A0A096NRY2_PAPAN Loading...

Activin receptor type-1B

AlphaFold DB (A0A2K5MZP9), UniProt , Accession A0A096NRY2, Species PAPAN (Papio anubis, Olive baboon), Gene ACVR1B, Length 505 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	35.7	Very low	27.9	Very low	242 Å²	242	151 Å²	151	100%	1.192	83%	0.831	S	S	*	*				0	125.2	0	-79.4	172.6	-169.2	0	0	107.3
2	A	30	Very low	28	Very low	92 Å²	92	147.8 Å²	147.8	76%	0.76	82%	0.823	S	S	*	*			trans	35.8	141.8	153.3	0	0	0	0	0	120.1
3	E	27.8	Very low	27.9	Very low	182 Å²	182	148.8 Å²	148.8	85%	0.85	83%	0.825	S	S	*	*			cis	-172	137.7	-5.4	-119.9	175.9	141.7	0	0	106.4
4	S	26.9	Very low	27.9	Very low	112 Å²	112	147.8 Å²	147.8	78%	0.783	82%	0.824	S	S	*	*			trans	45.6	123.5	130.6	-160.1	0	0	0	0	121.9
5	A	29.1	Very low	28	Very low	82 Å²	82	145.5 Å²	145.5	68%	0.678	82%	0.815	S	S	*	*				172.7	128.7	95.8	0	0	0	0	0	113.7
6	R	27.8	Very low	27.9	Very low	246 Å²	246	146.3 Å²	146.3	93%	0.928	82%	0.816	S	S	*	*			trans	51.6	145.3	139.8	-76.1	-177.1	-177.1	172.9	1.9	120
7	A	26	Very low	27.7	Very low	81 Å²	81	146.4 Å²	146.4	67%	0.669	81%	0.813	S	S	*	*			cis	-173.5	177.3	1.4	0	0	0	0	0	108.1
8	S	25.9	Very low	27.6	Very low	117 Å²	117	147.1 Å²	147.1	82%	0.818	81%	0.814	S	S	*	*			trans	85.7	139.3	165.8	80.2	0	0	0	0	116
9	S	25.9	Very low	27.5	Very low	93 Å²	93	144.6 Å²	144.6	65%	0.65	82%	0.815	S	S	*	*			cis	-179.8	108	-16.9	42.7	0	0	0	0	104.5
10	F	25.9	Very low	27.4	Very low	203 Å²	203	140.8 Å²	140.8	89%	0.89	81%	0.809	S	S	*	*			trans	-158.7	112.9	169.4	-90.7	-77.5	0	0	0	109.3
11	F	25.7	Very low	27.3	Very low	211 Å²	211	140.3 Å²	140.3	93%	0.925	81%	0.814	S	S	*	*			trans	-147.1	145.2	145.6	-103.4	-82.3	0	0	0	109.3
12	P	29.7	Very low	26.8	Very low	112 Å²	112	132.6 Å²	132.6	73%	0.727	80%	0.797	S	S	*	*			trans	-94.2	168.6	-170.2	31.5	-17.5	0	0	0	113
13	L	26.9	Very low	26.6	Very low	162 Å²	162	131.8 Å²	131.8	85%	0.848	80%	0.798	S	S	*	*			trans	-52.5	125.9	172.1	-141.4	93.1	0	0	0	112.9
14	V	27.9	Very low	26.7	Very low	134 Å²	134	128.9 Å²	128.9	81%	0.812	80%	0.797	S	S	*	*			trans	-146.6	125.5	148.8	178.8	0	0	0	0	109.2
15	V	28.9	Very low	27.2	Very low	114 Å²	114	127.3 Å²	127.3	69%	0.691	80%	0.799	S	S	*	*			trans	-82.6	135.8	171.2	169	0	0	0	0	109.2
16	L	25.8	Very low	27.7	Very low	158 Å²	158	128.7 Å²	128.7	83%	0.827	80%	0.801	S	S	*	*			trans	-161.2	134.3	146.3	-114.1	134.9	0	0	0	113.1
17	L	25.4	Very low	28.1	Very low	147 Å²	147	128 Å²	128	77%	0.77	80%	0.798	S	S	*	*			trans	-63.4	158.5	174.4	-72.8	129.5	0	0	0	113
18	L	26.1	Very low	28.9	Very low	160 Å²	160	128.1 Å²	128.1	84%	0.838	81%	0.807	S	S	*	*			trans	156.2	109.3	135.9	-81.1	165.3	0	0	0	107.8
19	A	25.3	Very low	30.2	Very low	100 Å²	100	128.6 Å²	128.6	83%	0.826	80%	0.799	S	S	*	*				75.6	125.4	88.7	0	0	0	0	0	114.2
20	G	24.9	Very low	31.9	Very low	67 Å²	67	133.2 Å²	133.2	69%	0.691	81%	0.811	S	S	*	*			trans	131.9	84.8	168.6	0	0	0	0	0	112.4
21	S	24.8	Very low	34.3	Very low	131 Å²	131	125 Å²	125	92%	0.916	78%	0.781	S	S	*	*				75.6	122	87.3	63.9	0	0	0	0	114.1
22	G	25.4	Very low	37.3	Very low	81 Å²	81	115.9 Å²	115.9	84%	0.835	74%	0.741	S	S	*	*			trans	129.7	86.9	147	0	0	0	0	0	116.8
23	G	27.1	Very low	40.2	Very low	75 Å²	75	113.3 Å²	113.3	77%	0.773	72%	0.721	S	S	*	*				77.7	104.1	128.5	0	0	0	0	0	119
24	S	28.5	Very low	43.3	Very low	121 Å²	121	105.6 Å²	105.6	85%	0.846	68%	0.68	S	S	*	*				178.3	113.2	117	36.7	0	0	0	0	108.2
25	G	39.2	Very low	46.3	Very low	79 Å²	79	99.9 Å²	99.9	81%	0.814	65%	0.647	S	S	*	*			trans	-67.9	166	-178.5	0	0	0	0	0	112.8
26	P	37.9	Very low	49.1	Very low	110 Å²	110	94.8 Å²	94.8	71%	0.714	62%	0.617	S	S	*	*			trans	-131.1	133.8	147.8	32.3	-17.2	0	0	0	112.3
27	R	37.7	Very low	52	Low	232 Å²	232	90 Å²	90	88%	0.875	59%	0.594	S	S	*	*			trans	62	106.9	143	-60.7	176.9	-173.1	-175.9	1.2	115.9	I29	R27-I29 PolarHBondContact O-N 3.3Å
28	G	42.5	Very low	54.6	Low	84 Å²	84	88 Å²	88	87%	0.866	59%	0.592	S	S	*	*			trans	-47.3	111.8	168.7	0	0	0	0	0	111	Q30	G28-Q30 PolarHBondContact O-N 2.92Å
29	I	53	Low	57.3	Low	126 Å²	126	82 Å²	82	65%	0.646	56%	0.563	S	S	*	*			trans	-72.3	109.3	161.5	-62	169.7	0	0	0	103.6	R27 A31 D49	R27-I29 PolarHBondContact O-N 3.3Å; I29-A31 PolarHBondContact O-N 3.14Å; I29-D49 HydrophobicContact CG2-CB 4.04Å
30	Q	61.6	Low	59.6	Low	191 Å²	191	83.2 Å²	83.2	89%	0.893	56%	0.556	S	S	*	*			trans	-60.7	111.3	174.1	-156.8	169.8	6.3	0	0	106.4	G28	G28-Q30 PolarHBondContact O-N 2.92Å
31	A	76.8	Confident	61.7	Low	31 Å²	31	89.7 Å²	89.7	26%	0.256	57%	0.568	S	S	.	*	P	Polyproline II helix	trans	-81.5	135.9	-170.2	0	0	0	0	0	110.3	I29 E47	I29-A31 PolarHBondContact O-N 3.14Å; A31-E47 HydrophobicContact CB-CG 3.24Å; A31-E47 WeakPolarHBondContact CB-OE1 3.03Å
32	L	88.5	Confident	64.1	Low	19 Å²	19	85.9 Å²	85.9	10%	0.099	54%	0.544	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.8	124.9	-175.6	-175	72.3	0	0	0	109.7	E47 T48 C52	L32-E47 CarbonylContact O-C 3.59Å; L32-E47 VanDerWaalsContact O-CA 3.31Å; L32-E47 WeakPolarHBondContact O-CA 3.47Å; L32-T48 HydrophobicContact CB-CG2 4.22Å; L32-T48 WeakPolarHBondContact CB-O 3.18Å; L32-T48 HydrophobicContact CD2-CG2 4.23Å; L32-T48 PolarHBondContact N-O 2.95Å; L32-T48 PolarHBondContact O-N 2.92Å; L32-C52 VanDerWaalsContact CD2-SG 3.54Å
33	L	90.1	Very high	66.8	Low	57 Å²	57	88.6 Å²	88.6	30%	0.298	54%	0.539	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.9	128.9	176.8	-73.4	158.4	0	0	0	110.5	D99 Y100	L33-D99 HydrophobicContact CB-CB 4.48Å; L33-D99 PolarHBondContact N-OD1 3.24Å; L33-D99 CarbonylContact O-C 3.56Å; L33-D99 WeakPolarHBondContact O-CA 2.97Å; L33-Y100 HydrophobicContact CB-CD2 4.48Å; L33-Y100 HydrophobicContact CB-CE1 4.44Å; L33-Y100 HydrophobicContact CB-CE2 3.88Å; L33-Y100 HydrophobicContact CD1-CE2 4.31Å; L33-Y100 PolarHBondContact O-N 2.7Å
34	C	91.9	Very high	69.6	Low	0 Å²	0	91 Å²	91	0%	0	53%	0.526	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	157	178.7	-46.8	0	0	0	0	112	T45 C46 C52 C69	C34-T45 VanDerWaalsContact O-CA 3.3Å; C34-T45 WeakPolarHBondContact O-CA 3.42Å; C34-C46 PolarHBondContact N-O 3.1Å; C34-C46 PolarHBondContact O-N 2.79Å; C34-C52 HydrophobicContact CB-CB 3.64Å; C34-C52 WeakPolarHBondContact CB-SG 3.43Å; C34-C52 WeakPolarHBondContact SG-CA 3.48Å; C34-C52 WeakPolarHBondContact SG-CB 3.41Å; C34-C52 CovalentContact SG-SG 2.02Å; C34-C52 PolarHBondContact SG-SG 2.89Å; C34-C69 WeakPolarHBondContact CB-SG 3.24Å; C34-C69 PolarHBondContact SG-SG 2.8Å
35	A	90.1	Very high	72.5	Confident	14 Å²	14	87.3 Å²	87.3	12%	0.116	50%	0.498	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.3	141.6	165.8	0	0	0	0	0	110.3	R67 N102	A35-R67 CarbonylContact O-C 3.57Å; A35-R67 WeakPolarHBondContact O-CB 3.47Å; A35-N102 WeakPolarHBondContact CB-OD1 3.43Å; A35-N102 PolarHBondContact N-OD1 3.11Å; A35-N102 PolarHBondContact O-ND2 3.4Å
36	C	88.4	Confident	74.9	Confident	7 Å²	7	84.6 Å²	84.6	5%	0.047	47%	0.467	C	S	.	.			trans	-134.4	125.2	-178.8	176.9	0	0	0	0	111.5	C39 Y44 C46 R67	C36-C39 HydrophobicContact CB-CB 3.53Å; C36-C39 WeakPolarHBondContact CB-SG 3.49Å; C36-C39 WeakPolarHBondContact SG-CB 3.44Å; C36-C39 PolarHBondContact SG-N 3.22Å; C36-C39 CovalentContact SG-SG 2.03Å; C36-C39 PolarHBondContact SG-SG 3.09Å; C36-Y44 PolarHBondContact N-O 2.79Å; C36-Y44 CarbonylContact O-C 3.59Å; C36-Y44 WeakPolarHBondContact O-CA 3.23Å; C36-Y44 WeakPolarHBondContact O-CB 3.3Å; C36-C46 HydrophobicContact CB-CB 4.16Å; C36-R67 VanDerWaalsContact CA-O 3.32Å; C36-R67 WeakPolarHBondContact CA-O 3.48Å
37	T	86.2	Confident	77.4	Confident	59 Å²	59	85.9 Å²	85.9	36%	0.362	46%	0.463	S	S	.	.	S	Bend	trans	-70.4	-34.8	-177.4	-51.2	0	0	0	0	112.6	H65 R67	T37-H65 PolarHBondContact OG1-O 3.32Å; T37-R67 PolarHBondContact N-O 3.42Å; T37-R67 PolarHBondContact OG1-N 2.92Å
38	S	80.5	Confident	79.8	Confident	103 Å²	103	75.4 Å²	75.4	72%	0.72	43%	0.425	S	S	*	.	S	Bend	trans	-109.4	7.7	-171.8	-53.3	0	0	0	0	114.4	L40	S38-L40 PolarHBondContact O-N 3.05Å; S38-L40 VanDerWaalsContact O-N 3.17Å
39	C	82.4	Confident	82	Confident	35 Å²	35	75.1 Å²	75.1	24%	0.236	40%	0.404	C	S	.	.			trans	-90.5	62.7	-176.5	-59.2	0	0	0	0	112.2	C36 Q41 A42 Y44	C36-C39 HydrophobicContact CB-CB 3.53Å; C36-C39 WeakPolarHBondContact CB-SG 3.49Å; C36-C39 WeakPolarHBondContact SG-CB 3.44Å; C36-C39 PolarHBondContact SG-N 3.22Å; C36-C39 CovalentContact SG-SG 2.03Å; C36-C39 PolarHBondContact SG-SG 3.09Å; C39-Q41 VanDerWaalsContact C-N 3.27Å; C39-Q41 PolarHBondContact O-N 3.12Å; C39-A42 HydrophobicContact CB-CB 4.49Å; C39-A42 CarbonylContact O-C 3.57Å; C39-A42 PolarHBondContact O-N 3.19Å; C39-A42 VanDerWaalsContact O-N 3.16Å; C39-Y44 PolarHBondContact O-N 3.28Å
40	L	73.2	Confident	83.7	Confident	126 Å²	126	69.6 Å²	69.6	66%	0.66	38%	0.378	S	S	*	.	G	3₁₀ helix	trans	-59	-35.4	-176.9	-73.7	161.9	0	0	0	113.5	S38 A42 Y44	S38-L40 PolarHBondContact O-N 3.05Å; S38-L40 VanDerWaalsContact O-N 3.17Å; L40-A42 VanDerWaalsContact C-N 3.26Å; L40-A42 PolarHBondContact O-N 3.3Å; L40-Y44 HydrophobicContact CD2-CE1 3.9Å; L40-Y44 VanDerWaalsContact CD2-OH 3.25Å; L40-Y44 WeakPolarHBondContact CD2-OH 2.97Å
41	Q	69.9	Low	85.1	Confident	203 Å²	203	60.5 Å²	60.5	95%	0.949	34%	0.335	S	S	*	.	G	3₁₀ helix	trans	-75.5	-14.5	-178.1	-68.6	175.7	-24.1	0	0	113.5	C39	C39-Q41 VanDerWaalsContact C-N 3.27Å; C39-Q41 PolarHBondContact O-N 3.12Å
42	A	74.6	Confident	85.8	Confident	50 Å²	50	59 Å²	59	41%	0.413	32%	0.323	S	S	.	.	G	3₁₀ helix	trans	-122.7	34.9	-176.7	0	0	0	0	0	111.7	C39 L40 Y44 T45	C39-A42 HydrophobicContact CB-CB 4.49Å; C39-A42 CarbonylContact O-C 3.57Å; C39-A42 PolarHBondContact O-N 3.19Å; C39-A42 VanDerWaalsContact O-N 3.16Å; L40-A42 VanDerWaalsContact C-N 3.26Å; L40-A42 PolarHBondContact O-N 3.3Å; A42-Y44 VanDerWaalsContact C-N 3.27Å; A42-Y44 PolarHBondContact O-N 3.41Å; A42-Y44 VanDerWaalsContact O-N 3.15Å; A42-T45 VanDerWaalsContact CB-O 3.31Å; A42-T45 WeakPolarHBondContact CB-O 3.15Å; A42-T45 PolarHBondContact O-N 3.49Å; A42-T45 PolarHBondContact O-OG1 2.99Å
43	N	82.4	Confident	86	Confident	138 Å²	138	59.1 Å²	59.1	74%	0.738	32%	0.323	S	S	*	.	T	Hydrogen-bonded Turn	trans	49.9	42.3	177	-158.3	18.8	0	0	0	113.9	T45	N43-T45 PolarHBondContact O-N 3.49Å
44	Y	86.4	Confident	86.1	Confident	126 Å²	126	56.4 Å²	56.4	49%	0.494	31%	0.309	S	S	.	.	T	Hydrogen-bonded Turn	trans	59.5	29.6	-177.7	-56.1	-83.4	0	0	0	114.4	C36 C39 L40 A42	C36-Y44 PolarHBondContact N-O 2.79Å; C36-Y44 CarbonylContact O-C 3.59Å; C36-Y44 WeakPolarHBondContact O-CA 3.23Å; C36-Y44 WeakPolarHBondContact O-CB 3.3Å; C39-Y44 PolarHBondContact O-N 3.28Å; L40-Y44 HydrophobicContact CD2-CE1 3.9Å; L40-Y44 VanDerWaalsContact CD2-OH 3.25Å; L40-Y44 WeakPolarHBondContact CD2-OH 2.97Å; A42-Y44 VanDerWaalsContact C-N 3.27Å; A42-Y44 PolarHBondContact O-N 3.41Å; A42-Y44 VanDerWaalsContact O-N 3.15Å
45	T	88.8	Confident	85.9	Confident	43 Å²	43	56.7 Å²	56.7	26%	0.264	31%	0.311	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	153.6	176.1	63.6	0	0	0	0	111	C34 A42 N43 Y100	C34-T45 VanDerWaalsContact O-CA 3.3Å; C34-T45 WeakPolarHBondContact O-CA 3.42Å; A42-T45 VanDerWaalsContact CB-O 3.31Å; A42-T45 WeakPolarHBondContact CB-O 3.15Å; A42-T45 PolarHBondContact O-N 3.49Å; A42-T45 PolarHBondContact O-OG1 2.99Å; N43-T45 PolarHBondContact O-N 3.49Å; T45-Y100 HydrophobicContact CG2-CE1 3.86Å
46	C	89.3	Confident	85.7	Confident	23 Å²	23	56 Å²	56	16%	0.155	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.4	160.6	174.6	60.2	0	0	0	0	110.2	C34 C36 C69	C34-C46 PolarHBondContact N-O 3.1Å; C34-C46 PolarHBondContact O-N 2.79Å; C36-C46 HydrophobicContact CB-CB 4.16Å; C46-C69 HydrophobicContact CB-CB 3.94Å; C46-C69 WeakPolarHBondContact CB-SG 3.35Å; C46-C69 PolarHBondContact O-SG 3.3Å; C46-C69 WeakPolarHBondContact SG-CB 2.87Å; C46-C69 PolarHBondContact SG-N 3.32Å; C46-C69 CovalentContact SG-SG 2.03Å; C46-C69 PolarHBondContact SG-SG 2.86Å
47	E	90.7	Very high	85.5	Confident	137 Å²	137	58.2 Å²	58.2	64%	0.64	31%	0.314	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-122.8	136	-175.6	-178.2	178.8	153.5	0	0	110	A31 L32	A31-E47 HydrophobicContact CB-CG 3.24Å; A31-E47 WeakPolarHBondContact CB-OE1 3.03Å; L32-E47 CarbonylContact O-C 3.59Å; L32-E47 VanDerWaalsContact O-CA 3.31Å; L32-E47 WeakPolarHBondContact O-CA 3.47Å
48	T	88.3	Confident	84.9	Confident	11 Å²	11	58.5 Å²	58.5	7%	0.067	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.9	158.2	-178.3	-170.4	0	0	0	0	114	L32 G50 C69 I70 P71	L32-T48 HydrophobicContact CB-CG2 4.22Å; L32-T48 WeakPolarHBondContact CB-O 3.18Å; L32-T48 HydrophobicContact CD2-CG2 4.23Å; L32-T48 PolarHBondContact N-O 2.95Å; L32-T48 PolarHBondContact O-N 2.92Å; T48-G50 PolarHBondContact OG1-N 3.26Å; T48-C69 HydrophobicContact CG2-CB 3.82Å; T48-I70 PolarHBondContact OG1-O 3.47Å; T48-I70 VanDerWaalsContact OG1-O 3.08Å; T48-P71 WeakPolarHBondContact OG1-CA 3.45Å
49	D	88.4	Confident	84.3	Confident	79 Å²	79	58.2 Å²	58.2	42%	0.422	30%	0.303	S	S	.	.	S	Bend	trans	-94	-0.6	170.9	70.7	-26.1	0	0	0	113.2	I29 K72	I29-D49 HydrophobicContact CG2-CB 4.04Å; D49-K72 PolarHBondContact OD1-N 2.77Å
50	G	90.2	Very high	83.4	Confident	10 Å²	10	64.5 Å²	64.5	10%	0.103	34%	0.335	C	S	.	.	S	Bend	trans	-105.9	-106.7	-177.5	0	0	0	0	0	113.2	T48 I70 Y97	T48-G50 PolarHBondContact OG1-N 3.26Å; G50-I70 CarbonylContact C-O 3.54Å; G50-I70 VanDerWaalsContact CA-O 3.26Å; G50-I70 WeakPolarHBondContact CA-O 3.12Å; G50-Y97 WeakPolarHBondContact O-CD1 3.41Å
51	A	89.9	Confident	83	Confident	0 Å²	0	61.5 Å²	61.5	0%	0	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.5	150.1	-173.1	0	0	0	0	0	112.8	I70 L75 C95 Y97	A51-I70 PolarHBondContact N-O 3.27Å; A51-I70 PolarHBondContact O-N 3.35Å; A51-L75 HydrophobicContact CB-CD1 4.05Å; A51-L75 HydrophobicContact CB-CD2 4.26Å; A51-C95 HydrophobicContact CB-CB 4.46Å; A51-Y97 HydrophobicContact CB-CD1 3.89Å; A51-Y97 HydrophobicContact CB-CE1 3.5Å
52	C	92.1	Very high	82.9	Confident	0 Å²	0	57.6 Å²	57.6	0%	0	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.5	135.6	165.4	-55.2	0	0	0	0	110	L32 C34 C95 C96 N102	L32-C52 VanDerWaalsContact CD2-SG 3.54Å; C34-C52 HydrophobicContact CB-CB 3.64Å; C34-C52 WeakPolarHBondContact CB-SG 3.43Å; C34-C52 WeakPolarHBondContact SG-CA 3.48Å; C34-C52 WeakPolarHBondContact SG-CB 3.41Å; C34-C52 CovalentContact SG-SG 2.02Å; C34-C52 PolarHBondContact SG-SG 2.89Å; C52-C95 CarbonylContact O-C 3.53Å; C52-C95 VanDerWaalsContact O-CA 3.25Å; C52-C95 WeakPolarHBondContact O-CA 3.36Å; C52-C96 PolarHBondContact N-O 3.1Å; C52-C96 PolarHBondContact O-N 3.34Å; C52-N102 HydrophobicContact CB-CB 3.75Å
53	M	92.2	Very high	82.9	Confident	21 Å²	21	60.9 Å²	60.9	10%	0.103	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	140.6	177.8	-173.5	-166.2	83.3	0	0	110.7	V66 R67 T68 I70 T93 N102	M53-V66 HydrophobicContact CE-CG1 4.48Å; M53-R67 WeakPolarHBondContact O-CA 3.36Å; M53-T68 HydrophobicContact CB-CG2 4.24Å; M53-T68 HydrophobicContact CE-CG2 3.59Å; M53-T68 PolarHBondContact N-O 3.31Å; M53-T68 PolarHBondContact O-N 2.81Å; M53-T68 VanDerWaalsContact O-N 3.08Å; M53-T68 HydrophobicContact SD-CG2 4.36Å; M53-I70 HydrophobicContact CB-CG1 4.03Å; M53-I70 HydrophobicContact SD-CD1 4.28Å; M53-T93 HydrophobicContact CG-CG2 3.77Å; M53-T93 HydrophobicContact SD-CG2 4.09Å; M53-N102 PolarHBondContact O-ND2 3.33Å
54	V	91.3	Very high	82.8	Confident	0 Å²	0	57.9 Å²	57.9	0%	0	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.9	133.9	163.1	53.2	0	0	0	0	108.9	V66 R67 T93 H94 N102 I104 L106	V54-V66 CarbonylContact C-O 3.57Å; V54-V66 WeakPolarHBondContact CA-O 3.23Å; V54-R67 HydrophobicContact CB-CG 4.22Å; V54-R67 HydrophobicContact CG2-CG 4Å; V54-T93 CarbonylContact O-C 3.59Å; V54-T93 WeakPolarHBondContact O-CA 3.17Å; V54-H94 HydrophobicContact CG1-CB 4.08Å; V54-H94 PolarHBondContact N-O 3.13Å; V54-H94 PolarHBondContact O-N 3.49Å; V54-N102 HydrophobicContact CB-CB 4.03Å; V54-N102 HydrophobicContact CG1-CB 4.21Å; V54-I104 HydrophobicContact CG1-CD1 4Å; V54-I104 HydrophobicContact CG1-CG1 3.75Å; V54-L106 HydrophobicContact CG1-CD1 3.99Å; V54-L106 HydrophobicContact CG1-CG 4.29Å; V54-L106 HydrophobicContact CG2-CD1 4.15Å; V54-L106 HydrophobicContact CG2-CG 4.31Å
55	S	88.9	Confident	82.7	Confident	5 Å²	5	54.8 Å²	54.8	4%	0.035	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.4	139.8	178.8	-169.8	0	0	0	0	110.5	V66 R91 N92 T93	S55-V66 PolarHBondContact N-O 3.47Å; S55-V66 PolarHBondContact O-N 2.9Å; S55-R91 WeakPolarHBondContact OG-CD 3.45Å; S55-R91 VanDerWaalsContact OG-CG 3.31Å; S55-R91 WeakPolarHBondContact OG-CG 3.27Å; S55-N92 CarbonylContact C-O 3.53Å; S55-N92 WeakPolarHBondContact CA-O 3.28Å; S55-T93 WeakPolarHBondContact CB-OG1 3.15Å; S55-T93 PolarHBondContact OG-OG1 3Å
56	I	86.5	Confident	82.6	Confident	1 Å²	1	55.1 Å²	55.1	1%	0.005	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	131.8	169.6	-168.7	178.9	0	0	0	109.1	H64 H65 R91 N92 L106 V108	I56-H64 WeakPolarHBondContact CA-O 3.4Å; I56-H65 WeakPolarHBondContact CD1-CE1 3.43Å; I56-H65 VanDerWaalsContact CD1-NE2 3.28Å; I56-H65 WeakPolarHBondContact CD1-NE2 3.2Å; I56-R91 WeakPolarHBondContact O-CA 3.31Å; I56-N92 HydrophobicContact CG2-CB 3.78Å; I56-N92 PolarHBondContact N-O 2.83Å; I56-N92 PolarHBondContact O-N 3.37Å; I56-L106 HydrophobicContact CB-CB 4.38Å; I56-L106 WeakPolarHBondContact CD1-O 3.28Å; I56-L106 HydrophobicContact CG2-CB 3.63Å; I56-L106 HydrophobicContact CG2-CD1 4.44Å; I56-V108 HydrophobicContact CD1-CB 4.35Å; I56-V108 HydrophobicContact CD1-CG2 3.3Å; I56-V108 HydrophobicContact CG1-CG2 3.94Å
57	F	82.8	Confident	82.7	Confident	53 Å²	53	56.1 Å²	56.1	23%	0.232	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.3	155.2	175.5	52.8	-88.3	0	0	0	110.3	L59 H64 V66 L90 R91	F57-L59 HydrophobicContact CD2-CD1 3.85Å; F57-L59 HydrophobicContact CD2-CG 3.98Å; F57-L59 HydrophobicContact CE2-CD1 3.5Å; F57-L59 VanDerWaalsContact CE2-CD1 3.5Å; F57-L59 HydrophobicContact CE2-CG 4.15Å; F57-H64 HydrophobicContact CD2-CB 3.98Å; F57-H64 HydrophobicContact CE1-CB 4.26Å; F57-H64 HydrophobicContact CE2-CB 3.5Å; F57-H64 HydrophobicContact CZ-CB 3.67Å; F57-H64 PolarHBondContact N-O 2.89Å; F57-H64 PolarHBondContact O-N 3.36Å; F57-V66 HydrophobicContact CE1-CB 4.44Å; F57-V66 HydrophobicContact CE1-CG2 3.68Å; F57-V66 HydrophobicContact CZ-CG2 3.96Å; F57-L90 WeakPolarHBondContact CA-O 3.19Å; F57-L90 WeakPolarHBondContact CB-O 3.33Å; F57-R91 HydrophobicContact CB-CB 4.16Å; F57-R91 HydrophobicContact CB-CG 4.06Å
58	N	73.8	Confident	82.7	Confident	64 Å²	64	51.7 Å²	51.7	34%	0.342	28%	0.28	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	120.1	176.7	-164.8	-44	0	0	0	109	G61 M62 V108	N58-G61 WeakPolarHBondContact OD1-CA 3.32Å; N58-G61 PolarHBondContact OD1-N 3.36Å; N58-M62 PolarHBondContact OD1-N 2.84Å; N58-V108 HydrophobicContact CB-CG1 4.42Å
59	L	68.8	Low	82.9	Confident	97 Å²	97	52 Å²	52	51%	0.508	28%	0.283	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119	123.3	169.1	-82.4	165.6	0	0	0	107.1	F57 G61 M62	F57-L59 HydrophobicContact CD2-CD1 3.85Å; F57-L59 HydrophobicContact CD2-CG 3.98Å; F57-L59 HydrophobicContact CE2-CD1 3.5Å; F57-L59 VanDerWaalsContact CE2-CD1 3.5Å; F57-L59 HydrophobicContact CE2-CG 4.15Å; L59-G61 PolarHBondContact O-N 3.49Å; L59-G61 VanDerWaalsContact O-N 3.13Å; L59-M62 PolarHBondContact N-O 2.84Å; L59-M62 PolarHBondContact O-N 2.97Å
60	D	64	Low	82.9	Confident	168 Å²	168	48.6 Å²	48.6	90%	0.898	26%	0.264	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.9	33	175.4	-55.6	-39.3	0	0	0	115.1	M62	D60-M62 VanDerWaalsContact C-N 3.32Å
61	G	64.3	Low	82.8	Confident	62 Å²	62	50.3 Å²	50.3	64%	0.639	27%	0.273	S	S	*	.	T	Hydrogen-bonded Turn	trans	83.8	1.8	179.7	0	0	0	0	0	114.6	N58 L59	N58-G61 WeakPolarHBondContact OD1-CA 3.32Å; N58-G61 PolarHBondContact OD1-N 3.36Å; L59-G61 PolarHBondContact O-N 3.49Å; L59-G61 VanDerWaalsContact O-N 3.13Å
62	M	67.6	Low	82.6	Confident	121 Å²	121	57 Å²	57	60%	0.596	30%	0.303	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-104.9	132	174.7	-65.5	-164.7	-61.8	0	0	111.7	N58 L59 D60 H64	N58-M62 PolarHBondContact OD1-N 2.84Å; L59-M62 PolarHBondContact N-O 2.84Å; L59-M62 PolarHBondContact O-N 2.97Å; D60-M62 VanDerWaalsContact C-N 3.32Å; M62-H64 PolarHBondContact O-CD2 2.92Å
63	E	75	Confident	82.2	Confident	119 Å²	119	62.9 Å²	62.9	56%	0.556	34%	0.338	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-80.9	120.2	177	-56.9	-174.3	167.1	0	0	110.4	V108	E63-V108 HydrophobicContact CB-CG2 4.35Å; E63-V108 HydrophobicContact CG-CG2 3.7Å; E63-V108 WeakPolarHBondContact OE1-CG2 3.21Å
64	H	79.9	Confident	81.7	Confident	75 Å²	75	65.7 Å²	65.7	35%	0.347	35%	0.351	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	122.6	176.9	-72.4	-84.7	0	0	0	110.6	I56 F57 M62	I56-H64 WeakPolarHBondContact CA-O 3.4Å; F57-H64 HydrophobicContact CD2-CB 3.98Å; F57-H64 HydrophobicContact CE1-CB 4.26Å; F57-H64 HydrophobicContact CE2-CB 3.5Å; F57-H64 HydrophobicContact CZ-CB 3.67Å; F57-H64 PolarHBondContact N-O 2.89Å; F57-H64 PolarHBondContact O-N 3.36Å; M62-H64 PolarHBondContact O-CD2 2.92Å
65	H	83.3	Confident	81.3	Confident	61 Å²	61	66.8 Å²	66.8	28%	0.282	36%	0.357	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	117.2	175.3	-72.1	-105.7	0	0	0	111.2	T37 I56	T37-H65 PolarHBondContact OG1-O 3.32Å; I56-H65 WeakPolarHBondContact CD1-CE1 3.43Å; I56-H65 VanDerWaalsContact CD1-NE2 3.28Å; I56-H65 WeakPolarHBondContact CD1-NE2 3.2Å
66	V	87.8	Confident	80.7	Confident	51 Å²	51	70.7 Å²	70.7	31%	0.309	38%	0.38	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	127	-179.5	-177.8	0	0	0	0	110.2	M53 V54 S55 F57	M53-V66 HydrophobicContact CE-CG1 4.48Å; V54-V66 CarbonylContact C-O 3.57Å; V54-V66 WeakPolarHBondContact CA-O 3.23Å; S55-V66 PolarHBondContact N-O 3.47Å; S55-V66 PolarHBondContact O-N 2.9Å; F57-V66 HydrophobicContact CE1-CB 4.44Å; F57-V66 HydrophobicContact CE1-CG2 3.68Å; F57-V66 HydrophobicContact CZ-CG2 3.96Å
67	R	91.3	Very high	80.1	Confident	43 Å²	43	73.5 Å²	73.5	16%	0.162	40%	0.399	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	132.6	175.1	-62.4	178.3	173.6	94.8	-1.8	108.8	A35 C36 T37 M53 V54 N102 I104 D105	A35-R67 CarbonylContact O-C 3.57Å; A35-R67 WeakPolarHBondContact O-CB 3.47Å; C36-R67 VanDerWaalsContact CA-O 3.32Å; C36-R67 WeakPolarHBondContact CA-O 3.48Å; T37-R67 PolarHBondContact N-O 3.42Å; T37-R67 PolarHBondContact OG1-N 2.92Å; M53-R67 WeakPolarHBondContact O-CA 3.36Å; V54-R67 HydrophobicContact CB-CG 4.22Å; V54-R67 HydrophobicContact CG2-CG 4Å; R67-N102 WeakPolarHBondContact CD-O 3.22Å; R67-N102 PolarHBondContact NE-O 2.7Å; R67-I104 PolarHBondContact NH2-O 2.95Å; R67-D105 IonicContact NH2-OD1 3.4Å; R67-D105 PolarHBondContact NH2-OD1 3.21Å
68	T	90.9	Very high	79.3	Confident	44 Å²	44	76 Å²	76	27%	0.27	43%	0.429	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-156.9	167.4	-179.7	-162.3	0	0	0	0	112.4	M53 I70	M53-T68 HydrophobicContact CB-CG2 4.24Å; M53-T68 HydrophobicContact CE-CG2 3.59Å; M53-T68 PolarHBondContact N-O 3.31Å; M53-T68 PolarHBondContact O-N 2.81Å; M53-T68 VanDerWaalsContact O-N 3.08Å; M53-T68 HydrophobicContact SD-CG2 4.36Å; T68-I70 HydrophobicContact CG2-CD1 3.72Å; T68-I70 HydrophobicContact CG2-CG1 4.4Å
69	C	91.5	Very high	79	Confident	19 Å²	19	76.5 Å²	76.5	13%	0.128	45%	0.45	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.5	138.2	169.6	-70.3	0	0	0	0	110.6	C34 C46 T48	C34-C69 WeakPolarHBondContact CB-SG 3.24Å; C34-C69 PolarHBondContact SG-SG 2.8Å; C46-C69 HydrophobicContact CB-CB 3.94Å; C46-C69 WeakPolarHBondContact CB-SG 3.35Å; C46-C69 PolarHBondContact O-SG 3.3Å; C46-C69 WeakPolarHBondContact SG-CB 2.87Å; C46-C69 PolarHBondContact SG-N 3.32Å; C46-C69 CovalentContact SG-SG 2.03Å; C46-C69 PolarHBondContact SG-SG 2.86Å; T48-C69 HydrophobicContact CG2-CB 3.82Å
70	I	89.8	Confident	79.1	Confident	7 Å²	7	79.5 Å²	79.5	4%	0.036	46%	0.458	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	117.2	175.7	-54.2	-63.1	0	0	0	109	T48 G50 A51 M53 T68 E74 L75 Y83	T48-I70 PolarHBondContact OG1-O 3.47Å; T48-I70 VanDerWaalsContact OG1-O 3.08Å; G50-I70 CarbonylContact C-O 3.54Å; G50-I70 VanDerWaalsContact CA-O 3.26Å; G50-I70 WeakPolarHBondContact CA-O 3.12Å; A51-I70 PolarHBondContact N-O 3.27Å; A51-I70 PolarHBondContact O-N 3.35Å; M53-I70 HydrophobicContact CB-CG1 4.03Å; M53-I70 HydrophobicContact SD-CD1 4.28Å; T68-I70 HydrophobicContact CG2-CD1 3.72Å; T68-I70 HydrophobicContact CG2-CG1 4.4Å; I70-E74 HydrophobicContact CG2-CB 3.92Å; I70-L75 HydrophobicContact CB-CD2 4.3Å; I70-L75 HydrophobicContact CG2-CD2 3.68Å; I70-L75 HydrophobicContact CG2-CG 4.11Å; I70-Y83 HydrophobicContact CD1-CD1 3.95Å; I70-Y83 HydrophobicContact CD1-CE1 4.33Å; I70-Y83 HydrophobicContact CD1-CG 4.25Å; I70-Y83 HydrophobicContact CG2-CD2 4.3Å; I70-Y83 HydrophobicContact CG2-CG 4.4Å
71	P	88	Confident	80	Confident	45 Å²	45	72 Å²	72	29%	0.292	42%	0.419	S	S	.	.			trans	-60.2	149	175.7	-21.1	32.4	0	0	0	112.2	T48 V73 E74	T48-P71 WeakPolarHBondContact OG1-CA 3.45Å; P71-V73 HydrophobicContact CB-CG2 3.94Å; P71-V73 PolarHBondContact O-N 3.03Å; P71-V73 VanDerWaalsContact O-N 3.11Å; P71-E74 PolarHBondContact O-N 3.07Å
72	K	84	Confident	80.8	Confident	142 Å²	142	75.5 Å²	75.5	62%	0.617	42%	0.417	S	S	*	.	G	3₁₀ helix	trans	-57.4	-31.7	-179	-173	173.8	-179.7	176.3	0	113.6	D49 E74 L75	D49-K72 PolarHBondContact OD1-N 2.77Å; K72-E74 PolarHBondContact O-N 2.8Å; K72-L75 PolarHBondContact O-N 2.81Å
73	V	83.8	Confident	81.5	Confident	122 Å²	122	74.8 Å²	74.8	74%	0.739	41%	0.408	S	S	*	.	G	3₁₀ helix	trans	-66.5	-22	178	-64.4	0	0	0	0	113.6	P71	P71-V73 HydrophobicContact CB-CG2 3.94Å; P71-V73 PolarHBondContact O-N 3.03Å; P71-V73 VanDerWaalsContact O-N 3.11Å
74	E	82.4	Confident	81.9	Confident	80 Å²	80	70.5 Å²	70.5	37%	0.374	39%	0.391	S	S	.	.	G	3₁₀ helix	trans	-92.6	-7.3	179.4	-67.8	-168.8	-150	0	0	113.1	I70 P71 K72 V76 Y83	I70-E74 HydrophobicContact CG2-CB 3.92Å; P71-E74 PolarHBondContact O-N 3.07Å; K72-E74 PolarHBondContact O-N 2.8Å; E74-V76 PolarHBondContact O-N 3.42Å; E74-Y83 HydrophobicContact CB-CD2 4.4Å; E74-Y83 HydrophobicContact CB-CE2 3.91Å; E74-Y83 WeakPolarHBondContact O-CD2 3.24Å; E74-Y83 PolarHBondContact OE2-OH 2.77Å
75	L	83.1	Confident	82	Confident	24 Å²	24	70.5 Å²	70.5	13%	0.126	39%	0.393	C	S	.	.			trans	-81	65.4	179.1	-64.7	175.7	0	0	0	112.1	A51 I70 K72 P81 Y97	A51-L75 HydrophobicContact CB-CD1 4.05Å; A51-L75 HydrophobicContact CB-CD2 4.26Å; I70-L75 HydrophobicContact CB-CD2 4.3Å; I70-L75 HydrophobicContact CG2-CD2 3.68Å; I70-L75 HydrophobicContact CG2-CG 4.11Å; K72-L75 PolarHBondContact O-N 2.81Å; L75-P81 HydrophobicContact CB-CB 4.18Å; L75-P81 HydrophobicContact CB-CG 4.04Å; L75-P81 HydrophobicContact CD2-CB 3.74Å; L75-P81 HydrophobicContact CD2-CG 3.83Å; L75-P81 HydrophobicContact CG-CG 4.48Å; L75-Y97 HydrophobicContact CD1-CE1 4.3Å
76	V	76.6	Confident	82	Confident	86 Å²	86	70.7 Å²	70.7	52%	0.521	40%	0.401	S	S	.	.			trans	-110.1	137	-179.4	-172.7	0	0	0	0	110.3	E74 F82	E74-V76 PolarHBondContact O-N 3.42Å; V76-F82 WeakPolarHBondContact O-CD2 3.18Å; V76-F82 PolarHBondContact O-N 3.26Å; V76-F82 VanDerWaalsContact O-N 3.13Å
77	P	74.3	Confident	81.4	Confident	61 Å²	61	71 Å²	71	40%	0.396	41%	0.406	S	S	.	.	S	Bend	cis	-75.2	154.7	-12.2	31.4	-35.6	0	0	0	113	G79 K80	P77-G79 PolarHBondContact O-N 2.83Å; P77-G79 VanDerWaalsContact O-N 3.14Å; P77-K80 WeakPolarHBondContact CD-O 2.97Å; P77-K80 CarbonylContact O-C 3.56Å; P77-K80 PolarHBondContact O-N 3.47Å
78	A	65.7	Low	80.1	Confident	105 Å²	105	77.5 Å²	77.5	87%	0.868	44%	0.438	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.1	116.5	177.3	0	0	0	0	0	110.7
79	G	66.3	Low	78.9	Confident	75 Å²	75	81.1 Å²	81.1	77%	0.773	46%	0.456	S	S	*	.	T	Hydrogen-bonded Turn	trans	112.6	-30.3	180	0	0	0	0	0	114.9	P77	P77-G79 PolarHBondContact O-N 2.83Å; P77-G79 VanDerWaalsContact O-N 3.14Å
80	K	72.3	Confident	77.7	Confident	159 Å²	159	85.8 Å²	85.8	69%	0.691	48%	0.479	S	S	*	.	S	Bend	trans	-144.1	75.8	170.2	-81.4	-171.2	176	-178.8	0	110.3	P77	P77-K80 WeakPolarHBondContact CD-O 2.97Å; P77-K80 CarbonylContact O-C 3.56Å; P77-K80 PolarHBondContact O-N 3.47Å
81	P	82.3	Confident	77.2	Confident	10 Å²	10	90.4 Å²	90.4	7%	0.065	50%	0.496	C	S	.	.			trans	-62.2	137.5	-179	-19.5	31.9	0	0	0	111.3	L75 Y83 C84	L75-P81 HydrophobicContact CB-CB 4.18Å; L75-P81 HydrophobicContact CB-CG 4.04Å; L75-P81 HydrophobicContact CD2-CB 3.74Å; L75-P81 HydrophobicContact CD2-CG 3.83Å; L75-P81 HydrophobicContact CG-CG 4.48Å; P81-Y83 PolarHBondContact O-N 3.48Å; P81-C84 HydrophobicContact CB-CB 4.38Å; P81-C84 PolarHBondContact O-N 3.37Å
82	F	81.5	Confident	77.1	Confident	137 Å²	137	90.7 Å²	90.7	60%	0.601	50%	0.495	S	S	*	.	G	3₁₀ helix	trans	-56.7	-35.1	178.3	-67.4	-66.4	0	0	0	112.8	V76 C84 L85	V76-F82 WeakPolarHBondContact O-CD2 3.18Å; V76-F82 PolarHBondContact O-N 3.26Å; V76-F82 VanDerWaalsContact O-N 3.13Å; F82-C84 PolarHBondContact O-N 2.75Å; F82-C84 VanDerWaalsContact O-N 3.17Å; F82-L85 HydrophobicContact CD1-CD1 3.79Å; F82-L85 PolarHBondContact O-N 3.46Å
83	Y	82.1	Confident	77.3	Confident	106 Å²	106	84.2 Å²	84.2	42%	0.416	47%	0.467	S	S	.	.	G	3₁₀ helix	trans	-62.1	-18.6	175.7	-77.6	-76.8	0	0	0	114.1	I70 E74 P81 T93	I70-Y83 HydrophobicContact CD1-CD1 3.95Å; I70-Y83 HydrophobicContact CD1-CE1 4.33Å; I70-Y83 HydrophobicContact CD1-CG 4.25Å; I70-Y83 HydrophobicContact CG2-CD2 4.3Å; I70-Y83 HydrophobicContact CG2-CG 4.4Å; E74-Y83 HydrophobicContact CB-CD2 4.4Å; E74-Y83 HydrophobicContact CB-CE2 3.91Å; E74-Y83 WeakPolarHBondContact O-CD2 3.24Å; E74-Y83 PolarHBondContact OE2-OH 2.77Å; P81-Y83 PolarHBondContact O-N 3.48Å; Y83-T93 VanDerWaalsContact O-CG2 3.29Å; Y83-T93 WeakPolarHBondContact O-CG2 3.2Å
84	C	83.4	Confident	77.5	Confident	29 Å²	29	82.7 Å²	82.7	20%	0.196	45%	0.452	C	S	.	.	G	3₁₀ helix	trans	-104.6	10	-177.4	-53.9	0	0	0	0	113	P81 F82 C95	P81-C84 HydrophobicContact CB-CB 4.38Å; P81-C84 PolarHBondContact O-N 3.37Å; F82-C84 PolarHBondContact O-N 2.75Å; F82-C84 VanDerWaalsContact O-N 3.17Å; C84-C95 WeakPolarHBondContact CA-SG 3.31Å; C84-C95 HydrophobicContact CB-CB 3.71Å; C84-C95 WeakPolarHBondContact CB-SG 3.2Å; C84-C95 WeakPolarHBondContact SG-CB 3.17Å; C84-C95 CovalentContact SG-SG 2.03Å; C84-C95 PolarHBondContact SG-SG 2.99Å
85	L	82.5	Confident	77.9	Confident	74 Å²	74	79.8 Å²	79.8	39%	0.387	44%	0.44	S	S	.	.			trans	-86.8	129.5	-179.8	-63.6	175.5	0	0	0	112.1	F82 R91	F82-L85 HydrophobicContact CD1-CD1 3.79Å; F82-L85 PolarHBondContact O-N 3.46Å; L85-R91 PolarHBondContact O-NH2 3.39Å
86	S	81.9	Confident	78.2	Confident	66 Å²	66	79.3 Å²	79.3	46%	0.462	44%	0.439	S	S	.	.			trans	-94.6	153.1	168.7	-65.7	0	0	0	0	111.2	R91 T93	S86-R91 CarbonylContact C-O 3.55Å; S86-R91 WeakPolarHBondContact CA-O 3.16Å; S86-T93 PolarHBondContact OG-N 3.17Å; S86-T93 PolarHBondContact OG-O 2.72Å
87	S	75	Confident	78.8	Confident	58 Å²	58	81.8 Å²	81.8	41%	0.406	44%	0.44	S	S	.	.	B	Isolated β-bridge	trans	-120	131.3	171.1	172.3	0	0	0	0	108.3	D89 R91	S87-D89 PolarHBondContact O-N 3.21Å; S87-D89 VanDerWaalsContact O-N 3.1Å; S87-R91 PolarHBondContact N-O 2.72Å; S87-R91 PolarHBondContact O-N 3.37Å
88	E	65.5	Low	79.4	Confident	178 Å²	178	83.4 Å²	83.4	83%	0.832	45%	0.449	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.9	-26.5	-171.2	-69.1	-174.5	160.7	0	0	113.8	P109	E88-P109 WeakPolarHBondContact O-CB 3.02Å
89	D	64.1	Low	80.6	Confident	120 Å²	120	82.9 Å²	82.9	64%	0.642	43%	0.431	S	S	*	.	T	Hydrogen-bonded Turn	trans	-115.9	-8.1	-172	-60.6	-48.3	0	0	0	115.3	S87	S87-D89 PolarHBondContact O-N 3.21Å; S87-D89 VanDerWaalsContact O-N 3.1Å
90	L	67.8	Low	81.7	Confident	118 Å²	118	83.9 Å²	83.9	62%	0.618	41%	0.412	S	S	*	.	T	Hydrogen-bonded Turn	trans	-133.2	-33.1	-170.2	-94.7	122.3	0	0	0	115.5	F57	F57-L90 WeakPolarHBondContact CA-O 3.19Å; F57-L90 WeakPolarHBondContact CB-O 3.33Å
91	R	79.8	Confident	82.4	Confident	103 Å²	103	77.4 Å²	77.4	39%	0.389	39%	0.387	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.4	123.1	-170.2	-174.2	177.9	77.8	-175.8	5.4	112.3	S55 I56 F57 L85 S86 S87 T93	S55-R91 WeakPolarHBondContact OG-CD 3.45Å; S55-R91 VanDerWaalsContact OG-CG 3.31Å; S55-R91 WeakPolarHBondContact OG-CG 3.27Å; I56-R91 WeakPolarHBondContact O-CA 3.31Å; F57-R91 HydrophobicContact CB-CB 4.16Å; F57-R91 HydrophobicContact CB-CG 4.06Å; L85-R91 PolarHBondContact O-NH2 3.39Å; S86-R91 CarbonylContact C-O 3.55Å; S86-R91 WeakPolarHBondContact CA-O 3.16Å; S87-R91 PolarHBondContact N-O 2.72Å; S87-R91 PolarHBondContact O-N 3.37Å; R91-T93 WeakPolarHBondContact CG-OG1 3.06Å; R91-T93 PolarHBondContact NE-OG1 3.47Å
92	N	84.6	Confident	82.8	Confident	51 Å²	51	76.9 Å²	76.9	27%	0.273	38%	0.384	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.2	114.1	171.4	-174.2	1.6	0	0	0	109.1	S55 I56 L106 R107 P109	S55-N92 CarbonylContact C-O 3.53Å; S55-N92 WeakPolarHBondContact CA-O 3.28Å; I56-N92 HydrophobicContact CG2-CB 3.78Å; I56-N92 PolarHBondContact N-O 2.83Å; I56-N92 PolarHBondContact O-N 3.37Å; N92-L106 VanDerWaalsContact O-CD1 3.32Å; N92-L106 WeakPolarHBondContact O-CD1 3.5Å; N92-R107 PolarHBondContact ND2-O 2.92Å; N92-P109 HydrophobicContact CB-CG 4.1Å
93	T	88.4	Confident	83	Confident	7 Å²	7	79.6 Å²	79.6	4%	0.043	39%	0.39	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	130.6	-176.9	-56.8	0	0	0	0	110.6	M53 V54 S55 Y83 S86 R91	M53-T93 HydrophobicContact CG-CG2 3.77Å; M53-T93 HydrophobicContact SD-CG2 4.09Å; V54-T93 CarbonylContact O-C 3.59Å; V54-T93 WeakPolarHBondContact O-CA 3.17Å; S55-T93 WeakPolarHBondContact CB-OG1 3.15Å; S55-T93 PolarHBondContact OG-OG1 3Å; Y83-T93 VanDerWaalsContact O-CG2 3.29Å; Y83-T93 WeakPolarHBondContact O-CG2 3.2Å; S86-T93 PolarHBondContact OG-N 3.17Å; S86-T93 PolarHBondContact OG-O 2.72Å; R91-T93 WeakPolarHBondContact CG-OG1 3.06Å; R91-T93 PolarHBondContact NE-OG1 3.47Å
94	H	88.4	Confident	83.1	Confident	89 Å²	89	78 Å²	78	41%	0.412	39%	0.388	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	131.6	177.8	-173.6	-90.6	0	0	0	110.7	V54 I104 L106	V54-H94 HydrophobicContact CG1-CB 4.08Å; V54-H94 PolarHBondContact N-O 3.13Å; V54-H94 PolarHBondContact O-N 3.49Å; H94-I104 HydrophobicContact CB-CD1 4.48Å; H94-L106 HydrophobicContact CB-CD1 4.22Å; H94-L106 HydrophobicContact CB-CD2 4.33Å
95	C	90.3	Very high	82.7	Confident	19 Å²	19	82.8 Å²	82.8	13%	0.128	41%	0.411	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	143.7	172.9	-68.4	0	0	0	0	110.8	A51 C52 C84	A51-C95 HydrophobicContact CB-CB 4.46Å; C52-C95 CarbonylContact O-C 3.53Å; C52-C95 VanDerWaalsContact O-CA 3.25Å; C52-C95 WeakPolarHBondContact O-CA 3.36Å; C84-C95 WeakPolarHBondContact CA-SG 3.31Å; C84-C95 HydrophobicContact CB-CB 3.71Å; C84-C95 WeakPolarHBondContact CB-SG 3.2Å; C84-C95 WeakPolarHBondContact SG-CB 3.17Å; C84-C95 CovalentContact SG-SG 2.03Å; C84-C95 PolarHBondContact SG-SG 2.99Å
96	C	88.8	Confident	82.5	Confident	15 Å²	15	80.5 Å²	80.5	10%	0.101	40%	0.4	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.1	164.8	-178.5	55.3	0	0	0	0	111.4	C52 C101 N102	C52-C96 PolarHBondContact N-O 3.1Å; C52-C96 PolarHBondContact O-N 3.34Å; C96-C101 HydrophobicContact CB-CB 3.68Å; C96-C101 WeakPolarHBondContact CB-SG 3.23Å; C96-C101 WeakPolarHBondContact SG-CB 3.24Å; C96-C101 CovalentContact SG-SG 2Å; C96-C101 PolarHBondContact SG-SG 3.34Å; C96-N102 PolarHBondContact SG-N 2.78Å
97	Y	89.6	Confident	82	Confident	137 Å²	137	87.9 Å²	87.9	54%	0.537	42%	0.417	S	S	.	.			trans	-129.2	25.4	-163.5	-56.3	-88.4	0	0	0	113.5	G50 A51 L75	G50-Y97 WeakPolarHBondContact O-CD1 3.41Å; A51-Y97 HydrophobicContact CB-CD1 3.89Å; A51-Y97 HydrophobicContact CB-CE1 3.5Å; L75-Y97 HydrophobicContact CD1-CE1 4.3Å
98	T	88.1	Confident	81.5	Confident	95 Å²	95	86.6 Å²	86.6	58%	0.583	41%	0.407	S	S	*	.	S	Bend	trans	-126.5	153.2	174.7	60.2	0	0	0	0	110.4	Y100 C101	T98-Y100 PolarHBondContact O-N 3.4Å; T98-C101 WeakPolarHBondContact O-CB 3.42Å; T98-C101 PolarHBondContact O-N 3.48Å; T98-C101 VanDerWaalsContact O-N 3.13Å; T98-C101 PolarHBondContact O-SG 3.3Å; T98-C101 WeakPolarHBondContact OG1-CB 3.2Å
99	D	90.2	Very high	81.4	Confident	94 Å²	94	79.6 Å²	79.6	50%	0.503	38%	0.377	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54.5	131.2	-175.2	-69.3	-24.6	0	0	0	112	L33 C101	L33-D99 HydrophobicContact CB-CB 4.48Å; L33-D99 PolarHBondContact N-OD1 3.24Å; L33-D99 CarbonylContact O-C 3.56Å; L33-D99 WeakPolarHBondContact O-CA 2.97Å; D99-C101 PolarHBondContact O-N 2.8Å; D99-C101 VanDerWaalsContact O-N 3.11Å
100	Y	88.7	Confident	81	Confident	96 Å²	96	79 Å²	79	38%	0.376	38%	0.382	S	S	.	.	T	Hydrogen-bonded Turn	trans	56.9	18.7	-179.9	-57.3	-79.3	0	0	0	116	L33 T45 T98 N102 R103	L33-Y100 HydrophobicContact CB-CD2 4.48Å; L33-Y100 HydrophobicContact CB-CE1 4.44Å; L33-Y100 HydrophobicContact CB-CE2 3.88Å; L33-Y100 HydrophobicContact CD1-CE2 4.31Å; L33-Y100 PolarHBondContact O-N 2.7Å; T45-Y100 HydrophobicContact CG2-CE1 3.86Å; T98-Y100 PolarHBondContact O-N 3.4Å; Y100-N102 PolarHBondContact O-N 2.71Å; Y100-N102 VanDerWaalsContact O-N 3.12Å; Y100-R103 VanDerWaalsContact O-CB 3.28Å; Y100-R103 WeakPolarHBondContact O-CB 3.15Å; Y100-R103 PolarHBondContact O-N 3.49Å; Y100-R103 VanDerWaalsContact O-N 3.08Å
101	C	87.8	Confident	80.1	Confident	23 Å²	23	76 Å²	76	16%	0.155	38%	0.38	C	S	.	.	G	3₁₀ helix	trans	-63.4	-20.4	-177.8	64.9	0	0	0	0	114.3	C96 T98 D99 R103	C96-C101 HydrophobicContact CB-CB 3.68Å; C96-C101 WeakPolarHBondContact CB-SG 3.23Å; C96-C101 WeakPolarHBondContact SG-CB 3.24Å; C96-C101 CovalentContact SG-SG 2Å; C96-C101 PolarHBondContact SG-SG 3.34Å; T98-C101 WeakPolarHBondContact O-CB 3.42Å; T98-C101 PolarHBondContact O-N 3.48Å; T98-C101 VanDerWaalsContact O-N 3.13Å; T98-C101 PolarHBondContact O-SG 3.3Å; T98-C101 WeakPolarHBondContact OG1-CB 3.2Å; D99-C101 PolarHBondContact O-N 2.8Å; D99-C101 VanDerWaalsContact O-N 3.11Å; C101-R103 PolarHBondContact O-N 2.69Å
102	N	90.1	Very high	78.1	Confident	0 Å²	0	79.6 Å²	79.6	0%	0	40%	0.401	C	S	.	.	G	3₁₀ helix	trans	-84.8	10	177.7	71.8	-26.1	0	0	0	113.4	A35 C52 M53 V54 R67 C96 Y100 I104	A35-N102 WeakPolarHBondContact CB-OD1 3.43Å; A35-N102 PolarHBondContact N-OD1 3.11Å; A35-N102 PolarHBondContact O-ND2 3.4Å; C52-N102 HydrophobicContact CB-CB 3.75Å; M53-N102 PolarHBondContact O-ND2 3.33Å; V54-N102 HydrophobicContact CB-CB 4.03Å; V54-N102 HydrophobicContact CG1-CB 4.21Å; R67-N102 WeakPolarHBondContact CD-O 3.22Å; R67-N102 PolarHBondContact NE-O 2.7Å; C96-N102 PolarHBondContact SG-N 2.78Å; Y100-N102 PolarHBondContact O-N 2.71Å; Y100-N102 VanDerWaalsContact O-N 3.12Å; N102-I104 PolarHBondContact O-N 2.72Å
103	R	85.5	Confident	75.9	Confident	193 Å²	193	85 Å²	85	73%	0.728	43%	0.428	S	S	*	.	G	3₁₀ helix	trans	-82	14.1	172.6	-153.7	173.7	-177.6	177.8	1.3	113.6	Y100 C101	Y100-R103 VanDerWaalsContact O-CB 3.28Å; Y100-R103 WeakPolarHBondContact O-CB 3.15Å; Y100-R103 PolarHBondContact O-N 3.49Å; Y100-R103 VanDerWaalsContact O-N 3.08Å; C101-R103 PolarHBondContact O-N 2.69Å
104	I	83.8	Confident	73.2	Confident	72 Å²	72	94.1 Å²	94.1	37%	0.369	47%	0.468	S	S	.	.			trans	-77.1	151.8	171.2	61.8	174.5	0	0	0	110.8	V54 R67 H94 N102 L106	V54-I104 HydrophobicContact CG1-CD1 4Å; V54-I104 HydrophobicContact CG1-CG1 3.75Å; R67-I104 PolarHBondContact NH2-O 2.95Å; H94-I104 HydrophobicContact CB-CD1 4.48Å; N102-I104 PolarHBondContact O-N 2.72Å; I104-L106 HydrophobicContact CD1-CD2 3.88Å; I104-L106 HydrophobicContact CG1-CD2 4.43Å
105	D	76.4	Confident	70.3	Confident	130 Å²	130	98.3 Å²	98.3	70%	0.695	49%	0.488	S	S	*	.			trans	-100.1	111.5	171	-67.9	-41.2	0	0	0	109.1	R67	R67-D105 IonicContact NH2-OD1 3.4Å; R67-D105 PolarHBondContact NH2-OD1 3.21Å
106	L	77.7	Confident	67.6	Low	27 Å²	27	103.1 Å²	103.1	14%	0.141	52%	0.519	C	S	.	.	P	Polyproline II helix	trans	-80.5	146.5	174.1	-63.6	179.3	0	0	0	109.6	V54 I56 N92 H94 I104	V54-L106 HydrophobicContact CG1-CD1 3.99Å; V54-L106 HydrophobicContact CG1-CG 4.29Å; V54-L106 HydrophobicContact CG2-CD1 4.15Å; V54-L106 HydrophobicContact CG2-CG 4.31Å; I56-L106 HydrophobicContact CB-CB 4.38Å; I56-L106 WeakPolarHBondContact CD1-O 3.28Å; I56-L106 HydrophobicContact CG2-CB 3.63Å; I56-L106 HydrophobicContact CG2-CD1 4.44Å; N92-L106 VanDerWaalsContact O-CD1 3.32Å; N92-L106 WeakPolarHBondContact O-CD1 3.5Å; H94-L106 HydrophobicContact CB-CD1 4.22Å; H94-L106 HydrophobicContact CB-CD2 4.33Å; I104-L106 HydrophobicContact CD1-CD2 3.88Å; I104-L106 HydrophobicContact CG1-CD2 4.43Å
107	R	70.9	Confident	64.9	Low	221 Å²	221	111.4 Å²	111.4	83%	0.834	56%	0.556	S	S	*	*	P	Polyproline II helix	trans	-85.9	142.6	170.9	-63.9	-175.6	-177.4	179.5	0.6	109.9	N92	N92-R107 PolarHBondContact ND2-O 2.92Å
108	V	64.9	Low	62.3	Low	30 Å²	30	113.6 Å²	113.6	18%	0.182	57%	0.571	C	S	.	*	P	Polyproline II helix	trans	-61	137.3	170.5	-174.9	0	0	0	0	108.6	I56 N58 E63 S110	I56-V108 HydrophobicContact CD1-CB 4.35Å; I56-V108 HydrophobicContact CD1-CG2 3.3Å; I56-V108 HydrophobicContact CG1-CG2 3.94Å; N58-V108 HydrophobicContact CB-CG1 4.42Å; E63-V108 HydrophobicContact CB-CG2 4.35Å; E63-V108 HydrophobicContact CG-CG2 3.7Å; E63-V108 WeakPolarHBondContact OE1-CG2 3.21Å; V108-S110 PolarHBondContact O-N 3.19Å
109	P	63.7	Low	59.8	Low	32 Å²	32	114.4 Å²	114.4	21%	0.208	58%	0.577	C	S	.	*			trans	-59.8	113.4	169.4	-16.5	28.4	0	0	0	109.6	E88 N92 G111	E88-P109 WeakPolarHBondContact O-CB 3.02Å; N92-P109 HydrophobicContact CB-CG 4.1Å; P109-G111 PolarHBondContact O-N 2.94Å
110	S	55.7	Low	57.5	Low	108 Å²	108	113.8 Å²	113.8	76%	0.755	58%	0.58	S	S	*	*			trans	-70.2	100.6	172.7	-60	0	0	0	0	108.2	V108 H112	V108-S110 PolarHBondContact O-N 3.19Å; S110-H112 VanDerWaalsContact C-N 3.28Å; S110-H112 PolarHBondContact O-N 2.88Å
111	G	48.4	Very low	55.3	Low	55 Å²	55	118.1 Å²	118.1	57%	0.567	61%	0.606	S	S	*	*			trans	-61.2	92.3	167	0	0	0	0	0	109.3	P109 L113	P109-G111 PolarHBondContact O-N 2.94Å; G111-L113 VanDerWaalsContact C-N 3.32Å; G111-L113 PolarHBondContact O-N 2.81Å
112	H	38.5	Very low	53.4	Low	177 Å²	177	124.2 Å²	124.2	82%	0.819	63%	0.626	S	S	*	*			trans	-68.6	97.6	165.7	-97	-53.4	0	0	0	107.3	S110 K114	S110-H112 VanDerWaalsContact C-N 3.28Å; S110-H112 PolarHBondContact O-N 2.88Å; H112-K114 VanDerWaalsContact C-N 3.3Å; H112-K114 PolarHBondContact O-N 2.81Å
113	L	38.9	Very low	51.8	Low	164 Å²	164	125.5 Å²	125.5	86%	0.859	64%	0.64	S	S	*	*			trans	-50.1	103.2	149.5	-82.8	154.9	0	0	0	106.7	G111 E115	G111-L113 VanDerWaalsContact C-N 3.32Å; G111-L113 PolarHBondContact O-N 2.81Å; L113-E115 PolarHBondContact O-N 2.82Å; L113-E115 VanDerWaalsContact O-N 3.1Å
114	K	30.7	Very low	50.7	Low	200 Å²	200	121.6 Å²	121.6	87%	0.87	64%	0.639	S	S	*	*			trans	-58.9	112.9	162.2	-82.6	-178.6	174.9	178.1	0	106.5	H112	H112-K114 VanDerWaalsContact C-N 3.3Å; H112-K114 PolarHBondContact O-N 2.81Å
115	E	28.1	Very low	49.6	Very low	177 Å²	177	124.1 Å²	124.1	83%	0.827	66%	0.658	S	S	*	*			trans	-53	136	160.4	-71.4	-179.6	154	0	0	108.3	L113 E117	L113-E115 PolarHBondContact O-N 2.82Å; L113-E115 VanDerWaalsContact O-N 3.1Å; E115-E117 PolarHBondContact O-N 2.86Å; E115-E117 VanDerWaalsContact O-N 3.12Å
116	P	33.3	Very low	48.7	Very low	120 Å²	120	122.8 Å²	122.8	78%	0.779	65%	0.647	S	S	*	*			trans	-71.1	109.4	169.9	28.5	-27.7	0	0	0	107.4	H118	P116-H118 PolarHBondContact O-N 2.87Å
117	E	31.7	Very low	47.9	Very low	189 Å²	189	126.5 Å²	126.5	88%	0.883	67%	0.667	S	S	*	*			trans	-54.3	130	159.5	-78.8	-170.3	157.4	0	0	108.4	E115	E115-E117 PolarHBondContact O-N 2.86Å; E115-E117 VanDerWaalsContact O-N 3.12Å
118	H	34.3	Very low	47.6	Very low	183 Å²	183	120.5 Å²	120.5	85%	0.847	65%	0.654	S	S	*	*			trans	-29.7	118.6	176.8	-84.4	-88.3	0	0	0	113.6	P116 S120	P116-H118 PolarHBondContact O-N 2.87Å; H118-S120 PolarHBondContact O-N 3.07Å; H118-S120 VanDerWaalsContact O-N 3.11Å
119	P	35.7	Very low	47.6	Very low	111 Å²	111	121.2 Å²	121.2	72%	0.721	67%	0.668	S	S	*	*			trans	-69	116.2	161	27.4	-26.7	0	0	0	106.7	M121	P119-M121 PolarHBondContact O-N 2.84Å
120	S	42.8	Very low	47.8	Very low	81 Å²	81	124 Å²	124	57%	0.566	68%	0.68	S	S	*	*			trans	-42.1	131.5	147.3	44.9	0	0	0	0	107.6	H118 W122	H118-S120 PolarHBondContact O-N 3.07Å; H118-S120 VanDerWaalsContact O-N 3.11Å; S120-W122 PolarHBondContact O-N 3.49Å; S120-W122 PolarHBondContact OG-NE1 3.17Å
121	M	41.5	Very low	48.5	Very low	188 Å²	188	123.9 Å²	123.9	93%	0.926	67%	0.67	S	S	*	*			trans	-72.1	94	-177.8	-172.6	162.7	62.7	0	0	108	P119	P119-M121 PolarHBondContact O-N 2.84Å
122	W	48.7	Very low	49.8	Very low	150 Å²	150	123.7 Å²	123.7	57%	0.568	66%	0.663	S	S	*	*			trans	-77.1	125.7	171.3	-70.6	40.5	0	0	0	107.2	S120 E126 I130	S120-W122 PolarHBondContact O-N 3.49Å; S120-W122 PolarHBondContact OG-NE1 3.17Å; W122-E126 VanDerWaalsContact CA-OE2 3.23Å; W122-E126 WeakPolarHBondContact CA-OE2 3.47Å; W122-E126 HydrophobicContact CB-CB 4.24Å; W122-E126 WeakPolarHBondContact CB-OE2 3.48Å; W122-E126 HydrophobicContact CE3-CB 3.76Å; W122-I130 HydrophobicContact CE3-CD1 3.5Å; W122-I130 VanDerWaalsContact CE3-CD1 3.5Å; W122-I130 HydrophobicContact CH2-CD1 4.33Å; W122-I130 HydrophobicContact CZ3-CD1 3.34Å; W122-I130 HydrophobicContact CZ3-CG1 4.32Å
123	G	57.2	Low	51.7	Low	28 Å²	28	116.7 Å²	116.7	29%	0.289	64%	0.639	S	S	.	*			trans	-64.6	160.2	-177.6	0	0	0	0	0	111.6	V125 E126 L127	G123-V125 PolarHBondContact O-N 3.34Å; G123-E126 PolarHBondContact N-OE2 2.86Å; G123-E126 VanDerWaalsContact N-OE2 3.14Å; G123-E126 PolarHBondContact O-N 3.38Å; G123-L127 PolarHBondContact O-N 2.97Å
124	P	61.2	Low	53.7	Low	111 Å²	111	112.6 Å²	112.6	72%	0.721	62%	0.622	S	S	*	*	H	α-helix	trans	-55.3	-21.5	178.9	19.5	-30.4	0	0	0	113.5	V128	P124-V128 VanDerWaalsContact O-CG2 3.3Å; P124-V128 WeakPolarHBondContact O-CG2 3.31Å; P124-V128 PolarHBondContact O-N 2.99Å
125	V	60.3	Low	56.3	Low	124 Å²	124	107.5 Å²	107.5	75%	0.752	61%	0.608	S	S	*	*	H	α-helix	trans	-73.1	-35.3	176.9	-166.7	0	0	0	0	112.4	G123 G129	G123-V125 PolarHBondContact O-N 3.34Å; V125-G129 PolarHBondContact O-N 3.29Å
126	E	58.7	Low	59.1	Low	102 Å²	102	105.3 Å²	105.3	48%	0.477	60%	0.596	S	S	.	*	H	α-helix	trans	-80	-32.6	-178.2	-64.7	172.1	142.2	0	0	111.7	W122 G123 G129 I130	W122-E126 VanDerWaalsContact CA-OE2 3.23Å; W122-E126 WeakPolarHBondContact CA-OE2 3.47Å; W122-E126 HydrophobicContact CB-CB 4.24Å; W122-E126 WeakPolarHBondContact CB-OE2 3.48Å; W122-E126 HydrophobicContact CE3-CB 3.76Å; G123-E126 PolarHBondContact N-OE2 2.86Å; G123-E126 VanDerWaalsContact N-OE2 3.14Å; G123-E126 PolarHBondContact O-N 3.38Å; E126-G129 PolarHBondContact O-N 2.75Å; E126-I130 WeakPolarHBondContact O-CG1 3.44Å; E126-I130 PolarHBondContact O-N 2.84Å; E126-I130 VanDerWaalsContact O-N 3.09Å
127	L	59.7	Low	61.7	Low	105 Å²	105	104.6 Å²	104.6	55%	0.55	59%	0.585	S	S	.	*	H	α-helix	trans	-65.9	-38.7	173.7	-161.8	78.7	0	0	0	112	G123 G129 I130 I131	G123-L127 PolarHBondContact O-N 2.97Å; L127-G129 VanDerWaalsContact C-N 3.32Å; L127-I130 PolarHBondContact O-N 3.05Å; L127-I131 HydrophobicContact CG-CD1 4.27Å; L127-I131 WeakPolarHBondContact O-CG1 3.37Å; L127-I131 PolarHBondContact O-N 3.32Å
128	V	65.6	Low	64.5	Low	95 Å²	95	100.8 Å²	100.8	58%	0.576	57%	0.569	S	S	*	*	H	α-helix	trans	-63.9	-39.4	172.8	172.5	0	0	0	0	110.4	P124 I130 I131 A132	P124-V128 VanDerWaalsContact O-CG2 3.3Å; P124-V128 WeakPolarHBondContact O-CG2 3.31Å; P124-V128 PolarHBondContact O-N 2.99Å; V128-I130 PolarHBondContact O-N 2.84Å; V128-I131 PolarHBondContact O-N 3.38Å; V128-A132 HydrophobicContact CG1-CB 4.28Å; V128-A132 WeakPolarHBondContact O-CA 3.42Å; V128-A132 WeakPolarHBondContact O-CB 3.24Å; V128-A132 PolarHBondContact O-N 2.93Å
129	G	65.1	Low	67.2	Low	45 Å²	45	98.2 Å²	98.2	46%	0.464	56%	0.556	S	S	.	*	H	α-helix	trans	-62	-41.5	176.1	0	0	0	0	0	113.8	V125 E126 L127 G133	V125-G129 PolarHBondContact O-N 3.29Å; E126-G129 PolarHBondContact O-N 2.75Å; L127-G129 VanDerWaalsContact C-N 3.32Å; G129-G133 WeakPolarHBondContact O-CA 3.28Å; G129-G133 PolarHBondContact O-N 2.95Å
130	I	67.4	Low	69.9	Low	91 Å²	91	96.3 Å²	96.3	47%	0.467	54%	0.539	S	S	.	.	H	α-helix	trans	-73.6	-29.5	-178.1	-66.2	163.2	0	0	0	112.7	W122 E126 L127 V128 P134	W122-I130 HydrophobicContact CE3-CD1 3.5Å; W122-I130 VanDerWaalsContact CE3-CD1 3.5Å; W122-I130 HydrophobicContact CH2-CD1 4.33Å; W122-I130 HydrophobicContact CZ3-CD1 3.34Å; W122-I130 HydrophobicContact CZ3-CG1 4.32Å; E126-I130 WeakPolarHBondContact O-CG1 3.44Å; E126-I130 PolarHBondContact O-N 2.84Å; E126-I130 VanDerWaalsContact O-N 3.09Å; L127-I130 PolarHBondContact O-N 3.05Å; V128-I130 PolarHBondContact O-N 2.84Å; I130-P134 WeakPolarHBondContact O-CD 3.5Å; I130-P134 WeakPolarHBondContact O-CG 3.43Å
131	I	71.6	Confident	72.2	Confident	106 Å²	106	96.8 Å²	96.8	54%	0.544	54%	0.535	S	S	.	.	H	α-helix	trans	-92.1	-44.6	178.5	-60.2	171.9	0	0	0	110.8	L127 V128 G133 P134 V135	L127-I131 HydrophobicContact CG-CD1 4.27Å; L127-I131 WeakPolarHBondContact O-CG1 3.37Å; L127-I131 PolarHBondContact O-N 3.32Å; V128-I131 PolarHBondContact O-N 3.38Å; I131-G133 VanDerWaalsContact C-N 3.33Å; I131-G133 PolarHBondContact O-N 3.08Å; I131-P134 WeakPolarHBondContact O-CD 3.42Å; I131-V135 HydrophobicContact CG2-CG2 4.46Å; I131-V135 WeakPolarHBondContact O-CB 3.32Å; I131-V135 WeakPolarHBondContact O-CG2 3.33Å; I131-V135 PolarHBondContact O-N 3.24Å
132	A	74.3	Confident	74.6	Confident	50 Å²	50	92.3 Å²	92.3	41%	0.413	51%	0.514	S	S	.	.	H	α-helix	trans	-68.5	-33.2	180	0	0	0	0	0	111.7	V128 F136	V128-A132 HydrophobicContact CG1-CB 4.28Å; V128-A132 WeakPolarHBondContact O-CA 3.42Å; V128-A132 WeakPolarHBondContact O-CB 3.24Å; V128-A132 PolarHBondContact O-N 2.93Å; A132-F136 WeakPolarHBondContact O-CB 3.45Å; A132-F136 PolarHBondContact O-N 3.45Å
133	G	78.4	Confident	76.6	Confident	31 Å²	31	88.5 Å²	88.5	32%	0.32	50%	0.504	S	S	.	.	H	α-helix	trans	-58.2	-59	178.5	0	0	0	0	0	113.2	G129 I131 V135 F136 L137	G129-G133 WeakPolarHBondContact O-CA 3.28Å; G129-G133 PolarHBondContact O-N 2.95Å; I131-G133 VanDerWaalsContact C-N 3.33Å; I131-G133 PolarHBondContact O-N 3.08Å; G133-V135 PolarHBondContact O-N 2.73Å; G133-F136 PolarHBondContact O-N 2.88Å; G133-L137 WeakPolarHBondContact O-CB 3.31Å; G133-L137 PolarHBondContact O-N 2.99Å
134	P	82.4	Confident	78.3	Confident	78 Å²	78	91.9 Å²	91.9	51%	0.506	51%	0.514	S	S	.	.	H	α-helix	trans	-62.8	-39.8	177	-23.6	34	0	0	0	113	I130 I131 L137 L138	I130-P134 WeakPolarHBondContact O-CD 3.5Å; I130-P134 WeakPolarHBondContact O-CG 3.43Å; I131-P134 WeakPolarHBondContact O-CD 3.42Å; P134-L137 PolarHBondContact O-N 2.87Å; P134-L138 VanDerWaalsContact O-CB 3.31Å; P134-L138 WeakPolarHBondContact O-CB 3.36Å; P134-L138 PolarHBondContact O-N 3.24Å
135	V	85.4	Confident	79.8	Confident	93 Å²	93	90.1 Å²	90.1	56%	0.564	50%	0.501	S	S	*	.	H	α-helix	trans	-65.6	-40.9	178.3	173	0	0	0	0	111	I131 G133 L138 F139	I131-V135 HydrophobicContact CG2-CG2 4.46Å; I131-V135 WeakPolarHBondContact O-CB 3.32Å; I131-V135 WeakPolarHBondContact O-CG2 3.33Å; I131-V135 PolarHBondContact O-N 3.24Å; G133-V135 PolarHBondContact O-N 2.73Å; V135-L138 PolarHBondContact O-N 3.02Å; V135-F139 WeakPolarHBondContact O-CB 3.28Å; V135-F139 PolarHBondContact O-N 2.78Å
136	F	86.4	Confident	81.3	Confident	131 Å²	131	90.4 Å²	90.4	58%	0.575	49%	0.493	S	S	*	.	H	α-helix	trans	-67.3	-40.5	175.2	-176	-105.6	0	0	0	111.6	A132 G133 L138 F139 L140	A132-F136 WeakPolarHBondContact O-CB 3.45Å; A132-F136 PolarHBondContact O-N 3.45Å; G133-F136 PolarHBondContact O-N 2.88Å; F136-L138 VanDerWaalsContact C-N 3.34Å; F136-L138 PolarHBondContact O-N 2.97Å; F136-F139 PolarHBondContact O-N 3.08Å; F136-L140 HydrophobicContact CD1-CD1 3.78Å; F136-L140 HydrophobicContact CD1-CG 4.25Å; F136-L140 HydrophobicContact CE1-CD1 3.37Å; F136-L140 HydrophobicContact CE1-CG 3.97Å; F136-L140 HydrophobicContact CZ-CD1 3.94Å; F136-L140 HydrophobicContact CZ-CD2 4.28Å; F136-L140 HydrophobicContact CZ-CG 4.14Å; F136-L140 WeakPolarHBondContact O-CB 3.31Å; F136-L140 WeakPolarHBondContact O-CG 3.42Å; F136-L140 PolarHBondContact O-N 2.81Å
137	L	87.6	Confident	82.8	Confident	105 Å²	105	90.5 Å²	90.5	55%	0.55	50%	0.496	S	S	.	.	H	α-helix	trans	-61.1	-42.6	172.6	-108.5	159.7	0	0	0	111.8	G133 P134 F139 L140 I141	G133-L137 WeakPolarHBondContact O-CB 3.31Å; G133-L137 PolarHBondContact O-N 2.99Å; P134-L137 PolarHBondContact O-N 2.87Å; L137-F139 VanDerWaalsContact C-N 3.35Å; L137-L140 PolarHBondContact O-N 3.13Å; L137-I141 WeakPolarHBondContact O-CB 3.29Å; L137-I141 WeakPolarHBondContact O-CD1 3.41Å; L137-I141 WeakPolarHBondContact O-CG1 3.37Å; L137-I141 PolarHBondContact O-N 3.17Å
138	L	90.4	Very high	84.2	Confident	108 Å²	108	88.7 Å²	88.7	57%	0.565	49%	0.489	S	S	*	.	H	α-helix	trans	-66.4	-39.6	177.9	-147.5	156.1	0	0	0	110.7	P134 V135 F136 I141 I142	P134-L138 VanDerWaalsContact O-CB 3.31Å; P134-L138 WeakPolarHBondContact O-CB 3.36Å; P134-L138 PolarHBondContact O-N 3.24Å; V135-L138 PolarHBondContact O-N 3.02Å; F136-L138 VanDerWaalsContact C-N 3.34Å; F136-L138 PolarHBondContact O-N 2.97Å; L138-I141 PolarHBondContact O-N 2.91Å; L138-I142 HydrophobicContact CD2-CD1 3.62Å; L138-I142 HydrophobicContact CD2-CG1 4.22Å; L138-I142 VanDerWaalsContact O-CG1 3.28Å; L138-I142 WeakPolarHBondContact O-CG1 3.35Å; L138-I142 PolarHBondContact O-N 3.12Å
139	F	90.7	Very high	85.2	Confident	130 Å²	130	88 Å²	88	57%	0.57	48%	0.481	S	S	*	.	H	α-helix	trans	-66.3	-41.2	174.7	-150	-96.9	0	0	0	112.2	V135 F136 L137 I142 I143	V135-F139 WeakPolarHBondContact O-CB 3.28Å; V135-F139 PolarHBondContact O-N 2.78Å; F136-F139 PolarHBondContact O-N 3.08Å; L137-F139 VanDerWaalsContact C-N 3.35Å; F139-I142 PolarHBondContact O-N 3.49Å; F139-I143 HydrophobicContact CD1-CD1 3.62Å; F139-I143 HydrophobicContact CD1-CG1 4.25Å; F139-I143 HydrophobicContact CE1-CD1 3.78Å; F139-I143 HydrophobicContact CE1-CG1 4.36Å; F139-I143 WeakPolarHBondContact O-CG1 3.33Å; F139-I143 PolarHBondContact O-N 2Å
140	L	92	Very high	86	Confident	70 Å²	70	88.4 Å²	88.4	37%	0.366	47%	0.473	S	S	.	.	H	α-helix	trans	-64	-40.6	173.5	-76.3	-179.9	0	0	0	111.8	F136 L137 I143 I144	F136-L140 HydrophobicContact CD1-CD1 3.78Å; F136-L140 HydrophobicContact CD1-CG 4.25Å; F136-L140 HydrophobicContact CE1-CD1 3.37Å; F136-L140 HydrophobicContact CE1-CG 3.97Å; F136-L140 HydrophobicContact CZ-CD1 3.94Å; F136-L140 HydrophobicContact CZ-CD2 4.28Å; F136-L140 HydrophobicContact CZ-CG 4.14Å; F136-L140 WeakPolarHBondContact O-CB 3.31Å; F136-L140 WeakPolarHBondContact O-CG 3.42Å; F136-L140 PolarHBondContact O-N 2.81Å; L137-L140 PolarHBondContact O-N 3.13Å; L140-I143 PolarHBondContact O-N 2.88Å; L140-I144 WeakPolarHBondContact O-CB 3.45Å; L140-I144 WeakPolarHBondContact O-CG1 3.45Å; L140-I144 PolarHBondContact O-N 3.11Å
141	I	92.4	Very high	86.7	Confident	92 Å²	92	91.2 Å²	91.2	47%	0.472	48%	0.479	S	S	.	.	H	α-helix	trans	-63.1	-43.6	174.7	-70	163.8	0	0	0	110.2	L137 L138 I143 I144 V145	L137-I141 WeakPolarHBondContact O-CB 3.29Å; L137-I141 WeakPolarHBondContact O-CD1 3.41Å; L137-I141 WeakPolarHBondContact O-CG1 3.37Å; L137-I141 PolarHBondContact O-N 3.17Å; L138-I141 PolarHBondContact O-N 2.91Å; I141-I143 PolarHBondContact O-N 3.03Å; I141-I144 PolarHBondContact O-N 2.9Å; I141-V145 HydrophobicContact CG2-CG2 4.26Å; I141-V145 WeakPolarHBondContact O-CB 3.38Å; I141-V145 VanDerWaalsContact O-CG2 3.23Å; I141-V145 WeakPolarHBondContact O-CG2 3.25Å; I141-V145 PolarHBondContact O-N 3.19Å
142	I	91.1	Very high	87	Confident	94 Å²	94	91.9 Å²	91.9	48%	0.482	48%	0.479	S	S	.	.	H	α-helix	trans	-61.7	-43.4	176	-70.1	166.8	0	0	0	110.9	L138 F139 V145 F146	L138-I142 HydrophobicContact CD2-CD1 3.62Å; L138-I142 HydrophobicContact CD2-CG1 4.22Å; L138-I142 VanDerWaalsContact O-CG1 3.28Å; L138-I142 WeakPolarHBondContact O-CG1 3.35Å; L138-I142 PolarHBondContact O-N 3.12Å; F139-I142 PolarHBondContact O-N 3.49Å; I142-V145 PolarHBondContact O-N 3.13Å; I142-F146 VanDerWaalsContact O-CB 3.24Å; I142-F146 WeakPolarHBondContact O-CB 3.25Å; I142-F146 PolarHBondContact O-N 2.03Å
143	I	91.6	Very high	87	Confident	70 Å²	70	94.7 Å²	94.7	36%	0.359	48%	0.484	S	S	.	.	H	α-helix	trans	-63.9	-44.8	176.5	-70.4	169.9	0	0	0	110.6	F139 L140 I141 F146 L147	F139-I143 HydrophobicContact CD1-CD1 3.62Å; F139-I143 HydrophobicContact CD1-CG1 4.25Å; F139-I143 HydrophobicContact CE1-CD1 3.78Å; F139-I143 HydrophobicContact CE1-CG1 4.36Å; F139-I143 WeakPolarHBondContact O-CG1 3.33Å; F139-I143 PolarHBondContact O-N 2Å; L140-I143 PolarHBondContact O-N 2.88Å; I141-I143 PolarHBondContact O-N 3.03Å; I143-F146 PolarHBondContact O-N 3Å; I143-L147 HydrophobicContact CG2-CD1 3.79Å; I143-L147 HydrophobicContact CG2-CG 4.18Å; I143-L147 WeakPolarHBondContact O-CB 2.9Å; I143-L147 VanDerWaalsContact O-CG 3.24Å; I143-L147 WeakPolarHBondContact O-CG 2.97Å; I143-L147 PolarHBondContact O-N 3.48Å
144	I	92.2	Very high	86.9	Confident	99 Å²	99	102.4 Å²	102.4	51%	0.508	50%	0.503	S	S	.	.	H	α-helix	trans	-62.9	-45	177.8	-70	165.9	0	0	0	110	L140 I141 F146 L147 V148	L140-I144 WeakPolarHBondContact O-CB 3.45Å; L140-I144 WeakPolarHBondContact O-CG1 3.45Å; L140-I144 PolarHBondContact O-N 3.11Å; I141-I144 PolarHBondContact O-N 2.9Å; I144-F146 VanDerWaalsContact C-N 3.34Å; I144-F146 PolarHBondContact O-N 2.85Å; I144-L147 PolarHBondContact O-N 3.41Å; I144-V148 HydrophobicContact CG2-CG2 4.13Å; I144-V148 VanDerWaalsContact O-CB 3.27Å; I144-V148 WeakPolarHBondContact O-CB 3.32Å; I144-V148 WeakPolarHBondContact O-CG2 3.34Å; I144-V148 PolarHBondContact O-N 2.83Å
145	V	92.9	Very high	86.6	Confident	74 Å²	74	101 Å²	101	45%	0.448	49%	0.493	S	S	.	.	H	α-helix	trans	-61.5	-43	175.5	169.6	0	0	0	0	110.7	I141 I142 V148 I149	I141-V145 HydrophobicContact CG2-CG2 4.26Å; I141-V145 WeakPolarHBondContact O-CB 3.38Å; I141-V145 VanDerWaalsContact O-CG2 3.23Å; I141-V145 WeakPolarHBondContact O-CG2 3.25Å; I141-V145 PolarHBondContact O-N 3.19Å; I142-V145 PolarHBondContact O-N 3.13Å; V145-V148 PolarHBondContact O-N 3.16Å; V145-I149 HydrophobicContact CG1-CD1 3.67Å; V145-I149 HydrophobicContact CG1-CG1 4.32Å; V145-I149 WeakPolarHBondContact O-CB 3.34Å; V145-I149 WeakPolarHBondContact O-CG1 3.49Å; V145-I149 PolarHBondContact O-N 2.9Å
146	F	91.1	Very high	85.6	Confident	130 Å²	130	104 Å²	104	57%	0.57	50%	0.495	S	S	*	.	H	α-helix	trans	-64.3	-41.3	176	-176.9	-104.4	0	0	0	111.9	I142 I143 I144 I149 N150	I142-F146 VanDerWaalsContact O-CB 3.24Å; I142-F146 WeakPolarHBondContact O-CB 3.25Å; I142-F146 PolarHBondContact O-N 2.03Å; I143-F146 PolarHBondContact O-N 3Å; I144-F146 VanDerWaalsContact C-N 3.34Å; I144-F146 PolarHBondContact O-N 2.85Å; F146-I149 PolarHBondContact O-N 2.72Å; F146-N150 WeakPolarHBondContact CD1-ND2 3Å; F146-N150 WeakPolarHBondContact CE1-ND2 3.04Å; F146-N150 WeakPolarHBondContact CE2-ND2 3.41Å; F146-N150 WeakPolarHBondContact CZ-ND2 3.01Å; F146-N150 VanDerWaalsContact O-CB 3.31Å; F146-N150 WeakPolarHBondContact O-CB 3.18Å; F146-N150 PolarHBondContact O-N 2.83Å; F146-N150 PolarHBondContact O-ND2 3Å
147	L	89.7	Confident	84.5	Confident	103 Å²	103	104 Å²	104	54%	0.539	50%	0.496	S	S	.	.	H	α-helix	trans	-68.9	-38	176.1	-72	175.1	0	0	0	111.8	I143 I144 N150 Y151	I143-L147 HydrophobicContact CG2-CD1 3.79Å; I143-L147 HydrophobicContact CG2-CG 4.18Å; I143-L147 WeakPolarHBondContact O-CB 2.9Å; I143-L147 VanDerWaalsContact O-CG 3.24Å; I143-L147 WeakPolarHBondContact O-CG 2.97Å; I143-L147 PolarHBondContact O-N 3.48Å; I144-L147 PolarHBondContact O-N 3.41Å; L147-N150 PolarHBondContact O-N 2.95Å; L147-Y151 WeakPolarHBondContact O-CA 3.35Å; L147-Y151 WeakPolarHBondContact O-CB 3.27Å; L147-Y151 PolarHBondContact O-N 2.89Å
148	V	90	Very high	83	Confident	68 Å²	68	103.1 Å²	103.1	41%	0.412	49%	0.493	S	S	.	.	H	α-helix	trans	-68.1	-42.1	174.8	168.8	0	0	0	0	109.9	I144 V145 Y151 H152	I144-V148 HydrophobicContact CG2-CG2 4.13Å; I144-V148 VanDerWaalsContact O-CB 3.27Å; I144-V148 WeakPolarHBondContact O-CB 3.32Å; I144-V148 WeakPolarHBondContact O-CG2 3.34Å; I144-V148 PolarHBondContact O-N 2.83Å; V145-V148 PolarHBondContact O-N 3.16Å; V148-Y151 PolarHBondContact O-N 3.17Å; V148-H152 VanDerWaalsContact O-CB 3.28Å; V148-H152 WeakPolarHBondContact O-CB 2.92Å; V148-H152 PolarHBondContact O-CD2 3.44Å; V148-H152 PolarHBondContact O-N 2.89Å
149	I	86.8	Confident	81.2	Confident	80 Å²	80	106.2 Å²	106.2	41%	0.41	50%	0.497	S	S	.	.	H	α-helix	trans	-64	-45.8	173.6	-71.1	168	0	0	0	110.2	V145 F146 Y151 H152 Q153	V145-I149 HydrophobicContact CG1-CD1 3.67Å; V145-I149 HydrophobicContact CG1-CG1 4.32Å; V145-I149 WeakPolarHBondContact O-CB 3.34Å; V145-I149 WeakPolarHBondContact O-CG1 3.49Å; V145-I149 PolarHBondContact O-N 2.9Å; F146-I149 PolarHBondContact O-N 2.72Å; I149-Y151 VanDerWaalsContact C-N 3.33Å; I149-Y151 PolarHBondContact O-N 3.02Å; I149-H152 PolarHBondContact O-N 2.81Å; I149-Q153 HydrophobicContact CG2-CG 4.23Å; I149-Q153 WeakPolarHBondContact O-CB 3.33Å; I149-Q153 WeakPolarHBondContact O-CG 3.13Å; I149-Q153 PolarHBondContact O-N 3.49Å
150	N	80.9	Confident	79.4	Confident	53 Å²	53	105.3 Å²	105.3	28%	0.283	49%	0.494	S	S	.	.	H	α-helix	trans	-67.6	-33.8	177	-77.9	-58	0	0	0	112.5	F146 L147 R154	F146-N150 WeakPolarHBondContact CD1-ND2 3Å; F146-N150 WeakPolarHBondContact CE1-ND2 3.04Å; F146-N150 WeakPolarHBondContact CE2-ND2 3.41Å; F146-N150 WeakPolarHBondContact CZ-ND2 3.01Å; F146-N150 VanDerWaalsContact O-CB 3.31Å; F146-N150 WeakPolarHBondContact O-CB 3.18Å; F146-N150 PolarHBondContact O-N 2.83Å; F146-N150 PolarHBondContact O-ND2 3Å; L147-N150 PolarHBondContact O-N 2.95Å; N150-R154 VanDerWaalsContact O-CB 3.23Å; N150-R154 WeakPolarHBondContact O-CB 3.05Å; N150-R154 PolarHBondContact O-N 3.28Å
151	Y	83.7	Confident	77.3	Confident	151 Å²	151	111.4 Å²	111.4	59%	0.592	51%	0.512	S	S	*	.	H	α-helix	trans	-70.1	-45.4	174.3	177.5	-100.3	0	0	0	110.5	L147 V148 I149 Q153 R154 V155	L147-Y151 WeakPolarHBondContact O-CA 3.35Å; L147-Y151 WeakPolarHBondContact O-CB 3.27Å; L147-Y151 PolarHBondContact O-N 2.89Å; V148-Y151 PolarHBondContact O-N 3.17Å; I149-Y151 VanDerWaalsContact C-N 3.33Å; I149-Y151 PolarHBondContact O-N 3.02Å; Y151-Q153 VanDerWaalsContact C-N 3.35Å; Y151-R154 CarbonylContact O-C 3.59Å; Y151-R154 PolarHBondContact O-N 3.28Å; Y151-V155 HydrophobicContact CD1-CG2 4.09Å; Y151-V155 HydrophobicContact CD2-CG2 4.09Å; Y151-V155 HydrophobicContact CE1-CG2 3.74Å; Y151-V155 HydrophobicContact CE2-CG2 3.72Å; Y151-V155 HydrophobicContact CG-CG2 4.26Å; Y151-V155 VanDerWaalsContact O-CB 3.22Å; Y151-V155 WeakPolarHBondContact O-CB 3.23Å; Y151-V155 WeakPolarHBondContact O-CG2 3.39Å; Y151-V155 PolarHBondContact O-N 3.4Å
152	H	77.6	Confident	75.2	Confident	119 Å²	119	113.1 Å²	113.1	55%	0.551	52%	0.522	S	S	*	.	H	α-helix	trans	-65.2	-37.1	172.9	-87.1	-83.1	0	0	0	111.5	V148 I149 Y156	V148-H152 VanDerWaalsContact O-CB 3.28Å; V148-H152 WeakPolarHBondContact O-CB 2.92Å; V148-H152 PolarHBondContact O-CD2 3.44Å; V148-H152 PolarHBondContact O-N 2.89Å; I149-H152 PolarHBondContact O-N 2.81Å; H152-Y156 WeakPolarHBondContact O-CA 3.42Å; H152-Y156 WeakPolarHBondContact O-CB 3.44Å; H152-Y156 PolarHBondContact O-N 2.03Å
153	Q	73.8	Confident	72.7	Confident	110 Å²	110	115 Å²	115	51%	0.514	53%	0.533	S	S	.	.	H	α-helix	trans	-67.2	-41.9	173.5	-77.6	175.7	-5.1	0	0	110.8	I149 Y151 H157	I149-Q153 HydrophobicContact CG2-CG 4.23Å; I149-Q153 WeakPolarHBondContact O-CB 3.33Å; I149-Q153 WeakPolarHBondContact O-CG 3.13Å; I149-Q153 PolarHBondContact O-N 3.49Å; Y151-Q153 VanDerWaalsContact C-N 3.35Å; Q153-H157 VanDerWaalsContact O-CB 3.24Å; Q153-H157 WeakPolarHBondContact O-CB 3.49Å; Q153-H157 PolarHBondContact O-N 3.03Å
154	R	76.9	Confident	70.6	Confident	192 Å²	192	119.2 Å²	119.2	73%	0.725	55%	0.553	S	S	*	*	H	α-helix	trans	-68	-40.3	174.5	-92.9	-176.6	170.4	173	-1.7	112.9	N150 Y151 H157 N158	N150-R154 VanDerWaalsContact O-CB 3.23Å; N150-R154 WeakPolarHBondContact O-CB 3.05Å; N150-R154 PolarHBondContact O-N 3.28Å; Y151-R154 CarbonylContact O-C 3.59Å; Y151-R154 PolarHBondContact O-N 3.28Å; R154-H157 PolarHBondContact O-N 2.93Å; R154-N158 WeakPolarHBondContact O-CA 3.04Å; R154-N158 WeakPolarHBondContact O-CB 3.3Å; R154-N158 PolarHBondContact O-N 2.03Å
155	V	74.9	Confident	68	Low	48 Å²	48	122.7 Å²	122.7	29%	0.291	57%	0.567	S	S	.	*	H	α-helix	trans	-72.6	-38.3	177.1	170.7	0	0	0	0	109.6	Y151 N158 R159	Y151-V155 HydrophobicContact CD1-CG2 4.09Å; Y151-V155 HydrophobicContact CD2-CG2 4.09Å; Y151-V155 HydrophobicContact CE1-CG2 3.74Å; Y151-V155 HydrophobicContact CE2-CG2 3.72Å; Y151-V155 HydrophobicContact CG-CG2 4.26Å; Y151-V155 VanDerWaalsContact O-CB 3.22Å; Y151-V155 WeakPolarHBondContact O-CB 3.23Å; Y151-V155 WeakPolarHBondContact O-CG2 3.39Å; Y151-V155 PolarHBondContact O-N 3.4Å; V155-N158 CarbonylContact O-C 3.6Å; V155-N158 PolarHBondContact O-N 3.29Å; V155-R159 WeakPolarHBondContact O-CA 3.29Å; V155-R159 WeakPolarHBondContact O-CB 3Å; V155-R159 PolarHBondContact O-N 2.8Å
156	Y	65.3	Low	65.5	Low	158 Å²	158	124 Å²	124	62%	0.62	57%	0.572	S	S	*	*	H	α-helix	trans	-65.1	-42.2	171.6	-166.9	-90.4	0	0	0	110.7	H152 R159 Q160	H152-Y156 WeakPolarHBondContact O-CA 3.42Å; H152-Y156 WeakPolarHBondContact O-CB 3.44Å; H152-Y156 PolarHBondContact O-N 2.03Å; Y156-R159 PolarHBondContact O-N 3.15Å; Y156-Q160 HydrophobicContact CE1-CG 4.34Å; Y156-Q160 VanDerWaalsContact O-CB 3.31Å; Y156-Q160 WeakPolarHBondContact O-CB 3.02Å; Y156-Q160 PolarHBondContact O-N 2.89Å
157	H	62.2	Low	63.1	Low	129 Å²	129	123.5 Å²	123.5	60%	0.597	58%	0.582	S	S	*	*	H	α-helix	trans	-64.1	-39.5	171.4	-110.6	-61.3	0	0	0	113	Q153 R154 R161	Q153-H157 VanDerWaalsContact O-CB 3.24Å; Q153-H157 WeakPolarHBondContact O-CB 3.49Å; Q153-H157 PolarHBondContact O-N 3.03Å; R154-H157 PolarHBondContact O-N 2.93Å; H157-R161 PolarHBondContact O-N 3.28Å; H157-R161 VanDerWaalsContact O-N 3.07Å
158	N	56.5	Low	60.5	Low	88 Å²	88	123.8 Å²	123.8	47%	0.471	59%	0.592	S	S	.	*	H	α-helix	trans	-76.8	-30.9	179.3	-86.6	-6.6	0	0	0	112.1	R154 V155 R161 L162	R154-N158 WeakPolarHBondContact O-CA 3.04Å; R154-N158 WeakPolarHBondContact O-CB 3.3Å; R154-N158 PolarHBondContact O-N 2.03Å; V155-N158 CarbonylContact O-C 3.6Å; V155-N158 PolarHBondContact O-N 3.29Å; N158-R161 CarbonylContact O-C 3.55Å; N158-R161 WeakPolarHBondContact O-CA 3.02Å; N158-R161 VanDerWaalsContact O-CB 3.31Å; N158-R161 WeakPolarHBondContact O-CB 3.45Å; N158-R161 PolarHBondContact O-N 3.49Å; N158-L162 WeakPolarHBondContact O-CG 3.34Å; N158-L162 PolarHBondContact O-N 3Å
159	R	53.7	Low	57.9	Low	172 Å²	172	126 Å²	126	65%	0.649	61%	0.609	S	S	*	*	H	α-helix	trans	-78	-36.4	176.4	-155.2	174.2	-163.6	-177.8	4	110.5	V155 Y156 R161 L162 D163	V155-R159 WeakPolarHBondContact O-CA 3.29Å; V155-R159 WeakPolarHBondContact O-CB 3Å; V155-R159 PolarHBondContact O-N 2.8Å; Y156-R159 PolarHBondContact O-N 3.15Å; R159-R161 PolarHBondContact O-N 2.8Å; R159-L162 PolarHBondContact O-N 2.87Å; R159-D163 WeakPolarHBondContact O-CB 3.03Å; R159-D163 PolarHBondContact O-N 2.02Å
160	Q	52.2	Low	55.7	Low	111 Å²	111	131.2 Å²	131.2	52%	0.519	63%	0.632	S	S	.	*	H	α-helix	trans	-62.5	-25.6	162.4	-87.6	-175.9	-30.2	0	0	113.2	Y156	Y156-Q160 HydrophobicContact CE1-CG 4.34Å; Y156-Q160 VanDerWaalsContact O-CB 3.31Å; Y156-Q160 WeakPolarHBondContact O-CB 3.02Å; Y156-Q160 PolarHBondContact O-N 2.89Å
161	R	48.7	Very low	53.9	Low	198 Å²	198	132.1 Å²	132.1	75%	0.747	64%	0.635	S	S	*	*	H	α-helix	trans	-78.7	-29.1	171.8	-98.1	-174	160.7	177.1	-5.2	113.7	H157 N158 R159	H157-R161 PolarHBondContact O-N 3.28Å; H157-R161 VanDerWaalsContact O-N 3.07Å; N158-R161 CarbonylContact O-C 3.55Å; N158-R161 WeakPolarHBondContact O-CA 3.02Å; N158-R161 VanDerWaalsContact O-CB 3.31Å; N158-R161 WeakPolarHBondContact O-CB 3.45Å; N158-R161 PolarHBondContact O-N 3.49Å; R159-R161 PolarHBondContact O-N 2.8Å
162	L	46.7	Very low	51.8	Low	129 Å²	129	130.8 Å²	130.8	68%	0.675	65%	0.647	S	S	*	*	H	α-helix	trans	-94.7	-26.3	-176.9	-78.5	159.2	0	0	0	113.4	N158 R159 M164	N158-L162 WeakPolarHBondContact O-CG 3.34Å; N158-L162 PolarHBondContact O-N 3Å; R159-L162 PolarHBondContact O-N 2.87Å; L162-M164 PolarHBondContact O-N 2.76Å
163	D	39.8	Very low	50	Low	134 Å²	134	129.2 Å²	129.2	72%	0.717	64%	0.642	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.8	9	171.2	-71.4	-26.7	0	0	0	112.4	R159	R159-D163 WeakPolarHBondContact O-CB 3.03Å; R159-D163 PolarHBondContact O-N 2.02Å
164	M	46	Very low	48.3	Very low	158 Å²	158	126.8 Å²	126.8	78%	0.778	64%	0.637	S	S	*	*	T	Hydrogen-bonded Turn	trans	-111.3	32.2	177.6	-150.2	171	111.3	0	0	112.3	L162	L162-M164 PolarHBondContact O-N 2.76Å
165	E	39	Very low	46.8	Very low	171 Å²	171	127.9 Å²	127.9	80%	0.799	65%	0.647	S	S	*	*	S	Bend	trans	-128.8	73.9	164.2	-77	-175.6	145	0	0	110.6
166	D	39	Very low	45.6	Very low	103 Å²	103	132.6 Å²	132.6	55%	0.551	67%	0.671	S	S	*	*			trans	60.2	140.7	140.7	-130.7	30.4	0	0	0	121.5	S168 C169	D166-S168 PolarHBondContact OD1-N 3.29Å; D166-S168 PolarHBondContact OD2-N 2.94Å; D166-C169 PolarHBondContact OD1-N 3.3Å
167	P	40.8	Very low	45	Very low	119 Å²	119	129 Å²	129	77%	0.773	66%	0.658	S	S	*	*	S	Bend		-134.5	134.3	77.3	30.6	-13.4	0	0	0	114
168	S	35.3	Very low	45.3	Very low	108 Å²	108	126.1 Å²	126.1	76%	0.755	65%	0.65	S	S	*	*	S	Bend	trans	95.6	58.3	173.3	76	0	0	0	0	118	D166	D166-S168 PolarHBondContact OD1-N 3.29Å; D166-S168 PolarHBondContact OD2-N 2.94Å
169	C	36.6	Very low	45.8	Very low	114 Å²	114	123 Å²	123	77%	0.77	63%	0.633	S	S	*	*				-164.7	90.2	124.1	-97.9	0	0	0	0	110.1	D166 M171	D166-C169 PolarHBondContact OD1-N 3.3Å; C169-M171 PolarHBondContact O-N 2.92Å
170	E	39.9	Very low	46.3	Very low	190 Å²	190	118.8 Å²	118.8	89%	0.888	62%	0.621	S	S	*	*			trans	-58.7	90.5	154	-86.9	-165.9	146.2	0	0	109.2
171	M	42.2	Very low	47	Very low	73 Å²	73	116.6 Å²	116.6	36%	0.36	61%	0.613	S	S	.	*			trans	-156.8	62.1	142.9	-144.9	139.4	65.9	0	0	110.2	C169 L173 K177 L182 D185	C169-M171 PolarHBondContact O-N 2.92Å; M171-L173 PolarHBondContact O-N 2.96Å; M171-K177 HydrophobicContact SD-CD 4.43Å; M171-L182 HydrophobicContact CB-CD1 4.02Å; M171-L182 HydrophobicContact CE-CD1 3.48Å; M171-L182 VanDerWaalsContact CE-CD1 3.48Å; M171-L182 HydrophobicContact CE-CG 3.64Å; M171-L182 HydrophobicContact CG-CD1 3.63Å; M171-L182 HydrophobicContact SD-CD1 4.24Å; M171-D185 HydrophobicContact CE-CB 4.47Å
172	C	39.6	Very low	47.8	Very low	123 Å²	123	107.6 Å²	107.6	83%	0.831	58%	0.579	S	S	*	*	S	Bend	trans	-59.1	134.4	150.5	-142.8	0	0	0	0	106.4	S174	C172-S174 PolarHBondContact O-N 3.14Å
173	L	39.9	Very low	48.8	Very low	86 Å²	86	101.4 Å²	101.4	45%	0.45	55%	0.547	S	S	.	.			trans	-51	104.5	174.2	-111.7	88.8	0	0	0	107.3	M171 K177	M171-L173 PolarHBondContact O-N 2.96Å; L173-K177 WeakPolarHBondContact CD2-O 3.45Å; L173-K177 VanDerWaalsContact CG-O 3.29Å; L173-K177 WeakPolarHBondContact CG-O 3.39Å
174	S	39.4	Very low	50	Low	59 Å²	59	101.7 Å²	101.7	41%	0.413	54%	0.539	S	S	.	.			trans	-58.3	150.1	161	55.6	0	0	0	0	106.3	C172 D176 K177	C172-S174 PolarHBondContact O-N 3.14Å; S174-D176 PolarHBondContact O-N 3.18Å; S174-K177 PolarHBondContact O-N 3.23Å
175	K	44.8	Very low	50.7	Low	214 Å²	214	97.4 Å²	97.4	93%	0.93	52%	0.519	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55	-8.6	-174.2	-143	173.4	-178.9	179.2	0	114
176	D	50.1	Low	51.7	Low	148 Å²	148	92.3 Å²	92.3	79%	0.791	50%	0.497	S	S	*	.	T	Hydrogen-bonded Turn	trans	-115.7	-6.8	-175.1	-53.5	-44.4	0	0	0	115.2	S174	S174-D176 PolarHBondContact O-N 3.18Å
177	K	51.3	Low	52.5	Low	82 Å²	82	88.5 Å²	88.5	36%	0.357	48%	0.479	S	S	.	.			trans	-101.8	130.5	178.9	-76.2	-167.9	175.2	-165.6	0	111.8	M171 L173 S174 D185	M171-K177 HydrophobicContact SD-CD 4.43Å; L173-K177 WeakPolarHBondContact CD2-O 3.45Å; L173-K177 VanDerWaalsContact CG-O 3.29Å; L173-K177 WeakPolarHBondContact CG-O 3.39Å; S174-K177 PolarHBondContact O-N 3.23Å; K177-D185 IonicContact NZ-OD2 3.32Å
178	T	70	Confident	53.2	Low	69 Å²	69	87.7 Å²	87.7	42%	0.423	47%	0.471	S	S	.	.			trans	-88.6	161.3	177.5	70	0	0	0	0	111.6	Q180 D181 L182	T178-Q180 PolarHBondContact O-N 2.81Å; T178-D181 WeakPolarHBondContact CB-OD2 3.08Å; T178-D181 PolarHBondContact N-OD2 3.19Å; T178-D181 WeakPolarHBondContact O-CB 3.26Å; T178-D181 PolarHBondContact O-N 3.26Å; T178-D181 PolarHBondContact OG1-N 2.88Å; T178-D181 PolarHBondContact OG1-OD2 3Å; T178-L182 PolarHBondContact O-N 2.81Å
179	L	67.5	Low	54	Low	23 Å²	23	87.3 Å²	87.3	12%	0.12	47%	0.469	C	S	.	.	H	α-helix	trans	-58.1	-30.3	174.5	-171.5	137.1	0	0	0	112.1	L182 V183 W226 R227 V231 I265	L179-L182 PolarHBondContact O-N 2.86Å; L179-V183 HydrophobicContact CD2-CG2 4.27Å; L179-V183 WeakPolarHBondContact O-CG2 3.41Å; L179-V183 PolarHBondContact O-N 2.83Å; L179-V183 VanDerWaalsContact O-N 3.14Å; L179-W226 HydrophobicContact CD1-CE3 3.87Å; L179-W226 HydrophobicContact CD1-CZ3 4.41Å; L179-W226 WeakPolarHBondContact CD1-O 3.38Å; L179-W226 HydrophobicContact CD2-CE3 4.18Å; L179-W226 HydrophobicContact CD2-CZ3 4.3Å; L179-W226 HydrophobicContact CG-CE3 4.37Å; L179-W226 HydrophobicContact CG-CZ3 4.48Å; L179-R227 HydrophobicContact CD1-CB 4.38Å; L179-V231 HydrophobicContact CD2-CG1 4.37Å; L179-I265 HydrophobicContact CD2-CD1 4.23Å
180	Q	63.5	Low	54.7	Low	83 Å²	83	84 Å²	84	39%	0.388	45%	0.453	S	S	.	.	H	α-helix	trans	-65.9	-37.9	175.9	-72.4	178.3	-34.5	0	0	112.4	T178 V183 Y184 D283	T178-Q180 PolarHBondContact O-N 2.81Å; Q180-V183 PolarHBondContact O-N 2.82Å; Q180-Y184 WeakPolarHBondContact O-CB 3.32Å; Q180-Y184 PolarHBondContact O-N 3.33Å; Q180-D283 PolarHBondContact NE2-OD2 3.44Å
181	D	66.3	Low	55.3	Low	65 Å²	65	79.9 Å²	79.9	35%	0.348	45%	0.446	S	S	.	.	H	α-helix	trans	-66.6	-40.4	177.3	-55.9	-42.2	0	0	0	110.8	T178 V183 Y184 D185	T178-D181 WeakPolarHBondContact CB-OD2 3.08Å; T178-D181 PolarHBondContact N-OD2 3.19Å; T178-D181 WeakPolarHBondContact O-CB 3.26Å; T178-D181 PolarHBondContact O-N 3.26Å; T178-D181 PolarHBondContact OG1-N 2.88Å; T178-D181 PolarHBondContact OG1-OD2 3Å; D181-V183 PolarHBondContact O-N 3.38Å; D181-Y184 WeakPolarHBondContact O-CB 3.47Å; D181-Y184 PolarHBondContact O-N 3.46Å; D181-D185 PolarHBondContact O-N 3.34Å
182	L	66.5	Low	56.1	Low	8 Å²	8	77.9 Å²	77.9	4%	0.042	44%	0.444	C	S	.	.	H	α-helix	trans	-64.1	-42.3	177.8	-155.4	118.3	0	0	0	112.2	M171 T178 L179 Y184 L186 R227	M171-L182 HydrophobicContact CB-CD1 4.02Å; M171-L182 HydrophobicContact CE-CD1 3.48Å; M171-L182 VanDerWaalsContact CE-CD1 3.48Å; M171-L182 HydrophobicContact CE-CG 3.64Å; M171-L182 HydrophobicContact CG-CD1 3.63Å; M171-L182 HydrophobicContact SD-CD1 4.24Å; T178-L182 PolarHBondContact O-N 2.81Å; L179-L182 PolarHBondContact O-N 2.86Å; L182-Y184 VanDerWaalsContact C-N 3.33Å; L182-L186 HydrophobicContact CD2-CD1 3.86Å; L182-L186 HydrophobicContact CG-CD1 4.4Å; L182-L186 WeakPolarHBondContact O-CB 3.36Å; L182-L186 WeakPolarHBondContact O-CD1 3.31Å; L182-L186 VanDerWaalsContact O-CG 3.29Å; L182-L186 WeakPolarHBondContact O-CG 3.32Å; L182-L186 PolarHBondContact O-N 2.79Å; L182-R227 VanDerWaalsContact CD2-NH1 3.31Å
183	V	67.3	Low	57.1	Low	0 Å²	0	72.7 Å²	72.7	0%	0	41%	0.409	C	S	.	.	H	α-helix	trans	-66.9	-38.3	174.7	176	0	0	0	0	110.5	L179 Q180 D181 L186 S187 W226 I265	L179-V183 HydrophobicContact CD2-CG2 4.27Å; L179-V183 WeakPolarHBondContact O-CG2 3.41Å; L179-V183 PolarHBondContact O-N 2.83Å; L179-V183 VanDerWaalsContact O-N 3.14Å; Q180-V183 PolarHBondContact O-N 2.82Å; D181-V183 PolarHBondContact O-N 3.38Å; V183-L186 PolarHBondContact O-N 2.96Å; V183-S187 WeakPolarHBondContact O-CB 3.48Å; V183-S187 PolarHBondContact O-N 3.42Å; V183-S187 VanDerWaalsContact O-N 3.13Å; V183-S187 PolarHBondContact O-OG 3.1Å; V183-W226 HydrophobicContact CG2-CZ3 4.3Å; V183-I265 HydrophobicContact CG2-CG1 4.42Å; V183-I265 HydrophobicContact CG2-CG2 4.44Å
184	Y	65	Low	58	Low	139 Å²	139	68.9 Å²	68.9	55%	0.545	39%	0.39	S	S	.	.	H	α-helix	trans	-61	-52.4	176.8	-173.1	-95.9	0	0	0	111.3	Q180 D181 L182 L186 S187	Q180-Y184 WeakPolarHBondContact O-CB 3.32Å; Q180-Y184 PolarHBondContact O-N 3.33Å; D181-Y184 WeakPolarHBondContact O-CB 3.47Å; D181-Y184 PolarHBondContact O-N 3.46Å; L182-Y184 VanDerWaalsContact C-N 3.33Å; Y184-L186 VanDerWaalsContact C-N 3.29Å; Y184-L186 PolarHBondContact O-N 3.47Å; Y184-S187 WeakPolarHBondContact CA-OG 3.44Å; Y184-S187 PolarHBondContact O-N 2.84Å; Y184-S187 PolarHBondContact O-OG 2.9Å
185	D	61.3	Low	59.1	Low	68 Å²	68	66.3 Å²	66.3	36%	0.364	37%	0.372	S	S	.	.	H	α-helix	trans	-56.2	-42.9	179.2	-71.6	-14.4	0	0	0	111.5	M171 K177 D181 S187 T188	M171-D185 HydrophobicContact CE-CB 4.47Å; K177-D185 IonicContact NZ-OD2 3.32Å; D181-D185 PolarHBondContact O-N 3.34Å; D185-S187 VanDerWaalsContact C-N 3.31Å; D185-S187 PolarHBondContact O-N 2.99Å; D185-T188 PolarHBondContact O-OG1 3.16Å
186	L	59	Low	59.8	Low	65 Å²	65	59 Å²	59	34%	0.34	35%	0.347	S	S	.	.	H	α-helix	trans	-72.8	-18.1	179.5	-71.3	164.1	0	0	0	114.5	L182 V183 Y184 L195	L182-L186 HydrophobicContact CD2-CD1 3.86Å; L182-L186 HydrophobicContact CG-CD1 4.4Å; L182-L186 WeakPolarHBondContact O-CB 3.36Å; L182-L186 WeakPolarHBondContact O-CD1 3.31Å; L182-L186 VanDerWaalsContact O-CG 3.29Å; L182-L186 WeakPolarHBondContact O-CG 3.32Å; L182-L186 PolarHBondContact O-N 2.79Å; V183-L186 PolarHBondContact O-N 2.96Å; Y184-L186 VanDerWaalsContact C-N 3.29Å; Y184-L186 PolarHBondContact O-N 3.47Å; L186-L195 HydrophobicContact CB-CD2 3.66Å; L186-L195 HydrophobicContact CD1-CD2 3.5Å; L186-L195 HydrophobicContact CG-CD2 4.18Å
187	S	56.5	Low	60.3	Low	23 Å²	23	57.7 Å²	57.7	16%	0.161	34%	0.339	C	S	.	.	T	Hydrogen-bonded Turn	trans	-93.9	2.1	-178.1	57.7	0	0	0	0	114.2	V183 Y184 D185 S189	V183-S187 WeakPolarHBondContact O-CB 3.48Å; V183-S187 PolarHBondContact O-N 3.42Å; V183-S187 VanDerWaalsContact O-N 3.13Å; V183-S187 PolarHBondContact O-OG 3.1Å; Y184-S187 WeakPolarHBondContact CA-OG 3.44Å; Y184-S187 PolarHBondContact O-N 2.84Å; Y184-S187 PolarHBondContact O-OG 2.9Å; D185-S187 VanDerWaalsContact C-N 3.31Å; D185-S187 PolarHBondContact O-N 2.99Å; S187-S189 VanDerWaalsContact C-N 3.31Å; S187-S189 PolarHBondContact O-N 2.72Å
188	T	54.6	Low	60.3	Low	101 Å²	101	63 Å²	63	62%	0.62	36%	0.363	S	S	*	.			trans	-76.4	-8.9	178.4	52.3	0	0	0	0	114.7	D185 G190	D185-T188 PolarHBondContact O-OG1 3.16Å; T188-G190 PolarHBondContact O-N 3.43Å
189	S	53.3	Low	59.8	Low	101 Å²	101	62 Å²	62	71%	0.706	36%	0.356	S	S	*	.	S	Bend	trans	-78.4	63.8	170.9	-75.4	0	0	0	0	112.8	S187 S191	S187-S189 VanDerWaalsContact C-N 3.31Å; S187-S189 PolarHBondContact O-N 2.72Å; S189-S191 VanDerWaalsContact C-N 3.29Å; S189-S191 PolarHBondContact O-N 3.42Å
190	G	50.8	Low	59.5	Low	43 Å²	43	61.6 Å²	61.6	44%	0.443	35%	0.353	S	S	.	.	S	Bend	trans	48.6	-1.2	145.8	0	0	0	0	0	123.8	T188 Q326	T188-G190 PolarHBondContact O-N 3.43Å; G190-Q326 PolarHBondContact O-OE1 2.9Å
191	S	53.1	Low	59.4	Low	105 Å²	105	66.6 Å²	66.6	73%	0.734	37%	0.369	S	S	*	.	S	Bend	trans	-122.6	-4.1	-169.1	-57.1	0	0	0	0	116.1	S189	S189-S191 VanDerWaalsContact C-N 3.29Å; S189-S191 PolarHBondContact O-N 3.42Å
192	G	57.3	Low	59.7	Low	31 Å²	31	66.7 Å²	66.7	32%	0.32	37%	0.372	S	S	.	.			trans	167.3	167.4	178	0	0	0	0	0	113.5
193	S	60.6	Low	60.5	Low	13 Å²	13	66.4 Å²	66.4	9%	0.091	37%	0.37	C	S	.	.	S	Bend	trans	-80.5	124.1	170.6	33.7	0	0	0	0	111.1	Y251 T253 F264	S193-Y251 PolarHBondContact OG-O 3.48Å; S193-T253 PolarHBondContact OG-O 3.29Å; S193-F264 WeakPolarHBondContact O-CD1 3.39Å
194	G	60.1	Low	61.4	Low	6 Å²	6	66.4 Å²	66.4	6%	0.062	37%	0.37	C	S	.	.	S	Bend	trans	121.2	-173.4	178.1	0	0	0	0	0	113.3
195	L	61.6	Low	62.3	Low	6 Å²	6	69.3 Å²	69.3	3%	0.031	38%	0.38	C	S	.	.	S	Bend	trans	-74.6	158.4	178.8	-66.4	169.3	0	0	0	112	L186 V199 Q200 V203 W226 I265	L186-L195 HydrophobicContact CB-CD2 3.66Å; L186-L195 HydrophobicContact CD1-CD2 3.5Å; L186-L195 HydrophobicContact CG-CD2 4.18Å; L195-V199 HydrophobicContact CB-CB 4.23Å; L195-V199 HydrophobicContact CB-CG1 4.13Å; L195-V199 HydrophobicContact CD1-CG1 3.9Å; L195-V199 HydrophobicContact CG-CG1 4.41Å; L195-Q200 HydrophobicContact CB-CG 4.12Å; L195-Q200 VanDerWaalsContact O-CD 3.31Å; L195-Q200 VanDerWaalsContact O-CG 3.29Å; L195-Q200 WeakPolarHBondContact O-CG 3.49Å; L195-Q200 PolarHBondContact O-NE2 2.72Å; L195-V203 HydrophobicContact CD1-CG2 4.09Å; L195-W226 HydrophobicContact CD1-CH2 3.66Å; L195-W226 HydrophobicContact CD1-CZ2 4.27Å; L195-W226 HydrophobicContact CD1-CZ3 4.47Å; L195-I265 HydrophobicContact CD1-CG2 3.82Å; L195-I265 HydrophobicContact CG-CG2 4.45Å; L195-I265 PolarHBondContact N-O 3.19Å
196	P	61	Low	63.7	Low	61 Å²	61	70 Å²	70	40%	0.396	39%	0.387	S	S	.	.			trans	-56.1	146.1	172.2	-24.4	33.4	0	0	0	113	F198 V199 Q200	P196-F198 VanDerWaalsContact C-N 3.3Å; P196-F198 PolarHBondContact O-N 3.06Å; P196-F198 VanDerWaalsContact O-N 3.12Å; P196-V199 HydrophobicContact CB-CG2 4.32Å; P196-V199 HydrophobicContact CG-CG2 4.44Å; P196-V199 WeakPolarHBondContact O-CA 3.43Å; P196-V199 WeakPolarHBondContact O-CB 3.43Å; P196-V199 PolarHBondContact O-N 3.2Å; P196-Q200 PolarHBondContact O-N 3.16Å
197	L	60.8	Low	65.4	Low	120 Å²	120	67.1 Å²	67.1	63%	0.628	37%	0.372	S	S	*	.	H	α-helix	trans	-50.3	-40.7	-173.7	-75.3	168.5	0	0	0	114.8	Q200 R201	L197-Q200 PolarHBondContact O-N 3.28Å; L197-R201 PolarHBondContact O-N 2.85Å
198	F	51.1	Low	67.2	Low	194 Å²	194	70.7 Å²	70.7	85%	0.851	39%	0.393	S	S	*	.	H	α-helix	trans	-67.6	-36.1	177.8	-71.4	-72.2	0	0	0	112.7	P196	P196-F198 VanDerWaalsContact C-N 3.3Å; P196-F198 PolarHBondContact O-N 3.06Å; P196-F198 VanDerWaalsContact O-N 3.12Å
199	V	59.8	Low	69.1	Low	47 Å²	47	68.2 Å²	68.2	29%	0.285	38%	0.376	S	S	.	.	H	α-helix	trans	-69.5	-42.4	175.7	-178	0	0	0	0	109.4	L195 P196 R201 T202 V203	L195-V199 HydrophobicContact CB-CB 4.23Å; L195-V199 HydrophobicContact CB-CG1 4.13Å; L195-V199 HydrophobicContact CD1-CG1 3.9Å; L195-V199 HydrophobicContact CG-CG1 4.41Å; P196-V199 HydrophobicContact CB-CG2 4.32Å; P196-V199 HydrophobicContact CG-CG2 4.44Å; P196-V199 WeakPolarHBondContact O-CA 3.43Å; P196-V199 WeakPolarHBondContact O-CB 3.43Å; P196-V199 PolarHBondContact O-N 3.2Å; V199-R201 VanDerWaalsContact C-N 3.32Å; V199-R201 PolarHBondContact O-N 3.14Å; V199-T202 PolarHBondContact O-N 3.08Å; V199-T202 PolarHBondContact O-OG1 2.92Å; V199-V203 WeakPolarHBondContact O-CG2 3.46Å
200	Q	60.6	Low	71.1	Confident	14 Å²	14	67.3 Å²	67.3	7%	0.065	36%	0.36	C	S	.	.	H	α-helix	trans	-53.8	-44.1	179.9	-68.1	-177.3	-2.1	0	0	112.8	L195 P196 L197 T202 V203 A266 D268	L195-Q200 HydrophobicContact CB-CG 4.12Å; L195-Q200 VanDerWaalsContact O-CD 3.31Å; L195-Q200 VanDerWaalsContact O-CG 3.29Å; L195-Q200 WeakPolarHBondContact O-CG 3.49Å; L195-Q200 PolarHBondContact O-NE2 2.72Å; P196-Q200 PolarHBondContact O-N 3.16Å; L197-Q200 PolarHBondContact O-N 3.28Å; Q200-T202 PolarHBondContact O-N 3.22Å; Q200-V203 PolarHBondContact O-N 2.8Å; Q200-A266 HydrophobicContact CB-CB 4.18Å; Q200-A266 HydrophobicContact CG-CB 4.03Å; Q200-D268 WeakPolarHBondContact O-CB 3.42Å
201	R	60.9	Low	73.2	Confident	188 Å²	188	69.6 Å²	69.6	71%	0.709	36%	0.359	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.5	5.9	-178	-70.9	-172.3	179.2	-177.5	0.5	116.1	L197 V199 D268	L197-R201 PolarHBondContact O-N 2.85Å; V199-R201 VanDerWaalsContact C-N 3.32Å; V199-R201 PolarHBondContact O-N 3.14Å; R201-D268 VanDerWaalsContact CA-OD1 3.3Å; R201-D268 WeakPolarHBondContact CA-OD1 2.82Å
202	T	72.9	Confident	75.1	Confident	67 Å²	67	68.2 Å²	68.2	41%	0.411	34%	0.343	S	S	.	.	T	Hydrogen-bonded Turn	trans	-128.1	-4.3	179.1	61.8	0	0	0	0	113	V199 Q200 R205 D268	V199-T202 PolarHBondContact O-N 3.08Å; V199-T202 PolarHBondContact O-OG1 2.92Å; Q200-T202 PolarHBondContact O-N 3.22Å; T202-R205 PolarHBondContact O-N 2.96Å; T202-D268 PolarHBondContact N-OD2 3.04Å
203	V	83.5	Confident	76.8	Confident	2 Å²	2	70.2 Å²	70.2	1%	0.012	35%	0.345	C	S	.	.	H	α-helix	trans	-64.6	-48.5	-175.2	172.9	0	0	0	0	110.2	L195 V199 Q200 R205 T206 I207 W226 A266 D268 V281	L195-V203 HydrophobicContact CD1-CG2 4.09Å; V199-V203 WeakPolarHBondContact O-CG2 3.46Å; Q200-V203 PolarHBondContact O-N 2.8Å; V203-R205 PolarHBondContact O-N 3.11Å; V203-R205 VanDerWaalsContact O-N 3.16Å; V203-T206 PolarHBondContact O-N 3.02Å; V203-T206 PolarHBondContact O-OG1 3.34Å; V203-I207 HydrophobicContact CG1-CD1 3.57Å; V203-I207 HydrophobicContact CG1-CG1 4.21Å; V203-I207 WeakPolarHBondContact O-CG1 3.46Å; V203-I207 PolarHBondContact O-N 2.68Å; V203-W226 HydrophobicContact CG1-CD2 4.5Å; V203-W226 HydrophobicContact CG1-CZ2 4.41Å; V203-W226 HydrophobicContact CG2-CZ2 4.24Å; V203-A266 HydrophobicContact CB-CB 4.08Å; V203-A266 HydrophobicContact CG1-CB 4.23Å; V203-A266 HydrophobicContact CG2-CB 3.83Å; V203-D268 PolarHBondContact N-OD2 3.42Å; V203-D268 VanDerWaalsContact N-OD2 3.09Å; V203-V281 HydrophobicContact CG1-CG1 4.46Å; V203-V281 HydrophobicContact CG1-CG2 4.22Å
204	A	84.7	Confident	78	Confident	0 Å²	0	70.9 Å²	70.9	0%	0	35%	0.354	C	S	.	.	H	α-helix	trans	-62.3	-28	-175	0	0	0	0	0	113.6	T206 D268 K270 W279	A204-T206 VanDerWaalsContact C-N 3.28Å; A204-T206 PolarHBondContact O-N 2.76Å; A204-D268 HydrophobicContact CB-CB 3.88Å; A204-D268 VanDerWaalsContact CB-OD2 3.28Å; A204-D268 WeakPolarHBondContact CB-OD2 3.09Å; A204-D268 PolarHBondContact N-OD2 3.24Å; A204-K270 HydrophobicContact CB-CB 4.2Å; A204-K270 HydrophobicContact CB-CD 4.45Å; A204-K270 PolarHBondContact O-NZ 3.35Å; A204-W279 HydrophobicContact CB-CD2 3.92Å; A204-W279 HydrophobicContact CB-CE3 3.58Å; A204-W279 HydrophobicContact CB-CG 4.36Å; A204-W279 HydrophobicContact CB-CZ3 4.12Å
205	R	85.4	Confident	79.1	Confident	200 Å²	200	77.9 Å²	77.9	76%	0.755	38%	0.383	S	S	*	.	H	α-helix	trans	-66.4	-32.2	175.9	-66.5	-176.5	179.3	175.4	-0.6	112.5	T202 V203	T202-R205 PolarHBondContact O-N 2.96Å; V203-R205 PolarHBondContact O-N 3.11Å; V203-R205 VanDerWaalsContact O-N 3.16Å
206	T	89.6	Confident	79.5	Confident	84 Å²	84	79.6 Å²	79.6	52%	0.515	40%	0.402	S	S	.	.	H	α-helix	trans	-94.2	-4.8	-176.6	63.2	0	0	0	0	113.7	V203 A204 W226	V203-T206 PolarHBondContact O-N 3.02Å; V203-T206 PolarHBondContact O-OG1 3.34Å; A204-T206 VanDerWaalsContact C-N 3.28Å; A204-T206 PolarHBondContact O-N 2.76Å; T206-W226 PolarHBondContact OG1-NE1 2.99Å
207	I	94.4	Very high	80	Confident	3 Å²	3	84.1 Å²	84.1	2%	0.015	41%	0.411	C	S	.	.	P	Polyproline II helix	trans	-90.4	131.4	177.6	-66.5	174.1	0	0	0	110.6	V203 L209 R225 W226 V231 V233 K270 W279 V281	V203-I207 HydrophobicContact CG1-CD1 3.57Å; V203-I207 HydrophobicContact CG1-CG1 4.21Å; V203-I207 WeakPolarHBondContact O-CG1 3.46Å; V203-I207 PolarHBondContact O-N 2.68Å; I207-L209 HydrophobicContact CG2-CD2 4.41Å; I207-R225 WeakPolarHBondContact CA-O 3.49Å; I207-W226 HydrophobicContact CD1-CG 4.46Å; I207-W226 HydrophobicContact CG1-CB 3.9Å; I207-W226 HydrophobicContact CG1-CG 3.86Å; I207-V231 HydrophobicContact CD1-CG2 4.2Å; I207-V231 HydrophobicContact CG2-CG2 4.38Å; I207-V233 HydrophobicContact CD1-CG2 4.3Å; I207-V233 HydrophobicContact CG2-CG2 4.06Å; I207-K270 PolarHBondContact O-NZ 3.23Å; I207-W279 HydrophobicContact CB-CZ3 3.82Å; I207-W279 HydrophobicContact CD1-CE3 4.5Å; I207-W279 HydrophobicContact CD1-CZ3 4.33Å; I207-W279 HydrophobicContact CG2-CH2 4.41Å; I207-W279 HydrophobicContact CG2-CZ3 3.77Å; I207-V281 HydrophobicContact CD1-CB 4.4Å; I207-V281 HydrophobicContact CD1-CG1 3.73Å; I207-V281 HydrophobicContact CD1-CG2 3.71Å
208	V	94.3	Very high	80.5	Confident	98 Å²	98	79.8 Å²	79.8	59%	0.594	39%	0.388	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-102	116.8	169.9	-176.7	0	0	0	0	108.8	G224 R225	V208-G224 CarbonylContact O-C 3.51Å; V208-G224 VanDerWaalsContact O-CA 3.23Å; V208-G224 WeakPolarHBondContact O-CA 3.4Å; V208-R225 PolarHBondContact N-O 3.19Å; V208-R225 VanDerWaalsContact N-O 3.16Å; V208-R225 PolarHBondContact O-N 3.24Å
209	L	95.4	Very high	81.8	Confident	50 Å²	50	71.3 Å²	71.3	26%	0.262	36%	0.355	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.6	140.7	174.1	-60.3	178.1	0	0	0	110	I207 W222 V233 I235 W279	I207-L209 HydrophobicContact CG2-CD2 4.41Å; L209-W222 HydrophobicContact CB-CD2 4.4Å; L209-W222 HydrophobicContact CB-CE3 3.84Å; L209-W222 HydrophobicContact CB-CZ3 4.3Å; L209-W222 HydrophobicContact CD1-CD2 4.13Å; L209-W222 HydrophobicContact CD1-CE3 4.29Å; L209-W222 HydrophobicContact CD1-CG 4.39Å; L209-W222 HydrophobicContact CD2-CB 3.81Å; L209-W222 HydrophobicContact CD2-CG 4.22Å; L209-V233 HydrophobicContact CD2-CB 4.08Å; L209-V233 HydrophobicContact CD2-CG1 4.24Å; L209-V233 HydrophobicContact CD2-CG2 4.1Å; L209-I235 HydrophobicContact CD1-CD1 3.64Å; L209-I235 HydrophobicContact CD2-CD1 4.27Å; L209-W279 HydrophobicContact CD1-CH2 3.87Å; L209-W279 HydrophobicContact CD1-CZ2 3.79Å; L209-W279 HydrophobicContact CD2-CH2 3.55Å; L209-W279 HydrophobicContact CD2-CZ2 4.15Å; L209-W279 HydrophobicContact CD2-CZ3 3.98Å; L209-W279 HydrophobicContact CG-CH2 3.63Å; L209-W279 HydrophobicContact CG-CZ2 4.11Å
210	Q	95.2	Very high	83.3	Confident	81 Å²	81	72.1 Å²	72.1	38%	0.379	36%	0.355	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	-67	-179.1	-60.9	-173	-52.6	0	0	111.3	R223	Q210-R223 PolarHBondContact N-O 2.87Å
211	E	94.2	Very high	84.9	Confident	91 Å²	91	73 Å²	73	43%	0.425	36%	0.362	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.5	151	-173.4	62.9	-172.2	167.5	0	0	111.3	I213 W222 R223	E211-I213 HydrophobicContact CG-CG2 4.01Å; E211-W222 CarbonylContact O-C 3.42Å; E211-W222 VanDerWaalsContact O-CA 3.31Å; E211-W222 WeakPolarHBondContact O-CA 3.09Å; E211-R223 HydrophobicContact CG-CB 3.92Å; E211-R223 PolarHBondContact N-O 3.35Å; E211-R223 PolarHBondContact O-N 2.73Å; E211-R223 VanDerWaalsContact OE1-CD 3.27Å; E211-R223 WeakPolarHBondContact OE1-CD 3.45Å; E211-R223 IonicContact OE1-CZ 2.73Å; E211-R223 IonicContact OE1-NH1 3.76Å; E211-R223 PolarHBondContact OE1-NH1 2.78Å
212	I	94.4	Very high	86.6	Confident	76 Å²	76	66.9 Å²	66.9	39%	0.39	34%	0.339	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78	121.8	171.8	-60.8	171.4	0	0	0	107.7	K215 W222	I212-K215 HydrophobicContact CG2-CG 4.46Å; I212-W222 HydrophobicContact CD1-CH2 3.92Å; I212-W222 HydrophobicContact CD1-CZ2 3.58Å; I212-W222 HydrophobicContact CG1-CD2 3.7Å; I212-W222 HydrophobicContact CG1-CE3 3.89Å; I212-W222 HydrophobicContact CG1-CG 4.44Å; I212-W222 HydrophobicContact CG1-CH2 3.58Å; I212-W222 HydrophobicContact CG1-CZ2 3.34Å; I212-W222 HydrophobicContact CG1-CZ3 3.85Å
213	I	92.3	Very high	87.7	Confident	73 Å²	73	66.4 Å²	66.4	37%	0.374	33%	0.33	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	-14.4	179.9	59.6	174.9	0	0	0	113	E211 V221 R223 A232 Y284	E211-I213 HydrophobicContact CG-CG2 4.01Å; I213-V221 HydrophobicContact CD1-CG1 3.86Å; I213-V221 HydrophobicContact CG1-CB 4.11Å; I213-V221 HydrophobicContact CG1-CG1 3.78Å; I213-V221 WeakPolarHBondContact CG1-O 3.31Å; I213-V221 PolarHBondContact N-O 3.15Å; I213-R223 HydrophobicContact CD1-CB 4.46Å; I213-R223 HydrophobicContact CG2-CB 3.74Å; I213-A232 HydrophobicContact CD1-CB 4.4Å; I213-Y284 HydrophobicContact CD1-CD2 3.93Å; I213-Y284 HydrophobicContact CD1-CE2 3.75Å; I213-Y284 HydrophobicContact CG2-CE2 4.39Å
214	G	86.2	Confident	88.3	Confident	27 Å²	27	66.3 Å²	66.3	28%	0.278	33%	0.329	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-167.8	155.8	175.7	0	0	0	0	0	113.1	V221	G214-V221 PolarHBondContact N-O 3.46Å; G214-V221 VanDerWaalsContact N-O 3.13Å; G214-V221 PolarHBondContact O-N 3.45Å
215	K	82.8	Confident	88.8	Confident	154 Å²	154	71.5 Å²	71.5	67%	0.67	35%	0.348	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-116.8	112.7	168	-62.2	-165.9	-179.8	-146	0	107.9	I212 E220	I212-K215 HydrophobicContact CG2-CG 4.46Å; K215-E220 VanDerWaalsContact CE-OE1 3.26Å; K215-E220 WeakPolarHBondContact CE-OE1 3.44Å; K215-E220 HydrophobicContact CG-CG 4.29Å; K215-E220 IonicContact NZ-OE1 3.71Å; K215-E220 PolarHBondContact NZ-OE1 3.49Å
216	G	70.1	Confident	89.2	Confident	42 Å²	42	62.1 Å²	62.1	43%	0.433	31%	0.313	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.7	-175.9	-179.9	0	0	0	0	0	112.2	F218 G219	G216-F218 VanDerWaalsContact C-N 3.29Å; G216-F218 PolarHBondContact O-N 2.77Å; G216-G219 WeakPolarHBondContact CA-O 3.31Å; G216-G219 PolarHBondContact N-O 3.44Å
217	R	70.4	Confident	89	Confident	155 Å²	155	65 Å²	65	59%	0.585	31%	0.314	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.7	-34.2	177.3	-179.7	176.5	175.5	-179.8	0.8	113.2
218	F	72.6	Confident	88.4	Confident	30 Å²	30	68.1 Å²	68.1	13%	0.132	35%	0.348	C	S	.	.	T	Hydrogen-bonded Turn	trans	-122.1	13.9	-168.6	-54	-65.8	0	0	0	113.8	G216 F236 E240 L356	G216-F218 VanDerWaalsContact C-N 3.29Å; G216-F218 PolarHBondContact O-N 2.77Å; F218-F236 HydrophobicContact CB-CD1 3.81Å; F218-F236 HydrophobicContact CB-CE1 3.65Å; F218-F236 WeakPolarHBondContact O-CD1 3.26Å; F218-E240 WeakPolarHBondContact CA-OE1 3.2Å; F218-E240 VanDerWaalsContact O-OE1 3.14Å; F218-L356 HydrophobicContact CZ-CD2 4.41Å
219	G	78.3	Confident	88.2	Confident	16 Å²	16	64.4 Å²	64.4	17%	0.165	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	160.5	177.4	-173.8	0	0	0	0	0	114.6	G216 I235	G216-G219 WeakPolarHBondContact CA-O 3.31Å; G216-G219 PolarHBondContact N-O 3.44Å; G219-I235 VanDerWaalsContact CA-O 3.23Å; G219-I235 WeakPolarHBondContact CA-O 3.5Å
220	E	90.3	Very high	88.2	Confident	63 Å²	63	64.3 Å²	64.3	29%	0.294	33%	0.329	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101	139.1	177.5	-58.7	-171.7	149.8	0	0	109.8	K215 I235	K215-E220 VanDerWaalsContact CE-OE1 3.26Å; K215-E220 WeakPolarHBondContact CE-OE1 3.44Å; K215-E220 HydrophobicContact CG-CG 4.29Å; K215-E220 IonicContact NZ-OE1 3.71Å; K215-E220 PolarHBondContact NZ-OE1 3.49Å; E220-I235 PolarHBondContact N-O 3.13Å; E220-I235 PolarHBondContact O-N 3.5Å
221	V	94.6	Very high	88.2	Confident	34 Å²	34	60.4 Å²	60.4	21%	0.206	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.6	124.4	175.1	-169.4	0	0	0	0	108.1	I213 G214 A232 V233 K234	I213-V221 HydrophobicContact CD1-CG1 3.86Å; I213-V221 HydrophobicContact CG1-CB 4.11Å; I213-V221 HydrophobicContact CG1-CG1 3.78Å; I213-V221 WeakPolarHBondContact CG1-O 3.31Å; I213-V221 PolarHBondContact N-O 3.15Å; G214-V221 PolarHBondContact N-O 3.46Å; G214-V221 VanDerWaalsContact N-O 3.13Å; G214-V221 PolarHBondContact O-N 3.45Å; V221-A232 HydrophobicContact CG1-CB 4.46Å; V221-V233 CarbonylContact C-O 3.58Å; V221-V233 WeakPolarHBondContact CA-O 3.46Å; V221-K234 HydrophobicContact CG2-CB 4.37Å; V221-K234 HydrophobicContact CG2-CG 4.11Å
222	W	96.1	Very high	88.4	Confident	59 Å²	59	56.6 Å²	56.6	22%	0.223	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	145.6	-179.9	-70.5	72.5	0	0	0	110.4	L209 E211 I212 A232 V233 I235	L209-W222 HydrophobicContact CB-CD2 4.4Å; L209-W222 HydrophobicContact CB-CE3 3.84Å; L209-W222 HydrophobicContact CB-CZ3 4.3Å; L209-W222 HydrophobicContact CD1-CD2 4.13Å; L209-W222 HydrophobicContact CD1-CE3 4.29Å; L209-W222 HydrophobicContact CD1-CG 4.39Å; L209-W222 HydrophobicContact CD2-CB 3.81Å; L209-W222 HydrophobicContact CD2-CG 4.22Å; E211-W222 CarbonylContact O-C 3.42Å; E211-W222 VanDerWaalsContact O-CA 3.31Å; E211-W222 WeakPolarHBondContact O-CA 3.09Å; I212-W222 HydrophobicContact CD1-CH2 3.92Å; I212-W222 HydrophobicContact CD1-CZ2 3.58Å; I212-W222 HydrophobicContact CG1-CD2 3.7Å; I212-W222 HydrophobicContact CG1-CE3 3.89Å; I212-W222 HydrophobicContact CG1-CG 4.44Å; I212-W222 HydrophobicContact CG1-CH2 3.58Å; I212-W222 HydrophobicContact CG1-CZ2 3.34Å; I212-W222 HydrophobicContact CG1-CZ3 3.85Å; W222-A232 CarbonylContact O-C 3.38Å; W222-A232 WeakPolarHBondContact O-CA 3.12Å; W222-V233 HydrophobicContact CB-CB 4.41Å; W222-V233 PolarHBondContact N-O 3.02Å; W222-V233 PolarHBondContact O-N 2.94Å; W222-I235 HydrophobicContact CG-CD1 4.16Å
223	R	97	Very high	88.5	Confident	57 Å²	57	53 Å²	53	22%	0.215	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.1	129	157.4	-179.2	-174.9	177.1	-177.5	4.2	108	Q210 E211 I213 D230 Y284	Q210-R223 PolarHBondContact N-O 2.87Å; E211-R223 HydrophobicContact CG-CB 3.92Å; E211-R223 PolarHBondContact N-O 3.35Å; E211-R223 PolarHBondContact O-N 2.73Å; E211-R223 VanDerWaalsContact OE1-CD 3.27Å; E211-R223 WeakPolarHBondContact OE1-CD 3.45Å; E211-R223 IonicContact OE1-CZ 2.73Å; E211-R223 IonicContact OE1-NH1 3.76Å; E211-R223 PolarHBondContact OE1-NH1 2.78Å; I213-R223 HydrophobicContact CD1-CB 4.46Å; I213-R223 HydrophobicContact CG2-CB 3.74Å; R223-D230 IonicContact CZ-OD2 3.45Å; R223-D230 IonicContact NE-OD1 2.72Å; R223-D230 IonicContact NE-OD2 3.48Å; R223-D230 PolarHBondContact NE-OD2 2.98Å; R223-D230 IonicContact NH2-OD1 3Å; R223-D230 IonicContact NH2-OD2 3.95Å; R223-D230 PolarHBondContact NH2-OD2 3.45Å; R223-Y284 HydrophobicContact CB-CE2 4.26Å; R223-Y284 HydrophobicContact CG-CD2 4.26Å; R223-Y284 HydrophobicContact CG-CE2 4.13Å
224	G	96.6	Very high	88.6	Confident	0 Å²	0	50.5 Å²	50.5	0%	0	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	164.5	174.8	0	0	0	0	0	111.5	V208 D230 V231	V208-G224 CarbonylContact O-C 3.51Å; V208-G224 VanDerWaalsContact O-CA 3.23Å; V208-G224 WeakPolarHBondContact O-CA 3.4Å; G224-D230 WeakPolarHBondContact O-CA 3.14Å; G224-V231 PolarHBondContact N-O 2.91Å; G224-V231 WeakPolarHBondContact O-CG2 3.37Å; G224-V231 PolarHBondContact O-N 3.3Å
225	R	95.2	Very high	89	Confident	108 Å²	108	50 Å²	50	41%	0.408	25%	0.254	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	127.1	173.2	-173.1	150.2	-69.4	-179.8	-0.8	110.1	I207 V208 G229 D230	I207-R225 WeakPolarHBondContact CA-O 3.49Å; V208-R225 PolarHBondContact N-O 3.19Å; V208-R225 VanDerWaalsContact N-O 3.16Å; V208-R225 PolarHBondContact O-N 3.24Å; R225-G229 WeakPolarHBondContact CA-O 3.28Å; R225-D230 IonicContact CZ-OD1 2.93Å; R225-D230 IonicContact NE-OD1 3.65Å; R225-D230 PolarHBondContact NE-OD1 3.39Å; R225-D230 IonicContact NH2-OD1 2.81Å; R225-D230 PolarHBondContact NH2-OD1 3.09Å
226	W	92.8	Very high	89.5	Confident	4 Å²	4	42.8 Å²	42.8	2%	0.015	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.6	125.1	179	-170	51.1	0	0	0	110.2	L179 V183 L195 V203 T206 I207 G228 G229 V231 I265	L179-W226 HydrophobicContact CD1-CE3 3.87Å; L179-W226 HydrophobicContact CD1-CZ3 4.41Å; L179-W226 WeakPolarHBondContact CD1-O 3.38Å; L179-W226 HydrophobicContact CD2-CE3 4.18Å; L179-W226 HydrophobicContact CD2-CZ3 4.3Å; L179-W226 HydrophobicContact CG-CE3 4.37Å; L179-W226 HydrophobicContact CG-CZ3 4.48Å; V183-W226 HydrophobicContact CG2-CZ3 4.3Å; L195-W226 HydrophobicContact CD1-CH2 3.66Å; L195-W226 HydrophobicContact CD1-CZ2 4.27Å; L195-W226 HydrophobicContact CD1-CZ3 4.47Å; V203-W226 HydrophobicContact CG1-CD2 4.5Å; V203-W226 HydrophobicContact CG1-CZ2 4.41Å; V203-W226 HydrophobicContact CG2-CZ2 4.24Å; T206-W226 PolarHBondContact OG1-NE1 2.99Å; I207-W226 HydrophobicContact CD1-CG 4.46Å; I207-W226 HydrophobicContact CG1-CB 3.9Å; I207-W226 HydrophobicContact CG1-CG 3.86Å; W226-G228 PolarHBondContact O-N 3.4Å; W226-G229 PolarHBondContact N-O 2.82Å; W226-G229 PolarHBondContact O-N 3.21Å; W226-V231 HydrophobicContact CB-CG1 3.92Å; W226-V231 HydrophobicContact CB-CG2 3.99Å; W226-V231 HydrophobicContact CE3-CG1 4.34Å; W226-I265 HydrophobicContact CE3-CG2 4.39Å; W226-I265 HydrophobicContact CH2-CG2 4.27Å; W226-I265 HydrophobicContact CZ3-CG2 3.83Å
227	R	86.7	Confident	90.5	Very high	143 Å²	143	43 Å²	43	54%	0.54	22%	0.217	S	C	.	.	T	Hydrogen-bonded Turn	trans	47.1	36.6	179.9	-62.3	-176.9	173.4	-167.8	-2.5	114.3	L179 L182 G229	L179-R227 HydrophobicContact CD1-CB 4.38Å; L182-R227 VanDerWaalsContact CD2-NH1 3.31Å; R227-G229 VanDerWaalsContact C-N 3.32Å; R227-G229 PolarHBondContact O-N 2.78Å
228	G	80.8	Confident	91.4	Very high	69 Å²	69	38.9 Å²	38.9	71%	0.711	21%	0.212	S	C	*	.	T	Hydrogen-bonded Turn	trans	83.1	-5.8	-179.9	0	0	0	0	0	116	W226	W226-G228 PolarHBondContact O-N 3.4Å
229	G	89.8	Confident	92.2	Very high	20 Å²	20	48.7 Å²	48.7	21%	0.206	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	161	173.7	0	0	0	0	0	113.2	R225 W226 R227	R225-G229 WeakPolarHBondContact CA-O 3.28Å; W226-G229 PolarHBondContact N-O 2.82Å; W226-G229 PolarHBondContact O-N 3.21Å; R227-G229 VanDerWaalsContact C-N 3.32Å; R227-G229 PolarHBondContact O-N 2.78Å
230	D	95.5	Very high	92.7	Very high	48 Å²	48	50.3 Å²	50.3	26%	0.257	25%	0.251	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.6	137.2	174.8	-66	-32.5	0	0	0	110.7	R223 G224 R225 Y284	R223-D230 IonicContact CZ-OD2 3.45Å; R223-D230 IonicContact NE-OD1 2.72Å; R223-D230 IonicContact NE-OD2 3.48Å; R223-D230 PolarHBondContact NE-OD2 2.98Å; R223-D230 IonicContact NH2-OD1 3Å; R223-D230 IonicContact NH2-OD2 3.95Å; R223-D230 PolarHBondContact NH2-OD2 3.45Å; G224-D230 WeakPolarHBondContact O-CA 3.14Å; R225-D230 IonicContact CZ-OD1 2.93Å; R225-D230 IonicContact NE-OD1 3.65Å; R225-D230 PolarHBondContact NE-OD1 3.39Å; R225-D230 IonicContact NH2-OD1 2.81Å; R225-D230 PolarHBondContact NH2-OD1 3.09Å; D230-Y284 HydrophobicContact CB-CD1 3.65Å; D230-Y284 HydrophobicContact CB-CE1 4.44Å; D230-Y284 HydrophobicContact CB-CG 4.1Å; D230-Y284 WeakPolarHBondContact O-CB 3.23Å
231	V	96.8	Very high	92.7	Very high	0 Å²	0	52.8 Å²	52.8	0%	0	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	152.7	178	-65.6	0	0	0	0	110.3	L179 I207 G224 W226 V233 I265 V281	L179-V231 HydrophobicContact CD2-CG1 4.37Å; I207-V231 HydrophobicContact CD1-CG2 4.2Å; I207-V231 HydrophobicContact CG2-CG2 4.38Å; G224-V231 PolarHBondContact N-O 2.91Å; G224-V231 WeakPolarHBondContact O-CG2 3.37Å; G224-V231 PolarHBondContact O-N 3.3Å; W226-V231 HydrophobicContact CB-CG1 3.92Å; W226-V231 HydrophobicContact CB-CG2 3.99Å; W226-V231 HydrophobicContact CE3-CG1 4.34Å; V231-V233 HydrophobicContact CG2-CG2 4.13Å; V231-I265 HydrophobicContact CG1-CD1 3.83Å; V231-V281 HydrophobicContact CB-CG1 4.09Å; V231-V281 HydrophobicContact CG1-CG1 4.43Å; V231-V281 HydrophobicContact CG2-CG1 4.22Å
232	A	96.9	Very high	92.4	Very high	10 Å²	10	62.1 Å²	62.1	8%	0.083	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.9	128.2	170.7	0	0	0	0	0	109.5	I213 V221 W222 V281 S282	I213-A232 HydrophobicContact CD1-CB 4.4Å; V221-A232 HydrophobicContact CG1-CB 4.46Å; W222-A232 CarbonylContact O-C 3.38Å; W222-A232 WeakPolarHBondContact O-CA 3.12Å; A232-V281 WeakPolarHBondContact O-CA 3.47Å; A232-S282 PolarHBondContact N-O 2.89Å; A232-S282 PolarHBondContact O-N 3.41Å; A232-S282 PolarHBondContact O-OG 3.13Å
233	V	96.3	Very high	92.1	Very high	0 Å²	0	60.7 Å²	60.7	0%	0	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	108.5	-177.9	-174.3	0	0	0	0	109.1	I207 L209 V221 W222 V231 I235 W279 L280	I207-V233 HydrophobicContact CD1-CG2 4.3Å; I207-V233 HydrophobicContact CG2-CG2 4.06Å; L209-V233 HydrophobicContact CD2-CB 4.08Å; L209-V233 HydrophobicContact CD2-CG1 4.24Å; L209-V233 HydrophobicContact CD2-CG2 4.1Å; V221-V233 CarbonylContact C-O 3.58Å; V221-V233 WeakPolarHBondContact CA-O 3.46Å; W222-V233 HydrophobicContact CB-CB 4.41Å; W222-V233 PolarHBondContact N-O 3.02Å; W222-V233 PolarHBondContact O-N 2.94Å; V231-V233 HydrophobicContact CG2-CG2 4.13Å; V233-I235 HydrophobicContact CG1-CD1 4.28Å; V233-I235 HydrophobicContact CG1-CG1 3.76Å; V233-W279 HydrophobicContact CB-CE3 4.49Å; V233-W279 HydrophobicContact CG1-CB 4.26Å; V233-W279 HydrophobicContact CG1-CD2 3.55Å; V233-W279 HydrophobicContact CG1-CE3 3.3Å; V233-W279 HydrophobicContact CG1-CG 4Å; V233-W279 HydrophobicContact CG1-CH2 4.43Å; V233-W279 HydrophobicContact CG1-CZ3 3.77Å; V233-W279 HydrophobicContact CG2-CE3 4.42Å; V233-W279 HydrophobicContact CG2-CZ3 4.33Å; V233-L280 WeakPolarHBondContact CA-O 3.43Å
234	K	95.4	Very high	91.9	Very high	21 Å²	21	59.9 Å²	59.9	9%	0.091	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.5	118	171	-169.1	176.5	-172	-173.6	0	108.5	V221 F236 E247 L280 D353	V221-K234 HydrophobicContact CG2-CB 4.37Å; V221-K234 HydrophobicContact CG2-CG 4.11Å; K234-F236 HydrophobicContact CB-CE2 4.07Å; K234-F236 HydrophobicContact CD-CE1 4.45Å; K234-F236 HydrophobicContact CD-CE2 3.79Å; K234-F236 HydrophobicContact CD-CZ 3.52Å; K234-F236 HydrophobicContact CG-CD2 4.35Å; K234-F236 HydrophobicContact CG-CE2 3.6Å; K234-F236 HydrophobicContact CG-CZ 3.79Å; K234-E247 IonicContact NZ-OE1 2.75Å; K234-E247 PolarHBondContact NZ-OE1 3.32Å; K234-E247 IonicContact NZ-OE2 2.76Å; K234-E247 PolarHBondContact NZ-OE2 3.15Å; K234-L280 HydrophobicContact CB-CB 4.32Å; K234-L280 PolarHBondContact N-O 2.62Å; K234-L280 PolarHBondContact O-N 2.85Å; K234-D353 IonicContact NZ-OD1 3.66Å; K234-D353 PolarHBondContact NZ-OD1 2.87Å
235	I	94.1	Very high	91.7	Very high	18 Å²	18	65.4 Å²	65.4	9%	0.092	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	121.6	-175.8	-55.4	-179.5	0	0	0	109	L209 G219 E220 W222 V233 Q277 L278 W279	L209-I235 HydrophobicContact CD1-CD1 3.64Å; L209-I235 HydrophobicContact CD2-CD1 4.27Å; G219-I235 VanDerWaalsContact CA-O 3.23Å; G219-I235 WeakPolarHBondContact CA-O 3.5Å; E220-I235 PolarHBondContact N-O 3.13Å; E220-I235 PolarHBondContact O-N 3.5Å; W222-I235 HydrophobicContact CG-CD1 4.16Å; V233-I235 HydrophobicContact CG1-CD1 4.28Å; V233-I235 HydrophobicContact CG1-CG1 3.76Å; I235-Q277 HydrophobicContact CG2-CB 3.87Å; I235-Q277 HydrophobicContact CG2-CG 4.09Å; I235-L278 WeakPolarHBondContact CA-O 3.47Å; I235-W279 HydrophobicContact CD1-CZ2 3.93Å; I235-W279 HydrophobicContact CG1-CD2 4.43Å; I235-W279 HydrophobicContact CG1-CG 4.39Å
236	F	93.2	Very high	91.5	Very high	2 Å²	2	62.5 Å²	62.5	1%	0.009	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.1	148.4	177.7	-57.9	-107.2	0	0	0	110	F218 K234 E240 W244 E247 L278 L280	F218-F236 HydrophobicContact CB-CD1 3.81Å; F218-F236 HydrophobicContact CB-CE1 3.65Å; F218-F236 WeakPolarHBondContact O-CD1 3.26Å; K234-F236 HydrophobicContact CB-CE2 4.07Å; K234-F236 HydrophobicContact CD-CE1 4.45Å; K234-F236 HydrophobicContact CD-CE2 3.79Å; K234-F236 HydrophobicContact CD-CZ 3.52Å; K234-F236 HydrophobicContact CG-CD2 4.35Å; K234-F236 HydrophobicContact CG-CE2 3.6Å; K234-F236 HydrophobicContact CG-CZ 3.79Å; F236-E240 HydrophobicContact CB-CB 4.25Å; F236-E240 HydrophobicContact CD1-CB 4.25Å; F236-W244 HydrophobicContact CB-CB 4.16Å; F236-W244 HydrophobicContact CD1-CB 4.04Å; F236-W244 HydrophobicContact CD2-CB 3.91Å; F236-W244 AromaticContact CD2-CD1 3.61Å; F236-W244 HydrophobicContact CD2-CG 4.14Å; F236-W244 HydrophobicContact CE1-CB 4.37Å; F236-W244 HydrophobicContact CE2-CB 4.25Å; F236-W244 AromaticContact CE2-CD1 3.83Å; F236-W244 HydrophobicContact CE2-CG 4.46Å; F236-W244 HydrophobicContact CG-CB 3.79Å; F236-W244 HydrophobicContact CG-CG 4.45Å; F236-W244 HydrophobicContact CZ-CB 4.46Å; F236-E247 WeakPolarHBondContact CZ-OE2 3.33Å; F236-L278 HydrophobicContact CB-CB 4.2Å; F236-L278 PolarHBondContact N-O 2.8Å; F236-L278 PolarHBondContact O-N 3.48Å; F236-L278 VanDerWaalsContact O-N 3.09Å; F236-L280 HydrophobicContact CE2-CB 4.07Å
237	S	91.6	Very high	91.5	Very high	47 Å²	47	62.5 Å²	62.5	33%	0.329	30%	0.304	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73	158.6	167.9	71.1	0	0	0	0	110.8	R239 E240	S237-R239 PolarHBondContact O-N 3.05Å; S237-R239 VanDerWaalsContact O-N 3.1Å; S237-E240 WeakPolarHBondContact CB-OE2 3.45Å; S237-E240 PolarHBondContact N-OE2 2.84Å; S237-E240 PolarHBondContact O-N 2.84Å; S237-E240 PolarHBondContact OG-OE2 2.98Å
238	S	88.3	Confident	91.9	Very high	68 Å²	68	55.9 Å²	55.9	48%	0.476	28%	0.28	S	S	.	.	G	3₁₀ helix	trans	-58.9	-22.1	173.4	57	0	0	0	0	113.4	E240	S238-E240 PolarHBondContact O-N 3.23Å
239	R	89.2	Confident	92.4	Very high	236 Å²	236	55.6 Å²	55.6	89%	0.891	26%	0.26	S	S	*	.	G	3₁₀ helix	trans	-71.3	-18.8	174.9	-60.4	-179	-179	177.8	0.2	112.9	S237	S237-R239 PolarHBondContact O-N 3.05Å; S237-R239 VanDerWaalsContact O-N 3.1Å
240	E	89.1	Confident	92.6	Very high	50 Å²	50	54.6 Å²	54.6	23%	0.234	25%	0.25	C	C	.	.	G	3₁₀ helix	trans	-105.9	18.3	-175.9	-66.7	164.6	123.8	0	0	112.3	F218 F236 S237 S238 R242 S243 W244	F218-E240 WeakPolarHBondContact CA-OE1 3.2Å; F218-E240 VanDerWaalsContact O-OE1 3.14Å; F236-E240 HydrophobicContact CB-CB 4.25Å; F236-E240 HydrophobicContact CD1-CB 4.25Å; S237-E240 WeakPolarHBondContact CB-OE2 3.45Å; S237-E240 PolarHBondContact N-OE2 2.84Å; S237-E240 PolarHBondContact O-N 2.84Å; S237-E240 PolarHBondContact OG-OE2 2.98Å; S238-E240 PolarHBondContact O-N 3.23Å; E240-R242 PolarHBondContact O-N 3.46Å; E240-R242 VanDerWaalsContact O-N 3.16Å; E240-S243 WeakPolarHBondContact O-CB 3.46Å; E240-S243 PolarHBondContact O-N 2.85Å; E240-W244 PolarHBondContact O-N 2.86Å
241	E	90.5	Very high	92.6	Very high	114 Å²	114	52.5 Å²	52.5	53%	0.533	24%	0.238	S	C	.	.	H	α-helix	trans	-51.5	-40.2	-179.3	-176.1	-179.1	-175.7	0	0	113	S243 W244 F245 L278	E241-S243 VanDerWaalsContact C-N 3.34Å; E241-S243 PolarHBondContact O-N 2.85Å; E241-W244 PolarHBondContact O-N 3.33Å; E241-F245 WeakPolarHBondContact O-CB 3.33Å; E241-F245 PolarHBondContact O-N 3.48Å; E241-L278 HydrophobicContact CB-CD1 3.78Å; E241-L278 HydrophobicContact CG-CD1 3.96Å
242	R	89.4	Confident	92.4	Very high	231 Å²	231	55.5 Å²	55.5	87%	0.872	25%	0.252	S	S	*	.	H	α-helix	trans	-62.3	-40	177.2	-65.9	-178.4	-176.9	168.3	0.8	112.5	E240 R246	E240-R242 PolarHBondContact O-N 3.46Å; E240-R242 VanDerWaalsContact O-N 3.16Å; R242-R246 VanDerWaalsContact O-CB 3.28Å; R242-R246 WeakPolarHBondContact O-CB 3.33Å; R242-R246 PolarHBondContact O-N 3.49Å
243	S	89.8	Confident	92.2	Very high	28 Å²	28	55.5 Å²	55.5	20%	0.196	25%	0.251	C	S	.	.	H	α-helix	trans	-70.3	-44.6	177.6	-62.5	0	0	0	0	111.1	E240 E241 R246 E247	E240-S243 WeakPolarHBondContact O-CB 3.46Å; E240-S243 PolarHBondContact O-N 2.85Å; E241-S243 VanDerWaalsContact C-N 3.34Å; E241-S243 PolarHBondContact O-N 2.85Å; S243-R246 PolarHBondContact O-N 3.12Å; S243-E247 WeakPolarHBondContact O-CB 3.28Å; S243-E247 PolarHBondContact O-N 2.74Å
244	W	92.9	Very high	91.9	Very high	40 Å²	40	56.9 Å²	56.9	15%	0.152	26%	0.26	C	S	.	.	H	α-helix	trans	-59.9	-48.5	175.3	168.3	81.6	0	0	0	111.6	F236 E240 E241 R246 E247 A248 A267 L278 W279	F236-W244 HydrophobicContact CB-CB 4.16Å; F236-W244 HydrophobicContact CD1-CB 4.04Å; F236-W244 HydrophobicContact CD2-CB 3.91Å; F236-W244 AromaticContact CD2-CD1 3.61Å; F236-W244 HydrophobicContact CD2-CG 4.14Å; F236-W244 HydrophobicContact CE1-CB 4.37Å; F236-W244 HydrophobicContact CE2-CB 4.25Å; F236-W244 AromaticContact CE2-CD1 3.83Å; F236-W244 HydrophobicContact CE2-CG 4.46Å; F236-W244 HydrophobicContact CG-CB 3.79Å; F236-W244 HydrophobicContact CG-CG 4.45Å; F236-W244 HydrophobicContact CZ-CB 4.46Å; E240-W244 PolarHBondContact O-N 2.86Å; E241-W244 PolarHBondContact O-N 3.33Å; W244-R246 PolarHBondContact O-N 2.84Å; W244-E247 PolarHBondContact O-N 2.86Å; W244-A248 VanDerWaalsContact O-CB 3.29Å; W244-A248 WeakPolarHBondContact O-CB 3.44Å; W244-A248 PolarHBondContact O-N 3.06Å; W244-A267 HydrophobicContact CZ2-CB 3.86Å; W244-L278 HydrophobicContact CB-CB 4.29Å; W244-L278 HydrophobicContact CB-CD1 4.21Å; W244-L278 HydrophobicContact CD2-CB 3.86Å; W244-L278 HydrophobicContact CD2-CD1 4.11Å; W244-L278 HydrophobicContact CD2-CG 4.4Å; W244-L278 HydrophobicContact CE3-CB 4.5Å; W244-L278 HydrophobicContact CE3-CD1 4.02Å; W244-L278 HydrophobicContact CE3-CD2 4.46Å; W244-L278 HydrophobicContact CG-CB 3.72Å; W244-L278 HydrophobicContact CG-CD1 4.2Å; W244-W279 PolarHBondContact NE1-O 2.84Å
245	F	91.9	Very high	91.7	Very high	117 Å²	117	60.7 Å²	60.7	51%	0.513	28%	0.279	S	S	.	.	H	α-helix	trans	-60.6	-46.5	-179.9	-178.7	-91.3	0	0	0	110.8	E241 E247 A248 E249	E241-F245 WeakPolarHBondContact O-CB 3.33Å; E241-F245 PolarHBondContact O-N 3.48Å; F245-E247 PolarHBondContact O-N 2.89Å; F245-A248 PolarHBondContact O-N 2.94Å; F245-E249 WeakPolarHBondContact O-CB 3.37Å; F245-E249 PolarHBondContact O-N 3.28Å
246	R	90.9	Very high	91.7	Very high	46 Å²	46	60 Å²	60	17%	0.174	28%	0.275	C	S	.	.	H	α-helix	trans	-59.8	-47.8	177.5	180	57.1	174.7	-171.6	-3.5	111.8	R242 S243 W244 E249 I250 A357 D368	R242-R246 VanDerWaalsContact O-CB 3.28Å; R242-R246 WeakPolarHBondContact O-CB 3.33Å; R242-R246 PolarHBondContact O-N 3.49Å; S243-R246 PolarHBondContact O-N 3.12Å; W244-R246 PolarHBondContact O-N 2.84Å; R246-E249 IonicContact NH1-OE2 3.83Å; R246-E249 PolarHBondContact NH1-OE2 2.89Å; R246-E249 PolarHBondContact O-N 2.85Å; R246-I250 VanDerWaalsContact O-CG1 3.31Å; R246-I250 WeakPolarHBondContact O-CG1 3.2Å; R246-I250 PolarHBondContact O-N 2.78Å; R246-A357 PolarHBondContact NE-O 2.88Å; R246-A357 PolarHBondContact NH2-O 3.41Å; R246-D368 IonicContact CZ-OD1 2.56Å; R246-D368 IonicContact CZ-OD2 3.35Å; R246-D368 VanDerWaalsContact NH1-CG 3.35Å; R246-D368 IonicContact NH1-OD1 3.81Å; R246-D368 IonicContact NH1-OD2 2.95Å; R246-D368 PolarHBondContact NH1-OD2 2.88Å; R246-D368 PolarHBondContact NH2-O 2.81Å; R246-D368 IonicContact NH2-OD1 3.91Å; R246-D368 PolarHBondContact NH2-OD1 3.09Å; R246-D368 IonicContact NH2-OD2 3.42Å; R246-D368 PolarHBondContact NH2-OD2 3.41Å; R246-D368 VanDerWaalsContact NH2-OD2 3.15Å
247	E	93.6	Very high	91.7	Very high	4 Å²	4	63.6 Å²	63.6	2%	0.019	29%	0.289	C	S	.	.	H	α-helix	trans	-65.9	-43.1	-178.9	-165.3	168.3	166.9	0	0	111.6	K234 F236 S243 W244 F245 I250 Y251 L280	K234-E247 IonicContact NZ-OE1 2.75Å; K234-E247 PolarHBondContact NZ-OE1 3.32Å; K234-E247 IonicContact NZ-OE2 2.76Å; K234-E247 PolarHBondContact NZ-OE2 3.15Å; F236-E247 WeakPolarHBondContact CZ-OE2 3.33Å; S243-E247 WeakPolarHBondContact O-CB 3.28Å; S243-E247 PolarHBondContact O-N 2.74Å; W244-E247 PolarHBondContact O-N 2.86Å; F245-E247 PolarHBondContact O-N 2.89Å; E247-I250 PolarHBondContact O-N 3.29Å; E247-Y251 HydrophobicContact CG-CD2 3.84Å; E247-Y251 HydrophobicContact CG-CE2 3.68Å; E247-Y251 WeakPolarHBondContact O-CD2 3.11Å; E247-Y251 PolarHBondContact O-N 2.91Å; E247-L280 HydrophobicContact CB-CD1 3.97Å; E247-L280 HydrophobicContact CG-CD1 3.65Å
248	A	93.3	Very high	91.9	Very high	5 Å²	5	63.5 Å²	63.5	4%	0.041	28%	0.283	C	S	.	.	H	α-helix	trans	-61.8	-43.9	174.7	0	0	0	0	0	112.2	W244 F245 I250 Y251 Q252 A267	W244-A248 VanDerWaalsContact O-CB 3.29Å; W244-A248 WeakPolarHBondContact O-CB 3.44Å; W244-A248 PolarHBondContact O-N 3.06Å; F245-A248 PolarHBondContact O-N 2.94Å; A248-I250 PolarHBondContact O-N 3.03Å; A248-Y251 PolarHBondContact O-N 3.13Å; A248-Q252 WeakPolarHBondContact O-CB 3.3Å; A248-Q252 VanDerWaalsContact O-CG 3.25Å; A248-Q252 WeakPolarHBondContact O-CG 3.44Å; A248-Q252 PolarHBondContact O-N 3.17Å; A248-A267 HydrophobicContact CB-CB 3.74Å
249	E	92.9	Very high	92.3	Very high	62 Å²	62	65.4 Å²	65.4	29%	0.29	29%	0.285	S	S	.	.	H	α-helix	trans	-59.1	-46.2	176.6	-179.6	-171	-151.9	0	0	111.3	F245 R246 Q252 T253 R359	F245-E249 WeakPolarHBondContact O-CB 3.37Å; F245-E249 PolarHBondContact O-N 3.28Å; R246-E249 IonicContact NH1-OE2 3.83Å; R246-E249 PolarHBondContact NH1-OE2 2.89Å; R246-E249 PolarHBondContact O-N 2.85Å; E249-Q252 PolarHBondContact O-N 2.92Å; E249-T253 PolarHBondContact O-N 3.19Å; E249-T253 PolarHBondContact O-OG1 3.45Å; E249-R359 IonicContact OE1-CZ 3.83Å; E249-R359 IonicContact OE1-NH1 3.58Å; E249-R359 IonicContact OE1-NH2 2.86Å; E249-R359 PolarHBondContact OE1-NH2 3.03Å; E249-R359 IonicContact OE2-NH2 3.52Å; E249-R359 PolarHBondContact OE2-NH2 3.38Å
250	I	94.1	Very high	92.7	Very high	0 Å²	0	54.2 Å²	54.2	0%	0	24%	0.242	C	C	.	.	H	α-helix	trans	-62.2	-50.4	176.7	-64.1	-65.1	0	0	0	109.8	R246 E247 A248 Q252 T253 L256 I331 L354 A357 R359	R246-I250 VanDerWaalsContact O-CG1 3.31Å; R246-I250 WeakPolarHBondContact O-CG1 3.2Å; R246-I250 PolarHBondContact O-N 2.78Å; E247-I250 PolarHBondContact O-N 3.29Å; A248-I250 PolarHBondContact O-N 3.03Å; I250-Q252 PolarHBondContact O-N 3.48Å; I250-T253 WeakPolarHBondContact O-CB 3.15Å; I250-T253 PolarHBondContact O-N 2.89Å; I250-T253 PolarHBondContact O-OG1 3.39Å; I250-L256 HydrophobicContact CG2-CD2 4.49Å; I250-L256 WeakPolarHBondContact O-CD2 3.48Å; I250-I331 HydrophobicContact CG2-CD1 4.49Å; I250-L354 HydrophobicContact CB-CB 4.39Å; I250-L354 HydrophobicContact CG2-CB 3.71Å; I250-L354 HydrophobicContact CG2-CD1 3.87Å; I250-L354 HydrophobicContact CG2-CG 4.42Å; I250-A357 HydrophobicContact CD1-CB 4.41Å; I250-A357 HydrophobicContact CG1-CB 4.32Å; I250-A357 HydrophobicContact CG2-CB 4.18Å; I250-R359 HydrophobicContact CD1-CG 3.62Å
251	Y	94.8	Very high	93.1	Very high	4 Å²	4	52.1 Å²	52.1	2%	0.016	23%	0.233	C	C	.	.	H	α-helix	trans	-62.2	-23.2	-179.3	-86.1	-62.5	0	0	0	114.8	S193 E247 A248 T253 L262 F264 L280 D353 L354	S193-Y251 PolarHBondContact OG-O 3.48Å; E247-Y251 HydrophobicContact CG-CD2 3.84Å; E247-Y251 HydrophobicContact CG-CE2 3.68Å; E247-Y251 WeakPolarHBondContact O-CD2 3.11Å; E247-Y251 PolarHBondContact O-N 2.91Å; A248-Y251 PolarHBondContact O-N 3.13Å; Y251-T253 VanDerWaalsContact C-N 3.34Å; Y251-L262 HydrophobicContact CE1-CB 4.31Å; Y251-F264 HydrophobicContact CD1-CB 3.81Å; Y251-F264 HydrophobicContact CD1-CG 4.48Å; Y251-F264 HydrophobicContact CD2-CD2 4.41Å; Y251-F264 HydrophobicContact CG-CB 4.01Å; Y251-F264 AromaticContact CG-CD2 4Å; Y251-F264 HydrophobicContact CG-CD2 4Å; Y251-F264 HydrophobicContact CG-CG 4.18Å; Y251-L280 HydrophobicContact CD2-CD1 4.03Å; Y251-L280 HydrophobicContact CD2-CD2 4.34Å; Y251-L280 HydrophobicContact CE2-CD1 4.35Å; Y251-L280 HydrophobicContact CE2-CD2 4.4Å; Y251-D353 PolarHBondContact OH-N 3.12Å; Y251-D353 VanDerWaalsContact OH-N 3.12Å; Y251-L354 HydrophobicContact CD1-CD1 3.95Å; Y251-L354 HydrophobicContact CE1-CD1 3.63Å; Y251-L354 HydrophobicContact CE1-CG 4.06Å; Y251-L354 HydrophobicContact CE2-CB 4.26Å; Y251-L354 HydrophobicContact CE2-CG 4.4Å
252	Q	92.9	Very high	93.5	Very high	62 Å²	62	47.4 Å²	47.4	29%	0.29	21%	0.211	S	C	.	.	T	Hydrogen-bonded Turn	trans	-87.2	-2	176.2	-71.4	174.2	28.9	0	0	113.6	A248 E249 I250 V254 F264	A248-Q252 WeakPolarHBondContact O-CB 3.3Å; A248-Q252 VanDerWaalsContact O-CG 3.25Å; A248-Q252 WeakPolarHBondContact O-CG 3.44Å; A248-Q252 PolarHBondContact O-N 3.17Å; E249-Q252 PolarHBondContact O-N 2.92Å; I250-Q252 PolarHBondContact O-N 3.48Å; Q252-V254 PolarHBondContact O-N 3.19Å; Q252-F264 HydrophobicContact CG-CD1 4.38Å; Q252-F264 HydrophobicContact CG-CE1 3.59Å; Q252-F264 HydrophobicContact CG-CZ 3.96Å
253	T	91.6	Very high	93.7	Very high	10 Å²	10	36.9 Å²	36.9	6%	0.061	17%	0.174	C	C	.	.			trans	-55.1	132.2	179.5	-60.6	0	0	0	0	110.9	S193 E249 I250 Y251 M255 L256 K328 P329 I331	S193-T253 PolarHBondContact OG-O 3.29Å; E249-T253 PolarHBondContact O-N 3.19Å; E249-T253 PolarHBondContact O-OG1 3.45Å; I250-T253 WeakPolarHBondContact O-CB 3.15Å; I250-T253 PolarHBondContact O-N 2.89Å; I250-T253 PolarHBondContact O-OG1 3.39Å; Y251-T253 VanDerWaalsContact C-N 3.34Å; T253-M255 PolarHBondContact O-N 2.88Å; T253-L256 WeakPolarHBondContact O-CB 3.37Å; T253-L256 PolarHBondContact O-N 3.3Å; T253-L256 VanDerWaalsContact O-N 3.16Å; T253-K328 HydrophobicContact CG2-CG 4.29Å; T253-P329 HydrophobicContact CG2-CG 3.97Å; T253-I331 HydrophobicContact CG2-CD1 4.23Å
254	V	90.1	Very high	93.9	Very high	29 Å²	29	35.9 Å²	35.9	18%	0.176	17%	0.166	C	C	.	.	T	Hydrogen-bonded Turn	trans	-53.9	138.7	178.9	174	0	0	0	0	111	Q252 L256 Q326 K328	Q252-V254 PolarHBondContact O-N 3.19Å; V254-L256 PolarHBondContact O-N 2.79Å; V254-L256 VanDerWaalsContact O-N 3.1Å; V254-Q326 HydrophobicContact CG1-CB 3.75Å; V254-Q326 WeakPolarHBondContact CG1-O 3.48Å; V254-K328 WeakPolarHBondContact O-CB 3.27Å; V254-K328 WeakPolarHBondContact O-CG 3.4Å
255	M	90.8	Very high	93.8	Very high	101 Å²	101	34 Å²	34	50%	0.498	16%	0.159	S	C	.	.	T	Hydrogen-bonded Turn	trans	57.3	18.9	-179.2	-62.6	-68.1	108.7	0	0	115.1	T253 H317 I322 Q326 K328	T253-M255 PolarHBondContact O-N 2.88Å; M255-H317 PolarHBondContact O-CE1 3.08Å; M255-H317 PolarHBondContact O-NE2 3.28Å; M255-H317 VanDerWaalsContact O-NE2 3.09Å; M255-I322 HydrophobicContact CB-CD1 4.23Å; M255-Q326 WeakPolarHBondContact CG-O 3.37Å; M255-K328 HydrophobicContact CB-CB 4.12Å
256	L	94.4	Very high	93.8	Very high	3 Å²	3	28.4 Å²	28.4	2%	0.016	14%	0.135	C	C	.	.			trans	-75.6	-24.7	176.9	-178.9	61.5	0	0	0	113.9	I250 T253 V254 H258 I261 H317 L318 I331 L354	I250-L256 HydrophobicContact CG2-CD2 4.49Å; I250-L256 WeakPolarHBondContact O-CD2 3.48Å; T253-L256 WeakPolarHBondContact O-CB 3.37Å; T253-L256 PolarHBondContact O-N 3.3Å; T253-L256 VanDerWaalsContact O-N 3.16Å; V254-L256 PolarHBondContact O-N 2.79Å; V254-L256 VanDerWaalsContact O-N 3.1Å; L256-H258 PolarHBondContact O-N 3.28Å; L256-I261 HydrophobicContact CD1-CD1 3.86Å; L256-H317 PolarHBondContact O-NE2 3.03Å; L256-L318 HydrophobicContact CD1-CD2 3.7Å; L256-I331 HydrophobicContact CD1-CD1 3.95Å; L256-L354 HydrophobicContact CD2-CD1 4.19Å
257	R	93	Very high	93.9	Very high	79 Å²	79	26.7 Å²	26.7	30%	0.298	13%	0.13	S	C	.	.			trans	-61.8	120.8	-176.7	-170.2	176	179.7	103.5	-5.6	109.7
258	H	96.1	Very high	93.8	Very high	44 Å²	44	26.7 Å²	26.7	20%	0.204	13%	0.131	C	C	.	.			trans	-147.7	150.4	-178.9	-177	-97	0	0	0	109.9	L256 N260 I261 H317	L256-H258 PolarHBondContact O-N 3.28Å; H258-N260 PolarHBondContact CE1-OD1 2.6Å; H258-N260 PolarHBondContact ND1-N 3.41Å; H258-N260 PolarHBondContact O-N 3Å; H258-I261 HydrophobicContact CB-CB 4.29Å; H258-I261 HydrophobicContact CB-CD1 4.01Å; H258-I261 HydrophobicContact CB-CG1 4.1Å; H258-I261 PolarHBondContact O-N 3Å; H258-I261 VanDerWaalsContact O-O 3.09Å; H258-H317 HydrophobicContact CB-CB 4.44Å; H258-H317 AromaticContact CD2-CG 3.74Å; H258-H317 AromaticContact CD2-ND1 3.6Å; H258-H317 AromaticContact CG-CG 3.73Å; H258-H317 AromaticContact CG-ND1 3.99Å
259	E	96.1	Very high	93.7	Very high	108 Å²	108	31 Å²	31	51%	0.505	15%	0.153	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.2	-21.8	-177.7	61.9	169	163.6	0	0	114.1	K344	E259-K344 VanDerWaalsContact O-CE 3.27Å; E259-K344 WeakPolarHBondContact O-CE 3.32Å; E259-K344 PolarHBondContact O-NZ 2.7Å
260	N	98.5	Very high	93.4	Very high	1 Å²	1	30.8 Å²	30.8	1%	0.005	15%	0.151	C	C	.	.	T	Hydrogen-bonded Turn	trans	-112.5	22.8	178	-49.7	122.2	0	0	0	113.5	H258 S310 S313 C349 A350 I351	H258-N260 PolarHBondContact CE1-OD1 2.6Å; H258-N260 PolarHBondContact ND1-N 3.41Å; H258-N260 PolarHBondContact O-N 3Å; N260-S310 WeakPolarHBondContact CB-O 3.47Å; N260-S310 VanDerWaalsContact ND2-CB 3.27Å; N260-S310 WeakPolarHBondContact ND2-CB 3.31Å; N260-S310 PolarHBondContact OD1-O 2.87Å; N260-S313 VanDerWaalsContact OD1-CB 3.23Å; N260-S313 WeakPolarHBondContact OD1-CB 3.5Å; N260-C349 WeakPolarHBondContact CA-O 3.45Å; N260-C349 WeakPolarHBondContact CB-O 3.38Å; N260-C349 PolarHBondContact ND2-O 3.09Å; N260-A350 WeakPolarHBondContact O-CA 3.45Å; N260-I351 PolarHBondContact O-N 3.22Å
261	I	98.3	Very high	93	Very high	6 Å²	6	35.9 Å²	35.9	3%	0.031	18%	0.178	C	C	.	.	B	Isolated β-bridge	trans	-121	142.7	167.1	-63.8	177.7	0	0	0	107	L256 H258 G263 H317 L318 L354	L256-I261 HydrophobicContact CD1-CD1 3.86Å; H258-I261 HydrophobicContact CB-CB 4.29Å; H258-I261 HydrophobicContact CB-CD1 4.01Å; H258-I261 HydrophobicContact CB-CG1 4.1Å; H258-I261 PolarHBondContact O-N 3Å; H258-I261 VanDerWaalsContact O-O 3.09Å; I261-G263 PolarHBondContact O-N 2.81Å; I261-H317 HydrophobicContact CD1-CB 4.45Å; I261-H317 VanDerWaalsContact CD1-CD2 3.41Å; I261-H317 WeakPolarHBondContact CD1-CD2 3.29Å; I261-L318 HydrophobicContact CD1-CD2 3.77Å; I261-L318 HydrophobicContact CD1-CG 3.78Å; I261-L318 HydrophobicContact CG1-CG 4.46Å; I261-L354 HydrophobicContact CG2-CD1 4.44Å
262	L	97.5	Very high	92.5	Very high	16 Å²	16	39.1 Å²	39.1	8%	0.084	20%	0.196	C	C	.	.			trans	-56	127.9	180	176.7	56.7	0	0	0	110.5	Y251 F264 D283 L342 I351 A352	Y251-L262 HydrophobicContact CE1-CB 4.31Å; L262-F264 PolarHBondContact O-N 3.42Å; L262-D283 HydrophobicContact CD1-CB 4.26Å; L262-L342 HydrophobicContact CD1-CD1 3.86Å; L262-L342 HydrophobicContact CD2-CD1 4.18Å; L262-I351 WeakPolarHBondContact CB-O 3.33Å; L262-I351 PolarHBondContact N-O 3.2Å; L262-A352 HydrophobicContact CB-CB 4.12Å; L262-A352 HydrophobicContact CD2-CB 3.76Å
263	G	94.4	Very high	91.9	Very high	9 Å²	9	39.5 Å²	39.5	9%	0.093	22%	0.216	C	C	.	.			trans	-66.7	103.9	178.2	0	0	0	0	0	111.1	I261 S282 D283	I261-G263 PolarHBondContact O-N 2.81Å; G263-S282 CarbonylContact O-C 3.6Å; G263-S282 WeakPolarHBondContact O-CA 3.46Å; G263-S282 VanDerWaalsContact O-CB 3.31Å; G263-S282 WeakPolarHBondContact O-CB 3.46Å; G263-D283 PolarHBondContact O-N 2.96Å
264	F	94	Very high	91.6	Very high	7 Å²	7	43.9 Å²	43.9	3%	0.031	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.1	137.1	171	174.2	-102.3	0	0	0	110.8	S193 Y251 Q252 L262 A266 A267 L280	S193-F264 WeakPolarHBondContact O-CD1 3.39Å; Y251-F264 HydrophobicContact CD1-CB 3.81Å; Y251-F264 HydrophobicContact CD1-CG 4.48Å; Y251-F264 HydrophobicContact CD2-CD2 4.41Å; Y251-F264 HydrophobicContact CG-CB 4.01Å; Y251-F264 AromaticContact CG-CD2 4Å; Y251-F264 HydrophobicContact CG-CD2 4Å; Y251-F264 HydrophobicContact CG-CG 4.18Å; Q252-F264 HydrophobicContact CG-CD1 4.38Å; Q252-F264 HydrophobicContact CG-CE1 3.59Å; Q252-F264 HydrophobicContact CG-CZ 3.96Å; L262-F264 PolarHBondContact O-N 3.42Å; F264-A266 VanDerWaalsContact CE2-C 3.41Å; F264-A266 WeakPolarHBondContact CE2-O 3.44Å; F264-A267 HydrophobicContact CE2-CB 4.22Å; F264-A267 HydrophobicContact CZ-CB 3.98Å; F264-L280 HydrophobicContact CD2-CD2 3.99Å; F264-L280 HydrophobicContact CD2-CG 4.35Å; F264-L280 HydrophobicContact CE2-CD2 4.21Å; F264-L280 HydrophobicContact CE2-CG 4.07Å
265	I	91.7	Very high	91.5	Very high	0 Å²	0	49.7 Å²	49.7	0%	0	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	-57.9	-179.8	-59.8	174.1	0	0	0	109.9	L179 V183 L195 W226 V231 V281	L179-I265 HydrophobicContact CD2-CD1 4.23Å; V183-I265 HydrophobicContact CG2-CG1 4.42Å; V183-I265 HydrophobicContact CG2-CG2 4.44Å; L195-I265 HydrophobicContact CD1-CG2 3.82Å; L195-I265 HydrophobicContact CG-CG2 4.45Å; L195-I265 PolarHBondContact N-O 3.19Å; W226-I265 HydrophobicContact CE3-CG2 4.39Å; W226-I265 HydrophobicContact CH2-CG2 4.27Å; W226-I265 HydrophobicContact CZ3-CG2 3.83Å; V231-I265 HydrophobicContact CG1-CD1 3.83Å; I265-V281 HydrophobicContact CB-CB 4.39Å; I265-V281 HydrophobicContact CB-CG1 4.19Å; I265-V281 WeakPolarHBondContact CB-O 2.99Å; I265-V281 HydrophobicContact CD1-CG1 4.25Å; I265-V281 HydrophobicContact CG2-CG1 4.43Å; I265-V281 PolarHBondContact N-O 2.88Å
266	A	91.8	Very high	91.4	Very high	0 Å²	0	47.5 Å²	47.5	0%	0	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-159.2	155.6	-175.1	0	0	0	0	0	112.5	Q200 V203 F264 V281	Q200-A266 HydrophobicContact CB-CB 4.18Å; Q200-A266 HydrophobicContact CG-CB 4.03Å; V203-A266 HydrophobicContact CB-CB 4.08Å; V203-A266 HydrophobicContact CG1-CB 4.23Å; V203-A266 HydrophobicContact CG2-CB 3.83Å; F264-A266 VanDerWaalsContact CE2-C 3.41Å; F264-A266 WeakPolarHBondContact CE2-O 3.44Å; A266-V281 HydrophobicContact CB-CB 4.5Å; A266-V281 PolarHBondContact N-O 2.99Å; A266-V281 PolarHBondContact O-N 2.79Å
267	A	92.8	Very high	91.4	Very high	10 Å²	10	49.1 Å²	49.1	8%	0.083	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	130.6	162.9	0	0	0	0	0	107.5	W244 A248 F264 W279	W244-A267 HydrophobicContact CZ2-CB 3.86Å; A248-A267 HydrophobicContact CB-CB 3.74Å; F264-A267 HydrophobicContact CE2-CB 4.22Å; F264-A267 HydrophobicContact CZ-CB 3.98Å; A267-W279 WeakPolarHBondContact CA-O 3.35Å
268	D	92	Very high	91.4	Very high	5 Å²	5	46.1 Å²	46.1	3%	0.027	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.6	167.2	-171.2	-159.3	0.6	0	0	0	110.6	Q200 R201 T202 V203 A204 W279	Q200-D268 WeakPolarHBondContact O-CB 3.42Å; R201-D268 VanDerWaalsContact CA-OD1 3.3Å; R201-D268 WeakPolarHBondContact CA-OD1 2.82Å; T202-D268 PolarHBondContact N-OD2 3.04Å; V203-D268 PolarHBondContact N-OD2 3.42Å; V203-D268 VanDerWaalsContact N-OD2 3.09Å; A204-D268 HydrophobicContact CB-CB 3.88Å; A204-D268 VanDerWaalsContact CB-OD2 3.28Å; A204-D268 WeakPolarHBondContact CB-OD2 3.09Å; A204-D268 PolarHBondContact N-OD2 3.24Å; D268-W279 PolarHBondContact N-O 3.09Å; D268-W279 PolarHBondContact O-N 2.7Å
269	N	89.8	Confident	91.4	Very high	94 Å²	94	44 Å²	44	50%	0.503	24%	0.242	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-118	141.3	173.2	59.8	-3.7	0	0	0	110.9	T276 Q277 L278	N269-T276 HydrophobicContact CB-CG2 4.16Å; N269-Q277 CarbonylContact C-O 3.47Å; N269-Q277 WeakPolarHBondContact CA-O 3.3Å; N269-L278 HydrophobicContact CB-CD2 4.17Å
270	K	87.2	Confident	91.3	Very high	58 Å²	58	39.1 Å²	39.1	25%	0.252	22%	0.219	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	117.2	176.9	-164.7	173.2	-171.4	159.2	0	109.6	A204 I207 Q277 W279	A204-K270 HydrophobicContact CB-CB 4.2Å; A204-K270 HydrophobicContact CB-CD 4.45Å; A204-K270 PolarHBondContact O-NZ 3.35Å; I207-K270 PolarHBondContact O-NZ 3.23Å; K270-Q277 PolarHBondContact N-O 3.04Å; K270-Q277 WeakPolarHBondContact O-CB 3.38Å; K270-Q277 PolarHBondContact O-N 3.2Å; K270-W279 HydrophobicContact CB-CD2 4.44Å; K270-W279 HydrophobicContact CB-CZ2 4.35Å; K270-W279 HydrophobicContact CD-CH2 3.68Å; K270-W279 HydrophobicContact CD-CZ2 3.33Å; K270-W279 HydrophobicContact CD-CZ3 4.41Å; K270-W279 HydrophobicContact CG-CZ2 4.45Å
271	D	85.4	Confident	91.2	Very high	108 Å²	108	39 Å²	39	58%	0.578	22%	0.219	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-88.2	127.6	169.5	-164.8	-14.8	0	0	0	108.8	G273	D271-G273 WeakPolarHBondContact OD1-CA 3.3Å; D271-G273 PolarHBondContact OD1-N 3.48Å
272	N	83.3	Confident	91	Very high	72 Å²	72	39.1 Å²	39.1	39%	0.385	22%	0.22	S	C	.	.			trans	-100.1	9.1	175.6	67.8	9.6	0	0	0	112.5	T274 W275	N272-T274 VanDerWaalsContact C-N 3.33Å; N272-T274 PolarHBondContact OD1-N 3.36Å; N272-T274 PolarHBondContact OD1-OG1 3Å; N272-W275 WeakPolarHBondContact ND2-CZ2 3.39Å; N272-W275 PolarHBondContact ND2-NE1 3.27Å; N272-W275 PolarHBondContact OD1-N 3.16Å; N272-W275 PolarHBondContact OD1-O 3.09Å; N272-W275 VanDerWaalsContact OD1-O 3.05Å
273	G	82.1	Confident	90.9	Very high	69 Å²	69	38.9 Å²	38.9	71%	0.711	22%	0.218	S	C	*	.	S	Bend	trans	89	-6.7	-177.9	0	0	0	0	0	114.2	D271	D271-G273 WeakPolarHBondContact OD1-CA 3.3Å; D271-G273 PolarHBondContact OD1-N 3.48Å
274	T	84.9	Confident	91	Very high	102 Å²	102	40.9 Å²	40.9	63%	0.626	22%	0.223	S	C	*	.	S	Bend	trans	-127.1	-36.6	-178.2	51.6	0	0	0	0	113	N272	N272-T274 VanDerWaalsContact C-N 3.33Å; N272-T274 PolarHBondContact OD1-N 3.36Å; N272-T274 PolarHBondContact OD1-OG1 3Å
275	W	87	Confident	91.2	Very high	151 Å²	151	41.3 Å²	41.3	57%	0.572	23%	0.226	S	C	*	.	S	Bend	trans	-154.1	152.6	171.2	59.5	87.2	0	0	0	111	N272	N272-W275 WeakPolarHBondContact ND2-CZ2 3.39Å; N272-W275 PolarHBondContact ND2-NE1 3.27Å; N272-W275 PolarHBondContact OD1-N 3.16Å; N272-W275 PolarHBondContact OD1-O 3.09Å; N272-W275 VanDerWaalsContact OD1-O 3.05Å
276	T	89.9	Confident	91.3	Very high	55 Å²	55	46.2 Å²	46.2	34%	0.337	25%	0.249	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.2	127	174.5	-49.7	0	0	0	0	110.5	N269 L278	N269-T276 HydrophobicContact CB-CG2 4.16Å; T276-L278 HydrophobicContact CG2-CD2 4.44Å
277	Q	92.9	Very high	91.5	Very high	38 Å²	38	48.5 Å²	48.5	18%	0.178	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99	136.8	169.1	-63.6	-178.7	-18	0	0	109.7	I235 N269 K270	I235-Q277 HydrophobicContact CG2-CB 3.87Å; I235-Q277 HydrophobicContact CG2-CG 4.09Å; N269-Q277 CarbonylContact C-O 3.47Å; N269-Q277 WeakPolarHBondContact CA-O 3.3Å; K270-Q277 PolarHBondContact N-O 3.04Å; K270-Q277 WeakPolarHBondContact O-CB 3.38Å; K270-Q277 PolarHBondContact O-N 3.2Å
278	L	93.9	Very high	91.7	Very high	15 Å²	15	49.1 Å²	49.1	8%	0.079	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.5	121.7	174.6	-56.2	172.7	0	0	0	108.4	I235 F236 E241 W244 N269 T276	I235-L278 WeakPolarHBondContact CA-O 3.47Å; F236-L278 HydrophobicContact CB-CB 4.2Å; F236-L278 PolarHBondContact N-O 2.8Å; F236-L278 PolarHBondContact O-N 3.48Å; F236-L278 VanDerWaalsContact O-N 3.09Å; E241-L278 HydrophobicContact CB-CD1 3.78Å; E241-L278 HydrophobicContact CG-CD1 3.96Å; W244-L278 HydrophobicContact CB-CB 4.29Å; W244-L278 HydrophobicContact CB-CD1 4.21Å; W244-L278 HydrophobicContact CD2-CB 3.86Å; W244-L278 HydrophobicContact CD2-CD1 4.11Å; W244-L278 HydrophobicContact CD2-CG 4.4Å; W244-L278 HydrophobicContact CE3-CB 4.5Å; W244-L278 HydrophobicContact CE3-CD1 4.02Å; W244-L278 HydrophobicContact CE3-CD2 4.46Å; W244-L278 HydrophobicContact CG-CB 3.72Å; W244-L278 HydrophobicContact CG-CD1 4.2Å; N269-L278 HydrophobicContact CB-CD2 4.17Å; T276-L278 HydrophobicContact CG2-CD2 4.44Å
279	W	95.2	Very high	92	Very high	1 Å²	1	49.4 Å²	49.4	0%	0.004	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	137.9	-171	-74.3	31.7	0	0	0	110.2	A204 I207 L209 V233 I235 W244 A267 D268 K270	A204-W279 HydrophobicContact CB-CD2 3.92Å; A204-W279 HydrophobicContact CB-CE3 3.58Å; A204-W279 HydrophobicContact CB-CG 4.36Å; A204-W279 HydrophobicContact CB-CZ3 4.12Å; I207-W279 HydrophobicContact CB-CZ3 3.82Å; I207-W279 HydrophobicContact CD1-CE3 4.5Å; I207-W279 HydrophobicContact CD1-CZ3 4.33Å; I207-W279 HydrophobicContact CG2-CH2 4.41Å; I207-W279 HydrophobicContact CG2-CZ3 3.77Å; L209-W279 HydrophobicContact CD1-CH2 3.87Å; L209-W279 HydrophobicContact CD1-CZ2 3.79Å; L209-W279 HydrophobicContact CD2-CH2 3.55Å; L209-W279 HydrophobicContact CD2-CZ2 4.15Å; L209-W279 HydrophobicContact CD2-CZ3 3.98Å; L209-W279 HydrophobicContact CG-CH2 3.63Å; L209-W279 HydrophobicContact CG-CZ2 4.11Å; V233-W279 HydrophobicContact CB-CE3 4.49Å; V233-W279 HydrophobicContact CG1-CB 4.26Å; V233-W279 HydrophobicContact CG1-CD2 3.55Å; V233-W279 HydrophobicContact CG1-CE3 3.3Å; V233-W279 HydrophobicContact CG1-CG 4Å; V233-W279 HydrophobicContact CG1-CH2 4.43Å; V233-W279 HydrophobicContact CG1-CZ3 3.77Å; V233-W279 HydrophobicContact CG2-CE3 4.42Å; V233-W279 HydrophobicContact CG2-CZ3 4.33Å; I235-W279 HydrophobicContact CD1-CZ2 3.93Å; I235-W279 HydrophobicContact CG1-CD2 4.43Å; I235-W279 HydrophobicContact CG1-CG 4.39Å; W244-W279 PolarHBondContact NE1-O 2.84Å; A267-W279 WeakPolarHBondContact CA-O 3.35Å; D268-W279 PolarHBondContact N-O 3.09Å; D268-W279 PolarHBondContact O-N 2.7Å; K270-W279 HydrophobicContact CB-CD2 4.44Å; K270-W279 HydrophobicContact CB-CZ2 4.35Å; K270-W279 HydrophobicContact CD-CH2 3.68Å; K270-W279 HydrophobicContact CD-CZ2 3.33Å; K270-W279 HydrophobicContact CD-CZ3 4.41Å; K270-W279 HydrophobicContact CG-CZ2 4.45Å
280	L	94.8	Very high	92.4	Very high	4 Å²	4	44.9 Å²	44.9	2%	0.021	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	115.8	167	-167.3	161.6	0	0	0	107.7	V233 K234 F236 E247 Y251 F264	V233-L280 WeakPolarHBondContact CA-O 3.43Å; K234-L280 HydrophobicContact CB-CB 4.32Å; K234-L280 PolarHBondContact N-O 2.62Å; K234-L280 PolarHBondContact O-N 2.85Å; F236-L280 HydrophobicContact CE2-CB 4.07Å; E247-L280 HydrophobicContact CB-CD1 3.97Å; E247-L280 HydrophobicContact CG-CD1 3.65Å; Y251-L280 HydrophobicContact CD2-CD1 4.03Å; Y251-L280 HydrophobicContact CD2-CD2 4.34Å; Y251-L280 HydrophobicContact CE2-CD1 4.35Å; Y251-L280 HydrophobicContact CE2-CD2 4.4Å; F264-L280 HydrophobicContact CD2-CD2 3.99Å; F264-L280 HydrophobicContact CD2-CG 4.35Å; F264-L280 HydrophobicContact CE2-CD2 4.21Å; F264-L280 HydrophobicContact CE2-CG 4.07Å
281	V	95.9	Very high	93	Very high	0 Å²	0	44 Å²	44	0%	0	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	131	-173.7	-171.5	0	0	0	0	109.5	V203 I207 V231 A232 I265 A266	V203-V281 HydrophobicContact CG1-CG1 4.46Å; V203-V281 HydrophobicContact CG1-CG2 4.22Å; I207-V281 HydrophobicContact CD1-CB 4.4Å; I207-V281 HydrophobicContact CD1-CG1 3.73Å; I207-V281 HydrophobicContact CD1-CG2 3.71Å; V231-V281 HydrophobicContact CB-CG1 4.09Å; V231-V281 HydrophobicContact CG1-CG1 4.43Å; V231-V281 HydrophobicContact CG2-CG1 4.22Å; A232-V281 WeakPolarHBondContact O-CA 3.47Å; I265-V281 HydrophobicContact CB-CB 4.39Å; I265-V281 HydrophobicContact CB-CG1 4.19Å; I265-V281 WeakPolarHBondContact CB-O 2.99Å; I265-V281 HydrophobicContact CD1-CG1 4.25Å; I265-V281 HydrophobicContact CG2-CG1 4.43Å; I265-V281 PolarHBondContact N-O 2.88Å; A266-V281 HydrophobicContact CB-CB 4.5Å; A266-V281 PolarHBondContact N-O 2.99Å; A266-V281 PolarHBondContact O-N 2.79Å
282	S	95.6	Very high	93.5	Very high	7 Å²	7	41.5 Å²	41.5	5%	0.049	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.2	170.6	-177.3	58.2	0	0	0	0	111.8	A232 G263	A232-S282 PolarHBondContact N-O 2.89Å; A232-S282 PolarHBondContact O-N 3.41Å; A232-S282 PolarHBondContact O-OG 3.13Å; G263-S282 CarbonylContact O-C 3.6Å; G263-S282 WeakPolarHBondContact O-CA 3.46Å; G263-S282 VanDerWaalsContact O-CB 3.31Å; G263-S282 WeakPolarHBondContact O-CB 3.46Å
283	D	95.3	Very high	94.2	Very high	11 Å²	11	40.1 Å²	40.1	6%	0.059	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-56.5	137.4	171.8	-75.7	-4.9	0	0	0	111.2	Q180 L262 G263	Q180-D283 PolarHBondContact NE2-OD2 3.44Å; L262-D283 HydrophobicContact CD1-CB 4.26Å; G263-D283 PolarHBondContact O-N 2.96Å
284	Y	96.6	Very high	95	Very high	51 Å²	51	36.8 Å²	36.8	20%	0.2	18%	0.183	C	C	.	.			trans	-86.6	137.5	169.9	177.9	-110.8	0	0	0	111	I213 R223 D230 E286	I213-Y284 HydrophobicContact CD1-CD2 3.93Å; I213-Y284 HydrophobicContact CD1-CE2 3.75Å; I213-Y284 HydrophobicContact CG2-CE2 4.39Å; R223-Y284 HydrophobicContact CB-CE2 4.26Å; R223-Y284 HydrophobicContact CG-CD2 4.26Å; R223-Y284 HydrophobicContact CG-CE2 4.13Å; D230-Y284 HydrophobicContact CB-CD1 3.65Å; D230-Y284 HydrophobicContact CB-CE1 4.44Å; D230-Y284 HydrophobicContact CB-CG 4.1Å; D230-Y284 WeakPolarHBondContact O-CB 3.23Å; Y284-E286 HydrophobicContact CE1-CB 4.04Å
285	H	96.6	Very high	95.7	Very high	17 Å²	17	35.6 Å²	35.6	8%	0.079	17%	0.173	C	C	.	.			trans	-124.7	111.8	175.5	-67	-25.9	0	0	0	109.7	H287 G288 L342	H285-H287 VanDerWaalsContact C-N 3.28Å; H285-H287 PolarHBondContact O-N 3.29Å; H285-G288 PolarHBondContact O-N 2.77Å; H285-L342 HydrophobicContact CB-CB 4.37Å
286	E	94.8	Very high	96.2	Very high	103 Å²	103	36 Å²	36	48%	0.481	17%	0.174	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.8	-27.5	-169.9	66.1	-174.5	143.2	0	0	114.5	Y284 G288 K345	Y284-E286 HydrophobicContact CE1-CB 4.04Å; E286-G288 PolarHBondContact O-N 2.97Å; E286-K345 WeakPolarHBondContact OE1-CD 3.3Å; E286-K345 WeakPolarHBondContact OE1-CG 3.45Å
287	H	96.6	Very high	96.5	Very high	48 Å²	48	38.3 Å²	38.3	22%	0.222	18%	0.177	C	C	.	.	T	Hydrogen-bonded Turn	trans	-76.8	-5.7	176.4	-67.6	-46.5	0	0	0	113.3	H285 Y293 V343 K344	H285-H287 VanDerWaalsContact C-N 3.28Å; H285-H287 PolarHBondContact O-N 3.29Å; H287-Y293 HydrophobicContact CB-CD2 3.92Å; H287-Y293 HydrophobicContact CB-CE2 4.4Å; H287-V343 HydrophobicContact CB-CB 3.95Å; H287-V343 HydrophobicContact CB-CG1 4.22Å; H287-V343 WeakPolarHBondContact CB-O 3.32Å; H287-K344 PolarHBondContact CD2-O 3.37Å
288	G	96.4	Very high	96.7	Very high	23 Å²	23	39 Å²	39	24%	0.237	19%	0.185	C	C	.	.			trans	66.1	-147	178.8	0	0	0	0	0	112.3	H285 E286 L342 V343	H285-G288 PolarHBondContact O-N 2.77Å; E286-G288 PolarHBondContact O-N 2.97Å; G288-L342 WeakPolarHBondContact O-CA 3.14Å; G288-V343 PolarHBondContact O-N 3.13Å
289	S	97.9	Very high	96.9	Very high	10 Å²	10	38.7 Å²	38.7	7%	0.07	18%	0.183	C	C	.	.	B	Isolated β-bridge	trans	-76.3	158.2	180	70.6	0	0	0	0	112.3	F291 D292 Y293 K339 I341	S289-F291 PolarHBondContact O-N 3.47Å; S289-F291 WeakPolarHBondContact OG-CB 3.43Å; S289-D292 WeakPolarHBondContact CB-OD2 3.47Å; S289-D292 PolarHBondContact N-OD2 2.99Å; S289-D292 VanDerWaalsContact N-OD2 3.15Å; S289-D292 PolarHBondContact O-N 2.78Å; S289-D292 PolarHBondContact OG-N 3.22Å; S289-D292 VanDerWaalsContact OG-N 3.13Å; S289-D292 PolarHBondContact OG-OD2 2.96Å; S289-Y293 PolarHBondContact O-N 3.4Å; S289-K339 WeakPolarHBondContact CB-O 3.31Å; S289-I341 CarbonylContact C-O 3.5Å; S289-I341 VanDerWaalsContact CA-O 3.28Å; S289-I341 WeakPolarHBondContact CA-O 3.18Å
290	L	98.8	Very high	97	Very high	0 Å²	0	42.7 Å²	42.7	0%	0	21%	0.208	C	C	.	.	H	α-helix	trans	-59.7	-33.9	171.9	178.3	65.7	0	0	0	110.3	Y293 L294 L307 S338 I341 V343 V409 I413	L290-Y293 PolarHBondContact O-N 3.28Å; L290-L294 HydrophobicContact CD1-CD1 3.89Å; L290-L294 HydrophobicContact CD1-CD2 4.22Å; L290-L294 HydrophobicContact CD1-CG 3.8Å; L290-L294 HydrophobicContact CD2-CD1 4.42Å; L290-L294 HydrophobicContact CG-CD1 3.78Å; L290-L294 HydrophobicContact CG-CG 4.12Å; L290-L294 VanDerWaalsContact O-CB 3.31Å; L290-L294 WeakPolarHBondContact O-CB 3.48Å; L290-L294 WeakPolarHBondContact O-CG 3.45Å; L290-L294 PolarHBondContact O-N 3.06Å; L290-L307 HydrophobicContact CD1-CD1 4.11Å; L290-L307 HydrophobicContact CD1-CD2 4.2Å; L290-S338 WeakPolarHBondContact CB-O 3.34Å; L290-S338 PolarHBondContact N-O 2.79Å; L290-I341 HydrophobicContact CB-CB 4.14Å; L290-I341 HydrophobicContact CB-CG2 4.22Å; L290-I341 HydrophobicContact CD2-CB 4.42Å; L290-I341 HydrophobicContact CD2-CD1 4.43Å; L290-I341 HydrophobicContact CD2-CG2 4.27Å; L290-I341 PolarHBondContact N-O 3.48Å; L290-V343 HydrophobicContact CB-CG2 4.14Å; L290-V343 HydrophobicContact CD1-CG2 3.9Å; L290-V409 HydrophobicContact CD2-CG1 3.59Å; L290-I413 HydrophobicContact CD1-CG1 4.4Å; L290-I413 HydrophobicContact CD2-CD1 3.97Å; L290-I413 HydrophobicContact CD2-CG1 3.97Å
291	F	98.4	Very high	97	Very high	39 Å²	39	44.4 Å²	44.4	17%	0.171	22%	0.217	C	C	.	.	H	α-helix	trans	-55	-53.1	168.7	173.5	-86	0	0	0	111.4	S289 Y293 L294 N295 S338 K339 Y426 L428	S289-F291 PolarHBondContact O-N 3.47Å; S289-F291 WeakPolarHBondContact OG-CB 3.43Å; F291-Y293 VanDerWaalsContact C-N 3.33Å; F291-Y293 PolarHBondContact O-N 3.4Å; F291-L294 PolarHBondContact O-N 2.83Å; F291-N295 PolarHBondContact O-N 2.63Å; F291-N295 VanDerWaalsContact O-N 3.15Å; F291-N295 PolarHBondContact O-ND2 3.06Å; F291-S338 PolarHBondContact N-O 3Å; F291-S338 VanDerWaalsContact N-O 3.09Å; F291-K339 HydrophobicContact CB-CB 4.43Å; F291-K339 HydrophobicContact CB-CG 3.59Å; F291-K339 HydrophobicContact CD1-CG 4.18Å; F291-K339 HydrophobicContact CD2-CD 4.49Å; F291-K339 HydrophobicContact CD2-CG 3.96Å; F291-K339 HydrophobicContact CG-CD 4.4Å; F291-K339 HydrophobicContact CG-CG 3.64Å; F291-Y426 AromaticContact CD2-CE1 3.95Å; F291-Y426 HydrophobicContact CD2-CE1 3.95Å; F291-Y426 AromaticContact CD2-CZ 3.68Å; F291-Y426 WeakPolarHBondContact CD2-OH 3.43Å; F291-Y426 AromaticContact CE2-CE1 3.59Å; F291-Y426 HydrophobicContact CE2-CE1 3.59Å; F291-Y426 AromaticContact CE2-CZ 3.82Å; F291-Y426 WeakPolarHBondContact CE2-OH 3.46Å; F291-Y426 HydrophobicContact CZ-CE1 4.27Å; F291-L428 HydrophobicContact CD2-CD2 4.14Å; F291-L428 HydrophobicContact CE2-CD1 4.48Å; F291-L428 HydrophobicContact CE2-CD2 4.02Å; F291-L428 HydrophobicContact CE2-CG 4.29Å
292	D	97.3	Very high	97.1	Very high	55 Å²	55	49.4 Å²	49.4	29%	0.294	24%	0.24	S	C	.	.	H	α-helix	trans	-63.6	-41.3	-180	-57.5	-50	0	0	0	111.5	S289 N295 R296	S289-D292 WeakPolarHBondContact CB-OD2 3.47Å; S289-D292 PolarHBondContact N-OD2 2.99Å; S289-D292 VanDerWaalsContact N-OD2 3.15Å; S289-D292 PolarHBondContact O-N 2.78Å; S289-D292 PolarHBondContact OG-N 3.22Å; S289-D292 VanDerWaalsContact OG-N 3.13Å; S289-D292 PolarHBondContact OG-OD2 2.96Å; D292-N295 PolarHBondContact O-N 2.86Å; D292-R296 VanDerWaalsContact O-CG 3.32Å; D292-R296 WeakPolarHBondContact O-CG 3.22Å; D292-R296 PolarHBondContact O-N 2.97Å
293	Y	98.6	Very high	97.1	Very high	43 Å²	43	50 Å²	50	17%	0.169	25%	0.248	C	C	.	.	H	α-helix	trans	-62.3	-48	-179.9	-169.7	-93.7	0	0	0	112.1	H287 S289 L290 F291 N295 R296 Y297 V299 L307 V343	H287-Y293 HydrophobicContact CB-CD2 3.92Å; H287-Y293 HydrophobicContact CB-CE2 4.4Å; S289-Y293 PolarHBondContact O-N 3.4Å; L290-Y293 PolarHBondContact O-N 3.28Å; F291-Y293 VanDerWaalsContact C-N 3.33Å; F291-Y293 PolarHBondContact O-N 3.4Å; Y293-N295 VanDerWaalsContact C-N 3.33Å; Y293-N295 PolarHBondContact O-N 3.14Å; Y293-R296 PolarHBondContact O-N 2.85Å; Y293-Y297 HydrophobicContact CD1-CD2 4.34Å; Y293-Y297 AromaticContact CD2-CD2 3.58Å; Y293-Y297 HydrophobicContact CD2-CD2 3.58Å; Y293-Y297 AromaticContact CD2-CE2 3.88Å; Y293-Y297 HydrophobicContact CD2-CE2 3.88Å; Y293-Y297 HydrophobicContact CE1-CD2 4.33Å; Y293-Y297 AromaticContact CE2-CD2 3.59Å; Y293-Y297 HydrophobicContact CE2-CD2 3.59Å; Y293-Y297 AromaticContact CE2-CE2 3.94Å; Y293-Y297 HydrophobicContact CE2-CE2 3.94Å; Y293-Y297 AromaticContact CG-CD2 3.99Å; Y293-Y297 HydrophobicContact CG-CD2 3.99Å; Y293-Y297 AromaticContact CZ-CD2 3.98Å; Y293-Y297 WeakPolarHBondContact O-CD2 3.37Å; Y293-Y297 PolarHBondContact O-N 3.06Å; Y293-V299 HydrophobicContact CE1-CG1 3.88Å; Y293-L307 HydrophobicContact CD1-CD1 4.45Å; Y293-L307 HydrophobicContact CE1-CD1 4.25Å; Y293-V343 HydrophobicContact CD1-CG2 4.34Å; Y293-V343 HydrophobicContact CD2-CB 4.14Å; Y293-V343 HydrophobicContact CD2-CG1 3.9Å; Y293-V343 HydrophobicContact CD2-CG2 4.31Å; Y293-V343 HydrophobicContact CE2-CG1 3.97Å; Y293-V343 HydrophobicContact CG-CB 4.26Å; Y293-V343 HydrophobicContact CG-CG1 4.21Å; Y293-V343 HydrophobicContact CG-CG2 3.9Å
294	L	98.6	Very high	97.3	Very high	0 Å²	0	49.5 Å²	49.5	0%	0	25%	0.245	C	C	.	.	H	α-helix	trans	-71.2	-26.5	-178.5	-68.5	177.2	0	0	0	113.1	L290 F291 E412 I413 R416 Y426	L290-L294 HydrophobicContact CD1-CD1 3.89Å; L290-L294 HydrophobicContact CD1-CD2 4.22Å; L290-L294 HydrophobicContact CD1-CG 3.8Å; L290-L294 HydrophobicContact CD2-CD1 4.42Å; L290-L294 HydrophobicContact CG-CD1 3.78Å; L290-L294 HydrophobicContact CG-CG 4.12Å; L290-L294 VanDerWaalsContact O-CB 3.31Å; L290-L294 WeakPolarHBondContact O-CB 3.48Å; L290-L294 WeakPolarHBondContact O-CG 3.45Å; L290-L294 PolarHBondContact O-N 3.06Å; F291-L294 PolarHBondContact O-N 2.83Å; L294-E412 HydrophobicContact CD1-CB 4.03Å; L294-I413 HydrophobicContact CD1-CG1 4.05Å; L294-R416 HydrophobicContact CB-CG 4Å; L294-R416 HydrophobicContact CD2-CB 3.87Å; L294-R416 HydrophobicContact CD2-CG 3.87Å; L294-R416 HydrophobicContact CG-CG 4.41Å; L294-R416 PolarHBondContact O-NE 3.39Å; L294-Y426 HydrophobicContact CB-CD2 3.58Å; L294-Y426 HydrophobicContact CB-CE2 3.86Å; L294-Y426 HydrophobicContact CD1-CE2 4.26Å
295	N	97.9	Very high	97.4	Very high	77 Å²	77	47.2 Å²	47.2	41%	0.412	24%	0.236	S	C	.	.	H	α-helix	trans	-68.5	-36.6	169.9	-86	-83.5	0	0	0	112.1	F291 D292 Y293 Y426	F291-N295 PolarHBondContact O-N 2.63Å; F291-N295 VanDerWaalsContact O-N 3.15Å; F291-N295 PolarHBondContact O-ND2 3.06Å; D292-N295 PolarHBondContact O-N 2.86Å; Y293-N295 VanDerWaalsContact C-N 3.33Å; Y293-N295 PolarHBondContact O-N 3.14Å; N295-Y426 WeakPolarHBondContact ND2-CD1 3.39Å; N295-Y426 WeakPolarHBondContact ND2-CE1 3.26Å; N295-Y426 WeakPolarHBondContact OD1-CD1 3.47Å
296	R	97.4	Very high	97.5	Very high	159 Å²	159	50.2 Å²	50.2	60%	0.6	25%	0.249	S	C	*	.	H	α-helix	trans	-86.1	-35.6	-175.8	-68.1	175.4	-164.3	178.2	7.1	113.3	D292 Y293	D292-R296 VanDerWaalsContact O-CG 3.32Å; D292-R296 WeakPolarHBondContact O-CG 3.22Å; D292-R296 PolarHBondContact O-N 2.97Å; Y293-R296 PolarHBondContact O-N 2.85Å
297	Y	97.4	Very high	97.6	Very high	103 Å²	103	45.4 Å²	45.4	40%	0.404	23%	0.226	S	C	.	.			trans	-124.4	153.1	-168	-53.3	-66.6	0	0	0	112.1	Y293 R416	Y293-Y297 HydrophobicContact CD1-CD2 4.34Å; Y293-Y297 AromaticContact CD2-CD2 3.58Å; Y293-Y297 HydrophobicContact CD2-CD2 3.58Å; Y293-Y297 AromaticContact CD2-CE2 3.88Å; Y293-Y297 HydrophobicContact CD2-CE2 3.88Å; Y293-Y297 HydrophobicContact CE1-CD2 4.33Å; Y293-Y297 AromaticContact CE2-CD2 3.59Å; Y293-Y297 HydrophobicContact CE2-CD2 3.59Å; Y293-Y297 AromaticContact CE2-CE2 3.94Å; Y293-Y297 HydrophobicContact CE2-CE2 3.94Å; Y293-Y297 AromaticContact CG-CD2 3.99Å; Y293-Y297 HydrophobicContact CG-CD2 3.99Å; Y293-Y297 AromaticContact CZ-CD2 3.98Å; Y293-Y297 WeakPolarHBondContact O-CD2 3.37Å; Y293-Y297 PolarHBondContact O-N 3.06Å; Y297-R416 PolarHBondContact O-NE 3.2Å; Y297-R416 PolarHBondContact O-NH2 3.19Å
298	T	97.8	Very high	97.7	Very high	54 Å²	54	43.1 Å²	43.1	33%	0.331	22%	0.216	S	C	.	.			trans	-93.7	157.9	156	56.1	0	0	0	0	109	R416	T298-R416 CarbonylContact C-O 3.5Å; T298-R416 WeakPolarHBondContact CA-O 3.37Å; T298-R416 WeakPolarHBondContact CB-O 3.29Å
299	V	97.4	Very high	97.9	Very high	8 Å²	8	43.5 Å²	43.5	5%	0.048	21%	0.212	C	C	.	.	B	Isolated β-bridge	trans	-119.5	152	178.4	-61.4	0	0	0	0	111	Y293 M304 L307 R416 C417 N418	Y293-V299 HydrophobicContact CE1-CG1 3.88Å; V299-M304 HydrophobicContact CG2-CB 4.01Å; V299-L307 HydrophobicContact CG1-CD1 3.86Å; V299-R416 PolarHBondContact N-O 3.41Å; V299-C417 HydrophobicContact CG2-CB 4.49Å; V299-C417 CarbonylContact O-C 3.6Å; V299-C417 WeakPolarHBondContact O-CA 3.43Å; V299-N418 PolarHBondContact O-N 3.31Å
300	T	96.9	Very high	97.9	Very high	84 Å²	84	43.2 Å²	43.2	52%	0.515	21%	0.21	S	C	.	.			trans	-74.6	173.6	168.2	59.7	0	0	0	0	110.3	E302 G303 M304	T300-E302 VanDerWaalsContact C-N 3.31Å; T300-E302 PolarHBondContact O-N 2.93Å; T300-G303 PolarHBondContact O-N 3.26Å; T300-G303 PolarHBondContact OG1-N 3.24Å; T300-M304 WeakPolarHBondContact O-CB 3.38Å; T300-M304 PolarHBondContact O-N 2.79Å
301	I	96.1	Very high	97.9	Very high	40 Å²	40	43.3 Å²	43.3	21%	0.205	21%	0.211	C	C	.	.	H	α-helix	trans	-56.9	-46.3	171.3	-68.5	174.4	0	0	0	110.8	G303 M304 I305 A465 E501	I301-G303 PolarHBondContact O-N 3.03Å; I301-M304 WeakPolarHBondContact O-CB 3.34Å; I301-M304 PolarHBondContact O-N 2.75Å; I301-I305 HydrophobicContact CG2-CD1 3.85Å; I301-I305 WeakPolarHBondContact O-CG1 3.33Å; I301-I305 PolarHBondContact O-N 2.98Å; I301-A465 HydrophobicContact CG2-CB 3.51Å; I301-E501 HydrophobicContact CG2-CG 4.29Å
302	E	96	Very high	97.9	Very high	106 Å²	106	41.4 Å²	41.4	50%	0.495	20%	0.203	S	C	.	.	H	α-helix	trans	-58.7	-47.8	175.4	-171	-158.3	147.6	0	0	111.1	T300 M304 I305 K306	T300-E302 VanDerWaalsContact C-N 3.31Å; T300-E302 PolarHBondContact O-N 2.93Å; E302-M304 VanDerWaalsContact C-N 3.34Å; E302-M304 PolarHBondContact O-N 3.07Å; E302-I305 PolarHBondContact O-N 3.17Å; E302-K306 VanDerWaalsContact O-CB 3.31Å; E302-K306 WeakPolarHBondContact O-CB 3.37Å; E302-K306 PolarHBondContact O-N 3.08Å
303	G	97.5	Very high	98	Very high	20 Å²	20	39.1 Å²	39.1	21%	0.206	19%	0.191	C	C	.	.	H	α-helix	trans	-60.2	-41.4	177.5	0	0	0	0	0	112.8	T300 I301 K306 L307	T300-G303 PolarHBondContact O-N 3.26Å; T300-G303 PolarHBondContact OG1-N 3.24Å; I301-G303 PolarHBondContact O-N 3.03Å; G303-K306 PolarHBondContact O-N 3.06Å; G303-L307 WeakPolarHBondContact O-CB 3.35Å; G303-L307 VanDerWaalsContact O-CG 3.26Å; G303-L307 WeakPolarHBondContact O-CG 3.4Å; G303-L307 PolarHBondContact O-N 3.18Å
304	M	98.4	Very high	98	Very high	0 Å²	0	37.1 Å²	37.1	0%	0	18%	0.183	C	C	.	.	H	α-helix	trans	-59.9	-49.6	174.2	177.2	-166.8	69.3	0	0	111.2	V299 T300 I301 E302 K306 L307 A308 I413 A414 C417 A465 L466 M469	V299-M304 HydrophobicContact CG2-CB 4.01Å; T300-M304 WeakPolarHBondContact O-CB 3.38Å; T300-M304 PolarHBondContact O-N 2.79Å; I301-M304 WeakPolarHBondContact O-CB 3.34Å; I301-M304 PolarHBondContact O-N 2.75Å; E302-M304 VanDerWaalsContact C-N 3.34Å; E302-M304 PolarHBondContact O-N 3.07Å; M304-K306 VanDerWaalsContact C-N 3.33Å; M304-K306 PolarHBondContact O-N 2.6Å; M304-L307 PolarHBondContact O-N 2.76Å; M304-A308 WeakPolarHBondContact O-CB 3.31Å; M304-A308 PolarHBondContact O-N 3.39Å; M304-I413 HydrophobicContact CB-CG2 4.25Å; M304-I413 HydrophobicContact CG-CG2 3.79Å; M304-A414 HydrophobicContact SD-CB 4.25Å; M304-C417 HydrophobicContact CB-CB 4.37Å; M304-C417 HydrophobicContact CG-CB 4.47Å; M304-C417 HydrophobicContact SD-CB 3.87Å; M304-A465 HydrophobicContact CE-CB 3.86Å; M304-L466 HydrophobicContact CE-CD2 4.36Å; M304-L466 HydrophobicContact SD-CD2 3.62Å; M304-L466 HydrophobicContact SD-CG 4.47Å; M304-M469 HydrophobicContact CE-CE 4.34Å; M304-M469 HydrophobicContact CG-CE 4.1Å; M304-M469 HydrophobicContact SD-CE 4.25Å
305	I	98.1	Very high	98	Very high	3 Å²	3	37.1 Å²	37.1	2%	0.015	18%	0.183	C	C	.	.	H	α-helix	trans	-62	-43.8	179.3	-66.6	164.8	0	0	0	110	I301 E302 A308 L309 A465 L497 E501	I301-I305 HydrophobicContact CG2-CD1 3.85Å; I301-I305 WeakPolarHBondContact O-CG1 3.33Å; I301-I305 PolarHBondContact O-N 2.98Å; E302-I305 PolarHBondContact O-N 3.17Å; I305-A308 PolarHBondContact O-N 2.98Å; I305-L309 WeakPolarHBondContact O-CB 3.1Å; I305-L309 PolarHBondContact O-N 3.34Å; I305-A465 HydrophobicContact CD1-CB 4.31Å; I305-L497 HydrophobicContact CD1-CD2 3.94Å; I305-L497 HydrophobicContact CD1-CG 3.82Å; I305-L497 HydrophobicContact CG1-CD2 3.96Å; I305-L497 HydrophobicContact CG1-CG 4.33Å; I305-E501 HydrophobicContact CD1-CB 4.42Å; I305-E501 HydrophobicContact CD1-CG 3.73Å
306	K	98.3	Very high	98	Very high	79 Å²	79	34 Å²	34	34%	0.343	17%	0.168	S	C	.	.	H	α-helix	trans	-60.9	-48	179.4	-168	175.2	-165.3	172.4	0	112.3	E302 G303 M304 S310 N346 M348	E302-K306 VanDerWaalsContact O-CB 3.31Å; E302-K306 WeakPolarHBondContact O-CB 3.37Å; E302-K306 PolarHBondContact O-N 3.08Å; G303-K306 PolarHBondContact O-N 3.06Å; M304-K306 VanDerWaalsContact C-N 3.33Å; M304-K306 PolarHBondContact O-N 2.6Å; K306-S310 WeakPolarHBondContact O-CB 3.44Å; K306-S310 PolarHBondContact O-N 3.28Å; K306-S310 PolarHBondContact O-OG 3.04Å; K306-N346 WeakPolarHBondContact CE-O 3.37Å; K306-N346 PolarHBondContact NZ-O 3.04Å; K306-M348 HydrophobicContact CG-CG 4.24Å
307	L	98.8	Very high	98.1	Very high	2 Å²	2	27.4 Å²	27.4	1%	0.01	14%	0.144	C	C	.	.	H	α-helix	trans	-62.8	-45.7	176.9	-69.8	171.8	0	0	0	111.6	L290 Y293 V299 G303 M304 S310 A311 V343 G347 C349 I413	L290-L307 HydrophobicContact CD1-CD1 4.11Å; L290-L307 HydrophobicContact CD1-CD2 4.2Å; Y293-L307 HydrophobicContact CD1-CD1 4.45Å; Y293-L307 HydrophobicContact CE1-CD1 4.25Å; V299-L307 HydrophobicContact CG1-CD1 3.86Å; G303-L307 WeakPolarHBondContact O-CB 3.35Å; G303-L307 VanDerWaalsContact O-CG 3.26Å; G303-L307 WeakPolarHBondContact O-CG 3.4Å; G303-L307 PolarHBondContact O-N 3.18Å; M304-L307 PolarHBondContact O-N 2.76Å; L307-S310 PolarHBondContact O-OG 3.01Å; L307-S310 VanDerWaalsContact O-OG 3.06Å; L307-A311 WeakPolarHBondContact O-CB 3.27Å; L307-A311 PolarHBondContact O-N 3.36Å; L307-A311 VanDerWaalsContact O-N 3.14Å; L307-V343 HydrophobicContact CD2-CG1 4.09Å; L307-V343 HydrophobicContact CD2-CG2 4.11Å; L307-G347 WeakPolarHBondContact CD2-O 3.4Å; L307-C349 VanDerWaalsContact CD2-SG 3.55Å; L307-C349 PolarHBondContact O-SG 2.84Å; L307-I413 HydrophobicContact CB-CD1 4.18Å; L307-I413 HydrophobicContact CB-CG2 4.3Å; L307-I413 HydrophobicContact CD1-CG2 4.24Å
308	A	98.8	Very high	98.1	Very high	0 Å²	0	22.5 Å²	22.5	0%	0	13%	0.125	C	C	.	.	H	α-helix	trans	-67	-45.3	-179.8	0	0	0	0	0	112	M304 I305 A311 A312 Y410 I413 M469 L494	M304-A308 WeakPolarHBondContact O-CB 3.31Å; M304-A308 PolarHBondContact O-N 3.39Å; I305-A308 PolarHBondContact O-N 2.98Å; A308-A311 PolarHBondContact O-N 3.36Å; A308-A312 WeakPolarHBondContact O-CB 3.4Å; A308-A312 PolarHBondContact O-N 2.88Å; A308-Y410 HydrophobicContact CB-CD1 4.05Å; A308-Y410 HydrophobicContact CB-CE1 3.68Å; A308-Y410 PolarHBondContact O-OH 3.27Å; A308-I413 HydrophobicContact CB-CD1 4.45Å; A308-M469 HydrophobicContact CB-CE 3.57Å; A308-L494 HydrophobicContact CB-CD1 3.79Å; A308-L494 HydrophobicContact CB-CD2 4.32Å
309	L	98.7	Very high	98.1	Very high	32 Å²	32	20.7 Å²	20.7	17%	0.168	11%	0.112	C	C	.	.	H	α-helix	trans	-65.4	-42.8	-177.6	175.4	57.9	0	0	0	111.8	I305 A312 S313 K491 L494 S495	I305-L309 WeakPolarHBondContact O-CB 3.1Å; I305-L309 PolarHBondContact O-N 3.34Å; L309-A312 PolarHBondContact O-N 3.25Å; L309-S313 VanDerWaalsContact O-CB 3.3Å; L309-S313 WeakPolarHBondContact O-CB 3.34Å; L309-S313 PolarHBondContact O-N 2.66Å; L309-S313 PolarHBondContact O-OG 3.45Å; L309-K491 HydrophobicContact CD1-CG 4Å; L309-L494 HydrophobicContact CB-CB 4.08Å; L309-L494 HydrophobicContact CB-CD1 4.44Å; L309-L494 HydrophobicContact CD1-CB 3.82Å; L309-L494 HydrophobicContact CG-CB 4.46Å; L309-S495 WeakPolarHBondContact CD1-OG 3.37Å
310	S	98.8	Very high	98.1	Very high	4 Å²	4	24.7 Å²	24.7	3%	0.028	13%	0.132	C	C	.	.	H	α-helix	trans	-65.9	-42.5	176.8	50.1	0	0	0	0	111.6	N260 K306 L307 A312 S313 G314 C349	N260-S310 WeakPolarHBondContact CB-O 3.47Å; N260-S310 VanDerWaalsContact ND2-CB 3.27Å; N260-S310 WeakPolarHBondContact ND2-CB 3.31Å; N260-S310 PolarHBondContact OD1-O 2.87Å; K306-S310 WeakPolarHBondContact O-CB 3.44Å; K306-S310 PolarHBondContact O-N 3.28Å; K306-S310 PolarHBondContact O-OG 3.04Å; L307-S310 PolarHBondContact O-OG 3.01Å; L307-S310 VanDerWaalsContact O-OG 3.06Å; S310-A312 PolarHBondContact O-N 3.17Å; S310-S313 PolarHBondContact O-N 3.12Å; S310-G314 PolarHBondContact O-N 3.42Å; S310-C349 WeakPolarHBondContact OG-CB 3.35Å; S310-C349 PolarHBondContact OG-N 3.13Å
311	A	98.8	Very high	98	Very high	1 Å²	1	25 Å²	25	1%	0.008	13%	0.128	C	C	.	.	H	α-helix	trans	-61.1	-44.8	173	0	0	0	0	0	112.1	L307 A308 S313 G314 L315 C349 L406	L307-A311 WeakPolarHBondContact O-CB 3.27Å; L307-A311 PolarHBondContact O-N 3.36Å; L307-A311 VanDerWaalsContact O-N 3.14Å; A308-A311 PolarHBondContact O-N 3.36Å; A311-S313 VanDerWaalsContact C-N 3.29Å; A311-S313 PolarHBondContact O-N 3.13Å; A311-G314 PolarHBondContact O-N 3.35Å; A311-L315 PolarHBondContact O-N 3.41Å; A311-C349 HydrophobicContact CB-CB 4.18Å; A311-L406 HydrophobicContact CB-CD1 4.31Å
312	A	98.8	Very high	97.8	Very high	0 Å²	0	25.8 Å²	25.8	0%	0	13%	0.131	C	C	.	.	H	α-helix	trans	-59.3	-41	174.9	0	0	0	0	0	112.2	A308 L309 S310 L315 A316 Y410 I490 K491 L494	A308-A312 WeakPolarHBondContact O-CB 3.4Å; A308-A312 PolarHBondContact O-N 2.88Å; L309-A312 PolarHBondContact O-N 3.25Å; S310-A312 PolarHBondContact O-N 3.17Å; A312-L315 PolarHBondContact O-N 2.61Å; A312-A316 WeakPolarHBondContact O-CB 3.43Å; A312-A316 PolarHBondContact O-N 2.78Å; A312-Y410 VanDerWaalsContact CB-OH 3.28Å; A312-Y410 WeakPolarHBondContact CB-OH 3.02Å; A312-I490 HydrophobicContact CB-CG2 3.9Å; A312-K491 HydrophobicContact CB-CB 4.3Å; A312-L494 HydrophobicContact CB-CD1 4.31Å
313	S	98.8	Very high	97.5	Very high	7 Å²	7	27 Å²	27	5%	0.049	15%	0.146	C	C	.	.	H	α-helix	trans	-67.1	-41.8	-178.5	-65.6	0	0	0	0	111.7	N260 L309 S310 A311 H317 K491	N260-S313 VanDerWaalsContact OD1-CB 3.23Å; N260-S313 WeakPolarHBondContact OD1-CB 3.5Å; L309-S313 VanDerWaalsContact O-CB 3.3Å; L309-S313 WeakPolarHBondContact O-CB 3.34Å; L309-S313 PolarHBondContact O-N 2.66Å; L309-S313 PolarHBondContact O-OG 3.45Å; S310-S313 PolarHBondContact O-N 3.12Å; A311-S313 VanDerWaalsContact C-N 3.29Å; A311-S313 PolarHBondContact O-N 3.13Å; S313-H317 WeakPolarHBondContact O-CB 3.36Å; S313-H317 PolarHBondContact O-N 3.4Å; S313-K491 WeakPolarHBondContact OG-CD 3.29Å; S313-K491 VanDerWaalsContact OG-CE 3.29Å; S313-K491 WeakPolarHBondContact OG-CE 3.26Å
314	G	98.7	Very high	96.8	Very high	0 Å²	0	28.6 Å²	28.6	0%	0	16%	0.162	C	C	.	.	H	α-helix	trans	-61.8	-46	172.3	0	0	0	0	0	112.3	S310 A311 H317 L318	S310-G314 PolarHBondContact O-N 3.42Å; A311-G314 PolarHBondContact O-N 3.35Å; G314-H317 PolarHBondContact O-N 2.93Å; G314-L318 PolarHBondContact O-N 3.44Å
315	L	98.8	Very high	95.7	Very high	0 Å²	0	35.6 Å²	35.6	0%	0	21%	0.205	C	C	.	.	H	α-helix	trans	-68	-39.6	-179.6	-169.3	66.2	0	0	0	111.9	A311 A312 H317 L318 H319 L336 I351 D402 I403 L406 A487	A311-L315 PolarHBondContact O-N 3.41Å; A312-L315 PolarHBondContact O-N 2.61Å; L315-H317 VanDerWaalsContact C-N 3.3Å; L315-H317 PolarHBondContact O-N 2.78Å; L315-L318 HydrophobicContact CD1-CD1 4.38Å; L315-L318 PolarHBondContact O-N 2.74Å; L315-H319 WeakPolarHBondContact CD1-NE2 3.37Å; L315-H319 WeakPolarHBondContact O-CB 3.32Å; L315-H319 PolarHBondContact O-N 3.41Å; L315-L336 HydrophobicContact CD1-CD2 4.23Å; L315-L336 HydrophobicContact CD2-CD2 3.93Å; L315-I351 HydrophobicContact CB-CD1 3.87Å; L315-I351 HydrophobicContact CD1-CD1 4.37Å; L315-I351 VanDerWaalsContact N-CD1 3.3Å; L315-D402 HydrophobicContact CD1-CB 4.15Å; L315-D402 HydrophobicContact CD2-CB 4.25Å; L315-I403 HydrophobicContact CD2-CD1 4.1Å; L315-L406 HydrophobicContact CD2-CB 4.17Å; L315-L406 HydrophobicContact CD2-CD2 3.72Å; L315-L406 HydrophobicContact CD2-CG 4.43Å; L315-A487 HydrophobicContact CB-CB 4.24Å; L315-A487 HydrophobicContact CD2-CB 4.21Å; L315-A487 HydrophobicContact CG-CB 4.13Å
316	A	98.8	Very high	94.9	Very high	12 Å²	12	39.7 Å²	39.7	10%	0.099	22%	0.224	C	C	.	.	H	α-helix	trans	-61.2	-40.6	174.8	0	0	0	0	0	111.3	A312 H319 M320 A487	A312-A316 WeakPolarHBondContact O-CB 3.43Å; A312-A316 PolarHBondContact O-N 2.78Å; A316-H319 PolarHBondContact O-N 3.45Å; A316-M320 WeakPolarHBondContact O-CB 3.4Å; A316-M320 PolarHBondContact O-N 2.7Å; A316-A487 HydrophobicContact CB-CB 3.86Å
317	H	98.5	Very high	94.2	Very high	20 Å²	20	37.3 Å²	37.3	9%	0.093	22%	0.222	C	C	.	.	H	α-helix	trans	-65.4	-41.9	175	-178.1	87.7	0	0	0	112.2	M255 L256 H258 I261 S313 G314 L315 M320 K328	M255-H317 PolarHBondContact O-CE1 3.08Å; M255-H317 PolarHBondContact O-NE2 3.28Å; M255-H317 VanDerWaalsContact O-NE2 3.09Å; L256-H317 PolarHBondContact O-NE2 3.03Å; H258-H317 HydrophobicContact CB-CB 4.44Å; H258-H317 AromaticContact CD2-CG 3.74Å; H258-H317 AromaticContact CD2-ND1 3.6Å; H258-H317 AromaticContact CG-CG 3.73Å; H258-H317 AromaticContact CG-ND1 3.99Å; I261-H317 HydrophobicContact CD1-CB 4.45Å; I261-H317 VanDerWaalsContact CD1-CD2 3.41Å; I261-H317 WeakPolarHBondContact CD1-CD2 3.29Å; S313-H317 WeakPolarHBondContact O-CB 3.36Å; S313-H317 PolarHBondContact O-N 3.4Å; G314-H317 PolarHBondContact O-N 2.93Å; L315-H317 VanDerWaalsContact C-N 3.3Å; L315-H317 PolarHBondContact O-N 2.78Å; H317-M320 PolarHBondContact O-N 3.1Å; H317-K328 WeakPolarHBondContact O-CE 3.24Å; H317-K328 PolarHBondContact O-NZ 3.48Å; H317-K328 VanDerWaalsContact O-NZ 3.08Å
318	L	98.3	Very high	94	Very high	0 Å²	0	37.3 Å²	37.3	0%	0	22%	0.221	C	C	.	.	H	α-helix	trans	-57.6	-51.9	173.5	-76.4	172.9	0	0	0	111.2	L256 I261 G314 L315 M320 K328 I331 I351 L354	L256-L318 HydrophobicContact CD1-CD2 3.7Å; I261-L318 HydrophobicContact CD1-CD2 3.77Å; I261-L318 HydrophobicContact CD1-CG 3.78Å; I261-L318 HydrophobicContact CG1-CG 4.46Å; G314-L318 PolarHBondContact O-N 3.44Å; L315-L318 HydrophobicContact CD1-CD1 4.38Å; L315-L318 PolarHBondContact O-N 2.74Å; L318-M320 VanDerWaalsContact C-N 3.3Å; L318-M320 PolarHBondContact O-N 3.08Å; L318-K328 PolarHBondContact O-NZ 3.22Å; L318-I331 CarbonylContact C-O 3.58Å; L318-I331 HydrophobicContact CB-CB 4.49Å; L318-I331 HydrophobicContact CD2-CB 4.19Å; L318-I331 HydrophobicContact CD2-CD1 4.5Å; L318-I331 HydrophobicContact CD2-CG2 4.22Å; L318-I331 PolarHBondContact O-N 3.19Å; L318-I351 HydrophobicContact CD1-CD1 4.18Å; L318-I351 HydrophobicContact CD1-CG2 4.04Å; L318-L354 HydrophobicContact CD1-CD2 4.16Å; L318-L354 HydrophobicContact CD2-CD1 4.39Å; L318-L354 HydrophobicContact CD2-CD2 4.39Å
319	H	98.3	Very high	93.8	Very high	16 Å²	16	38.9 Å²	38.9	7%	0.074	23%	0.232	C	C	.	.	H	α-helix	trans	-68	-26.9	-175.7	-73.1	-170	0	0	0	114	L315 A316 I331 K399 D402	L315-H319 WeakPolarHBondContact CD1-NE2 3.37Å; L315-H319 WeakPolarHBondContact O-CB 3.32Å; L315-H319 PolarHBondContact O-N 3.41Å; A316-H319 PolarHBondContact O-N 3.45Å; H319-I331 PolarHBondContact CD2-O 3.17Å; H319-I331 VanDerWaalsContact CD2-O 3.28Å; H319-I331 PolarHBondContact N-O 2.92Å; H319-K399 HydrophobicContact CB-CD 4.08Å; H319-K399 HydrophobicContact CB-CG 4.37Å; H319-K399 PolarHBondContact CE1-O 2.97Å; H319-K399 WeakPolarHBondContact O-CE 3.37Å; H319-D402 IonicContact CD2-OD2 2.71Å; H319-D402 IonicContact CE1-OD2 3.41Å; H319-D402 IonicContact NE2-OD2 2.87Å; H319-D402 PolarHBondContact NE2-OD2 3.4Å
320	M	96.4	Very high	93.6	Very high	93 Å²	93	37.4 Å²	37.4	46%	0.458	22%	0.224	S	C	.	.			trans	-74.7	127.5	-177.1	-178.8	173.1	68.3	0	0	111.3	A316 H317 L318 I322 K328	A316-M320 WeakPolarHBondContact O-CB 3.4Å; A316-M320 PolarHBondContact O-N 2.7Å; H317-M320 PolarHBondContact O-N 3.1Å; L318-M320 VanDerWaalsContact C-N 3.3Å; L318-M320 PolarHBondContact O-N 3.08Å; M320-I322 HydrophobicContact CE-CD1 4.19Å; M320-I322 HydrophobicContact CE-CG1 4.1Å; M320-K328 PolarHBondContact O-NZ 3.35Å
321	E	94	Very high	93.5	Very high	91 Å²	91	37.2 Å²	37.2	43%	0.425	22%	0.223	S	C	.	.			trans	-81.1	137.2	165.9	-171.1	-175.4	167.1	0	0	109.6	K328 A362	E321-K328 WeakPolarHBondContact CA-O 3.35Å; E321-A362 WeakPolarHBondContact OE1-CB 3.47Å
322	I	91.9	Very high	93.5	Very high	55 Å²	55	37.1 Å²	37.1	28%	0.282	22%	0.222	S	C	.	.	B	Isolated β-bridge	trans	-115.1	115	175.1	-56.2	175.4	0	0	0	107.1	M255 M320 G327 K328	M255-I322 HydrophobicContact CB-CD1 4.23Å; M320-I322 HydrophobicContact CE-CD1 4.19Å; M320-I322 HydrophobicContact CE-CG1 4.1Å; I322-G327 CarbonylContact O-C 3.39Å; I322-G327 WeakPolarHBondContact O-CA 3.43Å; I322-K328 HydrophobicContact CB-CB 3.86Å; I322-K328 HydrophobicContact CD1-CB 4Å; I322-K328 HydrophobicContact CD1-CD 4.07Å; I322-K328 HydrophobicContact CG1-CB 4.02Å; I322-K328 PolarHBondContact N-O 3.21Å; I322-K328 PolarHBondContact O-N 3.2Å
323	V	89.5	Confident	93.4	Very high	132 Å²	132	37.1 Å²	37.1	80%	0.8	22%	0.222	S	C	*	.			trans	-83.4	140	-179.8	-174.1	0	0	0	0	110
324	G	83.8	Confident	93.3	Very high	53 Å²	53	38.7 Å²	38.7	55%	0.546	23%	0.227	S	C	.	.	S	Bend	trans	154.1	178.3	176.4	0	0	0	0	0	112.7	Q326 G327	G324-Q326 PolarHBondContact O-N 3.46Å; G324-G327 PolarHBondContact O-N 3.09Å; G324-G327 VanDerWaalsContact O-N 3.13Å
325	T	75.9	Confident	93.2	Very high	147 Å²	147	39.1 Å²	39.1	90%	0.902	23%	0.23	S	C	*	.	T	Hydrogen-bonded Turn	trans	-61.6	-30.2	176	47.4	0	0	0	0	112.8
326	Q	80.4	Confident	93.2	Very high	90 Å²	90	39.3 Å²	39.3	42%	0.421	23%	0.23	S	C	.	.	T	Hydrogen-bonded Turn	trans	-114.6	54	171.3	-67.9	-61.6	-34.2	0	0	109.1	G190 V254 M255 G324	G190-Q326 PolarHBondContact O-OE1 2.9Å; V254-Q326 HydrophobicContact CG1-CB 3.75Å; V254-Q326 WeakPolarHBondContact CG1-O 3.48Å; M255-Q326 WeakPolarHBondContact CG-O 3.37Å; G324-Q326 PolarHBondContact O-N 3.46Å
327	G	84.8	Confident	93.1	Very high	28 Å²	28	40 Å²	40	29%	0.289	23%	0.231	S	C	.	.			trans	-68.6	156.2	-178.4	0	0	0	0	0	113.2	I322 G324	I322-G327 CarbonylContact O-C 3.39Å; I322-G327 WeakPolarHBondContact O-CA 3.43Å; G324-G327 PolarHBondContact O-N 3.09Å; G324-G327 VanDerWaalsContact O-N 3.13Å
328	K	93.3	Very high	93.1	Very high	2 Å²	2	39 Å²	39	1%	0.009	23%	0.227	C	C	.	.	B	Isolated β-bridge	trans	-111.2	122.6	172.7	-173.4	-167.2	146.6	-63.1	0	108.7	T253 V254 M255 H317 L318 M320 E321 I322	T253-K328 HydrophobicContact CG2-CG 4.29Å; V254-K328 WeakPolarHBondContact O-CB 3.27Å; V254-K328 WeakPolarHBondContact O-CG 3.4Å; M255-K328 HydrophobicContact CB-CB 4.12Å; H317-K328 WeakPolarHBondContact O-CE 3.24Å; H317-K328 PolarHBondContact O-NZ 3.48Å; H317-K328 VanDerWaalsContact O-NZ 3.08Å; L318-K328 PolarHBondContact O-NZ 3.22Å; M320-K328 PolarHBondContact O-NZ 3.35Å; E321-K328 WeakPolarHBondContact CA-O 3.35Å; I322-K328 HydrophobicContact CB-CB 3.86Å; I322-K328 HydrophobicContact CD1-CB 4Å; I322-K328 HydrophobicContact CD1-CD 4.07Å; I322-K328 HydrophobicContact CG1-CB 4.02Å; I322-K328 PolarHBondContact N-O 3.21Å; I322-K328 PolarHBondContact O-N 3.2Å
329	P	94.3	Very high	93.1	Very high	33 Å²	33	44.5 Å²	44.5	21%	0.214	25%	0.25	C	S	.	.			trans	-64.3	155.1	172	28	-34.1	0	0	0	110.8	T253 I331 R359 H360	T253-P329 HydrophobicContact CG2-CG 3.97Å; P329-I331 WeakPolarHBondContact O-CG1 3.44Å; P329-I331 PolarHBondContact O-N 3.38Å; P329-R359 HydrophobicContact CB-CB 4.26Å; P329-R359 HydrophobicContact CG-CB 4.17Å; P329-R359 HydrophobicContact CG-CG 4.2Å; P329-H360 WeakPolarHBondContact CB-O 3.38Å
330	G	95.7	Very high	93.1	Very high	1 Å²	1	44.5 Å²	44.5	1%	0.01	25%	0.251	C	S	.	.			trans	-62.5	136.3	165.9	0	0	0	0	0	109.9	R359 H360 F395	G330-R359 WeakPolarHBondContact O-CA 3.21Å; G330-H360 PolarHBondContact O-N 3.39Å; G330-F395 WeakPolarHBondContact O-CZ 3.43Å
331	I	97.1	Very high	93.2	Very high	0 Å²	0	40 Å²	40	0%	0	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	129	-179.5	-49.3	-171.8	0	0	0	109.7	I250 T253 L256 L318 H319 P329 A357 V358 R359	I250-I331 HydrophobicContact CG2-CD1 4.49Å; T253-I331 HydrophobicContact CG2-CD1 4.23Å; L256-I331 HydrophobicContact CD1-CD1 3.95Å; L318-I331 CarbonylContact C-O 3.58Å; L318-I331 HydrophobicContact CB-CB 4.49Å; L318-I331 HydrophobicContact CD2-CB 4.19Å; L318-I331 HydrophobicContact CD2-CD1 4.5Å; L318-I331 HydrophobicContact CD2-CG2 4.22Å; L318-I331 PolarHBondContact O-N 3.19Å; H319-I331 PolarHBondContact CD2-O 3.17Å; H319-I331 VanDerWaalsContact CD2-O 3.28Å; H319-I331 PolarHBondContact N-O 2.92Å; P329-I331 WeakPolarHBondContact O-CG1 3.44Å; P329-I331 PolarHBondContact O-N 3.38Å; I331-A357 HydrophobicContact CG2-CB 3.83Å; I331-V358 CarbonylContact C-O 3.59Å; I331-V358 VanDerWaalsContact CA-O 3.31Å; I331-V358 WeakPolarHBondContact CA-O 3.12Å; I331-R359 HydrophobicContact CD1-CG 4.4Å; I331-R359 HydrophobicContact CG1-CG 4.18Å
332	A	97.2	Very high	93.4	Very high	0 Å²	0	37.3 Å²	37.3	0%	0	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	137.9	170	0	0	0	0	0	110.1	A357 V358 F395 F398 D402	A332-A357 CarbonylContact O-C 3.22Å; A332-A357 WeakPolarHBondContact O-CA 3.42Å; A332-A357 WeakPolarHBondContact O-CB 3.29Å; A332-V358 HydrophobicContact CB-CG2 4.02Å; A332-V358 PolarHBondContact N-O 3.44Å; A332-V358 PolarHBondContact O-N 3.5Å; A332-F395 HydrophobicContact CB-CE2 3.82Å; A332-F395 HydrophobicContact CB-CZ 4.1Å; A332-F398 HydrophobicContact CB-CB 3.45Å; A332-F398 VanDerWaalsContact CB-CB 3.45Å; A332-D402 WeakPolarHBondContact CA-OD2 3.18Å
333	H	97.7	Very high	93.7	Very high	0 Å²	0	34.7 Å²	34.7	0%	0	20%	0.204	C	C	.	.			trans	-79.7	-43.1	-168.9	-173.8	-37.7	0	0	0	113.3	D335 I351 A352 D353 D402	H333-D335 PolarHBondContact CE1-O 2.91Å; H333-D335 PolarHBondContact ND1-N 3.44Å; H333-D335 PolarHBondContact O-N 3.34Å; H333-D335 VanDerWaalsContact O-N 3.09Å; H333-I351 WeakPolarHBondContact CD2-CG2 3.28Å; H333-A352 PolarHBondContact NE2-O 3.19Å; H333-A352 VanDerWaalsContact NE2-O 3.09Å; H333-D353 PolarHBondContact CE1-O 2.79Å; H333-D402 PolarHBondContact N-OD1 2.92Å; H333-D402 PolarHBondContact N-OD2 3.47Å
334	R	95.6	Very high	94.1	Very high	39 Å²	39	29.8 Å²	29.8	15%	0.147	17%	0.172	C	C	.	.	S	Bend	trans	65.1	-0.8	179.7	-55.4	-179.7	64.5	-166	7.5	117.3	L356 V358 N372 Q373 V375 F398 D402	R334-L356 WeakPolarHBondContact CD-O 3.42Å; R334-V358 HydrophobicContact CG-CG2 4.33Å; R334-N372 PolarHBondContact NH2-O 3.5Å; R334-Q373 PolarHBondContact NH2-O 2.88Å; R334-V375 HydrophobicContact CB-CG2 4.44Å; R334-V375 VanDerWaalsContact NH2-CG2 3.28Å; R334-F398 HydrophobicContact CG-CD1 4.12Å; R334-D402 PolarHBondContact N-OD1 3.24Å
335	D	96.6	Very high	94.7	Very high	10 Å²	10	35.2 Å²	35.2	5%	0.053	18%	0.18	C	C	.	.			trans	-147.7	40.6	174.2	-165.6	32.5	0	0	0	111.9	H333 K337 N340 L356 G376 T377	H333-D335 PolarHBondContact CE1-O 2.91Å; H333-D335 PolarHBondContact ND1-N 3.44Å; H333-D335 PolarHBondContact O-N 3.34Å; H333-D335 VanDerWaalsContact O-N 3.09Å; D335-K337 PolarHBondContact O-N 3.42Å; D335-K337 IonicContact OD1-NZ 3.6Å; D335-K337 PolarHBondContact OD1-NZ 3Å; D335-K337 IonicContact OD2-NZ 3.65Å; D335-K337 PolarHBondContact OD2-NZ 3.09Å; D335-N340 PolarHBondContact O-ND2 3.16Å; D335-N340 PolarHBondContact OD2-ND2 3.49Å; D335-L356 HydrophobicContact CB-CD1 3.83Å; D335-G376 WeakPolarHBondContact OD1-CA 3.42Å; D335-T377 VanDerWaalsContact OD1-CB 3.3Å; D335-T377 WeakPolarHBondContact OD1-CB 3.38Å; D335-T377 PolarHBondContact OD1-N 2.58Å; D335-T377 PolarHBondContact OD1-OG1 3.12Å
336	L	98.4	Very high	95.5	Very high	3 Å²	3	32.1 Å²	32.1	2%	0.016	16%	0.158	C	C	.	.			trans	-70	125.7	177.7	-167.5	72	0	0	0	109.9	L315 I341 I351 A405 L406	L315-L336 HydrophobicContact CD1-CD2 4.23Å; L315-L336 HydrophobicContact CD2-CD2 3.93Å; L336-I341 HydrophobicContact CD1-CD1 4.15Å; L336-I341 HydrophobicContact CD1-CG1 4.23Å; L336-I351 HydrophobicContact CD1-CD1 4.2Å; L336-I351 HydrophobicContact CD1-CG1 4.49Å; L336-I351 HydrophobicContact CD1-CG2 4.2Å; L336-A405 HydrophobicContact CB-CB 4.11Å; L336-A405 WeakPolarHBondContact O-CB 3.34Å; L336-L406 HydrophobicContact CD2-CB 3.76Å; L336-L406 HydrophobicContact CD2-CD1 4.16Å
337	K	98.5	Very high	96.2	Very high	27 Å²	27	28.6 Å²	28.6	12%	0.117	15%	0.146	C	C	.	.			trans	-163.1	164.2	179	65.2	-157.8	-174.7	-147.7	0	109.9	D335 K339 N340 I341 T377 Y380	D335-K337 PolarHBondContact O-N 3.42Å; D335-K337 IonicContact OD1-NZ 3.6Å; D335-K337 PolarHBondContact OD1-NZ 3Å; D335-K337 IonicContact OD2-NZ 3.65Å; D335-K337 PolarHBondContact OD2-NZ 3.09Å; K337-K339 HydrophobicContact CG-CB 4.2Å; K337-K339 PolarHBondContact O-N 2.94Å; K337-K339 VanDerWaalsContact O-N 3.16Å; K337-N340 VanDerWaalsContact CE-CG 3.46Å; K337-N340 WeakPolarHBondContact CE-ND2 3.12Å; K337-N340 VanDerWaalsContact CE-OD1 3.28Å; K337-N340 WeakPolarHBondContact CE-OD1 3.08Å; K337-N340 HydrophobicContact CG-CB 4.04Å; K337-N340 PolarHBondContact NZ-ND2 2.78Å; K337-N340 PolarHBondContact O-N 3.44Å; K337-I341 PolarHBondContact O-N 3.29Å; K337-T377 HydrophobicContact CD-CG2 4.18Å; K337-T377 WeakPolarHBondContact CD-OG1 3.37Å; K337-T377 WeakPolarHBondContact CE-OG1 3.04Å; K337-T377 PolarHBondContact NZ-OG1 2.68Å; K337-Y380 HydrophobicContact CB-CD1 4Å; K337-Y380 HydrophobicContact CB-CD2 3.83Å; K337-Y380 HydrophobicContact CB-CE1 3.93Å; K337-Y380 HydrophobicContact CB-CE2 3.76Å; K337-Y380 HydrophobicContact CB-CG 3.96Å
338	S	98.6	Very high	96.8	Very high	0 Å²	0	29.2 Å²	29.2	0%	0	14%	0.142	C	C	.	.	G	3₁₀ helix	trans	-59.2	-28.6	-179.3	54.8	0	0	0	0	113.9	L290 F291 N340 Y380 E412	L290-S338 WeakPolarHBondContact CB-O 3.34Å; L290-S338 PolarHBondContact N-O 2.79Å; F291-S338 PolarHBondContact N-O 3Å; F291-S338 VanDerWaalsContact N-O 3.09Å; S338-N340 VanDerWaalsContact C-N 3.32Å; S338-N340 PolarHBondContact O-N 3.37Å; S338-Y380 PolarHBondContact OG-OH 3.06Å; S338-E412 VanDerWaalsContact CB-OE2 3.24Å; S338-E412 WeakPolarHBondContact CB-OE2 3.47Å; S338-E412 PolarHBondContact OG-OE1 3.34Å; S338-E412 PolarHBondContact OG-OE2 3.09Å
339	K	97.2	Very high	97.1	Very high	114 Å²	114	29.1 Å²	29.1	50%	0.496	14%	0.142	S	C	.	.	G	3₁₀ helix	trans	-70.4	-22.9	173.1	-69.1	-174	175.9	-173.9	0	114.5	S289 F291 K337	S289-K339 WeakPolarHBondContact CB-O 3.31Å; F291-K339 HydrophobicContact CB-CB 4.43Å; F291-K339 HydrophobicContact CB-CG 3.59Å; F291-K339 HydrophobicContact CD1-CG 4.18Å; F291-K339 HydrophobicContact CD2-CD 4.49Å; F291-K339 HydrophobicContact CD2-CG 3.96Å; F291-K339 HydrophobicContact CG-CD 4.4Å; F291-K339 HydrophobicContact CG-CG 3.64Å; K337-K339 HydrophobicContact CG-CB 4.2Å; K337-K339 PolarHBondContact O-N 2.94Å; K337-K339 VanDerWaalsContact O-N 3.16Å
340	N	97.8	Very high	97.3	Very high	16 Å²	16	27.6 Å²	27.6	9%	0.086	13%	0.132	C	C	.	.	G	3₁₀ helix	trans	-102.3	12.6	-178.9	-71.5	4	0	0	0	112.3	D335 K337 S338 A352 D353	D335-N340 PolarHBondContact O-ND2 3.16Å; D335-N340 PolarHBondContact OD2-ND2 3.49Å; K337-N340 VanDerWaalsContact CE-CG 3.46Å; K337-N340 WeakPolarHBondContact CE-ND2 3.12Å; K337-N340 VanDerWaalsContact CE-OD1 3.28Å; K337-N340 WeakPolarHBondContact CE-OD1 3.08Å; K337-N340 HydrophobicContact CG-CB 4.04Å; K337-N340 PolarHBondContact NZ-ND2 2.78Å; K337-N340 PolarHBondContact O-N 3.44Å; S338-N340 VanDerWaalsContact C-N 3.32Å; S338-N340 PolarHBondContact O-N 3.37Å; N340-A352 PolarHBondContact O-N 3.3Å; N340-D353 HydrophobicContact CB-CB 4.2Å; N340-D353 PolarHBondContact ND2-OD2 3.34Å; N340-D353 VanDerWaalsContact ND2-OD2 3.09Å; N340-D353 PolarHBondContact OD1-OD2 3.29Å
341	I	98.8	Very high	97.5	Very high	0 Å²	0	27.6 Å²	27.6	0%	0	13%	0.131	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	127.3	172.1	-61.8	168.3	0	0	0	106.1	S289 L290 L336 K337 C349 A350 I351 V409	S289-I341 CarbonylContact C-O 3.5Å; S289-I341 VanDerWaalsContact CA-O 3.28Å; S289-I341 WeakPolarHBondContact CA-O 3.18Å; L290-I341 HydrophobicContact CB-CB 4.14Å; L290-I341 HydrophobicContact CB-CG2 4.22Å; L290-I341 HydrophobicContact CD2-CB 4.42Å; L290-I341 HydrophobicContact CD2-CD1 4.43Å; L290-I341 HydrophobicContact CD2-CG2 4.27Å; L290-I341 PolarHBondContact N-O 3.48Å; L336-I341 HydrophobicContact CD1-CD1 4.15Å; L336-I341 HydrophobicContact CD1-CG1 4.23Å; K337-I341 PolarHBondContact O-N 3.29Å; I341-C349 HydrophobicContact CG2-CB 3.61Å; I341-A350 CarbonylContact C-O 3.57Å; I341-I351 HydrophobicContact CG1-CG1 4.5Å; I341-V409 HydrophobicContact CD1-CG1 3.94Å; I341-V409 HydrophobicContact CD1-CG2 4.32Å
342	L	98.6	Very high	97.4	Very high	33 Å²	33	28 Å²	28	17%	0.173	14%	0.135	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.8	148.9	179	-60.2	175.9	0	0	0	110.5	L262 H285 G288 C349 A350 A352	L262-L342 HydrophobicContact CD1-CD1 3.86Å; L262-L342 HydrophobicContact CD2-CD1 4.18Å; H285-L342 HydrophobicContact CB-CB 4.37Å; G288-L342 WeakPolarHBondContact O-CA 3.14Å; L342-C349 CarbonylContact O-C 3.55Å; L342-C349 WeakPolarHBondContact O-CA 3.37Å; L342-A350 PolarHBondContact N-O 2.91Å; L342-A350 PolarHBondContact O-N 3.4Å; L342-A352 HydrophobicContact CD1-CB 4.02Å; L342-A352 HydrophobicContact CG-CB 4.05Å
343	V	98.7	Very high	97.3	Very high	0 Å²	0	29.4 Å²	29.4	0%	0	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	126.8	174.3	-176.1	0	0	0	0	109.4	H287 G288 L290 Y293 L307	H287-V343 HydrophobicContact CB-CB 3.95Å; H287-V343 HydrophobicContact CB-CG1 4.22Å; H287-V343 WeakPolarHBondContact CB-O 3.32Å; G288-V343 PolarHBondContact O-N 3.13Å; L290-V343 HydrophobicContact CB-CG2 4.14Å; L290-V343 HydrophobicContact CD1-CG2 3.9Å; Y293-V343 HydrophobicContact CD1-CG2 4.34Å; Y293-V343 HydrophobicContact CD2-CB 4.14Å; Y293-V343 HydrophobicContact CD2-CG1 3.9Å; Y293-V343 HydrophobicContact CD2-CG2 4.31Å; Y293-V343 HydrophobicContact CE2-CG1 3.97Å; Y293-V343 HydrophobicContact CG-CB 4.26Å; Y293-V343 HydrophobicContact CG-CG1 4.21Å; Y293-V343 HydrophobicContact CG-CG2 3.9Å; L307-V343 HydrophobicContact CD2-CG1 4.09Å; L307-V343 HydrophobicContact CD2-CG2 4.11Å
344	K	97.6	Very high	97.2	Very high	30 Å²	30	29.4 Å²	29.4	13%	0.13	14%	0.143	C	C	.	.	P	Polyproline II helix	trans	-84.1	161.4	177.5	-61.8	-173.1	177.7	-161.6	0	110.8	E259 H287 N346 G347 M348	E259-K344 VanDerWaalsContact O-CE 3.27Å; E259-K344 WeakPolarHBondContact O-CE 3.32Å; E259-K344 PolarHBondContact O-NZ 2.7Å; H287-K344 PolarHBondContact CD2-O 3.37Å; K344-N346 WeakPolarHBondContact CB-OD1 3.36Å; K344-N346 PolarHBondContact O-N 3.4Å; K344-N346 VanDerWaalsContact O-N 3.1Å; K344-G347 PolarHBondContact O-N 3.23Å; K344-M348 WeakPolarHBondContact CB-O 3.4Å; K344-M348 WeakPolarHBondContact CG-O 3.47Å; K344-M348 PolarHBondContact N-O 3.33Å
345	K	95.4	Very high	97	Very high	167 Å²	167	28 Å²	28	73%	0.726	14%	0.14	S	C	*	.	T	Hydrogen-bonded Turn	trans	-53.5	-31.2	176.5	-174.7	175.1	-175.6	173.3	0	114.1	E286 G347	E286-K345 WeakPolarHBondContact OE1-CD 3.3Å; E286-K345 WeakPolarHBondContact OE1-CG 3.45Å; K345-G347 VanDerWaalsContact C-N 3.25Å; K345-G347 PolarHBondContact O-N 2.83Å
346	N	94.3	Very high	96.8	Very high	81 Å²	81	29 Å²	29	43%	0.433	15%	0.145	S	C	.	.	T	Hydrogen-bonded Turn	trans	-83.4	6.3	177.2	64.3	7.5	0	0	0	113.9	K306 K344 M348	K306-N346 WeakPolarHBondContact CE-O 3.37Å; K306-N346 PolarHBondContact NZ-O 3.04Å; K344-N346 WeakPolarHBondContact CB-OD1 3.36Å; K344-N346 PolarHBondContact O-N 3.4Å; K344-N346 VanDerWaalsContact O-N 3.1Å; N346-M348 VanDerWaalsContact C-N 3.33Å; N346-M348 WeakPolarHBondContact ND2-CE 3.4Å; N346-M348 PolarHBondContact O-N 3.35Å; N346-M348 WeakPolarHBondContact OD1-CB 3.37Å; N346-M348 PolarHBondContact OD1-N 2.95Å; N346-M348 VanDerWaalsContact OD1-N 3.12Å
347	G	94.6	Very high	96.6	Very high	17 Å²	17	28.9 Å²	28.9	18%	0.175	14%	0.144	C	C	.	.	S	Bend	trans	77.6	11.4	-179.6	0	0	0	0	0	114.8	L307 K344 K345	L307-G347 WeakPolarHBondContact CD2-O 3.4Å; K344-G347 PolarHBondContact O-N 3.23Å; K345-G347 VanDerWaalsContact C-N 3.25Å; K345-G347 PolarHBondContact O-N 2.83Å
348	M	97.9	Very high	96.3	Very high	41 Å²	41	27.7 Å²	27.7	20%	0.202	14%	0.139	C	C	.	.			trans	-93	154.5	172.2	-61.9	-159.8	-72.8	0	0	111.8	K306 K344 N346	K306-M348 HydrophobicContact CG-CG 4.24Å; K344-M348 WeakPolarHBondContact CB-O 3.4Å; K344-M348 WeakPolarHBondContact CG-O 3.47Å; K344-M348 PolarHBondContact N-O 3.33Å; N346-M348 VanDerWaalsContact C-N 3.33Å; N346-M348 WeakPolarHBondContact ND2-CE 3.4Å; N346-M348 PolarHBondContact O-N 3.35Å; N346-M348 WeakPolarHBondContact OD1-CB 3.37Å; N346-M348 PolarHBondContact OD1-N 2.95Å; N346-M348 VanDerWaalsContact OD1-N 3.12Å
349	C	98.7	Very high	96.1	Very high	0 Å²	0	30.2 Å²	30.2	0%	0	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.3	152.4	176.1	-67.3	0	0	0	0	112.6	N260 L307 S310 A311 I341 L342	N260-C349 WeakPolarHBondContact CA-O 3.45Å; N260-C349 WeakPolarHBondContact CB-O 3.38Å; N260-C349 PolarHBondContact ND2-O 3.09Å; L307-C349 VanDerWaalsContact CD2-SG 3.55Å; L307-C349 PolarHBondContact O-SG 2.84Å; S310-C349 WeakPolarHBondContact OG-CB 3.35Å; S310-C349 PolarHBondContact OG-N 3.13Å; A311-C349 HydrophobicContact CB-CB 4.18Å; I341-C349 HydrophobicContact CG2-CB 3.61Å; L342-C349 CarbonylContact O-C 3.55Å; L342-C349 WeakPolarHBondContact O-CA 3.37Å
350	A	98.6	Very high	95.8	Very high	0 Å²	0	26 Å²	26	0%	0	13%	0.131	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.5	130	161.1	0	0	0	0	0	110.8	N260 I341 L342	N260-A350 WeakPolarHBondContact O-CA 3.45Å; I341-A350 CarbonylContact C-O 3.57Å; L342-A350 PolarHBondContact N-O 2.91Å; L342-A350 PolarHBondContact O-N 3.4Å
351	I	98.8	Very high	95.2	Very high	1 Å²	1	28.6 Å²	28.6	1%	0.005	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.3	133.3	176.3	-61.2	-179.4	0	0	0	109.7	N260 L262 L315 L318 H333 L336 I341 L354	N260-I351 PolarHBondContact O-N 3.22Å; L262-I351 WeakPolarHBondContact CB-O 3.33Å; L262-I351 PolarHBondContact N-O 3.2Å; L315-I351 HydrophobicContact CB-CD1 3.87Å; L315-I351 HydrophobicContact CD1-CD1 4.37Å; L315-I351 VanDerWaalsContact N-CD1 3.3Å; L318-I351 HydrophobicContact CD1-CD1 4.18Å; L318-I351 HydrophobicContact CD1-CG2 4.04Å; H333-I351 WeakPolarHBondContact CD2-CG2 3.28Å; L336-I351 HydrophobicContact CD1-CD1 4.2Å; L336-I351 HydrophobicContact CD1-CG1 4.49Å; L336-I351 HydrophobicContact CD1-CG2 4.2Å; I341-I351 HydrophobicContact CG1-CG1 4.5Å; I351-L354 HydrophobicContact CG2-CD2 4.3Å
352	A	96.9	Very high	94.3	Very high	9 Å²	9	30.7 Å²	30.7	7%	0.074	16%	0.162	C	C	.	.			trans	-127.8	177.1	-177.7	0	0	0	0	0	111.5	L262 H333 N340 L342	L262-A352 HydrophobicContact CB-CB 4.12Å; L262-A352 HydrophobicContact CD2-CB 3.76Å; H333-A352 PolarHBondContact NE2-O 3.19Å; H333-A352 VanDerWaalsContact NE2-O 3.09Å; N340-A352 PolarHBondContact O-N 3.3Å; L342-A352 HydrophobicContact CD1-CB 4.02Å; L342-A352 HydrophobicContact CG-CB 4.05Å
353	D	94.1	Very high	93.5	Very high	30 Å²	30	35.7 Å²	35.7	16%	0.16	19%	0.194	C	C	.	.			trans	59.6	62.5	174.9	-161.8	26.3	0	0	0	113.8	K234 Y251 H333 N340 G355	K234-D353 IonicContact NZ-OD1 3.66Å; K234-D353 PolarHBondContact NZ-OD1 2.87Å; Y251-D353 PolarHBondContact OH-N 3.12Å; Y251-D353 VanDerWaalsContact OH-N 3.12Å; H333-D353 PolarHBondContact CE1-O 2.79Å; N340-D353 HydrophobicContact CB-CB 4.2Å; N340-D353 PolarHBondContact ND2-OD2 3.34Å; N340-D353 VanDerWaalsContact ND2-OD2 3.09Å; N340-D353 PolarHBondContact OD1-OD2 3.29Å; D353-G355 PolarHBondContact O-N 3.47Å
354	L	94.7	Very high	92.7	Very high	0 Å²	0	39.4 Å²	39.4	0%	0	22%	0.217	C	C	.	.	G	3₁₀ helix	trans	-83.6	13	-179.5	-56.5	-179	0	0	0	113.7	I250 Y251 L256 I261 L318 I351 L356 A357	I250-L354 HydrophobicContact CB-CB 4.39Å; I250-L354 HydrophobicContact CG2-CB 3.71Å; I250-L354 HydrophobicContact CG2-CD1 3.87Å; I250-L354 HydrophobicContact CG2-CG 4.42Å; Y251-L354 HydrophobicContact CD1-CD1 3.95Å; Y251-L354 HydrophobicContact CE1-CD1 3.63Å; Y251-L354 HydrophobicContact CE1-CG 4.06Å; Y251-L354 HydrophobicContact CE2-CB 4.26Å; Y251-L354 HydrophobicContact CE2-CG 4.4Å; L256-L354 HydrophobicContact CD2-CD1 4.19Å; I261-L354 HydrophobicContact CG2-CD1 4.44Å; L318-L354 HydrophobicContact CD1-CD2 4.16Å; L318-L354 HydrophobicContact CD2-CD1 4.39Å; L318-L354 HydrophobicContact CD2-CD2 4.39Å; I351-L354 HydrophobicContact CG2-CD2 4.3Å; L354-L356 PolarHBondContact O-N 3.31Å; L354-L356 VanDerWaalsContact O-N 3.15Å; L354-A357 HydrophobicContact CB-CB 4.28Å; L354-A357 WeakPolarHBondContact O-CB 3.4Å; L354-A357 PolarHBondContact O-N 2.56Å
355	G	91.6	Very high	92.1	Very high	8 Å²	8	43.1 Å²	43.1	8%	0.082	24%	0.238	C	C	.	.	G	3₁₀ helix	trans	-66.2	-17.4	-173.7	0	0	0	0	0	115.2	D353	D353-G355 PolarHBondContact O-N 3.47Å
356	L	92.2	Very high	91.6	Very high	31 Å²	31	38.7 Å²	38.7	16%	0.162	23%	0.225	C	C	.	.	G	3₁₀ helix	trans	-104.5	2	174.9	-65.4	176.9	0	0	0	113.4	F218 R334 D335 L354 V375	F218-L356 HydrophobicContact CZ-CD2 4.41Å; R334-L356 WeakPolarHBondContact CD-O 3.42Å; D335-L356 HydrophobicContact CB-CD1 3.83Å; L354-L356 PolarHBondContact O-N 3.31Å; L354-L356 VanDerWaalsContact O-N 3.15Å; L356-V375 HydrophobicContact CD1-CB 4.37Å; L356-V375 HydrophobicContact CD1-CG2 4.43Å; L356-V375 HydrophobicContact CD2-CB 4.3Å; L356-V375 HydrophobicContact CD2-CG2 4.4Å
357	A	94.4	Very high	91.1	Very high	1 Å²	1	36 Å²	36	1%	0.008	21%	0.21	C	C	.	.			trans	-66.3	155.3	-176	0	0	0	0	0	111.9	R246 I250 I331 A332 L354	R246-A357 PolarHBondContact NE-O 2.88Å; R246-A357 PolarHBondContact NH2-O 3.41Å; I250-A357 HydrophobicContact CD1-CB 4.41Å; I250-A357 HydrophobicContact CG1-CB 4.32Å; I250-A357 HydrophobicContact CG2-CB 4.18Å; I331-A357 HydrophobicContact CG2-CB 3.83Å; A332-A357 CarbonylContact O-C 3.22Å; A332-A357 WeakPolarHBondContact O-CA 3.42Å; A332-A357 WeakPolarHBondContact O-CB 3.29Å; L354-A357 HydrophobicContact CB-CB 4.28Å; L354-A357 WeakPolarHBondContact O-CB 3.4Å; L354-A357 PolarHBondContact O-N 2.56Å
358	V	93.3	Very high	90.4	Very high	2 Å²	2	37.7 Å²	37.7	1%	0.012	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	140.4	177.1	-62.5	0	0	0	0	110	I331 A332 R334 I367 D368 I369 F395 F398	I331-V358 CarbonylContact C-O 3.59Å; I331-V358 VanDerWaalsContact CA-O 3.31Å; I331-V358 WeakPolarHBondContact CA-O 3.12Å; A332-V358 HydrophobicContact CB-CG2 4.02Å; A332-V358 PolarHBondContact N-O 3.44Å; A332-V358 PolarHBondContact O-N 3.5Å; R334-V358 HydrophobicContact CG-CG2 4.33Å; V358-I367 HydrophobicContact CB-CG2 3.85Å; V358-I367 HydrophobicContact CG2-CG2 4Å; V358-D368 WeakPolarHBondContact CA-OD1 3.43Å; V358-I369 HydrophobicContact CB-CG1 4.27Å; V358-I369 HydrophobicContact CG1-CB 4.47Å; V358-I369 HydrophobicContact CG1-CG1 3.89Å; V358-I369 HydrophobicContact CG1-CG2 4.37Å; V358-F395 HydrophobicContact CG2-CE2 4.19Å; V358-F398 HydrophobicContact CG2-CB 4.45Å; V358-F398 HydrophobicContact CG2-CD2 4.42Å; V358-F398 HydrophobicContact CG2-CG 4.2Å
359	R	93	Very high	89	Confident	53 Å²	53	37.8 Å²	37.8	20%	0.2	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	141.7	177.9	-60.6	178.5	-65.7	-172.5	2.6	109.5	E249 I250 P329 G330 I331 I367 D368	E249-R359 IonicContact OE1-CZ 3.83Å; E249-R359 IonicContact OE1-NH1 3.58Å; E249-R359 IonicContact OE1-NH2 2.86Å; E249-R359 PolarHBondContact OE1-NH2 3.03Å; E249-R359 IonicContact OE2-NH2 3.52Å; E249-R359 PolarHBondContact OE2-NH2 3.38Å; I250-R359 HydrophobicContact CD1-CG 3.62Å; P329-R359 HydrophobicContact CB-CB 4.26Å; P329-R359 HydrophobicContact CG-CB 4.17Å; P329-R359 HydrophobicContact CG-CG 4.2Å; G330-R359 WeakPolarHBondContact O-CA 3.21Å; I331-R359 HydrophobicContact CD1-CG 4.4Å; I331-R359 HydrophobicContact CG1-CG 4.18Å; R359-I367 WeakPolarHBondContact O-CA 3.25Å; R359-I367 WeakPolarHBondContact O-CG2 3.41Å; R359-D368 IonicContact CZ-OD2 3.3Å; R359-D368 PolarHBondContact N-OD1 3.38Å; R359-D368 IonicContact NE-OD2 2.71Å; R359-D368 PolarHBondContact NE-OD2 3.38Å; R359-D368 IonicContact NH2-OD2 2.72Å; R359-D368 PolarHBondContact NH2-OD2 3.29Å; R359-D368 VanDerWaalsContact NH2-OD2 3.12Å; R359-D368 PolarHBondContact O-N 3.18Å
360	H	91.3	Very high	87.2	Confident	27 Å²	27	41.3 Å²	41.3	13%	0.125	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.8	125.7	171.2	-178	-134.5	0	0	0	110	P329 G330 D365 T366 F395	P329-H360 WeakPolarHBondContact CB-O 3.38Å; G330-H360 PolarHBondContact O-N 3.39Å; H360-D365 IonicContact CD2-OD1 3.94Å; H360-D365 IonicContact CE1-OD1 3.71Å; H360-D365 IonicContact NE2-OD1 2.87Å; H360-D365 PolarHBondContact NE2-OD1 3.39Å; H360-T366 PolarHBondContact CD2-O 3.43Å; H360-F395 HydrophobicContact CB-CB 4.14Å; H360-F395 HydrophobicContact CB-CD1 3.43Å; H360-F395 VanDerWaalsContact CB-CD1 3.43Å; H360-F395 HydrophobicContact CB-CD2 3.78Å; H360-F395 HydrophobicContact CB-CE1 3.64Å; H360-F395 HydrophobicContact CB-CE2 4Å; H360-F395 HydrophobicContact CB-CG 3.52Å; H360-F395 HydrophobicContact CB-CZ 3.96Å; H360-F395 AromaticContact CG-CD1 3.71Å; H360-F395 AromaticContact CG-CG 3.77Å; H360-F395 AromaticContact ND1-CD1 3.93Å
361	D	86.2	Confident	85.1	Confident	69 Å²	69	47 Å²	47	37%	0.369	28%	0.282	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.8	100.8	164.5	178	0.6	0	0	0	108.2	V363 T364 D365 T366	D361-V363 PolarHBondContact O-N 3Å; D361-V363 WeakPolarHBondContact OD1-CB 3.42Å; D361-V363 PolarHBondContact OD1-N 3.24Å; D361-T364 WeakPolarHBondContact CB-OG1 3.48Å; D361-T364 PolarHBondContact O-N 3.38Å; D361-T364 PolarHBondContact OD1-N 2.91Å; D361-T364 WeakPolarHBondContact OD2-CG2 3.45Å; D361-T364 PolarHBondContact OD2-OG1 2.98Å; D361-D365 VanDerWaalsContact O-CA 3.26Å; D361-D365 WeakPolarHBondContact O-CA 3.29Å; D361-D365 PolarHBondContact O-N 3.31Å; D361-T366 PolarHBondContact N-O 3.25Å; D361-T366 PolarHBondContact O-N 3.49Å
362	A	80	Confident	83.7	Confident	44 Å²	44	52.4 Å²	52.4	36%	0.364	31%	0.311	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.8	-20.8	-178.8	0	0	0	0	0	113.5	E321	E321-A362 WeakPolarHBondContact OE1-CB 3.47Å
363	V	80.4	Confident	82.2	Confident	138 Å²	138	56 Å²	56	84%	0.836	33%	0.326	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.8	-43.1	-179.5	180	0	0	0	0	110.7	D361	D361-V363 PolarHBondContact O-N 3Å; D361-V363 WeakPolarHBondContact OD1-CB 3.42Å; D361-V363 PolarHBondContact OD1-N 3.24Å
364	T	83.7	Confident	81.4	Confident	79 Å²	79	58.9 Å²	58.9	49%	0.485	34%	0.335	S	S	.	.	T	Hydrogen-bonded Turn	trans	-95.1	-6.9	-179.1	60.8	0	0	0	0	113.1	D361 T366	D361-T364 WeakPolarHBondContact CB-OG1 3.48Å; D361-T364 PolarHBondContact O-N 3.38Å; D361-T364 PolarHBondContact OD1-N 2.91Å; D361-T364 WeakPolarHBondContact OD2-CG2 3.45Å; D361-T364 PolarHBondContact OD2-OG1 2.98Å; T364-T366 WeakPolarHBondContact O-CG2 3.3Å; T364-T366 PolarHBondContact O-N 2.98Å; T364-T366 WeakPolarHBondContact OG1-CG2 3.23Å; T364-T366 PolarHBondContact OG1-OG1 3.49Å
365	D	83.4	Confident	81	Confident	108 Å²	108	60 Å²	60	58%	0.578	34%	0.341	S	S	*	.	T	Hydrogen-bonded Turn	trans	49.4	41.1	-167.7	-163.7	32.7	0	0	0	112.1	H360 D361	H360-D365 IonicContact CD2-OD1 3.94Å; H360-D365 IonicContact CE1-OD1 3.71Å; H360-D365 IonicContact NE2-OD1 2.87Å; H360-D365 PolarHBondContact NE2-OD1 3.39Å; D361-D365 VanDerWaalsContact O-CA 3.26Å; D361-D365 WeakPolarHBondContact O-CA 3.29Å; D361-D365 PolarHBondContact O-N 3.31Å
366	T	85.3	Confident	80.9	Confident	73 Å²	73	60.4 Å²	60.4	45%	0.448	35%	0.346	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	160.4	178.1	68.3	0	0	0	0	111.3	H360 D361 T364	H360-T366 PolarHBondContact CD2-O 3.43Å; D361-T366 PolarHBondContact N-O 3.25Å; D361-T366 PolarHBondContact O-N 3.49Å; T364-T366 WeakPolarHBondContact O-CG2 3.3Å; T364-T366 PolarHBondContact O-N 2.98Å; T364-T366 WeakPolarHBondContact OG1-CG2 3.23Å; T364-T366 PolarHBondContact OG1-OG1 3.49Å
367	I	84.4	Confident	81.1	Confident	26 Å²	26	61.1 Å²	61.1	13%	0.133	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	133.1	178.6	-44.9	171.6	0	0	0	107.2	V358 R359 I369 M392 F395 F398	V358-I367 HydrophobicContact CB-CG2 3.85Å; V358-I367 HydrophobicContact CG2-CG2 4Å; R359-I367 WeakPolarHBondContact O-CA 3.25Å; R359-I367 WeakPolarHBondContact O-CG2 3.41Å; I367-I369 HydrophobicContact CB-CD1 3.72Å; I367-I369 HydrophobicContact CB-CG1 3.65Å; I367-I369 HydrophobicContact CD1-CD1 4.16Å; I367-I369 HydrophobicContact CG2-CD1 3.58Å; I367-I369 HydrophobicContact CG2-CG1 3.32Å; I367-I369 PolarHBondContact O-N 3.06Å; I367-M392 WeakPolarHBondContact CD1-O 3.4Å; I367-F395 HydrophobicContact CD1-CB 3.88Å; I367-F395 HydrophobicContact CD1-CD2 4.24Å; I367-F395 HydrophobicContact CG1-CB 4.2Å; I367-F395 HydrophobicContact CG1-CD2 4.4Å; I367-F395 HydrophobicContact CG2-CD2 4.2Å; I367-F398 HydrophobicContact CD1-CD2 4Å; I367-F398 HydrophobicContact CD1-CE2 3.56Å
368	D	79.6	Confident	81.2	Confident	51 Å²	51	64.3 Å²	64.3	27%	0.273	37%	0.366	S	S	.	.			trans	-77.4	55.1	-174.9	71.3	-8.6	0	0	0	113.2	R246 V358 R359	R246-D368 IonicContact CZ-OD1 2.56Å; R246-D368 IonicContact CZ-OD2 3.35Å; R246-D368 VanDerWaalsContact NH1-CG 3.35Å; R246-D368 IonicContact NH1-OD1 3.81Å; R246-D368 IonicContact NH1-OD2 2.95Å; R246-D368 PolarHBondContact NH1-OD2 2.88Å; R246-D368 PolarHBondContact NH2-O 2.81Å; R246-D368 IonicContact NH2-OD1 3.91Å; R246-D368 PolarHBondContact NH2-OD1 3.09Å; R246-D368 IonicContact NH2-OD2 3.42Å; R246-D368 PolarHBondContact NH2-OD2 3.41Å; R246-D368 VanDerWaalsContact NH2-OD2 3.15Å; V358-D368 WeakPolarHBondContact CA-OD1 3.43Å; R359-D368 IonicContact CZ-OD2 3.3Å; R359-D368 PolarHBondContact N-OD1 3.38Å; R359-D368 IonicContact NE-OD2 2.71Å; R359-D368 PolarHBondContact NE-OD2 3.38Å; R359-D368 IonicContact NH2-OD2 2.72Å; R359-D368 PolarHBondContact NH2-OD2 3.29Å; R359-D368 VanDerWaalsContact NH2-OD2 3.12Å; R359-D368 PolarHBondContact O-N 3.18Å
369	I	69.2	Low	81.5	Confident	44 Å²	44	64.8 Å²	64.8	23%	0.226	37%	0.367	C	S	.	.			trans	-99.1	132.8	-171.3	-42	175.1	0	0	0	111.6	V358 I367 M392 F398	V358-I369 HydrophobicContact CB-CG1 4.27Å; V358-I369 HydrophobicContact CG1-CB 4.47Å; V358-I369 HydrophobicContact CG1-CG1 3.89Å; V358-I369 HydrophobicContact CG1-CG2 4.37Å; I367-I369 HydrophobicContact CB-CD1 3.72Å; I367-I369 HydrophobicContact CB-CG1 3.65Å; I367-I369 HydrophobicContact CD1-CD1 4.16Å; I367-I369 HydrophobicContact CG2-CD1 3.58Å; I367-I369 HydrophobicContact CG2-CG1 3.32Å; I367-I369 PolarHBondContact O-N 3.06Å; I369-M392 HydrophobicContact CD1-CE 4.05Å; I369-M392 HydrophobicContact CG2-CE 4.09Å; I369-F398 HydrophobicContact CD1-CE1 4.24Å; I369-F398 HydrophobicContact CD1-CE2 3.61Å; I369-F398 HydrophobicContact CD1-CZ 3.34Å
370	A	60	Low	81.7	Confident	74 Å²	74	62.9 Å²	62.9	61%	0.612	36%	0.36	S	S	*	.			trans	-69.6	146	156	0	0	0	0	0	110.2	N372	A370-N372 PolarHBondContact O-N 2.89Å
371	P	55.6	Low	82.1	Confident	120 Å²	120	62.1 Å²	62.1	78%	0.779	36%	0.357	S	S	*	.	S	Bend	trans	-60.4	-0	-164.4	19.5	-32.2	0	0	0	118.1	Q373	P371-Q373 PolarHBondContact O-N 2.81Å
372	N	67.9	Low	82.6	Confident	113 Å²	113	58.9 Å²	58.9	60%	0.604	34%	0.339	S	S	*	.			trans	-82.9	117.9	-178	-70.7	-12.6	0	0	0	112.5	R334 A370 V375	R334-N372 PolarHBondContact NH2-O 3.5Å; A370-N372 PolarHBondContact O-N 2.89Å; N372-V375 HydrophobicContact CB-CG1 4Å
373	Q	66.2	Low	83.5	Confident	84 Å²	84	57.1 Å²	57.1	39%	0.393	32%	0.324	S	S	.	.	S	Bend	trans	-79.8	-43	-178.5	-56.9	178.3	-3.8	0	0	112.2	R334 P371 V375 M392	R334-Q373 PolarHBondContact NH2-O 2.88Å; P371-Q373 PolarHBondContact O-N 2.81Å; Q373-V375 PolarHBondContact O-N 3.18Å; Q373-M392 HydrophobicContact CB-CE 4.26Å; Q373-M392 HydrophobicContact CB-SD 4.1Å; Q373-M392 HydrophobicContact CG-CE 3.97Å; Q373-M392 HydrophobicContact CG-CG 3.95Å; Q373-M392 HydrophobicContact CG-SD 3.96Å
374	R	77.5	Confident	84.3	Confident	91 Å²	91	51.5 Å²	51.5	34%	0.343	29%	0.289	S	S	.	.			trans	-92.2	80.9	-178.1	-73.3	169.7	162.4	173.3	-0.5	112	L386 E388 I440	R374-L386 PolarHBondContact NH2-O 3.39Å; R374-E388 VanDerWaalsContact CD-OE1 3.28Å; R374-E388 WeakPolarHBondContact CD-OE1 3.35Å; R374-E388 HydrophobicContact CG-CG 4.44Å; R374-E388 VanDerWaalsContact CZ-CG 3.43Å; R374-E388 IonicContact CZ-OE1 3.7Å; R374-E388 VanDerWaalsContact NE-CG 3.28Å; R374-E388 IonicContact NE-OE1 2.76Å; R374-E388 PolarHBondContact NE-OE1 3.37Å; R374-E388 IonicContact NH1-OE1 3.37Å; R374-E388 PolarHBondContact NH1-OE1 3.18Å; R374-E388 IonicContact NH2-OE1 3.59Å; R374-E388 PolarHBondContact NH2-OE1 3.41Å; R374-I440 HydrophobicContact CB-CD1 4.37Å; R374-I440 HydrophobicContact CG-CD1 4.45Å
375	V	85	Confident	84.9	Confident	23 Å²	23	48.4 Å²	48.4	14%	0.139	27%	0.27	C	S	.	.			trans	-120.7	159.4	170	-53.3	0	0	0	0	110.2	R334 L356 N372 Q373 M381	R334-V375 HydrophobicContact CB-CG2 4.44Å; R334-V375 VanDerWaalsContact NH2-CG2 3.28Å; L356-V375 HydrophobicContact CD1-CB 4.37Å; L356-V375 HydrophobicContact CD1-CG2 4.43Å; L356-V375 HydrophobicContact CD2-CB 4.3Å; L356-V375 HydrophobicContact CD2-CG2 4.4Å; N372-V375 HydrophobicContact CB-CG1 4Å; Q373-V375 PolarHBondContact O-N 3.18Å; V375-M381 WeakPolarHBondContact O-CE 3.46Å
376	G	90.7	Very high	85.6	Confident	17 Å²	17	43.2 Å²	43.2	18%	0.175	24%	0.242	C	C	.	.	S	Bend	trans	99.4	-174.5	-177.6	0	0	0	0	0	112.7	D335 M381	D335-G376 WeakPolarHBondContact OD1-CA 3.42Å; G376-M381 WeakPolarHBondContact O-CE 3.4Å
377	T	95.4	Very high	86	Confident	46 Å²	46	42.6 Å²	42.6	28%	0.282	24%	0.236	S	C	.	.			trans	-85.2	115.5	-173.9	-55.2	0	0	0	0	110.2	D335 K337 R379 Y380 M381	D335-T377 VanDerWaalsContact OD1-CB 3.3Å; D335-T377 WeakPolarHBondContact OD1-CB 3.38Å; D335-T377 PolarHBondContact OD1-N 2.58Å; D335-T377 PolarHBondContact OD1-OG1 3.12Å; K337-T377 HydrophobicContact CD-CG2 4.18Å; K337-T377 WeakPolarHBondContact CD-OG1 3.37Å; K337-T377 WeakPolarHBondContact CE-OG1 3.04Å; K337-T377 PolarHBondContact NZ-OG1 2.68Å; T377-R379 PolarHBondContact O-N 2.94Å; T377-R379 VanDerWaalsContact O-N 3.09Å; T377-Y380 HydrophobicContact CG2-CD2 3.92Å; T377-Y380 HydrophobicContact CG2-CE2 4.45Å; T377-Y380 PolarHBondContact O-N 2.71Å; T377-M381 PolarHBondContact O-N 3.03Å
378	K	97.3	Very high	86.4	Confident	69 Å²	69	46 Å²	46	30%	0.3	25%	0.252	S	S	.	.	G	3₁₀ helix	trans	-49.1	-42.3	-172.2	-54.5	160.7	-164.3	143.5	0	113.5	Y380 M381 D437 P438 I440 M443	K378-Y380 PolarHBondContact O-N 3.46Å; K378-M381 WeakPolarHBondContact O-CB 2.93Å; K378-M381 PolarHBondContact O-N 3.17Å; K378-D437 IonicContact NZ-OD1 3.82Å; K378-D437 PolarHBondContact NZ-OD1 2.77Å; K378-P438 WeakPolarHBondContact CD-O 3.45Å; K378-I440 HydrophobicContact CD-CG1 4.19Å; K378-I440 HydrophobicContact CG-CG1 3.93Å; K378-M443 HydrophobicContact CB-CG 4.46Å
379	R	98.6	Very high	87.1	Confident	11 Å²	11	48.3 Å²	48.3	4%	0.042	27%	0.267	C	S	.	.	G	3₁₀ helix	trans	-58.3	-28.2	178.6	-176.1	-178	-68	-75.2	-3.1	114.3	T377 P429 Y430 P435 S436 P438 M443	T377-R379 PolarHBondContact O-N 2.94Å; T377-R379 VanDerWaalsContact O-N 3.09Å; R379-P429 VanDerWaalsContact CD-O 3.23Å; R379-P429 WeakPolarHBondContact CD-O 3.44Å; R379-P429 HydrophobicContact CG-CG 4.21Å; R379-P429 WeakPolarHBondContact CG-O 3.49Å; R379-P429 PolarHBondContact NH1-O 3.18Å; R379-Y430 HydrophobicContact CG-CD2 4.43Å; R379-Y430 PolarHBondContact NH1-O 3.12Å; R379-P435 PolarHBondContact NH2-O 3.02Å; R379-S436 PolarHBondContact NH2-O 3.4Å; R379-P438 HydrophobicContact CB-CG 4.18Å; R379-M443 WeakPolarHBondContact O-CE 3.44Å
380	Y	98.6	Very high	88.2	Confident	13 Å²	13	47 Å²	47	5%	0.051	26%	0.26	C	S	.	.	G	3₁₀ helix	trans	-104.5	-0.2	-176.5	-67.2	-98	0	0	0	113	K337 S338 T377 K378 A382 L408 V409 E412 L428 P429	K337-Y380 HydrophobicContact CB-CD1 4Å; K337-Y380 HydrophobicContact CB-CD2 3.83Å; K337-Y380 HydrophobicContact CB-CE1 3.93Å; K337-Y380 HydrophobicContact CB-CE2 3.76Å; K337-Y380 HydrophobicContact CB-CG 3.96Å; S338-Y380 PolarHBondContact OG-OH 3.06Å; T377-Y380 HydrophobicContact CG2-CD2 3.92Å; T377-Y380 HydrophobicContact CG2-CE2 4.45Å; T377-Y380 PolarHBondContact O-N 2.71Å; K378-Y380 PolarHBondContact O-N 3.46Å; Y380-A382 PolarHBondContact O-N 2.66Å; Y380-L408 HydrophobicContact CD1-CB 4Å; Y380-L408 HydrophobicContact CD1-CD1 3.92Å; Y380-L408 HydrophobicContact CE1-CB 4.13Å; Y380-L408 HydrophobicContact CG-CD1 4.36Å; Y380-V409 HydrophobicContact CE1-CG2 4.23Å; Y380-E412 VanDerWaalsContact CE1-OE1 3.31Å; Y380-E412 WeakPolarHBondContact CE1-OE1 3.23Å; Y380-E412 VanDerWaalsContact OH-CD 3.3Å; Y380-E412 PolarHBondContact OH-OE1 3.08Å; Y380-E412 PolarHBondContact OH-OE2 3.33Å; Y380-L428 WeakPolarHBondContact OH-CD2 3.18Å; Y380-P429 HydrophobicContact CD1-CG 4.35Å; Y380-P429 HydrophobicContact CE1-CG 3.7Å; Y380-P429 HydrophobicContact CE2-CG 4.32Å; Y380-P429 WeakPolarHBondContact OH-CD 3.3Å
381	M	98.4	Very high	89.7	Confident	12 Å²	12	47.6 Å²	47.6	6%	0.059	25%	0.254	C	S	.	.			trans	-65.1	133.8	-179.8	-72.8	179.9	173	0	0	111	V375 G376 T377 K378 V385 L386 Y404	V375-M381 WeakPolarHBondContact O-CE 3.46Å; G376-M381 WeakPolarHBondContact O-CE 3.4Å; T377-M381 PolarHBondContact O-N 3.03Å; K378-M381 WeakPolarHBondContact O-CB 2.93Å; K378-M381 PolarHBondContact O-N 3.17Å; M381-V385 HydrophobicContact CB-CB 4.28Å; M381-V385 HydrophobicContact CB-CG1 4.18Å; M381-V385 HydrophobicContact CG-CG1 4.01Å; M381-V385 HydrophobicContact SD-CG1 4.01Å; M381-L386 HydrophobicContact CB-CD1 4.47Å; M381-L386 HydrophobicContact CB-CD2 3.72Å; M381-L386 HydrophobicContact CB-CG 3.78Å; M381-L386 HydrophobicContact CG-CD2 4.46Å; M381-L386 HydrophobicContact SD-CD2 4Å; M381-Y404 VanDerWaalsContact O-CE1 3.25Å; M381-Y404 WeakPolarHBondContact O-CE1 3.44Å
382	A	98.3	Very high	91.1	Very high	1 Å²	1	43.6 Å²	43.6	1%	0.008	23%	0.225	C	C	.	.			trans	-66.5	156	173.8	0	0	0	0	0	111.4	Y380 E384 V385 L386 A401 Y404	Y380-A382 PolarHBondContact O-N 2.66Å; A382-E384 VanDerWaalsContact C-N 3.28Å; A382-E384 WeakPolarHBondContact CB-OE2 3.49Å; A382-E384 PolarHBondContact O-N 3.35Å; A382-V385 HydrophobicContact CB-CG2 4.3Å; A382-V385 WeakPolarHBondContact O-CB 3.31Å; A382-V385 PolarHBondContact O-N 3.09Å; A382-L386 PolarHBondContact O-N 2.89Å; A382-L386 VanDerWaalsContact O-N 3.08Å; A382-A401 HydrophobicContact CB-CB 3.99Å; A382-Y404 VanDerWaalsContact CA-CD1 3.46Å; A382-Y404 HydrophobicContact CB-CD1 3.82Å; A382-Y404 HydrophobicContact CB-CG 3.82Å
383	P	98.2	Very high	92	Very high	7 Å²	7	46.6 Å²	46.6	5%	0.045	23%	0.233	C	C	.	.	H	α-helix	trans	-49.4	-47	-179.7	-25.8	31.2	0	0	0	113.5	V385 L386 D387 Y404 V447 C448	P383-V385 PolarHBondContact O-N 3.48Å; P383-L386 PolarHBondContact O-N 2.64Å; P383-L386 VanDerWaalsContact O-N 3.1Å; P383-D387 PolarHBondContact O-N 2.74Å; P383-D387 VanDerWaalsContact O-OD1 3.12Å; P383-Y404 HydrophobicContact CG-CE2 4.23Å; P383-V447 HydrophobicContact CB-CG1 4.26Å; P383-V447 HydrophobicContact CG-CG1 3.73Å; P383-C448 PolarHBondContact O-SG 3.2Å
384	E	97.2	Very high	93.1	Very high	19 Å²	19	47.1 Å²	47.1	9%	0.089	24%	0.235	C	C	.	.	H	α-helix	trans	-66.2	-20	-179.5	67.2	-85.3	-158.6	0	0	114	A382 D387 T389 I390 R484	A382-E384 VanDerWaalsContact C-N 3.28Å; A382-E384 WeakPolarHBondContact CB-OE2 3.49Å; A382-E384 PolarHBondContact O-N 3.35Å; E384-D387 WeakPolarHBondContact CA-OD1 3.35Å; E384-T389 WeakPolarHBondContact CA-OG1 3.3Å; E384-T389 PolarHBondContact O-N 3.47Å; E384-I390 HydrophobicContact CB-CB 4.19Å; E384-I390 HydrophobicContact CG-CB 3.94Å; E384-I390 HydrophobicContact CG-CD1 4.32Å; E384-I390 HydrophobicContact CG-CG1 4.1Å; E384-I390 WeakPolarHBondContact O-CB 3.3Å; E384-I390 PolarHBondContact O-N 2.8Å; E384-R484 IonicContact OE1-CZ 3.99Å; E384-R484 IonicContact OE1-NH1 2.76Å; E384-R484 PolarHBondContact OE1-NH1 3.03Å; E384-R484 IonicContact OE1-NH2 3.12Å; E384-R484 PolarHBondContact OE1-NH2 2.78Å; E384-R484 IonicContact OE2-CZ 3.15Å; E384-R484 IonicContact OE2-NH1 2.86Å; E384-R484 IonicContact OE2-NH2 3.45Å; E384-R484 PolarHBondContact OE2-NH2 2.94Å
385	V	96.4	Very high	93.8	Very high	14 Å²	14	43.1 Å²	43.1	9%	0.085	22%	0.22	C	C	.	.	H	α-helix	trans	-85.2	-37.5	174.1	-180	0	0	0	0	110.3	M381 A382 P383 I390 A401	M381-V385 HydrophobicContact CB-CB 4.28Å; M381-V385 HydrophobicContact CB-CG1 4.18Å; M381-V385 HydrophobicContact CG-CG1 4.01Å; M381-V385 HydrophobicContact SD-CG1 4.01Å; A382-V385 HydrophobicContact CB-CG2 4.3Å; A382-V385 WeakPolarHBondContact O-CB 3.31Å; A382-V385 PolarHBondContact O-N 3.09Å; P383-V385 PolarHBondContact O-N 3.48Å; V385-I390 HydrophobicContact CG2-CD1 3.84Å; V385-A401 HydrophobicContact CG2-CB 4.17Å
386	L	96.9	Very high	94.3	Very high	0 Å²	0	45.4 Å²	45.4	0%	0	23%	0.232	C	C	.	.	H	α-helix	trans	-68.6	-43.3	179.4	-70.3	169.3	0	0	0	111.8	R374 M381 A382 P383 I440 M443 R444 V447	R374-L386 PolarHBondContact NH2-O 3.39Å; M381-L386 HydrophobicContact CB-CD1 4.47Å; M381-L386 HydrophobicContact CB-CD2 3.72Å; M381-L386 HydrophobicContact CB-CG 3.78Å; M381-L386 HydrophobicContact CG-CD2 4.46Å; M381-L386 HydrophobicContact SD-CD2 4Å; A382-L386 PolarHBondContact O-N 2.89Å; A382-L386 VanDerWaalsContact O-N 3.08Å; P383-L386 PolarHBondContact O-N 2.64Å; P383-L386 VanDerWaalsContact O-N 3.1Å; L386-I440 HydrophobicContact CD2-CG2 4.14Å; L386-M443 HydrophobicContact CD1-CB 4.01Å; L386-M443 HydrophobicContact CD2-CB 3.65Å; L386-R444 HydrophobicContact CB-CB 4.35Å; L386-R444 HydrophobicContact CB-CG 4.45Å; L386-V447 HydrophobicContact CD1-CB 3.78Å; L386-V447 HydrophobicContact CD1-CG1 3.87Å; L386-V447 HydrophobicContact CD1-CG2 4.24Å
387	D	94.4	Very high	94.5	Very high	60 Å²	60	45.7 Å²	45.7	32%	0.321	23%	0.23	S	C	.	.	T	Hydrogen-bonded Turn	trans	-90.5	4.3	-179.4	67.4	15.2	0	0	0	114.5	P383 E384 T389	P383-D387 PolarHBondContact O-N 2.74Å; P383-D387 VanDerWaalsContact O-OD1 3.12Å; E384-D387 WeakPolarHBondContact CA-OD1 3.35Å; D387-T389 HydrophobicContact CB-CG2 4.42Å; D387-T389 PolarHBondContact O-N 3.28Å; D387-T389 VanDerWaalsContact OD1-CB 3.27Å; D387-T389 WeakPolarHBondContact OD1-CB 3.47Å; D387-T389 VanDerWaalsContact OD1-CG2 3.26Å; D387-T389 WeakPolarHBondContact OD1-CG2 3.5Å; D387-T389 PolarHBondContact OD1-N 3.07Å; D387-T389 PolarHBondContact OD1-OG1 3.15Å
388	E	93	Very high	94.5	Very high	98 Å²	98	43.7 Å²	43.7	46%	0.458	22%	0.218	S	C	.	.	T	Hydrogen-bonded Turn	trans	61.1	23.6	179.8	-60.2	177.7	166.6	0	0	114.5	R374	R374-E388 VanDerWaalsContact CD-OE1 3.28Å; R374-E388 WeakPolarHBondContact CD-OE1 3.35Å; R374-E388 HydrophobicContact CG-CG 4.44Å; R374-E388 VanDerWaalsContact CZ-CG 3.43Å; R374-E388 IonicContact CZ-OE1 3.7Å; R374-E388 VanDerWaalsContact NE-CG 3.28Å; R374-E388 IonicContact NE-OE1 2.76Å; R374-E388 PolarHBondContact NE-OE1 3.37Å; R374-E388 IonicContact NH1-OE1 3.37Å; R374-E388 PolarHBondContact NH1-OE1 3.18Å; R374-E388 IonicContact NH2-OE1 3.59Å; R374-E388 PolarHBondContact NH2-OE1 3.41Å
389	T	94.3	Very high	94.6	Very high	98 Å²	98	42.7 Å²	42.7	60%	0.601	21%	0.214	S	C	*	.			trans	-89.8	-3.4	177.2	64	0	0	0	0	114.3	E384 D387 N391	E384-T389 WeakPolarHBondContact CA-OG1 3.3Å; E384-T389 PolarHBondContact O-N 3.47Å; D387-T389 HydrophobicContact CB-CG2 4.42Å; D387-T389 PolarHBondContact O-N 3.28Å; D387-T389 VanDerWaalsContact OD1-CB 3.27Å; D387-T389 WeakPolarHBondContact OD1-CB 3.47Å; D387-T389 VanDerWaalsContact OD1-CG2 3.26Å; D387-T389 WeakPolarHBondContact OD1-CG2 3.5Å; D387-T389 PolarHBondContact OD1-N 3.07Å; D387-T389 PolarHBondContact OD1-OG1 3.15Å; T389-N391 PolarHBondContact O-N 3.11Å
390	I	92.6	Very high	94.6	Very high	16 Å²	16	43.3 Å²	43.3	8%	0.082	22%	0.22	C	C	.	.			trans	-59.5	129.3	-179.7	-170.1	169.7	0	0	0	112.2	E384 V385 M392 F398	E384-I390 HydrophobicContact CB-CB 4.19Å; E384-I390 HydrophobicContact CG-CB 3.94Å; E384-I390 HydrophobicContact CG-CD1 4.32Å; E384-I390 HydrophobicContact CG-CG1 4.1Å; E384-I390 WeakPolarHBondContact O-CB 3.3Å; E384-I390 PolarHBondContact O-N 2.8Å; V385-I390 HydrophobicContact CG2-CD1 3.84Å; I390-M392 HydrophobicContact CG2-CG 4.3Å; I390-M392 HydrophobicContact CG2-SD 3.74Å; I390-M392 PolarHBondContact O-N 3.38Å; I390-F398 HydrophobicContact CD1-CD1 4.18Å; I390-F398 HydrophobicContact CD1-CE1 4.23Å
391	N	90.4	Very high	94.5	Very high	88 Å²	88	43.4 Å²	43.4	47%	0.471	22%	0.223	S	C	.	.			trans	-77.9	95.1	174.2	-176	-3.6	0	0	0	110.6	T389 K393 H394 S397	T389-N391 PolarHBondContact O-N 3.11Å; N391-K393 PolarHBondContact O-N 3.24Å; N391-K393 WeakPolarHBondContact OD1-CB 3.34Å; N391-K393 PolarHBondContact OD1-N 3.41Å; N391-H394 HydrophobicContact CB-CB 4.3Å; N391-H394 PolarHBondContact O-N 3.38Å; N391-H394 VanDerWaalsContact O-N 3.1Å; N391-S397 WeakPolarHBondContact O-CB 3.5Å; N391-S397 PolarHBondContact O-OG 3.41Å
392	M	86.1	Confident	94.5	Very high	36 Å²	36	43 Å²	43	18%	0.177	22%	0.221	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.5	-14.2	-179.4	-61.4	-68.2	-67.9	0	0	114.4	I367 I369 Q373 I390 F398	I367-M392 WeakPolarHBondContact CD1-O 3.4Å; I369-M392 HydrophobicContact CD1-CE 4.05Å; I369-M392 HydrophobicContact CG2-CE 4.09Å; Q373-M392 HydrophobicContact CB-CE 4.26Å; Q373-M392 HydrophobicContact CB-SD 4.1Å; Q373-M392 HydrophobicContact CG-CE 3.97Å; Q373-M392 HydrophobicContact CG-CG 3.95Å; Q373-M392 HydrophobicContact CG-SD 3.96Å; I390-M392 HydrophobicContact CG2-CG 4.3Å; I390-M392 HydrophobicContact CG2-SD 3.74Å; I390-M392 PolarHBondContact O-N 3.38Å; M392-F398 HydrophobicContact CB-CZ 4.32Å; M392-F398 HydrophobicContact CE-CE1 3.83Å; M392-F398 HydrophobicContact CE-CZ 3.6Å; M392-F398 HydrophobicContact SD-CE1 3.66Å; M392-F398 HydrophobicContact SD-CZ 3.48Å; M392-F398 WeakPolarHBondContact SD-CZ 3.44Å
393	K	86	Confident	94.6	Very high	176 Å²	176	43.1 Å²	43.1	77%	0.765	22%	0.221	S	C	*	.	T	Hydrogen-bonded Turn	trans	-85.7	-18.3	175.7	-61.8	-176.5	178.4	-177.5	0	112.3	N391	N391-K393 PolarHBondContact O-N 3.24Å; N391-K393 WeakPolarHBondContact OD1-CB 3.34Å; N391-K393 PolarHBondContact OD1-N 3.41Å
394	H	90.3	Very high	94.6	Very high	95 Å²	95	42.8 Å²	42.8	44%	0.44	22%	0.219	S	C	.	.			trans	-105.1	112.9	-175.8	-165	-79.9	0	0	0	110.2	N391 D396 S397	N391-H394 HydrophobicContact CB-CB 4.3Å; N391-H394 PolarHBondContact O-N 3.38Å; N391-H394 VanDerWaalsContact O-N 3.1Å; H394-D396 VanDerWaalsContact C-N 3.28Å; H394-D396 IonicContact CE1-OD2 3.42Å; H394-D396 PolarHBondContact CE1-OD2 2.96Å; H394-D396 PolarHBondContact ND1-N 3.09Å; H394-D396 PolarHBondContact O-N 3.27Å; H394-S397 VanDerWaalsContact O-CB 3.22Å; H394-S397 WeakPolarHBondContact O-CB 3.38Å; H394-S397 PolarHBondContact O-N 3.39Å; H394-S397 PolarHBondContact O-OG 3.36Å; H394-S397 VanDerWaalsContact O-OG 3.06Å
395	F	92.5	Very high	94.7	Very high	7 Å²	7	42.1 Å²	42.1	3%	0.031	22%	0.217	C	C	.	.	H	α-helix	trans	-60.6	-36.2	-172.4	179.7	-121.9	0	0	0	113.4	G330 A332 V358 H360 I367 S397 F398 K399	G330-F395 WeakPolarHBondContact O-CZ 3.43Å; A332-F395 HydrophobicContact CB-CE2 3.82Å; A332-F395 HydrophobicContact CB-CZ 4.1Å; V358-F395 HydrophobicContact CG2-CE2 4.19Å; H360-F395 HydrophobicContact CB-CB 4.14Å; H360-F395 HydrophobicContact CB-CD1 3.43Å; H360-F395 VanDerWaalsContact CB-CD1 3.43Å; H360-F395 HydrophobicContact CB-CD2 3.78Å; H360-F395 HydrophobicContact CB-CE1 3.64Å; H360-F395 HydrophobicContact CB-CE2 4Å; H360-F395 HydrophobicContact CB-CG 3.52Å; H360-F395 HydrophobicContact CB-CZ 3.96Å; H360-F395 AromaticContact CG-CD1 3.71Å; H360-F395 AromaticContact CG-CG 3.77Å; H360-F395 AromaticContact ND1-CD1 3.93Å; I367-F395 HydrophobicContact CD1-CB 3.88Å; I367-F395 HydrophobicContact CD1-CD2 4.24Å; I367-F395 HydrophobicContact CG1-CB 4.2Å; I367-F395 HydrophobicContact CG1-CD2 4.4Å; I367-F395 HydrophobicContact CG2-CD2 4.2Å; F395-S397 PolarHBondContact O-N 2.92Å; F395-S397 VanDerWaalsContact O-N 3.12Å; F395-F398 HydrophobicContact CD2-CD2 4.37Å; F395-F398 PolarHBondContact O-N 3.23Å; F395-K399 HydrophobicContact CE1-CD 4.25Å; F395-K399 HydrophobicContact CE1-CG 4.27Å; F395-K399 HydrophobicContact CZ-CG 4.49Å; F395-K399 PolarHBondContact O-N 3.47Å
396	D	94.8	Very high	94.8	Very high	71 Å²	71	41.5 Å²	41.5	38%	0.38	21%	0.213	S	C	.	.	H	α-helix	trans	-64.5	-19	178.6	-63.2	-32.2	0	0	0	113.3	H394 F398 K399 C400	H394-D396 VanDerWaalsContact C-N 3.28Å; H394-D396 IonicContact CE1-OD2 3.42Å; H394-D396 PolarHBondContact CE1-OD2 2.96Å; H394-D396 PolarHBondContact ND1-N 3.09Å; H394-D396 PolarHBondContact O-N 3.27Å; D396-F398 PolarHBondContact O-N 3.43Å; D396-K399 PolarHBondContact O-N 3.17Å; D396-K399 WeakPolarHBondContact OD1-CD 3.2Å; D396-K399 WeakPolarHBondContact OD1-CE 3.44Å; D396-K399 IonicContact OD1-NZ 3.33Å; D396-K399 PolarHBondContact OD1-NZ 2.86Å; D396-C400 WeakPolarHBondContact O-CB 3.31Å; D396-C400 PolarHBondContact O-N 3.29Å; D396-C400 PolarHBondContact O-SG 3.15Å
397	S	95.2	Very high	94.9	Very high	22 Å²	22	41.5 Å²	41.5	15%	0.154	21%	0.213	C	C	.	.	H	α-helix	trans	-59.2	-40.4	172.3	-53.4	0	0	0	0	111	N391 H394 F395 C400 A401	N391-S397 WeakPolarHBondContact O-CB 3.5Å; N391-S397 PolarHBondContact O-OG 3.41Å; H394-S397 VanDerWaalsContact O-CB 3.22Å; H394-S397 WeakPolarHBondContact O-CB 3.38Å; H394-S397 PolarHBondContact O-N 3.39Å; H394-S397 PolarHBondContact O-OG 3.36Å; H394-S397 VanDerWaalsContact O-OG 3.06Å; F395-S397 PolarHBondContact O-N 2.92Å; F395-S397 VanDerWaalsContact O-N 3.12Å; S397-C400 PolarHBondContact O-N 2.85Å; S397-A401 PolarHBondContact O-N 3Å
398	F	95.8	Very high	95.1	Very high	5 Å²	5	38.6 Å²	38.6	2%	0.022	20%	0.198	C	C	.	.	H	α-helix	trans	-71.2	-38.9	177.2	-59.1	-78.1	0	0	0	111.9	A332 R334 V358 I367 I369 I390 M392 F395 D396 C400 A401 D402	A332-F398 HydrophobicContact CB-CB 3.45Å; A332-F398 VanDerWaalsContact CB-CB 3.45Å; R334-F398 HydrophobicContact CG-CD1 4.12Å; V358-F398 HydrophobicContact CG2-CB 4.45Å; V358-F398 HydrophobicContact CG2-CD2 4.42Å; V358-F398 HydrophobicContact CG2-CG 4.2Å; I367-F398 HydrophobicContact CD1-CD2 4Å; I367-F398 HydrophobicContact CD1-CE2 3.56Å; I369-F398 HydrophobicContact CD1-CE1 4.24Å; I369-F398 HydrophobicContact CD1-CE2 3.61Å; I369-F398 HydrophobicContact CD1-CZ 3.34Å; I390-F398 HydrophobicContact CD1-CD1 4.18Å; I390-F398 HydrophobicContact CD1-CE1 4.23Å; M392-F398 HydrophobicContact CB-CZ 4.32Å; M392-F398 HydrophobicContact CE-CE1 3.83Å; M392-F398 HydrophobicContact CE-CZ 3.6Å; M392-F398 HydrophobicContact SD-CE1 3.66Å; M392-F398 HydrophobicContact SD-CZ 3.48Å; M392-F398 WeakPolarHBondContact SD-CZ 3.44Å; F395-F398 HydrophobicContact CD2-CD2 4.37Å; F395-F398 PolarHBondContact O-N 3.23Å; D396-F398 PolarHBondContact O-N 3.43Å; F398-C400 VanDerWaalsContact C-N 3.32Å; F398-C400 PolarHBondContact O-N 3.03Å; F398-A401 PolarHBondContact O-N 3.01Å; F398-D402 PolarHBondContact O-N 3.03Å
399	K	97.8	Very high	95.4	Very high	47 Å²	47	34 Å²	34	20%	0.204	18%	0.176	C	C	.	.	H	α-helix	trans	-59.9	-45.3	173	-63.6	-177.1	-167.9	154.3	0	111	H319 F395 D396 A401 D402 I403	H319-K399 HydrophobicContact CB-CD 4.08Å; H319-K399 HydrophobicContact CB-CG 4.37Å; H319-K399 PolarHBondContact CE1-O 2.97Å; H319-K399 WeakPolarHBondContact O-CE 3.37Å; F395-K399 HydrophobicContact CE1-CD 4.25Å; F395-K399 HydrophobicContact CE1-CG 4.27Å; F395-K399 HydrophobicContact CZ-CG 4.49Å; F395-K399 PolarHBondContact O-N 3.47Å; D396-K399 PolarHBondContact O-N 3.17Å; D396-K399 WeakPolarHBondContact OD1-CD 3.2Å; D396-K399 WeakPolarHBondContact OD1-CE 3.44Å; D396-K399 IonicContact OD1-NZ 3.33Å; D396-K399 PolarHBondContact OD1-NZ 2.86Å; K399-A401 VanDerWaalsContact C-N 3.29Å; K399-A401 PolarHBondContact O-N 2.95Å; K399-D402 WeakPolarHBondContact O-CB 3.28Å; K399-D402 PolarHBondContact O-N 3.44Å; K399-I403 WeakPolarHBondContact O-CG1 3.43Å; K399-I403 PolarHBondContact O-N 3.43Å
400	C	98.4	Very high	95.6	Very high	25 Å²	25	29.3 Å²	29.3	17%	0.169	15%	0.147	C	C	.	.	H	α-helix	trans	-62	-38.2	178.3	-66.2	0	0	0	0	111.6	D396 S397 F398 I403 Y404 G481 R484	D396-C400 WeakPolarHBondContact O-CB 3.31Å; D396-C400 PolarHBondContact O-N 3.29Å; D396-C400 PolarHBondContact O-SG 3.15Å; S397-C400 PolarHBondContact O-N 2.85Å; F398-C400 VanDerWaalsContact C-N 3.32Å; F398-C400 PolarHBondContact O-N 3.03Å; C400-I403 PolarHBondContact O-N 3.37Å; C400-Y404 PolarHBondContact O-N 2.83Å; C400-G481 PolarHBondContact SG-O 3.48Å; C400-R484 VanDerWaalsContact C-NH1 3.26Å; C400-R484 WeakPolarHBondContact O-CD 3.27Å; C400-R484 PolarHBondContact O-NH1 2.83Å
401	A	98.2	Very high	95.9	Very high	15 Å²	15	28.7 Å²	28.7	12%	0.124	14%	0.144	C	C	.	.	H	α-helix	trans	-64.7	-40.6	174.8	0	0	0	0	0	112.3	A382 V385 S397 F398 K399 I403 Y404 A405	A382-A401 HydrophobicContact CB-CB 3.99Å; V385-A401 HydrophobicContact CG2-CB 4.17Å; S397-A401 PolarHBondContact O-N 3Å; F398-A401 PolarHBondContact O-N 3.01Å; K399-A401 VanDerWaalsContact C-N 3.29Å; K399-A401 PolarHBondContact O-N 2.95Å; A401-I403 VanDerWaalsContact C-N 3.3Å; A401-I403 PolarHBondContact O-N 3.41Å; A401-Y404 WeakPolarHBondContact O-CB 3.47Å; A401-Y404 PolarHBondContact O-N 3.45Å; A401-A405 PolarHBondContact O-N 2.95Å
402	D	98.7	Very high	96.3	Very high	3 Å²	3	24.5 Å²	24.5	2%	0.016	12%	0.122	C	C	.	.	H	α-helix	trans	-61.7	-38	173.5	-72	-20.6	0	0	0	112.1	L315 H319 A332 H333 R334 F398 K399 Y404 A405 L406	L315-D402 HydrophobicContact CD1-CB 4.15Å; L315-D402 HydrophobicContact CD2-CB 4.25Å; H319-D402 IonicContact CD2-OD2 2.71Å; H319-D402 IonicContact CE1-OD2 3.41Å; H319-D402 IonicContact NE2-OD2 2.87Å; H319-D402 PolarHBondContact NE2-OD2 3.4Å; A332-D402 WeakPolarHBondContact CA-OD2 3.18Å; H333-D402 PolarHBondContact N-OD1 2.92Å; H333-D402 PolarHBondContact N-OD2 3.47Å; R334-D402 PolarHBondContact N-OD1 3.24Å; F398-D402 PolarHBondContact O-N 3.03Å; K399-D402 WeakPolarHBondContact O-CB 3.28Å; K399-D402 PolarHBondContact O-N 3.44Å; D402-Y404 VanDerWaalsContact C-N 3.34Å; D402-Y404 PolarHBondContact O-N 3.36Å; D402-A405 PolarHBondContact O-N 3.35Å; D402-L406 WeakPolarHBondContact O-CB 3.43Å; D402-L406 PolarHBondContact O-N 3.36Å
403	I	98.9	Very high	96.9	Very high	3 Å²	3	22.8 Å²	22.8	2%	0.015	11%	0.113	C	C	.	.	H	α-helix	trans	-63.8	-40.8	177.7	-64.7	-66.3	0	0	0	111.5	L315 K399 C400 A401 A405 L406 G407 C476 R484 L485 A487 I490	L315-I403 HydrophobicContact CD2-CD1 4.1Å; K399-I403 WeakPolarHBondContact O-CG1 3.43Å; K399-I403 PolarHBondContact O-N 3.43Å; C400-I403 PolarHBondContact O-N 3.37Å; A401-I403 VanDerWaalsContact C-N 3.3Å; A401-I403 PolarHBondContact O-N 3.41Å; I403-A405 VanDerWaalsContact C-N 3.31Å; I403-A405 PolarHBondContact O-N 3.11Å; I403-L406 PolarHBondContact O-N 3.43Å; I403-G407 PolarHBondContact O-N 3.05Å; I403-C476 HydrophobicContact CG2-CB 3.93Å; I403-R484 HydrophobicContact CG2-CB 4.02Å; I403-L485 WeakPolarHBondContact CG1-O 3.16Å; I403-L485 VanDerWaalsContact CG2-O 3.3Å; I403-L485 WeakPolarHBondContact CG2-O 3.28Å; I403-A487 HydrophobicContact CD1-CB 3.85Å; I403-A487 VanDerWaalsContact CD1-N 3.29Å; I403-I490 HydrophobicContact CD1-CD1 4.05Å; I403-I490 HydrophobicContact CG2-CD1 4.28Å
404	Y	98.9	Very high	97.5	Very high	0 Å²	0	14.4 Å²	14.4	0%	0	8%	0.077	C	C	.	.	H	α-helix	trans	-57.7	-47.9	174.7	173	-88	0	0	0	111	M381 A382 P383 C400 A401 D402 L406 G407 L408 Y430 V447 C476	M381-Y404 VanDerWaalsContact O-CE1 3.25Å; M381-Y404 WeakPolarHBondContact O-CE1 3.44Å; A382-Y404 VanDerWaalsContact CA-CD1 3.46Å; A382-Y404 HydrophobicContact CB-CD1 3.82Å; A382-Y404 HydrophobicContact CB-CG 3.82Å; P383-Y404 HydrophobicContact CG-CE2 4.23Å; C400-Y404 PolarHBondContact O-N 2.83Å; A401-Y404 WeakPolarHBondContact O-CB 3.47Å; A401-Y404 PolarHBondContact O-N 3.45Å; D402-Y404 VanDerWaalsContact C-N 3.34Å; D402-Y404 PolarHBondContact O-N 3.36Å; Y404-L406 PolarHBondContact O-N 3.12Å; Y404-G407 PolarHBondContact O-N 3.3Å; Y404-L408 HydrophobicContact CD1-CD1 4.19Å; Y404-L408 HydrophobicContact CE1-CD1 3.62Å; Y404-L408 HydrophobicContact CE1-CG 4.25Å; Y404-L408 PolarHBondContact O-N 3.05Å; Y404-Y430 PolarHBondContact OH-OH 2.89Å; Y404-V447 WeakPolarHBondContact OH-CG1 3.19Å; Y404-C476 WeakPolarHBondContact CA-O 3.39Å
405	A	98.9	Very high	97.9	Very high	5 Å²	5	11 Å²	11	4%	0.041	6%	0.06	C	C	.	.	H	α-helix	trans	-63.8	-40.2	177.8	0	0	0	0	0	112.4	L336 A401 D402 I403 G407 L408 V409	L336-A405 HydrophobicContact CB-CB 4.11Å; L336-A405 WeakPolarHBondContact O-CB 3.34Å; A401-A405 PolarHBondContact O-N 2.95Å; D402-A405 PolarHBondContact O-N 3.35Å; I403-A405 VanDerWaalsContact C-N 3.31Å; I403-A405 PolarHBondContact O-N 3.11Å; A405-G407 VanDerWaalsContact C-N 3.3Å; A405-G407 PolarHBondContact O-N 3.08Å; A405-L408 WeakPolarHBondContact O-CB 3.22Å; A405-L408 PolarHBondContact O-N 3.49Å; A405-L408 VanDerWaalsContact O-N 3.11Å; A405-V409 PolarHBondContact O-N 3.37Å
406	L	98.9	Very high	98.1	Very high	1 Å²	1	11.6 Å²	11.6	1%	0.005	6%	0.062	C	C	.	.	H	α-helix	trans	-60	-40.5	174.2	-177.1	64.8	0	0	0	111.6	A311 L315 L336 D402 I403 Y404 L408 V409 Y410 I490	A311-L406 HydrophobicContact CB-CD1 4.31Å; L315-L406 HydrophobicContact CD2-CB 4.17Å; L315-L406 HydrophobicContact CD2-CD2 3.72Å; L315-L406 HydrophobicContact CD2-CG 4.43Å; L336-L406 HydrophobicContact CD2-CB 3.76Å; L336-L406 HydrophobicContact CD2-CD1 4.16Å; D402-L406 WeakPolarHBondContact O-CB 3.43Å; D402-L406 PolarHBondContact O-N 3.36Å; I403-L406 PolarHBondContact O-N 3.43Å; Y404-L406 PolarHBondContact O-N 3.12Å; L406-L408 VanDerWaalsContact C-N 3.28Å; L406-L408 PolarHBondContact O-N 2.87Å; L406-V409 WeakPolarHBondContact O-CB 3.48Å; L406-V409 PolarHBondContact O-N 2.82Å; L406-V409 VanDerWaalsContact O-N 3.15Å; L406-Y410 HydrophobicContact CD1-CD1 4.22Å; L406-Y410 HydrophobicContact CD1-CE1 3.61Å; L406-Y410 HydrophobicContact CD2-CE1 4.43Å; L406-Y410 HydrophobicContact CD2-CE2 4.32Å; L406-Y410 HydrophobicContact CG-CD1 4.41Å; L406-Y410 HydrophobicContact CG-CE1 3.89Å; L406-Y410 HydrophobicContact CG-CE2 4.17Å; L406-Y410 PolarHBondContact O-N 3.28Å; L406-I490 HydrophobicContact CD2-CD1 4.09Å
407	G	98.9	Very high	98.3	Very high	0 Å²	0	8.2 Å²	8.2	0%	0	4%	0.044	C	C	.	.	H	α-helix	trans	-59.3	-38.4	174.6	0	0	0	0	0	112.6	I403 Y404 A405 Y410 W411 W477	I403-G407 PolarHBondContact O-N 3.05Å; Y404-G407 PolarHBondContact O-N 3.3Å; A405-G407 VanDerWaalsContact C-N 3.3Å; A405-G407 PolarHBondContact O-N 3.08Å; G407-Y410 PolarHBondContact O-N 3.03Å; G407-W411 PolarHBondContact O-N 3.08Å; G407-W477 VanDerWaalsContact O-CZ2 3.3Å; G407-W477 WeakPolarHBondContact O-CZ2 3.5Å
408	L	98.9	Very high	98.2	Very high	0 Å²	0	9.8 Å²	9.8	0%	0	5%	0.051	C	C	.	.	H	α-helix	trans	-66.4	-40.8	174.6	-61.2	175.7	0	0	0	111.7	Y380 Y404 A405 L406 Y410 W411 E412 P429 Y430 P454 W477	Y380-L408 HydrophobicContact CD1-CB 4Å; Y380-L408 HydrophobicContact CD1-CD1 3.92Å; Y380-L408 HydrophobicContact CE1-CB 4.13Å; Y380-L408 HydrophobicContact CG-CD1 4.36Å; Y404-L408 HydrophobicContact CD1-CD1 4.19Å; Y404-L408 HydrophobicContact CE1-CD1 3.62Å; Y404-L408 HydrophobicContact CE1-CG 4.25Å; Y404-L408 PolarHBondContact O-N 3.05Å; A405-L408 WeakPolarHBondContact O-CB 3.22Å; A405-L408 PolarHBondContact O-N 3.49Å; A405-L408 VanDerWaalsContact O-N 3.11Å; L406-L408 VanDerWaalsContact C-N 3.28Å; L406-L408 PolarHBondContact O-N 2.87Å; L408-Y410 VanDerWaalsContact C-N 3.31Å; L408-Y410 PolarHBondContact O-N 2.98Å; L408-W411 WeakPolarHBondContact O-CB 3.11Å; L408-W411 PolarHBondContact O-N 3.49Å; L408-E412 PolarHBondContact O-N 3.48Å; L408-P429 HydrophobicContact CB-CB 4.12Å; L408-P429 HydrophobicContact CB-CG 4.11Å; L408-P429 HydrophobicContact CD1-CB 4.49Å; L408-P429 HydrophobicContact CD1-CG 4.45Å; L408-P429 HydrophobicContact CD2-CB 3.99Å; L408-P429 HydrophobicContact CG-CB 4.43Å; L408-Y430 HydrophobicContact CD1-CE2 4Å; L408-Y430 HydrophobicContact CD2-CE2 3.71Å; L408-P454 HydrophobicContact CD2-CG 3.68Å; L408-W477 HydrophobicContact CD2-CZ2 3.96Å; L408-W477 VanDerWaalsContact N-NE1 3.18Å
409	V	98.9	Very high	97.9	Very high	0 Å²	0	9.8 Å²	9.8	0%	0	5%	0.052	C	C	.	.	H	α-helix	trans	-61.9	-39.9	174.6	173.5	0	0	0	0	111.2	L290 I341 Y380 A405 L406 W411 E412 I413	L290-V409 HydrophobicContact CD2-CG1 3.59Å; I341-V409 HydrophobicContact CD1-CG1 3.94Å; I341-V409 HydrophobicContact CD1-CG2 4.32Å; Y380-V409 HydrophobicContact CE1-CG2 4.23Å; A405-V409 PolarHBondContact O-N 3.37Å; L406-V409 WeakPolarHBondContact O-CB 3.48Å; L406-V409 PolarHBondContact O-N 2.82Å; L406-V409 VanDerWaalsContact O-N 3.15Å; V409-W411 VanDerWaalsContact C-N 3.26Å; V409-W411 PolarHBondContact O-N 2.77Å; V409-E412 WeakPolarHBondContact O-CB 3.41Å; V409-E412 PolarHBondContact O-N 2.99Å; V409-E412 VanDerWaalsContact O-N 3.09Å; V409-I413 HydrophobicContact CG1-CD1 4.16Å; V409-I413 HydrophobicContact CG1-CG1 4.43Å; V409-I413 WeakPolarHBondContact O-CG1 3.2Å; V409-I413 PolarHBondContact O-N 3.1Å
410	Y	98.9	Very high	97.1	Very high	0 Å²	0	11.1 Å²	11.1	0%	0	8%	0.079	C	C	.	.	H	α-helix	trans	-62	-35.1	175.9	-72.4	-6.5	0	0	0	113.1	A308 A312 L406 G407 L408 E412 I413 A414 M469 M472 M473 I490 L494	A308-Y410 HydrophobicContact CB-CD1 4.05Å; A308-Y410 HydrophobicContact CB-CE1 3.68Å; A308-Y410 PolarHBondContact O-OH 3.27Å; A312-Y410 VanDerWaalsContact CB-OH 3.28Å; A312-Y410 WeakPolarHBondContact CB-OH 3.02Å; L406-Y410 HydrophobicContact CD1-CD1 4.22Å; L406-Y410 HydrophobicContact CD1-CE1 3.61Å; L406-Y410 HydrophobicContact CD2-CE1 4.43Å; L406-Y410 HydrophobicContact CD2-CE2 4.32Å; L406-Y410 HydrophobicContact CG-CD1 4.41Å; L406-Y410 HydrophobicContact CG-CE1 3.89Å; L406-Y410 HydrophobicContact CG-CE2 4.17Å; L406-Y410 PolarHBondContact O-N 3.28Å; G407-Y410 PolarHBondContact O-N 3.03Å; L408-Y410 VanDerWaalsContact C-N 3.31Å; L408-Y410 PolarHBondContact O-N 2.98Å; Y410-E412 VanDerWaalsContact C-N 3.35Å; Y410-I413 HydrophobicContact CD1-CD1 4.16Å; Y410-I413 PolarHBondContact O-N 3.3Å; Y410-A414 VanDerWaalsContact O-CB 3.3Å; Y410-A414 WeakPolarHBondContact O-CB 3.4Å; Y410-A414 PolarHBondContact O-N 3.43Å; Y410-M469 HydrophobicContact CD2-SD 3.7Å; Y410-M469 HydrophobicContact CE2-SD 4.37Å; Y410-M469 HydrophobicContact CG-SD 3.8Å; Y410-M472 HydrophobicContact CD2-CE 4.18Å; Y410-M472 HydrophobicContact CE2-CE 3.97Å; Y410-M473 WeakPolarHBondContact O-CE 3.29Å; Y410-I490 HydrophobicContact CE2-CG2 3.67Å; Y410-I490 WeakPolarHBondContact OH-CG2 3.44Å; Y410-L494 HydrophobicContact CE2-CD1 4.42Å
411	W	98.8	Very high	96.5	Very high	3 Å²	3	12.6 Å²	12.6	1%	0.011	10%	0.098	C	C	.	.	H	α-helix	trans	-62.6	-42.2	172.1	-178.1	89	0	0	0	112	G407 L408 V409 I413 A414 R415 Q427 P429 Y431 P454 N455 W460 M473 W477	G407-W411 PolarHBondContact O-N 3.08Å; L408-W411 WeakPolarHBondContact O-CB 3.11Å; L408-W411 PolarHBondContact O-N 3.49Å; V409-W411 VanDerWaalsContact C-N 3.26Å; V409-W411 PolarHBondContact O-N 2.77Å; W411-I413 PolarHBondContact O-N 3.17Å; W411-A414 PolarHBondContact O-N 3.21Å; W411-R415 HydrophobicContact CD2-CG 4.39Å; W411-R415 VanDerWaalsContact CZ2-CD 3.44Å; W411-R415 HydrophobicContact CZ2-CG 4.41Å; W411-R415 VanDerWaalsContact CZ3-CD 3.45Å; W411-R415 WeakPolarHBondContact O-CG 3.47Å; W411-R415 PolarHBondContact O-N 3.37Å; W411-Q427 HydrophobicContact CH2-CB 4.18Å; W411-Q427 HydrophobicContact CZ3-CB 4.36Å; W411-Q427 WeakPolarHBondContact CZ3-O 3.18Å; W411-P429 HydrophobicContact CE3-CB 4.45Å; W411-Y431 AromaticContact CH2-CD1 3.92Å; W411-Y431 HydrophobicContact CH2-CD1 3.92Å; W411-Y431 AromaticContact CH2-CE1 3.92Å; W411-Y431 HydrophobicContact CH2-CE1 3.92Å; W411-Y431 HydrophobicContact CZ2-CE1 4.44Å; W411-P454 HydrophobicContact CD2-CB 3.66Å; W411-P454 HydrophobicContact CD2-CG 4.48Å; W411-P454 VanDerWaalsContact CE2-CB 3.45Å; W411-P454 HydrophobicContact CE3-CB 4.32Å; W411-P454 HydrophobicContact CG-CB 3.83Å; W411-P454 HydrophobicContact CZ2-CB 3.91Å; W411-N455 PolarHBondContact NE1-O 3.16Å; W411-W460 AromaticContact CD1-CH2 3.88Å; W411-M473 HydrophobicContact CB-CE 4.24Å; W411-M473 HydrophobicContact CB-SD 3.7Å; W411-M473 HydrophobicContact CG-SD 4.29Å; W411-W477 HydrophobicContact CB-CH2 3.89Å; W411-W477 HydrophobicContact CB-CZ2 3.81Å; W411-W477 AromaticContact CD1-CH2 3.87Å; W411-W477 HydrophobicContact CG-CH2 4.07Å; W411-W477 HydrophobicContact CG-CZ2 4.4Å
412	E	98.8	Very high	96.1	Very high	1 Å²	1	15.4 Å²	15.4	1%	0.005	11%	0.114	C	C	.	.	H	α-helix	trans	-60.6	-44.3	174.3	-62.5	177.2	-112	0	0	111.9	L294 S338 Y380 L408 V409 Y410 Y426	L294-E412 HydrophobicContact CD1-CB 4.03Å; S338-E412 VanDerWaalsContact CB-OE2 3.24Å; S338-E412 WeakPolarHBondContact CB-OE2 3.47Å; S338-E412 PolarHBondContact OG-OE1 3.34Å; S338-E412 PolarHBondContact OG-OE2 3.09Å; Y380-E412 VanDerWaalsContact CE1-OE1 3.31Å; Y380-E412 WeakPolarHBondContact CE1-OE1 3.23Å; Y380-E412 VanDerWaalsContact OH-CD 3.3Å; Y380-E412 PolarHBondContact OH-OE1 3.08Å; Y380-E412 PolarHBondContact OH-OE2 3.33Å; L408-E412 PolarHBondContact O-N 3.48Å; V409-E412 WeakPolarHBondContact O-CB 3.41Å; V409-E412 PolarHBondContact O-N 2.99Å; V409-E412 VanDerWaalsContact O-N 3.09Å; Y410-E412 VanDerWaalsContact C-N 3.35Å; E412-Y426 HydrophobicContact CB-CE2 4.25Å; E412-Y426 HydrophobicContact CG-CE2 4.48Å; E412-Y426 PolarHBondContact OE2-OH 3.42Å
413	I	98.8	Very high	95.8	Very high	0 Å²	0	19 Å²	19	0%	0	13%	0.13	C	C	.	.	H	α-helix	trans	-64.8	-48.9	178.8	-58.8	169.8	0	0	0	110.5	L290 L294 M304 L307 A308 V409 Y410 W411 R415 R416 C417	L290-I413 HydrophobicContact CD1-CG1 4.4Å; L290-I413 HydrophobicContact CD2-CD1 3.97Å; L290-I413 HydrophobicContact CD2-CG1 3.97Å; L294-I413 HydrophobicContact CD1-CG1 4.05Å; M304-I413 HydrophobicContact CB-CG2 4.25Å; M304-I413 HydrophobicContact CG-CG2 3.79Å; L307-I413 HydrophobicContact CB-CD1 4.18Å; L307-I413 HydrophobicContact CB-CG2 4.3Å; L307-I413 HydrophobicContact CD1-CG2 4.24Å; A308-I413 HydrophobicContact CB-CD1 4.45Å; V409-I413 HydrophobicContact CG1-CD1 4.16Å; V409-I413 HydrophobicContact CG1-CG1 4.43Å; V409-I413 WeakPolarHBondContact O-CG1 3.2Å; V409-I413 PolarHBondContact O-N 3.1Å; Y410-I413 HydrophobicContact CD1-CD1 4.16Å; Y410-I413 PolarHBondContact O-N 3.3Å; W411-I413 PolarHBondContact O-N 3.17Å; I413-R415 VanDerWaalsContact C-N 3.32Å; I413-R415 PolarHBondContact O-N 2.75Å; I413-R416 PolarHBondContact O-N 3.23Å; I413-C417 PolarHBondContact O-N 2.68Å
414	A	98.3	Very high	95.6	Very high	0 Å²	0	20.3 Å²	20.3	0%	0	14%	0.136	C	C	.	.	H	α-helix	trans	-63.5	-34.9	-173.6	0	0	0	0	0	113.1	M304 Y410 W411 R416 C417 W460 L466 M469 M473	M304-A414 HydrophobicContact SD-CB 4.25Å; Y410-A414 VanDerWaalsContact O-CB 3.3Å; Y410-A414 WeakPolarHBondContact O-CB 3.4Å; Y410-A414 PolarHBondContact O-N 3.43Å; W411-A414 PolarHBondContact O-N 3.21Å; A414-R416 PolarHBondContact O-N 3.48Å; A414-C417 WeakPolarHBondContact O-CB 3.46Å; A414-C417 PolarHBondContact O-N 3.46Å; A414-W460 HydrophobicContact CB-CE3 4.49Å; A414-W460 HydrophobicContact CB-CH2 3.44Å; A414-W460 VanDerWaalsContact CB-CH2 3.44Å; A414-W460 HydrophobicContact CB-CZ2 3.77Å; A414-W460 HydrophobicContact CB-CZ3 3.84Å; A414-L466 HydrophobicContact CB-CD2 3.99Å; A414-M469 HydrophobicContact CB-CG 4.2Å; A414-M473 HydrophobicContact CB-CE 3.51Å
415	R	97.9	Very high	95.5	Very high	22 Å²	22	27.3 Å²	27.3	8%	0.083	17%	0.169	C	C	.	.	H	α-helix	trans	-58.4	-31.4	173.4	-75.4	179.4	67.9	78.4	-0.9	113.6	W411 I413 C417 E424 E425 W460	W411-R415 HydrophobicContact CD2-CG 4.39Å; W411-R415 VanDerWaalsContact CZ2-CD 3.44Å; W411-R415 HydrophobicContact CZ2-CG 4.41Å; W411-R415 VanDerWaalsContact CZ3-CD 3.45Å; W411-R415 WeakPolarHBondContact O-CG 3.47Å; W411-R415 PolarHBondContact O-N 3.37Å; I413-R415 VanDerWaalsContact C-N 3.32Å; I413-R415 PolarHBondContact O-N 2.75Å; R415-C417 VanDerWaalsContact C-N 3.31Å; R415-E424 WeakPolarHBondContact CA-OE2 3.25Å; R415-E424 HydrophobicContact CB-CB 4.32Å; R415-E424 PolarHBondContact O-N 3.21Å; R415-E424 VanDerWaalsContact O-O 3.08Å; R415-E425 PolarHBondContact NE-O 3.5Å; R415-E425 PolarHBondContact NH2-O 2.72Å; R415-W460 HydrophobicContact CG-CH2 4.45Å; R415-W460 HydrophobicContact CG-CZ2 4.01Å
416	R	98.2	Very high	95.4	Very high	21 Å²	21	28.2 Å²	28.2	8%	0.079	17%	0.171	C	C	.	.	T	Hydrogen-bonded Turn	trans	-89.3	-0.4	-179.9	-55	-54.8	-68.6	143.2	1.6	112.7	L294 Y297 T298 V299 I413 A414 N418 H423 E424 Y426	L294-R416 HydrophobicContact CB-CG 4Å; L294-R416 HydrophobicContact CD2-CB 3.87Å; L294-R416 HydrophobicContact CD2-CG 3.87Å; L294-R416 HydrophobicContact CG-CG 4.41Å; L294-R416 PolarHBondContact O-NE 3.39Å; Y297-R416 PolarHBondContact O-NE 3.2Å; Y297-R416 PolarHBondContact O-NH2 3.19Å; T298-R416 CarbonylContact C-O 3.5Å; T298-R416 WeakPolarHBondContact CA-O 3.37Å; T298-R416 WeakPolarHBondContact CB-O 3.29Å; V299-R416 PolarHBondContact N-O 3.41Å; I413-R416 PolarHBondContact O-N 3.23Å; A414-R416 PolarHBondContact O-N 3.48Å; R416-N418 PolarHBondContact O-N 3.24Å; R416-H423 PolarHBondContact NH1-CD2 3.26Å; R416-E424 WeakPolarHBondContact CD-O 3.47Å; R416-E424 PolarHBondContact NH1-O 3.22Å; R416-Y426 HydrophobicContact CG-CD2 4.47Å
417	C	97.5	Very high	95.4	Very high	0 Å²	0	30.8 Å²	30.8	0%	0	18%	0.183	C	C	.	.	B	Isolated β-bridge	trans	-71	109.2	173.9	-171.4	0	0	0	0	109.7	V299 M304 I413 A414 R415 S419 L466	V299-C417 HydrophobicContact CG2-CB 4.49Å; V299-C417 CarbonylContact O-C 3.6Å; V299-C417 WeakPolarHBondContact O-CA 3.43Å; M304-C417 HydrophobicContact CB-CB 4.37Å; M304-C417 HydrophobicContact CG-CB 4.47Å; M304-C417 HydrophobicContact SD-CB 3.87Å; I413-C417 PolarHBondContact O-N 2.68Å; A414-C417 WeakPolarHBondContact O-CB 3.46Å; A414-C417 PolarHBondContact O-N 3.46Å; R415-C417 VanDerWaalsContact C-N 3.31Å; C417-S419 PolarHBondContact O-N 3.43Å; C417-L466 HydrophobicContact CB-CD2 3.98Å
418	N	94.1	Very high	95.4	Very high	55 Å²	55	32.9 Å²	32.9	29%	0.294	19%	0.194	S	C	.	.			trans	-84.4	106	175	-175.4	-11.1	0	0	0	109.6	V299 R416 G421 H423	V299-N418 PolarHBondContact O-N 3.31Å; R416-N418 PolarHBondContact O-N 3.24Å; N418-G421 VanDerWaalsContact OD1-C 3.3Å; N418-G421 WeakPolarHBondContact OD1-CA 3.34Å; N418-G421 PolarHBondContact OD1-N 3.41Å; N418-H423 HydrophobicContact CB-CB 4.27Å
419	S	89.3	Confident	95.4	Very high	5 Å²	5	32.9 Å²	32.9	4%	0.035	19%	0.194	C	C	.	.	B	Isolated β-bridge	trans	-116.5	110.5	176.9	-62	0	0	0	0	109.1	C417 G421 V422 Y463	C417-S419 PolarHBondContact O-N 3.43Å; S419-G421 VanDerWaalsContact C-N 3.32Å; S419-G421 PolarHBondContact O-N 3Å; S419-V422 PolarHBondContact N-O 3.46Å; S419-V422 VanDerWaalsContact N-O 3.09Å; S419-V422 PolarHBondContact O-N 3.22Å; S419-Y463 PolarHBondContact O-OH 3.05Å
420	G	80.5	Confident	95.4	Very high	75 Å²	75	32.9 Å²	32.9	77%	0.773	19%	0.194	S	C	*	.	T	Hydrogen-bonded Turn	trans	65.6	29.4	-179.8	0	0	0	0	0	114.6	V422	G420-V422 VanDerWaalsContact C-N 3.27Å; G420-V422 PolarHBondContact O-N 3.36Å
421	G	86.1	Confident	95.3	Very high	56 Å²	56	37.6 Å²	37.6	58%	0.577	21%	0.213	S	C	*	.	T	Hydrogen-bonded Turn	trans	85.9	-8.2	-177.4	0	0	0	0	0	114.2	N418 S419	N418-G421 VanDerWaalsContact OD1-C 3.3Å; N418-G421 WeakPolarHBondContact OD1-CA 3.34Å; N418-G421 PolarHBondContact OD1-N 3.41Å; S419-G421 VanDerWaalsContact C-N 3.32Å; S419-G421 PolarHBondContact O-N 3Å
422	V	90.1	Very high	95.3	Very high	74 Å²	74	41.4 Å²	41.4	45%	0.448	23%	0.233	S	C	.	.	B	Isolated β-bridge	trans	-96.4	127.4	-179.3	-175.2	0	0	0	0	109.8	S419 G420 W459	S419-V422 PolarHBondContact N-O 3.46Å; S419-V422 VanDerWaalsContact N-O 3.09Å; S419-V422 PolarHBondContact O-N 3.22Å; G420-V422 VanDerWaalsContact C-N 3.27Å; G420-V422 PolarHBondContact O-N 3.36Å; V422-W459 HydrophobicContact CG1-CD2 4.33Å; V422-W459 HydrophobicContact CG1-CE3 4.5Å; V422-W459 HydrophobicContact CG1-CH2 4.49Å; V422-W459 HydrophobicContact CG1-CZ2 4.31Å
423	H	92.1	Very high	95.3	Very high	77 Å²	77	44.7 Å²	44.7	36%	0.356	25%	0.251	S	S	.	.			trans	-157.8	161.7	172.8	62.3	-87.8	0	0	0	109.9	R416 N418	R416-H423 PolarHBondContact NH1-CD2 3.26Å; N418-H423 HydrophobicContact CB-CB 4.27Å
424	E	95.1	Very high	95.3	Very high	32 Å²	32	45.3 Å²	45.3	15%	0.15	25%	0.254	C	S	.	.	P	Polyproline II helix	trans	-99.8	154.4	171.2	-61.2	93.4	170	0	0	112.5	R415 R416 P457 W459	R415-E424 WeakPolarHBondContact CA-OE2 3.25Å; R415-E424 HydrophobicContact CB-CB 4.32Å; R415-E424 PolarHBondContact O-N 3.21Å; R415-E424 VanDerWaalsContact O-O 3.08Å; R416-E424 WeakPolarHBondContact CD-O 3.47Å; R416-E424 PolarHBondContact NH1-O 3.22Å; E424-P457 WeakPolarHBondContact OE1-CG 3.46Å; E424-W459 VanDerWaalsContact OE1-CE2 3.26Å; E424-W459 VanDerWaalsContact OE1-CZ2 3.3Å; E424-W459 WeakPolarHBondContact OE1-CZ2 3.34Å; E424-W459 PolarHBondContact OE1-NE1 3.48Å; E424-W459 WeakPolarHBondContact OE2-CZ2 3.4Å
425	E	96.3	Very high	95.2	Very high	146 Å²	146	48.5 Å²	48.5	68%	0.682	28%	0.275	S	S	*	.	P	Polyproline II helix	trans	-59	149.9	168.3	-66.3	-171.4	166.6	0	0	112.1	R415 Q427	R415-E425 PolarHBondContact NE-O 3.5Å; R415-E425 PolarHBondContact NH2-O 2.72Å; E425-Q427 PolarHBondContact O-N 3.29Å
426	Y	97.9	Very high	95.1	Very high	24 Å²	24	52.9 Å²	52.9	9%	0.094	31%	0.309	C	S	.	.	P	Polyproline II helix	trans	-60	132.6	174.3	177.5	-94.4	0	0	0	110.4	F291 L294 N295 E412 R416 L428	F291-Y426 AromaticContact CD2-CE1 3.95Å; F291-Y426 HydrophobicContact CD2-CE1 3.95Å; F291-Y426 AromaticContact CD2-CZ 3.68Å; F291-Y426 WeakPolarHBondContact CD2-OH 3.43Å; F291-Y426 AromaticContact CE2-CE1 3.59Å; F291-Y426 HydrophobicContact CE2-CE1 3.59Å; F291-Y426 AromaticContact CE2-CZ 3.82Å; F291-Y426 WeakPolarHBondContact CE2-OH 3.46Å; F291-Y426 HydrophobicContact CZ-CE1 4.27Å; L294-Y426 HydrophobicContact CB-CD2 3.58Å; L294-Y426 HydrophobicContact CB-CE2 3.86Å; L294-Y426 HydrophobicContact CD1-CE2 4.26Å; N295-Y426 WeakPolarHBondContact ND2-CD1 3.39Å; N295-Y426 WeakPolarHBondContact ND2-CE1 3.26Å; N295-Y426 WeakPolarHBondContact OD1-CD1 3.47Å; E412-Y426 HydrophobicContact CB-CE2 4.25Å; E412-Y426 HydrophobicContact CG-CE2 4.48Å; E412-Y426 PolarHBondContact OE2-OH 3.42Å; R416-Y426 HydrophobicContact CG-CD2 4.47Å; Y426-L428 HydrophobicContact CE1-CG 4.48Å; Y426-L428 VanDerWaalsContact OH-CD2 3.3Å; Y426-L428 WeakPolarHBondContact OH-CD2 3.43Å
427	Q	98.4	Very high	94.9	Very high	56 Å²	56	57.8 Å²	57.8	26%	0.262	34%	0.337	S	S	.	.			trans	-144.3	148.9	174.3	-69.1	-61.8	-17.2	0	0	108.9	W411 E425 Y431	W411-Q427 HydrophobicContact CH2-CB 4.18Å; W411-Q427 HydrophobicContact CZ3-CB 4.36Å; W411-Q427 WeakPolarHBondContact CZ3-O 3.18Å; E425-Q427 PolarHBondContact O-N 3.29Å; Q427-Y431 HydrophobicContact CB-CD1 3.55Å; Q427-Y431 HydrophobicContact CB-CD2 4.13Å; Q427-Y431 HydrophobicContact CB-CE1 3.93Å; Q427-Y431 HydrophobicContact CB-CE2 4.44Å; Q427-Y431 HydrophobicContact CB-CG 3.67Å; Q427-Y431 VanDerWaalsContact CD-CD2 3.42Å; Q427-Y431 HydrophobicContact CG-CD1 3.94Å; Q427-Y431 HydrophobicContact CG-CD2 3.74Å; Q427-Y431 HydrophobicContact CG-CE1 3.97Å; Q427-Y431 HydrophobicContact CG-CE2 3.74Å; Q427-Y431 HydrophobicContact CG-CG 3.84Å
428	L	98.4	Very high	95	Very high	43 Å²	43	58 Å²	58	23%	0.225	34%	0.338	C	S	.	.			trans	-71.9	152.2	168	-76	167.7	0	0	0	110	F291 Y380 Y426 Y430 Y431	F291-L428 HydrophobicContact CD2-CD2 4.14Å; F291-L428 HydrophobicContact CE2-CD1 4.48Å; F291-L428 HydrophobicContact CE2-CD2 4.02Å; F291-L428 HydrophobicContact CE2-CG 4.29Å; Y380-L428 WeakPolarHBondContact OH-CD2 3.18Å; Y426-L428 HydrophobicContact CE1-CG 4.48Å; Y426-L428 VanDerWaalsContact OH-CD2 3.3Å; Y426-L428 WeakPolarHBondContact OH-CD2 3.43Å; L428-Y430 PolarHBondContact O-N 3.13Å; L428-Y431 VanDerWaalsContact O-CB 3.32Å; L428-Y431 WeakPolarHBondContact O-CB 3.33Å; L428-Y431 PolarHBondContact O-N 3.18Å; L428-Y431 VanDerWaalsContact O-N 3.13Å
429	P	98.7	Very high	95.1	Very high	0 Å²	0	57.6 Å²	57.6	0%	0	34%	0.34	C	S	.	.	T	Hydrogen-bonded Turn	trans	-58.9	138.7	174.3	24.7	-33.2	0	0	0	109.9	R379 Y380 L408 W411 Y431 P454	R379-P429 VanDerWaalsContact CD-O 3.23Å; R379-P429 WeakPolarHBondContact CD-O 3.44Å; R379-P429 HydrophobicContact CG-CG 4.21Å; R379-P429 WeakPolarHBondContact CG-O 3.49Å; R379-P429 PolarHBondContact NH1-O 3.18Å; Y380-P429 HydrophobicContact CD1-CG 4.35Å; Y380-P429 HydrophobicContact CE1-CG 3.7Å; Y380-P429 HydrophobicContact CE2-CG 4.32Å; Y380-P429 WeakPolarHBondContact OH-CD 3.3Å; L408-P429 HydrophobicContact CB-CB 4.12Å; L408-P429 HydrophobicContact CB-CG 4.11Å; L408-P429 HydrophobicContact CD1-CB 4.49Å; L408-P429 HydrophobicContact CD1-CG 4.45Å; L408-P429 HydrophobicContact CD2-CB 3.99Å; L408-P429 HydrophobicContact CG-CB 4.43Å; W411-P429 HydrophobicContact CE3-CB 4.45Å; P429-Y431 VanDerWaalsContact C-N 3.26Å; P429-Y431 PolarHBondContact O-N 3.49Å; P429-P454 HydrophobicContact CB-CG 4.01Å
430	Y	98.6	Very high	95.5	Very high	0 Å²	0	59.4 Å²	59.4	0%	0	35%	0.349	C	S	.	.	T	Hydrogen-bonded Turn	trans	64.9	18.9	-176.3	-46.8	-78.2	0	0	0	115.2	R379 Y404 L408 L428 D432 L433 V434 M443 V446 V447 R453 P454	R379-Y430 HydrophobicContact CG-CD2 4.43Å; R379-Y430 PolarHBondContact NH1-O 3.12Å; Y404-Y430 PolarHBondContact OH-OH 2.89Å; L408-Y430 HydrophobicContact CD1-CE2 4Å; L408-Y430 HydrophobicContact CD2-CE2 3.71Å; L428-Y430 PolarHBondContact O-N 3.13Å; Y430-D432 PolarHBondContact O-N 3.07Å; Y430-D432 VanDerWaalsContact O-N 3.13Å; Y430-L433 HydrophobicContact CD1-CD1 4.13Å; Y430-L433 PolarHBondContact O-N 3.31Å; Y430-V434 WeakPolarHBondContact O-CG2 3.36Å; Y430-V434 PolarHBondContact O-N 3.2Å; Y430-V434 VanDerWaalsContact O-N 3.08Å; Y430-M443 HydrophobicContact CD2-CE 3.81Å; Y430-M443 HydrophobicContact CE2-CE 4.02Å; Y430-M443 HydrophobicContact CG-CE 4.36Å; Y430-V446 HydrophobicContact CD1-CG1 4.12Å; Y430-V446 HydrophobicContact CE1-CG1 4.44Å; Y430-V447 HydrophobicContact CE1-CG2 4.03Å; Y430-V447 HydrophobicContact CE2-CG2 4.28Å; Y430-R453 WeakPolarHBondContact OH-CD 3.4Å; Y430-P454 HydrophobicContact CD1-CG 4.45Å; Y430-P454 HydrophobicContact CE1-CG 4.16Å; Y430-P454 HydrophobicContact CE2-CG 4.36Å
431	Y	98.4	Very high	96.3	Very high	99 Å²	99	60.9 Å²	60.9	39%	0.388	34%	0.335	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.1	-28.2	177.4	77.5	-72.2	0	0	0	113.8	W411 Q427 L428 P429	W411-Y431 AromaticContact CH2-CD1 3.92Å; W411-Y431 HydrophobicContact CH2-CD1 3.92Å; W411-Y431 AromaticContact CH2-CE1 3.92Å; W411-Y431 HydrophobicContact CH2-CE1 3.92Å; W411-Y431 HydrophobicContact CZ2-CE1 4.44Å; Q427-Y431 HydrophobicContact CB-CD1 3.55Å; Q427-Y431 HydrophobicContact CB-CD2 4.13Å; Q427-Y431 HydrophobicContact CB-CE1 3.93Å; Q427-Y431 HydrophobicContact CB-CE2 4.44Å; Q427-Y431 HydrophobicContact CB-CG 3.67Å; Q427-Y431 VanDerWaalsContact CD-CD2 3.42Å; Q427-Y431 HydrophobicContact CG-CD1 3.94Å; Q427-Y431 HydrophobicContact CG-CD2 3.74Å; Q427-Y431 HydrophobicContact CG-CE1 3.97Å; Q427-Y431 HydrophobicContact CG-CE2 3.74Å; Q427-Y431 HydrophobicContact CG-CG 3.84Å; L428-Y431 VanDerWaalsContact O-CB 3.32Å; L428-Y431 WeakPolarHBondContact O-CB 3.33Å; L428-Y431 PolarHBondContact O-N 3.18Å; L428-Y431 VanDerWaalsContact O-N 3.13Å; P429-Y431 VanDerWaalsContact C-N 3.26Å; P429-Y431 PolarHBondContact O-N 3.49Å
432	D	98	Very high	96.9	Very high	83 Å²	83	61.9 Å²	61.9	44%	0.444	33%	0.325	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.1	-7.7	-178.1	54.9	-22.8	0	0	0	113.7	Y430	Y430-D432 PolarHBondContact O-N 3.07Å; Y430-D432 VanDerWaalsContact O-N 3.13Å
433	L	98.3	Very high	97.3	Very high	71 Å²	71	58.4 Å²	58.4	37%	0.372	30%	0.304	S	S	.	.	T	Hydrogen-bonded Turn	trans	-123.1	-23.2	-172.1	-64.5	171.5	0	0	0	113.8	Y430 V446 L452	Y430-L433 HydrophobicContact CD1-CD1 4.13Å; Y430-L433 PolarHBondContact O-N 3.31Å; L433-V446 HydrophobicContact CB-CG1 4.06Å; L433-V446 HydrophobicContact CB-CG2 4.34Å; L433-V446 HydrophobicContact CD1-CG1 3.85Å; L433-L452 HydrophobicContact CD1-CB 4.07Å; L433-L452 HydrophobicContact CD1-CD1 4.04Å; L433-L452 HydrophobicContact CD2-CD1 4.04Å
434	V	98.4	Very high	97.6	Very high	13 Å²	13	57.4 Å²	57.4	8%	0.079	30%	0.297	C	S	.	.	S	Bend	trans	-140.5	153	-177.2	-56.1	0	0	0	0	111.8	Y430 P438 M443 V446	Y430-V434 WeakPolarHBondContact O-CG2 3.36Å; Y430-V434 PolarHBondContact O-N 3.2Å; Y430-V434 VanDerWaalsContact O-N 3.08Å; V434-P438 HydrophobicContact CB-CB 3.9Å; V434-P438 HydrophobicContact CG2-CB 3.84Å; V434-P438 HydrophobicContact CG2-CG 3.97Å; V434-M443 HydrophobicContact CB-SD 4.38Å; V434-M443 HydrophobicContact CG1-SD 4Å; V434-M443 HydrophobicContact CG2-SD 3.81Å; V434-V446 HydrophobicContact CG1-CB 4.35Å; V434-V446 HydrophobicContact CG1-CG2 3.74Å
435	P	97.6	Very high	97.7	Very high	67 Å²	67	61.5 Å²	61.5	44%	0.435	31%	0.314	S	S	.	.			trans	-64.6	169.7	178.4	28.7	-37.1	0	0	0	112.5	R379 D437 P438 E442	R379-P435 PolarHBondContact NH2-O 3.02Å; P435-D437 PolarHBondContact O-N 3.43Å; P435-P438 HydrophobicContact CG-CB 4.44Å; P435-P438 WeakPolarHBondContact O-CD 3.46Å; P435-E442 WeakPolarHBondContact CG-OE1 3.46Å
436	S	94.8	Very high	97.9	Very high	113 Å²	113	55 Å²	55	79%	0.79	29%	0.285	S	S	*	.	S	Bend	trans	-57.1	-43.8	-173.3	-54.2	0	0	0	0	114.5	R379 P438	R379-S436 PolarHBondContact NH2-O 3.4Å; S436-P438 WeakPolarHBondContact O-CD 3.41Å
437	D	95.4	Very high	97.9	Very high	125 Å²	125	54 Å²	54	67%	0.668	28%	0.28	S	S	*	.	S	Bend	trans	-112.8	83.6	170	-179.5	25.9	0	0	0	109.8	K378 P435	K378-D437 IonicContact NZ-OD1 3.82Å; K378-D437 PolarHBondContact NZ-OD1 2.77Å; P435-D437 PolarHBondContact O-N 3.43Å
438	P	97.8	Very high	97.9	Very high	4 Å²	4	52.2 Å²	52.2	3%	0.026	27%	0.274	C	S	.	.			trans	-74.6	145	-174	32.7	-35.4	0	0	0	110.8	K378 R379 V434 P435 S436 M443	K378-P438 WeakPolarHBondContact CD-O 3.45Å; R379-P438 HydrophobicContact CB-CG 4.18Å; V434-P438 HydrophobicContact CB-CB 3.9Å; V434-P438 HydrophobicContact CG2-CB 3.84Å; V434-P438 HydrophobicContact CG2-CG 3.97Å; P435-P438 HydrophobicContact CG-CB 4.44Å; P435-P438 WeakPolarHBondContact O-CD 3.46Å; S436-P438 WeakPolarHBondContact O-CD 3.41Å; P438-M443 HydrophobicContact CB-CG 3.97Å; P438-M443 HydrophobicContact CB-SD 4.05Å; P438-M443 HydrophobicContact CG-CG 3.89Å; P438-M443 HydrophobicContact CG-SD 3.79Å
439	S	97.9	Very high	97.8	Very high	47 Å²	47	54.3 Å²	54.3	33%	0.329	29%	0.286	S	S	.	.			trans	-68.9	164.2	167.3	66.8	0	0	0	0	111.6	E441 E442 M443	S439-E441 PolarHBondContact O-N 2.86Å; S439-E442 WeakPolarHBondContact CB-OE2 2.92Å; S439-E442 PolarHBondContact N-OE2 3Å; S439-E442 PolarHBondContact O-N 3.33Å; S439-E442 VanDerWaalsContact OG-CD 3.32Å; S439-E442 VanDerWaalsContact OG-CG 3.29Å; S439-E442 WeakPolarHBondContact OG-CG 3.14Å; S439-E442 PolarHBondContact OG-N 3.22Å; S439-E442 PolarHBondContact OG-OE2 3.22Å; S439-M443 PolarHBondContact O-N 2.99Å
440	I	96.6	Very high	97.8	Very high	43 Å²	43	59 Å²	59	22%	0.221	31%	0.308	C	S	.	.	H	α-helix	trans	-61.2	-38.8	174.9	-63.4	-179.3	0	0	0	110.3	R374 K378 L386 M443 R444	R374-I440 HydrophobicContact CB-CD1 4.37Å; R374-I440 HydrophobicContact CG-CD1 4.45Å; K378-I440 HydrophobicContact CD-CG1 4.19Å; K378-I440 HydrophobicContact CG-CG1 3.93Å; L386-I440 HydrophobicContact CD2-CG2 4.14Å; I440-M443 PolarHBondContact O-N 3.28Å; I440-R444 VanDerWaalsContact O-CB 3.28Å; I440-R444 WeakPolarHBondContact O-CB 3.47Å; I440-R444 PolarHBondContact O-N 2.94Å
441	E	97.6	Very high	97.8	Very high	105 Å²	105	66.2 Å²	66.2	49%	0.491	34%	0.339	S	S	.	.	H	α-helix	trans	-68	-40.3	-177.7	-174.6	55.3	-155	0	0	112.6	S439 R444 K445	S439-E441 PolarHBondContact O-N 2.86Å; E441-R444 PolarHBondContact O-N 2.83Å; E441-R444 IonicContact OE1-CZ 3.55Å; E441-R444 IonicContact OE1-NE 2.78Å; E441-R444 PolarHBondContact OE1-NE 3.46Å; E441-R444 IonicContact OE1-NH2 2.68Å; E441-R444 PolarHBondContact OE1-NH2 2.94Å; E441-R444 IonicContact OE2-CZ 3.41Å; E441-R444 IonicContact OE2-NE 3.31Å; E441-R444 PolarHBondContact OE2-NE 2.78Å; E441-R444 IonicContact OE2-NH2 2.72Å; E441-K445 WeakPolarHBondContact O-CB 3.47Å; E441-K445 PolarHBondContact O-N 2.71Å
442	E	98.3	Very high	97.8	Very high	78 Å²	78	64.8 Å²	64.8	36%	0.364	34%	0.338	S	S	.	.	H	α-helix	trans	-62.1	-44.9	174	-72.6	162.8	134.9	0	0	111.5	P435 S439 K445 V446	P435-E442 WeakPolarHBondContact CG-OE1 3.46Å; S439-E442 WeakPolarHBondContact CB-OE2 2.92Å; S439-E442 PolarHBondContact N-OE2 3Å; S439-E442 PolarHBondContact O-N 3.33Å; S439-E442 VanDerWaalsContact OG-CD 3.32Å; S439-E442 VanDerWaalsContact OG-CG 3.29Å; S439-E442 WeakPolarHBondContact OG-CG 3.14Å; S439-E442 PolarHBondContact OG-N 3.22Å; S439-E442 PolarHBondContact OG-OE2 3.22Å; E442-K445 PolarHBondContact O-N 2.76Å; E442-V446 PolarHBondContact O-N 3.15Å
443	M	98.6	Very high	97.8	Very high	0 Å²	0	63.4 Å²	63.4	0%	0	33%	0.326	C	S	.	.	H	α-helix	trans	-63.7	-43.7	175.8	-71.9	-57.3	-53.3	0	0	111.8	K378 R379 L386 Y430 V434 P438 S439 I440 K445 V446 V447	K378-M443 HydrophobicContact CB-CG 4.46Å; R379-M443 WeakPolarHBondContact O-CE 3.44Å; L386-M443 HydrophobicContact CD1-CB 4.01Å; L386-M443 HydrophobicContact CD2-CB 3.65Å; Y430-M443 HydrophobicContact CD2-CE 3.81Å; Y430-M443 HydrophobicContact CE2-CE 4.02Å; Y430-M443 HydrophobicContact CG-CE 4.36Å; V434-M443 HydrophobicContact CB-SD 4.38Å; V434-M443 HydrophobicContact CG1-SD 4Å; V434-M443 HydrophobicContact CG2-SD 3.81Å; P438-M443 HydrophobicContact CB-CG 3.97Å; P438-M443 HydrophobicContact CB-SD 4.05Å; P438-M443 HydrophobicContact CG-CG 3.89Å; P438-M443 HydrophobicContact CG-SD 3.79Å; S439-M443 PolarHBondContact O-N 2.99Å; I440-M443 PolarHBondContact O-N 3.28Å; M443-K445 VanDerWaalsContact C-N 3.35Å; M443-K445 PolarHBondContact O-N 3.12Å; M443-V446 PolarHBondContact O-N 2.76Å; M443-V447 HydrophobicContact CE-CG2 3.71Å; M443-V447 VanDerWaalsContact O-CB 3.25Å; M443-V447 WeakPolarHBondContact O-CB 3.31Å; M443-V447 WeakPolarHBondContact O-CG2 3.42Å; M443-V447 PolarHBondContact O-N 2.73Å
444	R	98.3	Very high	97.9	Very high	57 Å²	57	60.2 Å²	60.2	22%	0.215	31%	0.31	C	S	.	.	H	α-helix	trans	-58.9	-45.4	177.5	-167.7	-165.4	70.9	63.8	13.4	111	L386 I440 E441 V446 C448 D449	L386-R444 HydrophobicContact CB-CB 4.35Å; L386-R444 HydrophobicContact CB-CG 4.45Å; I440-R444 VanDerWaalsContact O-CB 3.28Å; I440-R444 WeakPolarHBondContact O-CB 3.47Å; I440-R444 PolarHBondContact O-N 2.94Å; E441-R444 PolarHBondContact O-N 2.83Å; E441-R444 IonicContact OE1-CZ 3.55Å; E441-R444 IonicContact OE1-NE 2.78Å; E441-R444 PolarHBondContact OE1-NE 3.46Å; E441-R444 IonicContact OE1-NH2 2.68Å; E441-R444 PolarHBondContact OE1-NH2 2.94Å; E441-R444 IonicContact OE2-CZ 3.41Å; E441-R444 IonicContact OE2-NE 3.31Å; E441-R444 PolarHBondContact OE2-NE 2.78Å; E441-R444 IonicContact OE2-NH2 2.72Å; R444-V446 PolarHBondContact O-N 3.4Å; R444-C448 HydrophobicContact CG-CB 4.21Å; R444-C448 WeakPolarHBondContact O-CA 3.42Å; R444-C448 WeakPolarHBondContact O-CB 3.45Å; R444-C448 PolarHBondContact O-N 2.83Å; R444-D449 IonicContact CZ-OD1 3.96Å; R444-D449 IonicContact CZ-OD2 2.86Å; R444-D449 VanDerWaalsContact NH1-CG 3.29Å; R444-D449 IonicContact NH1-OD1 3.3Å; R444-D449 PolarHBondContact NH1-OD1 2.99Å; R444-D449 IonicContact NH1-OD2 3.72Å; R444-D449 PolarHBondContact NH1-OD2 3.48Å; R444-D449 VanDerWaalsContact NH1-OD2 3.09Å; R444-D449 IonicContact NH2-OD1 2.73Å; R444-D449 IonicContact NH2-OD2 3.09Å; R444-D449 PolarHBondContact NH2-OD2 2.82Å; R444-D449 PolarHBondContact O-N 3.46Å; R444-D449 VanDerWaalsContact O-N 3.16Å
445	K	98.5	Very high	97.8	Very high	118 Å²	118	64.9 Å²	64.9	51%	0.513	33%	0.334	S	S	.	.	I	π-helix	trans	-58.9	-46.1	177.2	-175.2	178.9	179.1	-179.1	0	112.2	E441 E442 M443 D449 Q450	E441-K445 WeakPolarHBondContact O-CB 3.47Å; E441-K445 PolarHBondContact O-N 2.71Å; E442-K445 PolarHBondContact O-N 2.76Å; M443-K445 VanDerWaalsContact C-N 3.35Å; M443-K445 PolarHBondContact O-N 3.12Å; K445-D449 WeakPolarHBondContact O-CB 3.36Å; K445-D449 PolarHBondContact O-N 2.86Å; K445-Q450 WeakPolarHBondContact O-CG 3.17Å; K445-Q450 PolarHBondContact O-N 3.49Å
446	V	98.6	Very high	97.8	Very high	10 Å²	10	62.9 Å²	62.9	6%	0.061	32%	0.32	C	S	.	.	I	π-helix	trans	-73.3	-47.2	-178.4	172.8	0	0	0	0	111.8	Y430 L433 V434 E442 M443 R444 K451 L452	Y430-V446 HydrophobicContact CD1-CG1 4.12Å; Y430-V446 HydrophobicContact CE1-CG1 4.44Å; L433-V446 HydrophobicContact CB-CG1 4.06Å; L433-V446 HydrophobicContact CB-CG2 4.34Å; L433-V446 HydrophobicContact CD1-CG1 3.85Å; V434-V446 HydrophobicContact CG1-CB 4.35Å; V434-V446 HydrophobicContact CG1-CG2 3.74Å; E442-V446 PolarHBondContact O-N 3.15Å; M443-V446 PolarHBondContact O-N 2.76Å; R444-V446 PolarHBondContact O-N 3.4Å; V446-K451 PolarHBondContact O-N 2.73Å; V446-L452 HydrophobicContact CG1-CB 3.99Å; V446-L452 HydrophobicContact CG1-CD1 4.42Å; V446-L452 PolarHBondContact O-N 2.85Å
447	V	98.6	Very high	97.8	Very high	1 Å²	1	58.2 Å²	58.2	1%	0.006	29%	0.287	C	S	.	.	I	π-helix	trans	-86.9	-36.3	-168.4	173.4	0	0	0	0	113	P383 L386 Y404 Y430 M443 K451 R453	P383-V447 HydrophobicContact CB-CG1 4.26Å; P383-V447 HydrophobicContact CG-CG1 3.73Å; L386-V447 HydrophobicContact CD1-CB 3.78Å; L386-V447 HydrophobicContact CD1-CG1 3.87Å; L386-V447 HydrophobicContact CD1-CG2 4.24Å; Y404-V447 WeakPolarHBondContact OH-CG1 3.19Å; Y430-V447 HydrophobicContact CE1-CG2 4.03Å; Y430-V447 HydrophobicContact CE2-CG2 4.28Å; M443-V447 HydrophobicContact CE-CG2 3.71Å; M443-V447 VanDerWaalsContact O-CB 3.25Å; M443-V447 WeakPolarHBondContact O-CB 3.31Å; M443-V447 WeakPolarHBondContact O-CG2 3.42Å; M443-V447 PolarHBondContact O-N 2.73Å; V447-K451 WeakPolarHBondContact O-CA 3.45Å; V447-R453 PolarHBondContact O-NH1 3.32Å
448	C	98.1	Very high	97.7	Very high	20 Å²	20	59.2 Å²	59.2	14%	0.135	29%	0.292	C	S	.	.	I	π-helix	trans	-99	-51.1	-176.2	-51.6	0	0	0	0	111.7	P383 R444 K451	P383-C448 PolarHBondContact O-SG 3.2Å; R444-C448 HydrophobicContact CG-CB 4.21Å; R444-C448 WeakPolarHBondContact O-CA 3.42Å; R444-C448 WeakPolarHBondContact O-CB 3.45Å; R444-C448 PolarHBondContact O-N 2.83Å; C448-K451 VanDerWaalsContact O-CG 3.27Å; C448-K451 WeakPolarHBondContact O-CG 3.15Å
449	D	97.9	Very high	97.4	Very high	87 Å²	87	62 Å²	62	47%	0.465	30%	0.302	S	S	.	.	I	π-helix	trans	-76.8	-52.7	-174.4	-56.7	-18.1	0	0	0	111.2	R444 K445	R444-D449 IonicContact CZ-OD1 3.96Å; R444-D449 IonicContact CZ-OD2 2.86Å; R444-D449 VanDerWaalsContact NH1-CG 3.29Å; R444-D449 IonicContact NH1-OD1 3.3Å; R444-D449 PolarHBondContact NH1-OD1 2.99Å; R444-D449 IonicContact NH1-OD2 3.72Å; R444-D449 PolarHBondContact NH1-OD2 3.48Å; R444-D449 VanDerWaalsContact NH1-OD2 3.09Å; R444-D449 IonicContact NH2-OD1 2.73Å; R444-D449 IonicContact NH2-OD2 3.09Å; R444-D449 PolarHBondContact NH2-OD2 2.82Å; R444-D449 PolarHBondContact O-N 3.46Å; R444-D449 VanDerWaalsContact O-N 3.16Å; K445-D449 WeakPolarHBondContact O-CB 3.36Å; K445-D449 PolarHBondContact O-N 2.86Å
450	Q	98.3	Very high	97.3	Very high	99 Å²	99	59.8 Å²	59.8	46%	0.463	29%	0.286	S	S	.	.	S	Bend	trans	-84.4	-14.3	179.5	-62.3	177.4	-12.7	0	0	113.2	K445 L452	K445-Q450 WeakPolarHBondContact O-CG 3.17Å; K445-Q450 PolarHBondContact O-N 3.49Å; Q450-L452 HydrophobicContact CB-CD1 4.1Å; Q450-L452 HydrophobicContact CB-CG 3.84Å; Q450-L452 PolarHBondContact O-N 3.36Å
451	K	98.3	Very high	97.2	Very high	151 Å²	151	61.4 Å²	61.4	66%	0.657	29%	0.293	S	S	*	.			trans	55.2	31.2	179.9	-56.3	-176	-178.4	-175.1	0	113.9	V446 V447 C448	V446-K451 PolarHBondContact O-N 2.73Å; V447-K451 WeakPolarHBondContact O-CA 3.45Å; C448-K451 VanDerWaalsContact O-CG 3.27Å; C448-K451 WeakPolarHBondContact O-CG 3.15Å
452	L	98.5	Very high	97	Very high	68 Å²	68	61 Å²	61	36%	0.356	30%	0.302	S	S	.	.			trans	-77.8	153.5	178.6	-60.5	178.3	0	0	0	111.1	L433 V446 Q450	L433-L452 HydrophobicContact CD1-CB 4.07Å; L433-L452 HydrophobicContact CD1-CD1 4.04Å; L433-L452 HydrophobicContact CD2-CD1 4.04Å; V446-L452 HydrophobicContact CG1-CB 3.99Å; V446-L452 HydrophobicContact CG1-CD1 4.42Å; V446-L452 PolarHBondContact O-N 2.85Å; Q450-L452 HydrophobicContact CB-CD1 4.1Å; Q450-L452 HydrophobicContact CB-CG 3.84Å; Q450-L452 PolarHBondContact O-N 3.36Å
453	R	98.6	Very high	96.8	Very high	54 Å²	54	61 Å²	61	20%	0.204	30%	0.299	C	S	.	.			trans	-136.4	161.5	176.5	-64	-61.1	-178.9	-92.7	1.4	108.8	Y430 V447 N455 W477	Y430-R453 WeakPolarHBondContact OH-CD 3.4Å; V447-R453 PolarHBondContact O-NH1 3.32Å; R453-N455 PolarHBondContact O-N 2.87Å; R453-W477 HydrophobicContact CB-CD2 4.43Å; R453-W477 HydrophobicContact CB-CE3 3.77Å; R453-W477 HydrophobicContact CB-CZ3 4.15Å; R453-W477 HydrophobicContact CG-CB 4.16Å; R453-W477 HydrophobicContact CG-CE3 4.15Å; R453-W477 PolarHBondContact NE-O 2.87Å; R453-W477 PolarHBondContact NH2-O 3.13Å
454	P	98.5	Very high	96.5	Very high	5 Å²	5	64.5 Å²	64.5	3%	0.032	32%	0.316	C	S	.	.			trans	-56.2	135.7	175.5	-23.7	35.1	0	0	0	111.2	L408 W411 P429 Y430 I456 W477	L408-P454 HydrophobicContact CD2-CG 3.68Å; W411-P454 HydrophobicContact CD2-CB 3.66Å; W411-P454 HydrophobicContact CD2-CG 4.48Å; W411-P454 VanDerWaalsContact CE2-CB 3.45Å; W411-P454 HydrophobicContact CE3-CB 4.32Å; W411-P454 HydrophobicContact CG-CB 3.83Å; W411-P454 HydrophobicContact CZ2-CB 3.91Å; P429-P454 HydrophobicContact CB-CG 4.01Å; Y430-P454 HydrophobicContact CD1-CG 4.45Å; Y430-P454 HydrophobicContact CE1-CG 4.16Å; Y430-P454 HydrophobicContact CE2-CG 4.36Å; P454-I456 PolarHBondContact O-N 3.32Å; P454-W477 HydrophobicContact CB-CH2 3.97Å; P454-W477 HydrophobicContact CB-CZ2 4.5Å; P454-W477 HydrophobicContact CG-CH2 4.02Å; P454-W477 HydrophobicContact CG-CZ2 4.12Å
455	N	97.3	Very high	96.4	Very high	111 Å²	111	61.8 Å²	61.8	59%	0.594	31%	0.306	S	S	*	.			trans	-64.6	134.1	-176.3	-176.9	36.6	0	0	0	111.3	W411 R453 P457	W411-N455 PolarHBondContact NE1-O 3.16Å; R453-N455 PolarHBondContact O-N 2.87Å; N455-P457 WeakPolarHBondContact O-CD 3.4Å
456	I	96.8	Very high	96.2	Very high	24 Å²	24	56.2 Å²	56.2	12%	0.123	28%	0.281	C	S	.	.			trans	-97.7	110.1	173.4	-65.9	175.8	0	0	0	107.7	P454 W460 G470 M473 R474 W477	P454-I456 PolarHBondContact O-N 3.32Å; I456-W460 HydrophobicContact CG1-CZ3 4.42Å; I456-W460 HydrophobicContact CG2-CD2 4.35Å; I456-W460 HydrophobicContact CG2-CE3 3.64Å; I456-W460 HydrophobicContact CG2-CZ3 4.06Å; I456-G470 WeakPolarHBondContact CD1-O 3.3Å; I456-M473 HydrophobicContact CD1-CB 4.46Å; I456-R474 HydrophobicContact CD1-CG 3.87Å; I456-W477 HydrophobicContact CD1-CZ3 4.19Å; I456-W477 HydrophobicContact CG1-CZ3 4.31Å
457	P	94.9	Very high	96.1	Very high	15 Å²	15	60.4 Å²	60.4	10%	0.097	30%	0.296	C	S	.	.			trans	-57.1	138.5	-179.1	-23.3	32.4	0	0	0	112.9	E424 N455 W459 W460	E424-P457 WeakPolarHBondContact OE1-CG 3.46Å; N455-P457 WeakPolarHBondContact O-CD 3.4Å; P457-W459 VanDerWaalsContact CB-CD1 3.46Å; P457-W459 HydrophobicContact CB-CG 4.34Å; P457-W459 PolarHBondContact O-N 3.3Å; P457-W460 HydrophobicContact CB-CG 4.38Å; P457-W460 HydrophobicContact CG-CD2 4.35Å; P457-W460 HydrophobicContact CG-CZ2 4.05Å; P457-W460 WeakPolarHBondContact O-CB 2.99Å; P457-W460 PolarHBondContact O-N 2.94Å
458	N	93.6	Very high	96.1	Very high	146 Å²	146	61.8 Å²	61.8	78%	0.781	31%	0.305	S	S	*	.	G	3₁₀ helix	trans	-61.4	-33.2	-178.5	-71.2	-24.3	0	0	0	112.8	W460 Q461	N458-W460 PolarHBondContact O-N 3.44Å; N458-Q461 WeakPolarHBondContact O-CB 3.37Å; N458-Q461 WeakPolarHBondContact O-CG 3.42Å; N458-Q461 PolarHBondContact O-N 3.46Å; N458-Q461 VanDerWaalsContact O-N 3.08Å
459	W	92.6	Very high	96	Very high	63 Å²	63	60.9 Å²	60.9	24%	0.239	30%	0.298	C	S	.	.	G	3₁₀ helix	trans	-66.2	-19.3	-178.6	71.4	-97	0	0	0	113	V422 E424 P457 Q461 S462 Y463 L466	V422-W459 HydrophobicContact CG1-CD2 4.33Å; V422-W459 HydrophobicContact CG1-CE3 4.5Å; V422-W459 HydrophobicContact CG1-CH2 4.49Å; V422-W459 HydrophobicContact CG1-CZ2 4.31Å; E424-W459 VanDerWaalsContact OE1-CE2 3.26Å; E424-W459 VanDerWaalsContact OE1-CZ2 3.3Å; E424-W459 WeakPolarHBondContact OE1-CZ2 3.34Å; E424-W459 PolarHBondContact OE1-NE1 3.48Å; E424-W459 WeakPolarHBondContact OE2-CZ2 3.4Å; P457-W459 VanDerWaalsContact CB-CD1 3.46Å; P457-W459 HydrophobicContact CB-CG 4.34Å; P457-W459 PolarHBondContact O-N 3.3Å; W459-Q461 PolarHBondContact O-N 2.92Å; W459-Q461 VanDerWaalsContact O-N 3.17Å; W459-S462 WeakPolarHBondContact O-CB 3.43Å; W459-S462 PolarHBondContact O-N 2.71Å; W459-S462 VanDerWaalsContact O-N 3.08Å; W459-S462 PolarHBondContact O-OG 3.35Å; W459-Y463 HydrophobicContact CE3-CD2 4.06Å; W459-Y463 AromaticContact CE3-CE2 3.93Å; W459-Y463 HydrophobicContact CE3-CE2 3.93Å; W459-Y463 HydrophobicContact CZ3-CD2 4.02Å; W459-Y463 AromaticContact CZ3-CE2 3.97Å; W459-Y463 HydrophobicContact CZ3-CE2 3.97Å; W459-L466 HydrophobicContact CE3-CD1 4.37Å; W459-L466 HydrophobicContact CH2-CD1 3.83Å; W459-L466 HydrophobicContact CZ3-CD1 3.47Å; W459-L466 VanDerWaalsContact CZ3-CD1 3.47Å
460	W	95	Very high	96	Very high	0 Å²	0	56.7 Å²	56.7	0%	0	28%	0.276	C	S	.	.	G	3₁₀ helix	trans	-60.9	-23.2	172.3	-71.5	10.4	0	0	0	112.6	W411 A414 R415 I456 P457 N458 S462 Y463 L466 R467 M473	W411-W460 AromaticContact CD1-CH2 3.88Å; A414-W460 HydrophobicContact CB-CE3 4.49Å; A414-W460 HydrophobicContact CB-CH2 3.44Å; A414-W460 VanDerWaalsContact CB-CH2 3.44Å; A414-W460 HydrophobicContact CB-CZ2 3.77Å; A414-W460 HydrophobicContact CB-CZ3 3.84Å; R415-W460 HydrophobicContact CG-CH2 4.45Å; R415-W460 HydrophobicContact CG-CZ2 4.01Å; I456-W460 HydrophobicContact CG1-CZ3 4.42Å; I456-W460 HydrophobicContact CG2-CD2 4.35Å; I456-W460 HydrophobicContact CG2-CE3 3.64Å; I456-W460 HydrophobicContact CG2-CZ3 4.06Å; P457-W460 HydrophobicContact CB-CG 4.38Å; P457-W460 HydrophobicContact CG-CD2 4.35Å; P457-W460 HydrophobicContact CG-CZ2 4.05Å; P457-W460 WeakPolarHBondContact O-CB 2.99Å; P457-W460 PolarHBondContact O-N 2.94Å; N458-W460 PolarHBondContact O-N 3.44Å; W460-S462 PolarHBondContact O-N 3.3Å; W460-Y463 PolarHBondContact O-N 3.19Å; W460-Y463 VanDerWaalsContact O-O 3.11Å; W460-L466 HydrophobicContact CB-CB 3.88Å; W460-L466 HydrophobicContact CD2-CD2 4.26Å; W460-L466 HydrophobicContact CG-CB 4.08Å; W460-L466 HydrophobicContact CG-CD1 4.3Å; W460-L466 HydrophobicContact CG-CD2 4.39Å; W460-R467 PolarHBondContact O-N 2.85Å; W460-M473 HydrophobicContact CE3-CE 4.45Å; W460-M473 HydrophobicContact CH2-CE 3.87Å; W460-M473 HydrophobicContact CH2-SD 4.4Å; W460-M473 HydrophobicContact CZ3-CE 3.43Å; W460-M473 VanDerWaalsContact CZ3-CE 3.43Å; W460-M473 HydrophobicContact CZ3-SD 3.85Å
461	Q	94.3	Very high	96	Very high	77 Å²	77	57.5 Å²	57.5	36%	0.36	28%	0.278	S	S	.	.	G	3₁₀ helix	trans	-66.4	-20.7	177.1	-60.4	-51.4	-52.5	0	0	113.2	N458 W459 Y463 R467	N458-Q461 WeakPolarHBondContact O-CB 3.37Å; N458-Q461 WeakPolarHBondContact O-CG 3.42Å; N458-Q461 PolarHBondContact O-N 3.46Å; N458-Q461 VanDerWaalsContact O-N 3.08Å; W459-Q461 PolarHBondContact O-N 2.92Å; W459-Q461 VanDerWaalsContact O-N 3.17Å; Q461-Y463 VanDerWaalsContact C-N 3.3Å; Q461-Y463 PolarHBondContact O-N 2.95Å; Q461-R467 PolarHBondContact O-NH1 2.87Å
462	S	93.7	Very high	96	Very high	98 Å²	98	50.5 Å²	50.5	69%	0.685	25%	0.248	S	C	*	.	G	3₁₀ helix	trans	-75.6	-15.9	179.9	-59	0	0	0	0	113.6	W459 W460	W459-S462 WeakPolarHBondContact O-CB 3.43Å; W459-S462 PolarHBondContact O-N 2.71Å; W459-S462 VanDerWaalsContact O-N 3.08Å; W459-S462 PolarHBondContact O-OG 3.35Å; W460-S462 PolarHBondContact O-N 3.3Å
463	Y	93.3	Very high	96	Very high	77 Å²	77	47.3 Å²	47.3	30%	0.302	23%	0.231	S	C	.	.	S	Bend	trans	-121	125	-179.2	-60.4	-85.1	0	0	0	110.1	S419 W459 W460 Q461 A465 L466 R467	S419-Y463 PolarHBondContact O-OH 3.05Å; W459-Y463 HydrophobicContact CE3-CD2 4.06Å; W459-Y463 AromaticContact CE3-CE2 3.93Å; W459-Y463 HydrophobicContact CE3-CE2 3.93Å; W459-Y463 HydrophobicContact CZ3-CD2 4.02Å; W459-Y463 AromaticContact CZ3-CE2 3.97Å; W459-Y463 HydrophobicContact CZ3-CE2 3.97Å; W460-Y463 PolarHBondContact O-N 3.19Å; W460-Y463 VanDerWaalsContact O-O 3.11Å; Q461-Y463 VanDerWaalsContact C-N 3.3Å; Q461-Y463 PolarHBondContact O-N 2.95Å; Y463-A465 PolarHBondContact O-N 3.21Å; Y463-L466 HydrophobicContact CD2-CD1 4.08Å; Y463-L466 HydrophobicContact CG-CD1 4.33Å; Y463-L466 PolarHBondContact O-N 2.95Å; Y463-R467 WeakPolarHBondContact O-CB 3.36Å; Y463-R467 PolarHBondContact O-N 2.71Å
464	E	93.4	Very high	96	Very high	73 Å²	73	50 Å²	50	34%	0.341	24%	0.241	S	C	.	.	H	α-helix	trans	-53.6	-50.4	-176.6	-176.9	64.2	-121.1	0	0	112.2	L466 R467 V468	E464-L466 VanDerWaalsContact C-N 3.33Å; E464-L466 PolarHBondContact O-N 2.84Å; E464-R467 WeakPolarHBondContact O-CB 3.28Å; E464-R467 PolarHBondContact O-N 2.95Å; E464-R467 VanDerWaalsContact O-N 3.13Å; E464-R467 IonicContact OE1-CZ 2.74Å; E464-R467 IonicContact OE1-NE 2.78Å; E464-R467 IonicContact OE1-NH2 2.79Å; E464-R467 IonicContact OE2-CZ 3.41Å; E464-R467 IonicContact OE2-NE 2.68Å; E464-R467 IonicContact OE2-NH2 3.76Å; E464-R467 PolarHBondContact OE2-NH2 3.47Å; E464-V468 HydrophobicContact CG-CG2 4.39Å; E464-V468 WeakPolarHBondContact O-CG2 3.25Å; E464-V468 PolarHBondContact O-N 3.1Å; E464-V468 WeakPolarHBondContact OE1-CG2 3.18Å
465	A	94.8	Very high	96	Very high	1 Å²	1	52 Å²	52	1%	0.008	25%	0.25	C	S	.	.	H	α-helix	trans	-60.9	-41	-177.1	0	0	0	0	0	112.7	I301 M304 I305 Y463 M469 L497	I301-A465 HydrophobicContact CG2-CB 3.51Å; M304-A465 HydrophobicContact CE-CB 3.86Å; I305-A465 HydrophobicContact CD1-CB 4.31Å; Y463-A465 PolarHBondContact O-N 3.21Å; A465-M469 WeakPolarHBondContact O-CB 3.28Å; A465-M469 PolarHBondContact O-N 2.85Å; A465-L497 HydrophobicContact CB-CD1 4.39Å; A465-L497 HydrophobicContact CB-CD2 4.08Å
466	L	96.2	Very high	96.1	Very high	0 Å²	0	46.8 Å²	46.8	0%	0	22%	0.222	C	C	.	.	H	α-helix	trans	-71.2	-34.6	176.2	-74.1	170.4	0	0	0	112.1	M304 A414 C417 W459 W460 Y463 E464 M469 G470	M304-L466 HydrophobicContact CE-CD2 4.36Å; M304-L466 HydrophobicContact SD-CD2 3.62Å; M304-L466 HydrophobicContact SD-CG 4.47Å; A414-L466 HydrophobicContact CB-CD2 3.99Å; C417-L466 HydrophobicContact CB-CD2 3.98Å; W459-L466 HydrophobicContact CE3-CD1 4.37Å; W459-L466 HydrophobicContact CH2-CD1 3.83Å; W459-L466 HydrophobicContact CZ3-CD1 3.47Å; W459-L466 VanDerWaalsContact CZ3-CD1 3.47Å; W460-L466 HydrophobicContact CB-CB 3.88Å; W460-L466 HydrophobicContact CD2-CD2 4.26Å; W460-L466 HydrophobicContact CG-CB 4.08Å; W460-L466 HydrophobicContact CG-CD1 4.3Å; W460-L466 HydrophobicContact CG-CD2 4.39Å; Y463-L466 HydrophobicContact CD2-CD1 4.08Å; Y463-L466 HydrophobicContact CG-CD1 4.33Å; Y463-L466 PolarHBondContact O-N 2.95Å; E464-L466 VanDerWaalsContact C-N 3.33Å; E464-L466 PolarHBondContact O-N 2.84Å; L466-M469 PolarHBondContact O-N 3.16Å; L466-G470 PolarHBondContact O-N 2.82Å
467	R	96.4	Very high	96.1	Very high	99 Å²	99	46.1 Å²	46.1	37%	0.374	22%	0.218	S	C	.	.	H	α-helix	trans	-64.2	-45.8	173.1	178.8	170.3	65.5	-152.4	18.7	112	W460 Q461 Y463 E464 M469 G470 K471	W460-R467 PolarHBondContact O-N 2.85Å; Q461-R467 PolarHBondContact O-NH1 2.87Å; Y463-R467 WeakPolarHBondContact O-CB 3.36Å; Y463-R467 PolarHBondContact O-N 2.71Å; E464-R467 WeakPolarHBondContact O-CB 3.28Å; E464-R467 PolarHBondContact O-N 2.95Å; E464-R467 VanDerWaalsContact O-N 3.13Å; E464-R467 IonicContact OE1-CZ 2.74Å; E464-R467 IonicContact OE1-NE 2.78Å; E464-R467 IonicContact OE1-NH2 2.79Å; E464-R467 IonicContact OE2-CZ 3.41Å; E464-R467 IonicContact OE2-NE 2.68Å; E464-R467 IonicContact OE2-NH2 3.76Å; E464-R467 PolarHBondContact OE2-NH2 3.47Å; R467-M469 VanDerWaalsContact C-N 3.34Å; R467-G470 PolarHBondContact O-N 3.04Å; R467-K471 PolarHBondContact O-N 2.98Å
468	V	96.9	Very high	96.3	Very high	30 Å²	30	50.8 Å²	50.8	18%	0.182	23%	0.234	C	C	.	.	H	α-helix	trans	-60.1	-46.6	173.9	172.7	0	0	0	0	109.9	E464 G470 K471 M472 T493 L497	E464-V468 HydrophobicContact CG-CG2 4.39Å; E464-V468 WeakPolarHBondContact O-CG2 3.25Å; E464-V468 PolarHBondContact O-N 3.1Å; E464-V468 WeakPolarHBondContact OE1-CG2 3.18Å; V468-G470 PolarHBondContact O-N 2.94Å; V468-K471 PolarHBondContact O-N 3.37Å; V468-M472 WeakPolarHBondContact O-CG 3.42Å; V468-M472 PolarHBondContact O-N 3.08Å; V468-T493 HydrophobicContact CG1-CG2 4.17Å; V468-L497 HydrophobicContact CB-CD2 4.22Å; V468-L497 HydrophobicContact CG1-CD2 4.1Å; V468-L497 HydrophobicContact CG2-CD1 4.38Å
469	M	97.6	Very high	96.5	Very high	0 Å²	0	46.5 Å²	46.5	0%	0	22%	0.22	C	C	.	.	H	α-helix	trans	-59.5	-47.8	177.4	-168	66.4	78.4	0	0	111.9	M304 A308 Y410 A414 A465 L466 R467 K471 M472 M473 L494	M304-M469 HydrophobicContact CE-CE 4.34Å; M304-M469 HydrophobicContact CG-CE 4.1Å; M304-M469 HydrophobicContact SD-CE 4.25Å; A308-M469 HydrophobicContact CB-CE 3.57Å; Y410-M469 HydrophobicContact CD2-SD 3.7Å; Y410-M469 HydrophobicContact CE2-SD 4.37Å; Y410-M469 HydrophobicContact CG-SD 3.8Å; A414-M469 HydrophobicContact CB-CG 4.2Å; A465-M469 WeakPolarHBondContact O-CB 3.28Å; A465-M469 PolarHBondContact O-N 2.85Å; L466-M469 PolarHBondContact O-N 3.16Å; R467-M469 VanDerWaalsContact C-N 3.34Å; M469-K471 VanDerWaalsContact C-N 3.31Å; M469-K471 PolarHBondContact O-N 3.49Å; M469-M472 HydrophobicContact CE-CE 4.3Å; M469-M472 PolarHBondContact O-N 3.23Å; M469-M472 VanDerWaalsContact O-N 3.17Å; M469-M472 HydrophobicContact SD-CE 3.42Å; M469-M472 WeakPolarHBondContact SD-CE 3.39Å; M469-M473 HydrophobicContact CB-CE 4.27Å; M469-M473 HydrophobicContact CG-CE 3.33Å; M469-M473 WeakPolarHBondContact O-CG 3.42Å; M469-M473 PolarHBondContact O-N 3.45Å; M469-M473 HydrophobicContact SD-CE 4.49Å; M469-L494 HydrophobicContact CE-CD2 4.08Å
470	G	97.9	Very high	96.8	Very high	0 Å²	0	48.6 Å²	48.6	0%	0	24%	0.235	C	C	.	.	H	α-helix	trans	-62.2	-34.8	177.4	0	0	0	0	0	113.4	I456 L466 R467 V468 R474	I456-G470 WeakPolarHBondContact CD1-O 3.3Å; L466-G470 PolarHBondContact O-N 2.82Å; R467-G470 PolarHBondContact O-N 3.04Å; V468-G470 PolarHBondContact O-N 2.94Å; G470-R474 WeakPolarHBondContact O-CG 3.34Å; G470-R474 PolarHBondContact O-N 3.23Å
471	K	97.9	Very high	96.9	Very high	116 Å²	116	49.1 Å²	49.1	50%	0.504	24%	0.24	S	C	.	.	H	α-helix	trans	-64.6	-48.6	171.7	-179.2	-179.9	172.4	-178.6	0	111.2	R467 V468 M469 M473 R474 E475	R467-K471 PolarHBondContact O-N 2.98Å; V468-K471 PolarHBondContact O-N 3.37Å; M469-K471 VanDerWaalsContact C-N 3.31Å; M469-K471 PolarHBondContact O-N 3.49Å; K471-M473 VanDerWaalsContact C-N 3.33Å; K471-M473 PolarHBondContact O-N 3.45Å; K471-R474 PolarHBondContact O-N 2.72Å; K471-E475 WeakPolarHBondContact CE-OE1 3.32Å; K471-E475 IonicContact NZ-OE1 3.55Å; K471-E475 PolarHBondContact O-N 2.68Å; K471-E475 VanDerWaalsContact O-N 3.13Å
472	M	97.8	Very high	97	Very high	4 Å²	4	49.6 Å²	49.6	2%	0.02	26%	0.258	C	S	.	.	H	α-helix	trans	-60.3	-41.5	178.3	-68.6	-166.5	-44.6	0	0	112.1	Y410 V468 M469 R474 E475 C476 L485 I490 T493 L494	Y410-M472 HydrophobicContact CD2-CE 4.18Å; Y410-M472 HydrophobicContact CE2-CE 3.97Å; V468-M472 WeakPolarHBondContact O-CG 3.42Å; V468-M472 PolarHBondContact O-N 3.08Å; M469-M472 HydrophobicContact CE-CE 4.3Å; M469-M472 PolarHBondContact O-N 3.23Å; M469-M472 VanDerWaalsContact O-N 3.17Å; M469-M472 HydrophobicContact SD-CE 3.42Å; M469-M472 WeakPolarHBondContact SD-CE 3.39Å; M472-R474 VanDerWaalsContact C-N 3.34Å; M472-R474 PolarHBondContact O-N 3.31Å; M472-E475 CarbonylContact O-C 3.54Å; M472-E475 PolarHBondContact O-N 2.88Å; M472-C476 PolarHBondContact O-N 3.01Å; M472-C476 PolarHBondContact O-SG 3.01Å; M472-L485 HydrophobicContact CB-CD1 4.41Å; M472-L485 HydrophobicContact CG-CD1 4.42Å; M472-I490 HydrophobicContact SD-CG2 4.27Å; M472-T493 HydrophobicContact CG-CG2 4.47Å; M472-T493 HydrophobicContact SD-CG2 3.88Å; M472-L494 HydrophobicContact CE-CD1 4.11Å; M472-L494 HydrophobicContact CE-CD2 3.67Å; M472-L494 HydrophobicContact CE-CG 3.82Å; M472-L494 HydrophobicContact SD-CD2 4.49Å; M472-L494 HydrophobicContact SD-CG 4.2Å
473	M	98.6	Very high	97.2	Very high	0 Å²	0	47.4 Å²	47.4	0%	0	25%	0.245	C	C	.	.	H	α-helix	trans	-56.1	-48.3	176	-69.4	177.3	-152.9	0	0	111.5	Y410 W411 A414 I456 W460 M469 K471 E475 C476 W477	Y410-M473 WeakPolarHBondContact O-CE 3.29Å; W411-M473 HydrophobicContact CB-CE 4.24Å; W411-M473 HydrophobicContact CB-SD 3.7Å; W411-M473 HydrophobicContact CG-SD 4.29Å; A414-M473 HydrophobicContact CB-CE 3.51Å; I456-M473 HydrophobicContact CD1-CB 4.46Å; W460-M473 HydrophobicContact CE3-CE 4.45Å; W460-M473 HydrophobicContact CH2-CE 3.87Å; W460-M473 HydrophobicContact CH2-SD 4.4Å; W460-M473 HydrophobicContact CZ3-CE 3.43Å; W460-M473 VanDerWaalsContact CZ3-CE 3.43Å; W460-M473 HydrophobicContact CZ3-SD 3.85Å; M469-M473 HydrophobicContact CB-CE 4.27Å; M469-M473 HydrophobicContact CG-CE 3.33Å; M469-M473 WeakPolarHBondContact O-CG 3.42Å; M469-M473 PolarHBondContact O-N 3.45Å; M469-M473 HydrophobicContact SD-CE 4.49Å; K471-M473 VanDerWaalsContact C-N 3.33Å; K471-M473 PolarHBondContact O-N 3.45Å; M473-E475 VanDerWaalsContact C-N 3.29Å; M473-E475 PolarHBondContact O-N 2.94Å; M473-C476 WeakPolarHBondContact O-CB 3.41Å; M473-C476 PolarHBondContact O-N 3.29Å; M473-W477 HydrophobicContact CB-CD2 4.31Å; M473-W477 HydrophobicContact CB-CE3 4.2Å; M473-W477 HydrophobicContact CB-CH2 3.82Å; M473-W477 HydrophobicContact CB-CZ2 3.92Å; M473-W477 HydrophobicContact CB-CZ3 3.97Å; M473-W477 HydrophobicContact CG-CH2 4.21Å; M473-W477 HydrophobicContact CG-CZ2 4.17Å; M473-W477 WeakPolarHBondContact O-CB 3.41Å; M473-W477 VanDerWaalsContact O-CD2 3.29Å; M473-W477 PolarHBondContact O-N 3.25Å; M473-W477 HydrophobicContact SD-CH2 3.83Å; M473-W477 HydrophobicContact SD-CZ2 4.2Å
474	R	98.5	Very high	97.5	Very high	111 Å²	111	44.5 Å²	44.5	42%	0.419	23%	0.234	S	C	.	.	H	α-helix	trans	-58.6	-42.1	177.4	-72.4	-175.6	-71	-104	3.3	112.1	I456 G470 K471 M472 C476 W477	I456-R474 HydrophobicContact CD1-CG 3.87Å; G470-R474 WeakPolarHBondContact O-CG 3.34Å; G470-R474 PolarHBondContact O-N 3.23Å; K471-R474 PolarHBondContact O-N 2.72Å; M472-R474 VanDerWaalsContact C-N 3.34Å; M472-R474 PolarHBondContact O-N 3.31Å; R474-C476 VanDerWaalsContact C-N 3.29Å; R474-C476 PolarHBondContact O-N 2.8Å; R474-W477 PolarHBondContact O-N 3.05Å
475	E	98.6	Very high	97.7	Very high	48 Å²	48	42.3 Å²	42.3	22%	0.224	22%	0.224	C	C	.	.	H	α-helix	trans	-72.1	-21.2	177.8	-63.9	173.6	-178	0	0	112.9	K471 M472 M473 Y478 R484 L485	K471-E475 WeakPolarHBondContact CE-OE1 3.32Å; K471-E475 IonicContact NZ-OE1 3.55Å; K471-E475 PolarHBondContact O-N 2.68Å; K471-E475 VanDerWaalsContact O-N 3.13Å; M472-E475 CarbonylContact O-C 3.54Å; M472-E475 PolarHBondContact O-N 2.88Å; M473-E475 VanDerWaalsContact C-N 3.29Å; M473-E475 PolarHBondContact O-N 2.94Å; E475-Y478 HydrophobicContact CB-CE2 4.12Å; E475-Y478 HydrophobicContact CG-CE2 4.18Å; E475-Y478 WeakPolarHBondContact O-CD2 3.15Å; E475-R484 VanDerWaalsContact O-CA 3.3Å; E475-R484 WeakPolarHBondContact O-CA 3.45Å; E475-L485 HydrophobicContact CB-CD1 3.85Å; E475-L485 HydrophobicContact CB-CD2 4.34Å; E475-L485 HydrophobicContact CB-CG 3.76Å; E475-L485 WeakPolarHBondContact OE2-CD1 3.43Å; E475-L485 WeakPolarHBondContact OE2-CD2 3.37Å
476	C	98.8	Very high	97.9	Very high	0 Å²	0	46.3 Å²	46.3	0%	0	25%	0.249	C	C	.	.	H	α-helix	trans	-80.8	-25.2	170.5	-63.6	0	0	0	0	112.7	I403 Y404 M472 M473 R474 R484	I403-C476 HydrophobicContact CG2-CB 3.93Å; Y404-C476 WeakPolarHBondContact CA-O 3.39Å; M472-C476 PolarHBondContact O-N 3.01Å; M472-C476 PolarHBondContact O-SG 3.01Å; M473-C476 WeakPolarHBondContact O-CB 3.41Å; M473-C476 PolarHBondContact O-N 3.29Å; R474-C476 VanDerWaalsContact C-N 3.29Å; R474-C476 PolarHBondContact O-N 2.8Å; C476-R484 WeakPolarHBondContact O-CD 3.19Å; C476-R484 WeakPolarHBondContact O-CG 3.39Å; C476-R484 PolarHBondContact O-NE 2.74Å
477	W	98.5	Very high	98	Very high	11 Å²	11	46.4 Å²	46.4	4%	0.042	25%	0.25	C	C	.	.	S	Bend	trans	-96	5.4	-170.6	-68.1	-20.1	0	0	0	115.5	G407 L408 W411 R453 P454 I456 M473 R474 A479	G407-W477 VanDerWaalsContact O-CZ2 3.3Å; G407-W477 WeakPolarHBondContact O-CZ2 3.5Å; L408-W477 HydrophobicContact CD2-CZ2 3.96Å; L408-W477 VanDerWaalsContact N-NE1 3.18Å; W411-W477 HydrophobicContact CB-CH2 3.89Å; W411-W477 HydrophobicContact CB-CZ2 3.81Å; W411-W477 AromaticContact CD1-CH2 3.87Å; W411-W477 HydrophobicContact CG-CH2 4.07Å; W411-W477 HydrophobicContact CG-CZ2 4.4Å; R453-W477 HydrophobicContact CB-CD2 4.43Å; R453-W477 HydrophobicContact CB-CE3 3.77Å; R453-W477 HydrophobicContact CB-CZ3 4.15Å; R453-W477 HydrophobicContact CG-CB 4.16Å; R453-W477 HydrophobicContact CG-CE3 4.15Å; R453-W477 PolarHBondContact NE-O 2.87Å; R453-W477 PolarHBondContact NH2-O 3.13Å; P454-W477 HydrophobicContact CB-CH2 3.97Å; P454-W477 HydrophobicContact CB-CZ2 4.5Å; P454-W477 HydrophobicContact CG-CH2 4.02Å; P454-W477 HydrophobicContact CG-CZ2 4.12Å; I456-W477 HydrophobicContact CD1-CZ3 4.19Å; I456-W477 HydrophobicContact CG1-CZ3 4.31Å; M473-W477 HydrophobicContact CB-CD2 4.31Å; M473-W477 HydrophobicContact CB-CE3 4.2Å; M473-W477 HydrophobicContact CB-CH2 3.82Å; M473-W477 HydrophobicContact CB-CZ2 3.92Å; M473-W477 HydrophobicContact CB-CZ3 3.97Å; M473-W477 HydrophobicContact CG-CH2 4.21Å; M473-W477 HydrophobicContact CG-CZ2 4.17Å; M473-W477 WeakPolarHBondContact O-CB 3.41Å; M473-W477 VanDerWaalsContact O-CD2 3.29Å; M473-W477 PolarHBondContact O-N 3.25Å; M473-W477 HydrophobicContact SD-CH2 3.83Å; M473-W477 HydrophobicContact SD-CZ2 4.2Å; R474-W477 PolarHBondContact O-N 3.05Å; W477-A479 PolarHBondContact O-N 3.1Å
478	Y	98.6	Very high	98.1	Very high	112 Å²	112	46.1 Å²	46.1	44%	0.439	26%	0.255	S	S	.	.			trans	-52.1	138.8	174.7	-74.1	-54	0	0	0	111.4	E475 N480 A483 R484	E475-Y478 HydrophobicContact CB-CE2 4.12Å; E475-Y478 HydrophobicContact CG-CE2 4.18Å; E475-Y478 WeakPolarHBondContact O-CD2 3.15Å; Y478-N480 VanDerWaalsContact C-N 3.33Å; Y478-A483 HydrophobicContact CD2-CB 3.97Å; Y478-A483 WeakPolarHBondContact CD2-O 3.27Å; Y478-A483 HydrophobicContact CG-CB 4.21Å; Y478-R484 PolarHBondContact O-NE 3.38Å; Y478-R484 PolarHBondContact O-NH2 3.19Å
479	A	97.6	Very high	98.2	Very high	57 Å²	57	51.8 Å²	51.8	47%	0.471	27%	0.273	S	S	.	.	S	Bend	trans	-62.6	-43.5	175.8	0	0	0	0	0	111	W477 G481 R484	W477-A479 PolarHBondContact O-N 3.1Å; A479-G481 PolarHBondContact O-N 3.29Å; A479-R484 PolarHBondContact O-NH2 2.86Å
480	N	97.8	Very high	98.2	Very high	107 Å²	107	51.8 Å²	51.8	57%	0.572	27%	0.273	S	S	*	.	S	Bend	trans	-74.2	112.7	171.6	-177.4	0.2	0	0	0	110.3	Y478 A482 A483	Y478-N480 VanDerWaalsContact C-N 3.33Å; N480-A482 VanDerWaalsContact C-N 3.27Å; N480-A482 PolarHBondContact O-N 3.47Å; N480-A482 PolarHBondContact OD1-N 3.45Å; N480-A482 VanDerWaalsContact OD1-N 3.07Å; N480-A483 HydrophobicContact CB-CB 4.36Å; N480-A483 PolarHBondContact O-N 2.85Å; N480-A483 VanDerWaalsContact O-N 3.15Å
481	G	97.4	Very high	98.2	Very high	10 Å²	10	55 Å²	55	10%	0.103	29%	0.287	C	S	.	.	G	3₁₀ helix	trans	-55.4	-38.7	177.6	0	0	0	0	0	113.7	C400 A479 A483 R484	C400-G481 PolarHBondContact SG-O 3.48Å; A479-G481 PolarHBondContact O-N 3.29Å; G481-A483 PolarHBondContact O-N 3.24Å; G481-R484 VanDerWaalsContact O-CB 3.29Å; G481-R484 WeakPolarHBondContact O-CB 3.21Å; G481-R484 WeakPolarHBondContact O-CG 3.26Å; G481-R484 PolarHBondContact O-N 3.44Å
482	A	97.1	Very high	98.2	Very high	88 Å²	88	55.1 Å²	55.1	73%	0.727	29%	0.288	S	S	*	.	G	3₁₀ helix	trans	-67.4	-17.8	-178.6	0	0	0	0	0	113.9	N480 R484	N480-A482 VanDerWaalsContact C-N 3.27Å; N480-A482 PolarHBondContact O-N 3.47Å; N480-A482 PolarHBondContact OD1-N 3.45Å; N480-A482 VanDerWaalsContact OD1-N 3.07Å; A482-R484 VanDerWaalsContact C-N 3.34Å
483	A	98.1	Very high	98.2	Very high	51 Å²	51	56.5 Å²	56.5	42%	0.421	30%	0.296	S	S	.	.	G	3₁₀ helix	trans	-86.5	-7.2	175.3	0	0	0	0	0	112.9	Y478 N480 G481	Y478-A483 HydrophobicContact CD2-CB 3.97Å; Y478-A483 WeakPolarHBondContact CD2-O 3.27Å; Y478-A483 HydrophobicContact CG-CB 4.21Å; N480-A483 HydrophobicContact CB-CB 4.36Å; N480-A483 PolarHBondContact O-N 2.85Å; N480-A483 VanDerWaalsContact O-N 3.15Å; G481-A483 PolarHBondContact O-N 3.24Å
484	R	98.7	Very high	98.1	Very high	16 Å²	16	56.5 Å²	56.5	6%	0.06	30%	0.296	C	S	.	.	S	Bend	trans	-75.1	154	-178.1	-61.1	177	-170.6	144.4	14.5	111.3	E384 C400 I403 E475 C476 Y478 A479 G481 A482	E384-R484 IonicContact OE1-CZ 3.99Å; E384-R484 IonicContact OE1-NH1 2.76Å; E384-R484 PolarHBondContact OE1-NH1 3.03Å; E384-R484 IonicContact OE1-NH2 3.12Å; E384-R484 PolarHBondContact OE1-NH2 2.78Å; E384-R484 IonicContact OE2-CZ 3.15Å; E384-R484 IonicContact OE2-NH1 2.86Å; E384-R484 IonicContact OE2-NH2 3.45Å; E384-R484 PolarHBondContact OE2-NH2 2.94Å; C400-R484 VanDerWaalsContact C-NH1 3.26Å; C400-R484 WeakPolarHBondContact O-CD 3.27Å; C400-R484 PolarHBondContact O-NH1 2.83Å; I403-R484 HydrophobicContact CG2-CB 4.02Å; E475-R484 VanDerWaalsContact O-CA 3.3Å; E475-R484 WeakPolarHBondContact O-CA 3.45Å; C476-R484 WeakPolarHBondContact O-CD 3.19Å; C476-R484 WeakPolarHBondContact O-CG 3.39Å; C476-R484 PolarHBondContact O-NE 2.74Å; Y478-R484 PolarHBondContact O-NE 3.38Å; Y478-R484 PolarHBondContact O-NH2 3.19Å; A479-R484 PolarHBondContact O-NH2 2.86Å; G481-R484 VanDerWaalsContact O-CB 3.29Å; G481-R484 WeakPolarHBondContact O-CB 3.21Å; G481-R484 WeakPolarHBondContact O-CG 3.26Å; G481-R484 PolarHBondContact O-N 3.44Å; A482-R484 VanDerWaalsContact C-N 3.34Å
485	L	98.5	Very high	98	Very high	28 Å²	28	53.3 Å²	53.3	15%	0.147	29%	0.291	C	S	.	.	P	Polyproline II helix	trans	-61.2	155	171.4	-63.4	176.3	0	0	0	111.4	I403 M472 E475 R489 I490	I403-L485 WeakPolarHBondContact CG1-O 3.16Å; I403-L485 VanDerWaalsContact CG2-O 3.3Å; I403-L485 WeakPolarHBondContact CG2-O 3.28Å; M472-L485 HydrophobicContact CB-CD1 4.41Å; M472-L485 HydrophobicContact CG-CD1 4.42Å; E475-L485 HydrophobicContact CB-CD1 3.85Å; E475-L485 HydrophobicContact CB-CD2 4.34Å; E475-L485 HydrophobicContact CB-CG 3.76Å; E475-L485 WeakPolarHBondContact OE2-CD1 3.43Å; E475-L485 WeakPolarHBondContact OE2-CD2 3.37Å; L485-R489 HydrophobicContact CD2-CG 3.93Å; L485-I490 HydrophobicContact CB-CD1 4.04Å; L485-I490 HydrophobicContact CB-CG1 3.79Å; L485-I490 HydrophobicContact CD1-CD1 4.48Å; L485-I490 HydrophobicContact CD1-CG1 3.81Å; L485-I490 HydrophobicContact CG-CG1 4.48Å
486	T	98.6	Very high	97.8	Very high	85 Å²	85	57 Å²	57	52%	0.521	31%	0.309	S	S	.	.	P	Polyproline II helix	trans	-88.4	154.3	166.1	65.7	0	0	0	0	110.5	L488 R489 I490	T486-L488 PolarHBondContact O-N 3.09Å; T486-R489 WeakPolarHBondContact O-CB 3.38Å; T486-R489 PolarHBondContact O-N 2.73Å; T486-R489 WeakPolarHBondContact OG1-CB 3.22Å; T486-R489 PolarHBondContact OG1-N 3.3Å; T486-I490 WeakPolarHBondContact O-CG1 3.41Å; T486-I490 PolarHBondContact O-N 3Å
487	A	98.5	Very high	97.5	Very high	2 Å²	2	57.2 Å²	57.2	2%	0.017	31%	0.31	C	S	.	.	H	α-helix	trans	-57.5	-36.3	176.8	0	0	0	0	0	111.6	L315 A316 I403 I490 K491	L315-A487 HydrophobicContact CB-CB 4.24Å; L315-A487 HydrophobicContact CD2-CB 4.21Å; L315-A487 HydrophobicContact CG-CB 4.13Å; A316-A487 HydrophobicContact CB-CB 3.86Å; I403-A487 HydrophobicContact CD1-CB 3.85Å; I403-A487 VanDerWaalsContact CD1-N 3.29Å; A487-I490 PolarHBondContact O-N 3.3Å; A487-K491 WeakPolarHBondContact O-CB 3.49Å; A487-K491 PolarHBondContact O-N 2.59Å
488	L	98.1	Very high	97.1	Very high	93 Å²	93	58.3 Å²	58.3	49%	0.487	32%	0.319	S	S	.	.	H	α-helix	trans	-64.9	-39.5	175	-176.3	61.5	0	0	0	112.6	T486 K491 K492	T486-L488 PolarHBondContact O-N 3.09Å; L488-K491 PolarHBondContact O-N 3.01Å; L488-K492 WeakPolarHBondContact O-CG 3.48Å; L488-K492 PolarHBondContact O-N 3.05Å
489	R	98.3	Very high	96.6	Very high	148 Å²	148	57.3 Å²	57.3	56%	0.558	32%	0.324	S	S	*	.	H	α-helix	trans	-66.6	-41	175.9	179.4	59.2	178.9	-171.2	2.1	111.4	L485 T486 K492 T493	L485-R489 HydrophobicContact CD2-CG 3.93Å; T486-R489 WeakPolarHBondContact O-CB 3.38Å; T486-R489 PolarHBondContact O-N 2.73Å; T486-R489 WeakPolarHBondContact OG1-CB 3.22Å; T486-R489 PolarHBondContact OG1-N 3.3Å; R489-K492 PolarHBondContact O-N 3.29Å; R489-T493 PolarHBondContact O-N 3.18Å; R489-T493 VanDerWaalsContact O-N 3.08Å; R489-T493 PolarHBondContact O-OG1 3.12Å
490	I	98.6	Very high	95.9	Very high	0 Å²	0	59.6 Å²	59.6	0%	0	33%	0.325	C	S	.	.	H	α-helix	trans	-61.5	-49.5	174.9	-66.4	169.9	0	0	0	110.2	A312 I403 L406 Y410 M472 L485 T486 A487 K492 T493 L494	A312-I490 HydrophobicContact CB-CG2 3.9Å; I403-I490 HydrophobicContact CD1-CD1 4.05Å; I403-I490 HydrophobicContact CG2-CD1 4.28Å; L406-I490 HydrophobicContact CD2-CD1 4.09Å; Y410-I490 HydrophobicContact CE2-CG2 3.67Å; Y410-I490 WeakPolarHBondContact OH-CG2 3.44Å; M472-I490 HydrophobicContact SD-CG2 4.27Å; L485-I490 HydrophobicContact CB-CD1 4.04Å; L485-I490 HydrophobicContact CB-CG1 3.79Å; L485-I490 HydrophobicContact CD1-CD1 4.48Å; L485-I490 HydrophobicContact CD1-CG1 3.81Å; L485-I490 HydrophobicContact CG-CG1 4.48Å; T486-I490 WeakPolarHBondContact O-CG1 3.41Å; T486-I490 PolarHBondContact O-N 3Å; A487-I490 PolarHBondContact O-N 3.3Å; I490-K492 VanDerWaalsContact C-N 3.35Å; I490-K492 PolarHBondContact O-N 3.04Å; I490-T493 PolarHBondContact O-N 3.15Å; I490-T493 VanDerWaalsContact O-N 3.11Å; I490-L494 HydrophobicContact CG2-CD1 3.89Å; I490-L494 PolarHBondContact O-N 3.01Å
491	K	98.3	Very high	95.1	Very high	67 Å²	67	56.1 Å²	56.1	29%	0.291	31%	0.305	S	S	.	.	H	α-helix	trans	-51.8	-51.7	175.7	179.4	-177.8	-179	172.6	0	111.3	L309 A312 S313 A487 L488 T493 L494 S495	L309-K491 HydrophobicContact CD1-CG 4Å; A312-K491 HydrophobicContact CB-CB 4.3Å; S313-K491 WeakPolarHBondContact OG-CD 3.29Å; S313-K491 VanDerWaalsContact OG-CE 3.29Å; S313-K491 WeakPolarHBondContact OG-CE 3.26Å; A487-K491 WeakPolarHBondContact O-CB 3.49Å; A487-K491 PolarHBondContact O-N 2.59Å; L488-K491 PolarHBondContact O-N 3.01Å; K491-T493 VanDerWaalsContact C-N 3.31Å; K491-T493 PolarHBondContact O-N 3.07Å; K491-L494 PolarHBondContact O-N 3.06Å; K491-S495 PolarHBondContact O-N 2.98Å; K491-S495 PolarHBondContact O-OG 2.9Å; K491-S495 VanDerWaalsContact O-OG 3.05Å
492	K	97.7	Very high	93.9	Very high	120 Å²	120	60 Å²	60	52%	0.522	32%	0.323	S	S	.	.	H	α-helix	trans	-58.1	-42.1	178.8	-74.2	-179.7	178.7	-176.4	0	112.6	L488 R489 I490 S495 Q496	L488-K492 WeakPolarHBondContact O-CG 3.48Å; L488-K492 PolarHBondContact O-N 3.05Å; R489-K492 PolarHBondContact O-N 3.29Å; I490-K492 VanDerWaalsContact C-N 3.35Å; I490-K492 PolarHBondContact O-N 3.04Å; K492-S495 PolarHBondContact O-N 3.25Å; K492-Q496 WeakPolarHBondContact O-CG 3.5Å; K492-Q496 PolarHBondContact O-N 3.39Å; K492-Q496 VanDerWaalsContact O-N 3.12Å
493	T	97.4	Very high	92.2	Very high	32 Å²	32	61.3 Å²	61.3	20%	0.196	32%	0.322	C	S	.	.	H	α-helix	trans	-65.7	-45.2	-179.8	-53	0	0	0	0	111.1	V468 M472 R489 I490 K491 Q496 L497	V468-T493 HydrophobicContact CG1-CG2 4.17Å; M472-T493 HydrophobicContact CG-CG2 4.47Å; M472-T493 HydrophobicContact SD-CG2 3.88Å; R489-T493 PolarHBondContact O-N 3.18Å; R489-T493 VanDerWaalsContact O-N 3.08Å; R489-T493 PolarHBondContact O-OG1 3.12Å; I490-T493 PolarHBondContact O-N 3.15Å; I490-T493 VanDerWaalsContact O-N 3.11Å; K491-T493 VanDerWaalsContact C-N 3.31Å; K491-T493 PolarHBondContact O-N 3.07Å; T493-Q496 PolarHBondContact O-N 3.31Å; T493-L497 PolarHBondContact O-N 3.1Å
494	L	97.1	Very high	90.3	Very high	0 Å²	0	65.1 Å²	65.1	0%	0	33%	0.33	C	S	.	.	H	α-helix	trans	-69.3	-34.9	178	-75.3	170.6	0	0	0	112.9	A308 L309 A312 Y410 M469 M472 I490 K491 Q496 L497 S498	A308-L494 HydrophobicContact CB-CD1 3.79Å; A308-L494 HydrophobicContact CB-CD2 4.32Å; L309-L494 HydrophobicContact CB-CB 4.08Å; L309-L494 HydrophobicContact CB-CD1 4.44Å; L309-L494 HydrophobicContact CD1-CB 3.82Å; L309-L494 HydrophobicContact CG-CB 4.46Å; A312-L494 HydrophobicContact CB-CD1 4.31Å; Y410-L494 HydrophobicContact CE2-CD1 4.42Å; M469-L494 HydrophobicContact CE-CD2 4.08Å; M472-L494 HydrophobicContact CE-CD1 4.11Å; M472-L494 HydrophobicContact CE-CD2 3.67Å; M472-L494 HydrophobicContact CE-CG 3.82Å; M472-L494 HydrophobicContact SD-CD2 4.49Å; M472-L494 HydrophobicContact SD-CG 4.2Å; I490-L494 HydrophobicContact CG2-CD1 3.89Å; I490-L494 PolarHBondContact O-N 3.01Å; K491-L494 PolarHBondContact O-N 3.06Å; L494-Q496 VanDerWaalsContact C-N 3.34Å; L494-L497 HydrophobicContact CD2-CD2 4.41Å; L494-L497 PolarHBondContact O-N 3.19Å; L494-S498 PolarHBondContact O-N 3.42Å
495	S	95.4	Very high	88	Confident	45 Å²	45	72.8 Å²	72.8	32%	0.315	37%	0.37	S	S	.	.	H	α-helix	trans	-62.9	-41.4	173.1	-62.8	0	0	0	0	111.8	L309 K491 K492 L497 S498 V499	L309-S495 WeakPolarHBondContact CD1-OG 3.37Å; K491-S495 PolarHBondContact O-N 2.98Å; K491-S495 PolarHBondContact O-OG 2.9Å; K491-S495 VanDerWaalsContact O-OG 3.05Å; K492-S495 PolarHBondContact O-N 3.25Å; S495-L497 VanDerWaalsContact C-N 3.33Å; S495-S498 PolarHBondContact O-N 2.71Å; S495-V499 WeakPolarHBondContact O-CG2 3.26Å; S495-V499 PolarHBondContact O-N 2.87Å
496	Q	94.3	Very high	87.4	Confident	126 Å²	126	75.1 Å²	75.1	59%	0.589	38%	0.381	S	S	*	.	H	α-helix	trans	-63.6	-41.1	174.9	-72.4	171.9	-9.2	0	0	111.6	K492 T493 L494 V499 Q500	K492-Q496 WeakPolarHBondContact O-CG 3.5Å; K492-Q496 PolarHBondContact O-N 3.39Å; K492-Q496 VanDerWaalsContact O-N 3.12Å; T493-Q496 PolarHBondContact O-N 3.31Å; L494-Q496 VanDerWaalsContact C-N 3.34Å; Q496-V499 PolarHBondContact O-N 3.34Å; Q496-Q500 WeakPolarHBondContact O-CG 3.5Å; Q496-Q500 PolarHBondContact O-N 3.24Å; Q496-Q500 VanDerWaalsContact O-N 3.12Å
497	L	92.9	Very high	86.8	Confident	4 Å²	4	74.5 Å²	74.5	2%	0.021	37%	0.374	C	S	.	.	H	α-helix	trans	-65.1	-40.7	176.9	-174.2	64.1	0	0	0	112	I305 A465 V468 T493 L494 S495 V499 Q500 E501	I305-L497 HydrophobicContact CD1-CD2 3.94Å; I305-L497 HydrophobicContact CD1-CG 3.82Å; I305-L497 HydrophobicContact CG1-CD2 3.96Å; I305-L497 HydrophobicContact CG1-CG 4.33Å; A465-L497 HydrophobicContact CB-CD1 4.39Å; A465-L497 HydrophobicContact CB-CD2 4.08Å; V468-L497 HydrophobicContact CB-CD2 4.22Å; V468-L497 HydrophobicContact CG1-CD2 4.1Å; V468-L497 HydrophobicContact CG2-CD1 4.38Å; T493-L497 PolarHBondContact O-N 3.1Å; L494-L497 HydrophobicContact CD2-CD2 4.41Å; L494-L497 PolarHBondContact O-N 3.19Å; S495-L497 VanDerWaalsContact C-N 3.33Å; L497-V499 PolarHBondContact O-N 3.06Å; L497-Q500 PolarHBondContact O-N 3.42Å; L497-E501 WeakPolarHBondContact O-CG 3.37Å; L497-E501 PolarHBondContact O-N 2.87Å
498	S	90.9	Very high	86.2	Confident	33 Å²	33	78.6 Å²	78.6	23%	0.231	39%	0.393	C	S	.	.	H	α-helix	trans	-57.6	-49.5	175.7	-167.1	0	0	0	0	111.4	L494 S495 Q500 E501 D502	L494-S498 PolarHBondContact O-N 3.42Å; S495-S498 PolarHBondContact O-N 2.71Å; S498-Q500 VanDerWaalsContact C-N 3.28Å; S498-Q500 PolarHBondContact O-N 3.46Å; S498-E501 PolarHBondContact O-N 2.9Å; S498-E501 VanDerWaalsContact O-N 3.17Å; S498-D502 VanDerWaalsContact O-CG 3.3Å; S498-D502 PolarHBondContact O-N 2.66Å
499	V	86.9	Confident	85.5	Confident	92 Å²	92	77.7 Å²	77.7	56%	0.558	39%	0.388	S	S	*	.	H	α-helix	trans	-62.2	-37.2	179.2	174.2	0	0	0	0	111.6	S495 Q496 L497 E501 V503	S495-V499 WeakPolarHBondContact O-CG2 3.26Å; S495-V499 PolarHBondContact O-N 2.87Å; Q496-V499 PolarHBondContact O-N 3.34Å; L497-V499 PolarHBondContact O-N 3.06Å; V499-E501 VanDerWaalsContact C-N 3.35Å; V499-V503 VanDerWaalsContact O-CG2 3.26Å; V499-V503 WeakPolarHBondContact O-CG2 3.43Å; V499-V503 PolarHBondContact O-N 3.46Å
500	Q	82.8	Confident	84.7	Confident	105 Å²	105	73.3 Å²	73.3	49%	0.491	38%	0.377	S	S	.	.	H	α-helix	trans	-67.8	-33.8	177.6	-74.5	175.8	1.1	0	0	113.1	Q496 L497 S498 K504	Q496-Q500 WeakPolarHBondContact O-CG 3.5Å; Q496-Q500 PolarHBondContact O-N 3.24Å; Q496-Q500 VanDerWaalsContact O-N 3.12Å; L497-Q500 PolarHBondContact O-N 3.42Å; S498-Q500 VanDerWaalsContact C-N 3.28Å; S498-Q500 PolarHBondContact O-N 3.46Å; Q500-K504 WeakPolarHBondContact O-CG 3.46Å
501	E	81.3	Confident	83.8	Confident	34 Å²	34	78.2 Å²	78.2	16%	0.159	40%	0.403	C	S	.	.	H	α-helix	trans	-76.5	-37.7	176.7	-67.8	-59.8	124.2	0	0	111.5	I301 I305 L497 S498 V499 V503 K504	I301-E501 HydrophobicContact CG2-CG 4.29Å; I305-E501 HydrophobicContact CD1-CB 4.42Å; I305-E501 HydrophobicContact CD1-CG 3.73Å; L497-E501 WeakPolarHBondContact O-CG 3.37Å; L497-E501 PolarHBondContact O-N 2.87Å; S498-E501 PolarHBondContact O-N 2.9Å; S498-E501 VanDerWaalsContact O-N 3.17Å; V499-E501 VanDerWaalsContact C-N 3.35Å; E501-V503 PolarHBondContact O-N 3.27Å; E501-K504 PolarHBondContact O-N 3.46Å; E501-K504 IonicContact OE1-NZ 3.41Å; E501-K504 PolarHBondContact OE1-NZ 2.96Å
502	D	73.5	Confident	82.7	Confident	90 Å²	90	79 Å²	79	48%	0.481	41%	0.41	S	S	.	.	H	α-helix	trans	-60.6	-30.3	174.9	-66.7	-25.9	0	0	0	112.4	S498 K504	S498-D502 VanDerWaalsContact O-CG 3.3Å; S498-D502 PolarHBondContact O-N 2.66Å; D502-K504 VanDerWaalsContact C-N 3.34Å
503	V	60.3	Low	81.6	Confident	116 Å²	116	75.8 Å²	75.8	70%	0.703	40%	0.402	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.1	-16.4	177.6	172.8	0	0	0	0	112.8	V499 E501	V499-V503 VanDerWaalsContact O-CG2 3.26Å; V499-V503 WeakPolarHBondContact O-CG2 3.43Å; V499-V503 PolarHBondContact O-N 3.46Å; E501-V503 PolarHBondContact O-N 3.27Å
504	K	58.3	Low	80.3	Confident	132 Å²	132	79.5 Å²	79.5	57%	0.574	42%	0.419	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.7	-15.1	-179.4	-70.8	174.2	-169.3	167.1	0	113.7	Q500 E501 D502	Q500-K504 WeakPolarHBondContact O-CG 3.46Å; E501-K504 PolarHBondContact O-N 3.46Å; E501-K504 IonicContact OE1-NZ 3.41Å; E501-K504 PolarHBondContact OE1-NZ 2.96Å; D502-K504 VanDerWaalsContact C-N 3.34Å
505	I	49.4	Very low	78.7	Confident	177 Å²	177	86.7 Å²	86.7	91%	0.908	46%	0.457	S	S	*	.			trans	-85.5	0	173.6	-58.4	172.2	0	0	0	108.1

Retrieved 505 of 505 residues in 2481.9 ms (Link to these results)

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