A0A061IDJ3_CRIGR Loading...

28S ribosomal protein S30

AlphaFold DB , UniProt , Accession A0A061IDJ3, Species CRIGR (Cricetulus griseus, Chinese hamster), Gene Mrps30, Length 439 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	38.4	Very low	33.1	Very low	252 Å²	252	159.3 Å²	159.3	100%	1.241	88%	0.878	S	S	*	*				0	117.2	0	-77.5	-157.5	-113	0	0	108.4
2	A	33.6	Very low	33.1	Very low	105 Å²	105	167 Å²	167	87%	0.868	88%	0.884	S	S	*	*			trans	-86.4	147.3	-176.7	0	0	0	0	0	111
3	A	33.3	Very low	32.9	Very low	101 Å²	101	173.2 Å²	173.2	84%	0.835	89%	0.888	S	S	*	*			trans	-148.5	91.4	157.1	0	0	0	0	0	108.8
4	A	32.5	Very low	32.7	Very low	97 Å²	97	166.1 Å²	166.1	80%	0.802	88%	0.878	S	S	*	*			trans	-78.5	135	166.9	0	0	0	0	0	109.1
5	R	38.1	Very low	32.7	Very low	233 Å²	233	166.1 Å²	166.1	88%	0.879	88%	0.878	S	S	*	*			trans	-107.1	99.2	167.7	-78.4	-175	175.4	-172.5	-1.3	108.9
6	C	30.3	Very low	32.6	Very low	120 Å²	120	162.3 Å²	162.3	81%	0.811	87%	0.869	S	S	*	*			trans	-67.5	137.3	163.8	-83.5	0	0	0	0	110.2
7	W	30.2	Very low	32.8	Very low	239 Å²	239	162.2 Å²	162.2	91%	0.905	87%	0.867	S	S	*	*			trans	-115.8	116.8	160.7	-81.1	60.2	0	0	0	107.6
8	Q	31.8	Very low	32.6	Very low	184 Å²	184	163.7 Å²	163.7	86%	0.86	87%	0.868	S	S	*	*			trans	-83	136.9	179	-76.1	-178.2	-27.5	0	0	110.8
9	L	30.8	Very low	32.5	Very low	176 Å²	176	160.4 Å²	160.4	92%	0.921	87%	0.866	S	S	*	*			trans	-78.3	133.9	167.3	-73.4	154.5	0	0	0	109.4
10	V	31.1	Very low	32.5	Very low	129 Å²	129	157.5 Å²	157.5	78%	0.782	87%	0.865	S	S	*	*			trans	-128.6	132.5	164.2	179.8	0	0	0	0	108.1
11	P	33.9	Very low	32.4	Very low	116 Å²	116	154.9 Å²	154.9	75%	0.753	86%	0.864	S	S	*	*			trans	-88.1	145	-167.9	35	-33	0	0	0	111.8
12	R	32.8	Very low	32	Very low	252 Å²	252	151.9 Å²	151.9	95%	0.951	85%	0.847	S	S	*	*			trans	-106.5	114.1	163	-84	-172.9	172.3	-175.9	-2.3	110
13	R	31.3	Very low	31.9	Very low	248 Å²	248	151.6 Å²	151.6	94%	0.936	85%	0.845	S	S	*	*			trans	-57.4	143.2	168.8	-81.7	176.6	168.7	-179.2	-3.9	110.6
14	G	30.4	Very low	31.8	Very low	73 Å²	73	152.6 Å²	152.6	75%	0.753	85%	0.846	S	S	*	*			trans	-72.1	165.2	176.4	0	0	0	0	0	114
15	L	31.5	Very low	31.8	Very low	167 Å²	167	153.1 Å²	153.1	87%	0.874	85%	0.85	S	S	*	*			trans	-151.5	108.7	158.9	-98.6	157	0	0	0	106.9
16	S	31	Very low	31.6	Very low	104 Å²	104	147.7 Å²	147.7	73%	0.727	85%	0.848	S	S	*	*			trans	-79.2	129	162.7	52.5	0	0	0	0	108.6
17	L	36.3	Very low	31.8	Very low	161 Å²	161	147 Å²	147	84%	0.843	85%	0.851	S	S	*	*			trans	-137.3	113.6	157.8	-79.5	173.2	0	0	0	109.2
18	H	29.7	Very low	31.9	Very low	189 Å²	189	141.2 Å²	141.2	88%	0.875	85%	0.847	S	S	*	*			trans	-53.2	130.5	161.2	-74.8	-89.8	0	0	0	109.8
19	A	31.4	Very low	32.1	Very low	102 Å²	102	142.3 Å²	142.3	84%	0.843	85%	0.849	S	S	*	*			trans	-122.8	95.3	160.8	0	0	0	0	0	107.5
20	A	31.2	Very low	32.3	Very low	102 Å²	102	140.7 Å²	140.7	84%	0.843	85%	0.846	S	S	*	*			trans	-72.7	131.2	159.1	0	0	0	0	0	107.7
21	A	31.6	Very low	32.7	Very low	103 Å²	103	139.4 Å²	139.4	85%	0.851	84%	0.842	S	S	*	*			trans	-124.2	105.4	167.3	0	0	0	0	0	107.3
22	E	30.2	Very low	33.1	Very low	189 Å²	189	141 Å²	141	88%	0.883	85%	0.845	S	S	*	*			trans	-84.1	153.5	167.3	-86.6	-178.9	152.5	0	0	111
23	A	30.4	Very low	33.7	Very low	98 Å²	98	135.2 Å²	135.2	81%	0.81	84%	0.84	S	S	*	*			trans	80.4	109.9	152.8	0	0	0	0	0	119.7
24	S	31.3	Very low	34.4	Very low	123 Å²	123	131.7 Å²	131.7	86%	0.86	83%	0.834	S	S	*	*				-156.1	115.8	110	61.5	0	0	0	0	110.5
25	A	33.1	Very low	35.5	Very low	108 Å²	108	134.7 Å²	134.7	89%	0.893	84%	0.837	S	S	*	*			trans	-82.9	134.9	170.3	0	0	0	0	0	110.2
26	S	33.8	Very low	36.6	Very low	119 Å²	119	132.9 Å²	132.9	83%	0.832	83%	0.833	S	S	*	*			trans	-137.7	113.5	156.4	59.7	0	0	0	0	108.3
27	A	33.9	Very low	38.1	Very low	106 Å²	106	132 Å²	132	88%	0.876	83%	0.832	S	S	*	*			trans	-80.7	132.6	178.3	0	0	0	0	0	110.9
28	S	32.2	Very low	39.6	Very low	117 Å²	117	129.8 Å²	129.8	82%	0.818	83%	0.826	S	S	*	*			trans	-136.9	109.7	153.5	56.5	0	0	0	0	107.8
29	K	36	Very low	41.9	Very low	206 Å²	206	127.1 Å²	127.1	90%	0.896	83%	0.825	S	S	*	*			trans	-77	122.8	171.6	-82.6	176.8	172.2	177.5	0	109.1
30	V	35.3	Very low	44.5	Very low	143 Å²	143	128.2 Å²	128.2	87%	0.867	82%	0.821	S	S	*	*			trans	-136.2	136.3	146.4	-178.9	0	0	0	0	107.4
31	S	39.8	Very low	47.2	Very low	101 Å²	101	126.5 Å²	126.5	71%	0.706	81%	0.806	S	S	*	*			trans	-75.9	130.4	-168.3	46.8	0	0	0	0	114.3
32	D	41.1	Very low	50.1	Low	151 Å²	151	133.2 Å²	133.2	81%	0.807	81%	0.81	S	S	*	*			trans	-155.3	145.9	146.7	-86.3	-38	0	0	0	107.7	E34	D32-E34 PolarHBondContact O-N 3.41Å
33	P	45.2	Very low	53.2	Low	129 Å²	129	133.7 Å²	133.7	84%	0.838	81%	0.805	S	S	*	*			trans	-77.9	72.8	172.7	33.4	-31.3	0	0	0	108.8	V35	P33-V35 PolarHBondContact O-N 3.09Å
34	E	46.9	Very low	56.3	Low	174 Å²	174	134 Å²	134	81%	0.813	80%	0.799	S	S	*	*			trans	-68.1	111.8	165	-120.4	-178.1	174.3	0	0	107.3	D32 V36	D32-E34 PolarHBondContact O-N 3.41Å; E34-V36 VanDerWaalsContact C-N 3.34Å; E34-V36 PolarHBondContact O-N 3.18Å
35	V	53.8	Low	59.4	Low	136 Å²	136	133.1 Å²	133.1	82%	0.824	79%	0.79	S	S	*	*			trans	-54.3	103	166.8	175.9	0	0	0	0	106.6	P33 A37	P33-V35 PolarHBondContact O-N 3.09Å; V35-A37 VanDerWaalsContact C-N 3.28Å; V35-A37 PolarHBondContact O-N 2.82Å
36	V	53.6	Low	62.4	Low	129 Å²	129	136.6 Å²	136.6	78%	0.782	79%	0.792	S	S	*	*			trans	-60	94.4	176.2	178.1	0	0	0	0	107.1	E34 T38	E34-V36 VanDerWaalsContact C-N 3.34Å; E34-V36 PolarHBondContact O-N 3.18Å; V36-T38 PolarHBondContact O-N 2.78Å
37	A	62.8	Low	65.4	Low	87 Å²	87	134.8 Å²	134.8	72%	0.719	78%	0.775	S	S	*	*			trans	-64.1	107.2	174.5	0	0	0	0	0	107.3	V35	V35-A37 VanDerWaalsContact C-N 3.28Å; V35-A37 PolarHBondContact O-N 2.82Å
38	T	67.6	Low	68.3	Low	114 Å²	114	131.7 Å²	131.7	70%	0.699	75%	0.75	S	S	*	*			trans	-56.8	131.2	173	45	0	0	0	0	108.6	V36 V40	V36-T38 PolarHBondContact O-N 2.78Å; T38-V40 PolarHBondContact O-N 2.8Å
39	P	78.2	Confident	71.4	Confident	132 Å²	132	129.1 Å²	129.1	86%	0.857	73%	0.732	S	S	*	*			trans	-63.9	112.5	-177.4	24	-32.3	0	0	0	109.4	A41	P39-A41 PolarHBondContact O-N 2.91Å
40	V	86.6	Confident	74.1	Confident	125 Å²	125	122.2 Å²	122.2	76%	0.758	70%	0.704	S	S	*	*			trans	-70.9	121.5	177.2	-178.8	0	0	0	0	108.9	T38 R42	T38-V40 PolarHBondContact O-N 2.8Å; V40-R42 PolarHBondContact O-N 2.85Å
41	A	88.9	Confident	77	Confident	66 Å²	66	122 Å²	122	55%	0.545	70%	0.703	S	S	.	*			trans	-60.1	121.6	178	0	0	0	0	0	111.2	P39 Y43	P39-A41 PolarHBondContact O-N 2.91Å; A41-Y43 HydrophobicContact CB-CD2 4.3Å; A41-Y43 HydrophobicContact CB-CE2 3.7Å
42	R	91.9	Very high	79.7	Confident	244 Å²	244	119 Å²	119	92%	0.921	68%	0.684	S	S	*	*			trans	-101.9	92.4	176.1	-70.4	-173.9	179.5	178.3	0.7	110.4	V40	V40-R42 PolarHBondContact O-N 2.85Å
43	Y	95.1	Very high	82.3	Confident	199 Å²	199	119.6 Å²	119.6	78%	0.78	69%	0.687	S	S	*	*	P	Polyproline II helix	trans	-73.2	148.3	173.9	-66.2	-82.6	0	0	0	111.5	A41	A41-Y43 HydrophobicContact CB-CD2 4.3Å; A41-Y43 HydrophobicContact CB-CE2 3.7Å
44	P	96.2	Very high	84.6	Confident	106 Å²	106	115.9 Å²	115.9	69%	0.688	66%	0.664	S	S	*	*	P	Polyproline II helix	trans	-66.3	153.8	171.6	29.7	-34.9	0	0	0	110.8
45	P	95.8	Very high	86.8	Confident	104 Å²	104	115.9 Å²	115.9	68%	0.675	66%	0.662	S	S	*	*	P	Polyproline II helix	trans	-64.2	140.4	177	27	-34.2	0	0	0	111.1	V47	P45-V47 HydrophobicContact CB-CG1 4.46Å; P45-V47 HydrophobicContact CB-CG2 4.35Å; P45-V47 HydrophobicContact CG-CG2 4.18Å; P45-V47 WeakPolarHBondContact O-CG2 3.16Å; P45-V47 PolarHBondContact O-N 3.14Å
46	I	95.9	Very high	88.8	Confident	180 Å²	180	111.7 Å²	111.7	92%	0.923	64%	0.641	S	S	*	*			trans	-78.3	90.4	177.2	-57.1	172	0	0	0	108.6
47	V	95.9	Very high	90.8	Very high	81 Å²	81	105.5 Å²	105.5	49%	0.491	60%	0.604	S	S	.	*			trans	-138.9	141	-178.3	-71.6	0	0	0	0	111.4	P45 R60	P45-V47 HydrophobicContact CB-CG1 4.46Å; P45-V47 HydrophobicContact CB-CG2 4.35Å; P45-V47 HydrophobicContact CG-CG2 4.18Å; P45-V47 WeakPolarHBondContact O-CG2 3.16Å; P45-V47 PolarHBondContact O-N 3.14Å; V47-R60 VanDerWaalsContact CG2-CZ 3.5Å
48	A	95.8	Very high	92.3	Very high	41 Å²	41	106 Å²	106	34%	0.339	59%	0.587	S	S	.	*			trans	-63.3	153	178.8	0	0	0	0	0	112.3	A56 R60	A48-A56 HydrophobicContact CB-CB 3.64Å; A48-R60 WeakPolarHBondContact O-CD 3.44Å; A48-R60 PolarHBondContact O-NH1 3.38Å
49	S	96.3	Very high	93.5	Very high	64 Å²	64	104.2 Å²	104.2	45%	0.448	57%	0.573	S	S	.	*			trans	-63.5	156.7	179.4	64.7	0	0	0	0	113.4	A52 A57	S49-A52 WeakPolarHBondContact OG-CB 3.4Å; S49-A57 VanDerWaalsContact O-CA 3.29Å; S49-A57 WeakPolarHBondContact O-CA 3.22Å; S49-A57 WeakPolarHBondContact O-CB 3.31Å
50	M	94.6	Very high	94.3	Very high	60 Å²	60	101.6 Å²	101.6	30%	0.296	55%	0.546	S	S	.	.	S	Bend	trans	-90.4	-33.3	-176.4	-69.9	-176.1	65.8	0	0	114.3	R60 R61 R64	M50-R60 HydrophobicContact CG-CG 4.24Å; M50-R61 PolarHBondContact O-NH1 3.31Å; M50-R64 VanDerWaalsContact CE-CD 3.47Å
51	T	95.4	Very high	94.8	Very high	140 Å²	140	99.5 Å²	99.5	86%	0.859	52%	0.524	S	S	*	.	S	Bend	trans	-99.1	-12.6	-169.8	49.7	0	0	0	0	113.4
52	A	95.9	Very high	95	Very high	36 Å²	36	98.6 Å²	98.6	30%	0.298	51%	0.512	S	S	.	.	S	Bend	trans	-65.1	153.5	179.6	0	0	0	0	0	112.5	S49 S54 A57 R61	S49-A52 WeakPolarHBondContact OG-CB 3.4Å; A52-S54 VanDerWaalsContact C-N 3.33Å; A52-S54 PolarHBondContact O-N 3.42Å; A52-A57 HydrophobicContact CB-CB 4.15Å; A52-A57 WeakPolarHBondContact O-CB 2.98Å; A52-R61 PolarHBondContact O-NH1 3.45Å
53	D	95.3	Very high	95.2	Very high	165 Å²	165	92.6 Å²	92.6	88%	0.882	49%	0.494	S	S	*	.	S	Bend	trans	-87.2	73.6	170.2	-168.1	18.2	0	0	0	110.1
54	S	94.8	Very high	95.3	Very high	51 Å²	51	90.3 Å²	90.3	36%	0.357	48%	0.484	S	S	.	.	S	Bend	trans	-139.5	161	178.2	77.6	0	0	0	0	111.7	A52 A56 A57 R58	A52-S54 VanDerWaalsContact C-N 3.33Å; A52-S54 PolarHBondContact O-N 3.42Å; S54-A56 VanDerWaalsContact C-N 3.31Å; S54-A56 PolarHBondContact O-N 3.45Å; S54-A57 PolarHBondContact O-N 3.41Å; S54-A57 WeakPolarHBondContact OG-CB 3.36Å; S54-A57 PolarHBondContact OG-N 3.47Å; S54-A57 VanDerWaalsContact OG-N 3.11Å; S54-R58 PolarHBondContact O-N 3.01Å
55	K	93	Very high	95.3	Very high	173 Å²	173	90 Å²	90	75%	0.752	47%	0.47	S	S	*	.	H	α-helix	trans	-59.8	-42.2	175.4	-66.5	-177	-177.8	177.5	0	111.4	R58 L59	K55-R58 WeakPolarHBondContact O-CB 3.22Å; K55-R58 PolarHBondContact O-N 2.82Å; K55-L59 WeakPolarHBondContact O-CG 3.14Å; K55-L59 PolarHBondContact O-N 2.73Å
56	A	95	Very high	95.3	Very high	48 Å²	48	86.1 Å²	86.1	40%	0.397	44%	0.442	S	S	.	.	H	α-helix	trans	-64.6	-41.1	178.4	0	0	0	0	0	112.1	A48 S54 R58 L59 R60	A48-A56 HydrophobicContact CB-CB 3.64Å; S54-A56 VanDerWaalsContact C-N 3.31Å; S54-A56 PolarHBondContact O-N 3.45Å; A56-R58 VanDerWaalsContact C-N 3.33Å; A56-R58 PolarHBondContact O-N 2.81Å; A56-L59 PolarHBondContact O-N 2.85Å; A56-R60 PolarHBondContact O-N 3.04Å
57	A	95.2	Very high	95.3	Very high	0 Å²	0	80.2 Å²	80.2	0%	0	42%	0.421	C	S	.	.	H	α-helix	trans	-65.5	-36.4	174.6	0	0	0	0	0	112.2	S49 A52 S54 R60 R61	S49-A57 VanDerWaalsContact O-CA 3.29Å; S49-A57 WeakPolarHBondContact O-CA 3.22Å; S49-A57 WeakPolarHBondContact O-CB 3.31Å; A52-A57 HydrophobicContact CB-CB 4.15Å; A52-A57 WeakPolarHBondContact O-CB 2.98Å; S54-A57 PolarHBondContact O-N 3.41Å; S54-A57 WeakPolarHBondContact OG-CB 3.36Å; S54-A57 PolarHBondContact OG-N 3.47Å; S54-A57 VanDerWaalsContact OG-N 3.11Å; A57-R60 PolarHBondContact O-N 2.84Å; A57-R61 WeakPolarHBondContact O-CG 3.47Å; A57-R61 PolarHBondContact O-N 3.33Å
58	R	94	Very high	95.4	Very high	98 Å²	98	78.8 Å²	78.8	37%	0.37	42%	0.417	S	S	.	.	H	α-helix	trans	-60.2	-47.2	172	-170.9	-178.1	96.4	161.7	5.3	111.4	S54 K55 A56 R61 V62 I217	S54-R58 PolarHBondContact O-N 3.01Å; K55-R58 WeakPolarHBondContact O-CB 3.22Å; K55-R58 PolarHBondContact O-N 2.82Å; A56-R58 VanDerWaalsContact C-N 3.33Å; A56-R58 PolarHBondContact O-N 2.81Å; R58-R61 PolarHBondContact O-N 3.41Å; R58-V62 WeakPolarHBondContact O-CG2 3.41Å; R58-V62 PolarHBondContact O-N 2.84Å; R58-I217 PolarHBondContact NH1-O 3.19Å
59	L	93.6	Very high	95.4	Very high	76 Å²	76	76.8 Å²	76.8	40%	0.398	40%	0.401	S	S	.	.	H	α-helix	trans	-61.2	-44.3	177.8	-68.7	173.4	0	0	0	111.7	K55 A56 R61 V62 Q63	K55-L59 WeakPolarHBondContact O-CG 3.14Å; K55-L59 PolarHBondContact O-N 2.73Å; A56-L59 PolarHBondContact O-N 2.85Å; L59-R61 VanDerWaalsContact C-N 3.3Å; L59-R61 PolarHBondContact O-N 3.02Å; L59-V62 WeakPolarHBondContact O-CB 3.07Å; L59-V62 PolarHBondContact O-N 3.06Å; L59-V62 VanDerWaalsContact O-N 3.1Å; L59-Q63 WeakPolarHBondContact O-CG 3.45Å; L59-Q63 PolarHBondContact O-N 3.44Å
60	R	95.6	Very high	95.4	Very high	76 Å²	76	78.5 Å²	78.5	29%	0.287	40%	0.401	S	S	.	.	H	α-helix	trans	-62.3	-35.9	176.5	-170.3	171.3	-178.6	-175.5	1.2	112.6	V47 A48 M50 A56 A57 Q63 R64	V47-R60 VanDerWaalsContact CG2-CZ 3.5Å; A48-R60 WeakPolarHBondContact O-CD 3.44Å; A48-R60 PolarHBondContact O-NH1 3.38Å; M50-R60 HydrophobicContact CG-CG 4.24Å; A56-R60 PolarHBondContact O-N 3.04Å; A57-R60 PolarHBondContact O-N 2.84Å; R60-Q63 PolarHBondContact O-N 3.37Å; R60-R64 PolarHBondContact O-N 3.07Å
61	R	96	Very high	95.6	Very high	82 Å²	82	79.6 Å²	79.6	31%	0.309	42%	0.42	S	S	.	.	H	α-helix	trans	-66	-38.4	173.4	-72.8	-175.2	-65.3	-97.2	8	112.2	M50 A52 A57 R58 L59 W65	M50-R61 PolarHBondContact O-NH1 3.31Å; A52-R61 PolarHBondContact O-NH1 3.45Å; A57-R61 WeakPolarHBondContact O-CG 3.47Å; A57-R61 PolarHBondContact O-N 3.33Å; R58-R61 PolarHBondContact O-N 3.41Å; L59-R61 VanDerWaalsContact C-N 3.3Å; L59-R61 PolarHBondContact O-N 3.02Å; R61-W65 PolarHBondContact O-N 2.99Å; R61-W65 VanDerWaalsContact O-N 3.1Å
62	V	94.3	Very high	95.6	Very high	47 Å²	47	73.4 Å²	73.4	29%	0.285	38%	0.383	S	S	.	.	H	α-helix	trans	-63.2	-49.7	173.6	172.7	0	0	0	0	110.2	R58 L59 R64 W65 Q66	R58-V62 WeakPolarHBondContact O-CG2 3.41Å; R58-V62 PolarHBondContact O-N 2.84Å; L59-V62 WeakPolarHBondContact O-CB 3.07Å; L59-V62 PolarHBondContact O-N 3.06Å; L59-V62 VanDerWaalsContact O-N 3.1Å; V62-R64 VanDerWaalsContact C-N 3.32Å; V62-R64 PolarHBondContact O-N 3.08Å; V62-W65 WeakPolarHBondContact O-CA 3.37Å; V62-W65 WeakPolarHBondContact O-CB 3.48Å; V62-W65 PolarHBondContact O-N 3.45Å; V62-Q66 HydrophobicContact CG1-CG 4.2Å; V62-Q66 WeakPolarHBondContact O-CG 3.18Å; V62-Q66 PolarHBondContact O-N 3.39Å
63	Q	95.4	Very high	95.6	Very high	118 Å²	118	77 Å²	77	55%	0.551	40%	0.404	S	S	*	.	H	α-helix	trans	-56.7	-42.6	177	-72.2	172.5	-20.1	0	0	112.7	L59 R60 W65 Q66 A67	L59-Q63 WeakPolarHBondContact O-CG 3.45Å; L59-Q63 PolarHBondContact O-N 3.44Å; R60-Q63 PolarHBondContact O-N 3.37Å; Q63-W65 VanDerWaalsContact C-N 3.34Å; Q63-W65 PolarHBondContact O-N 3.02Å; Q63-Q66 PolarHBondContact O-N 2.95Å; Q63-A67 WeakPolarHBondContact O-CB 3.38Å; Q63-A67 PolarHBondContact O-N 3Å
64	R	96.4	Very high	95.7	Very high	150 Å²	150	71.1 Å²	71.1	57%	0.566	38%	0.375	S	S	*	.	H	α-helix	trans	-62.2	-42	174.9	-178.2	-179	65.4	170.9	2.8	112.2	M50 R60 V62 A67 A68	M50-R64 VanDerWaalsContact CE-CD 3.47Å; R60-R64 PolarHBondContact O-N 3.07Å; V62-R64 VanDerWaalsContact C-N 3.32Å; V62-R64 PolarHBondContact O-N 3.08Å; R64-A67 PolarHBondContact O-N 2.89Å; R64-A68 PolarHBondContact O-N 2.69Å
65	W	96.6	Very high	95.8	Very high	100 Å²	100	70.6 Å²	70.6	38%	0.379	37%	0.37	S	S	.	.	H	α-helix	trans	-66.3	-41.4	177.4	171.9	80.3	0	0	0	111.3	R61 V62 Q63 A67 A68 V69 I81 L82 W337	R61-W65 PolarHBondContact O-N 2.99Å; R61-W65 VanDerWaalsContact O-N 3.1Å; V62-W65 WeakPolarHBondContact O-CA 3.37Å; V62-W65 WeakPolarHBondContact O-CB 3.48Å; V62-W65 PolarHBondContact O-N 3.45Å; Q63-W65 VanDerWaalsContact C-N 3.34Å; Q63-W65 PolarHBondContact O-N 3.02Å; W65-A67 PolarHBondContact O-N 3.33Å; W65-A68 WeakPolarHBondContact O-CB 3.39Å; W65-A68 PolarHBondContact O-N 3.43Å; W65-V69 HydrophobicContact CD2-CG2 4.48Å; W65-V69 HydrophobicContact CZ2-CG2 4.18Å; W65-V69 WeakPolarHBondContact O-CG2 3.22Å; W65-V69 PolarHBondContact O-N 3.48Å; W65-V69 VanDerWaalsContact O-N 3.08Å; W65-I81 HydrophobicContact CZ2-CG2 4.27Å; W65-I81 VanDerWaalsContact NE1-CG2 3.35Å; W65-L82 HydrophobicContact CH2-CD2 3.53Å; W65-L82 HydrophobicContact CZ2-CD2 3.87Å; W65-W337 HydrophobicContact CZ3-CZ3 4.39Å
66	Q	96.1	Very high	96	Very high	22 Å²	22	66.7 Å²	66.7	10%	0.103	36%	0.357	C	S	.	.	H	α-helix	trans	-60.1	-44.6	173.3	-66.3	170.2	-40	0	0	111.1	V62 Q63 A68 V69 H70 W337 E339	V62-Q66 HydrophobicContact CG1-CG 4.2Å; V62-Q66 WeakPolarHBondContact O-CG 3.18Å; V62-Q66 PolarHBondContact O-N 3.39Å; Q63-Q66 PolarHBondContact O-N 2.95Å; Q66-A68 VanDerWaalsContact C-N 3.29Å; Q66-A68 PolarHBondContact O-N 3.49Å; Q66-V69 WeakPolarHBondContact O-CB 3.37Å; Q66-V69 PolarHBondContact O-N 2.9Å; Q66-V69 VanDerWaalsContact O-N 3.08Å; Q66-H70 PolarHBondContact O-CD2 3.4Å; Q66-H70 PolarHBondContact O-N 3.46Å; Q66-W337 HydrophobicContact CB-CH2 3.84Å; Q66-W337 HydrophobicContact CG-CH2 3.81Å; Q66-W337 HydrophobicContact CG-CZ3 4.37Å; Q66-E339 HydrophobicContact CG-CG 4.23Å; Q66-E339 PolarHBondContact NE2-OE1 2.85Å
67	A	96.6	Very high	96	Very high	57 Å²	57	68.8 Å²	68.8	47%	0.471	36%	0.359	S	S	.	.	H	α-helix	trans	-60.5	-37.2	175.5	0	0	0	0	0	112.5	Q63 R64 W65 V69 H70 A71	Q63-A67 WeakPolarHBondContact O-CB 3.38Å; Q63-A67 PolarHBondContact O-N 3Å; R64-A67 PolarHBondContact O-N 2.89Å; W65-A67 PolarHBondContact O-N 3.33Å; A67-V69 VanDerWaalsContact C-N 3.35Å; A67-H70 PolarHBondContact O-N 3.43Å; A67-A71 WeakPolarHBondContact O-CB 3.17Å; A67-A71 PolarHBondContact O-N 3.15Å
68	A	96.7	Very high	96.2	Very high	50 Å²	50	71 Å²	71	41%	0.413	37%	0.368	S	S	.	.	H	α-helix	trans	-65.8	-35.8	173.9	0	0	0	0	0	112.6	R64 W65 Q66 A71 A72	R64-A68 PolarHBondContact O-N 2.69Å; W65-A68 WeakPolarHBondContact O-CB 3.39Å; W65-A68 PolarHBondContact O-N 3.43Å; Q66-A68 VanDerWaalsContact C-N 3.29Å; Q66-A68 PolarHBondContact O-N 3.49Å; A68-A71 PolarHBondContact O-N 2.9Å; A68-A72 PolarHBondContact O-N 3.46Å
69	V	97	Very high	96.3	Very high	0 Å²	0	67.3 Å²	67.3	0%	0	36%	0.357	C	S	.	.	H	α-helix	trans	-66.9	-41.6	172.8	177.8	0	0	0	0	110.9	W65 Q66 A67 A71 A72 K78 I81 L82 W337	W65-V69 HydrophobicContact CD2-CG2 4.48Å; W65-V69 HydrophobicContact CZ2-CG2 4.18Å; W65-V69 WeakPolarHBondContact O-CG2 3.22Å; W65-V69 PolarHBondContact O-N 3.48Å; W65-V69 VanDerWaalsContact O-N 3.08Å; Q66-V69 WeakPolarHBondContact O-CB 3.37Å; Q66-V69 PolarHBondContact O-N 2.9Å; Q66-V69 VanDerWaalsContact O-N 3.08Å; A67-V69 VanDerWaalsContact C-N 3.35Å; V69-A71 VanDerWaalsContact C-N 3.32Å; V69-A71 PolarHBondContact O-N 3.37Å; V69-A72 WeakPolarHBondContact O-CB 3.46Å; V69-A72 PolarHBondContact O-N 3.17Å; V69-K78 HydrophobicContact CG1-CB 4.49Å; V69-K78 HydrophobicContact CG1-CG 4.31Å; V69-K78 WeakPolarHBondContact O-CE 3.41Å; V69-I81 HydrophobicContact CG2-CB 4.19Å; V69-I81 HydrophobicContact CG2-CG2 3.49Å; V69-I81 VanDerWaalsContact CG2-CG2 3.49Å; V69-L82 HydrophobicContact CG1-CD2 4.18Å; V69-L82 HydrophobicContact CG1-CG 4.27Å; V69-L82 HydrophobicContact CG2-CD2 4.14Å; V69-W337 HydrophobicContact CB-CH2 4.35Å; V69-W337 HydrophobicContact CB-CZ2 4.06Å; V69-W337 HydrophobicContact CG1-CD2 4.3Å; V69-W337 HydrophobicContact CG1-CH2 4.37Å; V69-W337 HydrophobicContact CG1-CZ2 3.86Å
70	H	96.6	Very high	96.5	Very high	99 Å²	99	71.3 Å²	71.3	46%	0.458	37%	0.367	S	S	.	.	H	α-helix	trans	-62.5	-38.8	175.7	-78.6	-72.1	0	0	0	112.7	Q66 A67 A72 W337	Q66-H70 PolarHBondContact O-CD2 3.4Å; Q66-H70 PolarHBondContact O-N 3.46Å; A67-H70 PolarHBondContact O-N 3.43Å; H70-A72 VanDerWaalsContact C-N 3.25Å; H70-A72 PolarHBondContact O-N 3.1Å; H70-W337 AromaticContact CD2-CZ2 3.83Å; H70-W337 AromaticContact CE1-CZ2 3.95Å; H70-W337 AromaticContact CE1-NE1 4Å; H70-W337 AromaticContact NE2-CZ2 3.5Å
71	A	97.3	Very high	96.5	Very high	84 Å²	84	69.9 Å²	69.9	69%	0.694	36%	0.364	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.8	-10	180	0	0	0	0	0	114.2	A67 A68 V69	A67-A71 WeakPolarHBondContact O-CB 3.17Å; A67-A71 PolarHBondContact O-N 3.15Å; A68-A71 PolarHBondContact O-N 2.9Å; V69-A71 VanDerWaalsContact C-N 3.32Å; V69-A71 PolarHBondContact O-N 3.37Å
72	A	97.1	Very high	96.6	Very high	9 Å²	9	67.2 Å²	67.2	7%	0.074	36%	0.356	C	S	.	.			trans	-68.2	127.1	-179.4	0	0	0	0	0	111.1	A68 V69 H70 E77 K78 I81	A68-A72 PolarHBondContact O-N 3.46Å; V69-A72 WeakPolarHBondContact O-CB 3.46Å; V69-A72 PolarHBondContact O-N 3.17Å; H70-A72 VanDerWaalsContact C-N 3.25Å; H70-A72 PolarHBondContact O-N 3.1Å; A72-E77 HydrophobicContact CB-CB 4.18Å; A72-K78 HydrophobicContact CB-CG 3.7Å; A72-K78 VanDerWaalsContact O-CE 3.24Å; A72-K78 WeakPolarHBondContact O-CE 3.26Å; A72-I81 HydrophobicContact CB-CD1 4.21Å
73	P	95.5	Very high	96.7	Very high	113 Å²	113	65.7 Å²	65.7	73%	0.734	35%	0.347	S	S	*	.	S	Bend	trans	-73.3	-31.5	-174.3	28.3	-36.3	0	0	0	113.5	E77	P73-E77 WeakPolarHBondContact CD-OE2 3.41Å
74	S	96.7	Very high	96.8	Very high	40 Å²	40	67.1 Å²	67.1	28%	0.28	35%	0.351	S	S	.	.	S	Bend	trans	-114.2	152.9	-175.2	70.4	0	0	0	0	112.4	D76 E77 K78	S74-D76 VanDerWaalsContact C-N 3.31Å; S74-E77 PolarHBondContact O-N 2.86Å; S74-E77 WeakPolarHBondContact OG-CB 3.49Å; S74-E77 WeakPolarHBondContact OG-CG 3.46Å; S74-E77 PolarHBondContact OG-N 3.39Å; S74-E77 PolarHBondContact OG-OE1 3.34Å; S74-K78 WeakPolarHBondContact O-CG 3.34Å; S74-K78 PolarHBondContact O-N 2.62Å; S74-K78 VanDerWaalsContact O-N 3.15Å
75	V	96.8	Very high	96.8	Very high	40 Å²	40	65 Å²	65	24%	0.242	35%	0.349	C	S	.	.	H	α-helix	trans	-64.6	-38.6	175.5	175.2	0	0	0	0	111	E77 K78 V79 T279 M332 Y333	V75-E77 VanDerWaalsContact C-N 3.32Å; V75-E77 PolarHBondContact O-N 3Å; V75-K78 WeakPolarHBondContact O-CB 3.33Å; V75-K78 PolarHBondContact O-N 3.28Å; V75-K78 VanDerWaalsContact O-N 3.15Å; V75-V79 HydrophobicContact CG1-CG2 4.19Å; V75-V79 WeakPolarHBondContact O-CG2 3.34Å; V75-V79 PolarHBondContact O-N 2.82Å; V75-T279 HydrophobicContact CG1-CG2 4.41Å; V75-M332 WeakPolarHBondContact CG1-O 3.46Å; V75-Y333 WeakPolarHBondContact CG1-O 3.49Å; V75-Y333 WeakPolarHBondContact CG2-O 3.35Å
76	D	96.8	Very high	96.8	Very high	91 Å²	91	64.4 Å²	64.4	49%	0.487	35%	0.351	S	S	.	.	H	α-helix	trans	-60.2	-42.3	178.2	-69.3	-25.8	0	0	0	111.9	S74 R80 T279	S74-D76 VanDerWaalsContact C-N 3.31Å; D76-R80 WeakPolarHBondContact O-CB 2.85Å; D76-R80 PolarHBondContact O-N 3.16Å; D76-T279 VanDerWaalsContact OD1-CB 3.26Å; D76-T279 WeakPolarHBondContact OD1-CB 3.26Å; D76-T279 VanDerWaalsContact OD1-CG2 3.26Å; D76-T279 WeakPolarHBondContact OD1-CG2 3.41Å; D76-T279 PolarHBondContact OD1-OG1 3.27Å; D76-T279 PolarHBondContact OD2-OG1 3.45Å
77	E	96.9	Very high	96.9	Very high	93 Å²	93	66.9 Å²	66.9	44%	0.435	36%	0.361	S	S	.	.	H	α-helix	trans	-65.3	-42.2	174.6	-75.8	172.4	-132.9	0	0	111.9	A72 P73 S74 V75 R80 I81	A72-E77 HydrophobicContact CB-CB 4.18Å; P73-E77 WeakPolarHBondContact CD-OE2 3.41Å; S74-E77 PolarHBondContact O-N 2.86Å; S74-E77 WeakPolarHBondContact OG-CB 3.49Å; S74-E77 WeakPolarHBondContact OG-CG 3.46Å; S74-E77 PolarHBondContact OG-N 3.39Å; S74-E77 PolarHBondContact OG-OE1 3.34Å; V75-E77 VanDerWaalsContact C-N 3.32Å; V75-E77 PolarHBondContact O-N 3Å; E77-R80 PolarHBondContact O-N 3.24Å; E77-I81 VanDerWaalsContact O-CG1 3.24Å; E77-I81 WeakPolarHBondContact O-CG1 3.47Å; E77-I81 PolarHBondContact O-N 2.92Å
78	K	97.5	Very high	96.9	Very high	45 Å²	45	71 Å²	71	20%	0.196	37%	0.369	C	S	.	.	H	α-helix	trans	-58.4	-53.1	175	-72	179.4	179.8	177.2	0	111.1	V69 A72 S74 V75 R80 I81 L82	V69-K78 HydrophobicContact CG1-CB 4.49Å; V69-K78 HydrophobicContact CG1-CG 4.31Å; V69-K78 WeakPolarHBondContact O-CE 3.41Å; A72-K78 HydrophobicContact CB-CG 3.7Å; A72-K78 VanDerWaalsContact O-CE 3.24Å; A72-K78 WeakPolarHBondContact O-CE 3.26Å; S74-K78 WeakPolarHBondContact O-CG 3.34Å; S74-K78 PolarHBondContact O-N 2.62Å; S74-K78 VanDerWaalsContact O-N 3.15Å; V75-K78 WeakPolarHBondContact O-CB 3.33Å; V75-K78 PolarHBondContact O-N 3.28Å; V75-K78 VanDerWaalsContact O-N 3.15Å; K78-R80 VanDerWaalsContact C-N 3.26Å; K78-R80 PolarHBondContact O-N 3.43Å; K78-I81 PolarHBondContact O-N 2.89Å; K78-L82 WeakPolarHBondContact O-CB 3.42Å; K78-L82 VanDerWaalsContact O-CG 3.27Å; K78-L82 WeakPolarHBondContact O-CG 3.42Å; K78-L82 PolarHBondContact O-N 2.98Å
79	V	96.7	Very high	97	Very high	22 Å²	22	68.7 Å²	68.7	13%	0.133	35%	0.349	C	S	.	.	H	α-helix	trans	-59	-41.9	178.3	173.7	0	0	0	0	110	V75 I81 L82 T83 I273	V75-V79 HydrophobicContact CG1-CG2 4.19Å; V75-V79 WeakPolarHBondContact O-CG2 3.34Å; V75-V79 PolarHBondContact O-N 2.82Å; V79-I81 PolarHBondContact O-N 2.93Å; V79-L82 PolarHBondContact O-N 3.17Å; V79-T83 HydrophobicContact CG1-CG2 4.13Å; V79-T83 WeakPolarHBondContact O-CB 3.34Å; V79-T83 WeakPolarHBondContact O-CG2 3.45Å; V79-T83 PolarHBondContact O-N 3.21Å; V79-T83 PolarHBondContact O-OG1 2.79Å; V79-I273 HydrophobicContact CG1-CB 4.4Å
80	R	97.3	Very high	97	Very high	159 Å²	159	68.8 Å²	68.8	60%	0.6	35%	0.349	S	S	*	.	H	α-helix	trans	-61.8	-43.8	177.7	-175.7	59.6	174	-177.9	-0.4	112.3	D76 E77 K78 K84	D76-R80 WeakPolarHBondContact O-CB 2.85Å; D76-R80 PolarHBondContact O-N 3.16Å; E77-R80 PolarHBondContact O-N 3.24Å; K78-R80 VanDerWaalsContact C-N 3.26Å; K78-R80 PolarHBondContact O-N 3.43Å; R80-K84 VanDerWaalsContact O-CB 3.3Å; R80-K84 WeakPolarHBondContact O-CB 3.4Å; R80-K84 PolarHBondContact O-N 3.22Å
81	I	97.4	Very high	97.1	Very high	47 Å²	47	65 Å²	65	24%	0.241	33%	0.332	C	S	.	.	H	α-helix	trans	-66.2	-44.2	178.7	-65.1	162.5	0	0	0	110.7	W65 V69 A72 E77 K78 V79	W65-I81 HydrophobicContact CZ2-CG2 4.27Å; W65-I81 VanDerWaalsContact NE1-CG2 3.35Å; V69-I81 HydrophobicContact CG2-CB 4.19Å; V69-I81 HydrophobicContact CG2-CG2 3.49Å; V69-I81 VanDerWaalsContact CG2-CG2 3.49Å; A72-I81 HydrophobicContact CB-CD1 4.21Å; E77-I81 VanDerWaalsContact O-CG1 3.24Å; E77-I81 WeakPolarHBondContact O-CG1 3.47Å; E77-I81 PolarHBondContact O-N 2.92Å; K78-I81 PolarHBondContact O-N 2.89Å; V79-I81 PolarHBondContact O-N 2.93Å
82	L	96.8	Very high	97.1	Very high	25 Å²	25	61.2 Å²	61.2	13%	0.131	30%	0.3	C	S	.	.	H	α-helix	trans	-65.7	-37.7	-179.3	-68.2	173.9	0	0	0	112.6	W65 V69 K78 V79 M332 W337	W65-L82 HydrophobicContact CH2-CD2 3.53Å; W65-L82 HydrophobicContact CZ2-CD2 3.87Å; V69-L82 HydrophobicContact CG1-CD2 4.18Å; V69-L82 HydrophobicContact CG1-CG 4.27Å; V69-L82 HydrophobicContact CG2-CD2 4.14Å; K78-L82 WeakPolarHBondContact O-CB 3.42Å; K78-L82 VanDerWaalsContact O-CG 3.27Å; K78-L82 WeakPolarHBondContact O-CG 3.42Å; K78-L82 PolarHBondContact O-N 2.98Å; V79-L82 PolarHBondContact O-N 3.17Å; L82-M332 HydrophobicContact CD1-CE 3.75Å; L82-W337 HydrophobicContact CD1-CB 4.01Å; L82-W337 HydrophobicContact CD1-CG 4.32Å; L82-W337 HydrophobicContact CD2-CD2 4.42Å; L82-W337 HydrophobicContact CD2-CE3 3.86Å; L82-W337 HydrophobicContact CD2-CZ3 4.17Å
83	T	97.1	Very high	97.2	Very high	16 Å²	16	65.7 Å²	65.7	10%	0.098	32%	0.316	C	S	.	.	H	α-helix	trans	-91.6	-11.6	-176.2	58	0	0	0	0	114.1	V79 M85 N271 I273	V79-T83 HydrophobicContact CG1-CG2 4.13Å; V79-T83 WeakPolarHBondContact O-CB 3.34Å; V79-T83 WeakPolarHBondContact O-CG2 3.45Å; V79-T83 PolarHBondContact O-N 3.21Å; V79-T83 PolarHBondContact O-OG1 2.79Å; T83-M85 VanDerWaalsContact C-N 3.34Å; T83-M85 PolarHBondContact O-N 2.92Å; T83-N271 WeakPolarHBondContact CB-O 3.28Å; T83-N271 HydrophobicContact CG2-CB 4.01Å; T83-N271 PolarHBondContact O-ND2 3.49Å; T83-I273 HydrophobicContact CG2-CD1 3.85Å; T83-I273 HydrophobicContact CG2-CG1 3.93Å
84	K	96.9	Very high	97.2	Very high	148 Å²	148	60.6 Å²	60.6	64%	0.643	28%	0.283	S	S	*	.	S	Bend	trans	-54.1	-43.1	-174.9	-173.2	174.5	-178.7	176.8	0	114.4	R80 Q86	R80-K84 VanDerWaalsContact O-CB 3.3Å; R80-K84 WeakPolarHBondContact O-CB 3.4Å; R80-K84 PolarHBondContact O-N 3.22Å; K84-Q86 PolarHBondContact O-N 3.12Å
85	M	96.4	Very high	97.2	Very high	105 Å²	105	61.8 Å²	61.8	52%	0.517	28%	0.284	S	S	.	.			trans	-87.2	111.4	-170.7	-62	-59.3	-65.9	0	0	111.2	T83 F87 N271	T83-M85 VanDerWaalsContact C-N 3.34Å; T83-M85 PolarHBondContact O-N 2.92Å; M85-F87 HydrophobicContact CB-CD2 4.21Å; M85-F87 HydrophobicContact CB-CE2 3.76Å; M85-F87 HydrophobicContact CE-CE2 4.17Å; M85-F87 HydrophobicContact CE-CZ 3.97Å; M85-N271 PolarHBondContact O-ND2 3.06Å
86	Q	97.1	Very high	97.2	Very high	88 Å²	88	60.5 Å²	60.5	41%	0.411	28%	0.276	S	S	.	.			trans	-92.1	118.3	179	-62.2	-179.8	7.1	0	0	110.8	K84 Q268	K84-Q86 PolarHBondContact O-N 3.12Å; Q86-Q268 HydrophobicContact CB-CG 4.26Å; Q86-Q268 PolarHBondContact O-NE2 3Å
87	F	96.8	Very high	97	Very high	74 Å²	74	63.5 Å²	63.5	33%	0.325	29%	0.285	S	S	.	.			trans	-130.8	171.2	173.9	-67.1	-71.7	0	0	0	109.5	M85 K89	M85-F87 HydrophobicContact CB-CD2 4.21Å; M85-F87 HydrophobicContact CB-CE2 3.76Å; M85-F87 HydrophobicContact CE-CE2 4.17Å; M85-F87 HydrophobicContact CE-CZ 3.97Å; F87-K89 PolarHBondContact O-N 2.97Å
88	K	97.5	Very high	96.9	Very high	144 Å²	144	59.3 Å²	59.3	63%	0.626	27%	0.267	S	S	*	.			trans	-57.7	127	169.6	-70.2	-169.2	179.2	-173.4	0	110.2	K266 R267	K88-K266 HydrophobicContact CB-CB 4.31Å; K88-R267 WeakPolarHBondContact CA-O 3.32Å
89	K	97.9	Very high	96.8	Very high	1 Å²	1	61.5 Å²	61.5	0%	0.004	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.8	147	179.8	61.9	-170.2	-175.6	176.6	0	110.3	F87 Y200 R221 Q223 K266 R267 Y269 E270 N271	F87-K89 PolarHBondContact O-N 2.97Å; K89-Y200 HydrophobicContact CD-CD2 4.17Å; K89-Y200 HydrophobicContact CD-CE2 4.13Å; K89-R221 CarbonylContact C-O 3.55Å; K89-R221 VanDerWaalsContact CA-O 3.3Å; K89-R221 WeakPolarHBondContact CA-O 3.39Å; K89-R221 HydrophobicContact CB-CB 3.65Å; K89-Q223 HydrophobicContact CD-CB 3.89Å; K89-Q223 HydrophobicContact CG-CB 4.38Å; K89-K266 CarbonylContact O-C 3.48Å; K89-K266 VanDerWaalsContact O-CA 3.24Å; K89-K266 WeakPolarHBondContact O-CA 3.34Å; K89-R267 WeakPolarHBondContact CG-O 2.96Å; K89-R267 PolarHBondContact N-O 3.31Å; K89-R267 PolarHBondContact O-N 2.9Å; K89-R267 VanDerWaalsContact O-O 3.1Å; K89-Y269 VanDerWaalsContact CE-CZ 3.49Å; K89-E270 PolarHBondContact NZ-O 3.46Å; K89-N271 WeakPolarHBondContact CD-OD1 3.42Å; K89-N271 WeakPolarHBondContact CE-OD1 3.3Å; K89-N271 PolarHBondContact NZ-OD1 2.93Å
90	Y	98.3	Very high	96.8	Very high	2 Å²	2	63.7 Å²	63.7	1%	0.008	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.6	136.4	174.3	-72.4	-76.1	0	0	0	110.6	L220 R221 Y222 Q223 P259 D260 L264 K266	Y90-L220 HydrophobicContact CE2-CD2 4.09Å; Y90-R221 PolarHBondContact N-O 2.84Å; Y90-Y222 HydrophobicContact CD2-CD1 4.03Å; Y90-Y222 AromaticContact CD2-CE1 3.55Å; Y90-Y222 HydrophobicContact CD2-CE1 3.55Å; Y90-Y222 AromaticContact CD2-CZ 3.9Å; Y90-Y222 HydrophobicContact CE2-CE1 4.3Å; Y90-Y222 HydrophobicContact CG-CD1 4.22Å; Y90-Y222 AromaticContact CG-CE1 3.99Å; Y90-Y222 HydrophobicContact CG-CE1 3.99Å; Y90-Q223 PolarHBondContact O-N 3.23Å; Y90-P259 HydrophobicContact CE1-CB 3.91Å; Y90-P259 HydrophobicContact CE2-CB 4.01Å; Y90-P259 HydrophobicContact CE2-CG 4.1Å; Y90-D260 WeakPolarHBondContact CE1-OD1 3.47Å; Y90-D260 PolarHBondContact OH-OD1 2.93Å; Y90-D260 VanDerWaalsContact OH-OD1 3.06Å; Y90-L264 HydrophobicContact CD1-CD2 3.71Å; Y90-L264 HydrophobicContact CD1-CG 3.9Å; Y90-L264 HydrophobicContact CE1-CD2 4.41Å; Y90-L264 HydrophobicContact CG-CD2 3.94Å; Y90-L264 HydrophobicContact CG-CG 4.41Å; Y90-K266 HydrophobicContact CD1-CG 3.71Å; Y90-K266 HydrophobicContact CD2-CG 4.44Å; Y90-K266 HydrophobicContact CE1-CD 4.25Å; Y90-K266 VanDerWaalsContact CE1-CE 3.47Å; Y90-K266 HydrophobicContact CE1-CG 3.66Å; Y90-K266 VanDerWaalsContact CE2-CE 3.45Å; Y90-K266 HydrophobicContact CE2-CG 4.41Å; Y90-K266 HydrophobicContact CG-CG 4.13Å; Y90-K266 WeakPolarHBondContact OH-CE 3.32Å; Y90-K266 PolarHBondContact OH-NZ 3.29Å
91	M	98.1	Very high	96.7	Very high	19 Å²	19	56.2 Å²	56.2	9%	0.094	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.5	103.9	172.1	-68.9	-173.4	67.3	0	0	110.1	Y93 L264 F265 R267 Y269	M91-Y93 HydrophobicContact CB-CE2 3.87Å; M91-Y93 HydrophobicContact CE-CE1 3.94Å; M91-Y93 WeakPolarHBondContact CE-OH 3.37Å; M91-Y93 WeakPolarHBondContact O-CD2 3.47Å; M91-Y93 WeakPolarHBondContact O-CE2 3.34Å; M91-L264 WeakPolarHBondContact O-CD1 3.31Å; M91-F265 PolarHBondContact N-O 3.4Å; M91-F265 VanDerWaalsContact N-O 3.1Å; M91-R267 HydrophobicContact CG-CB 4.26Å; M91-R267 HydrophobicContact SD-CB 3.83Å; M91-R267 WeakPolarHBondContact SD-CD 3.22Å; M91-R267 HydrophobicContact SD-CG 3.93Å; M91-Y269 HydrophobicContact CE-CE1 4.25Å; M91-Y269 HydrophobicContact CG-CE1 3.92Å; M91-Y269 HydrophobicContact SD-CE1 3.78Å
92	V	98.2	Very high	96.7	Very high	5 Å²	5	54.2 Å²	54.2	3%	0.03	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.2	116	177.6	-178.7	0	0	0	0	108.2	Y105 W201 Y222 Q223 I224 L264	V92-Y105 HydrophobicContact CG1-CD1 4.24Å; V92-Y105 HydrophobicContact CG1-CD2 4.45Å; V92-Y105 HydrophobicContact CG1-CE1 3.7Å; V92-Y105 HydrophobicContact CG1-CE2 3.93Å; V92-W201 HydrophobicContact CB-CH2 4.47Å; V92-W201 HydrophobicContact CG2-CH2 4.16Å; V92-Y222 HydrophobicContact CG2-CD1 3.76Å; V92-Y222 HydrophobicContact CG2-CG 4.48Å; V92-Q223 PolarHBondContact N-O 3.12Å; V92-I224 HydrophobicContact CB-CD1 4.49Å; V92-I224 HydrophobicContact CB-CG1 3.65Å; V92-I224 HydrophobicContact CG1-CD1 4.22Å; V92-I224 HydrophobicContact CG1-CG1 3.82Å; V92-L264 HydrophobicContact CG2-CD1 4.32Å
93	Y	97.8	Very high	96.7	Very high	103 Å²	103	60 Å²	60	40%	0.404	27%	0.273	S	S	.	.			trans	-98.2	116.4	179.4	-62.6	-79.7	0	0	0	109.4	M91 Q95 T96 Y105	M91-Y93 HydrophobicContact CB-CE2 3.87Å; M91-Y93 HydrophobicContact CE-CE1 3.94Å; M91-Y93 WeakPolarHBondContact CE-OH 3.37Å; M91-Y93 WeakPolarHBondContact O-CD2 3.47Å; M91-Y93 WeakPolarHBondContact O-CE2 3.34Å; Y93-Q95 VanDerWaalsContact C-N 3.35Å; Y93-Q95 PolarHBondContact O-N 3.45Å; Y93-T96 WeakPolarHBondContact O-CB 3.37Å; Y93-Y105 PolarHBondContact N-OH 2.87Å; Y93-Y105 PolarHBondContact O-OH 2.74Å
94	P	97.3	Very high	96.7	Very high	5 Å²	5	60.7 Å²	60.7	3%	0.032	27%	0.273	C	S	.	.	S	Bend	trans	-56.4	-49.1	176.5	-27.4	36.7	0	0	0	112	T96 I224 D226 N318 A321 S322	P94-T96 PolarHBondContact O-N 3.09Å; P94-I224 HydrophobicContact CG-CG2 3.73Å; P94-D226 HydrophobicContact CG-CB 3.9Å; P94-N318 WeakPolarHBondContact CB-OD1 3.33Å; P94-N318 VanDerWaalsContact O-CA 3.32Å; P94-N318 WeakPolarHBondContact O-CA 3.23Å; P94-A321 HydrophobicContact CB-CB 3.89Å; P94-A321 HydrophobicContact CG-CB 3.87Å; P94-S322 WeakPolarHBondContact CB-OG 3.27Å
95	Q	95.9	Very high	96.8	Very high	66 Å²	66	53.8 Å²	53.8	31%	0.308	24%	0.243	S	C	.	.	S	Bend	trans	-84.5	74.7	175.7	-58.5	-177.9	-7.1	0	0	111.2	Y93 L292 P294 L297 N318	Y93-Q95 VanDerWaalsContact C-N 3.35Å; Y93-Q95 PolarHBondContact O-N 3.45Å; Q95-L292 PolarHBondContact NE2-O 3.37Å; Q95-P294 VanDerWaalsContact OE1-CD 3.29Å; Q95-L297 HydrophobicContact CB-CD1 3.98Å; Q95-N318 WeakPolarHBondContact CG-OD1 3.22Å
96	T	95.7	Very high	96.9	Very high	12 Å²	12	49.6 Å²	49.6	7%	0.074	22%	0.222	C	C	.	.			trans	-102.1	149.7	-178.2	-173.7	0	0	0	0	113	Y93 P94 A98 A101 Y105	Y93-T96 WeakPolarHBondContact O-CB 3.37Å; P94-T96 PolarHBondContact O-N 3.09Å; T96-A98 HydrophobicContact CG2-CB 4.4Å; T96-A98 WeakPolarHBondContact OG1-CB 3.46Å; T96-A98 PolarHBondContact OG1-N 2.83Å; T96-A101 HydrophobicContact CG2-CB 3.56Å; T96-Y105 HydrophobicContact CG2-CE2 4.36Å
97	F	94	Very high	96.8	Very high	155 Å²	155	46.3 Å²	46.3	68%	0.68	21%	0.212	S	C	*	.			trans	-93	2.5	171.5	60.2	-95.3	0	0	0	112.7	P263 L297	F97-P263 HydrophobicContact CE2-CB 4.23Å; F97-P263 HydrophobicContact CE2-CG 4.01Å; F97-P263 HydrophobicContact CZ-CB 4.31Å; F97-P263 HydrophobicContact CZ-CG 4.41Å; F97-L297 HydrophobicContact CB-CD2 3.84Å
98	A	95.3	Very high	96.9	Very high	5 Å²	5	43.4 Å²	43.4	4%	0.041	20%	0.2	C	C	.	.			trans	-71.3	135.5	-175.6	0	0	0	0	0	111.8	T96 A101 L262 P263	T96-A98 HydrophobicContact CG2-CB 4.4Å; T96-A98 WeakPolarHBondContact OG1-CB 3.46Å; T96-A98 PolarHBondContact OG1-N 2.83Å; A98-A101 HydrophobicContact CB-CB 4.19Å; A98-A101 WeakPolarHBondContact O-CB 3.36Å; A98-L262 HydrophobicContact CB-CD1 3.55Å; A98-L262 HydrophobicContact CB-CG 4.03Å; A98-P263 HydrophobicContact CB-CG 3.56Å
99	L	94.9	Very high	96.9	Very high	90 Å²	90	36.7 Å²	36.7	47%	0.471	17%	0.171	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66.6	135.7	179.9	-56.2	177.2	0	0	0	111.2	A101 Q310	L99-A101 PolarHBondContact O-N 3.01Å; L99-A101 VanDerWaalsContact O-N 3.15Å; L99-Q310 HydrophobicContact CD2-CG 3.69Å
100	N	95.6	Very high	96.8	Very high	69 Å²	69	37.1 Å²	37.1	37%	0.369	17%	0.173	S	C	.	.	T	Hydrogen-bonded Turn	trans	54.6	30.5	177.2	-57.6	-35.3	0	0	0	113.6	D102 R103 Q310	N100-D102 VanDerWaalsContact C-OD1 3.26Å; N100-D102 PolarHBondContact O-N 3.28Å; N100-R103 PolarHBondContact O-N 3.46Å; N100-Q310 PolarHBondContact OD1-NE2 3.17Å
101	A	96.6	Very high	96.8	Very high	1 Å²	1	37 Å²	37	1%	0.008	17%	0.172	C	C	.	.	H	α-helix	trans	-62.1	-27	-177.6	0	0	0	0	0	113.3	T96 A98 L99 R103 W104 Y105 A317	T96-A101 HydrophobicContact CG2-CB 3.56Å; A98-A101 HydrophobicContact CB-CB 4.19Å; A98-A101 WeakPolarHBondContact O-CB 3.36Å; L99-A101 PolarHBondContact O-N 3.01Å; L99-A101 VanDerWaalsContact O-N 3.15Å; A101-R103 VanDerWaalsContact C-N 3.3Å; A101-R103 PolarHBondContact O-N 3.23Å; A101-W104 WeakPolarHBondContact O-CB 3.39Å; A101-W104 PolarHBondContact O-N 2.9Å; A101-W104 VanDerWaalsContact O-N 3.13Å; A101-Y105 WeakPolarHBondContact O-CD1 3.38Å; A101-Y105 PolarHBondContact O-N 3.38Å; A101-A317 HydrophobicContact CB-CB 4.04Å
102	D	96.5	Very high	96.8	Very high	5 Å²	5	36.2 Å²	36.2	3%	0.027	17%	0.168	C	C	.	.	H	α-helix	trans	-55	-42.7	176.2	64.8	-31.7	0	0	0	112.3	N100 Y105 Q106 V313 R316 A317 L320	N100-D102 VanDerWaalsContact C-OD1 3.26Å; N100-D102 PolarHBondContact O-N 3.28Å; D102-Y105 PolarHBondContact O-N 3.46Å; D102-Q106 VanDerWaalsContact O-CG 3.32Å; D102-Q106 WeakPolarHBondContact O-CG 3.48Å; D102-Q106 PolarHBondContact O-N 3.44Å; D102-Q106 PolarHBondContact O-NE2 3.4Å; D102-V313 HydrophobicContact CB-CG1 4.16Å; D102-V313 WeakPolarHBondContact OD1-CG1 3.18Å; D102-R316 HydrophobicContact CB-CB 4.15Å; D102-R316 IonicContact OD2-CZ 3.24Å; D102-R316 VanDerWaalsContact OD2-CZ 3.26Å; D102-R316 IonicContact OD2-NE 4Å; D102-R316 IonicContact OD2-NH1 2.88Å; D102-R316 IonicContact OD2-NH2 2.7Å; D102-R316 PolarHBondContact OD2-NH2 3.36Å; D102-A317 HydrophobicContact CB-CB 4.32Å; D102-L320 HydrophobicContact CB-CD1 4.32Å
103	R	96.8	Very high	96.7	Very high	147 Å²	147	37.6 Å²	37.6	56%	0.555	17%	0.174	S	C	*	.	H	α-helix	trans	-67.5	-38.6	177.3	-65.8	-176.7	179	-174.1	-0.3	112.3	N100 A101 G107 P253 M255	N100-R103 PolarHBondContact O-N 3.46Å; A101-R103 VanDerWaalsContact C-N 3.3Å; A101-R103 PolarHBondContact O-N 3.23Å; R103-G107 PolarHBondContact O-N 3.35Å; R103-P253 HydrophobicContact CB-CB 4.16Å; R103-P253 HydrophobicContact CB-CG 4.33Å; R103-P253 HydrophobicContact CG-CG 4.45Å; R103-M255 HydrophobicContact CB-CE 4.16Å
104	W	97.7	Very high	96.6	Very high	30 Å²	30	34.9 Å²	34.9	11%	0.114	17%	0.166	C	C	.	.	H	α-helix	trans	-65.5	-43.5	176	-71.7	84.9	0	0	0	111	A101 G107 F108 M255 C257 K261 L262	A101-W104 WeakPolarHBondContact O-CB 3.39Å; A101-W104 PolarHBondContact O-N 2.9Å; A101-W104 VanDerWaalsContact O-N 3.13Å; W104-G107 PolarHBondContact O-N 2.92Å; W104-G107 VanDerWaalsContact O-N 3.13Å; W104-F108 HydrophobicContact CB-CE2 4.06Å; W104-F108 HydrophobicContact CB-CZ 4.19Å; W104-F108 HydrophobicContact CE3-CE1 4.11Å; W104-F108 AromaticContact CE3-CZ 3.68Å; W104-F108 HydrophobicContact CE3-CZ 3.68Å; W104-F108 HydrophobicContact CZ3-CZ 4.47Å; W104-F108 WeakPolarHBondContact O-CD2 3.27Å; W104-F108 VanDerWaalsContact O-CG 3.26Å; W104-F108 WeakPolarHBondContact O-CG 3.19Å; W104-F108 PolarHBondContact O-N 2.89Å; W104-M255 HydrophobicContact CD2-CG 3.82Å; W104-M255 HydrophobicContact CD2-SD 3.9Å; W104-M255 HydrophobicContact CE3-CB 4.22Å; W104-M255 HydrophobicContact CE3-CG 3.61Å; W104-M255 HydrophobicContact CE3-SD 4.3Å; W104-M255 HydrophobicContact CG-CG 4.43Å; W104-M255 HydrophobicContact CG-SD 4.22Å; W104-M255 HydrophobicContact CH2-CB 4.31Å; W104-M255 HydrophobicContact CH2-CG 4.35Å; W104-M255 HydrophobicContact CZ2-SD 4.31Å; W104-M255 HydrophobicContact CZ3-CB 3.96Å; W104-M255 HydrophobicContact CZ3-CG 3.87Å; W104-C257 WeakPolarHBondContact CH2-SG 3.3Å; W104-K261 HydrophobicContact CH2-CB 4.47Å; W104-L262 HydrophobicContact CB-CD2 4.08Å; W104-L262 HydrophobicContact CD2-CB 4.45Å; W104-L262 HydrophobicContact CD2-CD1 4.38Å; W104-L262 HydrophobicContact CD2-CD2 4.35Å; W104-L262 HydrophobicContact CG-CD1 4.17Å; W104-L262 HydrophobicContact CG-CD2 4.1Å
105	Y	98.3	Very high	96.6	Very high	3 Å²	3	39.1 Å²	39.1	1%	0.012	20%	0.195	C	C	.	.	H	α-helix	trans	-68.5	-38.5	-178	-71.8	9.3	0	0	0	111.2	V92 Y93 T96 A101 D102 G107 F108 T109 L262 A317 A321	V92-Y105 HydrophobicContact CG1-CD1 4.24Å; V92-Y105 HydrophobicContact CG1-CD2 4.45Å; V92-Y105 HydrophobicContact CG1-CE1 3.7Å; V92-Y105 HydrophobicContact CG1-CE2 3.93Å; Y93-Y105 PolarHBondContact N-OH 2.87Å; Y93-Y105 PolarHBondContact O-OH 2.74Å; T96-Y105 HydrophobicContact CG2-CE2 4.36Å; A101-Y105 WeakPolarHBondContact O-CD1 3.38Å; A101-Y105 PolarHBondContact O-N 3.38Å; D102-Y105 PolarHBondContact O-N 3.46Å; Y105-G107 VanDerWaalsContact C-N 3.27Å; Y105-G107 PolarHBondContact O-N 2.95Å; Y105-F108 AromaticContact CD1-CD2 3.8Å; Y105-F108 HydrophobicContact CD1-CD2 3.8Å; Y105-F108 HydrophobicContact CD1-CE2 4.02Å; Y105-F108 HydrophobicContact CE1-CD2 4.34Å; Y105-F108 HydrophobicContact CE1-CE2 4.27Å; Y105-F108 PolarHBondContact O-N 3.38Å; Y105-F108 VanDerWaalsContact O-N 3.16Å; Y105-T109 WeakPolarHBondContact O-CG2 3.26Å; Y105-T109 PolarHBondContact O-N 3.4Å; Y105-T109 PolarHBondContact O-OG1 3.01Å; Y105-L262 HydrophobicContact CE1-CD2 4.23Å; Y105-A317 HydrophobicContact CD2-CB 4.05Å; Y105-A317 WeakPolarHBondContact CD2-O 3.49Å; Y105-A317 HydrophobicContact CE2-CB 4.21Å; Y105-A321 HydrophobicContact CD2-CB 3.79Å; Y105-A321 HydrophobicContact CE2-CB 3.84Å
106	Q	97.9	Very high	96.5	Very high	17 Å²	17	37.2 Å²	37.2	8%	0.079	19%	0.194	C	C	.	.	H	α-helix	trans	-53.7	-43	169	-77.1	176.4	72.2	0	0	112.3	D102 K110 T111 I252 P253 L320	D102-Q106 VanDerWaalsContact O-CG 3.32Å; D102-Q106 WeakPolarHBondContact O-CG 3.48Å; D102-Q106 PolarHBondContact O-N 3.44Å; D102-Q106 PolarHBondContact O-NE2 3.4Å; Q106-K110 WeakPolarHBondContact O-CA 3.19Å; Q106-K110 PolarHBondContact O-N 2.98Å; Q106-T111 VanDerWaalsContact CB-O 3.26Å; Q106-T111 WeakPolarHBondContact CB-O 3.28Å; Q106-T111 WeakPolarHBondContact CG-O 3.13Å; Q106-T111 PolarHBondContact O-N 3.02Å; Q106-I252 WeakPolarHBondContact O-CG2 3.29Å; Q106-P253 HydrophobicContact CB-CG 4.34Å; Q106-L320 HydrophobicContact CG-CD1 3.95Å; Q106-L320 HydrophobicContact CG-CD2 4.42Å
107	G	96.6	Very high	96.4	Very high	19 Å²	19	39.9 Å²	39.9	20%	0.196	21%	0.207	C	C	.	.	H	α-helix	trans	-67.5	-40	175.7	0	0	0	0	0	113.9	R103 W104 Y105 T109 R203	R103-G107 PolarHBondContact O-N 3.35Å; W104-G107 PolarHBondContact O-N 2.92Å; W104-G107 VanDerWaalsContact O-N 3.13Å; Y105-G107 VanDerWaalsContact C-N 3.27Å; Y105-G107 PolarHBondContact O-N 2.95Å; G107-T109 VanDerWaalsContact C-N 3.34Å; G107-T109 PolarHBondContact O-N 3.29Å; G107-R203 PolarHBondContact O-NE 3.48Å
108	F	97.3	Very high	96.3	Very high	14 Å²	14	33.3 Å²	33.3	6%	0.061	18%	0.18	C	C	.	.	H	α-helix	trans	-69.5	-29.6	179.5	-60.4	-25.8	0	0	0	113.5	W104 Y105 W201 R203 Y222 P259 L262 L264	W104-F108 HydrophobicContact CB-CE2 4.06Å; W104-F108 HydrophobicContact CB-CZ 4.19Å; W104-F108 HydrophobicContact CE3-CE1 4.11Å; W104-F108 AromaticContact CE3-CZ 3.68Å; W104-F108 HydrophobicContact CE3-CZ 3.68Å; W104-F108 HydrophobicContact CZ3-CZ 4.47Å; W104-F108 WeakPolarHBondContact O-CD2 3.27Å; W104-F108 VanDerWaalsContact O-CG 3.26Å; W104-F108 WeakPolarHBondContact O-CG 3.19Å; W104-F108 PolarHBondContact O-N 2.89Å; Y105-F108 AromaticContact CD1-CD2 3.8Å; Y105-F108 HydrophobicContact CD1-CD2 3.8Å; Y105-F108 HydrophobicContact CD1-CE2 4.02Å; Y105-F108 HydrophobicContact CE1-CD2 4.34Å; Y105-F108 HydrophobicContact CE1-CE2 4.27Å; Y105-F108 PolarHBondContact O-N 3.38Å; Y105-F108 VanDerWaalsContact O-N 3.16Å; F108-W201 PolarHBondContact O-NE1 2.89Å; F108-W201 VanDerWaalsContact O-NE1 3.15Å; F108-R203 WeakPolarHBondContact O-CG 3.34Å; F108-Y222 HydrophobicContact CD1-CE1 4.01Å; F108-Y222 HydrophobicContact CD2-CE1 4.33Å; F108-Y222 HydrophobicContact CE1-CE1 4.17Å; F108-Y222 HydrophobicContact CE2-CE1 4.47Å; F108-Y222 HydrophobicContact CG-CE1 4.1Å; F108-Y222 HydrophobicContact CZ-CE1 4.4Å; F108-P259 HydrophobicContact CE1-CB 4.07Å; F108-P259 HydrophobicContact CE1-CG 3.93Å; F108-P259 HydrophobicContact CZ-CB 3.86Å; F108-P259 HydrophobicContact CZ-CG 4.25Å; F108-L262 HydrophobicContact CE2-CD2 4.4Å; F108-L264 HydrophobicContact CE2-CD2 3.88Å; F108-L264 HydrophobicContact CZ-CD2 4.07Å
109	T	97.6	Very high	95.8	Very high	3 Å²	3	37.1 Å²	37.1	2%	0.018	20%	0.204	C	C	.	.	H	α-helix	trans	-109.1	1.1	-175.2	64.5	0	0	0	0	113.6	Y105 G107 T111 W201 F324 N382	Y105-T109 WeakPolarHBondContact O-CG2 3.26Å; Y105-T109 PolarHBondContact O-N 3.4Å; Y105-T109 PolarHBondContact O-OG1 3.01Å; G107-T109 VanDerWaalsContact C-N 3.34Å; G107-T109 PolarHBondContact O-N 3.29Å; T109-T111 VanDerWaalsContact C-N 3.29Å; T109-T111 PolarHBondContact O-N 3.2Å; T109-T111 PolarHBondContact O-OG1 3.37Å; T109-T111 WeakPolarHBondContact OG1-CB 3.49Å; T109-T111 PolarHBondContact OG1-OG1 3.36Å; T109-W201 HydrophobicContact CG2-CZ2 4.33Å; T109-F324 HydrophobicContact CG2-CB 4.14Å; T109-F324 HydrophobicContact CG2-CD1 3.36Å; T109-F324 HydrophobicContact CG2-CD2 4.08Å; T109-F324 HydrophobicContact CG2-CE1 3.66Å; T109-F324 HydrophobicContact CG2-CE2 4.32Å; T109-F324 HydrophobicContact CG2-CG 3.58Å; T109-F324 HydrophobicContact CG2-CZ 4.12Å; T109-N382 PolarHBondContact O-ND2 2.96Å
110	K	97.1	Very high	94.7	Very high	10 Å²	10	37.2 Å²	37.2	4%	0.043	22%	0.218	C	C	.	.	T	Hydrogen-bonded Turn	trans	51.7	48.3	-174.2	-163.2	-171.1	178.9	-170.4	0	111.4	Q106 I252 T367 L370 D375 N378 R380 N382	Q106-K110 WeakPolarHBondContact O-CA 3.19Å; Q106-K110 PolarHBondContact O-N 2.98Å; K110-I252 HydrophobicContact CB-CD1 4.14Å; K110-I252 HydrophobicContact CG-CD1 3.34Å; K110-T367 HydrophobicContact CD-CG2 4.31Å; K110-L370 HydrophobicContact CB-CD2 3.48Å; K110-L370 VanDerWaalsContact CB-CD2 3.48Å; K110-L370 HydrophobicContact CD-CD2 4.06Å; K110-L370 HydrophobicContact CG-CD2 4.4Å; K110-D375 WeakPolarHBondContact CD-OD1 3.48Å; K110-D375 WeakPolarHBondContact CE-OD1 3.48Å; K110-D375 IonicContact NZ-OD1 2.78Å; K110-D375 PolarHBondContact NZ-OD1 2.92Å; K110-N378 PolarHBondContact NZ-ND2 3.08Å; K110-N378 PolarHBondContact NZ-O 3.02Å; K110-R380 WeakPolarHBondContact CE-O 3.41Å; K110-R380 PolarHBondContact NZ-O 2.96Å; K110-N382 PolarHBondContact O-N 3.5Å
111	T	97.8	Very high	93.1	Very high	0 Å²	0	38.1 Å²	38.1	0%	0	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	142	-176.7	-54.3	0	0	0	0	111.6	Q106 T109 L320 Y363 N382 C384	Q106-T111 VanDerWaalsContact CB-O 3.26Å; Q106-T111 WeakPolarHBondContact CB-O 3.28Å; Q106-T111 WeakPolarHBondContact CG-O 3.13Å; Q106-T111 PolarHBondContact O-N 3.02Å; T109-T111 VanDerWaalsContact C-N 3.29Å; T109-T111 PolarHBondContact O-N 3.2Å; T109-T111 PolarHBondContact O-OG1 3.37Å; T109-T111 WeakPolarHBondContact OG1-CB 3.49Å; T109-T111 PolarHBondContact OG1-OG1 3.36Å; T111-L320 HydrophobicContact CG2-CD2 3.62Å; T111-Y363 HydrophobicContact CG2-CE2 3.66Å; T111-Y363 PolarHBondContact OG1-OH 3Å; T111-N382 CarbonylContact C-O 3.57Å; T111-N382 WeakPolarHBondContact CA-O 3.47Å; T111-N382 HydrophobicContact CG2-CB 4.26Å; T111-C384 HydrophobicContact CG2-CB 3.78Å
112	V	97.3	Very high	91	Very high	1 Å²	1	43.6 Å²	43.6	1%	0.006	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102	130.7	168.5	174.1	0	0	0	0	109.6	I114 V250 I252 K381 N382 C384	V112-I114 HydrophobicContact CG1-CG1 4.34Å; V112-V250 HydrophobicContact CG1-CB 3.72Å; V112-V250 HydrophobicContact CG1-CG1 3.63Å; V112-I252 HydrophobicContact CG2-CG1 3.91Å; V112-K381 HydrophobicContact CG2-CB 4.35Å; V112-K381 HydrophobicContact CG2-CD 3.84Å; V112-N382 PolarHBondContact N-O 2.94Å; V112-C384 PolarHBondContact O-N 3.12Å
113	F	97	Very high	89.1	Confident	35 Å²	35	50.7 Å²	50.7	15%	0.154	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.9	133	172.4	-177.5	-95.7	0	0	0	111.8	R316 F361 C384	F113-R316 HydrophobicContact CD2-CG 4.49Å; F113-R316 HydrophobicContact CE2-CG 3.82Å; F113-R316 HydrophobicContact CZ-CG 3.88Å; F113-F361 HydrophobicContact CE2-CD1 4.27Å; F113-F361 HydrophobicContact CE2-CE1 4.07Å; F113-C384 CarbonylContact C-O 3.56Å; F113-C384 VanDerWaalsContact CA-O 3.3Å; F113-C384 WeakPolarHBondContact CA-O 3.42Å; F113-C384 HydrophobicContact CD2-CB 4.37Å
114	I	96.3	Very high	87.2	Confident	45 Å²	45	49.3 Å²	49.3	23%	0.231	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	130.6	175.8	-52.3	178.5	0	0	0	108.8	V112 I248 I383 C384 W385 G386	V112-I114 HydrophobicContact CG1-CG1 4.34Å; I114-I248 HydrophobicContact CD1-CD1 3.48Å; I114-I248 VanDerWaalsContact CD1-CD1 3.48Å; I114-I248 HydrophobicContact CD1-CG1 4.41Å; I114-I248 HydrophobicContact CG1-CD1 4.44Å; I114-I383 HydrophobicContact CD1-CG2 3.67Å; I114-I383 HydrophobicContact CG1-CG2 4.22Å; I114-C384 PolarHBondContact N-O 2.83Å; I114-W385 CarbonylContact O-C 3.51Å; I114-W385 VanDerWaalsContact O-CA 3.31Å; I114-W385 WeakPolarHBondContact O-CA 3.46Å; I114-G386 PolarHBondContact O-N 2.78Å
115	S	95.8	Very high	85.6	Confident	94 Å²	94	56.3 Å²	56.3	66%	0.657	35%	0.345	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-74.5	136	174.8	-172.3	0	0	0	0	110.8
116	G	94.6	Very high	84.3	Confident	26 Å²	26	59 Å²	59	27%	0.268	36%	0.363	S	S	.	.	B	Isolated β-bridge	trans	104.4	-174.6	-176.4	0	0	0	0	0	112.6	W385 G386	G116-W385 WeakPolarHBondContact O-CB 3.26Å; G116-G386 PolarHBondContact N-O 3.05Å; G116-G386 CarbonylContact O-C 3.15Å; G116-G386 PolarHBondContact O-N 3.15Å
117	L	93.8	Very high	83.5	Confident	69 Å²	69	63.9 Å²	63.9	36%	0.361	40%	0.399	S	S	.	.	P	Polyproline II helix	trans	-98.1	158.7	174.2	-70	178.9	0	0	0	110.2	F360 T387 F415	L117-F360 HydrophobicContact CD2-CB 4.23Å; L117-T387 HydrophobicContact CD1-CG2 4.42Å; L117-T387 HydrophobicContact CD2-CG2 3.82Å; L117-T387 HydrophobicContact CG-CG2 3.7Å; L117-F415 HydrophobicContact CD1-CE1 4.23Å; L117-F415 HydrophobicContact CD2-CE1 3.91Å; L117-F415 HydrophobicContact CD2-CZ 3.75Å
118	P	92.7	Very high	83.1	Confident	17 Å²	17	65.4 Å²	65.4	11%	0.11	40%	0.402	C	S	.	.	P	Polyproline II helix	trans	-59.3	156.6	174.5	25	-34.2	0	0	0	111.4	A120 F241 C362 W385	P118-A120 PolarHBondContact O-N 2.94Å; P118-A120 VanDerWaalsContact O-N 3.15Å; P118-F241 HydrophobicContact CB-CB 3.77Å; P118-F241 HydrophobicContact CB-CD1 3.81Å; P118-F241 HydrophobicContact CB-CD2 4.27Å; P118-F241 HydrophobicContact CB-CE1 4.46Å; P118-F241 HydrophobicContact CB-CG 3.7Å; P118-F241 HydrophobicContact CG-CB 4.43Å; P118-F241 HydrophobicContact CG-CD1 3.58Å; P118-F241 HydrophobicContact CG-CD2 4.16Å; P118-F241 HydrophobicContact CG-CE1 3.73Å; P118-F241 HydrophobicContact CG-CE2 4.26Å; P118-F241 HydrophobicContact CG-CG 3.81Å; P118-F241 HydrophobicContact CG-CZ 4.07Å; P118-C362 HydrophobicContact CG-CB 4.03Å; P118-W385 HydrophobicContact CB-CD2 4.04Å; P118-W385 HydrophobicContact CB-CE3 4.41Å; P118-W385 HydrophobicContact CB-CG 4.32Å; P118-W385 HydrophobicContact CB-CZ2 4.44Å
119	P	83.3	Confident	82.8	Confident	85 Å²	85	69.9 Å²	69.9	55%	0.552	43%	0.427	S	S	*	.	P	Polyproline II helix	trans	-59.1	122	175.2	25.8	-33	0	0	0	109.3
120	A	72.8	Confident	82.6	Confident	92 Å²	92	72.1 Å²	72.1	76%	0.76	44%	0.438	S	S	*	.	P	Polyproline II helix	trans	-68.2	134.8	180	0	0	0	0	0	109.8	P118	P118-A120 PolarHBondContact O-N 2.94Å; P118-A120 VanDerWaalsContact O-N 3.15Å
121	P	62.6	Low	82.5	Confident	88 Å²	88	75 Å²	75	57%	0.571	47%	0.465	S	S	*	.	P	Polyproline II helix	trans	-62.2	139.5	164.9	26.9	-31.4	0	0	0	108.5	Q123	P121-Q123 HydrophobicContact CB-CG 4.45Å; P121-Q123 HydrophobicContact CG-CG 4.5Å; P121-Q123 PolarHBondContact O-N 3.46Å
122	A	51.6	Low	82.3	Confident	115 Å²	115	76.4 Å²	76.4	95%	0.95	48%	0.479	S	S	*	.			trans	-66.3	83.8	177.5	0	0	0	0	0	110.1
123	Q	56.8	Low	82.2	Confident	155 Å²	155	76.9 Å²	76.9	72%	0.724	48%	0.481	S	S	*	.			trans	-115.1	136.2	173.8	-67.1	-174.1	3.4	0	0	109	P121 R125	P121-Q123 HydrophobicContact CB-CG 4.45Å; P121-Q123 HydrophobicContact CG-CG 4.5Å; P121-Q123 PolarHBondContact O-N 3.46Å; Q123-R125 PolarHBondContact O-N 3.33Å
124	S	56.5	Low	82.2	Confident	117 Å²	117	79.5 Å²	79.5	82%	0.818	49%	0.49	S	S	*	.	P	Polyproline II helix	trans	-65.3	123	172.4	43.9	0	0	0	0	109.2
125	R	63.9	Low	82.2	Confident	177 Å²	177	79.7 Å²	79.7	67%	0.668	50%	0.498	S	S	*	.	P	Polyproline II helix	trans	-62.5	129.7	173.4	-75.7	-178.4	168.6	165.7	-4.9	108.9	Q123 D414	Q123-R125 PolarHBondContact O-N 3.33Å; R125-D414 IonicContact CZ-OD2 3.42Å; R125-D414 IonicContact NE-OD1 2.7Å; R125-D414 IonicContact NH2-OD1 3.38Å; R125-D414 IonicContact NH2-OD2 3.13Å; R125-D414 PolarHBondContact NH2-OD2 3.41Å
126	P	71.8	Confident	82.2	Confident	61 Å²	61	76.1 Å²	76.1	40%	0.396	47%	0.474	S	S	.	.	P	Polyproline II helix	trans	-63.6	156.6	172.2	27.5	-33	0	0	0	110.1	L128 L182 L417	P126-L128 PolarHBondContact O-N 2.97Å; P126-L182 HydrophobicContact CB-CD2 4.13Å; P126-L182 HydrophobicContact CG-CD2 4.44Å; P126-L417 HydrophobicContact CG-CD1 4.38Å
127	S	80.8	Confident	82.3	Confident	119 Å²	119	75 Å²	75	83%	0.832	46%	0.462	S	S	*	.			trans	-61.2	110.4	172.4	55.8	0	0	0	0	109.3
128	L	87.4	Confident	82.4	Confident	50 Å²	50	72.6 Å²	72.6	26%	0.262	45%	0.451	S	S	.	.			trans	-104.8	126.3	-175.9	-171.1	73	0	0	0	109.6	P126 L130 L133 L179 L182 L410 V413	P126-L128 PolarHBondContact O-N 2.97Å; L128-L130 PolarHBondContact O-N 3.44Å; L128-L133 HydrophobicContact CD1-CD1 3.57Å; L128-L133 HydrophobicContact CD2-CD1 3.88Å; L128-L133 HydrophobicContact CG-CD1 3.71Å; L128-L179 HydrophobicContact CD1-CD2 4.14Å; L128-L182 HydrophobicContact CD1-CD1 3.53Å; L128-L410 HydrophobicContact CD2-CD2 3.87Å; L128-V413 HydrophobicContact CD1-CG1 4.05Å; L128-V413 HydrophobicContact CD2-CG1 3.87Å
129	D	92.2	Very high	82.5	Confident	108 Å²	108	76.4 Å²	76.4	58%	0.578	47%	0.471	S	S	*	.			trans	-76	80.6	167.9	-180	14.2	0	0	0	110	A131 G132 L133	D129-A131 PolarHBondContact O-N 3.09Å; D129-A131 PolarHBondContact OD1-N 2.82Å; D129-G132 PolarHBondContact O-N 2.85Å; D129-G132 PolarHBondContact OD1-N 3.16Å; D129-G132 WeakPolarHBondContact OD2-CA 3.41Å; D129-L133 WeakPolarHBondContact O-CG 3.08Å; D129-L133 PolarHBondContact O-N 3.41Å; D129-L133 VanDerWaalsContact O-N 3.12Å
130	L	92.7	Very high	83.1	Confident	50 Å²	50	72.8 Å²	72.8	26%	0.262	45%	0.447	S	S	.	.	H	α-helix	trans	-63.8	-32.9	179.7	-176.9	60.7	0	0	0	111.9	L128 L133 R134 D406 L409 L410	L128-L130 PolarHBondContact O-N 3.44Å; L130-L133 PolarHBondContact O-N 3.47Å; L130-R134 VanDerWaalsContact O-CB 3.28Å; L130-R134 WeakPolarHBondContact O-CB 2.91Å; L130-R134 PolarHBondContact O-N 2.78Å; L130-D406 HydrophobicContact CD2-CB 4.4Å; L130-L409 HydrophobicContact CD1-CD2 4.08Å; L130-L410 HydrophobicContact CD1-CD2 3.75Å; L130-L410 HydrophobicContact CD1-CG 3.99Å; L130-L410 HydrophobicContact CD2-CD1 4.31Å; L130-L410 HydrophobicContact CD2-CD2 4.32Å; L130-L410 HydrophobicContact CD2-CG 4.42Å
131	A	94.1	Very high	84.1	Confident	72 Å²	72	68.5 Å²	68.5	60%	0.595	41%	0.412	S	S	*	.	H	α-helix	trans	-67.5	-45.8	179.8	0	0	0	0	0	111.1	D129 R134 A135	D129-A131 PolarHBondContact O-N 3.09Å; D129-A131 PolarHBondContact OD1-N 2.82Å; A131-R134 PolarHBondContact O-N 3Å; A131-A135 WeakPolarHBondContact O-CB 3.27Å; A131-A135 PolarHBondContact O-N 3.39Å
132	G	94.9	Very high	85.6	Confident	29 Å²	29	64.8 Å²	64.8	30%	0.299	39%	0.387	S	S	.	.	H	α-helix	trans	-61.7	-42.6	174.6	0	0	0	0	0	112.8	D129 A135 A136	D129-G132 PolarHBondContact O-N 2.85Å; D129-G132 PolarHBondContact OD1-N 3.16Å; D129-G132 WeakPolarHBondContact OD2-CA 3.41Å; G132-A135 PolarHBondContact O-N 2.79Å; G132-A136 WeakPolarHBondContact O-CB 3.33Å; G132-A136 PolarHBondContact O-N 2.79Å
133	L	95.4	Very high	87.6	Confident	10 Å²	10	63.1 Å²	63.1	5%	0.052	36%	0.359	C	S	.	.	H	α-helix	trans	-64.5	-43.1	176.3	-69.9	172.2	0	0	0	112.4	L128 D129 L130 A136 V137 L175 L178 L179 L409 V413	L128-L133 HydrophobicContact CD1-CD1 3.57Å; L128-L133 HydrophobicContact CD2-CD1 3.88Å; L128-L133 HydrophobicContact CG-CD1 3.71Å; D129-L133 WeakPolarHBondContact O-CG 3.08Å; D129-L133 PolarHBondContact O-N 3.41Å; D129-L133 VanDerWaalsContact O-N 3.12Å; L130-L133 PolarHBondContact O-N 3.47Å; L133-A136 PolarHBondContact O-N 3.02Å; L133-V137 WeakPolarHBondContact O-CG2 3.34Å; L133-V137 PolarHBondContact O-N 2.92Å; L133-L175 HydrophobicContact CD2-CD2 4.01Å; L133-L178 HydrophobicContact CD2-CB 3.94Å; L133-L178 HydrophobicContact CD2-CD1 3.84Å; L133-L179 HydrophobicContact CD1-CD2 4.37Å; L133-L409 HydrophobicContact CB-CD2 4.23Å; L133-V413 HydrophobicContact CD1-CG2 4.06Å
134	R	96.5	Very high	89.2	Confident	90 Å²	90	56.4 Å²	56.4	34%	0.34	33%	0.328	S	S	.	.	H	α-helix	trans	-60.3	-47.7	175.7	178	-179.3	178.3	147.2	-6.6	111	L130 A131 A136 V137 C138 F404 D406 L409	L130-R134 VanDerWaalsContact O-CB 3.28Å; L130-R134 WeakPolarHBondContact O-CB 2.91Å; L130-R134 PolarHBondContact O-N 2.78Å; A131-R134 PolarHBondContact O-N 3Å; R134-A136 PolarHBondContact O-N 2.66Å; R134-V137 PolarHBondContact O-N 3.03Å; R134-C138 WeakPolarHBondContact O-CB 3.46Å; R134-C138 PolarHBondContact O-N 2.83Å; R134-C138 PolarHBondContact O-SG 2.84Å; R134-C138 VanDerWaalsContact O-SG 3.38Å; R134-F404 HydrophobicContact CB-CE1 4.47Å; R134-F404 HydrophobicContact CG-CD1 3.98Å; R134-F404 HydrophobicContact CG-CE1 3.83Å; R134-F404 HydrophobicContact CG-CZ 4.33Å; R134-D406 WeakPolarHBondContact CD-OD1 3.41Å; R134-D406 IonicContact CZ-OD1 2.89Å; R134-D406 IonicContact NE-OD1 3.62Å; R134-D406 VanDerWaalsContact NH1-CG 3.26Å; R134-D406 IonicContact NH1-OD1 3.36Å; R134-D406 PolarHBondContact NH1-OD1 2.84Å; R134-D406 IonicContact NH1-OD2 2.89Å; R134-D406 PolarHBondContact NH1-OD2 2.7Å; R134-L409 HydrophobicContact CB-CD2 4.17Å
135	A	96.4	Very high	90.6	Very high	49 Å²	49	54 Å²	54	41%	0.405	30%	0.304	S	S	.	.	H	α-helix	trans	-57.4	-48.6	177.6	0	0	0	0	0	111.2	A131 G132 V137 C138 D139	A131-A135 WeakPolarHBondContact O-CB 3.27Å; A131-A135 PolarHBondContact O-N 3.39Å; G132-A135 PolarHBondContact O-N 2.79Å; A135-V137 VanDerWaalsContact C-N 3.33Å; A135-V137 PolarHBondContact O-N 2.94Å; A135-C138 PolarHBondContact O-N 3.5Å; A135-D139 WeakPolarHBondContact O-CB 3.37Å; A135-D139 VanDerWaalsContact O-CG 3.26Å; A135-D139 PolarHBondContact O-N 3.2Å
136	A	96.3	Very high	91.7	Very high	19 Å²	19	48.1 Å²	48.1	16%	0.157	29%	0.287	C	S	.	.	H	α-helix	trans	-60.6	-39.1	178.9	0	0	0	0	0	113.3	G132 L133 R134 C140 T174 L178	G132-A136 WeakPolarHBondContact O-CB 3.33Å; G132-A136 PolarHBondContact O-N 2.79Å; L133-A136 PolarHBondContact O-N 3.02Å; R134-A136 PolarHBondContact O-N 2.66Å; A136-C140 PolarHBondContact O-N 2.9Å; A136-C140 VanDerWaalsContact O-N 3.1Å; A136-C140 PolarHBondContact O-SG 2.79Å; A136-T174 HydrophobicContact CB-CG2 3.98Å; A136-L178 HydrophobicContact CB-CD1 3.82Å
137	V	95.7	Very high	92.5	Very high	2 Å²	2	51.3 Å²	51.3	1%	0.012	29%	0.293	C	S	.	.	H	α-helix	trans	-71.1	-42.3	176.9	173.9	0	0	0	0	111.3	L133 R134 A135 D139 C140 I141 L171 L175 L392 F404 L409	L133-V137 WeakPolarHBondContact O-CG2 3.34Å; L133-V137 PolarHBondContact O-N 2.92Å; R134-V137 PolarHBondContact O-N 3.03Å; A135-V137 VanDerWaalsContact C-N 3.33Å; A135-V137 PolarHBondContact O-N 2.94Å; V137-D139 VanDerWaalsContact C-N 3.31Å; V137-D139 PolarHBondContact O-N 2.91Å; V137-C140 PolarHBondContact O-N 3.42Å; V137-I141 HydrophobicContact CG1-CD1 4Å; V137-I141 VanDerWaalsContact O-CG1 3.31Å; V137-I141 WeakPolarHBondContact O-CG1 3.25Å; V137-I141 PolarHBondContact O-N 2.9Å; V137-L171 HydrophobicContact CG1-CD1 4.15Å; V137-L175 HydrophobicContact CG2-CD2 3.99Å; V137-L175 HydrophobicContact CG2-CG 4.46Å; V137-L392 HydrophobicContact CG1-CD2 4.24Å; V137-F404 HydrophobicContact CB-CZ 4.44Å; V137-F404 HydrophobicContact CG1-CE2 3.9Å; V137-F404 HydrophobicContact CG1-CZ 4.09Å; V137-L409 HydrophobicContact CG2-CD1 3.84Å
138	C	95.7	Very high	92.9	Very high	20 Å²	20	49.5 Å²	49.5	14%	0.135	27%	0.273	C	S	.	.	H	α-helix	trans	-59.3	-42.6	173.6	-73.6	0	0	0	0	111.5	R134 A135 C140 I141 L142 V401	R134-C138 WeakPolarHBondContact O-CB 3.46Å; R134-C138 PolarHBondContact O-N 2.83Å; R134-C138 PolarHBondContact O-SG 2.84Å; R134-C138 VanDerWaalsContact O-SG 3.38Å; A135-C138 PolarHBondContact O-N 3.5Å; C138-C140 PolarHBondContact O-N 3.01Å; C138-I141 WeakPolarHBondContact O-CB 3.22Å; C138-I141 PolarHBondContact O-N 2.89Å; C138-I141 VanDerWaalsContact O-N 3.15Å; C138-L142 WeakPolarHBondContact O-CB 3.45Å; C138-L142 WeakPolarHBondContact O-CG 3.44Å; C138-L142 PolarHBondContact O-N 2.76Å; C138-V401 HydrophobicContact CB-CG2 4.3Å
139	D	95.8	Very high	92.6	Very high	97 Å²	97	58.5 Å²	58.5	52%	0.519	30%	0.303	S	S	.	.	H	α-helix	trans	-61.4	-43.2	176.9	-72	-18	0	0	0	111.6	A135 V137 I141 L142 Q143	A135-D139 WeakPolarHBondContact O-CB 3.37Å; A135-D139 VanDerWaalsContact O-CG 3.26Å; A135-D139 PolarHBondContact O-N 3.2Å; V137-D139 VanDerWaalsContact C-N 3.31Å; V137-D139 PolarHBondContact O-N 2.91Å; D139-I141 VanDerWaalsContact C-N 3.32Å; D139-I141 PolarHBondContact O-N 2.61Å; D139-L142 PolarHBondContact O-N 3.37Å; D139-Q143 VanDerWaalsContact O-CB 3.22Å; D139-Q143 WeakPolarHBondContact O-CB 3.18Å; D139-Q143 PolarHBondContact O-N 3.07Å
140	C	95	Very high	91.9	Very high	9 Å²	9	57.2 Å²	57.2	6%	0.061	29%	0.291	C	S	.	.	H	α-helix	trans	-60.5	-42	174.2	-67.1	0	0	0	0	111.7	A136 V137 C138 E144 L167	A136-C140 PolarHBondContact O-N 2.9Å; A136-C140 VanDerWaalsContact O-N 3.1Å; A136-C140 PolarHBondContact O-SG 2.79Å; V137-C140 PolarHBondContact O-N 3.42Å; C138-C140 PolarHBondContact O-N 3.01Å; C140-E144 PolarHBondContact O-N 2.89Å; C140-L167 HydrophobicContact CB-CD1 4.12Å; C140-L167 WeakPolarHBondContact O-CD1 3.44Å
141	I	94.1	Very high	90.8	Very high	1 Å²	1	67 Å²	67	1%	0.005	32%	0.324	C	S	.	.	H	α-helix	trans	-63.6	-50.6	177.9	-67.5	165.6	0	0	0	110.3	V137 C138 D139 Q143 E144 H145 L167 L392 Y393 V396 V401 F404	V137-I141 HydrophobicContact CG1-CD1 4Å; V137-I141 VanDerWaalsContact O-CG1 3.31Å; V137-I141 WeakPolarHBondContact O-CG1 3.25Å; V137-I141 PolarHBondContact O-N 2.9Å; C138-I141 WeakPolarHBondContact O-CB 3.22Å; C138-I141 PolarHBondContact O-N 2.89Å; C138-I141 VanDerWaalsContact O-N 3.15Å; D139-I141 VanDerWaalsContact C-N 3.32Å; D139-I141 PolarHBondContact O-N 2.61Å; I141-Q143 VanDerWaalsContact C-N 3.33Å; I141-Q143 PolarHBondContact O-N 3.4Å; I141-E144 PolarHBondContact O-N 2.93Å; I141-H145 WeakPolarHBondContact O-CB 3.26Å; I141-H145 PolarHBondContact O-N 3.06Å; I141-H145 PolarHBondContact O-ND1 3.44Å; I141-L167 HydrophobicContact CB-CD1 4.47Å; I141-L167 HydrophobicContact CG1-CD1 4.02Å; I141-L167 HydrophobicContact CG1-CD2 4.49Å; I141-L392 HydrophobicContact CD1-CD2 4.26Å; I141-Y393 HydrophobicContact CD1-CD1 3.89Å; I141-Y393 HydrophobicContact CD1-CE1 4.2Å; I141-V396 HydrophobicContact CG2-CG2 3.83Å; I141-V401 HydrophobicContact CB-CG2 4.27Å; I141-V401 HydrophobicContact CG2-CG2 3.91Å; I141-F404 HydrophobicContact CD1-CE2 4.35Å
142	L	94.3	Very high	89.5	Confident	10 Å²	10	70.5 Å²	70.5	5%	0.052	33%	0.332	C	S	.	.	H	α-helix	trans	-65.9	-35.5	-179.1	-69	173.5	0	0	0	111.9	C138 D139 E144 V146 Y147 V396 N399 V401	C138-L142 WeakPolarHBondContact O-CB 3.45Å; C138-L142 WeakPolarHBondContact O-CG 3.44Å; C138-L142 PolarHBondContact O-N 2.76Å; D139-L142 PolarHBondContact O-N 3.37Å; L142-E144 PolarHBondContact O-N 3.49Å; L142-V146 HydrophobicContact CD2-CG2 4.06Å; L142-V146 WeakPolarHBondContact O-CA 3.18Å; L142-V146 VanDerWaalsContact O-CB 3.31Å; L142-V146 WeakPolarHBondContact O-CB 3.38Å; L142-V146 PolarHBondContact O-N 3.16Å; L142-Y147 HydrophobicContact CB-CD2 4.09Å; L142-Y147 HydrophobicContact CB-CE2 3.57Å; L142-Y147 HydrophobicContact CD1-CE2 4.45Å; L142-Y147 PolarHBondContact O-N 2.88Å; L142-V396 HydrophobicContact CD2-CG1 3.84Å; L142-N399 WeakPolarHBondContact CD1-O 3.34Å; L142-N399 WeakPolarHBondContact CD2-O 3.37Å; L142-V401 HydrophobicContact CD1-CG2 4.47Å; L142-V401 HydrophobicContact CD2-CG2 3.93Å; L142-V401 HydrophobicContact CG-CG2 3.9Å
143	Q	92.8	Very high	87.9	Confident	80 Å²	80	80.8 Å²	80.8	37%	0.374	36%	0.362	S	S	.	.	I	π-helix	trans	-55.1	-53.3	176.1	-177.6	178.6	10.9	0	0	111.3	D139 I141 Y147 L148	D139-Q143 VanDerWaalsContact O-CB 3.22Å; D139-Q143 WeakPolarHBondContact O-CB 3.18Å; D139-Q143 PolarHBondContact O-N 3.07Å; I141-Q143 VanDerWaalsContact C-N 3.33Å; I141-Q143 PolarHBondContact O-N 3.4Å; Q143-Y147 PolarHBondContact O-N 2.7Å; Q143-L148 WeakPolarHBondContact O-CB 3.08Å; Q143-L148 PolarHBondContact O-N 3.27Å
144	E	90.1	Very high	86.2	Confident	15 Å²	15	81.9 Å²	81.9	7%	0.07	37%	0.37	C	S	.	.	I	π-helix	trans	-77.7	-34	-176.7	-73.4	-60.3	146.5	0	0	113.6	C140 I141 L142 L148 R150 L163 P166 L167	C140-E144 PolarHBondContact O-N 2.89Å; I141-E144 PolarHBondContact O-N 2.93Å; L142-E144 PolarHBondContact O-N 3.49Å; E144-L148 WeakPolarHBondContact OE2-CD2 3.4Å; E144-R150 IonicContact OE2-CZ 3.95Å; E144-R150 IonicContact OE2-NH2 2.8Å; E144-R150 PolarHBondContact OE2-NH2 3.31Å; E144-L163 WeakPolarHBondContact O-CD2 3.38Å; E144-P166 HydrophobicContact CG-CB 4.38Å; E144-L167 HydrophobicContact CB-CB 4.42Å; E144-L167 HydrophobicContact CG-CB 4.18Å
145	H	86.4	Confident	84.6	Confident	67 Å²	67	85.3 Å²	85.3	31%	0.31	39%	0.389	S	S	.	.	I	π-helix	trans	-82.6	-34	-176.5	-72.7	84.7	0	0	0	113.7	I141 V396	I141-H145 WeakPolarHBondContact O-CB 3.26Å; I141-H145 PolarHBondContact O-N 3.06Å; I141-H145 PolarHBondContact O-ND1 3.44Å; H145-V396 HydrophobicContact CB-CG1 4.24Å
146	V	88.3	Confident	82.8	Confident	53 Å²	53	90.1 Å²	90.1	32%	0.321	41%	0.407	S	S	.	.	I	π-helix	trans	-122.7	-56.6	-166.7	179.3	0	0	0	0	111.5	L142 V396 N399	L142-V146 HydrophobicContact CD2-CG2 4.06Å; L142-V146 WeakPolarHBondContact O-CA 3.18Å; L142-V146 VanDerWaalsContact O-CB 3.31Å; L142-V146 WeakPolarHBondContact O-CB 3.38Å; L142-V146 PolarHBondContact O-N 3.16Å; V146-V396 HydrophobicContact CG2-CG1 3.84Å; V146-N399 HydrophobicContact CG1-CB 4.33Å; V146-N399 WeakPolarHBondContact CG1-OD1 3.44Å
147	Y	88.8	Confident	80.7	Confident	128 Å²	128	94.7 Å²	94.7	50%	0.502	42%	0.424	S	S	.	.	I	π-helix	trans	-79	-34.2	-166.5	-55.7	-41.1	0	0	0	113.6	L142 Q143 R149	L142-Y147 HydrophobicContact CB-CD2 4.09Å; L142-Y147 HydrophobicContact CB-CE2 3.57Å; L142-Y147 HydrophobicContact CD1-CE2 4.45Å; L142-Y147 PolarHBondContact O-N 2.88Å; Q143-Y147 PolarHBondContact O-N 2.7Å; Y147-R149 PolarHBondContact O-N 2.7Å; Y147-R149 VanDerWaalsContact O-N 3.09Å
148	L	88.8	Confident	79.3	Confident	81 Å²	81	98.6 Å²	98.6	42%	0.424	45%	0.445	S	S	.	.			trans	-72.4	106.7	-176.3	-170.2	70.7	0	0	0	111.2	Q143 E144 R150	Q143-L148 WeakPolarHBondContact O-CB 3.08Å; Q143-L148 PolarHBondContact O-N 3.27Å; E144-L148 WeakPolarHBondContact OE2-CD2 3.4Å; L148-R150 PolarHBondContact O-N 2.78Å
149	R	80.8	Confident	77.9	Confident	238 Å²	238	104.3 Å²	104.3	90%	0.898	46%	0.463	S	S	*	.			trans	-73.4	107	175.7	-64.8	-174.7	-177.7	-177.8	1.3	110.8	Y147	Y147-R149 PolarHBondContact O-N 2.7Å; Y147-R149 VanDerWaalsContact O-N 3.09Å
150	R	77.5	Confident	76.7	Confident	82 Å²	82	102.9 Å²	102.9	31%	0.309	45%	0.451	S	S	.	.			trans	-85.8	123.4	175.9	-62.3	-176.2	178.9	-139.8	-8.8	110.5	E144 L148 L152 A162 L163	E144-R150 IonicContact OE2-CZ 3.95Å; E144-R150 IonicContact OE2-NH2 2.8Å; E144-R150 PolarHBondContact OE2-NH2 3.31Å; L148-R150 PolarHBondContact O-N 2.78Å; R150-L152 VanDerWaalsContact C-N 3.29Å; R150-L152 PolarHBondContact O-N 3.4Å; R150-A162 VanDerWaalsContact CZ-O 3.31Å; R150-A162 VanDerWaalsContact NH1-C 3.26Å; R150-A162 PolarHBondContact NH1-O 2.84Å; R150-A162 PolarHBondContact NH2-O 3.47Å; R150-L163 VanDerWaalsContact CZ-CD2 3.49Å
151	R	68.6	Low	75.9	Confident	254 Å²	254	107 Å²	107	96%	0.958	47%	0.469	S	S	*	.	S	Bend	trans	-64.1	-32.4	180	-68.2	-172.9	179.9	-172.1	0.2	113
152	L	67.1	Low	75.3	Confident	147 Å²	147	108.3 Å²	108.3	77%	0.77	48%	0.48	S	S	*	.	S	Bend	trans	-113.5	136.9	175.2	-77.1	126	0	0	0	109.3	R150 P154	R150-L152 VanDerWaalsContact C-N 3.29Å; R150-L152 PolarHBondContact O-N 3.4Å; L152-P154 WeakPolarHBondContact O-CD 3.35Å
153	R	61.7	Low	74.9	Confident	244 Å²	244	109.1 Å²	109.1	92%	0.921	48%	0.484	S	S	*	.			trans	-69.9	111.2	164.9	-70.8	-174.6	-175.1	-178.4	2	106.9
154	P	60.3	Low	74.7	Confident	34 Å²	34	105.7 Å²	105.7	22%	0.221	47%	0.469	C	S	.	.			trans	-61.1	143.2	177	26.2	-33.8	0	0	0	109.3	L152 R159	L152-P154 WeakPolarHBondContact O-CD 3.35Å; P154-R159 HydrophobicContact CB-CB 4.28Å; P154-R159 HydrophobicContact CG-CB 3.87Å; P154-R159 HydrophobicContact CG-CG 3.85Å
155	H	61.7	Low	74.8	Confident	161 Å²	161	105.6 Å²	105.6	75%	0.745	47%	0.47	S	S	*	.			trans	-53.1	145.6	171.2	-73.2	-66.4	0	0	0	109.7	F157 D158 R159	H155-F157 PolarHBondContact O-N 3.3Å; H155-D158 CarbonylContact O-C 3.53Å; H155-D158 WeakPolarHBondContact O-CA 3.27Å; H155-D158 PolarHBondContact O-N 3.12Å; H155-R159 PolarHBondContact O-N 2.95Å
156	L	58.7	Low	75.1	Confident	151 Å²	151	104.4 Å²	104.4	79%	0.791	47%	0.468	S	S	*	.	H	α-helix	trans	-51.4	-36.9	-174.6	-70.1	171.5	0	0	0	113.4	D158	L156-D158 VanDerWaalsContact C-N 3.35Å
157	F	53.4	Low	75.4	Confident	115 Å²	115	102.3 Å²	102.3	50%	0.504	46%	0.455	S	S	.	.	H	α-helix	trans	-69.6	-29.8	178.4	-164.6	-92.1	0	0	0	113.5	H155 D295 R296	H155-F157 PolarHBondContact O-N 3.3Å; F157-D295 WeakPolarHBondContact CD2-OD2 3.33Å; F157-R296 HydrophobicContact CZ-CG 4.2Å
158	D	64.7	Low	75.7	Confident	84 Å²	84	96.4 Å²	96.4	45%	0.449	43%	0.432	S	S	.	.	H	α-helix	trans	-94.5	-18.8	-179.9	-159.3	12.5	0	0	0	111.5	H155 L156 R160 Q161 A162	H155-D158 CarbonylContact O-C 3.53Å; H155-D158 WeakPolarHBondContact O-CA 3.27Å; H155-D158 PolarHBondContact O-N 3.12Å; L156-D158 VanDerWaalsContact C-N 3.35Å; D158-R160 PolarHBondContact O-N 3.27Å; D158-Q161 PolarHBondContact O-N 3.24Å; D158-A162 WeakPolarHBondContact O-CB 3.27Å; D158-A162 PolarHBondContact O-N 3.17Å
159	R	67.1	Low	76	Confident	140 Å²	140	94.3 Å²	94.3	53%	0.528	42%	0.421	S	S	.	.	H	α-helix	trans	-59.2	-46.7	-173.4	-176.5	170.5	-176.5	-170.2	0.9	112.9	P154 H155 L163	P154-R159 HydrophobicContact CB-CB 4.28Å; P154-R159 HydrophobicContact CG-CB 3.87Å; P154-R159 HydrophobicContact CG-CG 3.85Å; H155-R159 PolarHBondContact O-N 2.95Å; R159-L163 HydrophobicContact CG-CD1 3.87Å; R159-L163 WeakPolarHBondContact O-CB 3.41Å; R159-L163 WeakPolarHBondContact O-CD1 3.48Å; R159-L163 WeakPolarHBondContact O-CG 3.43Å; R159-L163 PolarHBondContact O-N 3.07Å
160	R	71.3	Confident	76.7	Confident	67 Å²	67	88.3 Å²	88.3	25%	0.253	40%	0.398	S	S	.	.	H	α-helix	trans	-68.9	-46.4	-179.1	-172.1	176.8	-177.4	168.2	4.4	111.2	D158 A162 L163 V164 N298 D354	D158-R160 PolarHBondContact O-N 3.27Å; R160-A162 VanDerWaalsContact C-N 3.32Å; R160-A162 PolarHBondContact O-N 3.14Å; R160-L163 PolarHBondContact O-N 3.15Å; R160-V164 HydrophobicContact CG-CG2 3.89Å; R160-V164 WeakPolarHBondContact O-CB 3.43Å; R160-V164 VanDerWaalsContact O-CG2 3.26Å; R160-V164 WeakPolarHBondContact O-CG2 3.35Å; R160-V164 PolarHBondContact O-N 3.23Å; R160-N298 PolarHBondContact NH1-ND2 2.72Å; R160-N298 VanDerWaalsContact NH1-ND2 3.16Å; R160-N298 PolarHBondContact NH1-OD1 2.84Å; R160-D354 VanDerWaalsContact CZ-O 3.25Å; R160-D354 IonicContact CZ-OD2 3.06Å; R160-D354 PolarHBondContact NE-O 3.24Å; R160-D354 VanDerWaalsContact NH2-CB 3.34Å; R160-D354 PolarHBondContact NH2-O 2.82Å; R160-D354 IonicContact NH2-OD1 2.93Å; R160-D354 PolarHBondContact NH2-OD1 2.99Å; R160-D354 IonicContact NH2-OD2 3.82Å; R160-D354 PolarHBondContact NH2-OD2 2.95Å
161	Q	77.1	Confident	77.6	Confident	96 Å²	96	84.5 Å²	84.5	45%	0.449	38%	0.384	S	S	.	.	H	α-helix	trans	-64.8	-39.4	179.6	-168.6	167.5	6.4	0	0	111.6	D158 L163 S165	D158-Q161 PolarHBondContact O-N 3.24Å; Q161-L163 VanDerWaalsContact C-N 3.29Å; Q161-L163 PolarHBondContact O-N 3.37Å; Q161-S165 WeakPolarHBondContact O-CB 3.5Å; Q161-S165 PolarHBondContact O-N 3.06Å
162	A	81.7	Confident	78.9	Confident	27 Å²	27	72.4 Å²	72.4	22%	0.223	34%	0.339	C	S	.	.	H	α-helix	trans	-68.6	-23.5	175.9	0	0	0	0	0	113.4	R150 D158 R160 P166	R150-A162 VanDerWaalsContact CZ-O 3.31Å; R150-A162 VanDerWaalsContact NH1-C 3.26Å; R150-A162 PolarHBondContact NH1-O 2.84Å; R150-A162 PolarHBondContact NH2-O 3.47Å; D158-A162 WeakPolarHBondContact O-CB 3.27Å; D158-A162 PolarHBondContact O-N 3.17Å; R160-A162 VanDerWaalsContact C-N 3.32Å; R160-A162 PolarHBondContact O-N 3.14Å; A162-P166 WeakPolarHBondContact O-CD 3.41Å; A162-P166 WeakPolarHBondContact O-CG 3.22Å
163	L	85.4	Confident	80.3	Confident	28 Å²	28	69.4 Å²	69.4	15%	0.147	32%	0.321	C	S	.	.	H	α-helix	trans	-87.7	-48.9	175.3	-74.1	166.2	0	0	0	111.5	E144 R150 R159 R160 Q161 P166 L167	E144-L163 WeakPolarHBondContact O-CD2 3.38Å; R150-L163 VanDerWaalsContact CZ-CD2 3.49Å; R159-L163 HydrophobicContact CG-CD1 3.87Å; R159-L163 WeakPolarHBondContact O-CB 3.41Å; R159-L163 WeakPolarHBondContact O-CD1 3.48Å; R159-L163 WeakPolarHBondContact O-CG 3.43Å; R159-L163 PolarHBondContact O-N 3.07Å; R160-L163 PolarHBondContact O-N 3.15Å; Q161-L163 VanDerWaalsContact C-N 3.29Å; Q161-L163 PolarHBondContact O-N 3.37Å; L163-P166 WeakPolarHBondContact O-CD 3.5Å; L163-L167 WeakPolarHBondContact O-CB 3.46Å; L163-L167 PolarHBondContact O-N 3.01Å
164	V	89.9	Confident	81.9	Confident	8 Å²	8	59.7 Å²	59.7	5%	0.048	29%	0.288	C	S	.	.	H	α-helix	trans	-76.7	-33.3	-171	178.8	0	0	0	0	112.3	R160 L167 L168 L292	R160-V164 HydrophobicContact CG-CG2 3.89Å; R160-V164 WeakPolarHBondContact O-CB 3.43Å; R160-V164 VanDerWaalsContact O-CG2 3.26Å; R160-V164 WeakPolarHBondContact O-CG2 3.35Å; R160-V164 PolarHBondContact O-N 3.23Å; V164-L167 PolarHBondContact O-N 3.25Å; V164-L168 WeakPolarHBondContact O-CB 3.48Å; V164-L168 PolarHBondContact O-N 3.45Å; V164-L292 HydrophobicContact CB-CD1 4.21Å; V164-L292 HydrophobicContact CB-CD2 4.23Å; V164-L292 HydrophobicContact CG1-CD1 3.34Å; V164-L292 HydrophobicContact CG1-CD2 3.93Å; V164-L292 HydrophobicContact CG1-CG 4.29Å
165	S	92.3	Very high	83.7	Confident	13 Å²	13	58.1 Å²	58.1	9%	0.091	28%	0.278	C	S	.	.	H	α-helix	trans	-60.9	-56.6	177.8	169.1	0	0	0	0	111.4	Q161 L167 L168 D169 K194 H229	Q161-S165 WeakPolarHBondContact O-CB 3.5Å; Q161-S165 PolarHBondContact O-N 3.06Å; S165-L167 VanDerWaalsContact C-N 3.27Å; S165-L167 PolarHBondContact O-N 3.31Å; S165-L168 PolarHBondContact O-N 2.87Å; S165-D169 PolarHBondContact O-N 2.94Å; S165-K194 PolarHBondContact OG-NZ 3.34Å; S165-H229 PolarHBondContact O-NE2 3.35Å; S165-H229 PolarHBondContact OG-CE1 2.9Å
166	P	92.9	Very high	85.3	Confident	41 Å²	41	51.3 Å²	51.3	27%	0.266	25%	0.248	S	C	.	.	H	α-helix	trans	-61.3	-36.1	177.9	-23	34.3	0	0	0	113.2	E144 A162 L163 L168 D169 R170	E144-P166 HydrophobicContact CG-CB 4.38Å; A162-P166 WeakPolarHBondContact O-CD 3.41Å; A162-P166 WeakPolarHBondContact O-CG 3.22Å; L163-P166 WeakPolarHBondContact O-CD 3.5Å; P166-L168 PolarHBondContact O-N 3.13Å; P166-D169 PolarHBondContact O-N 3.21Å; P166-R170 WeakPolarHBondContact O-CG 3.34Å; P166-R170 PolarHBondContact O-N 3.03Å
167	L	93.6	Very high	87.1	Confident	9 Å²	9	47.7 Å²	47.7	5%	0.047	24%	0.235	C	C	.	.	H	α-helix	trans	-58.4	-47.7	175.7	173	62.9	0	0	0	111.7	C140 I141 E144 L163 V164 S165 R170 L171	C140-L167 HydrophobicContact CB-CD1 4.12Å; C140-L167 WeakPolarHBondContact O-CD1 3.44Å; I141-L167 HydrophobicContact CB-CD1 4.47Å; I141-L167 HydrophobicContact CG1-CD1 4.02Å; I141-L167 HydrophobicContact CG1-CD2 4.49Å; E144-L167 HydrophobicContact CB-CB 4.42Å; E144-L167 HydrophobicContact CG-CB 4.18Å; L163-L167 WeakPolarHBondContact O-CB 3.46Å; L163-L167 PolarHBondContact O-N 3.01Å; V164-L167 PolarHBondContact O-N 3.25Å; S165-L167 VanDerWaalsContact C-N 3.27Å; S165-L167 PolarHBondContact O-N 3.31Å; L167-R170 PolarHBondContact O-N 3.33Å; L167-L171 VanDerWaalsContact O-CB 3.23Å; L167-L171 WeakPolarHBondContact O-CB 3.18Å; L167-L171 PolarHBondContact O-N 2.69Å
168	L	95.4	Very high	89.1	Confident	5 Å²	5	46.3 Å²	46.3	3%	0.026	23%	0.232	C	C	.	.	H	α-helix	trans	-70.1	-35.9	-178	-172.9	58.2	0	0	0	111.6	V164 S165 P166 V172 H229 F290 L292 T353	V164-L168 WeakPolarHBondContact O-CB 3.48Å; V164-L168 PolarHBondContact O-N 3.45Å; S165-L168 PolarHBondContact O-N 2.87Å; P166-L168 PolarHBondContact O-N 3.13Å; L168-V172 HydrophobicContact CD1-CG2 4.3Å; L168-V172 VanDerWaalsContact O-CG2 3.27Å; L168-V172 WeakPolarHBondContact O-CG2 3.25Å; L168-V172 PolarHBondContact O-N 2.86Å; L168-V172 VanDerWaalsContact O-N 3.09Å; L168-H229 HydrophobicContact CD2-CB 4.38Å; L168-H229 WeakPolarHBondContact CD2-CD2 3.38Å; L168-F290 HydrophobicContact CD1-CD1 4.32Å; L168-F290 HydrophobicContact CD2-CB 4.41Å; L168-L292 HydrophobicContact CD2-CB 4.22Å; L168-T353 HydrophobicContact CD1-CG2 4.15Å; L168-T353 HydrophobicContact CD2-CG2 3.64Å
169	D	95.1	Very high	90.5	Very high	36 Å²	36	42.3 Å²	42.3	19%	0.193	21%	0.211	C	C	.	.	H	α-helix	trans	-57.7	-50.9	171.1	-68.7	-36.4	0	0	0	110.8	S165 P166 V172 E173 H229 N230	S165-D169 PolarHBondContact O-N 2.94Å; P166-D169 PolarHBondContact O-N 3.21Å; D169-V172 PolarHBondContact O-N 2.84Å; D169-E173 WeakPolarHBondContact O-CB 3.05Å; D169-E173 PolarHBondContact O-N 3.5Å; D169-H229 VanDerWaalsContact CG-NE2 3.32Å; D169-H229 IonicContact OD1-CD2 2.62Å; D169-H229 IonicContact OD1-CE1 2.69Å; D169-H229 PolarHBondContact OD1-CE1 2.96Å; D169-H229 IonicContact OD1-NE2 3.45Å; D169-H229 PolarHBondContact OD1-NE2 3.1Å; D169-H229 IonicContact OD2-CE1 2.67Å; D169-H229 PolarHBondContact OD2-CE1 2.79Å; D169-H229 IonicContact OD2-NE2 3.83Å; D169-N230 PolarHBondContact OD1-ND2 3.25Å; D169-N230 PolarHBondContact OD1-OD1 3.28Å; D169-N230 VanDerWaalsContact OD1-OD1 3.12Å
170	R	95.3	Very high	91.9	Very high	112 Å²	112	37.8 Å²	37.8	42%	0.423	20%	0.199	S	C	.	.	H	α-helix	trans	-67.9	-39.5	179.9	-68.8	-63.8	-178	-166.5	6.1	113.7	P166 L167 V172 E173 T174	P166-R170 WeakPolarHBondContact O-CG 3.34Å; P166-R170 PolarHBondContact O-N 3.03Å; L167-R170 PolarHBondContact O-N 3.33Å; R170-V172 VanDerWaalsContact C-N 3.34Å; R170-V172 PolarHBondContact O-N 3.04Å; R170-E173 IonicContact CZ-OE2 3.73Å; R170-E173 IonicContact NH1-OE1 3.67Å; R170-E173 IonicContact NH1-OE2 2.73Å; R170-E173 PolarHBondContact NH1-OE2 3.32Å; R170-E173 PolarHBondContact O-N 3.43Å; R170-T174 VanDerWaalsContact O-CB 3.26Å; R170-T174 WeakPolarHBondContact O-CB 3.3Å; R170-T174 PolarHBondContact O-N 3.49Å; R170-T174 PolarHBondContact O-OG1 2.75Å
171	L	95.8	Very high	92.9	Very high	3 Å²	3	39.9 Å²	39.9	2%	0.016	22%	0.221	C	C	.	.	H	α-helix	trans	-59.9	-47.7	177	-177.3	156.1	0	0	0	110.3	V137 L167 L175	V137-L171 HydrophobicContact CG1-CD1 4.15Å; L167-L171 VanDerWaalsContact O-CB 3.23Å; L167-L171 WeakPolarHBondContact O-CB 3.18Å; L167-L171 PolarHBondContact O-N 2.69Å; L171-L175 HydrophobicContact CD2-CD1 3.5Å; L171-L175 VanDerWaalsContact CD2-CD1 3.5Å; L171-L175 HydrophobicContact CD2-CG 4.33Å; L171-L175 HydrophobicContact CG-CD1 4.2Å; L171-L175 WeakPolarHBondContact O-CB 3.46Å; L171-L175 VanDerWaalsContact O-CG 3.26Å; L171-L175 WeakPolarHBondContact O-CG 3Å; L171-L175 PolarHBondContact O-N 3.07Å
172	V	96.4	Very high	93.6	Very high	0 Å²	0	37.5 Å²	37.5	0%	0	21%	0.211	C	C	.	.	H	α-helix	trans	-66.8	-46.1	-179.9	175.1	0	0	0	0	110.8	L168 D169 R170 T174 L175 V176 L191 N230 F290	L168-V172 HydrophobicContact CD1-CG2 4.3Å; L168-V172 VanDerWaalsContact O-CG2 3.27Å; L168-V172 WeakPolarHBondContact O-CG2 3.25Å; L168-V172 PolarHBondContact O-N 2.86Å; L168-V172 VanDerWaalsContact O-N 3.09Å; D169-V172 PolarHBondContact O-N 2.84Å; R170-V172 VanDerWaalsContact C-N 3.34Å; R170-V172 PolarHBondContact O-N 3.04Å; V172-T174 PolarHBondContact O-N 2.56Å; V172-L175 PolarHBondContact O-N 2.91Å; V172-V176 HydrophobicContact CG1-CG2 4.12Å; V172-V176 VanDerWaalsContact O-CB 3.3Å; V172-V176 WeakPolarHBondContact O-CB 3.19Å; V172-V176 WeakPolarHBondContact O-CG2 3.3Å; V172-V176 PolarHBondContact O-N 2.87Å; V172-L191 HydrophobicContact CG1-CD1 3.78Å; V172-L191 HydrophobicContact CG1-CD2 4.46Å; V172-N230 HydrophobicContact CG1-CB 4.45Å; V172-F290 HydrophobicContact CG1-CD2 4.22Å; V172-F290 HydrophobicContact CG1-CE2 3.94Å; V172-F290 HydrophobicContact CG2-CD1 3.84Å; V172-F290 HydrophobicContact CG2-CD2 3.71Å; V172-F290 HydrophobicContact CG2-CE1 3.89Å; V172-F290 HydrophobicContact CG2-CE2 3.77Å; V172-F290 HydrophobicContact CG2-CG 3.75Å; V172-F290 HydrophobicContact CG2-CZ 3.86Å
173	E	96.2	Very high	94.1	Very high	84 Å²	84	36.2 Å²	36.2	39%	0.393	20%	0.201	S	C	.	.	H	α-helix	trans	-57.7	-48	178	-174.3	-177.3	-171.9	0	0	112	D169 R170 S177	D169-E173 WeakPolarHBondContact O-CB 3.05Å; D169-E173 PolarHBondContact O-N 3.5Å; R170-E173 IonicContact CZ-OE2 3.73Å; R170-E173 IonicContact NH1-OE1 3.67Å; R170-E173 IonicContact NH1-OE2 2.73Å; R170-E173 PolarHBondContact NH1-OE2 3.32Å; R170-E173 PolarHBondContact O-N 3.43Å; E173-S177 WeakPolarHBondContact O-CB 3.37Å; E173-S177 PolarHBondContact O-N 3.07Å; E173-S177 PolarHBondContact O-OG 3.35Å
174	T	96.7	Very high	94.5	Very high	40 Å²	40	38.7 Å²	38.7	25%	0.245	22%	0.219	C	C	.	.	H	α-helix	trans	-64.9	-47.6	179.4	-60.5	0	0	0	0	111.6	A136 R170 V172 S177 L178	A136-T174 HydrophobicContact CB-CG2 3.98Å; R170-T174 VanDerWaalsContact O-CB 3.26Å; R170-T174 WeakPolarHBondContact O-CB 3.3Å; R170-T174 PolarHBondContact O-N 3.49Å; R170-T174 PolarHBondContact O-OG1 2.75Å; V172-T174 PolarHBondContact O-N 2.56Å; T174-S177 PolarHBondContact O-N 2.82Å; T174-L178 HydrophobicContact CG2-CD1 3.79Å; T174-L178 HydrophobicContact CG2-CG 4.35Å; T174-L178 WeakPolarHBondContact O-CB 3.3Å; T174-L178 VanDerWaalsContact O-CG 3.29Å; T174-L178 WeakPolarHBondContact O-CG 3.32Å; T174-L178 PolarHBondContact O-N 3.19Å
175	L	96.5	Very high	94.6	Very high	0 Å²	0	39.3 Å²	39.3	0%	0	22%	0.224	C	C	.	.	H	α-helix	trans	-64.8	-43.3	179.3	-70.8	179.7	0	0	0	111.9	L133 V137 L171 V172 S177 L178 L179 L409 I412 L416	L133-L175 HydrophobicContact CD2-CD2 4.01Å; V137-L175 HydrophobicContact CG2-CD2 3.99Å; V137-L175 HydrophobicContact CG2-CG 4.46Å; L171-L175 HydrophobicContact CD2-CD1 3.5Å; L171-L175 VanDerWaalsContact CD2-CD1 3.5Å; L171-L175 HydrophobicContact CD2-CG 4.33Å; L171-L175 HydrophobicContact CG-CD1 4.2Å; L171-L175 WeakPolarHBondContact O-CB 3.46Å; L171-L175 VanDerWaalsContact O-CG 3.26Å; L171-L175 WeakPolarHBondContact O-CG 3Å; L171-L175 PolarHBondContact O-N 3.07Å; V172-L175 PolarHBondContact O-N 2.91Å; L175-S177 VanDerWaalsContact C-N 3.29Å; L175-S177 PolarHBondContact O-N 2.89Å; L175-L178 PolarHBondContact O-N 2.8Å; L175-L179 VanDerWaalsContact O-CB 3.27Å; L175-L179 WeakPolarHBondContact O-CB 3.24Å; L175-L179 WeakPolarHBondContact O-CG 3.26Å; L175-L179 PolarHBondContact O-N 2.89Å; L175-L409 HydrophobicContact CD2-CD1 4.26Å; L175-I412 HydrophobicContact CD1-CG2 3.61Å; L175-L416 HydrophobicContact CB-CD1 3.79Å; L175-L416 HydrophobicContact CD1-CD1 4.26Å
176	V	95.9	Very high	94.7	Very high	19 Å²	19	39 Å²	39	12%	0.115	22%	0.221	C	C	.	.	H	α-helix	trans	-57.9	-46.1	175.7	168.4	0	0	0	0	110.1	V172 L179 V180 L186 I232	V172-V176 HydrophobicContact CG1-CG2 4.12Å; V172-V176 VanDerWaalsContact O-CB 3.3Å; V172-V176 WeakPolarHBondContact O-CB 3.19Å; V172-V176 WeakPolarHBondContact O-CG2 3.3Å; V172-V176 PolarHBondContact O-N 2.87Å; V176-L179 PolarHBondContact O-N 2.88Å; V176-V180 WeakPolarHBondContact O-CG2 3.42Å; V176-V180 PolarHBondContact O-N 2.95Å; V176-L186 HydrophobicContact CG1-CB 4.31Å; V176-I232 HydrophobicContact CG2-CD1 3.75Å
177	S	95.6	Very high	94.8	Very high	75 Å²	75	40.1 Å²	40.1	52%	0.524	23%	0.234	S	C	.	.	H	α-helix	trans	-63.2	-44.2	-179.9	-56.2	0	0	0	0	112.8	E173 T174 L175 L179	E173-S177 WeakPolarHBondContact O-CB 3.37Å; E173-S177 PolarHBondContact O-N 3.07Å; E173-S177 PolarHBondContact O-OG 3.35Å; T174-S177 PolarHBondContact O-N 2.82Å; L175-S177 VanDerWaalsContact C-N 3.29Å; L175-S177 PolarHBondContact O-N 2.89Å; S177-L179 VanDerWaalsContact C-N 3.33Å; S177-L179 PolarHBondContact O-N 3.37Å
178	L	95.9	Very high	94.8	Very high	85 Å²	85	44.3 Å²	44.3	45%	0.445	26%	0.261	S	S	.	.	H	α-helix	trans	-72	-26.7	-179.2	-68.1	175.3	0	0	0	113.1	L133 A136 T174 L175 P181	L133-L178 HydrophobicContact CD2-CB 3.94Å; L133-L178 HydrophobicContact CD2-CD1 3.84Å; A136-L178 HydrophobicContact CB-CD1 3.82Å; T174-L178 HydrophobicContact CG2-CD1 3.79Å; T174-L178 HydrophobicContact CG2-CG 4.35Å; T174-L178 WeakPolarHBondContact O-CB 3.3Å; T174-L178 VanDerWaalsContact O-CG 3.29Å; T174-L178 WeakPolarHBondContact O-CG 3.32Å; T174-L178 PolarHBondContact O-N 3.19Å; L175-L178 PolarHBondContact O-N 2.8Å; L178-P181 WeakPolarHBondContact O-CD 3.13Å
179	L	95.4	Very high	94.9	Very high	1 Å²	1	45.2 Å²	45.2	1%	0.005	27%	0.268	C	S	.	.	H	α-helix	trans	-91.3	-8.8	-178.5	-64	174.5	0	0	0	113.7	L128 L133 L175 V176 S177 P181 L182 N183 L186 V413 L416 L417	L128-L179 HydrophobicContact CD1-CD2 4.14Å; L133-L179 HydrophobicContact CD1-CD2 4.37Å; L175-L179 VanDerWaalsContact O-CB 3.27Å; L175-L179 WeakPolarHBondContact O-CB 3.24Å; L175-L179 WeakPolarHBondContact O-CG 3.26Å; L175-L179 PolarHBondContact O-N 2.89Å; V176-L179 PolarHBondContact O-N 2.88Å; S177-L179 VanDerWaalsContact C-N 3.33Å; S177-L179 PolarHBondContact O-N 3.37Å; L179-P181 VanDerWaalsContact C-CD 3.47Å; L179-L182 HydrophobicContact CD2-CD1 4.15Å; L179-L182 CarbonylContact O-C 3.6Å; L179-L182 WeakPolarHBondContact O-CA 3.42Å; L179-L182 PolarHBondContact O-N 3.09Å; L179-N183 PolarHBondContact O-N 3.19Å; L179-L186 HydrophobicContact CB-CD1 3.98Å; L179-V413 HydrophobicContact CD1-CG1 4.13Å; L179-V413 HydrophobicContact CD1-CG2 4.39Å; L179-V413 HydrophobicContact CD2-CG1 3.83Å; L179-L416 HydrophobicContact CD1-CB 3.59Å; L179-L416 HydrophobicContact CD1-CD1 3.74Å; L179-L416 HydrophobicContact CD1-CG 4.33Å; L179-L417 HydrophobicContact CD2-CD2 4.21Å
180	V	94.8	Very high	95	Very high	45 Å²	45	44.7 Å²	44.7	27%	0.273	27%	0.27	S	S	.	.	T	Hydrogen-bonded Turn	trans	-51.2	-44.7	176.2	163.8	0	0	0	0	113.5	V176 L182 N183 L186 A187	V176-V180 WeakPolarHBondContact O-CG2 3.42Å; V176-V180 PolarHBondContact O-N 2.95Å; V180-L182 PolarHBondContact O-N 3.23Å; V180-N183 CarbonylContact O-C 3.5Å; V180-N183 PolarHBondContact O-N 3.5Å; V180-L186 HydrophobicContact CG2-CB 4.17Å; V180-A187 HydrophobicContact CG1-CB 3.69Å; V180-A187 HydrophobicContact CG2-CB 4.33Å
181	P	93.2	Very high	95.1	Very high	111 Å²	111	42.5 Å²	42.5	72%	0.721	27%	0.266	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62	-29.3	177.8	-23.3	34.9	0	0	0	113.3	L178 L179	L178-P181 WeakPolarHBondContact O-CD 3.13Å; L179-P181 VanDerWaalsContact C-CD 3.47Å
182	L	91.8	Very high	95.1	Very high	45 Å²	45	43.3 Å²	43.3	24%	0.236	27%	0.27	C	S	.	.	T	Hydrogen-bonded Turn	trans	-87.9	-29	178.8	-60.3	-179.8	0	0	0	112.1	P126 L128 L179 V180 L417 K419	P126-L182 HydrophobicContact CB-CD2 4.13Å; P126-L182 HydrophobicContact CG-CD2 4.44Å; L128-L182 HydrophobicContact CD1-CD1 3.53Å; L179-L182 HydrophobicContact CD2-CD1 4.15Å; L179-L182 CarbonylContact O-C 3.6Å; L179-L182 WeakPolarHBondContact O-CA 3.42Å; L179-L182 PolarHBondContact O-N 3.09Å; V180-L182 PolarHBondContact O-N 3.23Å; L182-L417 HydrophobicContact CB-CD2 3.63Å; L182-L417 HydrophobicContact CD1-CD2 4.28Å; L182-K419 WeakPolarHBondContact O-CE 3.34Å; L182-K419 PolarHBondContact O-NZ 3.46Å
183	N	92.9	Very high	95.1	Very high	1 Å²	1	46.7 Å²	46.7	1%	0.005	29%	0.293	C	S	.	.			trans	-134.6	93.9	179.2	-171.7	3.5	0	0	0	111.8	L179 V180 A185 L186 L416 L417 N418 K419	L179-N183 PolarHBondContact O-N 3.19Å; V180-N183 CarbonylContact O-C 3.5Å; V180-N183 PolarHBondContact O-N 3.5Å; N183-A185 PolarHBondContact O-N 3.08Å; N183-A185 VanDerWaalsContact O-N 3.15Å; N183-A185 WeakPolarHBondContact OD1-CB 3.37Å; N183-A185 PolarHBondContact OD1-N 3.19Å; N183-L186 HydrophobicContact CB-CD1 4.11Å; N183-L186 HydrophobicContact CB-CG 4.13Å; N183-L186 WeakPolarHBondContact O-CB 3.43Å; N183-L186 PolarHBondContact O-N 2.92Å; N183-L186 VanDerWaalsContact O-N 3.07Å; N183-L416 PolarHBondContact ND2-O 3.47Å; N183-L417 HydrophobicContact CB-CD2 4.21Å; N183-N418 PolarHBondContact ND2-O 2.9Å; N183-K419 WeakPolarHBondContact OD1-CG 3.29Å
184	P	92.3	Very high	95	Very high	80 Å²	80	47.1 Å²	47.1	52%	0.519	29%	0.294	S	S	.	.	G	3₁₀ helix	trans	-66.3	-18.4	-177.8	27	-34.8	0	0	0	113.4	L186 A187	P184-L186 PolarHBondContact O-N 3.19Å; P184-A187 WeakPolarHBondContact O-CB 3.49Å; P184-A187 PolarHBondContact O-N 2.57Å; P184-A187 VanDerWaalsContact O-N 3.12Å
185	A	93.1	Very high	95	Very high	20 Å²	20	51.6 Å²	51.6	17%	0.165	31%	0.306	C	S	.	.	G	3₁₀ helix	trans	-62.5	-25.1	174.3	0	0	0	0	0	112.3	N183 A189	N183-A185 PolarHBondContact O-N 3.08Å; N183-A185 VanDerWaalsContact O-N 3.15Å; N183-A185 WeakPolarHBondContact OD1-CB 3.37Å; N183-A185 PolarHBondContact OD1-N 3.19Å; A185-A189 WeakPolarHBondContact O-CB 3.41Å; A185-A189 PolarHBondContact O-N 2.87Å
186	L	94.4	Very high	95.1	Very high	6 Å²	6	54.1 Å²	54.1	3%	0.031	32%	0.322	C	S	.	.	G	3₁₀ helix	trans	-74.5	-27	176.3	-63.4	-178.6	0	0	0	112.9	V176 L179 V180 N183 P184 T188 A189 I232	V176-L186 HydrophobicContact CG1-CB 4.31Å; L179-L186 HydrophobicContact CB-CD1 3.98Å; V180-L186 HydrophobicContact CG2-CB 4.17Å; N183-L186 HydrophobicContact CB-CD1 4.11Å; N183-L186 HydrophobicContact CB-CG 4.13Å; N183-L186 WeakPolarHBondContact O-CB 3.43Å; N183-L186 PolarHBondContact O-N 2.92Å; N183-L186 VanDerWaalsContact O-N 3.07Å; P184-L186 PolarHBondContact O-N 3.19Å; L186-T188 VanDerWaalsContact C-N 3.32Å; L186-T188 PolarHBondContact O-N 2.86Å; L186-A189 WeakPolarHBondContact O-CB 3.26Å; L186-A189 PolarHBondContact O-N 2.85Å; L186-I232 HydrophobicContact CD2-CG2 4.29Å
187	A	94.4	Very high	95.2	Very high	65 Å²	65	53.2 Å²	53.2	54%	0.537	32%	0.317	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.3	-33.5	178.3	0	0	0	0	0	112.6	V180 P184	V180-A187 HydrophobicContact CG1-CB 3.69Å; V180-A187 HydrophobicContact CG2-CB 4.33Å; P184-A187 WeakPolarHBondContact O-CB 3.49Å; P184-A187 PolarHBondContact O-N 2.57Å; P184-A187 VanDerWaalsContact O-N 3.12Å
188	T	94.5	Very high	95.3	Very high	98 Å²	98	50.6 Å²	50.6	60%	0.601	30%	0.297	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.8	2.3	177.6	58.1	0	0	0	0	112.8	L186	L186-T188 VanDerWaalsContact C-N 3.32Å; L186-T188 PolarHBondContact O-N 2.86Å
189	A	96.5	Very high	95.4	Very high	23 Å²	23	46.7 Å²	46.7	19%	0.19	28%	0.276	C	S	.	.			trans	-73.9	146.6	179.3	0	0	0	0	0	111.7	A185 L186 I232 R233 I234	A185-A189 WeakPolarHBondContact O-CB 3.41Å; A185-A189 PolarHBondContact O-N 2.87Å; L186-A189 WeakPolarHBondContact O-CB 3.26Å; L186-A189 PolarHBondContact O-N 2.85Å; A189-I232 HydrophobicContact CB-CG2 3.77Å; A189-R233 CarbonylContact C-O 3.54Å; A189-R233 VanDerWaalsContact CA-O 3.27Å; A189-R233 WeakPolarHBondContact CA-O 3.46Å; A189-R233 WeakPolarHBondContact CB-O 3.32Å; A189-I234 HydrophobicContact CB-CG2 3.77Å
190	A	97.1	Very high	95.6	Very high	26 Å²	26	47.5 Å²	47.5	22%	0.215	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90	115.2	168.9	0	0	0	0	0	109.6	R233 C283	A190-R233 HydrophobicContact CB-CB 4.39Å; A190-R233 PolarHBondContact N-O 2.85Å; A190-R233 PolarHBondContact O-N 2.86Å; A190-C283 HydrophobicContact CB-CB 4.32Å
191	L	97.4	Very high	95.8	Very high	66 Å²	66	46 Å²	46	35%	0.346	27%	0.269	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.6	113.3	170.9	179.7	63.4	0	0	0	109.5	V172 N230 I232	V172-L191 HydrophobicContact CG1-CD1 3.78Å; V172-L191 HydrophobicContact CG1-CD2 4.46Å; L191-N230 HydrophobicContact CD1-CB 4.41Å; L191-I232 HydrophobicContact CD1-CG1 3.87Å
192	D	96.6	Very high	96	Very high	19 Å²	19	43.2 Å²	43.2	10%	0.102	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107	130.9	179.9	-71.5	-39.4	0	0	0	111	R195 N230 Q231 R233	D192-R195 HydrophobicContact CB-CB 4.11Å; D192-R195 HydrophobicContact CB-CG 3.59Å; D192-N230 CarbonylContact O-C 3.59Å; D192-N230 WeakPolarHBondContact O-CA 3.38Å; D192-Q231 HydrophobicContact CB-CG 3.61Å; D192-Q231 PolarHBondContact N-O 3.11Å; D192-Q231 PolarHBondContact O-N 3.11Å; D192-Q231 PolarHBondContact OD2-NE2 3.03Å; D192-R233 IonicContact OD1-NH2 3.91Å; D192-R233 PolarHBondContact OD1-NH2 2.96Å; D192-R233 IonicContact OD2-CZ 3.21Å; D192-R233 VanDerWaalsContact OD2-CZ 3.31Å; D192-R233 IonicContact OD2-NE 3.83Å; D192-R233 PolarHBondContact OD2-NE 2.93Å; D192-R233 IonicContact OD2-NH2 3.75Å; D192-R233 PolarHBondContact OD2-NH2 2.89Å; D192-R233 VanDerWaalsContact OD2-NH2 3.07Å
193	C	95.4	Very high	96.3	Very high	71 Å²	71	43.3 Å²	43.3	48%	0.48	25%	0.245	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.9	127.3	172.1	-57	0	0	0	0	110.7	R195 N230	C193-R195 PolarHBondContact O-N 3.11Å; C193-R195 VanDerWaalsContact O-N 3.12Å; C193-N230 PolarHBondContact SG-OD1 3.3Å
194	K	95.1	Very high	96.3	Very high	94 Å²	94	44.4 Å²	44.4	41%	0.409	26%	0.256	S	S	.	.	S	Bend	trans	54.5	34.3	170.1	-64.5	174.8	-175	165.9	0	113.4	S165 K227 P228 H229	S165-K194 PolarHBondContact OG-NZ 3.34Å; K194-K227 WeakPolarHBondContact O-CE 3.48Å; K194-P228 WeakPolarHBondContact CA-O 3.23Å; K194-H229 VanDerWaalsContact CE-CE1 3.42Å; K194-H229 WeakPolarHBondContact CE-CE1 3.26Å; K194-H229 WeakPolarHBondContact CE-ND1 3.26Å; K194-H229 PolarHBondContact N-O 2.86Å
195	R	96.7	Very high	96.5	Very high	134 Å²	134	44.4 Å²	44.4	51%	0.506	25%	0.249	S	C	.	.			trans	-81.9	140.8	174.4	-71.4	-65.7	-174	166.9	-0.3	110.6	D192 C193 P228	D192-R195 HydrophobicContact CB-CB 4.11Å; D192-R195 HydrophobicContact CB-CG 3.59Å; C193-R195 PolarHBondContact O-N 3.11Å; C193-R195 VanDerWaalsContact O-N 3.12Å; R195-P228 WeakPolarHBondContact O-CD 3.19Å
196	P	97.6	Very high	96.6	Very high	52 Å²	52	45.3 Å²	45.3	34%	0.338	25%	0.25	S	C	.	.			trans	-72.4	151.7	178	30.2	-33	0	0	0	111.1	D226 F274	P196-D226 CarbonylContact C-O 3.6Å; P196-D226 VanDerWaalsContact CA-O 3.27Å; P196-D226 WeakPolarHBondContact CA-O 3.47Å; P196-F274 HydrophobicContact CG-CD1 4.06Å; P196-F274 HydrophobicContact CG-CE1 3.92Å; P196-F274 WeakPolarHBondContact O-CD1 3.22Å; P196-F274 WeakPolarHBondContact O-CE1 3.31Å
197	V	98.2	Very high	96.6	Very high	0 Å²	0	48.5 Å²	48.5	0%	0	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.8	121.1	170.6	176.5	0	0	0	0	107.8	D226 P228 Q231 F274 W326	V197-D226 PolarHBondContact N-O 3.49Å; V197-D226 PolarHBondContact O-N 3.17Å; V197-P228 HydrophobicContact CG2-CG 3.99Å; V197-Q231 VanDerWaalsContact CG2-OE1 3.24Å; V197-F274 CarbonylContact C-O 3.51Å; V197-F274 WeakPolarHBondContact CA-O 3.46Å; V197-W326 HydrophobicContact CG1-CB 4.12Å; V197-W326 HydrophobicContact CG1-CG 4.29Å
198	D	98.3	Very high	96.7	Very high	21 Å²	21	46.6 Å²	46.6	11%	0.112	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	141.2	-174.1	-66.1	-20.4	0	0	0	110.8	I224 N225 T272 I273 F274	D198-I224 VanDerWaalsContact CA-O 3.3Å; D198-I224 WeakPolarHBondContact CA-O 3.31Å; D198-N225 VanDerWaalsContact OD1-CA 3.3Å; D198-N225 WeakPolarHBondContact OD1-CA 3.33Å; D198-N225 PolarHBondContact OD1-OD1 3.35Å; D198-T272 VanDerWaalsContact CB-OG1 3.24Å; D198-T272 WeakPolarHBondContact CB-OG1 3.3Å; D198-T272 VanDerWaalsContact OD2-CB 3.26Å; D198-T272 WeakPolarHBondContact OD2-CB 3.34Å; D198-T272 PolarHBondContact OD2-OG1 2.51Å; D198-I273 CarbonylContact O-C 3.59Å; D198-I273 WeakPolarHBondContact O-CA 3.38Å; D198-F274 HydrophobicContact CB-CB 4.16Å; D198-F274 PolarHBondContact N-O 3.27Å; D198-F274 PolarHBondContact O-N 3.03Å
199	F	98.7	Very high	96.7	Very high	3 Å²	3	45.9 Å²	45.9	1%	0.013	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.9	133.6	174.6	-170.7	-120	0	0	0	112.5	W201 Q223 I224 I273 F324 A325 G328 A329 M332 L368	F199-W201 HydrophobicContact CD1-CB 4.47Å; F199-W201 HydrophobicContact CD1-CD2 4.17Å; F199-W201 AromaticContact CD1-CE3 3.51Å; F199-W201 HydrophobicContact CD1-CE3 3.51Å; F199-W201 HydrophobicContact CD1-CZ3 4.11Å; F199-W201 HydrophobicContact CE1-CB 3.82Å; F199-W201 HydrophobicContact CE1-CD2 4.16Å; F199-W201 AromaticContact CE1-CE3 3.96Å; F199-W201 HydrophobicContact CE1-CE3 3.96Å; F199-W201 HydrophobicContact CE1-CG 4.14Å; F199-W201 HydrophobicContact CG-CE3 4.4Å; F199-W201 HydrophobicContact CZ-CB 4.24Å; F199-Q223 WeakPolarHBondContact O-CA 3.39Å; F199-Q223 PolarHBondContact O-NE2 3.3Å; F199-I224 PolarHBondContact N-O 3.29Å; F199-I224 PolarHBondContact O-N 3.19Å; F199-I273 HydrophobicContact CD2-CG2 4.16Å; F199-F324 HydrophobicContact CD1-CD1 4.17Å; F199-F324 AromaticContact CD1-CE1 3.66Å; F199-F324 HydrophobicContact CD1-CE1 3.66Å; F199-F324 HydrophobicContact CD1-CZ 4.2Å; F199-F324 HydrophobicContact CE1-CD1 4.38Å; F199-F324 AromaticContact CE1-CE1 3.57Å; F199-F324 HydrophobicContact CE1-CE1 3.57Å; F199-F324 HydrophobicContact CE1-CE2 4.43Å; F199-F324 AromaticContact CE1-CZ 3.62Å; F199-F324 HydrophobicContact CE1-CZ 3.62Å; F199-A325 HydrophobicContact CB-CB 3.69Å; F199-G328 WeakPolarHBondContact CE2-O 3.48Å; F199-A329 HydrophobicContact CD2-CB 4.22Å; F199-M332 HydrophobicContact CE2-CG 4.06Å; F199-M332 HydrophobicContact CE2-SD 3.78Å; F199-L368 HydrophobicContact CZ-CD2 4Å
200	Y	98.7	Very high	96.6	Very high	17 Å²	17	48.1 Å²	48.1	7%	0.067	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	127.4	179.7	173.1	-104.2	0	0	0	110.4	K89 L202 R221 Y222 N271	K89-Y200 HydrophobicContact CD-CD2 4.17Å; K89-Y200 HydrophobicContact CD-CE2 4.13Å; Y200-L202 HydrophobicContact CE1-CD1 4.02Å; Y200-R221 HydrophobicContact CE2-CB 4.02Å; Y200-R221 HydrophobicContact CE2-CG 4.46Å; Y200-Y222 WeakPolarHBondContact CD2-O 3.47Å; Y200-N271 HydrophobicContact CD1-CB 4.29Å; Y200-N271 HydrophobicContact CD2-CB 4.14Å; Y200-N271 HydrophobicContact CG-CB 4Å
201	W	98.4	Very high	96.6	Very high	13 Å²	13	49.6 Å²	49.6	5%	0.049	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.8	172.6	177.1	77	104.7	0	0	0	112.6	V92 F108 T109 F199 Y222 I224 F324 L370	V92-W201 HydrophobicContact CB-CH2 4.47Å; V92-W201 HydrophobicContact CG2-CH2 4.16Å; F108-W201 PolarHBondContact O-NE1 2.89Å; F108-W201 VanDerWaalsContact O-NE1 3.15Å; T109-W201 HydrophobicContact CG2-CZ2 4.33Å; F199-W201 HydrophobicContact CD1-CB 4.47Å; F199-W201 HydrophobicContact CD1-CD2 4.17Å; F199-W201 AromaticContact CD1-CE3 3.51Å; F199-W201 HydrophobicContact CD1-CE3 3.51Å; F199-W201 HydrophobicContact CD1-CZ3 4.11Å; F199-W201 HydrophobicContact CE1-CB 3.82Å; F199-W201 HydrophobicContact CE1-CD2 4.16Å; F199-W201 AromaticContact CE1-CE3 3.96Å; F199-W201 HydrophobicContact CE1-CE3 3.96Å; F199-W201 HydrophobicContact CE1-CG 4.14Å; F199-W201 HydrophobicContact CG-CE3 4.4Å; F199-W201 HydrophobicContact CZ-CB 4.24Å; W201-Y222 HydrophobicContact CH2-CG 4.49Å; W201-Y222 VanDerWaalsContact CZ2-CB 3.44Å; W201-Y222 AromaticContact CZ2-CG 3.96Å; W201-Y222 HydrophobicContact CZ2-CG 3.96Å; W201-Y222 PolarHBondContact N-O 2.67Å; W201-Y222 VanDerWaalsContact N-O 3.16Å; W201-Y222 PolarHBondContact O-N 3.02Å; W201-I224 HydrophobicContact CH2-CD1 3.4Å; W201-I224 VanDerWaalsContact CH2-CD1 3.4Å; W201-I224 HydrophobicContact CH2-CG1 3.6Å; W201-I224 HydrophobicContact CZ2-CD1 4.5Å; W201-I224 HydrophobicContact CZ3-CB 4.27Å; W201-I224 HydrophobicContact CZ3-CD1 3.63Å; W201-I224 HydrophobicContact CZ3-CG1 3.66Å; W201-F324 AromaticContact CD2-CE1 3.66Å; W201-F324 HydrophobicContact CD2-CE1 3.66Å; W201-F324 HydrophobicContact CD2-CZ 4.17Å; W201-F324 AromaticContact CE2-CE1 3.59Å; W201-F324 AromaticContact CE3-CE1 3.88Å; W201-F324 HydrophobicContact CE3-CE1 3.88Å; W201-F324 HydrophobicContact CG-CE1 4.21Å; W201-F324 HydrophobicContact CG-CZ 4.24Å; W201-F324 HydrophobicContact CH2-CD1 4.44Å; W201-F324 HydrophobicContact CH2-CE1 4.04Å; W201-F324 HydrophobicContact CZ2-CD1 4.46Å; W201-F324 AromaticContact CZ2-CE1 3.8Å; W201-F324 HydrophobicContact CZ2-CE1 3.8Å; W201-F324 HydrophobicContact CZ3-CE1 4.07Å; W201-L370 HydrophobicContact CG-CD1 4.45Å
202	L	97.9	Very high	96.5	Very high	54 Å²	54	54.9 Å²	54.9	28%	0.283	31%	0.308	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	136.2	177.3	-63.3	90.1	0	0	0	109.7	Y200 A219 L220 R221 L370 T371	Y200-L202 HydrophobicContact CE1-CD1 4.02Å; L202-A219 HydrophobicContact CD2-CB 3.78Å; L202-L220 WeakPolarHBondContact CA-O 3.5Å; L202-R221 HydrophobicContact CD2-CG 4.14Å; L202-R221 HydrophobicContact CG-CG 4.19Å; L202-L370 CarbonylContact O-C 3.56Å; L202-L370 WeakPolarHBondContact O-CB 3.45Å; L202-T371 HydrophobicContact CB-CG2 4.2Å
203	R	97	Very high	96.4	Very high	47 Å²	47	57.8 Å²	57.8	18%	0.177	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.6	110.8	177.6	178.5	69.8	180	160.8	1.5	111	G107 F108 L220 Y222 L370 D375	G107-R203 PolarHBondContact O-NE 3.48Å; F108-R203 WeakPolarHBondContact O-CG 3.34Å; R203-L220 PolarHBondContact N-O 3.32Å; R203-L220 WeakPolarHBondContact O-CB 3.44Å; R203-Y222 HydrophobicContact CB-CD2 4.16Å; R203-Y222 HydrophobicContact CB-CE2 3.84Å; R203-Y222 WeakPolarHBondContact O-CE2 3.24Å; R203-L370 WeakPolarHBondContact CD-O 3.43Å; R203-L370 PolarHBondContact NH1-O 3.08Å; R203-D375 IonicContact CZ-OD2 3.07Å; R203-D375 IonicContact NH1-OD1 3.97Å; R203-D375 IonicContact NH1-OD2 3.88Å; R203-D375 PolarHBondContact NH1-OD2 2.79Å; R203-D375 IonicContact NH2-OD2 3.83Å; R203-D375 PolarHBondContact NH2-OD2 3.36Å; R203-D375 VanDerWaalsContact NH2-OD2 3.13Å
204	G	95	Very high	96.4	Very high	23 Å²	23	61.5 Å²	61.5	24%	0.237	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	77.7	176.3	179.8	0	0	0	0	0	114.3	L220	G204-L220 PolarHBondContact O-N 3.12Å
205	E	95.6	Very high	96.4	Very high	81 Å²	81	59.5 Å²	59.5	38%	0.379	33%	0.333	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.1	153.4	-178.8	-70.3	-178	160.5	0	0	110	I217 D218 V372	E205-I217 HydrophobicContact CB-CG2 4Å; E205-I217 HydrophobicContact CG-CG2 4.19Å; E205-I217 WeakPolarHBondContact OE2-CG2 3.43Å; E205-D218 CarbonylContact C-O 3.58Å; E205-D218 WeakPolarHBondContact CA-O 3.36Å; E205-V372 HydrophobicContact CB-CG2 4.24Å; E205-V372 HydrophobicContact CG-CB 4.35Å; E205-V372 HydrophobicContact CG-CG2 3.7Å
206	E	94.8	Very high	96.2	Very high	38 Å²	38	60.2 Å²	60.2	18%	0.178	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.2	150.7	170.4	75.1	176.1	156.9	0	0	111.7	D218 L220 K258 K266	E206-D218 PolarHBondContact N-O 2.88Å; E206-D218 PolarHBondContact O-N 3.49Å; E206-L220 HydrophobicContact CB-CD2 3.97Å; E206-L220 HydrophobicContact CB-CG 4.45Å; E206-L220 HydrophobicContact CG-CD2 3.59Å; E206-K258 IonicContact OE2-NZ 2.7Å; E206-K258 PolarHBondContact OE2-NZ 3.45Å; E206-K266 IonicContact OE1-NZ 3.61Å; E206-K266 PolarHBondContact OE1-NZ 3.05Å; E206-K266 IonicContact OE2-NZ 3.41Å
207	C	95.6	Very high	96.1	Very high	74 Å²	74	60.8 Å²	60.8	50%	0.5	34%	0.335	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.7	126	166.1	-171.3	0	0	0	0	109.1	P209 G215	C207-P209 WeakPolarHBondContact O-CD 3.26Å; C207-G215 VanDerWaalsContact SG-CA 3.54Å
208	I	95.8	Very high	95.9	Very high	24 Å²	24	62 Å²	62	12%	0.123	34%	0.341	C	S	.	.			trans	-64.7	121.2	-179.3	-64.1	172.6	0	0	0	109.3	A210 R213 K214 G215 R216 D218	I208-A210 VanDerWaalsContact CG2-O 3.26Å; I208-A210 WeakPolarHBondContact CG2-O 3.21Å; I208-R213 WeakPolarHBondContact CB-O 3.28Å; I208-R213 HydrophobicContact CD1-CB 3.56Å; I208-R213 HydrophobicContact CG2-CB 4.41Å; I208-K214 WeakPolarHBondContact O-CA 3.32Å; I208-G215 PolarHBondContact O-N 2.94Å; I208-R216 PolarHBondContact N-O 2.92Å; I208-R216 VanDerWaalsContact N-O 3.09Å; I208-D218 HydrophobicContact CD1-CB 4.03Å; I208-D218 HydrophobicContact CG1-CB 4.09Å
209	P	94.3	Very high	95.7	Very high	84 Å²	84	62.3 Å²	62.3	55%	0.545	35%	0.346	S	S	.	.			trans	-77.6	-32.1	-171.7	29.3	-34.8	0	0	0	113.7	C207 K214	C207-P209 WeakPolarHBondContact O-CD 3.26Å; P209-K214 WeakPolarHBondContact O-CD 3.49Å; P209-K214 WeakPolarHBondContact O-CE 3.36Å; P209-K214 WeakPolarHBondContact O-CG 3.42Å
210	A	95.1	Very high	95.7	Very high	70 Å²	70	63 Å²	63	58%	0.579	35%	0.35	S	S	*	.	S	Bend	trans	-147.7	167.2	-171.5	0	0	0	0	0	112.4	I208	I208-A210 VanDerWaalsContact CG2-O 3.26Å; I208-A210 WeakPolarHBondContact CG2-O 3.21Å
211	G	96.2	Very high	95.6	Very high	57 Å²	57	63.6 Å²	63.6	59%	0.588	35%	0.352	S	S	*	.	S	Bend	trans	84.8	-177	-178.3	0	0	0	0	0	114	R213 K214	G211-R213 PolarHBondContact O-N 3.1Å; G211-R213 VanDerWaalsContact O-N 3.1Å; G211-K214 VanDerWaalsContact O-CB 3.23Å; G211-K214 WeakPolarHBondContact O-CB 3.02Å; G211-K214 PolarHBondContact O-N 3.31Å
212	H	96.1	Very high	95.6	Very high	176 Å²	176	63.2 Å²	63.2	82%	0.815	35%	0.351	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64	-17.6	-173.4	70.9	-84.9	0	0	0	114.7
213	R	94.1	Very high	95.7	Very high	81 Å²	81	60.7 Å²	60.7	31%	0.306	34%	0.338	S	S	.	.	T	Hydrogen-bonded Turn	trans	-98.4	12.7	175.8	-63	176.7	64.5	-145	-6.8	113.1	I208 G211 R216 D218	I208-R213 WeakPolarHBondContact CB-O 3.28Å; I208-R213 HydrophobicContact CD1-CB 3.56Å; I208-R213 HydrophobicContact CG2-CB 4.41Å; G211-R213 PolarHBondContact O-N 3.1Å; G211-R213 VanDerWaalsContact O-N 3.1Å; R213-R216 VanDerWaalsContact O-CB 3.31Å; R213-R216 WeakPolarHBondContact O-CB 3.14Å; R213-R216 WeakPolarHBondContact O-CG 3.22Å; R213-R216 PolarHBondContact O-N 2.93Å; R213-D218 IonicContact CZ-OD2 2.9Å; R213-D218 IonicContact NH1-OD2 3.48Å; R213-D218 PolarHBondContact NH1-OD2 3.49Å; R213-D218 IonicContact NH2-OD1 3.31Å; R213-D218 IonicContact NH2-OD2 2.89Å; R213-D218 PolarHBondContact NH2-OD2 3.14Å
214	K	96.1	Very high	95.8	Very high	148 Å²	148	58.5 Å²	58.5	64%	0.643	33%	0.329	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.2	139.6	-179.7	-179.5	177.4	-179.1	-175.1	0	111.5	I208 P209 G211 R216	I208-K214 WeakPolarHBondContact O-CA 3.32Å; P209-K214 WeakPolarHBondContact O-CD 3.49Å; P209-K214 WeakPolarHBondContact O-CE 3.36Å; P209-K214 WeakPolarHBondContact O-CG 3.42Å; G211-K214 VanDerWaalsContact O-CB 3.23Å; G211-K214 WeakPolarHBondContact O-CB 3.02Å; G211-K214 PolarHBondContact O-N 3.31Å; K214-R216 PolarHBondContact O-N 2.88Å
215	G	93.9	Very high	95.9	Very high	53 Å²	53	60.4 Å²	60.4	55%	0.546	33%	0.334	S	S	.	.	T	Hydrogen-bonded Turn	trans	79.8	-6.2	178.4	0	0	0	0	0	114.8	C207 I208	C207-G215 VanDerWaalsContact SG-CA 3.54Å; I208-G215 PolarHBondContact O-N 2.94Å
216	R	94.1	Very high	96	Very high	148 Å²	148	57 Å²	57	56%	0.558	32%	0.319	S	S	*	.			trans	-85.5	140.8	175.2	-59.2	-178.7	-179.2	-176.6	-0.8	110.2	I208 R213 K214	I208-R216 PolarHBondContact N-O 2.92Å; I208-R216 VanDerWaalsContact N-O 3.09Å; R213-R216 VanDerWaalsContact O-CB 3.31Å; R213-R216 WeakPolarHBondContact O-CB 3.14Å; R213-R216 WeakPolarHBondContact O-CG 3.22Å; R213-R216 PolarHBondContact O-N 2.93Å; K214-R216 PolarHBondContact O-N 2.88Å
217	I	94.3	Very high	96.1	Very high	65 Å²	65	61.5 Å²	61.5	33%	0.333	34%	0.338	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.9	123.9	172.7	-59.2	171.7	0	0	0	108.7	R58 E205	R58-I217 PolarHBondContact NH1-O 3.19Å; E205-I217 HydrophobicContact CB-CG2 4Å; E205-I217 HydrophobicContact CG-CG2 4.19Å; E205-I217 WeakPolarHBondContact OE2-CG2 3.43Å
218	D	94.1	Very high	96.2	Very high	26 Å²	26	58 Å²	58	14%	0.139	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	145.3	173.6	-153.4	-14.1	0	0	0	110.2	E205 E206 I208 R213 R221	E205-D218 CarbonylContact C-O 3.58Å; E205-D218 WeakPolarHBondContact CA-O 3.36Å; E206-D218 PolarHBondContact N-O 2.88Å; E206-D218 PolarHBondContact O-N 3.49Å; I208-D218 HydrophobicContact CD1-CB 4.03Å; I208-D218 HydrophobicContact CG1-CB 4.09Å; R213-D218 IonicContact CZ-OD2 2.9Å; R213-D218 IonicContact NH1-OD2 3.48Å; R213-D218 PolarHBondContact NH1-OD2 3.49Å; R213-D218 IonicContact NH2-OD1 3.31Å; R213-D218 IonicContact NH2-OD2 2.89Å; R213-D218 PolarHBondContact NH2-OD2 3.14Å; D218-R221 IonicContact OD1-CZ 3.68Å; D218-R221 IonicContact OD1-NH1 3.4Å; D218-R221 PolarHBondContact OD1-NH1 3.39Å; D218-R221 IonicContact OD1-NH2 2.63Å; D218-R221 PolarHBondContact OD1-NH2 3.2Å; D218-R221 IonicContact OD2-NH1 3.07Å
219	A	95.1	Very high	96.3	Very high	26 Å²	26	57.4 Å²	57.4	22%	0.215	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.4	140.1	178.9	0	0	0	0	0	110.3	L202 R221	L202-A219 HydrophobicContact CD2-CB 3.78Å; A219-R221 PolarHBondContact O-NH1 2.69Å
220	L	96.8	Very high	96.4	Very high	18 Å²	18	53.4 Å²	53.4	9%	0.094	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82	122.8	174	-61.5	-178.2	0	0	0	109.2	Y90 L202 R203 G204 E206 Y222	Y90-L220 HydrophobicContact CE2-CD2 4.09Å; L202-L220 WeakPolarHBondContact CA-O 3.5Å; R203-L220 PolarHBondContact N-O 3.32Å; R203-L220 WeakPolarHBondContact O-CB 3.44Å; G204-L220 PolarHBondContact O-N 3.12Å; E206-L220 HydrophobicContact CB-CD2 3.97Å; E206-L220 HydrophobicContact CB-CG 4.45Å; E206-L220 HydrophobicContact CG-CD2 3.59Å; L220-Y222 HydrophobicContact CB-CE2 3.79Å
221	R	98.3	Very high	96.5	Very high	29 Å²	29	50.1 Å²	50.1	11%	0.109	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	140.1	-176.3	-60.6	164.1	-171.5	92.2	2.2	108.7	K89 Y90 Y200 L202 D218 A219	K89-R221 CarbonylContact C-O 3.55Å; K89-R221 VanDerWaalsContact CA-O 3.3Å; K89-R221 WeakPolarHBondContact CA-O 3.39Å; K89-R221 HydrophobicContact CB-CB 3.65Å; Y90-R221 PolarHBondContact N-O 2.84Å; Y200-R221 HydrophobicContact CE2-CB 4.02Å; Y200-R221 HydrophobicContact CE2-CG 4.46Å; L202-R221 HydrophobicContact CD2-CG 4.14Å; L202-R221 HydrophobicContact CG-CG 4.19Å; D218-R221 IonicContact OD1-CZ 3.68Å; D218-R221 IonicContact OD1-NH1 3.4Å; D218-R221 PolarHBondContact OD1-NH1 3.39Å; D218-R221 IonicContact OD1-NH2 2.63Å; D218-R221 PolarHBondContact OD1-NH2 3.2Å; D218-R221 IonicContact OD2-NH1 3.07Å; A219-R221 PolarHBondContact O-NH1 2.69Å
222	Y	98.6	Very high	96.6	Very high	5 Å²	5	47.5 Å²	47.5	2%	0.02	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	149.1	-179	-60.3	-94.4	0	0	0	109.9	Y90 V92 F108 Y200 W201 R203 L220	Y90-Y222 HydrophobicContact CD2-CD1 4.03Å; Y90-Y222 AromaticContact CD2-CE1 3.55Å; Y90-Y222 HydrophobicContact CD2-CE1 3.55Å; Y90-Y222 AromaticContact CD2-CZ 3.9Å; Y90-Y222 HydrophobicContact CE2-CE1 4.3Å; Y90-Y222 HydrophobicContact CG-CD1 4.22Å; Y90-Y222 AromaticContact CG-CE1 3.99Å; Y90-Y222 HydrophobicContact CG-CE1 3.99Å; V92-Y222 HydrophobicContact CG2-CD1 3.76Å; V92-Y222 HydrophobicContact CG2-CG 4.48Å; F108-Y222 HydrophobicContact CD1-CE1 4.01Å; F108-Y222 HydrophobicContact CD2-CE1 4.33Å; F108-Y222 HydrophobicContact CE1-CE1 4.17Å; F108-Y222 HydrophobicContact CE2-CE1 4.47Å; F108-Y222 HydrophobicContact CG-CE1 4.1Å; F108-Y222 HydrophobicContact CZ-CE1 4.4Å; Y200-Y222 WeakPolarHBondContact CD2-O 3.47Å; W201-Y222 HydrophobicContact CH2-CG 4.49Å; W201-Y222 VanDerWaalsContact CZ2-CB 3.44Å; W201-Y222 AromaticContact CZ2-CG 3.96Å; W201-Y222 HydrophobicContact CZ2-CG 3.96Å; W201-Y222 PolarHBondContact N-O 2.67Å; W201-Y222 VanDerWaalsContact N-O 3.16Å; W201-Y222 PolarHBondContact O-N 3.02Å; R203-Y222 HydrophobicContact CB-CD2 4.16Å; R203-Y222 HydrophobicContact CB-CE2 3.84Å; R203-Y222 WeakPolarHBondContact O-CE2 3.24Å; L220-Y222 HydrophobicContact CB-CE2 3.79Å
223	Q	98.6	Very high	96.7	Very high	1 Å²	1	39.6 Å²	39.6	1%	0.005	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.7	130.6	172.4	-179	81.2	47.3	0	0	108.5	K89 Y90 V92 F199 N225 Y269 T272	K89-Q223 HydrophobicContact CD-CB 3.89Å; K89-Q223 HydrophobicContact CG-CB 4.38Å; Y90-Q223 PolarHBondContact O-N 3.23Å; V92-Q223 PolarHBondContact N-O 3.12Å; F199-Q223 WeakPolarHBondContact O-CA 3.39Å; F199-Q223 PolarHBondContact O-NE2 3.3Å; Q223-N225 WeakPolarHBondContact CG-OD1 3.47Å; Q223-N225 PolarHBondContact NE2-OD1 3.1Å; Q223-Y269 HydrophobicContact CG-CE2 4.18Å; Q223-Y269 VanDerWaalsContact CG-OH 3.25Å; Q223-Y269 WeakPolarHBondContact CG-OH 3.17Å; Q223-T272 PolarHBondContact NE2-O 3.42Å; Q223-T272 PolarHBondContact NE2-OG1 3.49Å
224	I	98.7	Very high	96.9	Very high	1 Å²	1	35.9 Å²	35.9	1%	0.005	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	129.7	163	-69.2	163.1	0	0	0	106.9	V92 P94 D198 F199 W201 D226 A321 F324 A325	V92-I224 HydrophobicContact CB-CD1 4.49Å; V92-I224 HydrophobicContact CB-CG1 3.65Å; V92-I224 HydrophobicContact CG1-CD1 4.22Å; V92-I224 HydrophobicContact CG1-CG1 3.82Å; P94-I224 HydrophobicContact CG-CG2 3.73Å; D198-I224 VanDerWaalsContact CA-O 3.3Å; D198-I224 WeakPolarHBondContact CA-O 3.31Å; F199-I224 PolarHBondContact N-O 3.29Å; F199-I224 PolarHBondContact O-N 3.19Å; W201-I224 HydrophobicContact CH2-CD1 3.4Å; W201-I224 VanDerWaalsContact CH2-CD1 3.4Å; W201-I224 HydrophobicContact CH2-CG1 3.6Å; W201-I224 HydrophobicContact CZ2-CD1 4.5Å; W201-I224 HydrophobicContact CZ3-CB 4.27Å; W201-I224 HydrophobicContact CZ3-CD1 3.63Å; W201-I224 HydrophobicContact CZ3-CG1 3.66Å; I224-D226 HydrophobicContact CG2-CB 4.03Å; I224-A321 HydrophobicContact CD1-CB 3.96Å; I224-A321 WeakPolarHBondContact CD1-O 3.42Å; I224-F324 HydrophobicContact CD1-CD1 4.24Å; I224-A325 HydrophobicContact CB-CB 3.95Å; I224-A325 HydrophobicContact CD1-CB 3.98Å; I224-A325 HydrophobicContact CG2-CB 3.74Å
225	N	98	Very high	96.9	Very high	63 Å²	63	31.5 Å²	31.5	34%	0.337	17%	0.167	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	100.8	166.8	-67.1	2.3	0	0	0	106.6	D198 Q223 Y269	D198-N225 VanDerWaalsContact OD1-CA 3.3Å; D198-N225 WeakPolarHBondContact OD1-CA 3.33Å; D198-N225 PolarHBondContact OD1-OD1 3.35Å; Q223-N225 WeakPolarHBondContact CG-OD1 3.47Å; Q223-N225 PolarHBondContact NE2-OD1 3.1Å; N225-Y269 PolarHBondContact ND2-OH 3.08Å
226	D	97.8	Very high	96.9	Very high	11 Å²	11	32.9 Å²	32.9	6%	0.059	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	159.5	-177.3	-166.5	17.4	0	0	0	110.9	P94 P196 V197 I224 H291 S322	P94-D226 HydrophobicContact CG-CB 3.9Å; P196-D226 CarbonylContact C-O 3.6Å; P196-D226 VanDerWaalsContact CA-O 3.27Å; P196-D226 WeakPolarHBondContact CA-O 3.47Å; V197-D226 PolarHBondContact N-O 3.49Å; V197-D226 PolarHBondContact O-N 3.17Å; I224-D226 HydrophobicContact CG2-CB 4.03Å; D226-H291 IonicContact OD2-CE1 2.79Å; D226-H291 PolarHBondContact OD2-CE1 3.35Å; D226-H291 IonicContact OD2-ND1 3.66Å; D226-H291 IonicContact OD2-NE2 3.79Å; D226-S322 WeakPolarHBondContact OD2-CB 3.43Å; D226-S322 PolarHBondContact OD2-OG 3.43Å
227	K	97.4	Very high	97	Very high	131 Å²	131	27.7 Å²	27.7	57%	0.57	14%	0.142	S	C	*	.			trans	-140.6	80.3	175.6	-165.9	174.7	-175.8	-179.2	0	108.6	K194	K194-K227 WeakPolarHBondContact O-CE 3.48Å
228	P	97.3	Very high	97.1	Very high	0 Å²	0	24.9 Å²	24.9	0%	0	13%	0.127	C	C	.	.			trans	-52.8	152.1	173.1	21.9	-34	0	0	0	110.8	K194 R195 V197 Q231 Q289	K194-P228 WeakPolarHBondContact CA-O 3.23Å; R195-P228 WeakPolarHBondContact O-CD 3.19Å; V197-P228 HydrophobicContact CG2-CG 3.99Å; P228-Q231 HydrophobicContact CG-CB 4.44Å; P228-Q289 HydrophobicContact CB-CG 4.22Å
229	H	96.8	Very high	97.1	Very high	12 Å²	12	25 Å²	25	6%	0.056	13%	0.129	C	C	.	.	S	Bend	trans	-72.5	-52.5	179	-173.8	53	0	0	0	110.6	S165 L168 D169 K194 F290 L292	S165-H229 PolarHBondContact O-NE2 3.35Å; S165-H229 PolarHBondContact OG-CE1 2.9Å; L168-H229 HydrophobicContact CD2-CB 4.38Å; L168-H229 WeakPolarHBondContact CD2-CD2 3.38Å; D169-H229 VanDerWaalsContact CG-NE2 3.32Å; D169-H229 IonicContact OD1-CD2 2.62Å; D169-H229 IonicContact OD1-CE1 2.69Å; D169-H229 PolarHBondContact OD1-CE1 2.96Å; D169-H229 IonicContact OD1-NE2 3.45Å; D169-H229 PolarHBondContact OD1-NE2 3.1Å; D169-H229 IonicContact OD2-CE1 2.67Å; D169-H229 PolarHBondContact OD2-CE1 2.79Å; D169-H229 IonicContact OD2-NE2 3.83Å; K194-H229 VanDerWaalsContact CE-CE1 3.42Å; K194-H229 WeakPolarHBondContact CE-CE1 3.26Å; K194-H229 WeakPolarHBondContact CE-ND1 3.26Å; K194-H229 PolarHBondContact N-O 2.86Å; H229-F290 WeakPolarHBondContact CA-O 3.24Å; H229-F290 WeakPolarHBondContact CB-O 3.44Å; H229-F290 PolarHBondContact N-O 2.92Å; H229-L292 HydrophobicContact CB-CB 4.28Å
230	N	97.8	Very high	97	Very high	1 Å²	1	27.4 Å²	27.4	1%	0.005	14%	0.136	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	148.7	170	-67.2	-56.1	0	0	0	109.6	D169 V172 L191 D192 C193 F290	D169-N230 PolarHBondContact OD1-ND2 3.25Å; D169-N230 PolarHBondContact OD1-OD1 3.28Å; D169-N230 VanDerWaalsContact OD1-OD1 3.12Å; V172-N230 HydrophobicContact CG1-CB 4.45Å; L191-N230 HydrophobicContact CD1-CB 4.41Å; D192-N230 CarbonylContact O-C 3.59Å; D192-N230 WeakPolarHBondContact O-CA 3.38Å; C193-N230 PolarHBondContact SG-OD1 3.3Å; N230-F290 HydrophobicContact CB-CB 4.15Å; N230-F290 HydrophobicContact CB-CD2 4.22Å; N230-F290 PolarHBondContact N-O 3.47Å; N230-F290 PolarHBondContact O-N 3.18Å
231	Q	97.4	Very high	96.9	Very high	1 Å²	1	28.5 Å²	28.5	1%	0.005	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.7	141.4	170.7	65	177.7	18.8	0	0	110.2	D192 V197 P228 T275 Q289 W326	D192-Q231 HydrophobicContact CB-CG 3.61Å; D192-Q231 PolarHBondContact N-O 3.11Å; D192-Q231 PolarHBondContact O-N 3.11Å; D192-Q231 PolarHBondContact OD2-NE2 3.03Å; V197-Q231 VanDerWaalsContact CG2-OE1 3.24Å; P228-Q231 HydrophobicContact CG-CB 4.44Å; Q231-T275 PolarHBondContact NE2-O 3.25Å; Q231-Q289 HydrophobicContact CB-CG 3.79Å; Q231-W326 HydrophobicContact CB-CZ2 4.18Å
232	I	98.4	Very high	96.7	Very high	1 Å²	1	27.6 Å²	27.6	1%	0.005	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	120.3	177.7	-58.2	171.8	0	0	0	107.1	V176 L186 A189 L191 H287 T288 F290 W326 L416	V176-I232 HydrophobicContact CG2-CD1 3.75Å; L186-I232 HydrophobicContact CD2-CG2 4.29Å; A189-I232 HydrophobicContact CB-CG2 3.77Å; L191-I232 HydrophobicContact CD1-CG1 3.87Å; I232-H287 HydrophobicContact CB-CB 4.12Å; I232-H287 HydrophobicContact CG2-CB 3.92Å; I232-H287 WeakPolarHBondContact O-CB 2.98Å; I232-H287 PolarHBondContact O-N 2.95Å; I232-T288 PolarHBondContact N-O 3.28Å; I232-F290 HydrophobicContact CD1-CE2 4.15Å; I232-W326 WeakPolarHBondContact O-CH2 3.48Å; I232-L416 HydrophobicContact CD1-CD2 3.5Å
233	R	97.8	Very high	96.6	Very high	10 Å²	10	31 Å²	31	4%	0.038	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	143.5	174.4	-65.9	-176.3	-65.1	113.5	-0.7	110.5	A189 A190 D192 S277 D281 C283 Y285 W326	A189-R233 CarbonylContact C-O 3.54Å; A189-R233 VanDerWaalsContact CA-O 3.27Å; A189-R233 WeakPolarHBondContact CA-O 3.46Å; A189-R233 WeakPolarHBondContact CB-O 3.32Å; A190-R233 HydrophobicContact CB-CB 4.39Å; A190-R233 PolarHBondContact N-O 2.85Å; A190-R233 PolarHBondContact O-N 2.86Å; D192-R233 IonicContact OD1-NH2 3.91Å; D192-R233 PolarHBondContact OD1-NH2 2.96Å; D192-R233 IonicContact OD2-CZ 3.21Å; D192-R233 VanDerWaalsContact OD2-CZ 3.31Å; D192-R233 IonicContact OD2-NE 3.83Å; D192-R233 PolarHBondContact OD2-NE 2.93Å; D192-R233 IonicContact OD2-NH2 3.75Å; D192-R233 PolarHBondContact OD2-NH2 2.89Å; D192-R233 VanDerWaalsContact OD2-NH2 3.07Å; R233-S277 VanDerWaalsContact NH1-CB 3.34Å; R233-D281 IonicContact CZ-OD2 3.63Å; R233-D281 IonicContact NH1-OD1 3.26Å; R233-D281 IonicContact NH1-OD2 3.06Å; R233-D281 PolarHBondContact NH1-OD2 2.99Å; R233-D281 IonicContact NH2-OD2 3.35Å; R233-D281 PolarHBondContact NH2-OD2 2.6Å; R233-C283 HydrophobicContact CB-CB 4.08Å; R233-C283 PolarHBondContact NH1-O 3.5Å; R233-Y285 CarbonylContact C-O 3.55Å; R233-Y285 VanDerWaalsContact CA-O 3.26Å; R233-Y285 WeakPolarHBondContact CA-O 3.5Å; R233-W326 HydrophobicContact CG-CZ2 4.21Å
234	I	97.2	Very high	96.3	Very high	4 Å²	4	32 Å²	32	2%	0.021	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.4	160.2	-177.4	52.5	171.7	0	0	0	110	A189 Q236 L238 C283 Y285 H287 P420	A189-I234 HydrophobicContact CB-CG2 3.77Å; I234-Q236 WeakPolarHBondContact CD1-O 3.34Å; I234-Q236 WeakPolarHBondContact CG1-O 3.49Å; I234-L238 HydrophobicContact CD1-CD2 4.03Å; I234-L238 HydrophobicContact CD1-CG 4.12Å; I234-C283 CarbonylContact O-C 3.36Å; I234-C283 WeakPolarHBondContact O-CA 3.38Å; I234-Y285 PolarHBondContact N-O 2.92Å; I234-Y285 PolarHBondContact O-N 2.92Å; I234-Y285 VanDerWaalsContact O-N 3.14Å; I234-H287 HydrophobicContact CD1-CB 4.11Å; I234-H287 HydrophobicContact CG1-CB 4.2Å; I234-H287 HydrophobicContact CG2-CB 4.25Å; I234-P420 HydrophobicContact CD1-CG 3.86Å
235	S	95.9	Very high	96	Very high	56 Å²	56	37.5 Å²	37.5	39%	0.392	20%	0.195	S	C	.	.	S	Bend	trans	-80.7	-20.9	-179	56.1	0	0	0	0	113.7	P282 Y285	S235-P282 WeakPolarHBondContact CA-O 3.45Å; S235-Y285 WeakPolarHBondContact O-CD2 3.28Å
236	Q	95.6	Very high	95.7	Very high	81 Å²	81	39.9 Å²	39.9	38%	0.379	20%	0.2	S	C	.	.	S	Bend	trans	-116.9	151.7	-178.3	-65	179.8	-5.4	0	0	111.1	I234 P420	I234-Q236 WeakPolarHBondContact CD1-O 3.34Å; I234-Q236 WeakPolarHBondContact CG1-O 3.49Å; Q236-P420 HydrophobicContact CB-CB 3.7Å; Q236-P420 HydrophobicContact CB-CG 3.81Å
237	Q	95.6	Very high	95.1	Very high	40 Å²	40	44.2 Å²	44.2	19%	0.187	23%	0.231	C	C	.	.	P	Polyproline II helix	trans	-79.6	139.5	-176.5	-169.4	173	-1	0	0	111.8	Y285 P345 P420	Q237-Y285 HydrophobicContact CB-CD1 3.81Å; Q237-Y285 HydrophobicContact CB-CD2 4.45Å; Q237-Y285 HydrophobicContact CB-CE1 3.81Å; Q237-Y285 HydrophobicContact CB-CE2 4.47Å; Q237-Y285 HydrophobicContact CB-CG 4.14Å; Q237-Y285 HydrophobicContact CG-CD1 3.89Å; Q237-Y285 HydrophobicContact CG-CE1 3.97Å; Q237-P345 PolarHBondContact NE2-O 3.01Å; Q237-P420 WeakPolarHBondContact O-CB 3.36Å
238	L	95.2	Very high	94.6	Very high	6 Å²	6	39.2 Å²	39.2	3%	0.031	21%	0.211	C	C	.	.	P	Polyproline II helix	trans	-65.7	150.4	170.6	-72	-178.8	0	0	0	111.8	I234 V347	I234-L238 HydrophobicContact CD1-CD2 4.03Å; I234-L238 HydrophobicContact CD1-CG 4.12Å; L238-V347 HydrophobicContact CB-CG1 4.49Å
239	P	94.3	Very high	94.1	Very high	27 Å²	27	45.7 Å²	45.7	18%	0.175	25%	0.253	C	S	.	.	P	Polyproline II helix	trans	-62.7	147.6	174.6	25.2	-33.5	0	0	0	112.1	K419 K421	P239-K419 WeakPolarHBondContact CD-O 3.18Å; P239-K421 HydrophobicContact CB-CD 4.14Å; P239-K421 HydrophobicContact CB-CG 4.07Å
240	E	94.6	Very high	93.8	Very high	78 Å²	78	48.3 Å²	48.3	36%	0.364	27%	0.269	S	S	.	.	P	Polyproline II helix	trans	-62.2	145.8	167.8	65.9	-177.4	-164.9	0	0	111.3	P345	E240-P345 HydrophobicContact CB-CB 4.21Å; E240-P345 HydrophobicContact CB-CG 4.04Å; E240-P345 WeakPolarHBondContact OE2-CD 3.44Å; E240-P345 VanDerWaalsContact OE2-CG 3.25Å; E240-P345 WeakPolarHBondContact OE2-CG 3.37Å
241	F	93.6	Very high	93.4	Very high	40 Å²	40	56.3 Å²	56.3	18%	0.175	31%	0.307	C	S	.	.	S	Bend	trans	-83.5	-39.6	174.1	-62.8	-58	0	0	0	111.5	P118 V347 Q349 C362 W385	P118-F241 HydrophobicContact CB-CB 3.77Å; P118-F241 HydrophobicContact CB-CD1 3.81Å; P118-F241 HydrophobicContact CB-CD2 4.27Å; P118-F241 HydrophobicContact CB-CE1 4.46Å; P118-F241 HydrophobicContact CB-CG 3.7Å; P118-F241 HydrophobicContact CG-CB 4.43Å; P118-F241 HydrophobicContact CG-CD1 3.58Å; P118-F241 HydrophobicContact CG-CD2 4.16Å; P118-F241 HydrophobicContact CG-CE1 3.73Å; P118-F241 HydrophobicContact CG-CE2 4.26Å; P118-F241 HydrophobicContact CG-CG 3.81Å; P118-F241 HydrophobicContact CG-CZ 4.07Å; F241-V347 HydrophobicContact CD2-CG1 3.82Å; F241-V347 HydrophobicContact CD2-CG2 3.96Å; F241-V347 HydrophobicContact CE1-CG1 4.34Å; F241-V347 HydrophobicContact CE2-CB 4.28Å; F241-V347 HydrophobicContact CE2-CG1 3.14Å; F241-V347 HydrophobicContact CE2-CG2 4.15Å; F241-V347 HydrophobicContact CZ-CG1 3.45Å; F241-V347 VanDerWaalsContact CZ-CG1 3.45Å; F241-Q349 HydrophobicContact CZ-CG 4.44Å; F241-C362 HydrophobicContact CD2-CB 4.34Å; F241-C362 HydrophobicContact CE2-CB 3.56Å; F241-C362 HydrophobicContact CZ-CB 3.87Å; F241-W385 HydrophobicContact CB-CH2 4.06Å; F241-W385 HydrophobicContact CB-CZ3 4.33Å; F241-W385 HydrophobicContact CD2-CE3 4.21Å; F241-W385 HydrophobicContact CD2-CH2 4.31Å; F241-W385 AromaticContact CD2-CZ3 3.74Å; F241-W385 HydrophobicContact CD2-CZ3 3.74Å; F241-W385 HydrophobicContact CG-CZ3 4.44Å
242	V	94.7	Very high	93.3	Very high	11 Å²	11	57.6 Å²	57.6	7%	0.067	31%	0.313	C	S	.	.	S	Bend	trans	-132.4	155.1	176.1	-60.1	0	0	0	0	109.3	Y246 Q364 I383 W385	V242-Y246 HydrophobicContact CB-CD1 3.99Å; V242-Y246 HydrophobicContact CB-CD2 4.4Å; V242-Y246 HydrophobicContact CB-CG 3.89Å; V242-Y246 HydrophobicContact CG1-CD1 4.21Å; V242-Y246 HydrophobicContact CG1-CE1 4.29Å; V242-Y246 HydrophobicContact CG1-CG 4.42Å; V242-Y246 HydrophobicContact CG2-CD1 3.74Å; V242-Y246 HydrophobicContact CG2-CG 3.94Å; V242-Q364 VanDerWaalsContact N-OE1 3.1Å; V242-Q364 PolarHBondContact O-NE2 3.04Å; V242-Q364 PolarHBondContact O-OE1 3.44Å; V242-I383 HydrophobicContact CG2-CD1 3.72Å; V242-W385 HydrophobicContact CG1-CH2 4.33Å; V242-W385 HydrophobicContact CG1-CZ2 3.95Å; V242-W385 HydrophobicContact CG2-CH2 3.96Å; V242-W385 HydrophobicContact CG2-CZ2 4.24Å
243	P	95	Very high	93	Very high	76 Å²	76	59.2 Å²	59.2	49%	0.494	32%	0.324	S	S	.	.			trans	-58	154.2	176.5	-24.6	34.7	0	0	0	112.9	D245 Y246	P243-D245 VanDerWaalsContact C-N 3.29Å; P243-D245 PolarHBondContact O-N 3.45Å; P243-Y246 WeakPolarHBondContact O-CB 3.43Å; P243-Y246 PolarHBondContact O-N 2.9Å
244	L	94.2	Very high	92.8	Very high	23 Å²	23	64.9 Å²	64.9	12%	0.12	36%	0.359	C	S	.	.	T	Hydrogen-bonded Turn	trans	-55.5	-39.2	-179.3	-178.2	62.8	0	0	0	114.1	Y246 V342 P345 N366	L244-Y246 PolarHBondContact O-N 3.06Å; L244-V342 HydrophobicContact CD1-CG2 4.4Å; L244-P345 HydrophobicContact CB-CG 3.9Å; L244-P345 HydrophobicContact CD1-CG 3.88Å; L244-P345 HydrophobicContact CG-CG 4.49Å; L244-N366 HydrophobicContact CD1-CB 4.05Å; L244-N366 WeakPolarHBondContact CD1-O 3.31Å
245	D	91.6	Very high	92.5	Very high	115 Å²	115	67.6 Å²	67.6	62%	0.615	37%	0.373	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.7	15.6	-178.6	-61.1	-44	0	0	0	112.9	P243 S247 R380	P243-D245 VanDerWaalsContact C-N 3.29Å; P243-D245 PolarHBondContact O-N 3.45Å; D245-S247 PolarHBondContact O-N 3.46Å; D245-R380 IonicContact OD1-CZ 3.76Å; D245-R380 VanDerWaalsContact OD1-CZ 3.24Å; D245-R380 IonicContact OD1-NE 2.83Å; D245-R380 PolarHBondContact OD1-NE 3.32Å; D245-R380 IonicContact OD1-NH2 3.8Å; D245-R380 PolarHBondContact OD1-NH2 3.43Å; D245-R380 IonicContact OD2-NH2 3.87Å
246	Y	91.9	Very high	92.4	Very high	113 Å²	113	75.5 Å²	75.5	44%	0.443	40%	0.4	S	S	.	.			trans	-63.8	120.8	176.2	-174.3	-107.7	0	0	0	110.7	V242 P243 L244 I248 I383	V242-Y246 HydrophobicContact CB-CD1 3.99Å; V242-Y246 HydrophobicContact CB-CD2 4.4Å; V242-Y246 HydrophobicContact CB-CG 3.89Å; V242-Y246 HydrophobicContact CG1-CD1 4.21Å; V242-Y246 HydrophobicContact CG1-CE1 4.29Å; V242-Y246 HydrophobicContact CG1-CG 4.42Å; V242-Y246 HydrophobicContact CG2-CD1 3.74Å; V242-Y246 HydrophobicContact CG2-CG 3.94Å; P243-Y246 WeakPolarHBondContact O-CB 3.43Å; P243-Y246 PolarHBondContact O-N 2.9Å; L244-Y246 PolarHBondContact O-N 3.06Å; Y246-I248 HydrophobicContact CD1-CD1 4.02Å; Y246-I248 HydrophobicContact CD1-CG1 3.73Å; Y246-I248 HydrophobicContact CE1-CD1 3.7Å; Y246-I248 HydrophobicContact CE1-CG1 3.24Å; Y246-I383 HydrophobicContact CD1-CD1 3.81Å; Y246-I383 HydrophobicContact CE1-CD1 4.47Å
247	S	85.8	Confident	92.3	Very high	102 Å²	102	74.8 Å²	74.8	71%	0.713	40%	0.403	S	S	*	.			trans	-108.9	133	178.4	61.8	0	0	0	0	110.5	D245	D245-S247 PolarHBondContact O-N 3.46Å
248	I	85.9	Confident	92.1	Very high	27 Å²	27	77 Å²	77	14%	0.138	41%	0.412	C	S	.	.			trans	-113.4	134.1	177.2	-60.3	153.9	0	0	0	107.5	I114 Y246 V250 I383	I114-I248 HydrophobicContact CD1-CD1 3.48Å; I114-I248 VanDerWaalsContact CD1-CD1 3.48Å; I114-I248 HydrophobicContact CD1-CG1 4.41Å; I114-I248 HydrophobicContact CG1-CD1 4.44Å; Y246-I248 HydrophobicContact CD1-CD1 4.02Å; Y246-I248 HydrophobicContact CD1-CG1 3.73Å; Y246-I248 HydrophobicContact CE1-CD1 3.7Å; Y246-I248 HydrophobicContact CE1-CG1 3.24Å; I248-V250 HydrophobicContact CG2-CB 3.86Å; I248-V250 HydrophobicContact CG2-CG2 3.63Å; I248-V250 PolarHBondContact O-N 3.38Å; I248-I383 HydrophobicContact CD1-CD1 3.62Å; I248-I383 HydrophobicContact CD1-CG1 3.79Å; I248-I383 HydrophobicContact CD1-CG2 4.1Å
249	P	87.5	Confident	92.1	Very high	136 Å²	136	77.3 Å²	77.3	88%	0.883	42%	0.415	S	S	*	.	S	Bend	trans	-74.2	28.3	178.7	33.7	-37.8	0	0	0	113
250	V	89.6	Confident	92	Very high	66 Å²	66	79.7 Å²	79.7	40%	0.4	43%	0.426	S	S	.	.	P	Polyproline II helix	trans	-102.8	127.6	176.4	177.4	0	0	0	0	108.7	V112 I248 K381	V112-V250 HydrophobicContact CG1-CB 3.72Å; V112-V250 HydrophobicContact CG1-CG1 3.63Å; I248-V250 HydrophobicContact CG2-CB 3.86Å; I248-V250 HydrophobicContact CG2-CG2 3.63Å; I248-V250 PolarHBondContact O-N 3.38Å; V250-K381 PolarHBondContact O-NZ 3.19Å
251	E	90.6	Very high	92	Very high	170 Å²	170	84 Å²	84	79%	0.794	44%	0.443	S	S	*	.	P	Polyproline II helix	trans	-80.8	146.7	177.2	-65.9	-170.6	170.8	0	0	111.5
252	I	93.6	Very high	92	Very high	27 Å²	27	82.6 Å²	82.6	14%	0.138	44%	0.437	C	S	.	.	P	Polyproline II helix	trans	-80.6	133.3	176.7	-55.5	175.1	0	0	0	107.5	Q106 K110 V112 V254 K381	Q106-I252 WeakPolarHBondContact O-CG2 3.29Å; K110-I252 HydrophobicContact CB-CD1 4.14Å; K110-I252 HydrophobicContact CG-CD1 3.34Å; V112-I252 HydrophobicContact CG2-CG1 3.91Å; I252-V254 PolarHBondContact O-N 3.22Å; I252-K381 HydrophobicContact CD1-CB 4.41Å; I252-K381 HydrophobicContact CD1-CD 3.87Å; I252-K381 HydrophobicContact CD1-CG 3.95Å; I252-K381 HydrophobicContact CG1-CD 3.98Å
253	P	93.9	Very high	92	Very high	36 Å²	36	84.5 Å²	84.5	23%	0.234	45%	0.45	C	S	.	.	P	Polyproline II helix	trans	-55.7	121.8	176.5	-25.8	34.5	0	0	0	112.4	R103 Q106 M255	R103-P253 HydrophobicContact CB-CB 4.16Å; R103-P253 HydrophobicContact CB-CG 4.33Å; R103-P253 HydrophobicContact CG-CG 4.45Å; Q106-P253 HydrophobicContact CB-CG 4.34Å; P253-M255 HydrophobicContact CB-CE 3.5Å
254	V	91.9	Very high	92	Very high	128 Å²	128	81.1 Å²	81.1	78%	0.776	43%	0.428	S	S	*	.	P	Polyproline II helix	trans	-101.4	120	176.4	-177.5	0	0	0	0	110	I252	I252-V254 PolarHBondContact O-N 3.22Å
255	M	92	Very high	92.1	Very high	62 Å²	62	86.7 Å²	86.7	31%	0.305	45%	0.452	S	S	.	.	P	Polyproline II helix	trans	-83	130.3	179	-57.1	-59.2	113.9	0	0	110.3	R103 W104 P253 C257	R103-M255 HydrophobicContact CB-CE 4.16Å; W104-M255 HydrophobicContact CD2-CG 3.82Å; W104-M255 HydrophobicContact CD2-SD 3.9Å; W104-M255 HydrophobicContact CE3-CB 4.22Å; W104-M255 HydrophobicContact CE3-CG 3.61Å; W104-M255 HydrophobicContact CE3-SD 4.3Å; W104-M255 HydrophobicContact CG-CG 4.43Å; W104-M255 HydrophobicContact CG-SD 4.22Å; W104-M255 HydrophobicContact CH2-CB 4.31Å; W104-M255 HydrophobicContact CH2-CG 4.35Å; W104-M255 HydrophobicContact CZ2-SD 4.31Å; W104-M255 HydrophobicContact CZ3-CB 3.96Å; W104-M255 HydrophobicContact CZ3-CG 3.87Å; P253-M255 HydrophobicContact CB-CE 3.5Å; M255-C257 VanDerWaalsContact C-N 3.31Å
256	K	92.8	Very high	92.3	Very high	221 Å²	221	84.3 Å²	84.3	96%	0.961	44%	0.436	S	S	*	.	S	Bend	trans	-84.5	-4.9	179.2	-64.4	-178.4	179.5	179.3	0	113.6
257	C	93.4	Very high	92.6	Very high	66 Å²	66	85.9 Å²	85.9	45%	0.446	44%	0.441	S	S	.	.	S	Bend	trans	-127	168.3	-177	59.3	0	0	0	0	111.5	W104 M255 K261	W104-C257 WeakPolarHBondContact CH2-SG 3.3Å; M255-C257 VanDerWaalsContact C-N 3.31Å; C257-K261 HydrophobicContact CB-CG 4.34Å
258	K	92.4	Very high	93.2	Very high	86 Å²	86	86.4 Å²	86.4	37%	0.374	43%	0.432	S	S	.	.			trans	-68.4	148.1	-178.4	-67	-168.2	174.6	-159.2	0	111.7	E206 D260 K261	E206-K258 IonicContact OE2-NZ 2.7Å; E206-K258 PolarHBondContact OE2-NZ 3.45Å; K258-D260 HydrophobicContact CB-CB 4.46Å; K258-D260 PolarHBondContact O-N 3.45Å; K258-D260 VanDerWaalsContact O-N 3.09Å; K258-K261 WeakPolarHBondContact O-CB 3.32Å; K258-K261 PolarHBondContact O-N 2.78Å
259	P	94.5	Very high	93.7	Very high	14 Å²	14	87.7 Å²	87.7	9%	0.091	44%	0.435	C	S	.	.	G	3₁₀ helix	trans	-55.1	-26.4	172.9	-23.9	33	0	0	0	114.1	Y90 F108 K261 L262 L264	Y90-P259 HydrophobicContact CE1-CB 3.91Å; Y90-P259 HydrophobicContact CE2-CB 4.01Å; Y90-P259 HydrophobicContact CE2-CG 4.1Å; F108-P259 HydrophobicContact CE1-CB 4.07Å; F108-P259 HydrophobicContact CE1-CG 3.93Å; F108-P259 HydrophobicContact CZ-CB 3.86Å; F108-P259 HydrophobicContact CZ-CG 4.25Å; P259-K261 PolarHBondContact O-N 2.98Å; P259-L262 WeakPolarHBondContact O-CB 3.48Å; P259-L262 PolarHBondContact O-N 2.95Å; P259-L264 HydrophobicContact CB-CD2 4.17Å
260	D	93	Very high	94.2	Very high	76 Å²	76	86.5 Å²	86.5	41%	0.406	42%	0.418	S	S	.	.	G	3₁₀ helix	trans	-59.2	-12.2	174.4	-58.6	-44.6	0	0	0	114.2	Y90 K258 L262	Y90-D260 WeakPolarHBondContact CE1-OD1 3.47Å; Y90-D260 PolarHBondContact OH-OD1 2.93Å; Y90-D260 VanDerWaalsContact OH-OD1 3.06Å; K258-D260 HydrophobicContact CB-CB 4.46Å; K258-D260 PolarHBondContact O-N 3.45Å; K258-D260 VanDerWaalsContact O-N 3.09Å; D260-L262 CarbonylContact C-O 3.54Å
261	K	94.1	Very high	94.6	Very high	169 Å²	169	83.5 Å²	83.5	74%	0.735	40%	0.4	S	S	*	.	G	3₁₀ helix	trans	-84.9	-21.5	175.7	-64.7	-58.1	-173.1	179.7	0	113.3	W104 C257 K258 P259	W104-K261 HydrophobicContact CH2-CB 4.47Å; C257-K261 HydrophobicContact CB-CG 4.34Å; K258-K261 WeakPolarHBondContact O-CB 3.32Å; K258-K261 PolarHBondContact O-N 2.78Å; P259-K261 PolarHBondContact O-N 2.98Å
262	L	93.7	Very high	95	Very high	10 Å²	10	77.1 Å²	77.1	5%	0.052	37%	0.373	C	S	.	.	S	Bend	trans	-71.2	152.5	158.1	-162	67.4	0	0	0	107	A98 W104 Y105 F108 P259 D260 L264	A98-L262 HydrophobicContact CB-CD1 3.55Å; A98-L262 HydrophobicContact CB-CG 4.03Å; W104-L262 HydrophobicContact CB-CD2 4.08Å; W104-L262 HydrophobicContact CD2-CB 4.45Å; W104-L262 HydrophobicContact CD2-CD1 4.38Å; W104-L262 HydrophobicContact CD2-CD2 4.35Å; W104-L262 HydrophobicContact CG-CD1 4.17Å; W104-L262 HydrophobicContact CG-CD2 4.1Å; Y105-L262 HydrophobicContact CE1-CD2 4.23Å; F108-L262 HydrophobicContact CE2-CD2 4.4Å; P259-L262 WeakPolarHBondContact O-CB 3.48Å; P259-L262 PolarHBondContact O-N 2.95Å; D260-L262 CarbonylContact C-O 3.54Å; L262-L264 HydrophobicContact CB-CB 4.04Å; L262-L264 HydrophobicContact CD2-CB 4.27Å; L262-L264 HydrophobicContact CG-CB 4.36Å; L262-L264 PolarHBondContact O-N 3.35Å
263	P	94	Very high	95.2	Very high	52 Å²	52	76.5 Å²	76.5	34%	0.338	37%	0.369	S	S	.	.	S	Bend	trans	-68.5	59.6	169.8	30.8	-38.1	0	0	0	111.2	F97 A98 F265	F97-P263 HydrophobicContact CE2-CB 4.23Å; F97-P263 HydrophobicContact CE2-CG 4.01Å; F97-P263 HydrophobicContact CZ-CB 4.31Å; F97-P263 HydrophobicContact CZ-CG 4.41Å; A98-P263 HydrophobicContact CB-CG 3.56Å; P263-F265 HydrophobicContact CB-CE2 4.42Å
264	L	94.8	Very high	95.4	Very high	4 Å²	4	77 Å²	77	2%	0.021	37%	0.368	C	S	.	.			trans	-123	119.4	-173.6	-166.9	79	0	0	0	107.9	Y90 M91 V92 F108 P259 L262	Y90-L264 HydrophobicContact CD1-CD2 3.71Å; Y90-L264 HydrophobicContact CD1-CG 3.9Å; Y90-L264 HydrophobicContact CE1-CD2 4.41Å; Y90-L264 HydrophobicContact CG-CD2 3.94Å; Y90-L264 HydrophobicContact CG-CG 4.41Å; M91-L264 WeakPolarHBondContact O-CD1 3.31Å; V92-L264 HydrophobicContact CG2-CD1 4.32Å; F108-L264 HydrophobicContact CE2-CD2 3.88Å; F108-L264 HydrophobicContact CZ-CD2 4.07Å; P259-L264 HydrophobicContact CB-CD2 4.17Å; L262-L264 HydrophobicContact CB-CB 4.04Å; L262-L264 HydrophobicContact CD2-CB 4.27Å; L262-L264 HydrophobicContact CG-CB 4.36Å; L262-L264 PolarHBondContact O-N 3.35Å
265	F	96.4	Very high	95.6	Very high	141 Å²	141	71 Å²	71	62%	0.618	33%	0.332	S	S	*	.			trans	-116.4	147.6	-169.6	-59.1	-85.1	0	0	0	111.7	M91 P263	M91-F265 PolarHBondContact N-O 3.4Å; M91-F265 VanDerWaalsContact N-O 3.1Å; P263-F265 HydrophobicContact CB-CE2 4.42Å
266	K	96.9	Very high	95.7	Very high	64 Å²	64	68.3 Å²	68.3	28%	0.278	32%	0.319	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84	128.8	174.9	-63.5	177.7	-172.6	167.1	0	110.6	K88 K89 Y90 E206	K88-K266 HydrophobicContact CB-CB 4.31Å; K89-K266 CarbonylContact O-C 3.48Å; K89-K266 VanDerWaalsContact O-CA 3.24Å; K89-K266 WeakPolarHBondContact O-CA 3.34Å; Y90-K266 HydrophobicContact CD1-CG 3.71Å; Y90-K266 HydrophobicContact CD2-CG 4.44Å; Y90-K266 HydrophobicContact CE1-CD 4.25Å; Y90-K266 VanDerWaalsContact CE1-CE 3.47Å; Y90-K266 HydrophobicContact CE1-CG 3.66Å; Y90-K266 VanDerWaalsContact CE2-CE 3.45Å; Y90-K266 HydrophobicContact CE2-CG 4.41Å; Y90-K266 HydrophobicContact CG-CG 4.13Å; Y90-K266 WeakPolarHBondContact OH-CE 3.32Å; Y90-K266 PolarHBondContact OH-NZ 3.29Å; E206-K266 IonicContact OE1-NZ 3.61Å; E206-K266 PolarHBondContact OE1-NZ 3.05Å; E206-K266 IonicContact OE2-NZ 3.41Å
267	R	97.6	Very high	95.9	Very high	147 Å²	147	59 Å²	59	56%	0.555	28%	0.282	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-130.6	164.7	170.3	-70.8	-173.6	58.2	-160.8	11.3	110.1	K88 K89 M91 Y269	K88-R267 WeakPolarHBondContact CA-O 3.32Å; K89-R267 WeakPolarHBondContact CG-O 2.96Å; K89-R267 PolarHBondContact N-O 3.31Å; K89-R267 PolarHBondContact O-N 2.9Å; K89-R267 VanDerWaalsContact O-O 3.1Å; M91-R267 HydrophobicContact CG-CB 4.26Å; M91-R267 HydrophobicContact SD-CB 3.83Å; M91-R267 WeakPolarHBondContact SD-CD 3.22Å; M91-R267 HydrophobicContact SD-CG 3.93Å; R267-Y269 HydrophobicContact CB-CD1 4.17Å; R267-Y269 HydrophobicContact CB-CE1 4.19Å
268	Q	98.1	Very high	96.1	Very high	112 Å²	112	63.5 Å²	63.5	52%	0.523	29%	0.294	S	S	.	.			trans	-127.8	123.2	176	179.6	173.7	-33.1	0	0	108.4	Q86	Q86-Q268 HydrophobicContact CB-CG 4.26Å; Q86-Q268 PolarHBondContact O-NE2 3Å
269	Y	97.8	Very high	96.1	Very high	54 Å²	54	61.7 Å²	61.7	21%	0.212	29%	0.29	C	S	.	.			trans	-162.9	-178.1	177.8	58.1	-88.7	0	0	0	107.9	K89 M91 Q223 N225 R267 N271	K89-Y269 VanDerWaalsContact CE-CZ 3.49Å; M91-Y269 HydrophobicContact CE-CE1 4.25Å; M91-Y269 HydrophobicContact CG-CE1 3.92Å; M91-Y269 HydrophobicContact SD-CE1 3.78Å; Q223-Y269 HydrophobicContact CG-CE2 4.18Å; Q223-Y269 VanDerWaalsContact CG-OH 3.25Å; Q223-Y269 WeakPolarHBondContact CG-OH 3.17Å; N225-Y269 PolarHBondContact ND2-OH 3.08Å; R267-Y269 HydrophobicContact CB-CD1 4.17Å; R267-Y269 HydrophobicContact CB-CE1 4.19Å; Y269-N271 PolarHBondContact O-N 3.47Å
270	E	97.8	Very high	96.1	Very high	111 Å²	111	65.5 Å²	65.5	52%	0.519	32%	0.323	S	S	.	.			trans	-53.7	137.8	178.8	-171.1	165	-161.4	0	0	112.7	K89 T272	K89-E270 PolarHBondContact NZ-O 3.46Å; E270-T272 HydrophobicContact CG-CG2 4.24Å
271	N	98.3	Very high	96.3	Very high	4 Å²	4	63.8 Å²	63.8	2%	0.021	31%	0.314	C	S	.	.			trans	-87	120	173.9	-56.3	-42.6	0	0	0	107.8	T83 M85 K89 Y200 Y269	T83-N271 WeakPolarHBondContact CB-O 3.28Å; T83-N271 HydrophobicContact CG2-CB 4.01Å; T83-N271 PolarHBondContact O-ND2 3.49Å; M85-N271 PolarHBondContact O-ND2 3.06Å; K89-N271 WeakPolarHBondContact CD-OD1 3.42Å; K89-N271 WeakPolarHBondContact CE-OD1 3.3Å; K89-N271 PolarHBondContact NZ-OD1 2.93Å; Y200-N271 HydrophobicContact CD1-CB 4.29Å; Y200-N271 HydrophobicContact CD2-CB 4.14Å; Y200-N271 HydrophobicContact CG-CB 4Å; Y269-N271 PolarHBondContact O-N 3.47Å
272	T	97.6	Very high	96.4	Very high	36 Å²	36	60.5 Å²	60.5	22%	0.221	31%	0.31	C	S	.	.			trans	-118.7	139.4	-176.6	51.3	0	0	0	0	109.9	D198 Q223 E270	D198-T272 VanDerWaalsContact CB-OG1 3.24Å; D198-T272 WeakPolarHBondContact CB-OG1 3.3Å; D198-T272 VanDerWaalsContact OD2-CB 3.26Å; D198-T272 WeakPolarHBondContact OD2-CB 3.34Å; D198-T272 PolarHBondContact OD2-OG1 2.51Å; Q223-T272 PolarHBondContact NE2-O 3.42Å; Q223-T272 PolarHBondContact NE2-OG1 3.49Å; E270-T272 HydrophobicContact CG-CG2 4.24Å
273	I	98.3	Very high	96.5	Very high	13 Å²	13	60.7 Å²	60.7	7%	0.067	31%	0.312	C	S	.	.			trans	-133	109	174.6	-55.2	-172.6	0	0	0	105.2	V79 T83 D198 F199 A329 M332	V79-I273 HydrophobicContact CG1-CB 4.4Å; T83-I273 HydrophobicContact CG2-CD1 3.85Å; T83-I273 HydrophobicContact CG2-CG1 3.93Å; D198-I273 CarbonylContact O-C 3.59Å; D198-I273 WeakPolarHBondContact O-CA 3.38Å; F199-I273 HydrophobicContact CD2-CG2 4.16Å; I273-A329 HydrophobicContact CG2-CB 3.99Å; I273-M332 HydrophobicContact CD1-CE 4.33Å; I273-M332 HydrophobicContact CD1-SD 3.21Å; I273-M332 WeakPolarHBondContact CD1-SD 3.26Å; I273-M332 HydrophobicContact CG1-SD 4.45Å; I273-M332 HydrophobicContact CG2-CB 4.16Å; I273-M332 HydrophobicContact CG2-SD 4.18Å
274	F	98	Very high	96.5	Very high	48 Å²	48	59.2 Å²	59.2	21%	0.211	30%	0.302	C	S	.	.	B	Isolated β-bridge	trans	-150.3	126.3	-167	-171.8	-111	0	0	0	110.3	P196 V197 D198 G276 S277	P196-F274 HydrophobicContact CG-CD1 4.06Å; P196-F274 HydrophobicContact CG-CE1 3.92Å; P196-F274 WeakPolarHBondContact O-CD1 3.22Å; P196-F274 WeakPolarHBondContact O-CE1 3.31Å; V197-F274 CarbonylContact C-O 3.51Å; V197-F274 WeakPolarHBondContact CA-O 3.46Å; D198-F274 HydrophobicContact CB-CB 4.16Å; D198-F274 PolarHBondContact N-O 3.27Å; D198-F274 PolarHBondContact O-N 3.03Å; F274-G276 WeakPolarHBondContact CE1-O 3.21Å; F274-G276 WeakPolarHBondContact CZ-O 3.21Å; F274-S277 VanDerWaalsContact CE2-O 3.25Å; F274-S277 WeakPolarHBondContact CE2-O 3.34Å
275	T	95.9	Very high	96.6	Very high	2 Å²	2	60.2 Å²	60.2	1%	0.012	31%	0.306	C	S	.	.	S	Bend	trans	-91.9	-3.7	-176.6	54.5	0	0	0	0	113.7	Q231 S277 W326 A329 Q330 Y333	Q231-T275 PolarHBondContact NE2-O 3.25Å; T275-S277 PolarHBondContact OG1-O 3.43Å; T275-W326 PolarHBondContact O-NE1 3.31Å; T275-A329 HydrophobicContact CG2-CB 3.56Å; T275-Q330 HydrophobicContact CG2-CG 4.08Å; T275-Y333 HydrophobicContact CG2-CD1 4.32Å; T275-Y333 HydrophobicContact CG2-CD2 3.98Å; T275-Y333 HydrophobicContact CG2-CE1 4.27Å; T275-Y333 HydrophobicContact CG2-CE2 3.92Å; T275-Y333 HydrophobicContact CG2-CG 4.18Å; T275-Y333 WeakPolarHBondContact OG1-CE2 3.23Å
276	G	95.1	Very high	96.6	Very high	4 Å²	4	53.6 Å²	53.6	4%	0.041	28%	0.277	C	S	.	.	S	Bend	trans	114.7	-22	-167.9	0	0	0	0	0	113.5	F274	F274-G276 WeakPolarHBondContact CE1-O 3.21Å; F274-G276 WeakPolarHBondContact CZ-O 3.21Å
277	S	96.9	Very high	96.6	Very high	25 Å²	25	50.5 Å²	50.5	18%	0.175	26%	0.264	C	S	.	.	S	Bend	trans	-140.3	168	173.5	-165.2	0	0	0	0	111.6	R233 F274 T275 D281 Y333	R233-S277 VanDerWaalsContact NH1-CB 3.34Å; F274-S277 VanDerWaalsContact CE2-O 3.25Å; F274-S277 WeakPolarHBondContact CE2-O 3.34Å; T275-S277 PolarHBondContact OG1-O 3.43Å; S277-D281 WeakPolarHBondContact CB-OD2 3.27Å; S277-D281 WeakPolarHBondContact OG-CB 3.23Å; S277-D281 PolarHBondContact OG-OD2 3.24Å; S277-Y333 WeakPolarHBondContact O-CE2 3.35Å; S277-Y333 PolarHBondContact O-OH 2.97Å
278	K	96.3	Very high	96.7	Very high	162 Å²	162	43.5 Å²	43.5	70%	0.704	24%	0.237	S	C	*	.			trans	-73.9	161.3	177.6	-67.5	-175.7	178.3	-179.8	0	110.4	A280 D281	K278-A280 PolarHBondContact O-N 2.91Å; K278-A280 VanDerWaalsContact O-N 3.16Å; K278-D281 WeakPolarHBondContact O-CB 3.41Å; K278-D281 PolarHBondContact O-N 3.04Å
279	T	93.9	Very high	96.7	Very high	48 Å²	48	38.2 Å²	38.2	29%	0.294	21%	0.212	S	C	.	.	T	Hydrogen-bonded Turn	trans	-56.3	-26.9	179.1	45.3	0	0	0	0	114.5	V75 D76 D281 Y333	V75-T279 HydrophobicContact CG1-CG2 4.41Å; D76-T279 VanDerWaalsContact OD1-CB 3.26Å; D76-T279 WeakPolarHBondContact OD1-CB 3.26Å; D76-T279 VanDerWaalsContact OD1-CG2 3.26Å; D76-T279 WeakPolarHBondContact OD1-CG2 3.41Å; D76-T279 PolarHBondContact OD1-OG1 3.27Å; D76-T279 PolarHBondContact OD2-OG1 3.45Å; T279-D281 VanDerWaalsContact C-N 3.28Å; T279-D281 PolarHBondContact O-N 2.9Å; T279-Y333 HydrophobicContact CG2-CD1 3.93Å; T279-Y333 HydrophobicContact CG2-CD2 3.91Å; T279-Y333 HydrophobicContact CG2-CE1 3.85Å; T279-Y333 HydrophobicContact CG2-CE2 3.84Å; T279-Y333 HydrophobicContact CG2-CG 3.96Å
280	A	94.6	Very high	96.7	Very high	94 Å²	94	35.7 Å²	35.7	78%	0.777	20%	0.203	S	C	*	.	T	Hydrogen-bonded Turn	trans	-74.5	-13.1	177.7	0	0	0	0	0	114.4	K278	K278-A280 PolarHBondContact O-N 2.91Å; K278-A280 VanDerWaalsContact O-N 3.16Å
281	D	96.3	Very high	96.7	Very high	40 Å²	40	30.5 Å²	30.5	21%	0.214	18%	0.178	C	C	.	.			trans	-75	128.1	-179.6	-175.2	-16.2	0	0	0	110.8	R233 S277 K278 T279 C283	R233-D281 IonicContact CZ-OD2 3.63Å; R233-D281 IonicContact NH1-OD1 3.26Å; R233-D281 IonicContact NH1-OD2 3.06Å; R233-D281 PolarHBondContact NH1-OD2 2.99Å; R233-D281 IonicContact NH2-OD2 3.35Å; R233-D281 PolarHBondContact NH2-OD2 2.6Å; S277-D281 WeakPolarHBondContact CB-OD2 3.27Å; S277-D281 WeakPolarHBondContact OG-CB 3.23Å; S277-D281 PolarHBondContact OG-OD2 3.24Å; K278-D281 WeakPolarHBondContact O-CB 3.41Å; K278-D281 PolarHBondContact O-N 3.04Å; T279-D281 VanDerWaalsContact C-N 3.28Å; T279-D281 PolarHBondContact O-N 2.9Å; D281-C283 PolarHBondContact O-N 3.35Å; D281-C283 PolarHBondContact OD1-N 3.36Å
282	P	95.3	Very high	96.6	Very high	100 Å²	100	31.3 Å²	31.3	65%	0.649	18%	0.182	S	C	*	.	S	Bend	trans	-61	-28.9	177.1	25.6	-36.1	0	0	0	113.3	S235 C284	S235-P282 WeakPolarHBondContact CA-O 3.45Å; P282-C284 PolarHBondContact O-N 2.91Å
283	C	95.9	Very high	96.4	Very high	14 Å²	14	30.6 Å²	30.6	10%	0.095	18%	0.177	C	C	.	.			trans	-81.3	63.2	178.6	-66.5	0	0	0	0	111.3	A190 R233 I234 D281	A190-C283 HydrophobicContact CB-CB 4.32Å; R233-C283 HydrophobicContact CB-CB 4.08Å; R233-C283 PolarHBondContact NH1-O 3.5Å; I234-C283 CarbonylContact O-C 3.36Å; I234-C283 WeakPolarHBondContact O-CA 3.38Å; D281-C283 PolarHBondContact O-N 3.35Å; D281-C283 PolarHBondContact OD1-N 3.36Å
284	C	94.2	Very high	96.2	Very high	20 Å²	20	31.6 Å²	31.6	14%	0.135	18%	0.184	C	C	.	.			trans	-88.9	-7.3	-174.6	62.5	0	0	0	0	114.4	P282	P282-C284 PolarHBondContact O-N 2.91Å
285	Y	97.4	Very high	95.7	Very high	26 Å²	26	30.3 Å²	30.3	10%	0.102	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.9	145.8	179	-62.5	-77.7	0	0	0	111.9	R233 I234 S235 Q237 Q334 R344 F346	R233-Y285 CarbonylContact C-O 3.55Å; R233-Y285 VanDerWaalsContact CA-O 3.26Å; R233-Y285 WeakPolarHBondContact CA-O 3.5Å; I234-Y285 PolarHBondContact N-O 2.92Å; I234-Y285 PolarHBondContact O-N 2.92Å; I234-Y285 VanDerWaalsContact O-N 3.14Å; S235-Y285 WeakPolarHBondContact O-CD2 3.28Å; Q237-Y285 HydrophobicContact CB-CD1 3.81Å; Q237-Y285 HydrophobicContact CB-CD2 4.45Å; Q237-Y285 HydrophobicContact CB-CE1 3.81Å; Q237-Y285 HydrophobicContact CB-CE2 4.47Å; Q237-Y285 HydrophobicContact CB-CG 4.14Å; Q237-Y285 HydrophobicContact CG-CD1 3.89Å; Q237-Y285 HydrophobicContact CG-CE1 3.97Å; Y285-Q334 HydrophobicContact CE1-CG 4.45Å; Y285-Q334 PolarHBondContact OH-OE1 3.05Å; Y285-R344 PolarHBondContact OH-NH2 3.43Å; Y285-F346 HydrophobicContact CD1-CE1 4.31Å; Y285-F346 HydrophobicContact CE1-CD1 4.39Å; Y285-F346 AromaticContact CE1-CE1 3.8Å; Y285-F346 HydrophobicContact CE1-CE1 3.8Å
286	G	96.7	Very high	95.3	Very high	1 Å²	1	39.7 Å²	39.7	1%	0.01	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.7	138.2	176.6	0	0	0	0	0	112.1
287	H	97.6	Very high	95.1	Very high	0 Å²	0	40 Å²	40	0%	0	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.3	-82.2	169.7	-177.4	-71.1	0	0	0	109.9	I232 I234 Q349 F415 N418	I232-H287 HydrophobicContact CB-CB 4.12Å; I232-H287 HydrophobicContact CG2-CB 3.92Å; I232-H287 WeakPolarHBondContact O-CB 2.98Å; I232-H287 PolarHBondContact O-N 2.95Å; I234-H287 HydrophobicContact CD1-CB 4.11Å; I234-H287 HydrophobicContact CG1-CB 4.2Å; I234-H287 HydrophobicContact CG2-CB 4.25Å; H287-Q349 PolarHBondContact CE1-OE1 2.86Å; H287-Q349 PolarHBondContact O-N 3.32Å; H287-Q349 VanDerWaalsContact O-N 3.08Å; H287-F415 PolarHBondContact CE1-O 3.44Å; H287-N418 PolarHBondContact NE2-O 3.12Å
288	T	98.4	Very high	94.8	Very high	0 Å²	0	39.7 Å²	39.7	0%	0	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.7	136.7	-179.2	-59.9	0	0	0	0	111.2	I232 F290 Q349 V351	I232-T288 PolarHBondContact N-O 3.28Å; T288-F290 HydrophobicContact CG2-CD2 4.35Å; T288-F290 HydrophobicContact CG2-CE2 3.79Å; T288-F290 HydrophobicContact CG2-CZ 3.92Å; T288-Q349 CarbonylContact C-O 3.55Å; T288-Q349 WeakPolarHBondContact CA-O 3.32Å; T288-Q349 HydrophobicContact CG2-CB 4.2Å; T288-Q349 PolarHBondContact OG1-OE1 3.42Å; T288-V351 HydrophobicContact CG2-CG2 4.14Å
289	Q	98.3	Very high	94.5	Very high	0 Å²	0	34.8 Å²	34.8	0%	0	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	142.2	168.5	-86.7	179.4	-1.1	0	0	111.8	P228 Q231 H291 W326 Q349 G350 V351	P228-Q289 HydrophobicContact CB-CG 4.22Å; Q231-Q289 HydrophobicContact CB-CG 3.79Å; Q289-H291 PolarHBondContact OE1-NE2 2.86Å; Q289-W326 HydrophobicContact CB-CZ3 4.22Å; Q289-W326 HydrophobicContact CG-CD2 4.01Å; Q289-W326 HydrophobicContact CG-CE3 3.65Å; Q289-W326 HydrophobicContact CG-CH2 3.73Å; Q289-W326 HydrophobicContact CG-CZ2 4.07Å; Q289-W326 HydrophobicContact CG-CZ3 3.53Å; Q289-Q349 PolarHBondContact N-O 3.15Å; Q289-G350 CarbonylContact O-C 3.52Å; Q289-G350 WeakPolarHBondContact O-CA 3.37Å; Q289-V351 PolarHBondContact O-N 2.63Å
290	F	98.4	Very high	94.4	Very high	2 Å²	2	36.9 Å²	36.9	1%	0.009	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	127.4	172.1	-64.4	-92.4	0	0	0	109.7	L168 V172 H229 N230 I232 T288 V351 L416	L168-F290 HydrophobicContact CD1-CD1 4.32Å; L168-F290 HydrophobicContact CD2-CB 4.41Å; V172-F290 HydrophobicContact CG1-CD2 4.22Å; V172-F290 HydrophobicContact CG1-CE2 3.94Å; V172-F290 HydrophobicContact CG2-CD1 3.84Å; V172-F290 HydrophobicContact CG2-CD2 3.71Å; V172-F290 HydrophobicContact CG2-CE1 3.89Å; V172-F290 HydrophobicContact CG2-CE2 3.77Å; V172-F290 HydrophobicContact CG2-CG 3.75Å; V172-F290 HydrophobicContact CG2-CZ 3.86Å; H229-F290 WeakPolarHBondContact CA-O 3.24Å; H229-F290 WeakPolarHBondContact CB-O 3.44Å; H229-F290 PolarHBondContact N-O 2.92Å; N230-F290 HydrophobicContact CB-CB 4.15Å; N230-F290 HydrophobicContact CB-CD2 4.22Å; N230-F290 PolarHBondContact N-O 3.47Å; N230-F290 PolarHBondContact O-N 3.18Å; I232-F290 HydrophobicContact CD1-CE2 4.15Å; T288-F290 HydrophobicContact CG2-CD2 4.35Å; T288-F290 HydrophobicContact CG2-CE2 3.79Å; T288-F290 HydrophobicContact CG2-CZ 3.92Å; F290-V351 WeakPolarHBondContact CA-O 3.38Å; F290-V351 HydrophobicContact CD1-CB 3.76Å; F290-V351 HydrophobicContact CD1-CG1 4.17Å; F290-V351 HydrophobicContact CD1-CG2 4.26Å; F290-V351 HydrophobicContact CE1-CB 3.92Å; F290-V351 HydrophobicContact CE1-CG1 4.29Å; F290-V351 HydrophobicContact CE1-CG2 3.93Å; F290-L416 HydrophobicContact CE2-CD2 4.44Å; F290-L416 HydrophobicContact CZ-CD2 4.19Å
291	H	97.9	Very high	94.2	Very high	1 Å²	1	35.6 Å²	35.6	1%	0.005	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	129.2	-177.7	-75.1	-82.5	0	0	0	110.4	D226 Q289 S322 V351 I352 T353	D226-H291 IonicContact OD2-CE1 2.79Å; D226-H291 PolarHBondContact OD2-CE1 3.35Å; D226-H291 IonicContact OD2-ND1 3.66Å; D226-H291 IonicContact OD2-NE2 3.79Å; Q289-H291 PolarHBondContact OE1-NE2 2.86Å; H291-S322 PolarHBondContact CE1-OG 3.27Å; H291-V351 PolarHBondContact N-O 3.19Å; H291-I352 HydrophobicContact CB-CG1 4.08Å; H291-T353 PolarHBondContact O-N 2.89Å
292	L	95.9	Very high	94	Very high	21 Å²	21	34.3 Å²	34.3	11%	0.11	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.6	120.8	172.3	177.2	56.4	0	0	0	109.5	Q95 V164 L168 H229 T353	Q95-L292 PolarHBondContact NE2-O 3.37Å; V164-L292 HydrophobicContact CB-CD1 4.21Å; V164-L292 HydrophobicContact CB-CD2 4.23Å; V164-L292 HydrophobicContact CG1-CD1 3.34Å; V164-L292 HydrophobicContact CG1-CD2 3.93Å; V164-L292 HydrophobicContact CG1-CG 4.29Å; L168-L292 HydrophobicContact CD2-CB 4.22Å; H229-L292 HydrophobicContact CB-CB 4.28Å; L292-T353 WeakPolarHBondContact CA-O 3.41Å
293	L	94.1	Very high	93.9	Very high	22 Å²	22	33 Å²	33	12%	0.115	16%	0.155	C	C	.	.	P	Polyproline II helix	trans	-68.9	138.5	174.2	-66.3	179	0	0	0	111	V314 I352 T353	L293-V314 HydrophobicContact CD1-CG1 4.37Å; L293-V314 HydrophobicContact CD2-CG1 4.1Å; L293-I352 HydrophobicContact CD1-CG2 4.15Å; L293-I352 HydrophobicContact CD2-CG2 4.01Å; L293-I352 HydrophobicContact CG-CG2 3.87Å; L293-T353 PolarHBondContact N-O 3.42Å
294	P	92.2	Very high	93.8	Very high	33 Å²	33	40.7 Å²	40.7	21%	0.214	19%	0.187	C	C	.	.	P	Polyproline II helix	trans	-75.5	158.3	178.4	31.8	-34	0	0	0	110.5	Q95 R296 L297	Q95-P294 VanDerWaalsContact OE1-CD 3.29Å; P294-R296 PolarHBondContact O-N 2.97Å; P294-L297 HydrophobicContact CG-CB 4.47Å; P294-L297 HydrophobicContact CG-CD1 4.07Å; P294-L297 HydrophobicContact CG-CG 4.16Å; P294-L297 PolarHBondContact O-N 3.37Å
295	D	88.3	Confident	93.7	Very high	22 Å²	22	45.4 Å²	45.4	12%	0.118	21%	0.207	C	C	.	.	G	3₁₀ helix	trans	-61.3	-17.4	-178.7	-173.8	51.6	0	0	0	113.7	F157 L297 N298 K301	F157-D295 WeakPolarHBondContact CD2-OD2 3.33Å; D295-L297 VanDerWaalsContact C-N 3.28Å; D295-L297 PolarHBondContact O-N 3.34Å; D295-N298 VanDerWaalsContact O-CB 3.26Å; D295-N298 WeakPolarHBondContact O-CB 3.36Å; D295-N298 PolarHBondContact O-N 2.96Å; D295-N298 PolarHBondContact OD1-ND2 2.93Å; D295-K301 VanDerWaalsContact CG-NZ 3.28Å; D295-K301 WeakPolarHBondContact O-CD 3.27Å; D295-K301 WeakPolarHBondContact O-CE 3.32Å; D295-K301 PolarHBondContact O-NZ 3.15Å; D295-K301 IonicContact OD1-NZ 2.86Å; D295-K301 IonicContact OD2-NZ 3.39Å; D295-K301 PolarHBondContact OD2-NZ 3.48Å
296	R	88.3	Confident	93.5	Very high	199 Å²	199	51.4 Å²	51.4	75%	0.751	24%	0.241	S	C	*	.	G	3₁₀ helix	trans	-66.2	-29.8	172.4	-65.9	-175.2	-174.8	171.7	1.9	113.1	F157 P294	F157-R296 HydrophobicContact CZ-CG 4.2Å; P294-R296 PolarHBondContact O-N 2.97Å
297	L	91	Very high	93.4	Very high	10 Å²	10	54.2 Å²	54.2	5%	0.052	25%	0.254	C	S	.	.	G	3₁₀ helix	trans	-103.6	23.8	-179.2	-59.3	177.3	0	0	0	111.5	Q95 F97 P294 D295 R299 V314	Q95-L297 HydrophobicContact CB-CD1 3.98Å; F97-L297 HydrophobicContact CB-CD2 3.84Å; P294-L297 HydrophobicContact CG-CB 4.47Å; P294-L297 HydrophobicContact CG-CD1 4.07Å; P294-L297 HydrophobicContact CG-CG 4.16Å; P294-L297 PolarHBondContact O-N 3.37Å; D295-L297 VanDerWaalsContact C-N 3.28Å; D295-L297 PolarHBondContact O-N 3.34Å; L297-R299 PolarHBondContact O-N 2.84Å; L297-V314 HydrophobicContact CB-CG1 4.2Å; L297-V314 HydrophobicContact CD1-CG1 3.82Å; L297-V314 HydrophobicContact CG-CG1 4.42Å
298	N	89.5	Confident	93.1	Very high	18 Å²	18	58 Å²	58	10%	0.096	28%	0.277	C	S	.	.			trans	-63.4	132	-179.5	-179.4	-8.2	0	0	0	111	R160 D295 D300 K301 L302	R160-N298 PolarHBondContact NH1-ND2 2.72Å; R160-N298 VanDerWaalsContact NH1-ND2 3.16Å; R160-N298 PolarHBondContact NH1-OD1 2.84Å; D295-N298 VanDerWaalsContact O-CB 3.26Å; D295-N298 WeakPolarHBondContact O-CB 3.36Å; D295-N298 PolarHBondContact O-N 2.96Å; D295-N298 PolarHBondContact OD1-ND2 2.93Å; N298-D300 VanDerWaalsContact C-N 3.29Å; N298-D300 PolarHBondContact O-N 3.41Å; N298-D300 PolarHBondContact OD1-N 2.88Å; N298-D300 VanDerWaalsContact OD1-N 3.09Å; N298-K301 HydrophobicContact CB-CB 4.49Å; N298-K301 HydrophobicContact CB-CD 4.22Å; N298-K301 HydrophobicContact CB-CG 4.2Å; N298-K301 WeakPolarHBondContact O-CB 3.32Å; N298-K301 PolarHBondContact O-N 3.48Å; N298-L302 PolarHBondContact O-N 3.4Å; N298-L302 VanDerWaalsContact O-N 3.13Å
299	R	91.4	Very high	92.7	Very high	59 Å²	59	65.9 Å²	65.9	22%	0.223	31%	0.314	C	S	.	.	H	α-helix	trans	-45.3	-48.9	175	-174.6	176	-164.7	115	3.8	113	L297 K301 L302 I303 V311 S389	L297-R299 PolarHBondContact O-N 2.84Å; R299-K301 VanDerWaalsContact C-N 3.27Å; R299-K301 PolarHBondContact O-N 3.15Å; R299-L302 PolarHBondContact O-N 3.27Å; R299-I303 HydrophobicContact CG-CD1 3.81Å; R299-I303 HydrophobicContact CG-CG1 4.49Å; R299-I303 WeakPolarHBondContact O-CG1 3.22Å; R299-I303 PolarHBondContact O-N 3.42Å; R299-V311 HydrophobicContact CB-CG1 4.47Å; R299-V311 HydrophobicContact CG-CG1 4.01Å; R299-V311 HydrophobicContact CG-CG2 4.08Å; R299-S389 PolarHBondContact NH1-OG 2.86Å
300	D	90.8	Very high	92.5	Very high	92 Å²	92	66.7 Å²	66.7	49%	0.492	32%	0.318	S	S	.	.	H	α-helix	trans	-64.7	-33.5	-176.8	-61.7	-26.9	0	0	0	112.4	N298 K304	N298-D300 VanDerWaalsContact C-N 3.29Å; N298-D300 PolarHBondContact O-N 3.41Å; N298-D300 PolarHBondContact OD1-N 2.88Å; N298-D300 VanDerWaalsContact OD1-N 3.09Å; D300-K304 WeakPolarHBondContact O-CB 3.48Å; D300-K304 WeakPolarHBondContact O-CG 3.45Å; D300-K304 PolarHBondContact O-N 2.96Å
301	K	90.4	Very high	92.3	Very high	68 Å²	68	67.1 Å²	67.1	30%	0.296	32%	0.32	S	S	.	.	H	α-helix	trans	-71	-41.8	177.5	-66.9	-177.4	-174	166.9	0	110.9	D295 N298 R299 K304 Q305	D295-K301 VanDerWaalsContact CG-NZ 3.28Å; D295-K301 WeakPolarHBondContact O-CD 3.27Å; D295-K301 WeakPolarHBondContact O-CE 3.32Å; D295-K301 PolarHBondContact O-NZ 3.15Å; D295-K301 IonicContact OD1-NZ 2.86Å; D295-K301 IonicContact OD2-NZ 3.39Å; D295-K301 PolarHBondContact OD2-NZ 3.48Å; N298-K301 HydrophobicContact CB-CB 4.49Å; N298-K301 HydrophobicContact CB-CD 4.22Å; N298-K301 HydrophobicContact CB-CG 4.2Å; N298-K301 WeakPolarHBondContact O-CB 3.32Å; N298-K301 PolarHBondContact O-N 3.48Å; R299-K301 VanDerWaalsContact C-N 3.27Å; R299-K301 PolarHBondContact O-N 3.15Å; K301-K304 PolarHBondContact O-N 3.28Å; K301-Q305 WeakPolarHBondContact O-CB 3.44Å; K301-Q305 VanDerWaalsContact O-CG 3.27Å; K301-Q305 WeakPolarHBondContact O-CG 3.35Å; K301-Q305 PolarHBondContact O-N 3.19Å
302	L	92.5	Very high	92.2	Very high	13 Å²	13	69 Å²	69	7%	0.068	33%	0.329	C	S	.	.	H	α-helix	trans	-63.6	-42.4	176	-66.1	174.4	0	0	0	111.3	N298 R299 Q305 N306 Q307 V311 V314	N298-L302 PolarHBondContact O-N 3.4Å; N298-L302 VanDerWaalsContact O-N 3.13Å; R299-L302 PolarHBondContact O-N 3.27Å; L302-Q305 CarbonylContact O-C 3.59Å; L302-Q305 PolarHBondContact O-N 2.96Å; L302-Q305 VanDerWaalsContact O-N 3.14Å; L302-N306 PolarHBondContact O-N 3.29Å; L302-Q307 HydrophobicContact CB-CB 4.44Å; L302-Q307 HydrophobicContact CD2-CB 4.47Å; L302-Q307 WeakPolarHBondContact O-CA 3.45Å; L302-Q307 WeakPolarHBondContact O-CB 3.08Å; L302-Q307 PolarHBondContact O-N 3.34Å; L302-V311 HydrophobicContact CB-CG2 4.12Å; L302-V311 HydrophobicContact CD1-CG2 4Å; L302-V314 HydrophobicContact CD1-CG2 4.46Å
303	I	92.7	Very high	92.2	Very high	71 Å²	71	68.2 Å²	68.2	36%	0.364	33%	0.325	S	S	.	.	H	α-helix	trans	-62.2	-46.4	175.8	-66.9	168.5	0	0	0	110.6	R299 Q305 N306 T308	R299-I303 HydrophobicContact CG-CD1 3.81Å; R299-I303 HydrophobicContact CG-CG1 4.49Å; R299-I303 WeakPolarHBondContact O-CG1 3.22Å; R299-I303 PolarHBondContact O-N 3.42Å; I303-Q305 PolarHBondContact O-N 3.47Å; I303-N306 PolarHBondContact O-N 3.3Å; I303-T308 HydrophobicContact CG1-CG2 4.44Å
304	K	93.7	Very high	92.3	Very high	176 Å²	176	67.4 Å²	67.4	77%	0.765	32%	0.321	S	S	*	.	H	α-helix	trans	-60.8	-24.5	175.8	-75	173.5	-176.8	-178.5	0	113.6	D300 K301 N306	D300-K304 WeakPolarHBondContact O-CB 3.48Å; D300-K304 WeakPolarHBondContact O-CG 3.45Å; D300-K304 PolarHBondContact O-N 2.96Å; K301-K304 PolarHBondContact O-N 3.28Å; K304-N306 VanDerWaalsContact C-N 3.33Å
305	Q	93.1	Very high	92.5	Very high	120 Å²	120	66.3 Å²	66.3	56%	0.561	31%	0.314	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.5	8.3	176.2	-70.2	174.2	-4	0	0	113.2	K301 L302 I303 Q307	K301-Q305 WeakPolarHBondContact O-CB 3.44Å; K301-Q305 VanDerWaalsContact O-CG 3.27Å; K301-Q305 WeakPolarHBondContact O-CG 3.35Å; K301-Q305 PolarHBondContact O-N 3.19Å; L302-Q305 CarbonylContact O-C 3.59Å; L302-Q305 PolarHBondContact O-N 2.96Å; L302-Q305 VanDerWaalsContact O-N 3.14Å; I303-Q305 PolarHBondContact O-N 3.47Å; Q305-Q307 VanDerWaalsContact C-N 3.28Å; Q305-Q307 HydrophobicContact CB-CG 4.3Å; Q305-Q307 PolarHBondContact O-N 3.46Å
306	N	93.3	Very high	93	Very high	152 Å²	152	68.3 Å²	68.3	81%	0.813	32%	0.32	S	S	*	.	T	Hydrogen-bonded Turn	trans	60	33.5	-174.5	-57.9	-43.2	0	0	0	113.6	L302 I303 K304	L302-N306 PolarHBondContact O-N 3.29Å; I303-N306 PolarHBondContact O-N 3.3Å; K304-N306 VanDerWaalsContact C-N 3.33Å
307	Q	93.2	Very high	93.4	Very high	59 Å²	59	58.9 Å²	58.9	28%	0.276	28%	0.284	S	S	.	.			trans	-115.8	42.4	-178.3	-65.1	-179.8	-8	0	0	112.2	L302 Q305 E309 Q310	L302-Q307 HydrophobicContact CB-CB 4.44Å; L302-Q307 HydrophobicContact CD2-CB 4.47Å; L302-Q307 WeakPolarHBondContact O-CA 3.45Å; L302-Q307 WeakPolarHBondContact O-CB 3.08Å; L302-Q307 PolarHBondContact O-N 3.34Å; Q305-Q307 VanDerWaalsContact C-N 3.28Å; Q305-Q307 HydrophobicContact CB-CG 4.3Å; Q305-Q307 PolarHBondContact O-N 3.46Å; Q307-E309 VanDerWaalsContact C-N 3.3Å; Q307-E309 PolarHBondContact O-N 3.19Å; Q307-Q310 HydrophobicContact CB-CB 4.21Å; Q307-Q310 HydrophobicContact CB-CG 4.05Å; Q307-Q310 WeakPolarHBondContact O-CB 3.43Å; Q307-Q310 PolarHBondContact O-N 3.08Å
308	T	91.4	Very high	93.8	Very high	81 Å²	81	58.4 Å²	58.4	50%	0.497	28%	0.282	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59	-38.9	-176.2	-49.7	0	0	0	0	112.9	I303 Q310 V311	I303-T308 HydrophobicContact CG1-CG2 4.44Å; T308-Q310 PolarHBondContact O-N 3.17Å; T308-V311 WeakPolarHBondContact O-CB 3.43Å; T308-V311 WeakPolarHBondContact O-CG2 3.03Å; T308-V311 PolarHBondContact O-N 3.48Å
309	E	91	Very high	94.2	Very high	164 Å²	164	57.6 Å²	57.6	77%	0.766	28%	0.278	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64	-25.6	177.7	-63	-176.7	174.7	0	0	113	Q307 V311	Q307-E309 VanDerWaalsContact C-N 3.3Å; Q307-E309 PolarHBondContact O-N 3.19Å; E309-V311 VanDerWaalsContact C-N 3.26Å; E309-V311 PolarHBondContact O-N 3.34Å
310	Q	93.8	Very high	94.5	Very high	17 Å²	17	54.8 Å²	54.8	8%	0.079	27%	0.267	C	S	.	.	H	α-helix	trans	-76.1	-14.8	-177.4	-60.8	-61.1	-46.3	0	0	112.9	L99 N100 Q307 T308 E312 V313 V314	L99-Q310 HydrophobicContact CD2-CG 3.69Å; N100-Q310 PolarHBondContact OD1-NE2 3.17Å; Q307-Q310 HydrophobicContact CB-CB 4.21Å; Q307-Q310 HydrophobicContact CB-CG 4.05Å; Q307-Q310 WeakPolarHBondContact O-CB 3.43Å; Q307-Q310 PolarHBondContact O-N 3.08Å; T308-Q310 PolarHBondContact O-N 3.17Å; Q310-E312 PolarHBondContact O-N 3.1Å; Q310-V313 PolarHBondContact O-N 2.83Å; Q310-V314 VanDerWaalsContact O-CG2 3.32Å; Q310-V314 WeakPolarHBondContact O-CG2 3.34Å; Q310-V314 PolarHBondContact O-N 3.34Å
311	V	93.6	Very high	94.9	Very high	11 Å²	11	50.4 Å²	50.4	7%	0.067	24%	0.244	C	C	.	.	H	α-helix	trans	-57.7	-50.7	179.1	177.4	0	0	0	0	110.6	R299 L302 T308 E309 C315	R299-V311 HydrophobicContact CB-CG1 4.47Å; R299-V311 HydrophobicContact CG-CG1 4.01Å; R299-V311 HydrophobicContact CG-CG2 4.08Å; L302-V311 HydrophobicContact CB-CG2 4.12Å; L302-V311 HydrophobicContact CD1-CG2 4Å; T308-V311 WeakPolarHBondContact O-CB 3.43Å; T308-V311 WeakPolarHBondContact O-CG2 3.03Å; T308-V311 PolarHBondContact O-N 3.48Å; E309-V311 VanDerWaalsContact C-N 3.26Å; E309-V311 PolarHBondContact O-N 3.34Å; V311-C315 PolarHBondContact O-N 3.21Å
312	E	95.6	Very high	95.2	Very high	41 Å²	41	47.2 Å²	47.2	19%	0.192	23%	0.23	C	C	.	.	H	α-helix	trans	-73.9	-30.3	177.9	-61.9	-57	139.4	0	0	112.4	Q310 V314 C315 R316 S389	Q310-E312 PolarHBondContact O-N 3.1Å; E312-V314 VanDerWaalsContact C-N 3.34Å; E312-C315 PolarHBondContact O-N 2.97Å; E312-R316 WeakPolarHBondContact O-CB 3.3Å; E312-R316 WeakPolarHBondContact O-CG 3.47Å; E312-R316 PolarHBondContact O-N 3.38Å; E312-S389 WeakPolarHBondContact OE1-CB 3.49Å; E312-S389 PolarHBondContact OE1-N 3.28Å; E312-S389 PolarHBondContact OE1-OG 2.91Å; E312-S389 PolarHBondContact OE2-N 3.18Å
313	V	96.5	Very high	95.5	Very high	5 Å²	5	46.6 Å²	46.6	3%	0.03	23%	0.227	C	C	.	.	H	α-helix	trans	-62	-43	175.8	170.4	0	0	0	0	110.8	D102 Q310 R316 A317	D102-V313 HydrophobicContact CB-CG1 4.16Å; D102-V313 WeakPolarHBondContact OD1-CG1 3.18Å; Q310-V313 PolarHBondContact O-N 2.83Å; V313-R316 PolarHBondContact O-N 3.29Å; V313-A317 VanDerWaalsContact O-CB 3.26Å; V313-A317 WeakPolarHBondContact O-CB 3.26Å; V313-A317 PolarHBondContact O-N 3.34Å
314	V	96.4	Very high	95.8	Very high	5 Å²	5	43.2 Å²	43.2	3%	0.03	21%	0.21	C	C	.	.	H	α-helix	trans	-61.9	-46.6	178.3	168.5	0	0	0	0	110.7	L293 L297 L302 Q310 E312 A317 N318	L293-V314 HydrophobicContact CD1-CG1 4.37Å; L293-V314 HydrophobicContact CD2-CG1 4.1Å; L297-V314 HydrophobicContact CB-CG1 4.2Å; L297-V314 HydrophobicContact CD1-CG1 3.82Å; L297-V314 HydrophobicContact CG-CG1 4.42Å; L302-V314 HydrophobicContact CD1-CG2 4.46Å; Q310-V314 VanDerWaalsContact O-CG2 3.32Å; Q310-V314 WeakPolarHBondContact O-CG2 3.34Å; Q310-V314 PolarHBondContact O-N 3.34Å; E312-V314 VanDerWaalsContact C-N 3.34Å; V314-A317 PolarHBondContact O-N 2.89Å; V314-N318 WeakPolarHBondContact O-CB 3.35Å; V314-N318 PolarHBondContact O-N 3.01Å
315	C	96.8	Very high	96.1	Very high	9 Å²	9	34.9 Å²	34.9	6%	0.061	17%	0.173	C	C	.	.	H	α-helix	trans	-59.1	-50.3	175.3	-67	0	0	0	0	111.1	V311 E312 A317 N318 A319 I352 F361	V311-C315 PolarHBondContact O-N 3.21Å; E312-C315 PolarHBondContact O-N 2.97Å; C315-A317 PolarHBondContact O-N 3.1Å; C315-N318 PolarHBondContact O-N 3.48Å; C315-A319 PolarHBondContact O-N 3.15Å; C315-I352 HydrophobicContact CB-CG2 4.38Å; C315-I352 WeakPolarHBondContact O-CD1 3.45Å; C315-F361 HydrophobicContact CB-CE2 4.2Å; C315-F361 HydrophobicContact CB-CZ 4.02Å
316	R	97.6	Very high	96.3	Very high	65 Å²	65	29.2 Å²	29.2	25%	0.245	15%	0.147	C	C	.	.	H	α-helix	trans	-61	-45.9	179.8	-73.6	-175	-61.7	172.2	3.2	112.9	D102 F113 E312 V313 N318 A319 L320 F361	D102-R316 HydrophobicContact CB-CB 4.15Å; D102-R316 IonicContact OD2-CZ 3.24Å; D102-R316 VanDerWaalsContact OD2-CZ 3.26Å; D102-R316 IonicContact OD2-NE 4Å; D102-R316 IonicContact OD2-NH1 2.88Å; D102-R316 IonicContact OD2-NH2 2.7Å; D102-R316 PolarHBondContact OD2-NH2 3.36Å; F113-R316 HydrophobicContact CD2-CG 4.49Å; F113-R316 HydrophobicContact CE2-CG 3.82Å; F113-R316 HydrophobicContact CZ-CG 3.88Å; E312-R316 WeakPolarHBondContact O-CB 3.3Å; E312-R316 WeakPolarHBondContact O-CG 3.47Å; E312-R316 PolarHBondContact O-N 3.38Å; V313-R316 PolarHBondContact O-N 3.29Å; R316-N318 VanDerWaalsContact C-N 3.33Å; R316-N318 PolarHBondContact O-N 2.96Å; R316-A319 PolarHBondContact O-N 2.9Å; R316-L320 WeakPolarHBondContact O-CB 3.33Å; R316-L320 WeakPolarHBondContact O-CD1 3.06Å; R316-L320 VanDerWaalsContact O-CG 3.22Å; R316-L320 WeakPolarHBondContact O-CG 3.44Å; R316-L320 PolarHBondContact O-N 3.43Å; R316-F361 HydrophobicContact CG-CE1 3.76Å; R316-F361 HydrophobicContact CG-CZ 4.09Å
317	A	97.9	Very high	96.6	Very high	0 Å²	0	22 Å²	22	0%	0	11%	0.108	C	C	.	.	H	α-helix	trans	-61.8	-42.5	179.1	0	0	0	0	0	111.4	A101 D102 Y105 V313 V314 C315 A321	A101-A317 HydrophobicContact CB-CB 4.04Å; D102-A317 HydrophobicContact CB-CB 4.32Å; Y105-A317 HydrophobicContact CD2-CB 4.05Å; Y105-A317 WeakPolarHBondContact CD2-O 3.49Å; Y105-A317 HydrophobicContact CE2-CB 4.21Å; V313-A317 VanDerWaalsContact O-CB 3.26Å; V313-A317 WeakPolarHBondContact O-CB 3.26Å; V313-A317 PolarHBondContact O-N 3.34Å; V314-A317 PolarHBondContact O-N 2.89Å; C315-A317 PolarHBondContact O-N 3.1Å; A317-A321 WeakPolarHBondContact O-CB 3.27Å; A317-A321 PolarHBondContact O-N 3.38Å; A317-A321 VanDerWaalsContact O-N 3.08Å
318	N	98.3	Very high	96.8	Very high	0 Å²	0	19.1 Å²	19.1	0%	0	10%	0.095	C	C	.	.	H	α-helix	trans	-61.7	-50.6	175.7	-174	45.4	0	0	0	111	P94 Q95 V314 C315 R316 L320 A321 S322 I352	P94-N318 WeakPolarHBondContact CB-OD1 3.33Å; P94-N318 VanDerWaalsContact O-CA 3.32Å; P94-N318 WeakPolarHBondContact O-CA 3.23Å; Q95-N318 WeakPolarHBondContact CG-OD1 3.22Å; V314-N318 WeakPolarHBondContact O-CB 3.35Å; V314-N318 PolarHBondContact O-N 3.01Å; C315-N318 PolarHBondContact O-N 3.48Å; R316-N318 VanDerWaalsContact C-N 3.33Å; R316-N318 PolarHBondContact O-N 2.96Å; N318-L320 PolarHBondContact O-N 3.08Å; N318-A321 PolarHBondContact O-N 3.29Å; N318-S322 WeakPolarHBondContact O-CB 3.4Å; N318-S322 PolarHBondContact O-N 3.06Å; N318-S322 PolarHBondContact O-OG 2.66Å; N318-S322 VanDerWaalsContact O-OG 3.05Å; N318-S322 PolarHBondContact OD1-OG 3.04Å; N318-I352 HydrophobicContact CB-CD1 3.86Å
319	A	98	Very high	97.2	Very high	1 Å²	1	15.3 Å²	15.3	1%	0.008	7%	0.071	C	C	.	.	H	α-helix	trans	-58.5	-47.4	178.7	0	0	0	0	0	112.4	C315 R316 A321 L323 I352 F361	C315-A319 PolarHBondContact O-N 3.15Å; R316-A319 PolarHBondContact O-N 2.9Å; A319-A321 VanDerWaalsContact C-N 3.34Å; A319-A321 PolarHBondContact O-N 2.82Å; A319-L323 HydrophobicContact CB-CD1 4.41Å; A319-L323 VanDerWaalsContact O-CB 3.22Å; A319-L323 WeakPolarHBondContact O-CB 3.32Å; A319-L323 VanDerWaalsContact O-CG 3.26Å; A319-L323 WeakPolarHBondContact O-CG 3.44Å; A319-L323 PolarHBondContact O-N 3.13Å; A319-I352 HydrophobicContact CB-CD1 3.58Å; A319-I352 VanDerWaalsContact N-CD1 3.35Å; A319-F361 HydrophobicContact CB-CB 3.75Å; A319-F361 HydrophobicContact CB-CD1 3.71Å; A319-F361 HydrophobicContact CB-CD2 3.47Å; A319-F361 VanDerWaalsContact CB-CD2 3.47Å; A319-F361 HydrophobicContact CB-CE1 4.21Å; A319-F361 HydrophobicContact CB-CE2 3.95Å; A319-F361 HydrophobicContact CB-CG 3.33Å; A319-F361 HydrophobicContact CB-CZ 4.31Å
320	L	98.1	Very high	97.5	Very high	0 Å²	0	7.6 Å²	7.6	0%	0	4%	0.035	C	C	.	.	H	α-helix	trans	-58.7	-45.3	179.9	-77.4	163.5	0	0	0	111.8	D102 Q106 T111 R316 N318 F324 Y363 C384	D102-L320 HydrophobicContact CB-CD1 4.32Å; Q106-L320 HydrophobicContact CG-CD1 3.95Å; Q106-L320 HydrophobicContact CG-CD2 4.42Å; T111-L320 HydrophobicContact CG2-CD2 3.62Å; R316-L320 WeakPolarHBondContact O-CB 3.33Å; R316-L320 WeakPolarHBondContact O-CD1 3.06Å; R316-L320 VanDerWaalsContact O-CG 3.22Å; R316-L320 WeakPolarHBondContact O-CG 3.44Å; R316-L320 PolarHBondContact O-N 3.43Å; N318-L320 PolarHBondContact O-N 3.08Å; L320-F324 WeakPolarHBondContact O-CB 3.38Å; L320-F324 PolarHBondContact O-N 2.82Å; L320-Y363 HydrophobicContact CD2-CE2 4.31Å; L320-C384 HydrophobicContact CD2-CB 3.41Å; L320-C384 VanDerWaalsContact CD2-CB 3.41Å; L320-C384 HydrophobicContact CG-CB 4.47Å
321	A	98.4	Very high	97.7	Very high	1 Å²	1	6.8 Å²	6.8	1%	0.008	3%	0.031	C	C	.	.	H	α-helix	trans	-72	-50.4	-179.5	0	0	0	0	0	111.7	P94 Y105 I224 A317 N318 A319 A325	P94-A321 HydrophobicContact CB-CB 3.89Å; P94-A321 HydrophobicContact CG-CB 3.87Å; Y105-A321 HydrophobicContact CD2-CB 3.79Å; Y105-A321 HydrophobicContact CE2-CB 3.84Å; I224-A321 HydrophobicContact CD1-CB 3.96Å; I224-A321 WeakPolarHBondContact CD1-O 3.42Å; A317-A321 WeakPolarHBondContact O-CB 3.27Å; A317-A321 PolarHBondContact O-N 3.38Å; A317-A321 VanDerWaalsContact O-N 3.08Å; N318-A321 PolarHBondContact O-N 3.29Å; A319-A321 VanDerWaalsContact C-N 3.34Å; A319-A321 PolarHBondContact O-N 2.82Å; A321-A325 VanDerWaalsContact O-CB 3.3Å; A321-A325 WeakPolarHBondContact O-CB 3.36Å; A321-A325 PolarHBondContact O-N 3.26Å
322	S	98.4	Very high	97.9	Very high	0 Å²	0	7.2 Å²	7.2	0%	0	3%	0.033	C	C	.	.	H	α-helix	trans	-61.4	-48.4	-177.8	-62.1	0	0	0	0	112.2	P94 D226 H291 N318 A325 W326	P94-S322 WeakPolarHBondContact CB-OG 3.27Å; D226-S322 WeakPolarHBondContact OD2-CB 3.43Å; D226-S322 PolarHBondContact OD2-OG 3.43Å; H291-S322 PolarHBondContact CE1-OG 3.27Å; N318-S322 WeakPolarHBondContact O-CB 3.4Å; N318-S322 PolarHBondContact O-N 3.06Å; N318-S322 PolarHBondContact O-OG 2.66Å; N318-S322 VanDerWaalsContact O-OG 3.05Å; N318-S322 PolarHBondContact OD1-OG 3.04Å; S322-A325 PolarHBondContact O-N 3.16Å; S322-W326 WeakPolarHBondContact O-CB 3.48Å; S322-W326 PolarHBondContact O-N 2.89Å
323	L	98.7	Very high	98.1	Very high	1 Å²	1	6.2 Å²	6.2	1%	0.005	3%	0.028	C	C	.	.	H	α-helix	trans	-72.8	-34.5	-177.3	-61.6	174.5	0	0	0	112.3	A319 W326 T327 Q349 F361 Y363	A319-L323 HydrophobicContact CB-CD1 4.41Å; A319-L323 VanDerWaalsContact O-CB 3.22Å; A319-L323 WeakPolarHBondContact O-CB 3.32Å; A319-L323 VanDerWaalsContact O-CG 3.26Å; A319-L323 WeakPolarHBondContact O-CG 3.44Å; A319-L323 PolarHBondContact O-N 3.13Å; L323-W326 HydrophobicContact CD2-CE3 4.46Å; L323-W326 PolarHBondContact O-N 2.91Å; L323-T327 WeakPolarHBondContact O-CB 3.44Å; L323-T327 WeakPolarHBondContact O-CG2 3.41Å; L323-T327 PolarHBondContact O-N 2.85Å; L323-T327 PolarHBondContact O-OG1 3.34Å; L323-Q349 WeakPolarHBondContact CD2-O 3.37Å; L323-F361 HydrophobicContact CD1-CB 3.98Å; L323-Y363 VanDerWaalsContact CB-CB 3.45Å; L323-Y363 HydrophobicContact CB-CD1 4.44Å; L323-Y363 HydrophobicContact CB-CD2 4.03Å; L323-Y363 HydrophobicContact CB-CG 3.75Å
324	F	98.8	Very high	98.1	Very high	0 Å²	0	9.2 Å²	9.2	0%	0	4%	0.041	C	C	.	.	H	α-helix	trans	-63.9	-46.2	170.8	172	-104.6	0	0	0	111.7	T109 F199 W201 I224 L320 W326 T327 G328 Y363 L365 L370	T109-F324 HydrophobicContact CG2-CB 4.14Å; T109-F324 HydrophobicContact CG2-CD1 3.36Å; T109-F324 HydrophobicContact CG2-CD2 4.08Å; T109-F324 HydrophobicContact CG2-CE1 3.66Å; T109-F324 HydrophobicContact CG2-CE2 4.32Å; T109-F324 HydrophobicContact CG2-CG 3.58Å; T109-F324 HydrophobicContact CG2-CZ 4.12Å; F199-F324 HydrophobicContact CD1-CD1 4.17Å; F199-F324 AromaticContact CD1-CE1 3.66Å; F199-F324 HydrophobicContact CD1-CE1 3.66Å; F199-F324 HydrophobicContact CD1-CZ 4.2Å; F199-F324 HydrophobicContact CE1-CD1 4.38Å; F199-F324 AromaticContact CE1-CE1 3.57Å; F199-F324 HydrophobicContact CE1-CE1 3.57Å; F199-F324 HydrophobicContact CE1-CE2 4.43Å; F199-F324 AromaticContact CE1-CZ 3.62Å; F199-F324 HydrophobicContact CE1-CZ 3.62Å; W201-F324 AromaticContact CD2-CE1 3.66Å; W201-F324 HydrophobicContact CD2-CE1 3.66Å; W201-F324 HydrophobicContact CD2-CZ 4.17Å; W201-F324 AromaticContact CE2-CE1 3.59Å; W201-F324 AromaticContact CE3-CE1 3.88Å; W201-F324 HydrophobicContact CE3-CE1 3.88Å; W201-F324 HydrophobicContact CG-CE1 4.21Å; W201-F324 HydrophobicContact CG-CZ 4.24Å; W201-F324 HydrophobicContact CH2-CD1 4.44Å; W201-F324 HydrophobicContact CH2-CE1 4.04Å; W201-F324 HydrophobicContact CZ2-CD1 4.46Å; W201-F324 AromaticContact CZ2-CE1 3.8Å; W201-F324 HydrophobicContact CZ2-CE1 3.8Å; W201-F324 HydrophobicContact CZ3-CE1 4.07Å; I224-F324 HydrophobicContact CD1-CD1 4.24Å; L320-F324 WeakPolarHBondContact O-CB 3.38Å; L320-F324 PolarHBondContact O-N 2.82Å; F324-W326 VanDerWaalsContact C-N 3.29Å; F324-W326 PolarHBondContact O-N 2.9Å; F324-T327 PolarHBondContact O-OG1 3.35Å; F324-G328 PolarHBondContact O-N 2.97Å; F324-Y363 HydrophobicContact CB-CE1 4.35Å; F324-Y363 HydrophobicContact CB-CE2 4.22Å; F324-Y363 HydrophobicContact CD2-CE1 4.47Å; F324-Y363 WeakPolarHBondContact CD2-OH 3.49Å; F324-L365 HydrophobicContact CD2-CD1 4.03Å; F324-L365 HydrophobicContact CE2-CD1 4.08Å; F324-L370 HydrophobicContact CE2-CD1 4.04Å; F324-L370 HydrophobicContact CZ-CD1 3.65Å
325	A	98.7	Very high	98.1	Very high	0 Å²	0	9.5 Å²	9.5	0%	0	5%	0.046	C	C	.	.	H	α-helix	trans	-60.4	-42.9	177.8	0	0	0	0	0	111.1	F199 I224 A321 S322 A329	F199-A325 HydrophobicContact CB-CB 3.69Å; I224-A325 HydrophobicContact CB-CB 3.95Å; I224-A325 HydrophobicContact CD1-CB 3.98Å; I224-A325 HydrophobicContact CG2-CB 3.74Å; A321-A325 VanDerWaalsContact O-CB 3.3Å; A321-A325 WeakPolarHBondContact O-CB 3.36Å; A321-A325 PolarHBondContact O-N 3.26Å; S322-A325 PolarHBondContact O-N 3.16Å; A325-A329 VanDerWaalsContact O-CB 3.27Å; A325-A329 WeakPolarHBondContact O-CB 3.43Å; A325-A329 PolarHBondContact O-N 2.86Å
326	W	98.6	Very high	98.2	Very high	1 Å²	1	10.5 Å²	10.5	0%	0.004	5%	0.049	C	C	.	.	H	α-helix	trans	-68.8	-50.1	-178.7	-159.5	36.7	0	0	0	112.5	V197 Q231 I232 R233 T275 Q289 S322 L323 F324 G328 A329 Q330	V197-W326 HydrophobicContact CG1-CB 4.12Å; V197-W326 HydrophobicContact CG1-CG 4.29Å; Q231-W326 HydrophobicContact CB-CZ2 4.18Å; I232-W326 WeakPolarHBondContact O-CH2 3.48Å; R233-W326 HydrophobicContact CG-CZ2 4.21Å; T275-W326 PolarHBondContact O-NE1 3.31Å; Q289-W326 HydrophobicContact CB-CZ3 4.22Å; Q289-W326 HydrophobicContact CG-CD2 4.01Å; Q289-W326 HydrophobicContact CG-CE3 3.65Å; Q289-W326 HydrophobicContact CG-CH2 3.73Å; Q289-W326 HydrophobicContact CG-CZ2 4.07Å; Q289-W326 HydrophobicContact CG-CZ3 3.53Å; S322-W326 WeakPolarHBondContact O-CB 3.48Å; S322-W326 PolarHBondContact O-N 2.89Å; L323-W326 HydrophobicContact CD2-CE3 4.46Å; L323-W326 PolarHBondContact O-N 2.91Å; F324-W326 VanDerWaalsContact C-N 3.29Å; F324-W326 PolarHBondContact O-N 2.9Å; W326-G328 VanDerWaalsContact C-N 3.35Å; W326-G328 PolarHBondContact O-N 3.23Å; W326-A329 PolarHBondContact O-N 3.28Å; W326-Q330 VanDerWaalsContact O-CG 3.23Å; W326-Q330 WeakPolarHBondContact O-CG 3.37Å; W326-Q330 PolarHBondContact O-N 3.02Å; W326-Q330 PolarHBondContact O-NE2 3.04Å
327	T	98.6	Very high	98.2	Very high	0 Å²	0	7.5 Å²	7.5	0%	0	4%	0.038	C	C	.	.	H	α-helix	trans	-64.2	-39.3	177.4	50.8	0	0	0	0	112	L323 F324 Q330 A331 F346 S348 Y363 L365	L323-T327 WeakPolarHBondContact O-CB 3.44Å; L323-T327 WeakPolarHBondContact O-CG2 3.41Å; L323-T327 PolarHBondContact O-N 2.85Å; L323-T327 PolarHBondContact O-OG1 3.34Å; F324-T327 PolarHBondContact O-OG1 3.35Å; T327-Q330 PolarHBondContact O-N 2.8Å; T327-A331 WeakPolarHBondContact O-CB 3.38Å; T327-A331 PolarHBondContact O-N 3.33Å; T327-F346 HydrophobicContact CG2-CB 4.36Å; T327-S348 VanDerWaalsContact CG2-OG 3.27Å; T327-S348 WeakPolarHBondContact CG2-OG 3.46Å; T327-Y363 HydrophobicContact CG2-CD1 4.15Å; T327-L365 HydrophobicContact CG2-CB 4.43Å
328	G	98.4	Very high	98	Very high	0 Å²	0	8.7 Å²	8.7	0%	0	5%	0.046	C	C	.	.	H	α-helix	trans	-63.1	-42.8	176	0	0	0	0	0	112.6	F199 F324 W326 A331 M332	F199-G328 WeakPolarHBondContact CE2-O 3.48Å; F324-G328 PolarHBondContact O-N 2.97Å; W326-G328 VanDerWaalsContact C-N 3.35Å; W326-G328 PolarHBondContact O-N 3.23Å; G328-A331 PolarHBondContact O-N 2.98Å; G328-M332 WeakPolarHBondContact O-CG 3.43Å; G328-M332 PolarHBondContact O-N 3.43Å
329	A	98.3	Very high	97.9	Very high	0 Å²	0	11.9 Å²	11.9	0%	0	6%	0.061	C	C	.	.	H	α-helix	trans	-65.1	-41.7	175.1	0	0	0	0	0	111.9	F199 I273 T275 A325 W326 M332 Y333	F199-A329 HydrophobicContact CD2-CB 4.22Å; I273-A329 HydrophobicContact CG2-CB 3.99Å; T275-A329 HydrophobicContact CG2-CB 3.56Å; A325-A329 VanDerWaalsContact O-CB 3.27Å; A325-A329 WeakPolarHBondContact O-CB 3.43Å; A325-A329 PolarHBondContact O-N 2.86Å; W326-A329 PolarHBondContact O-N 3.28Å; A329-M332 PolarHBondContact O-N 2.85Å; A329-Y333 VanDerWaalsContact O-CD1 3.32Å; A329-Y333 WeakPolarHBondContact O-CD1 3.24Å; A329-Y333 PolarHBondContact O-N 3.07Å
330	Q	98.2	Very high	97.8	Very high	2 Å²	2	13.2 Å²	13.2	1%	0.009	7%	0.072	C	C	.	.	H	α-helix	trans	-59.6	-46.4	174.7	-70	170.6	54	0	0	111.7	T275 W326 T327 M332 Y333 Q334 F346 S348	T275-Q330 HydrophobicContact CG2-CG 4.08Å; W326-Q330 VanDerWaalsContact O-CG 3.23Å; W326-Q330 WeakPolarHBondContact O-CG 3.37Å; W326-Q330 PolarHBondContact O-N 3.02Å; W326-Q330 PolarHBondContact O-NE2 3.04Å; T327-Q330 PolarHBondContact O-N 2.8Å; Q330-M332 VanDerWaalsContact C-N 3.35Å; Q330-M332 PolarHBondContact O-N 3.03Å; Q330-Y333 WeakPolarHBondContact O-CB 3.33Å; Q330-Y333 PolarHBondContact O-N 2.92Å; Q330-Q334 PolarHBondContact O-N 3.48Å; Q330-F346 HydrophobicContact CB-CD1 4.02Å; Q330-F346 HydrophobicContact CB-CE1 4.35Å; Q330-S348 PolarHBondContact NE2-OG 2.67Å
331	A	98.3	Very high	97.8	Very high	0 Å²	0	14.8 Å²	14.8	0%	0	8%	0.081	C	C	.	.	H	α-helix	trans	-64.6	-38.1	178.1	0	0	0	0	0	112.3	T327 G328 Y333 Q334 G335 F336 V342 F346 L365 L368	T327-A331 WeakPolarHBondContact O-CB 3.38Å; T327-A331 PolarHBondContact O-N 3.33Å; G328-A331 PolarHBondContact O-N 2.98Å; A331-Y333 VanDerWaalsContact C-N 3.32Å; A331-Y333 PolarHBondContact O-N 2.81Å; A331-Q334 WeakPolarHBondContact O-CB 3.47Å; A331-Q334 PolarHBondContact O-N 3.46Å; A331-G335 PolarHBondContact O-N 3.3Å; A331-F336 HydrophobicContact CB-CB 4.41Å; A331-F336 HydrophobicContact CB-CD2 4.44Å; A331-F336 WeakPolarHBondContact O-CB 3.49Å; A331-F336 WeakPolarHBondContact O-CD2 3.49Å; A331-F336 PolarHBondContact O-N 2.98Å; A331-F336 VanDerWaalsContact O-N 3.16Å; A331-V342 HydrophobicContact CB-CG1 3.94Å; A331-F346 HydrophobicContact CB-CD1 4.38Å; A331-F346 HydrophobicContact CB-CD2 3.91Å; A331-F346 HydrophobicContact CB-CE1 4.28Å; A331-F346 HydrophobicContact CB-CE2 3.83Å; A331-F346 HydrophobicContact CB-CG 4.19Å; A331-F346 HydrophobicContact CB-CZ 4.02Å; A331-L365 HydrophobicContact CB-CD2 3.88Å; A331-L368 HydrophobicContact CB-CD1 3.6Å
332	M	98.2	Very high	97.7	Very high	20 Å²	20	14.9 Å²	14.9	10%	0.099	8%	0.081	C	C	.	.	H	α-helix	trans	-66	-33.4	173.5	-75.5	-158.2	137.5	0	0	113.4	V75 L82 F199 I273 G328 A329 Q330 Q334 G335 F336 W337	V75-M332 WeakPolarHBondContact CG1-O 3.46Å; L82-M332 HydrophobicContact CD1-CE 3.75Å; F199-M332 HydrophobicContact CE2-CG 4.06Å; F199-M332 HydrophobicContact CE2-SD 3.78Å; I273-M332 HydrophobicContact CD1-CE 4.33Å; I273-M332 HydrophobicContact CD1-SD 3.21Å; I273-M332 WeakPolarHBondContact CD1-SD 3.26Å; I273-M332 HydrophobicContact CG1-SD 4.45Å; I273-M332 HydrophobicContact CG2-CB 4.16Å; I273-M332 HydrophobicContact CG2-SD 4.18Å; G328-M332 WeakPolarHBondContact O-CG 3.43Å; G328-M332 PolarHBondContact O-N 3.43Å; A329-M332 PolarHBondContact O-N 2.85Å; Q330-M332 VanDerWaalsContact C-N 3.35Å; Q330-M332 PolarHBondContact O-N 3.03Å; M332-Q334 PolarHBondContact O-N 3.16Å; M332-G335 PolarHBondContact O-N 3.4Å; M332-F336 WeakPolarHBondContact CA-O 3.26Å; M332-F336 WeakPolarHBondContact CG-O 3.49Å; M332-W337 HydrophobicContact CE-CB 3.63Å
333	Y	97.9	Very high	97.6	Very high	21 Å²	21	19.9 Å²	19.9	8%	0.082	11%	0.112	C	C	.	.	H	α-helix	trans	-65.7	-19.7	172.4	-83.4	30.1	0	0	0	112.6	V75 T275 S277 T279 A329 Q330 A331	V75-Y333 WeakPolarHBondContact CG1-O 3.49Å; V75-Y333 WeakPolarHBondContact CG2-O 3.35Å; T275-Y333 HydrophobicContact CG2-CD1 4.32Å; T275-Y333 HydrophobicContact CG2-CD2 3.98Å; T275-Y333 HydrophobicContact CG2-CE1 4.27Å; T275-Y333 HydrophobicContact CG2-CE2 3.92Å; T275-Y333 HydrophobicContact CG2-CG 4.18Å; T275-Y333 WeakPolarHBondContact OG1-CE2 3.23Å; S277-Y333 WeakPolarHBondContact O-CE2 3.35Å; S277-Y333 PolarHBondContact O-OH 2.97Å; T279-Y333 HydrophobicContact CG2-CD1 3.93Å; T279-Y333 HydrophobicContact CG2-CD2 3.91Å; T279-Y333 HydrophobicContact CG2-CE1 3.85Å; T279-Y333 HydrophobicContact CG2-CE2 3.84Å; T279-Y333 HydrophobicContact CG2-CG 3.96Å; A329-Y333 VanDerWaalsContact O-CD1 3.32Å; A329-Y333 WeakPolarHBondContact O-CD1 3.24Å; A329-Y333 PolarHBondContact O-N 3.07Å; Q330-Y333 WeakPolarHBondContact O-CB 3.33Å; Q330-Y333 PolarHBondContact O-N 2.92Å; A331-Y333 VanDerWaalsContact C-N 3.32Å; A331-Y333 PolarHBondContact O-N 2.81Å
334	Q	97.1	Very high	97.5	Very high	67 Å²	67	23.9 Å²	23.9	31%	0.313	13%	0.126	S	C	.	.	T	Hydrogen-bonded Turn	trans	-92	3.6	171.7	-56.8	-58.3	-50.9	0	0	113	Y285 Q330 A331 M332 F336 F346	Y285-Q334 HydrophobicContact CE1-CG 4.45Å; Y285-Q334 PolarHBondContact OH-OE1 3.05Å; Q330-Q334 PolarHBondContact O-N 3.48Å; A331-Q334 WeakPolarHBondContact O-CB 3.47Å; A331-Q334 PolarHBondContact O-N 3.46Å; M332-Q334 PolarHBondContact O-N 3.16Å; Q334-F336 HydrophobicContact CB-CD2 3.86Å; Q334-F336 HydrophobicContact CB-CE2 3.9Å; Q334-F346 HydrophobicContact CB-CZ 4.24Å; Q334-F346 HydrophobicContact CG-CE1 3.96Å; Q334-F346 HydrophobicContact CG-CZ 3.86Å
335	G	97	Very high	97.4	Very high	12 Å²	12	24.1 Å²	24.1	12%	0.124	13%	0.128	C	C	.	.	T	Hydrogen-bonded Turn	trans	86.7	4.7	178.1	0	0	0	0	0	115.5	A331 M332	A331-G335 PolarHBondContact O-N 3.3Å; M332-G335 PolarHBondContact O-N 3.4Å
336	F	98.2	Very high	97.4	Very high	29 Å²	29	24.1 Å²	24.1	13%	0.127	13%	0.128	C	C	.	.			trans	-75.7	149.1	171.6	-59.9	-67.2	0	0	0	111	A331 M332 Q334 A340 D341 V342 T343 F346 L368	A331-F336 HydrophobicContact CB-CB 4.41Å; A331-F336 HydrophobicContact CB-CD2 4.44Å; A331-F336 WeakPolarHBondContact O-CB 3.49Å; A331-F336 WeakPolarHBondContact O-CD2 3.49Å; A331-F336 PolarHBondContact O-N 2.98Å; A331-F336 VanDerWaalsContact O-N 3.16Å; M332-F336 WeakPolarHBondContact CA-O 3.26Å; M332-F336 WeakPolarHBondContact CG-O 3.49Å; Q334-F336 HydrophobicContact CB-CD2 3.86Å; Q334-F336 HydrophobicContact CB-CE2 3.9Å; F336-A340 WeakPolarHBondContact CA-O 3.43Å; F336-A340 WeakPolarHBondContact CB-O 3.26Å; F336-D341 VanDerWaalsContact CD1-O 3.31Å; F336-D341 WeakPolarHBondContact CD1-O 3.35Å; F336-V342 HydrophobicContact CB-CG1 3.99Å; F336-V342 HydrophobicContact CD2-CG1 4.1Å; F336-V342 HydrophobicContact CG-CG1 3.97Å; F336-T343 HydrophobicContact CE1-CG2 4.08Å; F336-T343 WeakPolarHBondContact CZ-OG1 3.45Å; F336-F346 AromaticContact CD2-CE2 3.93Å; F336-F346 HydrophobicContact CD2-CE2 3.93Å; F336-F346 HydrophobicContact CD2-CZ 4.01Å; F336-F346 AromaticContact CE2-CE2 3.91Å; F336-F346 HydrophobicContact CE2-CE2 3.91Å; F336-F346 AromaticContact CE2-CZ 3.93Å; F336-F346 HydrophobicContact CE2-CZ 3.93Å; F336-L368 HydrophobicContact CB-CD1 4.16Å
337	W	97.4	Very high	97.3	Very high	3 Å²	3	24.2 Å²	24.2	1%	0.011	13%	0.129	C	C	.	.			trans	-163	-170.7	178.1	65.5	-72.8	0	0	0	109.9	W65 Q66 V69 H70 L82 M332 E339 A340	W65-W337 HydrophobicContact CZ3-CZ3 4.39Å; Q66-W337 HydrophobicContact CB-CH2 3.84Å; Q66-W337 HydrophobicContact CG-CH2 3.81Å; Q66-W337 HydrophobicContact CG-CZ3 4.37Å; V69-W337 HydrophobicContact CB-CH2 4.35Å; V69-W337 HydrophobicContact CB-CZ2 4.06Å; V69-W337 HydrophobicContact CG1-CD2 4.3Å; V69-W337 HydrophobicContact CG1-CH2 4.37Å; V69-W337 HydrophobicContact CG1-CZ2 3.86Å; H70-W337 AromaticContact CD2-CZ2 3.83Å; H70-W337 AromaticContact CE1-CZ2 3.95Å; H70-W337 AromaticContact CE1-NE1 4Å; H70-W337 AromaticContact NE2-CZ2 3.5Å; L82-W337 HydrophobicContact CD1-CB 4.01Å; L82-W337 HydrophobicContact CD1-CG 4.32Å; L82-W337 HydrophobicContact CD2-CD2 4.42Å; L82-W337 HydrophobicContact CD2-CE3 3.86Å; L82-W337 HydrophobicContact CD2-CZ3 4.17Å; M332-W337 HydrophobicContact CE-CB 3.63Å; W337-E339 VanDerWaalsContact C-N 3.27Å; W337-E339 HydrophobicContact CD2-CB 4.37Å; W337-E339 HydrophobicContact CE3-CB 4.34Å; W337-E339 HydrophobicContact CE3-CG 4.15Å; W337-E339 HydrophobicContact CH2-CB 3.61Å; W337-E339 HydrophobicContact CH2-CG 3.23Å; W337-E339 HydrophobicContact CZ2-CB 3.61Å; W337-E339 HydrophobicContact CZ2-CG 3.82Å; W337-E339 HydrophobicContact CZ3-CB 3.99Å; W337-E339 HydrophobicContact CZ3-CG 3.42Å; W337-E339 VanDerWaalsContact CZ3-CG 3.42Å; W337-E339 PolarHBondContact O-N 2.79Å; W337-E339 VanDerWaalsContact O-N 3.12Å; W337-A340 PolarHBondContact N-O 3.12Å; W337-A340 CarbonylContact O-C 3.59Å; W337-A340 PolarHBondContact O-N 3.39Å
338	S	95.2	Very high	97.3	Very high	25 Å²	25	24.2 Å²	24.2	18%	0.175	13%	0.129	C	C	.	.	S	Bend	trans	-57.2	-32	-170.4	61.5	0	0	0	0	115.6	A369 A374	S338-A369 WeakPolarHBondContact O-CA 3.45Å; S338-A369 WeakPolarHBondContact O-CB 3.36Å; S338-A374 WeakPolarHBondContact O-CB 3.48Å
339	E	95.2	Very high	97.2	Very high	66 Å²	66	24.5 Å²	24.5	31%	0.308	13%	0.13	S	C	.	.	S	Bend	trans	-95.8	-32.9	177.4	-56	-62.2	135.9	0	0	112.7	Q66 W337 D341	Q66-E339 HydrophobicContact CG-CG 4.23Å; Q66-E339 PolarHBondContact NE2-OE1 2.85Å; W337-E339 VanDerWaalsContact C-N 3.27Å; W337-E339 HydrophobicContact CD2-CB 4.37Å; W337-E339 HydrophobicContact CE3-CB 4.34Å; W337-E339 HydrophobicContact CE3-CG 4.15Å; W337-E339 HydrophobicContact CH2-CB 3.61Å; W337-E339 HydrophobicContact CH2-CG 3.23Å; W337-E339 HydrophobicContact CZ2-CB 3.61Å; W337-E339 HydrophobicContact CZ2-CG 3.82Å; W337-E339 HydrophobicContact CZ3-CB 3.99Å; W337-E339 HydrophobicContact CZ3-CG 3.42Å; W337-E339 VanDerWaalsContact CZ3-CG 3.42Å; W337-E339 PolarHBondContact O-N 2.79Å; W337-E339 VanDerWaalsContact O-N 3.12Å; E339-D341 PolarHBondContact O-N 2.75Å
340	A	96.1	Very high	97.2	Very high	30 Å²	30	24.5 Å²	24.5	25%	0.248	13%	0.131	C	C	.	.	S	Bend	trans	-98.3	79.5	173.1	0	0	0	0	0	108.8	F336 W337	F336-A340 WeakPolarHBondContact CA-O 3.43Å; F336-A340 WeakPolarHBondContact CB-O 3.26Å; W337-A340 PolarHBondContact N-O 3.12Å; W337-A340 CarbonylContact O-C 3.59Å; W337-A340 PolarHBondContact O-N 3.39Å
341	D	97.1	Very high	97.2	Very high	33 Å²	33	24.4 Å²	24.4	18%	0.176	13%	0.13	C	C	.	.			trans	-64.4	161.5	-177	-156.6	9.4	0	0	0	112	F336 E339 T367 L368 A369	F336-D341 VanDerWaalsContact CD1-O 3.31Å; F336-D341 WeakPolarHBondContact CD1-O 3.35Å; E339-D341 PolarHBondContact O-N 2.75Å; D341-T367 WeakPolarHBondContact OD1-CA 3.28Å; D341-T367 PolarHBondContact OD1-OG1 2.89Å; D341-T367 WeakPolarHBondContact OD2-CB 3.31Å; D341-T367 PolarHBondContact OD2-OG1 2.82Å; D341-L368 PolarHBondContact OD1-N 2.85Å; D341-A369 HydrophobicContact CB-CB 4.35Å
342	V	97.3	Very high	97.2	Very high	2 Å²	2	24.5 Å²	24.5	1%	0.012	13%	0.13	C	C	.	.			trans	-64.4	135.2	-177.1	-62.7	0	0	0	0	111.5	L244 A331 F336 F346 N366 L368	L244-V342 HydrophobicContact CD1-CG2 4.4Å; A331-V342 HydrophobicContact CB-CG1 3.94Å; F336-V342 HydrophobicContact CB-CG1 3.99Å; F336-V342 HydrophobicContact CD2-CG1 4.1Å; F336-V342 HydrophobicContact CG-CG1 3.97Å; V342-F346 HydrophobicContact CB-CE2 4.39Å; V342-F346 HydrophobicContact CG1-CD2 4.1Å; V342-F346 HydrophobicContact CG1-CE2 4Å; V342-N366 VanDerWaalsContact CG2-O 3.31Å; V342-N366 WeakPolarHBondContact CG2-O 3.46Å; V342-L368 HydrophobicContact CG1-CD1 3.99Å; V342-L368 HydrophobicContact CG1-CG 4.25Å
343	T	96.6	Very high	97.1	Very high	106 Å²	106	23.6 Å²	23.6	65%	0.65	13%	0.126	S	C	*	.	S	Bend	trans	-90.7	-14.3	175.4	55.5	0	0	0	0	113.1	F336	F336-T343 HydrophobicContact CE1-CG2 4.08Å; F336-T343 WeakPolarHBondContact CZ-OG1 3.45Å
344	R	96.1	Very high	96.8	Very high	84 Å²	84	23.3 Å²	23.3	32%	0.317	13%	0.126	S	C	.	.	S	Bend	trans	-142.1	146.6	177	65	-172.2	-176.4	-83	3.3	109.4	Y285 F346	Y285-R344 PolarHBondContact OH-NH2 3.43Å; R344-F346 HydrophobicContact CG-CE2 4.39Å; R344-F346 WeakPolarHBondContact O-CD2 3.26Å
345	P	97.2	Very high	96.4	Very high	5 Å²	5	20.4 Å²	20.4	3%	0.032	11%	0.114	C	C	.	.			trans	-67.3	144.8	179.8	-20.2	33.5	0	0	0	112.3	Q237 E240 L244 Q364 L365	Q237-P345 PolarHBondContact NE2-O 3.01Å; E240-P345 HydrophobicContact CB-CB 4.21Å; E240-P345 HydrophobicContact CB-CG 4.04Å; E240-P345 WeakPolarHBondContact OE2-CD 3.44Å; E240-P345 VanDerWaalsContact OE2-CG 3.25Å; E240-P345 WeakPolarHBondContact OE2-CG 3.37Å; L244-P345 HydrophobicContact CB-CG 3.9Å; L244-P345 HydrophobicContact CD1-CG 3.88Å; L244-P345 HydrophobicContact CG-CG 4.49Å; P345-Q364 HydrophobicContact CB-CG 3.63Å; P345-L365 VanDerWaalsContact CA-O 3.28Å; P345-L365 WeakPolarHBondContact CA-O 3.35Å
346	F	98.1	Very high	96.2	Very high	0 Å²	0	22.6 Å²	22.6	0%	0	12%	0.12	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.3	121.7	169.5	-72.3	-108.1	0	0	0	109.4	Y285 T327 Q330 A331 Q334 F336 V342 R344 Q364 L365	Y285-F346 HydrophobicContact CD1-CE1 4.31Å; Y285-F346 HydrophobicContact CE1-CD1 4.39Å; Y285-F346 AromaticContact CE1-CE1 3.8Å; Y285-F346 HydrophobicContact CE1-CE1 3.8Å; T327-F346 HydrophobicContact CG2-CB 4.36Å; Q330-F346 HydrophobicContact CB-CD1 4.02Å; Q330-F346 HydrophobicContact CB-CE1 4.35Å; A331-F346 HydrophobicContact CB-CD1 4.38Å; A331-F346 HydrophobicContact CB-CD2 3.91Å; A331-F346 HydrophobicContact CB-CE1 4.28Å; A331-F346 HydrophobicContact CB-CE2 3.83Å; A331-F346 HydrophobicContact CB-CG 4.19Å; A331-F346 HydrophobicContact CB-CZ 4.02Å; Q334-F346 HydrophobicContact CB-CZ 4.24Å; Q334-F346 HydrophobicContact CG-CE1 3.96Å; Q334-F346 HydrophobicContact CG-CZ 3.86Å; F336-F346 AromaticContact CD2-CE2 3.93Å; F336-F346 HydrophobicContact CD2-CE2 3.93Å; F336-F346 HydrophobicContact CD2-CZ 4.01Å; F336-F346 AromaticContact CE2-CE2 3.91Å; F336-F346 HydrophobicContact CE2-CE2 3.91Å; F336-F346 AromaticContact CE2-CZ 3.93Å; F336-F346 HydrophobicContact CE2-CZ 3.93Å; V342-F346 HydrophobicContact CB-CE2 4.39Å; V342-F346 HydrophobicContact CG1-CD2 4.1Å; V342-F346 HydrophobicContact CG1-CE2 4Å; R344-F346 HydrophobicContact CG-CE2 4.39Å; R344-F346 WeakPolarHBondContact O-CD2 3.26Å; F346-Q364 WeakPolarHBondContact O-CA 3.35Å; F346-L365 HydrophobicContact CB-CB 4.14Å; F346-L365 HydrophobicContact CB-CD2 4.29Å; F346-L365 PolarHBondContact N-O 3.1Å; F346-L365 PolarHBondContact O-N 3Å
347	V	97.4	Very high	96.1	Very high	3 Å²	3	24.2 Å²	24.2	2%	0.018	13%	0.126	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	142	-178.2	167.7	0	0	0	0	110.2	L238 F241 Y363 Q364	L238-V347 HydrophobicContact CB-CG1 4.49Å; F241-V347 HydrophobicContact CD2-CG1 3.82Å; F241-V347 HydrophobicContact CD2-CG2 3.96Å; F241-V347 HydrophobicContact CE1-CG1 4.34Å; F241-V347 HydrophobicContact CE2-CB 4.28Å; F241-V347 HydrophobicContact CE2-CG1 3.14Å; F241-V347 HydrophobicContact CE2-CG2 4.15Å; F241-V347 HydrophobicContact CZ-CG1 3.45Å; F241-V347 VanDerWaalsContact CZ-CG1 3.45Å; V347-Y363 WeakPolarHBondContact CA-O 3.43Å; V347-Q364 HydrophobicContact CG2-CB 4.09Å; V347-Q364 HydrophobicContact CG2-CG 3.82Å
348	S	97.1	Very high	96.1	Very high	0 Å²	0	24.4 Å²	24.4	0%	0	13%	0.127	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.2	149.1	168.4	-64.7	0	0	0	0	110.9	T327 Q330 Y363	T327-S348 VanDerWaalsContact CG2-OG 3.27Å; T327-S348 WeakPolarHBondContact CG2-OG 3.46Å; Q330-S348 PolarHBondContact NE2-OG 2.67Å; S348-Y363 PolarHBondContact N-O 2.96Å; S348-Y363 PolarHBondContact O-N 3.02Å
349	Q	98.2	Very high	96.3	Very high	6 Å²	6	23.2 Å²	23.2	3%	0.028	12%	0.119	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	148.3	178.6	-65.4	165.8	-34.7	0	0	110.2	F241 H287 T288 Q289 L323 F415 N418	F241-Q349 HydrophobicContact CZ-CG 4.44Å; H287-Q349 PolarHBondContact CE1-OE1 2.86Å; H287-Q349 PolarHBondContact O-N 3.32Å; H287-Q349 VanDerWaalsContact O-N 3.08Å; T288-Q349 CarbonylContact C-O 3.55Å; T288-Q349 WeakPolarHBondContact CA-O 3.32Å; T288-Q349 HydrophobicContact CG2-CB 4.2Å; T288-Q349 PolarHBondContact OG1-OE1 3.42Å; Q289-Q349 PolarHBondContact N-O 3.15Å; L323-Q349 WeakPolarHBondContact CD2-O 3.37Å; Q349-F415 HydrophobicContact CB-CD2 3.81Å; Q349-F415 HydrophobicContact CB-CE2 4.07Å; Q349-F415 HydrophobicContact CG-CD2 4.19Å; Q349-F415 HydrophobicContact CG-CE2 4.4Å; Q349-F415 PolarHBondContact OE1-O 3.06Å; Q349-N418 PolarHBondContact NE2-ND2 3.09Å; Q349-N418 VanDerWaalsContact NE2-ND2 3.1Å
350	G	97.8	Very high	96.4	Very high	1 Å²	1	20.2 Å²	20.2	1%	0.01	10%	0.104	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.5	130.9	179.7	0	0	0	0	0	112.1	Q289 F361	Q289-G350 CarbonylContact O-C 3.52Å; Q289-G350 WeakPolarHBondContact O-CA 3.37Å; G350-F361 PolarHBondContact N-O 2.89Å; G350-F361 PolarHBondContact O-N 3.33Å
351	V	98.4	Very high	96.5	Very high	0 Å²	0	18.8 Å²	18.8	0%	0	9%	0.093	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	121	173.8	-176.8	0	0	0	0	108.2	T288 Q289 F290 H291 F358 F360 F415	T288-V351 HydrophobicContact CG2-CG2 4.14Å; Q289-V351 PolarHBondContact O-N 2.63Å; F290-V351 WeakPolarHBondContact CA-O 3.38Å; F290-V351 HydrophobicContact CD1-CB 3.76Å; F290-V351 HydrophobicContact CD1-CG1 4.17Å; F290-V351 HydrophobicContact CD1-CG2 4.26Å; F290-V351 HydrophobicContact CE1-CB 3.92Å; F290-V351 HydrophobicContact CE1-CG1 4.29Å; F290-V351 HydrophobicContact CE1-CG2 3.93Å; H291-V351 PolarHBondContact N-O 3.19Å; V351-F358 HydrophobicContact CG1-CD1 3.77Å; V351-F358 HydrophobicContact CG1-CE1 4.46Å; V351-F360 HydrophobicContact CG1-CD1 4.48Å; V351-F360 HydrophobicContact CG1-CE1 4.3Å; V351-F360 HydrophobicContact CG2-CD1 4.04Å; V351-F360 HydrophobicContact CG2-CE1 4.27Å; V351-F415 HydrophobicContact CG2-CD2 4.06Å; V351-F415 HydrophobicContact CG2-CE2 4.48Å
352	I	97.9	Very high	96.6	Very high	1 Å²	1	17.3 Å²	17.3	1%	0.005	9%	0.085	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	130.1	178.1	-58.1	-179.7	0	0	0	108.3	H291 L293 C315 N318 A319 S359 F361	H291-I352 HydrophobicContact CB-CG1 4.08Å; L293-I352 HydrophobicContact CD1-CG2 4.15Å; L293-I352 HydrophobicContact CD2-CG2 4.01Å; L293-I352 HydrophobicContact CG-CG2 3.87Å; C315-I352 HydrophobicContact CB-CG2 4.38Å; C315-I352 WeakPolarHBondContact O-CD1 3.45Å; N318-I352 HydrophobicContact CB-CD1 3.86Å; A319-I352 HydrophobicContact CB-CD1 3.58Å; A319-I352 VanDerWaalsContact N-CD1 3.35Å; I352-S359 PolarHBondContact N-O 3.06Å; I352-S359 PolarHBondContact O-N 2.89Å; I352-F361 HydrophobicContact CB-CE2 4.23Å; I352-F361 HydrophobicContact CD1-CD2 3.92Å; I352-F361 HydrophobicContact CD1-CE2 3.71Å; I352-F361 HydrophobicContact CG1-CD2 4.08Å; I352-F361 HydrophobicContact CG1-CE2 4.06Å
353	T	96.4	Very high	96.6	Very high	2 Å²	2	17.2 Å²	17.2	1%	0.012	8%	0.084	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140	154.1	179.2	-174.6	0	0	0	0	112.3	L168 H291 L292 L293 G355 Y357 F358	L168-T353 HydrophobicContact CD1-CG2 4.15Å; L168-T353 HydrophobicContact CD2-CG2 3.64Å; H291-T353 PolarHBondContact O-N 2.89Å; L292-T353 WeakPolarHBondContact CA-O 3.41Å; L293-T353 PolarHBondContact N-O 3.42Å; T353-G355 PolarHBondContact OG1-N 3.28Å; T353-Y357 WeakPolarHBondContact CA-O 3.26Å; T353-Y357 VanDerWaalsContact CB-O 3.3Å; T353-Y357 WeakPolarHBondContact CB-O 3.43Å; T353-Y357 PolarHBondContact OG1-O 3.5Å; T353-F358 HydrophobicContact CG2-CD1 4.44Å; T353-F358 HydrophobicContact CG2-CE1 3.99Å; T353-F358 HydrophobicContact CG2-CZ 4.34Å
354	D	92.1	Very high	96.7	Very high	15 Å²	15	12.1 Å²	12.1	8%	0.08	5%	0.053	C	C	.	.	S	Bend	trans	-104.3	8.2	166.4	72.4	-8.2	0	0	0	112	R160 K356 Y357	R160-D354 VanDerWaalsContact CZ-O 3.25Å; R160-D354 IonicContact CZ-OD2 3.06Å; R160-D354 PolarHBondContact NE-O 3.24Å; R160-D354 VanDerWaalsContact NH2-CB 3.34Å; R160-D354 PolarHBondContact NH2-O 2.82Å; R160-D354 IonicContact NH2-OD1 2.93Å; R160-D354 PolarHBondContact NH2-OD1 2.99Å; R160-D354 IonicContact NH2-OD2 3.82Å; R160-D354 PolarHBondContact NH2-OD2 2.95Å; D354-K356 PolarHBondContact OD1-N 3.29Å; D354-Y357 PolarHBondContact N-O 3.13Å; D354-Y357 PolarHBondContact OD1-N 3.02Å
355	G	88.3	Confident	96.8	Very high	6 Å²	6	8.1 Å²	8.1	6%	0.062	4%	0.038	C	C	.	.	S	Bend	trans	97.3	-10.6	-176.5	0	0	0	0	0	115.5	T353 Y393	T353-G355 PolarHBondContact OG1-N 3.28Å; G355-Y393 PolarHBondContact O-OH 3.18Å
356	K	93.1	Very high	96.8	Very high	58 Å²	58	8 Å²	8	25%	0.252	4%	0.037	S	C	.	.	S	Bend	trans	-129	-47.3	175.6	-174.5	-178.4	-175.8	-178.5	0	111.1	D354 P391 L392 Y393 E394	D354-K356 PolarHBondContact OD1-N 3.29Å; K356-P391 CarbonylContact O-C 3.57Å; K356-P391 WeakPolarHBondContact O-CA 3.42Å; K356-L392 PolarHBondContact O-N 3.06Å; K356-Y393 WeakPolarHBondContact CE-O 3.36Å; K356-Y393 HydrophobicContact CG-CE1 4.46Å; K356-Y393 HydrophobicContact CG-CE2 4.36Å; K356-E394 WeakPolarHBondContact CE-O 3.3Å; K356-E394 PolarHBondContact NZ-O 3.05Å
357	Y	96	Very high	96.8	Very high	63 Å²	63	8 Å²	8	25%	0.247	4%	0.037	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.4	140	177.2	-65.8	-92.6	0	0	0	110.4	T353 D354 K390 P391	T353-Y357 WeakPolarHBondContact CA-O 3.26Å; T353-Y357 VanDerWaalsContact CB-O 3.3Å; T353-Y357 WeakPolarHBondContact CB-O 3.43Å; T353-Y357 PolarHBondContact OG1-O 3.5Å; D354-Y357 PolarHBondContact N-O 3.13Å; D354-Y357 PolarHBondContact OD1-N 3.02Å; Y357-K390 CarbonylContact C-O 3.54Å; Y357-K390 WeakPolarHBondContact CA-O 3.31Å; Y357-P391 HydrophobicContact CD1-CB 3.98Å; Y357-P391 HydrophobicContact CD1-CG 4.45Å; Y357-P391 HydrophobicContact CE1-CB 3.77Å; Y357-P391 HydrophobicContact CE1-CG 4.05Å
358	F	97.5	Very high	96.8	Very high	6 Å²	6	8.4 Å²	8.4	3%	0.026	4%	0.039	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	132.6	178.7	-71.7	-102.8	0	0	0	109.7	V351 T353 F360 S389 K390 L392 V408 I412	V351-F358 HydrophobicContact CG1-CD1 3.77Å; V351-F358 HydrophobicContact CG1-CE1 4.46Å; T353-F358 HydrophobicContact CG2-CD1 4.44Å; T353-F358 HydrophobicContact CG2-CE1 3.99Å; T353-F358 HydrophobicContact CG2-CZ 4.34Å; F358-F360 HydrophobicContact CB-CE2 4.06Å; F358-F360 HydrophobicContact CB-CZ 4.11Å; F358-S389 WeakPolarHBondContact O-CA 3.42Å; F358-K390 PolarHBondContact N-O 2.98Å; F358-K390 PolarHBondContact O-N 2.87Å; F358-L392 HydrophobicContact CD2-CB 3.78Å; F358-L392 HydrophobicContact CD2-CD2 4.49Å; F358-L392 HydrophobicContact CE2-CB 3.66Å; F358-L392 HydrophobicContact CE2-CD2 3.73Å; F358-L392 HydrophobicContact CE2-CG 4.32Å; F358-L392 HydrophobicContact CZ-CD2 4.08Å; F358-V408 HydrophobicContact CB-CG1 3.81Å; F358-V408 HydrophobicContact CD2-CG1 4.18Å; F358-V408 HydrophobicContact CG-CG1 4.06Å; F358-I412 HydrophobicContact CD1-CD1 4.14Å; F358-I412 HydrophobicContact CE1-CD1 4.16Å
359	S	97.6	Very high	96.7	Very high	1 Å²	1	8.7 Å²	8.7	1%	0.007	4%	0.041	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	134.8	172.7	-63.1	0	0	0	0	108.8	I352 F361 S389	I352-S359 PolarHBondContact N-O 3.06Å; I352-S359 PolarHBondContact O-N 2.89Å; S359-F361 VanDerWaalsContact CB-CE2 3.4Å; S359-S389 VanDerWaalsContact OG-CA 3.28Å; S359-S389 WeakPolarHBondContact OG-CA 3.31Å; S359-S389 WeakPolarHBondContact OG-CB 3.2Å; S359-S389 PolarHBondContact OG-N 3.09Å
360	F	98.3	Very high	96.7	Very high	2 Å²	2	8.5 Å²	8.5	1%	0.009	4%	0.041	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	132	-174	-60.4	-89.9	0	0	0	110.2	L117 V351 F358 G386 T387 V408 Q411 I412 F415	L117-F360 HydrophobicContact CD2-CB 4.23Å; V351-F360 HydrophobicContact CG1-CD1 4.48Å; V351-F360 HydrophobicContact CG1-CE1 4.3Å; V351-F360 HydrophobicContact CG2-CD1 4.04Å; V351-F360 HydrophobicContact CG2-CE1 4.27Å; F358-F360 HydrophobicContact CB-CE2 4.06Å; F358-F360 HydrophobicContact CB-CZ 4.11Å; F360-G386 VanDerWaalsContact O-CA 3.31Å; F360-G386 WeakPolarHBondContact O-CA 3.49Å; F360-T387 HydrophobicContact CB-CG2 4.47Å; F360-T387 PolarHBondContact N-OG1 3.42Å; F360-T387 VanDerWaalsContact N-OG1 3.15Å; F360-T387 PolarHBondContact O-N 3.15Å; F360-T387 PolarHBondContact O-OG1 3.16Å; F360-V408 HydrophobicContact CE2-CG1 4.12Å; F360-V408 HydrophobicContact CZ-CG1 3.92Å; F360-Q411 HydrophobicContact CD1-CB 4.15Å; F360-Q411 HydrophobicContact CD2-CB 4.27Å; F360-Q411 VanDerWaalsContact CD2-OE1 3.26Å; F360-Q411 HydrophobicContact CE1-CB 3.75Å; F360-Q411 HydrophobicContact CE2-CB 3.88Å; F360-Q411 HydrophobicContact CG-CB 4.39Å; F360-Q411 HydrophobicContact CZ-CB 3.61Å; F360-I412 HydrophobicContact CE1-CB 4.38Å; F360-I412 HydrophobicContact CE1-CG1 3.56Å; F360-I412 HydrophobicContact CZ-CG1 3.72Å; F360-F415 HydrophobicContact CB-CE1 4.37Å; F360-F415 HydrophobicContact CB-CE2 4.11Å; F360-F415 HydrophobicContact CB-CZ 3.72Å; F360-F415 HydrophobicContact CD1-CD2 4.38Å; F360-F415 HydrophobicContact CD1-CE1 4.42Å; F360-F415 HydrophobicContact CD1-CE2 4.17Å; F360-F415 HydrophobicContact CD1-CZ 4.2Å; F360-F415 HydrophobicContact CG-CZ 4.42Å
361	F	98.5	Very high	96.6	Very high	0 Å²	0	9.7 Å²	9.7	0%	0	5%	0.048	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.5	141.5	-177.7	-60.3	-82	0	0	0	111.3	F113 C315 R316 A319 L323 G350 I352 S359 W385 G386 F415	F113-F361 HydrophobicContact CE2-CD1 4.27Å; F113-F361 HydrophobicContact CE2-CE1 4.07Å; C315-F361 HydrophobicContact CB-CE2 4.2Å; C315-F361 HydrophobicContact CB-CZ 4.02Å; R316-F361 HydrophobicContact CG-CE1 3.76Å; R316-F361 HydrophobicContact CG-CZ 4.09Å; A319-F361 HydrophobicContact CB-CB 3.75Å; A319-F361 HydrophobicContact CB-CD1 3.71Å; A319-F361 HydrophobicContact CB-CD2 3.47Å; A319-F361 VanDerWaalsContact CB-CD2 3.47Å; A319-F361 HydrophobicContact CB-CE1 4.21Å; A319-F361 HydrophobicContact CB-CE2 3.95Å; A319-F361 HydrophobicContact CB-CG 3.33Å; A319-F361 HydrophobicContact CB-CZ 4.31Å; L323-F361 HydrophobicContact CD1-CB 3.98Å; G350-F361 PolarHBondContact N-O 2.89Å; G350-F361 PolarHBondContact O-N 3.33Å; I352-F361 HydrophobicContact CB-CE2 4.23Å; I352-F361 HydrophobicContact CD1-CD2 3.92Å; I352-F361 HydrophobicContact CD1-CE2 3.71Å; I352-F361 HydrophobicContact CG1-CD2 4.08Å; I352-F361 HydrophobicContact CG1-CE2 4.06Å; S359-F361 VanDerWaalsContact CB-CE2 3.4Å; F361-W385 VanDerWaalsContact CA-O 3.28Å; F361-W385 WeakPolarHBondContact CA-O 3.47Å; F361-G386 VanDerWaalsContact CD1-CA 3.42Å; F361-F415 WeakPolarHBondContact O-CE2 3.09Å
362	C	98.3	Very high	96.4	Very high	2 Å²	2	12.4 Å²	12.4	1%	0.014	6%	0.064	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	135.1	171.5	-69.1	0	0	0	0	107.9	P118 F241 C384 W385 F415	P118-C362 HydrophobicContact CG-CB 4.03Å; F241-C362 HydrophobicContact CD2-CB 4.34Å; F241-C362 HydrophobicContact CE2-CB 3.56Å; F241-C362 HydrophobicContact CZ-CB 3.87Å; C362-C384 CarbonylContact O-C 3.15Å; C362-C384 WeakPolarHBondContact O-CA 3.5Å; C362-W385 HydrophobicContact CB-CB 4.21Å; C362-W385 HydrophobicContact CB-CE3 4.09Å; C362-W385 PolarHBondContact N-O 3.43Å; C362-W385 PolarHBondContact O-N 2.96Å; C362-F415 VanDerWaalsContact SG-CZ 3.54Å
363	Y	98.6	Very high	96.2	Very high	0 Å²	0	16.1 Å²	16.1	0%	0	8%	0.081	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	138.2	179	-165.7	-84.4	0	0	0	110.1	T111 L320 L323 F324 T327 V347 S348 L365 N382 I383 C384	T111-Y363 HydrophobicContact CG2-CE2 3.66Å; T111-Y363 PolarHBondContact OG1-OH 3Å; L320-Y363 HydrophobicContact CD2-CE2 4.31Å; L323-Y363 VanDerWaalsContact CB-CB 3.45Å; L323-Y363 HydrophobicContact CB-CD1 4.44Å; L323-Y363 HydrophobicContact CB-CD2 4.03Å; L323-Y363 HydrophobicContact CB-CG 3.75Å; F324-Y363 HydrophobicContact CB-CE1 4.35Å; F324-Y363 HydrophobicContact CB-CE2 4.22Å; F324-Y363 HydrophobicContact CD2-CE1 4.47Å; F324-Y363 WeakPolarHBondContact CD2-OH 3.49Å; T327-Y363 HydrophobicContact CG2-CD1 4.15Å; V347-Y363 WeakPolarHBondContact CA-O 3.43Å; S348-Y363 PolarHBondContact N-O 2.96Å; S348-Y363 PolarHBondContact O-N 3.02Å; Y363-L365 HydrophobicContact CE1-CB 4.16Å; Y363-L365 HydrophobicContact CE1-CD1 4.29Å; Y363-N382 HydrophobicContact CE1-CB 4.36Å; Y363-N382 VanDerWaalsContact OH-CB 3.26Å; Y363-N382 WeakPolarHBondContact OH-CB 3.49Å; Y363-I383 WeakPolarHBondContact CA-O 3.41Å; Y363-C384 HydrophobicContact CD2-CB 3.74Å; Y363-C384 HydrophobicContact CE2-CB 4.12Å
364	Q	98	Very high	96	Very high	0 Å²	0	17.1 Å²	17.1	0%	0	9%	0.09	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128	116.5	173.2	-174.4	175.6	-50.7	0	0	109.8	V242 P345 F346 V347 N366 I383 W385	V242-Q364 VanDerWaalsContact N-OE1 3.1Å; V242-Q364 PolarHBondContact O-NE2 3.04Å; V242-Q364 PolarHBondContact O-OE1 3.44Å; P345-Q364 HydrophobicContact CB-CG 3.63Å; F346-Q364 WeakPolarHBondContact O-CA 3.35Å; V347-Q364 HydrophobicContact CG2-CB 4.09Å; V347-Q364 HydrophobicContact CG2-CG 3.82Å; Q364-N366 WeakPolarHBondContact CG-OD1 3.42Å; Q364-N366 PolarHBondContact NE2-OD1 3.4Å; Q364-I383 PolarHBondContact N-O 2.87Å; Q364-I383 PolarHBondContact O-N 3.37Å; Q364-W385 HydrophobicContact CB-CH2 4.07Å; Q364-W385 HydrophobicContact CB-CZ3 3.69Å
365	L	98.4	Very high	96.1	Very high	0 Å²	0	18.1 Å²	18.1	0%	0	10%	0.096	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.3	109.8	174.5	-175.1	79.9	0	0	0	109.3	F324 T327 A331 P345 F346 Y363 L368	F324-L365 HydrophobicContact CD2-CD1 4.03Å; F324-L365 HydrophobicContact CE2-CD1 4.08Å; T327-L365 HydrophobicContact CG2-CB 4.43Å; A331-L365 HydrophobicContact CB-CD2 3.88Å; P345-L365 VanDerWaalsContact CA-O 3.28Å; P345-L365 WeakPolarHBondContact CA-O 3.35Å; F346-L365 HydrophobicContact CB-CB 4.14Å; F346-L365 HydrophobicContact CB-CD2 4.29Å; F346-L365 PolarHBondContact N-O 3.1Å; F346-L365 PolarHBondContact O-N 3Å; Y363-L365 HydrophobicContact CE1-CB 4.16Å; Y363-L365 HydrophobicContact CE1-CD1 4.29Å; L365-L368 HydrophobicContact CD1-CD2 4.06Å; L365-L368 HydrophobicContact CD2-CD1 4.4Å; L365-L368 HydrophobicContact CD2-CD2 3.92Å; L365-L368 HydrophobicContact CD2-CG 3.97Å; L365-L368 HydrophobicContact CG-CD2 4.47Å
366	N	97.8	Very high	96.2	Very high	1 Å²	1	24.6 Å²	24.6	1%	0.005	12%	0.124	C	C	.	.			trans	-103.6	-17.3	178	-65.7	-31.3	0	0	0	112.5	L244 V342 Q364 K381 N382	L244-N366 HydrophobicContact CD1-CB 4.05Å; L244-N366 WeakPolarHBondContact CD1-O 3.31Å; V342-N366 VanDerWaalsContact CG2-O 3.31Å; V342-N366 WeakPolarHBondContact CG2-O 3.46Å; Q364-N366 WeakPolarHBondContact CG-OD1 3.42Å; Q364-N366 PolarHBondContact NE2-OD1 3.4Å; N366-K381 WeakPolarHBondContact CB-O 3.42Å; N366-K381 PolarHBondContact ND2-O 2.94Å; N366-N382 PolarHBondContact N-OD1 3.26Å
367	T	97.2	Very high	96	Very high	0 Å²	0	29.5 Å²	29.5	0%	0	15%	0.153	C	C	.	.			trans	-154.3	141.6	178.3	-171.6	0	0	0	0	113.5	K110 D341 A369 N378 R380 N382	K110-T367 HydrophobicContact CD-CG2 4.31Å; D341-T367 WeakPolarHBondContact OD1-CA 3.28Å; D341-T367 PolarHBondContact OD1-OG1 2.89Å; D341-T367 WeakPolarHBondContact OD2-CB 3.31Å; D341-T367 PolarHBondContact OD2-OG1 2.82Å; T367-A369 PolarHBondContact OG1-N 3.34Å; T367-N378 PolarHBondContact OG1-ND2 3.03Å; T367-R380 HydrophobicContact CG2-CB 4.42Å; T367-N382 PolarHBondContact N-OD1 2.72Å; T367-N382 PolarHBondContact O-ND2 2.95Å; T367-N382 VanDerWaalsContact O-ND2 3.11Å; T367-N382 PolarHBondContact O-OD1 2.71Å
368	L	96.7	Very high	95.8	Very high	12 Å²	12	27.8 Å²	27.8	6%	0.063	15%	0.148	C	C	.	.			trans	-110.7	-6.8	170.1	-75.7	178.3	0	0	0	113.1	F199 A331 F336 D341 V342 L365 L370	F199-L368 HydrophobicContact CZ-CD2 4Å; A331-L368 HydrophobicContact CB-CD1 3.6Å; F336-L368 HydrophobicContact CB-CD1 4.16Å; D341-L368 PolarHBondContact OD1-N 2.85Å; V342-L368 HydrophobicContact CG1-CD1 3.99Å; V342-L368 HydrophobicContact CG1-CG 4.25Å; L365-L368 HydrophobicContact CD1-CD2 4.06Å; L365-L368 HydrophobicContact CD2-CD1 4.4Å; L365-L368 HydrophobicContact CD2-CD2 3.92Å; L365-L368 HydrophobicContact CD2-CG 3.97Å; L365-L368 HydrophobicContact CG-CD2 4.47Å; L368-L370 PolarHBondContact O-N 3.49Å
369	A	96.3	Very high	95.6	Very high	6 Å²	6	32.7 Å²	32.7	5%	0.05	18%	0.183	C	C	.	.			trans	-73.7	73.1	179.1	0	0	0	0	0	111.4	S338 D341 T367 A374	S338-A369 WeakPolarHBondContact O-CA 3.45Å; S338-A369 WeakPolarHBondContact O-CB 3.36Å; D341-A369 HydrophobicContact CB-CB 4.35Å; T367-A369 PolarHBondContact OG1-N 3.34Å; A369-A374 HydrophobicContact CB-CB 3.68Å
370	L	97.1	Very high	95.5	Very high	3 Å²	3	36 Å²	36	2%	0.016	20%	0.196	C	C	.	.			trans	-100.6	-8	-173.7	-64.1	-177.7	0	0	0	114.3	K110 W201 L202 R203 F324 L368	K110-L370 HydrophobicContact CB-CD2 3.48Å; K110-L370 VanDerWaalsContact CB-CD2 3.48Å; K110-L370 HydrophobicContact CD-CD2 4.06Å; K110-L370 HydrophobicContact CG-CD2 4.4Å; W201-L370 HydrophobicContact CG-CD1 4.45Å; L202-L370 CarbonylContact O-C 3.56Å; L202-L370 WeakPolarHBondContact O-CB 3.45Å; R203-L370 WeakPolarHBondContact CD-O 3.43Å; R203-L370 PolarHBondContact NH1-O 3.08Å; F324-L370 HydrophobicContact CE2-CD1 4.04Å; F324-L370 HydrophobicContact CZ-CD1 3.65Å; L368-L370 PolarHBondContact O-N 3.49Å
371	T	96.5	Very high	95.3	Very high	25 Å²	25	38.9 Å²	38.9	15%	0.153	21%	0.208	C	C	.	.	S	Bend	trans	-69.5	154.9	176.5	60.9	0	0	0	0	110.7	L202 Q373 A374 D375	L202-T371 HydrophobicContact CB-CG2 4.2Å; T371-Q373 PolarHBondContact O-N 3.19Å; T371-Q373 VanDerWaalsContact O-N 3.15Å; T371-A374 PolarHBondContact O-N 3.02Å; T371-A374 WeakPolarHBondContact OG1-CB 3.25Å; T371-A374 PolarHBondContact OG1-N 3.47Å; T371-D375 WeakPolarHBondContact O-CB 3.17Å; T371-D375 PolarHBondContact O-N 3.1Å
372	V	94.9	Very high	95.3	Very high	57 Å²	57	38.9 Å²	38.9	35%	0.345	21%	0.208	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.6	-26.7	178.7	176.7	0	0	0	0	112.3	E205 Q376	E205-V372 HydrophobicContact CB-CG2 4.24Å; E205-V372 HydrophobicContact CG-CB 4.35Å; E205-V372 HydrophobicContact CG-CG2 3.7Å; V372-Q376 WeakPolarHBondContact O-CG 3.48Å; V372-Q376 PolarHBondContact O-NE2 3.11Å; V372-Q376 VanDerWaalsContact O-NE2 3.12Å
373	Q	92.4	Very high	95.3	Very high	79 Å²	79	38.9 Å²	38.9	37%	0.369	21%	0.208	S	C	.	.	T	Hydrogen-bonded Turn	trans	-76.8	-48.2	178.5	-66.9	176.8	-9.5	0	0	111.6	T371	T371-Q373 PolarHBondContact O-N 3.19Å; T371-Q373 VanDerWaalsContact O-N 3.15Å
374	A	92.1	Very high	95.3	Very high	24 Å²	24	38.9 Å²	38.9	20%	0.198	21%	0.208	C	C	.	.	T	Hydrogen-bonded Turn	trans	-78.1	-26	-176.6	0	0	0	0	0	112.9	S338 A369 T371 Q376	S338-A374 WeakPolarHBondContact O-CB 3.48Å; A369-A374 HydrophobicContact CB-CB 3.68Å; T371-A374 PolarHBondContact O-N 3.02Å; T371-A374 WeakPolarHBondContact OG1-CB 3.25Å; T371-A374 PolarHBondContact OG1-N 3.47Å; A374-Q376 PolarHBondContact O-N 2.81Å
375	D	93.8	Very high	95.3	Very high	36 Å²	36	39.4 Å²	39.4	19%	0.193	21%	0.21	C	C	.	.	S	Bend	trans	-78.5	-16.2	-176.4	-161.3	43.6	0	0	0	114.2	K110 R203 T371 N377 N378	K110-D375 WeakPolarHBondContact CD-OD1 3.48Å; K110-D375 WeakPolarHBondContact CE-OD1 3.48Å; K110-D375 IonicContact NZ-OD1 2.78Å; K110-D375 PolarHBondContact NZ-OD1 2.92Å; R203-D375 IonicContact CZ-OD2 3.07Å; R203-D375 IonicContact NH1-OD1 3.97Å; R203-D375 IonicContact NH1-OD2 3.88Å; R203-D375 PolarHBondContact NH1-OD2 2.79Å; R203-D375 IonicContact NH2-OD2 3.83Å; R203-D375 PolarHBondContact NH2-OD2 3.36Å; R203-D375 VanDerWaalsContact NH2-OD2 3.13Å; T371-D375 WeakPolarHBondContact O-CB 3.17Å; T371-D375 PolarHBondContact O-N 3.1Å; D375-N377 VanDerWaalsContact C-N 3.32Å; D375-N377 PolarHBondContact O-N 2.77Å; D375-N378 PolarHBondContact O-N 3.24Å
376	Q	90.4	Very high	95.2	Very high	141 Å²	141	39.4 Å²	39.4	66%	0.659	21%	0.21	S	C	*	.	T	Hydrogen-bonded Turn	trans	-56.6	-40.8	-172.7	-85	168.4	29.3	0	0	114.1	V372 A374	V372-Q376 WeakPolarHBondContact O-CG 3.48Å; V372-Q376 PolarHBondContact O-NE2 3.11Å; V372-Q376 VanDerWaalsContact O-NE2 3.12Å; A374-Q376 PolarHBondContact O-N 2.81Å
377	N	90.2	Very high	95.1	Very high	161 Å²	161	40.7 Å²	40.7	86%	0.861	22%	0.218	S	C	*	.	T	Hydrogen-bonded Turn	trans	-112.8	15.3	-178	-62.6	-33.1	0	0	0	112.2	D375	D375-N377 VanDerWaalsContact C-N 3.32Å; D375-N377 PolarHBondContact O-N 2.77Å
378	N	92.3	Very high	95	Very high	27 Å²	27	47.5 Å²	47.5	14%	0.144	25%	0.25	C	S	.	.			trans	-97.6	100.9	-174.3	-176.5	5.3	0	0	0	110.9	K110 T367 D375 R380	K110-N378 PolarHBondContact NZ-ND2 3.08Å; K110-N378 PolarHBondContact NZ-O 3.02Å; T367-N378 PolarHBondContact OG1-ND2 3.03Å; D375-N378 PolarHBondContact O-N 3.24Å; N378-R380 VanDerWaalsContact C-N 3.31Å; N378-R380 WeakPolarHBondContact OD1-CB 3.42Å; N378-R380 PolarHBondContact OD1-N 3.36Å
379	S	92.5	Very high	94.9	Very high	109 Å²	109	47.8 Å²	47.8	76%	0.762	25%	0.253	S	S	*	.			trans	-75.3	-18.2	176.2	57.9	0	0	0	0	113.6
380	R	94.8	Very high	95	Very high	71 Å²	71	52.3 Å²	52.3	27%	0.268	27%	0.271	S	S	.	.			trans	-70.4	144.5	-176	-60.4	179	-180	157.3	-1.2	111.2	K110 D245 T367 N378	K110-R380 WeakPolarHBondContact CE-O 3.41Å; K110-R380 PolarHBondContact NZ-O 2.96Å; D245-R380 IonicContact OD1-CZ 3.76Å; D245-R380 VanDerWaalsContact OD1-CZ 3.24Å; D245-R380 IonicContact OD1-NE 2.83Å; D245-R380 PolarHBondContact OD1-NE 3.32Å; D245-R380 IonicContact OD1-NH2 3.8Å; D245-R380 PolarHBondContact OD1-NH2 3.43Å; D245-R380 IonicContact OD2-NH2 3.87Å; T367-R380 HydrophobicContact CG2-CB 4.42Å; N378-R380 VanDerWaalsContact C-N 3.31Å; N378-R380 WeakPolarHBondContact OD1-CB 3.42Å; N378-R380 PolarHBondContact OD1-N 3.36Å
381	K	95.5	Very high	95	Very high	63 Å²	63	54.4 Å²	54.4	27%	0.274	29%	0.286	S	S	.	.			trans	-132.7	146.3	178.1	-57.6	176.8	179.1	166.3	0	109.2	V112 V250 I252 N366	V112-K381 HydrophobicContact CG2-CB 4.35Å; V112-K381 HydrophobicContact CG2-CD 3.84Å; V250-K381 PolarHBondContact O-NZ 3.19Å; I252-K381 HydrophobicContact CD1-CB 4.41Å; I252-K381 HydrophobicContact CD1-CD 3.87Å; I252-K381 HydrophobicContact CD1-CG 3.95Å; I252-K381 HydrophobicContact CG1-CD 3.98Å; N366-K381 WeakPolarHBondContact CB-O 3.42Å; N366-K381 PolarHBondContact ND2-O 2.94Å
382	N	97.8	Very high	95	Very high	0 Å²	0	53.4 Å²	53.4	0%	0	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.7	153.9	172.1	-61.9	-38.3	0	0	0	109.9	T109 K110 T111 V112 Y363 N366 T367	T109-N382 PolarHBondContact O-ND2 2.96Å; K110-N382 PolarHBondContact O-N 3.5Å; T111-N382 CarbonylContact C-O 3.57Å; T111-N382 WeakPolarHBondContact CA-O 3.47Å; T111-N382 HydrophobicContact CG2-CB 4.26Å; V112-N382 PolarHBondContact N-O 2.94Å; Y363-N382 HydrophobicContact CE1-CB 4.36Å; Y363-N382 VanDerWaalsContact OH-CB 3.26Å; Y363-N382 WeakPolarHBondContact OH-CB 3.49Å; N366-N382 PolarHBondContact N-OD1 3.26Å; T367-N382 PolarHBondContact N-OD1 2.72Å; T367-N382 PolarHBondContact O-ND2 2.95Å; T367-N382 VanDerWaalsContact O-ND2 3.11Å; T367-N382 PolarHBondContact O-OD1 2.71Å
383	I	97.9	Very high	95	Very high	2 Å²	2	51.5 Å²	51.5	1%	0.01	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	134.1	-175.2	-52.5	167.2	0	0	0	109.5	I114 V242 Y246 I248 Y363 Q364 W385	I114-I383 HydrophobicContact CD1-CG2 3.67Å; I114-I383 HydrophobicContact CG1-CG2 4.22Å; V242-I383 HydrophobicContact CG2-CD1 3.72Å; Y246-I383 HydrophobicContact CD1-CD1 3.81Å; Y246-I383 HydrophobicContact CE1-CD1 4.47Å; I248-I383 HydrophobicContact CD1-CD1 3.62Å; I248-I383 HydrophobicContact CD1-CG1 3.79Å; I248-I383 HydrophobicContact CD1-CG2 4.1Å; Y363-I383 WeakPolarHBondContact CA-O 3.41Å; Q364-I383 PolarHBondContact N-O 2.87Å; Q364-I383 PolarHBondContact O-N 3.37Å; I383-W385 HydrophobicContact CB-CH2 3.74Å; I383-W385 HydrophobicContact CB-CZ2 4.19Å; I383-W385 HydrophobicContact CB-CZ3 3.93Å; I383-W385 HydrophobicContact CD1-CH2 4.14Å; I383-W385 HydrophobicContact CD1-CZ2 4.35Å; I383-W385 HydrophobicContact CG2-CD2 3.9Å; I383-W385 HydrophobicContact CG2-CE3 3.94Å; I383-W385 HydrophobicContact CG2-CH2 3.46Å; I383-W385 VanDerWaalsContact CG2-CH2 3.46Å; I383-W385 HydrophobicContact CG2-CZ2 3.42Å; I383-W385 VanDerWaalsContact CG2-CZ2 3.42Å; I383-W385 HydrophobicContact CG2-CZ3 3.71Å
384	C	98.1	Very high	95.1	Very high	0 Å²	0	53.7 Å²	53.7	0%	0	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	120.4	171.9	-173.1	0	0	0	0	109.3	T111 V112 F113 I114 L320 C362 Y363	T111-C384 HydrophobicContact CG2-CB 3.78Å; V112-C384 PolarHBondContact O-N 3.12Å; F113-C384 CarbonylContact C-O 3.56Å; F113-C384 VanDerWaalsContact CA-O 3.3Å; F113-C384 WeakPolarHBondContact CA-O 3.42Å; F113-C384 HydrophobicContact CD2-CB 4.37Å; I114-C384 PolarHBondContact N-O 2.83Å; L320-C384 HydrophobicContact CD2-CB 3.41Å; L320-C384 VanDerWaalsContact CD2-CB 3.41Å; L320-C384 HydrophobicContact CG-CB 4.47Å; C362-C384 CarbonylContact O-C 3.15Å; C362-C384 WeakPolarHBondContact O-CA 3.5Å; Y363-C384 HydrophobicContact CD2-CB 3.74Å; Y363-C384 HydrophobicContact CE2-CB 4.12Å
385	W	98.1	Very high	95.2	Very high	10 Å²	10	55.1 Å²	55.1	4%	0.038	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.6	147.4	169.1	-63.7	-93.3	0	0	0	109.5	I114 G116 P118 F241 V242 F361 C362 Q364 I383	I114-W385 CarbonylContact O-C 3.51Å; I114-W385 VanDerWaalsContact O-CA 3.31Å; I114-W385 WeakPolarHBondContact O-CA 3.46Å; G116-W385 WeakPolarHBondContact O-CB 3.26Å; P118-W385 HydrophobicContact CB-CD2 4.04Å; P118-W385 HydrophobicContact CB-CE3 4.41Å; P118-W385 HydrophobicContact CB-CG 4.32Å; P118-W385 HydrophobicContact CB-CZ2 4.44Å; F241-W385 HydrophobicContact CB-CH2 4.06Å; F241-W385 HydrophobicContact CB-CZ3 4.33Å; F241-W385 HydrophobicContact CD2-CE3 4.21Å; F241-W385 HydrophobicContact CD2-CH2 4.31Å; F241-W385 AromaticContact CD2-CZ3 3.74Å; F241-W385 HydrophobicContact CD2-CZ3 3.74Å; F241-W385 HydrophobicContact CG-CZ3 4.44Å; V242-W385 HydrophobicContact CG1-CH2 4.33Å; V242-W385 HydrophobicContact CG1-CZ2 3.95Å; V242-W385 HydrophobicContact CG2-CH2 3.96Å; V242-W385 HydrophobicContact CG2-CZ2 4.24Å; F361-W385 VanDerWaalsContact CA-O 3.28Å; F361-W385 WeakPolarHBondContact CA-O 3.47Å; C362-W385 HydrophobicContact CB-CB 4.21Å; C362-W385 HydrophobicContact CB-CE3 4.09Å; C362-W385 PolarHBondContact N-O 3.43Å; C362-W385 PolarHBondContact O-N 2.96Å; Q364-W385 HydrophobicContact CB-CH2 4.07Å; Q364-W385 HydrophobicContact CB-CZ3 3.69Å; I383-W385 HydrophobicContact CB-CH2 3.74Å; I383-W385 HydrophobicContact CB-CZ2 4.19Å; I383-W385 HydrophobicContact CB-CZ3 3.93Å; I383-W385 HydrophobicContact CD1-CH2 4.14Å; I383-W385 HydrophobicContact CD1-CZ2 4.35Å; I383-W385 HydrophobicContact CG2-CD2 3.9Å; I383-W385 HydrophobicContact CG2-CE3 3.94Å; I383-W385 HydrophobicContact CG2-CH2 3.46Å; I383-W385 VanDerWaalsContact CG2-CH2 3.46Å; I383-W385 HydrophobicContact CG2-CZ2 3.42Å; I383-W385 VanDerWaalsContact CG2-CZ2 3.42Å; I383-W385 HydrophobicContact CG2-CZ3 3.71Å
386	G	97.2	Very high	95	Very high	1 Å²	1	55.3 Å²	55.3	1%	0.01	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-157.5	143.3	177.1	0	0	0	0	0	114	I114 G116 F360 F361	I114-G386 PolarHBondContact O-N 2.78Å; G116-G386 PolarHBondContact N-O 3.05Å; G116-G386 CarbonylContact O-C 3.15Å; G116-G386 PolarHBondContact O-N 3.15Å; F360-G386 VanDerWaalsContact O-CA 3.31Å; F360-G386 WeakPolarHBondContact O-CA 3.49Å; F361-G386 VanDerWaalsContact CD1-CA 3.42Å
387	T	96	Very high	95.1	Very high	27 Å²	27	53.6 Å²	53.6	17%	0.166	28%	0.277	C	S	.	.	P	Polyproline II helix	trans	-97.4	162.3	173.3	63.3	0	0	0	0	111.6	L117 F360	L117-T387 HydrophobicContact CD1-CG2 4.42Å; L117-T387 HydrophobicContact CD2-CG2 3.82Å; L117-T387 HydrophobicContact CG-CG2 3.7Å; F360-T387 HydrophobicContact CB-CG2 4.47Å; F360-T387 PolarHBondContact N-OG1 3.42Å; F360-T387 VanDerWaalsContact N-OG1 3.15Å; F360-T387 PolarHBondContact O-N 3.15Å; F360-T387 PolarHBondContact O-OG1 3.16Å
388	Q	95	Very high	94.7	Very high	144 Å²	144	53.1 Å²	53.1	67%	0.673	27%	0.274	S	S	*	.	P	Polyproline II helix	trans	-71.6	151.3	169.4	-66.9	-178.2	-7.5	0	0	110.6	K390	Q388-K390 PolarHBondContact O-N 2.87Å
389	S	95.3	Very high	94.5	Very high	18 Å²	18	56.5 Å²	56.5	13%	0.126	29%	0.292	C	S	.	.	P	Polyproline II helix	trans	-62.4	130.7	176.1	71.2	0	0	0	0	112.6	R299 E312 F358 S359	R299-S389 PolarHBondContact NH1-OG 2.86Å; E312-S389 WeakPolarHBondContact OE1-CB 3.49Å; E312-S389 PolarHBondContact OE1-N 3.28Å; E312-S389 PolarHBondContact OE1-OG 2.91Å; E312-S389 PolarHBondContact OE2-N 3.18Å; F358-S389 WeakPolarHBondContact O-CA 3.42Å; S359-S389 VanDerWaalsContact OG-CA 3.28Å; S359-S389 WeakPolarHBondContact OG-CA 3.31Å; S359-S389 WeakPolarHBondContact OG-CB 3.2Å; S359-S389 PolarHBondContact OG-N 3.09Å
390	K	96.8	Very high	94.6	Very high	100 Å²	100	54.7 Å²	54.7	44%	0.435	27%	0.274	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	139.4	174.4	-67.9	-171.9	178.7	-173.1	0	111	Y357 F358 Q388 V408	Y357-K390 CarbonylContact C-O 3.54Å; Y357-K390 WeakPolarHBondContact CA-O 3.31Å; F358-K390 PolarHBondContact N-O 2.98Å; F358-K390 PolarHBondContact O-N 2.87Å; Q388-K390 PolarHBondContact O-N 2.87Å; K390-V408 HydrophobicContact CB-CG2 3.79Å
391	P	97.1	Very high	94.5	Very high	48 Å²	48	51.8 Å²	51.8	31%	0.312	26%	0.264	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.1	138.3	176.9	30.5	-32.6	0	0	0	110.8	K356 Y357	K356-P391 CarbonylContact O-C 3.57Å; K356-P391 WeakPolarHBondContact O-CA 3.42Å; Y357-P391 HydrophobicContact CD1-CB 3.98Å; Y357-P391 HydrophobicContact CD1-CG 4.45Å; Y357-P391 HydrophobicContact CE1-CB 3.77Å; Y357-P391 HydrophobicContact CE1-CG 4.05Å
392	L	96.8	Very high	94.5	Very high	3 Å²	3	53 Å²	53	2%	0.016	27%	0.269	C	S	.	.	S	Bend	trans	-77.4	-33.7	172.4	179	64	0	0	0	111.9	V137 I141 K356 F358 F404 D405 V408	V137-L392 HydrophobicContact CG1-CD2 4.24Å; I141-L392 HydrophobicContact CD1-CD2 4.26Å; K356-L392 PolarHBondContact O-N 3.06Å; F358-L392 HydrophobicContact CD2-CB 3.78Å; F358-L392 HydrophobicContact CD2-CD2 4.49Å; F358-L392 HydrophobicContact CE2-CB 3.66Å; F358-L392 HydrophobicContact CE2-CD2 3.73Å; F358-L392 HydrophobicContact CE2-CG 4.32Å; F358-L392 HydrophobicContact CZ-CD2 4.08Å; L392-F404 HydrophobicContact CD1-CE1 4.43Å; L392-F404 HydrophobicContact CD1-CE2 3.82Å; L392-F404 HydrophobicContact CD1-CZ 3.76Å; L392-F404 HydrophobicContact CD2-CE2 4.43Å; L392-F404 HydrophobicContact CG-CD2 4.48Å; L392-F404 HydrophobicContact CG-CE2 3.94Å; L392-F404 HydrophobicContact CG-CZ 4.39Å; L392-F404 WeakPolarHBondContact O-CA 3.16Å; L392-D405 PolarHBondContact O-N 3.15Å; L392-V408 HydrophobicContact CB-CG1 4.29Å; L392-V408 HydrophobicContact CD1-CB 3.98Å; L392-V408 HydrophobicContact CD1-CG1 3.88Å
393	Y	95.8	Very high	94.3	Very high	18 Å²	18	55 Å²	55	7%	0.071	29%	0.29	C	S	.	.			trans	-147.9	159.8	177.5	61.3	-86.7	0	0	0	110.3	I141 G355 K356 V396 V401 G403	I141-Y393 HydrophobicContact CD1-CD1 3.89Å; I141-Y393 HydrophobicContact CD1-CE1 4.2Å; G355-Y393 PolarHBondContact O-OH 3.18Å; K356-Y393 WeakPolarHBondContact CE-O 3.36Å; K356-Y393 HydrophobicContact CG-CE1 4.46Å; K356-Y393 HydrophobicContact CG-CE2 4.36Å; Y393-V396 HydrophobicContact CD2-CG2 3.98Å; Y393-V396 HydrophobicContact CE2-CG2 3.81Å; Y393-V401 VanDerWaalsContact CB-CG1 3.49Å; Y393-V401 HydrophobicContact CD2-CG1 4.44Å; Y393-V401 HydrophobicContact CG-CG1 4.01Å; Y393-G403 WeakPolarHBondContact CA-O 3.16Å
394	E	94	Very high	94.2	Very high	124 Å²	124	55.8 Å²	55.8	58%	0.579	29%	0.293	S	S	*	.	S	Bend	trans	-88.8	-59.1	179.8	-71.1	-178.1	173	0	0	111.9	K356 K402 G403	K356-E394 WeakPolarHBondContact CE-O 3.3Å; K356-E394 PolarHBondContact NZ-O 3.05Å; E394-K402 PolarHBondContact N-O 3.1Å; E394-G403 PolarHBondContact N-O 3.13Å
395	T	93.1	Very high	94.1	Very high	55 Å²	55	57.8 Å²	57.8	34%	0.337	30%	0.304	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.7	160.9	179	58.3	0	0	0	0	111	E397 K402	T395-E397 WeakPolarHBondContact CB-OE1 3.38Å; T395-E397 PolarHBondContact OG1-OE1 3.01Å; T395-K402 PolarHBondContact N-O 3.26Å; T395-K402 PolarHBondContact O-N 3.49Å
396	V	91.6	Very high	94	Very high	40 Å²	40	59.5 Å²	59.5	24%	0.242	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	108	171.6	-179	0	0	0	0	106.6	I141 L142 H145 V146 Y393 D400 V401	I141-V396 HydrophobicContact CG2-CG2 3.83Å; L142-V396 HydrophobicContact CD2-CG1 3.84Å; H145-V396 HydrophobicContact CB-CG1 4.24Å; V146-V396 HydrophobicContact CG2-CG1 3.84Å; Y393-V396 HydrophobicContact CD2-CG2 3.98Å; Y393-V396 HydrophobicContact CE2-CG2 3.81Å; V396-D400 WeakPolarHBondContact CA-O 3.42Å; V396-V401 HydrophobicContact CG2-CG2 4.47Å
397	E	90.7	Very high	93.9	Very high	105 Å²	105	64.1 Å²	64.1	49%	0.491	34%	0.338	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139	145.1	-173.5	-70.6	174.4	-154.3	0	0	109.1	T395 N399 D400	T395-E397 WeakPolarHBondContact CB-OE1 3.38Å; T395-E397 PolarHBondContact OG1-OE1 3.01Å; E397-N399 PolarHBondContact O-N 3.25Å; E397-N399 VanDerWaalsContact O-N 3.14Å; E397-D400 PolarHBondContact N-O 3.04Å; E397-D400 VanDerWaalsContact N-O 3.08Å; E397-D400 PolarHBondContact O-N 2.82Å
398	D	83.4	Confident	93.9	Very high	151 Å²	151	62.8 Å²	62.8	81%	0.807	33%	0.331	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.1	37	176.7	-57.2	-32.9	0	0	0	115.3	D400	D398-D400 PolarHBondContact O-N 3.35Å
399	N	88.3	Confident	94	Very high	97 Å²	97	56 Å²	56	52%	0.519	30%	0.299	S	S	.	.	T	Hydrogen-bonded Turn	trans	61.1	24.4	-175.6	-49.4	-29.9	0	0	0	114.1	L142 V146 E397	L142-N399 WeakPolarHBondContact CD1-O 3.34Å; L142-N399 WeakPolarHBondContact CD2-O 3.37Å; V146-N399 HydrophobicContact CG1-CB 4.33Å; V146-N399 WeakPolarHBondContact CG1-OD1 3.44Å; E397-N399 PolarHBondContact O-N 3.25Å; E397-N399 VanDerWaalsContact O-N 3.14Å
400	D	92.6	Very high	94	Very high	72 Å²	72	57 Å²	57	39%	0.385	30%	0.302	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.5	153.1	178.1	-172.3	25.3	0	0	0	111	V396 E397 D398 K402	V396-D400 WeakPolarHBondContact CA-O 3.42Å; E397-D400 PolarHBondContact N-O 3.04Å; E397-D400 VanDerWaalsContact N-O 3.08Å; E397-D400 PolarHBondContact O-N 2.82Å; D398-D400 PolarHBondContact O-N 3.35Å; D400-K402 WeakPolarHBondContact OD2-CE 3.32Å; D400-K402 IonicContact OD2-NZ 3.56Å; D400-K402 PolarHBondContact OD2-NZ 2.91Å
401	V	94.2	Very high	93.9	Very high	9 Å²	9	53.8 Å²	53.8	6%	0.055	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.9	109	178.6	-176.4	0	0	0	0	108.5	C138 I141 L142 Y393 V396 F404	C138-V401 HydrophobicContact CB-CG2 4.3Å; I141-V401 HydrophobicContact CB-CG2 4.27Å; I141-V401 HydrophobicContact CG2-CG2 3.91Å; L142-V401 HydrophobicContact CD1-CG2 4.47Å; L142-V401 HydrophobicContact CD2-CG2 3.93Å; L142-V401 HydrophobicContact CG-CG2 3.9Å; Y393-V401 VanDerWaalsContact CB-CG1 3.49Å; Y393-V401 HydrophobicContact CD2-CG1 4.44Å; Y393-V401 HydrophobicContact CG-CG1 4.01Å; V396-V401 HydrophobicContact CG2-CG2 4.47Å; V401-F404 HydrophobicContact CG1-CD2 4.25Å
402	K	94.1	Very high	93.8	Very high	89 Å²	89	51.6 Å²	51.6	39%	0.387	28%	0.275	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89	142.9	-179.1	-57.6	-57.5	-175.1	-170.5	0	111.2	E394 T395 D400	E394-K402 PolarHBondContact N-O 3.1Å; T395-K402 PolarHBondContact N-O 3.26Å; T395-K402 PolarHBondContact O-N 3.49Å; D400-K402 WeakPolarHBondContact OD2-CE 3.32Å; D400-K402 IonicContact OD2-NZ 3.56Å; D400-K402 PolarHBondContact OD2-NZ 2.91Å
403	G	94	Very high	93.8	Very high	42 Å²	42	51.5 Å²	51.5	43%	0.433	27%	0.274	S	S	.	.	S	Bend	trans	64.3	40	174.8	0	0	0	0	0	114.5	Y393 E394	Y393-G403 WeakPolarHBondContact CA-O 3.16Å; E394-G403 PolarHBondContact N-O 3.13Å
404	F	96.4	Very high	93.7	Very high	18 Å²	18	53.3 Å²	53.3	8%	0.079	29%	0.285	C	S	.	.			trans	-68.4	128.2	177.2	-170.9	-85.9	0	0	0	111.6	R134 V137 I141 L392 V401 D406 L409	R134-F404 HydrophobicContact CB-CE1 4.47Å; R134-F404 HydrophobicContact CG-CD1 3.98Å; R134-F404 HydrophobicContact CG-CE1 3.83Å; R134-F404 HydrophobicContact CG-CZ 4.33Å; V137-F404 HydrophobicContact CB-CZ 4.44Å; V137-F404 HydrophobicContact CG1-CE2 3.9Å; V137-F404 HydrophobicContact CG1-CZ 4.09Å; I141-F404 HydrophobicContact CD1-CE2 4.35Å; L392-F404 HydrophobicContact CD1-CE1 4.43Å; L392-F404 HydrophobicContact CD1-CE2 3.82Å; L392-F404 HydrophobicContact CD1-CZ 3.76Å; L392-F404 HydrophobicContact CD2-CE2 4.43Å; L392-F404 HydrophobicContact CG-CD2 4.48Å; L392-F404 HydrophobicContact CG-CE2 3.94Å; L392-F404 HydrophobicContact CG-CZ 4.39Å; L392-F404 WeakPolarHBondContact O-CA 3.16Å; V401-F404 HydrophobicContact CG1-CD2 4.25Å; F404-D406 VanDerWaalsContact CD1-OD1 3.26Å; F404-D406 WeakPolarHBondContact CD1-OD1 3.37Å; F404-D406 WeakPolarHBondContact CE1-OD1 3.44Å; F404-L409 HydrophobicContact CE1-CB 4.12Å; F404-L409 HydrophobicContact CE1-CD2 4Å; F404-L409 HydrophobicContact CZ-CB 4.14Å; F404-L409 HydrophobicContact CZ-CD2 3.99Å
405	D	96.6	Very high	93.7	Very high	42 Å²	42	47.9 Å²	47.9	23%	0.225	26%	0.26	C	S	.	.			trans	-98.9	103.4	178.7	-172.8	-0.9	0	0	0	111.6	L392 N407 V408	L392-D405 PolarHBondContact O-N 3.15Å; D405-N407 PolarHBondContact O-N 3.03Å; D405-N407 VanDerWaalsContact OD1-CB 3.23Å; D405-N407 WeakPolarHBondContact OD1-CB 3.13Å; D405-N407 PolarHBondContact OD1-N 2.86Å; D405-N407 PolarHBondContact OD1-ND2 3.29Å; D405-V408 HydrophobicContact CB-CG2 4.17Å; D405-V408 PolarHBondContact O-N 3.32Å
406	D	95.8	Very high	93.9	Very high	46 Å²	46	45.3 Å²	45.3	25%	0.246	24%	0.244	C	C	.	.	H	α-helix	trans	-61.5	-24.3	177.7	-65	-28.6	0	0	0	112.6	L130 R134 F404 V408 L409 L410	L130-D406 HydrophobicContact CD2-CB 4.4Å; R134-D406 WeakPolarHBondContact CD-OD1 3.41Å; R134-D406 IonicContact CZ-OD1 2.89Å; R134-D406 IonicContact NE-OD1 3.62Å; R134-D406 VanDerWaalsContact NH1-CG 3.26Å; R134-D406 IonicContact NH1-OD1 3.36Å; R134-D406 PolarHBondContact NH1-OD1 2.84Å; R134-D406 IonicContact NH1-OD2 2.89Å; R134-D406 PolarHBondContact NH1-OD2 2.7Å; F404-D406 VanDerWaalsContact CD1-OD1 3.26Å; F404-D406 WeakPolarHBondContact CD1-OD1 3.37Å; F404-D406 WeakPolarHBondContact CE1-OD1 3.44Å; D406-V408 VanDerWaalsContact C-N 3.32Å; D406-V408 PolarHBondContact O-N 3.01Å; D406-L409 PolarHBondContact O-N 2.8Å; D406-L410 WeakPolarHBondContact O-CB 3.39Å; D406-L410 VanDerWaalsContact O-CG 3.26Å; D406-L410 WeakPolarHBondContact O-CG 3.34Å; D406-L410 PolarHBondContact O-N 3.21Å
407	N	95.3	Very high	94	Very high	98 Å²	98	44.7 Å²	44.7	52%	0.524	24%	0.239	S	C	.	.	H	α-helix	trans	-70.4	-30.2	179.6	-58.1	-68.4	0	0	0	112.5	D405 Q411	D405-N407 PolarHBondContact O-N 3.03Å; D405-N407 VanDerWaalsContact OD1-CB 3.23Å; D405-N407 WeakPolarHBondContact OD1-CB 3.13Å; D405-N407 PolarHBondContact OD1-N 2.86Å; D405-N407 PolarHBondContact OD1-ND2 3.29Å; N407-Q411 WeakPolarHBondContact O-CG 3.43Å; N407-Q411 PolarHBondContact O-N 3Å; N407-Q411 PolarHBondContact O-NE2 3.48Å; N407-Q411 VanDerWaalsContact O-NE2 3.08Å
408	V	96.1	Very high	94.1	Very high	0 Å²	0	41.2 Å²	41.2	0%	0	22%	0.223	C	C	.	.	H	α-helix	trans	-72.5	-44.1	175	177.6	0	0	0	0	109.3	F358 F360 K390 L392 D405 D406 L410 Q411 I412	F358-V408 HydrophobicContact CB-CG1 3.81Å; F358-V408 HydrophobicContact CD2-CG1 4.18Å; F358-V408 HydrophobicContact CG-CG1 4.06Å; F360-V408 HydrophobicContact CE2-CG1 4.12Å; F360-V408 HydrophobicContact CZ-CG1 3.92Å; K390-V408 HydrophobicContact CB-CG2 3.79Å; L392-V408 HydrophobicContact CB-CG1 4.29Å; L392-V408 HydrophobicContact CD1-CB 3.98Å; L392-V408 HydrophobicContact CD1-CG1 3.88Å; D405-V408 HydrophobicContact CB-CG2 4.17Å; D405-V408 PolarHBondContact O-N 3.32Å; D406-V408 VanDerWaalsContact C-N 3.32Å; D406-V408 PolarHBondContact O-N 3.01Å; V408-L410 PolarHBondContact O-N 3.12Å; V408-Q411 PolarHBondContact O-N 3.26Å; V408-I412 HydrophobicContact CG1-CD1 4.48Å; V408-I412 WeakPolarHBondContact O-CG1 3.4Å; V408-I412 PolarHBondContact O-N 2.84Å; V408-I412 VanDerWaalsContact O-N 3.09Å
409	L	96.3	Very high	94.5	Very high	1 Å²	1	38 Å²	38	1%	0.005	20%	0.202	C	C	.	.	H	α-helix	trans	-59	-48	174.7	177.4	57.9	0	0	0	111.5	L130 L133 R134 V137 L175 F404 D406 Q411 I412 V413	L130-L409 HydrophobicContact CD1-CD2 4.08Å; L133-L409 HydrophobicContact CB-CD2 4.23Å; R134-L409 HydrophobicContact CB-CD2 4.17Å; V137-L409 HydrophobicContact CG2-CD1 3.84Å; L175-L409 HydrophobicContact CD2-CD1 4.26Å; F404-L409 HydrophobicContact CE1-CB 4.12Å; F404-L409 HydrophobicContact CE1-CD2 4Å; F404-L409 HydrophobicContact CZ-CB 4.14Å; F404-L409 HydrophobicContact CZ-CD2 3.99Å; D406-L409 PolarHBondContact O-N 2.8Å; L409-Q411 VanDerWaalsContact C-N 3.27Å; L409-Q411 PolarHBondContact O-N 3.46Å; L409-I412 WeakPolarHBondContact O-CB 3.45Å; L409-I412 PolarHBondContact O-N 2.65Å; L409-I412 VanDerWaalsContact O-N 3.1Å; L409-V413 HydrophobicContact CD1-CG2 4.19Å; L409-V413 HydrophobicContact CG-CG2 4.46Å; L409-V413 WeakPolarHBondContact O-CG2 3.44Å; L409-V413 PolarHBondContact O-N 3.42Å
410	L	94.7	Very high	94.7	Very high	39 Å²	39	34 Å²	34	20%	0.204	18%	0.182	C	C	.	.	H	α-helix	trans	-58.2	-38	177.3	-76.5	171	0	0	0	112.3	L128 L130 D406 V408 V413 D414	L128-L410 HydrophobicContact CD2-CD2 3.87Å; L130-L410 HydrophobicContact CD1-CD2 3.75Å; L130-L410 HydrophobicContact CD1-CG 3.99Å; L130-L410 HydrophobicContact CD2-CD1 4.31Å; L130-L410 HydrophobicContact CD2-CD2 4.32Å; L130-L410 HydrophobicContact CD2-CG 4.42Å; D406-L410 WeakPolarHBondContact O-CB 3.39Å; D406-L410 VanDerWaalsContact O-CG 3.26Å; D406-L410 WeakPolarHBondContact O-CG 3.34Å; D406-L410 PolarHBondContact O-N 3.21Å; V408-L410 PolarHBondContact O-N 3.12Å; L410-V413 PolarHBondContact O-N 2.98Å; L410-D414 WeakPolarHBondContact O-CB 3.42Å; L410-D414 VanDerWaalsContact O-CG 3.27Å; L410-D414 PolarHBondContact O-N 2.86Å
411	Q	94.9	Very high	94.2	Very high	33 Å²	33	37.4 Å²	37.4	15%	0.154	19%	0.193	C	C	.	.	H	α-helix	trans	-67.5	-38.6	175.3	-79.7	170.9	71.7	0	0	113	F360 N407 V408 L409 V413 D414 F415	F360-Q411 HydrophobicContact CD1-CB 4.15Å; F360-Q411 HydrophobicContact CD2-CB 4.27Å; F360-Q411 VanDerWaalsContact CD2-OE1 3.26Å; F360-Q411 HydrophobicContact CE1-CB 3.75Å; F360-Q411 HydrophobicContact CE2-CB 3.88Å; F360-Q411 HydrophobicContact CG-CB 4.39Å; F360-Q411 HydrophobicContact CZ-CB 3.61Å; N407-Q411 WeakPolarHBondContact O-CG 3.43Å; N407-Q411 PolarHBondContact O-N 3Å; N407-Q411 PolarHBondContact O-NE2 3.48Å; N407-Q411 VanDerWaalsContact O-NE2 3.08Å; V408-Q411 PolarHBondContact O-N 3.26Å; L409-Q411 VanDerWaalsContact C-N 3.27Å; L409-Q411 PolarHBondContact O-N 3.46Å; Q411-V413 VanDerWaalsContact C-N 3.32Å; Q411-D414 PolarHBondContact O-N 3.47Å; Q411-F415 VanDerWaalsContact O-CD1 3.31Å; Q411-F415 WeakPolarHBondContact O-CD1 3.35Å; Q411-F415 PolarHBondContact O-N 3.25Å; Q411-F415 VanDerWaalsContact O-N 3.11Å
412	I	96.2	Very high	93.1	Very high	2 Å²	2	43.6 Å²	43.6	1%	0.01	22%	0.222	C	C	.	.	H	α-helix	trans	-61.7	-45.7	173.6	-61.6	167.5	0	0	0	109.5	L175 F358 F360 V408 L409 F415 L416	L175-I412 HydrophobicContact CD1-CG2 3.61Å; F358-I412 HydrophobicContact CD1-CD1 4.14Å; F358-I412 HydrophobicContact CE1-CD1 4.16Å; F360-I412 HydrophobicContact CE1-CB 4.38Å; F360-I412 HydrophobicContact CE1-CG1 3.56Å; F360-I412 HydrophobicContact CZ-CG1 3.72Å; V408-I412 HydrophobicContact CG1-CD1 4.48Å; V408-I412 WeakPolarHBondContact O-CG1 3.4Å; V408-I412 PolarHBondContact O-N 2.84Å; V408-I412 VanDerWaalsContact O-N 3.09Å; L409-I412 WeakPolarHBondContact O-CB 3.45Å; L409-I412 PolarHBondContact O-N 2.65Å; L409-I412 VanDerWaalsContact O-N 3.1Å; I412-F415 PolarHBondContact O-N 3.03Å; I412-L416 HydrophobicContact CG2-CD1 4.13Å; I412-L416 WeakPolarHBondContact O-CG 3.13Å; I412-L416 PolarHBondContact O-N 3.01Å; I412-L416 VanDerWaalsContact O-N 3.11Å
413	V	95.4	Very high	91.2	Very high	0 Å²	0	43.8 Å²	43.8	0%	0	23%	0.227	C	C	.	.	H	α-helix	trans	-64.2	-45.7	179.1	173.8	0	0	0	0	111.2	L128 L133 L179 L409 L410 Q411 F415 L416 L417	L128-V413 HydrophobicContact CD1-CG1 4.05Å; L128-V413 HydrophobicContact CD2-CG1 3.87Å; L133-V413 HydrophobicContact CD1-CG2 4.06Å; L179-V413 HydrophobicContact CD1-CG1 4.13Å; L179-V413 HydrophobicContact CD1-CG2 4.39Å; L179-V413 HydrophobicContact CD2-CG1 3.83Å; L409-V413 HydrophobicContact CD1-CG2 4.19Å; L409-V413 HydrophobicContact CG-CG2 4.46Å; L409-V413 WeakPolarHBondContact O-CG2 3.44Å; L409-V413 PolarHBondContact O-N 3.42Å; L410-V413 PolarHBondContact O-N 2.98Å; Q411-V413 VanDerWaalsContact C-N 3.32Å; V413-F415 PolarHBondContact O-N 3.2Å; V413-L416 CarbonylContact O-C 3.51Å; V413-L416 PolarHBondContact O-N 3.23Å; V413-L416 VanDerWaalsContact O-N 3.11Å; V413-L417 HydrophobicContact CG1-CD1 3.66Å; V413-L417 HydrophobicContact CG1-CG 4Å; V413-L417 WeakPolarHBondContact O-CB 3.4Å; V413-L417 WeakPolarHBondContact O-CG 3.47Å; V413-L417 PolarHBondContact O-N 2.98Å
414	D	93.6	Very high	89	Confident	56 Å²	56	52.1 Å²	52.1	30%	0.299	25%	0.245	S	C	.	.	H	α-helix	trans	-58.1	-37	177.8	-79.9	-14.1	0	0	0	111.4	R125 L410 Q411	R125-D414 IonicContact CZ-OD2 3.42Å; R125-D414 IonicContact NE-OD1 2.7Å; R125-D414 IonicContact NH2-OD1 3.38Å; R125-D414 IonicContact NH2-OD2 3.13Å; R125-D414 PolarHBondContact NH2-OD2 3.41Å; L410-D414 WeakPolarHBondContact O-CB 3.42Å; L410-D414 VanDerWaalsContact O-CG 3.27Å; L410-D414 PolarHBondContact O-N 2.86Å; Q411-D414 PolarHBondContact O-N 3.47Å
415	F	95.5	Very high	86.5	Confident	11 Å²	11	56.2 Å²	56.2	5%	0.048	27%	0.272	C	S	.	.	H	α-helix	trans	-65	-51.1	174.1	-84.6	36.2	0	0	0	110.9	L117 H287 Q349 V351 F360 F361 C362 Q411 I412 V413 L417 N418	L117-F415 HydrophobicContact CD1-CE1 4.23Å; L117-F415 HydrophobicContact CD2-CE1 3.91Å; L117-F415 HydrophobicContact CD2-CZ 3.75Å; H287-F415 PolarHBondContact CE1-O 3.44Å; Q349-F415 HydrophobicContact CB-CD2 3.81Å; Q349-F415 HydrophobicContact CB-CE2 4.07Å; Q349-F415 HydrophobicContact CG-CD2 4.19Å; Q349-F415 HydrophobicContact CG-CE2 4.4Å; Q349-F415 PolarHBondContact OE1-O 3.06Å; V351-F415 HydrophobicContact CG2-CD2 4.06Å; V351-F415 HydrophobicContact CG2-CE2 4.48Å; F360-F415 HydrophobicContact CB-CE1 4.37Å; F360-F415 HydrophobicContact CB-CE2 4.11Å; F360-F415 HydrophobicContact CB-CZ 3.72Å; F360-F415 HydrophobicContact CD1-CD2 4.38Å; F360-F415 HydrophobicContact CD1-CE1 4.42Å; F360-F415 HydrophobicContact CD1-CE2 4.17Å; F360-F415 HydrophobicContact CD1-CZ 4.2Å; F360-F415 HydrophobicContact CG-CZ 4.42Å; F361-F415 WeakPolarHBondContact O-CE2 3.09Å; C362-F415 VanDerWaalsContact SG-CZ 3.54Å; Q411-F415 VanDerWaalsContact O-CD1 3.31Å; Q411-F415 WeakPolarHBondContact O-CD1 3.35Å; Q411-F415 PolarHBondContact O-N 3.25Å; Q411-F415 VanDerWaalsContact O-N 3.11Å; I412-F415 PolarHBondContact O-N 3.03Å; V413-F415 PolarHBondContact O-N 3.2Å; F415-L417 VanDerWaalsContact C-N 3.27Å; F415-L417 PolarHBondContact O-N 2.98Å; F415-N418 VanDerWaalsContact O-CB 3.28Å; F415-N418 WeakPolarHBondContact O-CB 3.1Å; F415-N418 PolarHBondContact O-N 3.32Å; F415-N418 VanDerWaalsContact O-N 3.12Å
416	L	96	Very high	84	Confident	0 Å²	0	59.5 Å²	59.5	0%	0	29%	0.286	C	S	.	.	H	α-helix	trans	-64.4	-27.6	-179.7	-67.2	177.1	0	0	0	113.6	L175 L179 N183 I232 F290 I412 V413 N418	L175-L416 HydrophobicContact CB-CD1 3.79Å; L175-L416 HydrophobicContact CD1-CD1 4.26Å; L179-L416 HydrophobicContact CD1-CB 3.59Å; L179-L416 HydrophobicContact CD1-CD1 3.74Å; L179-L416 HydrophobicContact CD1-CG 4.33Å; N183-L416 PolarHBondContact ND2-O 3.47Å; I232-L416 HydrophobicContact CD1-CD2 3.5Å; F290-L416 HydrophobicContact CE2-CD2 4.44Å; F290-L416 HydrophobicContact CZ-CD2 4.19Å; I412-L416 HydrophobicContact CG2-CD1 4.13Å; I412-L416 WeakPolarHBondContact O-CG 3.13Å; I412-L416 PolarHBondContact O-N 3.01Å; I412-L416 VanDerWaalsContact O-N 3.11Å; V413-L416 CarbonylContact O-C 3.51Å; V413-L416 PolarHBondContact O-N 3.23Å; V413-L416 VanDerWaalsContact O-N 3.11Å; L416-N418 VanDerWaalsContact C-N 3.29Å; L416-N418 PolarHBondContact O-N 3.42Å
417	L	94.5	Very high	81.5	Confident	28 Å²	28	61.4 Å²	61.4	15%	0.147	30%	0.296	C	S	.	.	T	Hydrogen-bonded Turn	trans	-78.7	-9.2	176.6	-73	179.2	0	0	0	113.8	P126 L179 L182 N183 V413 F415 K419	P126-L417 HydrophobicContact CG-CD1 4.38Å; L179-L417 HydrophobicContact CD2-CD2 4.21Å; L182-L417 HydrophobicContact CB-CD2 3.63Å; L182-L417 HydrophobicContact CD1-CD2 4.28Å; N183-L417 HydrophobicContact CB-CD2 4.21Å; V413-L417 HydrophobicContact CG1-CD1 3.66Å; V413-L417 HydrophobicContact CG1-CG 4Å; V413-L417 WeakPolarHBondContact O-CB 3.4Å; V413-L417 WeakPolarHBondContact O-CG 3.47Å; V413-L417 PolarHBondContact O-N 2.98Å; F415-L417 VanDerWaalsContact C-N 3.27Å; F415-L417 PolarHBondContact O-N 2.98Å; L417-K419 VanDerWaalsContact O-CG 3.22Å; L417-K419 WeakPolarHBondContact O-CG 3.48Å; L417-K419 PolarHBondContact O-N 3.27Å
418	N	93	Very high	79	Confident	31 Å²	31	61.8 Å²	61.8	17%	0.166	30%	0.297	C	S	.	.			trans	-62.4	132.3	176	-167.5	12.5	0	0	0	110.5	N183 H287 Q349 F415 L416	N183-N418 PolarHBondContact ND2-O 2.9Å; H287-N418 PolarHBondContact NE2-O 3.12Å; Q349-N418 PolarHBondContact NE2-ND2 3.09Å; Q349-N418 VanDerWaalsContact NE2-ND2 3.1Å; F415-N418 VanDerWaalsContact O-CB 3.28Å; F415-N418 WeakPolarHBondContact O-CB 3.1Å; F415-N418 PolarHBondContact O-N 3.32Å; F415-N418 VanDerWaalsContact O-N 3.12Å; L416-N418 VanDerWaalsContact C-N 3.29Å; L416-N418 PolarHBondContact O-N 3.42Å
419	K	91.8	Very high	76.2	Confident	83 Å²	83	63.3 Å²	63.3	36%	0.361	31%	0.313	S	S	.	.			trans	-120.7	146.1	-173.6	-49.7	-166.8	-177.5	175.1	0	111.2	L182 N183 P239 L417	L182-K419 WeakPolarHBondContact O-CE 3.34Å; L182-K419 PolarHBondContact O-NZ 3.46Å; N183-K419 WeakPolarHBondContact OD1-CG 3.29Å; P239-K419 WeakPolarHBondContact CD-O 3.18Å; L417-K419 VanDerWaalsContact O-CG 3.22Å; L417-K419 WeakPolarHBondContact O-CG 3.48Å; L417-K419 PolarHBondContact O-N 3.27Å
420	P	92.1	Very high	73.8	Confident	14 Å²	14	66.9 Å²	66.9	9%	0.091	34%	0.338	C	S	.	.	P	Polyproline II helix	trans	-51.9	148.5	161.5	-24.8	36.1	0	0	0	111.1	I234 Q236 Q237 E422	I234-P420 HydrophobicContact CD1-CG 3.86Å; Q236-P420 HydrophobicContact CB-CB 3.7Å; Q236-P420 HydrophobicContact CB-CG 3.81Å; Q237-P420 WeakPolarHBondContact O-CB 3.36Å; P420-E422 PolarHBondContact O-N 3.49Å
421	K	82.8	Confident	71.3	Confident	144 Å²	144	71 Å²	71	63%	0.626	36%	0.356	S	S	*	.	P	Polyproline II helix	trans	-66.6	123.2	170.1	-82.8	171.9	179.1	175.8	0	108.1	P239 D423	P239-K421 HydrophobicContact CB-CD 4.14Å; P239-K421 HydrophobicContact CB-CG 4.07Å; K421-D423 PolarHBondContact O-N 3.22Å
422	E	70.3	Confident	68.9	Low	139 Å²	139	75.6 Å²	75.6	65%	0.65	38%	0.378	S	S	*	.	P	Polyproline II helix	trans	-65	124.2	169.7	-69.4	178.5	-175.5	0	0	108.9	P420 R424	P420-E422 PolarHBondContact O-N 3.49Å; E422-R424 PolarHBondContact O-N 3.25Å; E422-R424 VanDerWaalsContact O-N 3.12Å
423	D	54.8	Low	66.5	Low	93 Å²	93	83 Å²	83	50%	0.497	41%	0.41	S	S	.	.			trans	-63.7	112.6	173	-87	-24.2	0	0	0	108.7	K421 T425 Q426	K421-D423 PolarHBondContact O-N 3.22Å; D423-T425 PolarHBondContact O-N 2.63Å; D423-Q426 HydrophobicContact CB-CG 4.1Å; D423-Q426 PolarHBondContact O-N 2.91Å
424	R	46.8	Very low	64.1	Low	216 Å²	216	86.3 Å²	86.3	82%	0.815	44%	0.438	S	S	*	.	H	α-helix	trans	-52	-23.9	174.5	-88.4	-177.3	169.6	-177.2	-3.9	113.2	E422 L427 L428	E422-R424 PolarHBondContact O-N 3.25Å; E422-R424 VanDerWaalsContact O-N 3.12Å; R424-L427 PolarHBondContact O-N 2.86Å; R424-L428 PolarHBondContact O-N 3.02Å
425	T	44.7	Very low	62	Low	105 Å²	105	90.4 Å²	90.4	64%	0.644	46%	0.458	S	S	*	.	H	α-helix	trans	-69.7	-29.2	175.3	30.4	0	0	0	0	113.8	D423 G429	D423-T425 PolarHBondContact O-N 2.63Å; T425-G429 PolarHBondContact O-N 2.8Å
426	Q	43.7	Very low	59.8	Low	111 Å²	111	96.7 Å²	96.7	52%	0.519	49%	0.493	S	S	.	.	H	α-helix	trans	-75.8	-29.7	175.3	-65.1	-176.1	9.4	0	0	111.9	D423 S430	D423-Q426 HydrophobicContact CB-CG 4.1Å; D423-Q426 PolarHBondContact O-N 2.91Å; Q426-S430 WeakPolarHBondContact O-CB 3.34Å; Q426-S430 PolarHBondContact O-N 2.88Å; Q426-S430 VanDerWaalsContact O-N 3.1Å; Q426-S430 PolarHBondContact O-OG 2.78Å
427	L	43.1	Very low	57.7	Low	85 Å²	85	104.1 Å²	104.1	45%	0.445	53%	0.532	S	S	.	.	H	α-helix	trans	-68.3	-40	174.7	-80.9	155.8	0	0	0	112.4	R424 S430 Q431	R424-L427 PolarHBondContact O-N 2.86Å; L427-S430 PolarHBondContact O-N 3.23Å; L427-Q431 WeakPolarHBondContact O-CG 2.88Å; L427-Q431 PolarHBondContact O-N 2.65Å
428	L	42.9	Very low	55	Low	106 Å²	106	105.6 Å²	105.6	56%	0.555	55%	0.553	S	S	*	*	H	α-helix	trans	-66.8	-43.9	176.6	-78.8	157.7	0	0	0	112.2	R424 S430 Q431 E432	R424-L428 PolarHBondContact O-N 3.02Å; L428-S430 VanDerWaalsContact C-N 3.29Å; L428-S430 PolarHBondContact O-N 3.04Å; L428-Q431 PolarHBondContact O-N 3.11Å; L428-E432 PolarHBondContact O-N 3.25Å
429	G	38	Very low	52.6	Low	32 Å²	32	114.1 Å²	114.1	33%	0.33	61%	0.61	S	S	.	*	H	α-helix	trans	-70.1	-23.2	176.9	0	0	0	0	0	114.4	T425 K433	T425-G429 PolarHBondContact O-N 2.8Å; G429-K433 PolarHBondContact O-N 2.77Å
430	S	44.2	Very low	50.6	Low	77 Å²	77	115.7 Å²	115.7	54%	0.538	62%	0.623	S	S	.	*	H	α-helix	trans	-81	-32.1	174	-54.5	0	0	0	0	111.9	Q426 L427 L428 A434	Q426-S430 WeakPolarHBondContact O-CB 3.34Å; Q426-S430 PolarHBondContact O-N 2.88Å; Q426-S430 VanDerWaalsContact O-N 3.1Å; Q426-S430 PolarHBondContact O-OG 2.78Å; L427-S430 PolarHBondContact O-N 3.23Å; L428-S430 VanDerWaalsContact C-N 3.29Å; L428-S430 PolarHBondContact O-N 3.04Å; S430-A434 WeakPolarHBondContact O-CB 3.5Å; S430-A434 PolarHBondContact O-N 3.01Å
431	Q	42.8	Very low	48.5	Very low	124 Å²	124	121 Å²	121	58%	0.579	65%	0.651	S	S	*	*	H	α-helix	trans	-73.2	-37.7	172.8	-77.6	-175.6	-8.6	0	0	112.3	L427 L428 A434 L435	L427-Q431 WeakPolarHBondContact O-CG 2.88Å; L427-Q431 PolarHBondContact O-N 2.65Å; L428-Q431 PolarHBondContact O-N 3.11Å; Q431-A434 PolarHBondContact O-N 2.84Å; Q431-L435 WeakPolarHBondContact O-CG 3.38Å; Q431-L435 PolarHBondContact O-N 3.02Å; Q431-L435 VanDerWaalsContact O-N 3.08Å
432	E	44	Very low	46.6	Very low	131 Å²	131	119.7 Å²	119.7	61%	0.612	65%	0.652	S	S	*	*	H	α-helix	trans	-65.3	-41.4	173.9	-77	177.9	165.1	0	0	111.9	L428 A434 L435 D436	L428-E432 PolarHBondContact O-N 3.25Å; E432-A434 VanDerWaalsContact C-N 3.28Å; E432-A434 PolarHBondContact O-N 3.19Å; E432-L435 PolarHBondContact O-N 3.36Å; E432-D436 PolarHBondContact O-N 2.99Å; E432-D436 VanDerWaalsContact O-N 3.1Å
433	K	46.3	Very low	45.2	Very low	156 Å²	156	118.6 Å²	118.6	68%	0.678	65%	0.652	S	S	*	*	H	α-helix	trans	-67.6	-24.4	174.3	-80.8	-176.8	176	-178.8	0	114.5	G429	G429-K433 PolarHBondContact O-N 2.77Å
434	A	45.2	Very low	44.6	Very low	71 Å²	71	120.2 Å²	120.2	59%	0.587	66%	0.662	S	S	*	*	H	α-helix	trans	-81.3	-23.2	174.4	0	0	0	0	0	112.4	S430 Q431 E432	S430-A434 WeakPolarHBondContact O-CB 3.5Å; S430-A434 PolarHBondContact O-N 3.01Å; Q431-A434 PolarHBondContact O-N 2.84Å; E432-A434 VanDerWaalsContact C-N 3.28Å; E432-A434 PolarHBondContact O-N 3.19Å
435	L	49.7	Very low	44.4	Very low	141 Å²	141	113.8 Å²	113.8	74%	0.738	65%	0.652	S	S	*	*	H	α-helix	trans	-84.2	-24.7	175.4	-75.9	161.1	0	0	0	112.8	Q431 E432 L437	Q431-L435 WeakPolarHBondContact O-CG 3.38Å; Q431-L435 PolarHBondContact O-N 3.02Å; Q431-L435 VanDerWaalsContact O-N 3.08Å; E432-L435 PolarHBondContact O-N 3.36Å; L435-L437 VanDerWaalsContact C-N 3.29Å; L435-L437 PolarHBondContact O-N 2.89Å
436	D	49.5	Very low	44.4	Very low	144 Å²	144	114.4 Å²	114.4	77%	0.77	65%	0.652	S	S	*	*	S	Bend	trans	-82.1	-1.9	174.4	-83.8	-15.8	0	0	0	114	E432	E432-D436 PolarHBondContact O-N 2.99Å; E432-D436 VanDerWaalsContact O-N 3.1Å
437	L	51.8	Low	44.4	Very low	156 Å²	156	114.7 Å²	114.7	82%	0.817	66%	0.662	S	S	*	*	S	Bend	trans	-118.4	65.9	178.1	-76.3	171	0	0	0	111.7	L435	L435-L437 VanDerWaalsContact C-N 3.29Å; L435-L437 PolarHBondContact O-N 2.89Å
438	G	37.8	Very low	44.5	Very low	58 Å²	58	117.2 Å²	117.2	60%	0.598	68%	0.681	S	S	*	*			trans	144.9	160.5	141.6	0	0	0	0	0	115.7
439	P	42.4	Very low	44.7	Very low	210 Å²	210	118.2 Å²	118.2	100%	1.364	69%	0.692	S	S	*	*			cis	-89.2	0	-21.9	12	7.1	0	0	0	113.9

Retrieved 439 of 439 residues in 80.2 ms (Link to these results)

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