
579	V	98.4	Very high	96	Very high	0 Å²	0	48.6 Å²	48.6	0%	0	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	135.6	170.8	-176.8	0	0	0	0	108	W352 Y565 V566 I567 I592	W352-V579 HydrophobicContact CH2-CG2 4.28Å; W352-V579 HydrophobicContact CZ2-CG2 3.84Å; Y565-V579 HydrophobicContact CD1-CG1 4.08Å; V566-V579 WeakPolarHBondContact O-CA 3.32Å; V566-V579 WeakPolarHBondContact O-CG1 3.36Å; I567-V579 HydrophobicContact CB-CG2 4.25Å; I567-V579 HydrophobicContact CG1-CG1 3.93Å; I567-V579 HydrophobicContact CG1-CG2 4.25Å; I567-V579 HydrophobicContact CG2-CG2 3.9Å; V579-I592 HydrophobicContact CB-CD1 3.67Å; V579-I592 HydrophobicContact CB-CG1 3.9Å; V579-I592 HydrophobicContact CG1-CD1 4.23Å; V579-I592 HydrophobicContact CG2-CD1 4.06Å; V579-I592 PolarHBondContact O-N 3.18Å
580	E	98.4	Very high	96	Very high	0 Å²	0	51.2 Å²	51.2	0%	0	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.5	150.7	173.1	57.5	-170.7	113.6	0	0	110.9	N549 M550 R552 Y565 V566 W589 S590 L591	N549-E580 WeakPolarHBondContact CB-OE2 3.32Å; N549-E580 PolarHBondContact N-OE2 3.03Å; N549-E580 PolarHBondContact ND2-OE2 2.78Å; M550-E580 PolarHBondContact N-OE1 2.92Å; R552-E580 IonicContact CZ-OE1 3.73Å; R552-E580 IonicContact NE-OE1 3.12Å; R552-E580 PolarHBondContact NE-OE1 2.91Å; R552-E580 IonicContact NH2-OE1 2.71Å; R552-E580 PolarHBondContact NH2-OE1 3.21Å; Y565-E580 CarbonylContact C-O 3.56Å; Y565-E580 WeakPolarHBondContact CA-O 3.39Å; V566-E580 HydrophobicContact CB-CG 4.49Å; V566-E580 PolarHBondContact N-O 3.31Å; V566-E580 PolarHBondContact O-N 2.67Å; V566-E580 VanDerWaalsContact O-N 3.11Å; E580-W589 HydrophobicContact CB-CE3 4.17Å; E580-W589 HydrophobicContact CG-CE3 3.76Å; E580-W589 HydrophobicContact CG-CZ3 4.13Å; E580-S590 CarbonylContact C-O 3.59Å; E580-S590 WeakPolarHBondContact CA-O 3.23Å; E580-S590 WeakPolarHBondContact CB-O 3.26Å; E580-L591 HydrophobicContact CB-CD2 4.09Å
581	F	98.3	Very high	95.9	Very high	45 Å²	45	55 Å²	55	20%	0.197	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	143.2	-179.9	68	-90.8	0	0	0	111.8	L563 L564 Y565 W589 S590 I592	L563-F581 HydrophobicContact CB-CD2 4.44Å; L563-F581 HydrophobicContact CD1-CD2 3.77Å; L563-F581 HydrophobicContact CD1-CE2 3.97Å; L563-F581 HydrophobicContact CD2-CD2 4.21Å; L563-F581 HydrophobicContact CG-CD2 4.37Å; L564-F581 CarbonylContact O-C 3.56Å; L564-F581 VanDerWaalsContact O-CA 3.24Å; L564-F581 WeakPolarHBondContact O-CA 3.31Å; Y565-F581 HydrophobicContact CD1-CB 3.64Å; Y565-F581 HydrophobicContact CD1-CG 4.49Å; Y565-F581 HydrophobicContact CD2-CB 4.05Å; Y565-F581 HydrophobicContact CE1-CB 3.61Å; Y565-F581 HydrophobicContact CE1-CD1 4Å; Y565-F581 HydrophobicContact CE1-CG 4.01Å; Y565-F581 HydrophobicContact CE2-CB 4.02Å; Y565-F581 HydrophobicContact CG-CB 3.85Å; F581-W589 VanDerWaalsContact C-CE3 3.48Å; F581-W589 CarbonylContact O-C 3.51Å; F581-W589 WeakPolarHBondContact O-CA 3.4Å; F581-S590 VanDerWaalsContact CD1-O 3.31Å; F581-S590 WeakPolarHBondContact CD1-O 3.36Å; F581-S590 PolarHBondContact N-O 2.56Å; F581-S590 PolarHBondContact O-N 3.08Å; F581-I592 HydrophobicContact CD1-CG2 3.84Å; F581-I592 HydrophobicContact CE1-CG2 4.24Å
582	Y	98.7	Very high	95.6	Very high	4 Å²	4	52.7 Å²	52.7	2%	0.016	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.5	133.6	177	174.9	-107.5	0	0	0	111	Y518 V545 L563 L564 P584 D587 K588 W589	Y518-Y582 HydrophobicContact CE1-CD1 4.04Å; Y518-Y582 AromaticContact CE1-CE1 3.59Å; Y518-Y582 HydrophobicContact CE1-CE1 3.59Å; V545-Y582 HydrophobicContact CB-CE2 4.21Å; V545-Y582 HydrophobicContact CG2-CE2 4.29Å; L563-Y582 WeakPolarHBondContact CA-O 3.05Å; L564-Y582 PolarHBondContact N-O 2.79Å; L564-Y582 VanDerWaalsContact N-O 3.12Å; L564-Y582 PolarHBondContact O-N 3.02Å; Y582-P584 HydrophobicContact CD1-CB 4.47Å; Y582-P584 VanDerWaalsContact CE1-CA 3.49Å; Y582-P584 HydrophobicContact CE1-CB 3.77Å; Y582-D587 WeakPolarHBondContact CE2-OD1 3.26Å; Y582-D587 PolarHBondContact OH-OD1 2.88Å; Y582-K588 WeakPolarHBondContact CA-O 3.43Å; Y582-W589 AromaticContact CD2-CD1 3.95Å; Y582-W589 HydrophobicContact CD2-CD2 4.26Å; Y582-W589 AromaticContact CD2-CE2 3.78Å; Y582-W589 HydrophobicContact CD2-CG 4.36Å; Y582-W589 HydrophobicContact CD2-CZ2 4.19Å; Y582-W589 AromaticContact CD2-NE1 3.58Å; Y582-W589 HydrophobicContact CG-CD2 4.47Å; Y582-W589 HydrophobicContact CG-CH2 4.48Å; Y582-W589 HydrophobicContact CG-CZ2 4.01Å
583	N	93.8	Very high	95.3	Very high	46 Å²	46	55.6 Å²	55.6	25%	0.246	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	111.7	170.6	-176.4	-21.7	0	0	0	110	L563 M585 T586 D587 K588	L563-N583 HydrophobicContact CD2-CB 3.62Å; N583-M585 PolarHBondContact O-N 2.81Å; N583-M585 WeakPolarHBondContact OD1-CB 2.84Å; N583-M585 PolarHBondContact OD1-N 2.86Å; N583-T586 WeakPolarHBondContact CB-OG1 3.27Å; N583-T586 PolarHBondContact O-N 3.04Å; N583-D587 PolarHBondContact O-N 2.94Å; N583-K588 PolarHBondContact N-O 2.87Å
584	P	90.3	Very high	95.2	Very high	47 Å²	47	52.3 Å²	52.3	31%	0.305	29%	0.291	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.1	-19.2	-178.1	29.8	-37	0	0	0	113.7	L513 G562 Y582	L513-P584 HydrophobicContact CD2-CG 3.85Å; G562-P584 WeakPolarHBondContact O-CD 3.42Å; Y582-P584 HydrophobicContact CD1-CB 4.47Å; Y582-P584 VanDerWaalsContact CE1-CA 3.49Å; Y582-P584 HydrophobicContact CE1-CB 3.77Å
585	M	92.6	Very high	95.2	Very high	169 Å²	169	52.6 Å²	52.6	83%	0.833	29%	0.288	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.3	-21.8	178.6	-58.8	-58.8	-61.7	0	0	112.7	N583	N583-M585 PolarHBondContact O-N 2.81Å; N583-M585 WeakPolarHBondContact OD1-CB 2.84Å; N583-M585 PolarHBondContact OD1-N 2.86Å
586	T	91.1	Very high	95.2	Very high	77 Å²	77	50.5 Å²	50.5	47%	0.472	28%	0.276	S	S	.	.	T	Hydrogen-bonded Turn	trans	-117.1	-5.9	-178.4	60.6	0	0	0	0	113.8	N583 K588	N583-T586 WeakPolarHBondContact CB-OG1 3.27Å; N583-T586 PolarHBondContact O-N 3.04Å; T586-K588 VanDerWaalsContact C-N 3.34Å; T586-K588 PolarHBondContact O-N 2.8Å
587	D	94.5	Very high	94.8	Very high	63 Å²	63	53.1 Å²	53.1	34%	0.337	30%	0.296	S	S	.	.	T	Hydrogen-bonded Turn	trans	48.6	51.7	-171.8	-173.4	45.7	0	0	0	112	V545 S546 Y582 N583	V545-D587 WeakPolarHBondContact CB-OD1 3.49Å; S546-D587 VanDerWaalsContact CB-O 3.25Å; S546-D587 WeakPolarHBondContact CB-O 3.21Å; S546-D587 WeakPolarHBondContact CB-OD1 3.36Å; S546-D587 WeakPolarHBondContact CB-OD2 3.29Å; S546-D587 PolarHBondContact N-OD1 3.28Å; S546-D587 PolarHBondContact N-OD2 2.85Å; S546-D587 VanDerWaalsContact OG-CG 3.28Å; S546-D587 PolarHBondContact OG-O 2.73Å; S546-D587 PolarHBondContact OG-OD2 2.98Å; Y582-D587 WeakPolarHBondContact CE2-OD1 3.26Å; Y582-D587 PolarHBondContact OH-OD1 2.88Å; N583-D587 PolarHBondContact O-N 2.94Å
588	K	95.9	Very high	94.6	Very high	137 Å²	137	55.9 Å²	55.9	60%	0.596	31%	0.308	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-137.7	146	-177.4	-75	-179.1	-176.6	-176.6	0	113.1	Y582 N583 T586	Y582-K588 WeakPolarHBondContact CA-O 3.43Å; N583-K588 PolarHBondContact N-O 2.87Å; T586-K588 VanDerWaalsContact C-N 3.34Å; T586-K588 PolarHBondContact O-N 2.8Å
589	W	98.4	Very high	94.4	Very high	19 Å²	19	56.3 Å²	56.3	7%	0.072	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.3	131	170.6	-70.9	91.3	0	0	0	111.2	V532 S546 D547 M548 N549 L564 V566 E580 F581 Y582	V532-W589 HydrophobicContact CB-CZ2 4.43Å; V532-W589 HydrophobicContact CG1-CZ2 4.26Å; V532-W589 HydrophobicContact CG2-CZ2 3.74Å; S546-W589 VanDerWaalsContact O-CD1 3.27Å; S546-W589 PolarHBondContact O-NE1 3.05Å; D547-W589 VanDerWaalsContact C-CD1 3.44Å; M548-W589 HydrophobicContact CB-CD2 4.47Å; M548-W589 HydrophobicContact CG-CD2 3.82Å; M548-W589 HydrophobicContact CG-CE3 4.06Å; M548-W589 HydrophobicContact CG-CG 4.46Å; M548-W589 HydrophobicContact CG-CH2 4.03Å; M548-W589 HydrophobicContact CG-CZ2 3.76Å; M548-W589 HydrophobicContact CG-CZ3 4.16Å; M548-W589 HydrophobicContact SD-CH2 4.39Å; N549-W589 VanDerWaalsContact ND2-CB 3.33Å; N549-W589 WeakPolarHBondContact ND2-CB 3.41Å; N549-W589 PolarHBondContact ND2-O 2.81Å; L564-W589 HydrophobicContact CD2-CH2 4.39Å; V566-W589 HydrophobicContact CB-CH2 4.49Å; V566-W589 HydrophobicContact CB-CZ3 4.17Å; V566-W589 HydrophobicContact CG2-CH2 3.41Å; V566-W589 VanDerWaalsContact CG2-CH2 3.41Å; V566-W589 HydrophobicContact CG2-CZ3 3.52Å; E580-W589 HydrophobicContact CB-CE3 4.17Å; E580-W589 HydrophobicContact CG-CE3 3.76Å; E580-W589 HydrophobicContact CG-CZ3 4.13Å; F581-W589 VanDerWaalsContact C-CE3 3.48Å; F581-W589 CarbonylContact O-C 3.51Å; F581-W589 WeakPolarHBondContact O-CA 3.4Å; Y582-W589 AromaticContact CD2-CD1 3.95Å; Y582-W589 HydrophobicContact CD2-CD2 4.26Å; Y582-W589 AromaticContact CD2-CE2 3.78Å; Y582-W589 HydrophobicContact CD2-CG 4.36Å; Y582-W589 HydrophobicContact CD2-CZ2 4.19Å; Y582-W589 AromaticContact CD2-NE1 3.58Å; Y582-W589 HydrophobicContact CG-CD2 4.47Å; Y582-W589 HydrophobicContact CG-CH2 4.48Å; Y582-W589 HydrophobicContact CG-CZ2 4.01Å
590	S	97.3	Very high	94.4	Very high	56 Å²	56	56.4 Å²	56.4	39%	0.392	31%	0.314	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	142.4	175.4	-67.7	0	0	0	0	110.2	E580 F581	E580-S590 CarbonylContact C-O 3.59Å; E580-S590 WeakPolarHBondContact CA-O 3.23Å; E580-S590 WeakPolarHBondContact CB-O 3.26Å; F581-S590 VanDerWaalsContact CD1-O 3.31Å; F581-S590 WeakPolarHBondContact CD1-O 3.36Å; F581-S590 PolarHBondContact N-O 2.56Å; F581-S590 PolarHBondContact O-N 3.08Å
591	L	95.4	Very high	94.4	Very high	90 Å²	90	56.6 Å²	56.6	47%	0.471	32%	0.315	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.1	145.8	168.6	-71	161.8	0	0	0	110	E580	E580-L591 HydrophobicContact CB-CD2 4.09Å
592	I	92.7	Very high	94.4	Very high	9 Å²	9	56.7 Å²	56.7	5%	0.046	32%	0.315	C	S	.	.			trans	-74.1	151	159.7	73.6	175.8	0	0	0	108.7	Y345 W352 Y565 V579 F581 T594	Y345-I592 HydrophobicContact CD2-CD1 4.42Å; Y345-I592 HydrophobicContact CE2-CD1 3.96Å; W352-I592 HydrophobicContact CZ2-CD1 4.13Å; Y565-I592 HydrophobicContact CD1-CG2 4.37Å; Y565-I592 HydrophobicContact CE1-CG2 3.93Å; V579-I592 HydrophobicContact CB-CD1 3.67Å; V579-I592 HydrophobicContact CB-CG1 3.9Å; V579-I592 HydrophobicContact CG1-CD1 4.23Å; V579-I592 HydrophobicContact CG2-CD1 4.06Å; V579-I592 PolarHBondContact O-N 3.18Å; F581-I592 HydrophobicContact CD1-CG2 3.84Å; F581-I592 HydrophobicContact CE1-CG2 4.24Å; I592-T594 VanDerWaalsContact C-N 3.35Å; I592-T594 WeakPolarHBondContact CD1-O 3.35Å; I592-T594 WeakPolarHBondContact CG1-O 3.35Å; I592-T594 PolarHBondContact O-N 2.84Å
593	P	85.3	Confident	94.3	Very high	100 Å²	100	57 Å²	57	65%	0.649	32%	0.318	S	S	*	.	S	Bend	trans	-74.6	-25.2	-175.4	31.1	-36.1	0	0	0	112.9	D350	D350-P593 WeakPolarHBondContact OD1-CG 3.39Å; D350-P593 WeakPolarHBondContact OD2-CG 3.47Å
594	T	91.3	Very high	94.5	Very high	43 Å²	43	55.3 Å²	55.3	26%	0.264	31%	0.312	S	S	.	.	S	Bend	trans	-107	116	-177.3	57.1	0	0	0	0	112.2	Y345 D350 W352 I592	Y345-T594 WeakPolarHBondContact CE2-OG1 3.5Å; D350-T594 WeakPolarHBondContact O-CG2 3.44Å; D350-T594 PolarHBondContact O-OG1 3.24Å; D350-T594 WeakPolarHBondContact OD1-CG2 3.34Å; D350-T594 PolarHBondContact OD1-OG1 3.11Å; W352-T594 PolarHBondContact NE1-O 2.79Å; I592-T594 VanDerWaalsContact C-N 3.35Å; I592-T594 WeakPolarHBondContact CD1-O 3.35Å; I592-T594 WeakPolarHBondContact CG1-O 3.35Å; I592-T594 PolarHBondContact O-N 2.84Å
595	N	95.1	Very high	94.9	Very high	84 Å²	84	53.7 Å²	53.7	45%	0.449	30%	0.301	S	S	.	.			trans	-81.7	156.8	178.4	-65.1	-46	0	0	0	111.9	S578	S578-N595 VanDerWaalsContact CA-OD1 3.25Å; S578-N595 WeakPolarHBondContact CA-OD1 3.39Å
596	M	96.8	Very high	95.1	Very high	6 Å²	6	45.9 Å²	45.9	3%	0.03	26%	0.263	C	S	.	.			trans	-57.2	154.7	168.3	-68.9	-178.6	-68.7	0	0	111.4	V330 W352 I567 S577 N598 R600	V330-M596 HydrophobicContact CG1-SD 3.95Å; V330-M596 HydrophobicContact CG2-SD 4.41Å; W352-M596 HydrophobicContact CD2-CG 4.22Å; W352-M596 HydrophobicContact CE3-CG 4.18Å; W352-M596 HydrophobicContact CH2-CG 3.39Å; W352-M596 HydrophobicContact CH2-SD 4.07Å; W352-M596 HydrophobicContact CZ2-CG 3.46Å; W352-M596 VanDerWaalsContact CZ2-CG 3.46Å; W352-M596 HydrophobicContact CZ3-CG 3.78Å; W352-M596 HydrophobicContact CZ3-SD 4.44Å; I567-M596 HydrophobicContact CG2-CE 3.84Å; I567-M596 HydrophobicContact CG2-SD 3.69Å; S577-M596 PolarHBondContact O-N 3.34Å; M596-N598 PolarHBondContact O-N 3.42Å; M596-N598 VanDerWaalsContact O-N 3.08Å; M596-R600 HydrophobicContact CE-CG 3.7Å; M596-R600 HydrophobicContact SD-CG 3.75Å
597	S	91.4	Very high	95.3	Very high	69 Å²	69	43.5 Å²	43.5	48%	0.483	25%	0.249	S	C	.	.	S	Bend	trans	-57.1	-31	-177.5	76.9	0	0	0	0	113.9	E343	E343-S597 WeakPolarHBondContact OE1-CB 3.3Å; E343-S597 PolarHBondContact OE1-OG 3.06Å; E343-S597 PolarHBondContact OE2-N 2.96Å
598	N	91.9	Very high	95.2	Very high	97 Å²	97	40.9 Å²	40.9	52%	0.519	23%	0.234	S	C	.	.	S	Bend	trans	-144.9	148.4	-177.8	-72.6	-89.1	0	0	0	110.4	M596 R600	M596-N598 PolarHBondContact O-N 3.42Å; M596-N598 VanDerWaalsContact O-N 3.08Å; N598-R600 PolarHBondContact O-N 3.41Å
599	G	95.8	Very high	94.7	Very high	21 Å²	21	37.6 Å²	37.6	22%	0.216	22%	0.223	C	C	.	.			trans	-67.4	121.4	173.2	0	0	0	0	0	111.7	N575 L576	N575-G599 VanDerWaalsContact CB-C 3.47Å; N575-G599 VanDerWaalsContact CB-O 3.29Å; N575-G599 WeakPolarHBondContact CB-O 3.4Å; L576-G599 VanDerWaalsContact C-CA 3.44Å; L576-G599 WeakPolarHBondContact O-CA 3.36Å
600	R	97.1	Very high	93.9	Very high	3 Å²	3	39.1 Å²	39.1	1%	0.011	23%	0.23	C	C	.	.			trans	-135.8	133.4	-175.1	58.3	173.3	76.9	-157.2	9	113.3	G332 Q334 S341 E343 G569 L576 M596 N598 A603	G332-R600 PolarHBondContact O-NH1 3.41Å; Q334-R600 WeakPolarHBondContact O-CA 3.39Å; S341-R600 PolarHBondContact O-NH1 2.75Å; S341-R600 PolarHBondContact OG-NH2 2.82Å; E343-R600 IonicContact OE1-CZ 3.27Å; E343-R600 IonicContact OE1-NE 2.76Å; E343-R600 IonicContact OE1-NH2 2.9Å; E343-R600 PolarHBondContact OE1-NH2 2.89Å; G569-R600 PolarHBondContact N-O 2.89Å; L576-R600 PolarHBondContact O-N 2.86Å; M596-R600 HydrophobicContact CE-CG 3.7Å; M596-R600 HydrophobicContact SD-CG 3.75Å; N598-R600 PolarHBondContact O-N 3.41Å; R600-A603 HydrophobicContact CG-CB 4.22Å
601	S	97.8	Very high	92.5	Very high	3 Å²	3	39 Å²	39	2%	0.021	23%	0.228	C	C	.	.	B	Isolated β-bridge	trans	-116.3	159.4	174	60.3	0	0	0	0	111	G333 Q334 G569 N575 A603	G333-S601 CarbonylContact C-O 3.53Å; G333-S601 WeakPolarHBondContact CA-O 3.18Å; Q334-S601 PolarHBondContact N-O 2.82Å; Q334-S601 PolarHBondContact O-N 2.65Å; G569-S601 VanDerWaalsContact C-CB 3.48Å; N575-S601 WeakPolarHBondContact OD1-CB 3.25Å; N575-S601 PolarHBondContact OD1-OG 2.88Å; S601-A603 PolarHBondContact O-N 2.89Å
602	Y	98.4	Very high	90.5	Very high	47 Å²	47	43.1 Å²	43.1	18%	0.184	25%	0.25	C	C	.	.	S	Bend	trans	52.3	27.2	-174.7	-61.8	-79.1	0	0	0	114.1	Q334 R364 T411 N554	Q334-Y602 HydrophobicContact CG-CD2 4.42Å; Q334-Y602 VanDerWaalsContact OE1-CD2 3.26Å; R364-Y602 HydrophobicContact CB-CD1 4.3Å; R364-Y602 HydrophobicContact CG-CD1 3.59Å; R364-Y602 HydrophobicContact CG-CD2 4.13Å; R364-Y602 HydrophobicContact CG-CE1 4.15Å; R364-Y602 HydrophobicContact CG-CG 3.55Å; R364-Y602 PolarHBondContact N-O 3.44Å; T411-Y602 HydrophobicContact CG2-CD1 4.36Å; T411-Y602 HydrophobicContact CG2-CE1 3.9Å; N554-Y602 HydrophobicContact CB-CD1 3.65Å; N554-Y602 HydrophobicContact CB-CD2 3.95Å; N554-Y602 HydrophobicContact CB-CE1 3.69Å; N554-Y602 HydrophobicContact CB-CE2 3.98Å; N554-Y602 HydrophobicContact CB-CG 3.8Å; N554-Y602 WeakPolarHBondContact ND2-CE2 3.19Å; N554-Y602 PolarHBondContact ND2-OH 3.42Å; N554-Y602 PolarHBondContact O-N 3Å; N554-Y602 WeakPolarHBondContact OD1-CE1 3.43Å; N554-Y602 PolarHBondContact OD1-OH 2.85Å
603	A	98.4	Very high	90.4	Very high	11 Å²	11	44.8 Å²	44.8	9%	0.091	26%	0.26	C	S	.	.			trans	-82.1	134	167.2	0	0	0	0	0	107.8	V330 G332 R600 S601	V330-A603 HydrophobicContact CG1-CB 3.83Å; G332-A603 WeakPolarHBondContact O-CB 3.32Å; R600-A603 HydrophobicContact CG-CB 4.22Å; S601-A603 PolarHBondContact O-N 2.89Å
604	G	97.9	Very high	90.6	Very high	10 Å²	10	41.9 Å²	41.9	10%	0.103	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.3	152.2	174.3	0	0	0	0	0	110.5	V331	V331-G604 PolarHBondContact N-O 2.86Å; V331-G604 PolarHBondContact O-N 2.96Å
605	V	98.2	Very high	90.6	Very high	14 Å²	14	41.8 Å²	41.8	9%	0.085	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130	137.6	-175.8	178	0	0	0	0	110	M328 I329 V330 C558 I567	M328-V605 HydrophobicContact CG-CG1 3.68Å; M328-V605 HydrophobicContact SD-CG1 4.1Å; I329-V605 WeakPolarHBondContact O-CA 3.41Å; V330-V605 HydrophobicContact CB-CG2 4.49Å; V330-V605 HydrophobicContact CG1-CG2 4.21Å; V330-V605 HydrophobicContact CG2-CG2 4.13Å; C558-V605 HydrophobicContact CB-CG1 4.14Å; I567-V605 HydrophobicContact CB-CG2 3.99Å; I567-V605 HydrophobicContact CD1-CG1 4Å; I567-V605 HydrophobicContact CD1-CG2 4.22Å; I567-V605 HydrophobicContact CG1-CG1 4.33Å; I567-V605 HydrophobicContact CG1-CG2 4.07Å; I567-V605 HydrophobicContact CG2-CG2 4.18Å
606	A	97.1	Very high	90.3	Very high	5 Å²	5	39.4 Å²	39.4	4%	0.041	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135	152.9	171	0	0	0	0	0	110	I329 V367 V374	I329-A606 PolarHBondContact N-O 3.35Å; I329-A606 PolarHBondContact O-N 3.23Å; V367-A606 HydrophobicContact CG1-CB 4.06Å; V374-A606 HydrophobicContact CB-CB 4.38Å; V374-A606 HydrophobicContact CG1-CB 3.7Å; V374-A606 HydrophobicContact CG2-CB 3.84Å
607	V	94.9	Very high	89.9	Confident	27 Å²	27	41.4 Å²	41.4	16%	0.164	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	132	168.4	177.7	0	0	0	0	107.7	K326 V327 S369 C558 I560	K326-V607 HydrophobicContact CB-CG1 3.86Å; K326-V607 HydrophobicContact CD-CG1 3.93Å; K326-V607 HydrophobicContact CG-CG1 4.24Å; V327-V607 WeakPolarHBondContact O-CA 3.4Å; S369-V607 WeakPolarHBondContact CB-O 3.44Å; S369-V607 PolarHBondContact OG-O 3.27Å; C558-V607 HydrophobicContact CB-CG2 3.73Å; I560-V607 HydrophobicContact CD1-CG1 4.26Å
608	I	91.4	Very high	89.8	Confident	7 Å²	7	39.6 Å²	39.6	4%	0.036	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.1	164.2	170.9	61.2	176.4	0	0	0	109	K326 V327 I329 V374 Y392	K326-I608 CarbonylContact C-O 3.59Å; K326-I608 WeakPolarHBondContact CA-O 3.38Å; V327-I608 HydrophobicContact CG2-CD1 4.15Å; V327-I608 HydrophobicContact CG2-CG1 3.55Å; V327-I608 PolarHBondContact N-O 3.46Å; V327-I608 PolarHBondContact O-N 2.77Å; I329-I608 HydrophobicContact CD1-CD1 4.04Å; I329-I608 HydrophobicContact CD1-CG1 4.31Å; I329-I608 HydrophobicContact CG1-CD1 3.81Å; I329-I608 HydrophobicContact CG1-CG1 3.9Å; V374-I608 HydrophobicContact CG2-CG2 3.49Å; V374-I608 VanDerWaalsContact CG2-CG2 3.49Å; Y392-I608 HydrophobicContact CE1-CD1 4.35Å
609	D	85.8	Confident	89.7	Confident	68 Å²	68	35.5 Å²	35.5	36%	0.364	20%	0.201	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.3	140.5	165.5	-58.8	-40.6	0	0	0	108.6	I324 K326 P611	I324-D609 HydrophobicContact CB-CB 3.93Å; I324-D609 HydrophobicContact CG2-CB 3.87Å; K326-D609 WeakPolarHBondContact CG-OD1 3.17Å; K326-D609 IonicContact NZ-OD1 3.21Å; K326-D609 PolarHBondContact NZ-OD1 3.48Å; D609-P611 WeakPolarHBondContact O-CD 3.16Å
610	K	81.4	Confident	89.2	Confident	51 Å²	51	36.6 Å²	36.6	22%	0.222	20%	0.199	C	C	.	.	P	Polyproline II helix	trans	-58.9	126.3	178.9	-174.8	171.5	-177.7	167	0	107.8	I324 P325 V327 D346 E349 L612	I324-K610 WeakPolarHBondContact CG2-O 3.46Å; P325-K610 HydrophobicContact CG-CB 4.08Å; P325-K610 HydrophobicContact CG-CD 4.05Å; P325-K610 WeakPolarHBondContact O-CA 3.36Å; P325-K610 WeakPolarHBondContact O-CB 3.4Å; P325-K610 PolarHBondContact O-N 3.28Å; V327-K610 HydrophobicContact CG1-CB 3.87Å; V327-K610 HydrophobicContact CG1-CD 4.34Å; V327-K610 HydrophobicContact CG1-CG 4.01Å; D346-K610 WeakPolarHBondContact OD2-CD 3.49Å; D346-K610 WeakPolarHBondContact OD2-CE 3.21Å; D346-K610 IonicContact OD2-NZ 2.7Å; D346-K610 PolarHBondContact OD2-NZ 3.36Å; E349-K610 IonicContact OE1-NZ 2.72Å; E349-K610 PolarHBondContact OE1-NZ 2.75Å; K610-L612 PolarHBondContact O-N 2.8Å
611	P	69	Low	88.6	Confident	53 Å²	53	39.4 Å²	39.4	34%	0.344	22%	0.215	S	C	.	.	P	Polyproline II helix	trans	-53.5	130.8	168.6	-24.7	35.3	0	0	0	109.9	G394 D609	G394-P611 VanDerWaalsContact C-CG 3.46Å; G394-P611 WeakPolarHBondContact O-CB 3.31Å; G394-P611 WeakPolarHBondContact O-CG 3.19Å; D609-P611 WeakPolarHBondContact O-CD 3.16Å
612	L	52.3	Low	87.7	Confident	177 Å²	177	42.7 Å²	42.7	93%	0.927	23%	0.233	S	C	*	.			trans	-71	0	175.3	-69.7	172.7	0	0	0	111.2	K610	K610-L612 PolarHBondContact O-N 2.8Å

Retrieved 612 of 612 residues in 1057.1 ms (Link to these results)

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