A0A096NUB7_PAPAN Loading...

Protein smoothened

G protein-coupled receptor which associates with the patched protein (PTCH) to transduce hedgehog protein signaling. Binding of sonic hedgehog (SHH) to its receptor patched prevents inhibition of smoothened (SMO) by patched. When active, SMO binds to and sequesters protein kinase A catalytic subunit PRKACA at the cell membrane, preventing PRKACA-mediated phosphorylation of GLI transcription factors which releases the GLI proteins from PRKACA-mediated inhibition and allows for transcriptional activation of hedgehog pathway target genes. Required for the accumulation of KIF7, GLI2 and GLI3 in the cilia. Interacts with DLG5 at the ciliary base to induce the accumulation of KIF7 and GLI2 at the ciliary tip for GLI2 activation.

AlphaFold DB , UniProt , Accession A0A096NUB7, Species PAPAN (Papio anubis, Olive baboon), Gene SMO, Length 786 aa.

Structure Viewer

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

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	30.2	Very low	28.2	Very low	238 Å²	238	149 Å²	149	100%	1.172	87%	0.868	S	S	*	*				0	95.1	0	-54.7	176	-171.5	0	0	105.5
2	A	28.2	Very low	28.2	Very low	96 Å²	96	149.6 Å²	149.6	79%	0.793	86%	0.864	S	S	*	*				66.1	99.6	82.6	0	0	0	0	0	110.6
3	A	27.5	Very low	29	Very low	105 Å²	105	147.5 Å²	147.5	87%	0.868	86%	0.858	S	S	*	*				82.3	145.6	76.6	0	0	0	0	0	112
4	A	27.2	Very low	29.4	Very low	98 Å²	98	147.9 Å²	147.9	81%	0.81	85%	0.854	S	S	*	*			cis	-151.2	169.7	12.5	0	0	0	0	0	113
5	R	28.6	Very low	29.8	Very low	241 Å²	241	148.3 Å²	148.3	91%	0.909	85%	0.851	S	S	*	*	P	Polyproline II helix	trans	-87.4	150.6	162.4	-66.8	173.8	172.2	168.9	-4.2	110.4
6	P	29.2	Very low	30.1	Very low	130 Å²	130	141.9 Å²	141.9	84%	0.844	83%	0.828	S	S	*	*	P	Polyproline II helix	trans	-83.2	142.8	157.9	33.3	-30.2	0	0	0	111
7	A	26.9	Very low	30.4	Very low	102 Å²	102	142.2 Å²	142.2	84%	0.843	82%	0.824	S	S	*	*	P	Polyproline II helix	trans	-97	149.3	179.3	0	0	0	0	0	112
8	R	26.1	Very low	30.6	Very low	251 Å²	251	143.3 Å²	143.3	95%	0.947	83%	0.826	S	S	*	*	P	Polyproline II helix	trans	-79.2	128.7	167.3	-79.2	178.9	169.9	160.2	-4.4	110
9	G	24.3	Very low	30.9	Very low	64 Å²	64	143.6 Å²	143.6	66%	0.66	82%	0.823	S	S	*	*	P	Polyproline II helix	trans	-88.6	167.1	162.1	0	0	0	0	0	111.7
10	P	32.3	Very low	31.2	Very low	128 Å²	128	143.4 Å²	143.4	83%	0.831	82%	0.818	S	S	*	*	P	Polyproline II helix	trans	-84.6	137.6	-173.1	33.2	-33.9	0	0	0	112.9
11	E	29.2	Very low	31.4	Very low	186 Å²	186	143.9 Å²	143.9	87%	0.869	82%	0.818	S	S	*	*	P	Polyproline II helix	trans	-84.5	150.3	170.6	-62.6	-153.9	147.6	0	0	112.3
12	L	29.2	Very low	31.7	Very low	156 Å²	156	141 Å²	141	82%	0.817	81%	0.806	S	S	*	*	P	Polyproline II helix	trans	-77.9	124.8	177.6	-79.3	76.1	0	0	0	110.9	L14	L12-L14 PolarHBondContact O-N 3.19Å; L12-L14 VanDerWaalsContact O-N 3.09Å
13	P	38.2	Very low	31.8	Very low	122 Å²	122	140.2 Å²	140.2	79%	0.792	81%	0.807	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85.8	79.3	174.8	34.7	-33.2	0	0	0	110.6
14	L	34.2	Very low	31.9	Very low	154 Å²	154	138.6 Å²	138.6	81%	0.806	80%	0.801	S	S	*	*	T	Hydrogen-bonded Turn	trans	-121.4	-18.8	172	-133	82.8	0	0	0	115.1	L12	L12-L14 PolarHBondContact O-N 3.19Å; L12-L14 VanDerWaalsContact O-N 3.09Å
15	L	35.8	Very low	32.3	Very low	154 Å²	154	140.2 Å²	140.2	81%	0.806	80%	0.803	S	S	*	*	S	Bend	trans	-88.6	-24.3	172.6	-103.6	76.7	0	0	0	113.7	L17	L15-L17 VanDerWaalsContact C-N 3.33Å; L15-L17 PolarHBondContact O-N 3.43Å
16	G	34.8	Very low	32.3	Very low	46 Å²	46	134.4 Å²	134.4	47%	0.474	80%	0.799	S	S	.	*	T	Hydrogen-bonded Turn	trans	-70.9	-21	-171.5	0	0	0	0	0	115.5
17	L	35.4	Very low	32.4	Very low	146 Å²	146	140.1 Å²	140.1	76%	0.764	80%	0.804	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.7	-18.6	-173.2	-132.9	76.2	0	0	0	114.1	L15	L15-L17 VanDerWaalsContact C-N 3.33Å; L15-L17 PolarHBondContact O-N 3.43Å
18	L	33.3	Very low	32.5	Very low	163 Å²	163	139 Å²	139	85%	0.853	80%	0.802	S	S	*	*	S	Bend	trans	-85.1	-18.9	-177.8	-137.5	79	0	0	0	113.4
19	L	36.5	Very low	32.7	Very low	149 Å²	149	132.2 Å²	132.2	78%	0.78	80%	0.8	S	S	*	*	S	Bend	trans	-92.2	-4.4	-178.4	-82.6	159.1	0	0	0	114.1
20	L	36.3	Very low	33	Very low	138 Å²	138	135.1 Å²	135.1	72%	0.723	81%	0.81	S	S	*	*	S	Bend	trans	-92.2	0.6	-174.2	-85	164.7	0	0	0	115.2
21	L	35	Very low	32.8	Very low	155 Å²	155	135.1 Å²	135.1	81%	0.812	81%	0.813	S	S	*	*	S	Bend	trans	-104.9	1.9	-175.6	-77.1	170.2	0	0	0	115.8
22	L	36.9	Very low	32.9	Very low	178 Å²	178	131.8 Å²	131.8	93%	0.932	81%	0.811	S	S	*	*	S	Bend	trans	-133.5	12.2	-177.6	-69.8	174.8	0	0	0	115.3
23	G	30.6	Very low	32.9	Very low	78 Å²	78	128.2 Å²	128.2	80%	0.804	81%	0.811	S	S	*	*			trans	-104.8	91.1	-176.2	0	0	0	0	0	115
24	G	30.1	Very low	32.7	Very low	72 Å²	72	130.6 Å²	130.6	74%	0.742	82%	0.817	S	S	*	*			trans	-108.5	138	167.6	0	0	0	0	0	111.8
25	P	35.5	Very low	32.4	Very low	131 Å²	131	127.4 Å²	127.4	85%	0.851	81%	0.813	S	S	*	*			trans	-97.9	134.2	-164.4	35.5	-34	0	0	0	115.1
26	S	28.5	Very low	32.2	Very low	119 Å²	119	126.9 Å²	126.9	83%	0.832	82%	0.816	S	S	*	*			trans	-106.3	115.9	162.4	55.5	0	0	0	0	110.6
27	R	32.5	Very low	31.8	Very low	251 Å²	251	128.2 Å²	128.2	95%	0.947	83%	0.83	S	S	*	*			trans	-71.6	130.6	179.6	-73.3	174.5	168.1	171.5	-5.1	111.5
28	G	28.6	Very low	32	Very low	78 Å²	78	127.8 Å²	127.8	80%	0.804	84%	0.836	S	S	*	*			trans	-83.9	147.3	161	0	0	0	0	0	111.4
29	A	29	Very low	31.7	Very low	109 Å²	109	123.3 Å²	123.3	90%	0.901	83%	0.829	S	S	*	*			trans	-136.8	121.6	167.1	0	0	0	0	0	109
30	S	30.6	Very low	31.8	Very low	124 Å²	124	122.9 Å²	122.9	87%	0.867	84%	0.835	S	S	*	*			trans	-104.3	137.9	175.9	51.7	0	0	0	0	110.1
31	S	28.1	Very low	31.5	Very low	128 Å²	128	128 Å²	128	90%	0.895	85%	0.845	S	S	*	*			trans	-151.7	141.8	161.4	-172.3	0	0	0	0	110.5
32	S	32.8	Very low	31.4	Very low	117 Å²	117	126.3 Å²	126.3	82%	0.818	85%	0.846	S	S	*	*			trans	-125.7	140.5	-177.6	49.3	0	0	0	0	109.4
33	G	29.5	Very low	31	Very low	80 Å²	80	122.6 Å²	122.6	83%	0.825	84%	0.841	S	S	*	*			trans	-163.8	123.8	177.4	0	0	0	0	0	113.5
34	N	32.3	Very low	31	Very low	173 Å²	173	123.1 Å²	123.1	93%	0.925	85%	0.846	S	S	*	*			trans	-82	151.5	171	-95.9	-22	0	0	0	111.3
35	A	28.6	Very low	31	Very low	87 Å²	87	123.6 Å²	123.6	72%	0.719	85%	0.851	S	S	*	*			trans	174.3	122.5	130.5	0	0	0	0	0	114.7
36	T	31.2	Very low	30.9	Very low	142 Å²	142	123.3 Å²	123.3	87%	0.871	85%	0.852	S	S	*	*			trans	38	139.2	138.6	56.9	0	0	0	0	123.9
37	G	26.5	Very low	31.1	Very low	74 Å²	74	122 Å²	122	76%	0.763	85%	0.849	S	S	*	*			trans	-77.7	-149.8	177.3	0	0	0	0	0	116.3
38	P	39.6	Very low	31.3	Very low	138 Å²	138	121.9 Å²	121.9	90%	0.896	85%	0.848	S	S	*	*			cis	-126.8	-173.1	18.3	40.5	-22.5	0	0	0	115.5
39	G	28.1	Very low	31.6	Very low	68 Å²	68	129.7 Å²	129.7	70%	0.701	85%	0.853	S	S	*	*			trans	-90.3	-168.3	-175.7	0	0	0	0	0	116.6
40	P	38.2	Very low	31.8	Very low	140 Å²	140	130.1 Å²	130.1	91%	0.909	85%	0.85	S	S	*	*				-141.4	-175.5	121.1	38.8	-25	0	0	0	115.5
41	R	30.3	Very low	31.9	Very low	247 Å²	247	128.9 Å²	128.9	93%	0.932	85%	0.847	S	S	*	*			trans	-96.6	149.2	-162.3	-59.5	162.2	168	167.4	-6.3	115
42	S	31.1	Very low	32.3	Very low	118 Å²	118	126.7 Å²	126.7	83%	0.825	84%	0.837	S	S	*	*			trans	-156	148.9	134.4	64.7	0	0	0	0	107.8
43	A	29.9	Very low	32.7	Very low	101 Å²	101	128.2 Å²	128.2	84%	0.835	84%	0.841	S	S	*	*			cis	134.1	107.5	-7.1	0	0	0	0	0	109.5
44	G	29.7	Very low	33.3	Very low	89 Å²	89	130.4 Å²	130.4	92%	0.918	84%	0.838	S	S	*	*			trans	103.4	135.9	158.7	0	0	0	0	0	117.5
45	G	29.8	Very low	33.8	Very low	81 Å²	81	124.7 Å²	124.7	84%	0.835	82%	0.82	S	S	*	*			trans	130.9	50	162.3	0	0	0	0	0	118	A47	G45-A47 PolarHBondContact O-N 3.43Å
46	S	33.8	Very low	34.8	Very low	126 Å²	126	126.4 Å²	126.4	88%	0.881	82%	0.824	S	S	*	*			trans	-79.4	117.9	169.3	-174.5	0	0	0	0	110.9
47	A	32.1	Very low	36.2	Very low	91 Å²	91	124.7 Å²	124.7	75%	0.752	82%	0.815	S	S	*	*			trans	-135	100.1	171	0	0	0	0	0	110.3	G45 R49	G45-A47 PolarHBondContact O-N 3.43Å; A47-R49 PolarHBondContact O-N 3.23Å; A47-R49 VanDerWaalsContact O-N 3.17Å
48	R	36.4	Very low	38.1	Very low	248 Å²	248	126.6 Å²	126.6	94%	0.936	81%	0.814	S	S	*	*			trans	-61	113.9	168.7	-80.7	175.4	165.1	170.8	-6	109.2
49	R	35.5	Very low	39.3	Very low	242 Å²	242	124.6 Å²	124.6	91%	0.913	80%	0.801	S	S	*	*			trans	-98.2	116.1	155.5	-84.7	-173.9	172	-178.1	-2	108.6	A47 A51	A47-R49 PolarHBondContact O-N 3.23Å; A47-R49 VanDerWaalsContact O-N 3.17Å; R49-A51 PolarHBondContact O-N 3.13Å
50	S	32.7	Very low	41.4	Very low	119 Å²	119	125.7 Å²	125.7	83%	0.832	79%	0.79	S	S	*	*			trans	-58.9	125.1	171.4	-52.1	0	0	0	0	109.4	A52	S50-A52 PolarHBondContact O-N 3.49Å; S50-A52 VanDerWaalsContact O-N 3.14Å
51	A	34.6	Very low	43.1	Very low	97 Å²	97	124 Å²	124	80%	0.802	78%	0.782	S	S	*	*			trans	-69.6	108.3	170.3	0	0	0	0	0	108.5	R49 V53	R49-A51 PolarHBondContact O-N 3.13Å; A51-V53 PolarHBondContact O-N 3.3Å
52	A	34.8	Very low	45.7	Very low	83 Å²	83	117 Å²	117	69%	0.686	76%	0.759	S	S	*	*			trans	-66.7	128	165.9	0	0	0	0	0	108.2	S50 T54	S50-A52 PolarHBondContact O-N 3.49Å; S50-A52 VanDerWaalsContact O-N 3.14Å; A52-T54 VanDerWaalsContact C-N 3.29Å; A52-T54 PolarHBondContact O-N 3.48Å
53	V	42.6	Very low	48.4	Very low	148 Å²	148	112 Å²	112	90%	0.897	73%	0.725	S	S	*	*			trans	-71	90.7	170.4	178.4	0	0	0	0	107.4	A51 G55	A51-V53 PolarHBondContact O-N 3.3Å; V53-G55 PolarHBondContact O-N 2.95Å
54	T	41.7	Very low	51.1	Low	127 Å²	127	107.9 Å²	107.9	78%	0.779	69%	0.692	S	S	*	*			trans	-71.9	113.3	166.1	49.5	0	0	0	0	108	A52	A52-T54 VanDerWaalsContact C-N 3.29Å; A52-T54 PolarHBondContact O-N 3.48Å
55	G	41.6	Very low	54.1	Low	52 Å²	52	107.8 Å²	107.8	54%	0.536	66%	0.664	S	S	.	*	P	Polyproline II helix	trans	-58.5	166	163.4	0	0	0	0	0	111.2	V53	V53-G55 PolarHBondContact O-N 2.95Å
56	P	50.5	Low	57.1	Low	124 Å²	124	108 Å²	108	81%	0.805	66%	0.658	S	S	*	*	P	Polyproline II helix	trans	-55.3	142.4	178	24	-33.5	0	0	0	110.9
57	P	60.2	Low	59.9	Low	106 Å²	106	102.4 Å²	102.4	69%	0.688	62%	0.619	S	S	*	*	P	Polyproline II helix	trans	-61	147.9	179.5	26.5	-34.6	0	0	0	110.8
58	P	65.9	Low	62.8	Low	114 Å²	114	102.8 Å²	102.8	74%	0.74	61%	0.614	S	S	*	*	P	Polyproline II helix	trans	-61.4	139.7	-179.2	25.3	-34	0	0	0	111.1	L60	P58-L60 PolarHBondContact O-N 3.08Å
59	P	64.9	Low	65.5	Low	95 Å²	95	92.8 Å²	92.8	62%	0.617	58%	0.582	S	S	*	*			trans	-67	106.9	-173.1	25.3	-34.1	0	0	0	111.8	S61 R137	P59-S61 PolarHBondContact O-N 3.38Å; P59-R137 PolarHBondContact O-NH1 3.43Å; P59-R137 PolarHBondContact O-NH2 3.36Å; P59-R137 VanDerWaalsContact O-NH2 3.09Å
60	L	73.4	Confident	68.4	Low	92 Å²	92	85.1 Å²	85.1	48%	0.482	56%	0.556	S	S	.	*			trans	-41.1	129.4	178	-71.6	167.8	0	0	0	111.5	P58 H62 C63 R137	P58-L60 PolarHBondContact O-N 3.08Å; L60-H62 PolarHBondContact O-N 3.28Å; L60-H62 VanDerWaalsContact O-N 3.09Å; L60-C63 HydrophobicContact CB-CB 4.22Å; L60-C63 WeakPolarHBondContact O-CB 3.43Å; L60-C63 PolarHBondContact O-N 2.95Å; L60-R137 PolarHBondContact O-NH2 3.01Å
61	S	73.5	Confident	71.3	Confident	104 Å²	104	84.3 Å²	84.3	73%	0.727	55%	0.548	S	S	*	.	G	3₁₀ helix	trans	-55.7	-32.9	-170.9	51.3	0	0	0	0	114.2	P59	P59-S61 PolarHBondContact O-N 3.38Å
62	H	85.3	Confident	74.2	Confident	99 Å²	99	81.2 Å²	81.2	46%	0.458	52%	0.518	S	S	.	.	G	3₁₀ helix	trans	-80.8	-11.7	178	60.3	-97.3	0	0	0	114.5	L60 G64	L60-H62 PolarHBondContact O-N 3.28Å; L60-H62 VanDerWaalsContact O-N 3.09Å; H62-G64 VanDerWaalsContact C-N 3.32Å; H62-G64 PolarHBondContact O-N 3.46Å
63	C	86.9	Confident	77.1	Confident	15 Å²	15	85 Å²	85	10%	0.101	51%	0.514	C	S	.	.	G	3₁₀ helix	trans	-89.1	11.1	-179.7	-65.4	0	0	0	0	113.9	L60 L140 C177	L60-C63 HydrophobicContact CB-CB 4.22Å; L60-C63 WeakPolarHBondContact O-CB 3.43Å; L60-C63 PolarHBondContact O-N 2.95Å; C63-L140 PolarHBondContact O-N 3.14Å; C63-C177 WeakPolarHBondContact CA-SG 3.23Å; C63-C177 HydrophobicContact CB-CB 3.71Å; C63-C177 WeakPolarHBondContact CB-SG 3.49Å; C63-C177 WeakPolarHBondContact SG-CA 3.33Å; C63-C177 WeakPolarHBondContact SG-CB 3.22Å; C63-C177 CovalentContact SG-SG 2.03Å; C63-C177 PolarHBondContact SG-SG 2.85Å
64	G	88.2	Confident	79.5	Confident	14 Å²	14	81.6 Å²	81.6	14%	0.144	49%	0.486	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-156.8	159.3	174.9	0	0	0	0	0	112.3	H62 V138	H62-G64 VanDerWaalsContact C-N 3.32Å; H62-G64 PolarHBondContact O-N 3.46Å; G64-V138 CarbonylContact C-O 3.5Å; G64-V138 WeakPolarHBondContact CA-O 3.34Å
65	R	91.4	Very high	81.9	Confident	86 Å²	86	81 Å²	81	33%	0.325	48%	0.478	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	144.7	-176	-166.6	176.5	-67	163	-1.3	109.6	A67 L90 R137 V138 D171	R65-A67 PolarHBondContact O-N 2.98Å; R65-L90 HydrophobicContact CG-CD2 4.11Å; R65-R137 CarbonylContact O-C 3.54Å; R65-R137 WeakPolarHBondContact O-CA 3.34Å; R65-V138 HydrophobicContact CB-CG1 4Å; R65-V138 PolarHBondContact N-O 2.97Å; R65-V138 PolarHBondContact O-N 3.46Å; R65-D171 PolarHBondContact NH2-O 3.07Å
66	A	92.6	Very high	84.3	Confident	87 Å²	87	81.2 Å²	81.2	72%	0.719	47%	0.469	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-67.4	126.9	173.9	0	0	0	0	0	109.6	D136	A66-D136 WeakPolarHBondContact CA-O 3.46Å
67	A	92.8	Very high	86.3	Confident	7 Å²	7	75.4 Å²	75.4	6%	0.058	43%	0.431	C	S	.	.			trans	-159.7	139.6	-177.1	0	0	0	0	0	109.7	R65 C69 S88 L90 D136 V138	R65-A67 PolarHBondContact O-N 2.98Å; A67-C69 PolarHBondContact O-N 3.02Å; A67-S88 WeakPolarHBondContact CB-OG 3.49Å; A67-L90 HydrophobicContact CB-CB 4.27Å; A67-L90 HydrophobicContact CB-CD2 3.59Å; A67-D136 PolarHBondContact N-O 3.48Å; A67-D136 CarbonylContact O-C 3.53Å; A67-D136 WeakPolarHBondContact O-CA 3.35Å; A67-V138 HydrophobicContact CB-CB 4.18Å; A67-V138 HydrophobicContact CB-CG1 3.83Å
68	P	93	Very high	87.7	Confident	99 Å²	99	71.9 Å²	71.9	64%	0.643	41%	0.406	S	S	*	.			trans	-62.5	132	173.5	27.7	-33.8	0	0	0	109.7	S88	P68-S88 PolarHBondContact O-OG 3.5Å
69	C	94.5	Very high	88.8	Confident	39 Å²	39	69.1 Å²	69.1	26%	0.264	40%	0.399	S	S	.	.			trans	-90.1	127.5	177.3	-61.3	0	0	0	0	111.5	A67 A86 C133 E134 D136	A67-C69 PolarHBondContact O-N 3.02Å; C69-A86 HydrophobicContact CB-CB 4.4Å; C69-C133 WeakPolarHBondContact CA-SG 3.36Å; C69-C133 HydrophobicContact CB-CB 3.75Å; C69-C133 WeakPolarHBondContact CB-SG 3.38Å; C69-C133 WeakPolarHBondContact SG-CB 3.23Å; C69-C133 CovalentContact SG-SG 2.04Å; C69-C133 PolarHBondContact SG-SG 3.48Å; C69-E134 PolarHBondContact SG-N 2.9Å; C69-E134 VanDerWaalsContact SG-N 3.43Å; C69-D136 PolarHBondContact N-OD1 2.95Å
70	E	94.7	Very high	90	Very high	81 Å²	81	65.1 Å²	65.1	38%	0.379	37%	0.373	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107	146.3	174.6	-62.4	-169.8	161	0	0	111.3	A86 T87 Q98	E70-A86 CarbonylContact O-C 3.59Å; E70-A86 WeakPolarHBondContact O-CA 3.21Å; E70-A86 WeakPolarHBondContact O-CB 3.34Å; E70-T87 PolarHBondContact N-O 2.8Å; E70-T87 PolarHBondContact O-N 2.81Å; E70-Q98 PolarHBondContact OE2-NE2 3.32Å
71	P	95.2	Very high	90.9	Very high	101 Å²	101	65.8 Å²	65.8	66%	0.656	38%	0.38	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-64.2	140.8	171.3	28.5	-34.4	0	0	0	110.9	R73 Q98	P71-R73 PolarHBondContact O-N 3.04Å; P71-Q98 PolarHBondContact O-NE2 2.99Å; P71-Q98 PolarHBondContact O-OE1 3.29Å
72	L	95.1	Very high	91.9	Very high	32 Å²	32	61.5 Å²	61.5	17%	0.168	35%	0.349	C	S	.	.			trans	-66.6	119.6	178.3	-85.4	164.9	0	0	0	111.5	L82 Y84 G85 T87 M130	L72-L82 HydrophobicContact CD1-CB 4.43Å; L72-L82 HydrophobicContact CD1-CD1 3.89Å; L72-L82 HydrophobicContact CD2-CD1 4.06Å; L72-Y84 HydrophobicContact CD1-CD2 3.82Å; L72-Y84 HydrophobicContact CD1-CE2 4.12Å; L72-Y84 VanDerWaalsContact CD1-O 3.23Å; L72-Y84 WeakPolarHBondContact CD1-O 3.3Å; L72-G85 PolarHBondContact N-O 3.49Å; L72-T87 HydrophobicContact CD2-CG2 3.58Å; L72-T87 HydrophobicContact CG-CG2 3.99Å; L72-M130 HydrophobicContact CD2-CE 3.7Å
73	R	94.6	Very high	92.2	Very high	163 Å²	163	61.1 Å²	61.1	62%	0.615	36%	0.356	S	S	*	.	S	Bend	trans	-76.2	-28.8	169.6	-63.6	-177.1	-175.2	-174.6	5.5	112.5	P71 E99	P71-R73 PolarHBondContact O-N 3.04Å; R73-E99 WeakPolarHBondContact CD-OE1 3.43Å; R73-E99 IonicContact CZ-OE1 3.01Å; R73-E99 IonicContact CZ-OE2 3.71Å; R73-E99 IonicContact NE-OE1 3.71Å; R73-E99 IonicContact NH1-OE1 2.76Å; R73-E99 PolarHBondContact NH1-OE1 3.4Å; R73-E99 IonicContact NH1-OE2 2.75Å; R73-E99 PolarHBondContact NH1-OE2 3.13Å; R73-E99 VanDerWaalsContact NH1-OE2 3.07Å
74	Y	93.7	Very high	92.5	Very high	77 Å²	77	62 Å²	62	30%	0.302	36%	0.357	S	S	.	.			trans	-118.9	118.8	178.5	-54.4	-79.5	0	0	0	109.4	V76 H102 M130	Y74-V76 VanDerWaalsContact C-N 3.31Å; Y74-H102 HydrophobicContact CD2-CB 4.06Å; Y74-H102 HydrophobicContact CE2-CB 3.76Å; Y74-M130 WeakPolarHBondContact O-CE 3.39Å
75	N	91.5	Very high	92.7	Very high	114 Å²	114	64 Å²	64	61%	0.61	38%	0.379	S	S	*	.	S	Bend	trans	-87.1	2.1	-178.9	66.7	-12.2	0	0	0	114.1	L82	N75-L82 PolarHBondContact O-N 3.25Å
76	V	92.7	Very high	92.9	Very high	57 Å²	57	61.2 Å²	61.2	35%	0.345	37%	0.373	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.5	133.4	-177.1	71.1	0	0	0	0	109.7	Y74 S80	Y74-V76 VanDerWaalsContact C-N 3.31Å; V76-S80 CarbonylContact C-O 3.56Å; V76-S80 WeakPolarHBondContact CA-O 3.42Å; V76-S80 WeakPolarHBondContact CG2-O 3.48Å
77	C	92.4	Very high	93	Very high	1 Å²	1	57.2 Å²	57.2	1%	0.007	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	120.3	170.8	-175.2	0	0	0	0	109.7	G79 S80 L82 C126 M130	C77-G79 PolarHBondContact O-N 2.96Å; C77-S80 PolarHBondContact N-O 3.2Å; C77-S80 PolarHBondContact O-N 3.1Å; C77-L82 HydrophobicContact CB-CD1 4.37Å; C77-L82 HydrophobicContact CB-CD2 3.76Å; C77-L82 HydrophobicContact CB-CG 4.26Å; C77-C126 HydrophobicContact CB-CB 3.94Å; C77-C126 WeakPolarHBondContact CB-SG 3.36Å; C77-C126 WeakPolarHBondContact SG-CA 3.44Å; C77-C126 WeakPolarHBondContact SG-CB 3.26Å; C77-C126 CovalentContact SG-SG 2.04Å; C77-C126 PolarHBondContact SG-SG 3.28Å; C77-M130 HydrophobicContact CB-SD 3.77Å
78	L	90.6	Very high	93.1	Very high	32 Å²	32	57.1 Å²	57.1	17%	0.168	34%	0.339	C	S	.	.	T	Hydrogen-bonded Turn	trans	49.2	32.3	177.2	-57.2	-179.3	0	0	0	115.1	L105 W118 Q122 L125	L78-L105 HydrophobicContact CD1-CD2 4.21Å; L78-L105 HydrophobicContact CD2-CB 4.14Å; L78-L105 HydrophobicContact CD2-CD2 4.15Å; L78-L105 HydrophobicContact CG-CD2 4.19Å; L78-W118 HydrophobicContact CD1-CH2 3.93Å; L78-W118 HydrophobicContact CD2-CH2 4.06Å; L78-W118 HydrophobicContact CG-CH2 4.4Å; L78-Q122 HydrophobicContact CB-CG 4.48Å; L78-Q122 HydrophobicContact CD1-CB 4.25Å; L78-Q122 HydrophobicContact CD1-CG 4.02Å; L78-L125 HydrophobicContact CD1-CB 3.95Å; L78-L125 HydrophobicContact CD1-CD1 3.91Å
79	G	87.6	Confident	93.2	Very high	57 Å²	57	53.7 Å²	53.7	59%	0.588	32%	0.316	S	S	*	.	T	Hydrogen-bonded Turn	trans	99.1	-7.1	179.3	0	0	0	0	0	115.8	C77	C77-G79 PolarHBondContact O-N 2.96Å
80	S	91.2	Very high	93.1	Very high	11 Å²	11	55.9 Å²	55.9	8%	0.077	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	138.7	178.9	-66.2	0	0	0	0	112.1	V76 C77 K185	V76-S80 CarbonylContact C-O 3.56Å; V76-S80 WeakPolarHBondContact CA-O 3.42Å; V76-S80 WeakPolarHBondContact CG2-O 3.48Å; C77-S80 PolarHBondContact N-O 3.2Å; C77-S80 PolarHBondContact O-N 3.1Å; S80-K185 PolarHBondContact OG-O 3.42Å
81	V	92.6	Very high	93.1	Very high	105 Å²	105	52.8 Å²	52.8	64%	0.636	31%	0.311	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-73	136.7	179.8	-179	0	0	0	0	110.4
82	L	93.1	Very high	93	Very high	14 Å²	14	48.2 Å²	48.2	7%	0.073	28%	0.281	C	S	.	.			trans	-83.6	138.2	177.4	-59.9	-178.3	0	0	0	111.1	L72 N75 C77 Y84 M130 I184	L72-L82 HydrophobicContact CD1-CB 4.43Å; L72-L82 HydrophobicContact CD1-CD1 3.89Å; L72-L82 HydrophobicContact CD2-CD1 4.06Å; N75-L82 PolarHBondContact O-N 3.25Å; C77-L82 HydrophobicContact CB-CD1 4.37Å; C77-L82 HydrophobicContact CB-CD2 3.76Å; C77-L82 HydrophobicContact CB-CG 4.26Å; L82-Y84 HydrophobicContact CB-CE2 4.26Å; L82-Y84 HydrophobicContact CD1-CE2 3.95Å; L82-Y84 HydrophobicContact CG-CE2 4.5Å; L82-M130 HydrophobicContact CD1-CB 4.16Å; L82-M130 HydrophobicContact CD1-CE 3.73Å; L82-M130 HydrophobicContact CD1-SD 4.44Å; L82-I184 HydrophobicContact CD2-CD1 3.75Å
83	P	92.6	Very high	92.7	Very high	92 Å²	92	49.9 Å²	49.9	60%	0.597	31%	0.307	S	S	*	.	S	Bend	trans	-84.4	-4.9	-179.1	32.5	-34.1	0	0	0	114.4	I184	P83-I184 HydrophobicContact CG-CG1 4.46Å
84	Y	91.8	Very high	92.6	Very high	32 Å²	32	44.5 Å²	44.5	13%	0.125	29%	0.29	C	S	.	.			trans	-114.2	162.1	179.7	42.5	-92.5	0	0	0	111.4	L72 L82 A86 M130 K132 E180	L72-Y84 HydrophobicContact CD1-CD2 3.82Å; L72-Y84 HydrophobicContact CD1-CE2 4.12Å; L72-Y84 VanDerWaalsContact CD1-O 3.23Å; L72-Y84 WeakPolarHBondContact CD1-O 3.3Å; L82-Y84 HydrophobicContact CB-CE2 4.26Å; L82-Y84 HydrophobicContact CD1-CE2 3.95Å; L82-Y84 HydrophobicContact CG-CE2 4.5Å; Y84-A86 WeakPolarHBondContact CD2-O 3.35Å; Y84-M130 WeakPolarHBondContact CE2-O 3.47Å; Y84-M130 PolarHBondContact OH-O 3.32Å; Y84-K132 HydrophobicContact CD1-CB 3.76Å; Y84-K132 HydrophobicContact CD1-CD 3.93Å; Y84-K132 HydrophobicContact CD1-CG 3.94Å; Y84-K132 HydrophobicContact CD2-CB 4.11Å; Y84-K132 HydrophobicContact CD2-CG 4.42Å; Y84-K132 HydrophobicContact CE1-CB 3.87Å; Y84-K132 HydrophobicContact CE2-CB 4.2Å; Y84-K132 HydrophobicContact CG-CB 3.9Å; Y84-K132 HydrophobicContact CG-CD 4.28Å; Y84-K132 HydrophobicContact CG-CG 3.88Å; Y84-E180 HydrophobicContact CD1-CG 4.42Å; Y84-E180 HydrophobicContact CE1-CG 4.42Å
85	G	93.4	Very high	92.5	Very high	58 Å²	58	41 Å²	41	60%	0.598	28%	0.277	S	S	*	.	S	Bend	trans	-106.2	-7.2	-176.5	0	0	0	0	0	116.1	L72	L72-G85 PolarHBondContact N-O 3.49Å
86	A	94.9	Very high	92.6	Very high	26 Å²	26	42.7 Å²	42.7	22%	0.215	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.5	149.4	-176.7	0	0	0	0	0	112.5	C69 E70 Y84 C133	C69-A86 HydrophobicContact CB-CB 4.4Å; E70-A86 CarbonylContact O-C 3.59Å; E70-A86 WeakPolarHBondContact O-CA 3.21Å; E70-A86 WeakPolarHBondContact O-CB 3.34Å; Y84-A86 WeakPolarHBondContact CD2-O 3.35Å; A86-C133 PolarHBondContact O-N 3.23Å
87	T	95.5	Very high	92.7	Very high	3 Å²	3	42.1 Å²	42.1	2%	0.018	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.4	174.4	-171.6	-171.9	0	0	0	0	111.8	E70 L72 Q98 P131	E70-T87 PolarHBondContact N-O 2.8Å; E70-T87 PolarHBondContact O-N 2.81Å; L72-T87 HydrophobicContact CD2-CG2 3.58Å; L72-T87 HydrophobicContact CG-CG2 3.99Å; T87-Q98 HydrophobicContact CG2-CG 4.22Å; T87-P131 VanDerWaalsContact CA-O 3.3Å; T87-P131 WeakPolarHBondContact CA-O 3.28Å; T87-P131 PolarHBondContact OG1-O 2.86Å
88	S	94.9	Very high	92.8	Very high	5 Å²	5	42.7 Å²	42.7	4%	0.035	29%	0.287	C	S	.	.			trans	-148.8	140.9	170.4	-167.8	0	0	0	0	110.9	A67 P68 L90 P131	A67-S88 WeakPolarHBondContact CB-OG 3.49Å; P68-S88 PolarHBondContact O-OG 3.5Å; S88-L90 VanDerWaalsContact C-N 3.33Å; S88-P131 WeakPolarHBondContact O-CD 3.49Å; S88-P131 VanDerWaalsContact O-CG 3.26Å; S88-P131 WeakPolarHBondContact O-CG 3.47Å
89	T	94.3	Very high	92.9	Very high	27 Å²	27	44.9 Å²	44.9	17%	0.166	30%	0.297	C	S	.	.	S	Bend	trans	-80.7	-9.4	178.9	47.2	0	0	0	0	113.9	L91 A92	T89-L91 PolarHBondContact O-N 3.21Å; T89-A92 PolarHBondContact O-N 3.24Å
90	L	93.9	Very high	93.2	Very high	85 Å²	85	45.5 Å²	45.5	45%	0.445	28%	0.284	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54.3	-24.4	-171.1	-175.8	63.1	0	0	0	115.8	R65 A67 S88	R65-L90 HydrophobicContact CG-CD2 4.11Å; A67-L90 HydrophobicContact CB-CB 4.27Å; A67-L90 HydrophobicContact CB-CD2 3.59Å; S88-L90 VanDerWaalsContact C-N 3.33Å
91	L	92.6	Very high	93.3	Very high	17 Å²	17	45.1 Å²	45.1	9%	0.089	28%	0.281	C	S	.	.	T	Hydrogen-bonded Turn	trans	-85.5	-25.8	-179.9	-53.8	-171.3	0	0	0	113.1	T89 G93 V128 P131 V138 L140	T89-L91 PolarHBondContact O-N 3.21Å; L91-G93 PolarHBondContact O-N 3.21Å; L91-V128 HydrophobicContact CB-CG1 4.32Å; L91-V128 WeakPolarHBondContact CB-O 3.4Å; L91-P131 HydrophobicContact CD1-CB 3.94Å; L91-P131 HydrophobicContact CD1-CG 3.99Å; L91-P131 HydrophobicContact CG-CG 4.33Å; L91-V138 HydrophobicContact CD1-CG2 4.18Å; L91-V138 HydrophobicContact CD2-CG1 4.27Å; L91-V138 HydrophobicContact CG-CG2 4.33Å; L91-L140 HydrophobicContact CD1-CD2 4.33Å; L91-L140 HydrophobicContact CD2-CD2 3.55Å
92	A	93.3	Very high	93.3	Very high	4 Å²	4	43.2 Å²	43.2	3%	0.033	27%	0.266	C	S	.	.			trans	-89.9	84	179.8	0	0	0	0	0	110.1	T89 D94 S95 Y129	T89-A92 PolarHBondContact O-N 3.24Å; A92-D94 PolarHBondContact O-N 3.33Å; A92-S95 PolarHBondContact O-N 3.41Å; A92-Y129 HydrophobicContact CB-CD1 3.57Å; A92-Y129 HydrophobicContact CB-CE1 3.74Å; A92-Y129 HydrophobicContact CB-CG 4.35Å
93	G	90.2	Very high	93.2	Very high	68 Å²	68	44.3 Å²	44.3	70%	0.701	28%	0.28	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.7	8.9	-177	0	0	0	0	0	116.2	L91	L91-G93 PolarHBondContact O-N 3.21Å
94	D	91.2	Very high	93.1	Very high	49 Å²	49	42 Å²	42	26%	0.262	26%	0.261	S	S	.	.	T	Hydrogen-bonded Turn	trans	-120	10.5	173.4	73.2	-13.6	0	0	0	113.2	A92 K104 Y129 F165	A92-D94 PolarHBondContact O-N 3.33Å; D94-K104 WeakPolarHBondContact O-CE 3.49Å; D94-K104 PolarHBondContact O-NZ 3.41Å; D94-Y129 VanDerWaalsContact OD1-CE1 3.29Å; D94-Y129 WeakPolarHBondContact OD1-CE1 3.34Å; D94-Y129 PolarHBondContact OD1-OH 3.2Å; D94-Y129 PolarHBondContact OD2-OH 2.9Å; D94-F165 HydrophobicContact CB-CE1 3.76Å; D94-F165 HydrophobicContact CB-CZ 4.04Å; D94-F165 WeakPolarHBondContact OD1-CZ 3.46Å; D94-F165 WeakPolarHBondContact OD2-CZ 3.36Å
95	S	93.3	Very high	93	Very high	3 Å²	3	40.7 Å²	40.7	2%	0.021	26%	0.256	C	S	.	.			trans	-145	109	-171.5	-57.4	0	0	0	0	112.2	A92 K104	A92-S95 PolarHBondContact O-N 3.41Å; S95-K104 WeakPolarHBondContact OG-CG 3.43Å
96	D	92.9	Very high	92.8	Very high	151 Å²	151	42 Å²	42	81%	0.807	25%	0.252	S	S	*	.	S	Bend	trans	-84	-21	-178.8	-69	-38.5	0	0	0	113.1	E100	D96-E100 PolarHBondContact N-OE2 3.39Å
97	S	94.9	Very high	92.3	Very high	45 Å²	45	43.1 Å²	43.1	32%	0.315	25%	0.254	S	S	.	.	S	Bend	trans	-130	158.7	-173.9	61.5	0	0	0	0	113	E99 E100 A101	S97-E99 VanDerWaalsContact C-N 3.26Å; S97-E99 PolarHBondContact O-N 2.97Å; S97-E100 PolarHBondContact O-N 3.2Å; S97-E100 WeakPolarHBondContact OG-CB 3.45Å; S97-E100 PolarHBondContact OG-N 3.25Å; S97-A101 WeakPolarHBondContact O-CB 3.36Å; S97-A101 PolarHBondContact O-N 2.95Å
98	Q	93.7	Very high	92	Very high	13 Å²	13	43.6 Å²	43.6	6%	0.061	26%	0.255	C	S	.	.	H	α-helix	trans	-61.4	-34.9	174.9	-66.4	-172.6	42.9	0	0	112.2	E70 P71 T87 H102	E70-Q98 PolarHBondContact OE2-NE2 3.32Å; P71-Q98 PolarHBondContact O-NE2 2.99Å; P71-Q98 PolarHBondContact O-OE1 3.29Å; T87-Q98 HydrophobicContact CG2-CG 4.22Å; Q98-H102 WeakPolarHBondContact O-CB 3.47Å; Q98-H102 PolarHBondContact O-N 2.78Å
99	E	93.9	Very high	91.5	Very high	78 Å²	78	44.9 Å²	44.9	36%	0.364	26%	0.264	S	S	.	.	H	α-helix	trans	-62.6	-44.1	173.6	-72.8	65.4	-146.8	0	0	111.9	R73 S97 G103	R73-E99 WeakPolarHBondContact CD-OE1 3.43Å; R73-E99 IonicContact CZ-OE1 3.01Å; R73-E99 IonicContact CZ-OE2 3.71Å; R73-E99 IonicContact NE-OE1 3.71Å; R73-E99 IonicContact NH1-OE1 2.76Å; R73-E99 PolarHBondContact NH1-OE1 3.4Å; R73-E99 IonicContact NH1-OE2 2.75Å; R73-E99 PolarHBondContact NH1-OE2 3.13Å; R73-E99 VanDerWaalsContact NH1-OE2 3.07Å; S97-E99 VanDerWaalsContact C-N 3.26Å; S97-E99 PolarHBondContact O-N 2.97Å; E99-G103 PolarHBondContact O-N 3.43Å
100	E	93.1	Very high	90.9	Very high	70 Å²	70	44.4 Å²	44.4	33%	0.327	27%	0.265	S	S	.	.	H	α-helix	trans	-68.4	-44.4	177.3	-175.8	168.1	-154.2	0	0	111.5	D96 S97 H102 G103 K104	D96-E100 PolarHBondContact N-OE2 3.39Å; S97-E100 PolarHBondContact O-N 3.2Å; S97-E100 WeakPolarHBondContact OG-CB 3.45Å; S97-E100 PolarHBondContact OG-N 3.25Å; E100-H102 VanDerWaalsContact C-N 3.31Å; E100-H102 PolarHBondContact O-N 2.92Å; E100-G103 CarbonylContact O-C 3.34Å; E100-G103 VanDerWaalsContact O-CA 3.29Å; E100-G103 WeakPolarHBondContact O-CA 3.31Å; E100-G103 PolarHBondContact O-N 3.41Å; E100-K104 WeakPolarHBondContact O-CG 3.21Å; E100-K104 PolarHBondContact O-N 3.25Å; E100-K104 WeakPolarHBondContact OE1-CE 3.24Å; E100-K104 IonicContact OE1-NZ 3.85Å; E100-K104 PolarHBondContact OE1-NZ 3.4Å
101	A	93.4	Very high	90.5	Very high	2 Å²	2	40.4 Å²	40.4	2%	0.017	24%	0.244	C	C	.	.	H	α-helix	trans	-57.3	-43.9	175.7	0	0	0	0	0	111.6	S97 G103 K104 L105 Y129	S97-A101 WeakPolarHBondContact O-CB 3.36Å; S97-A101 PolarHBondContact O-N 2.95Å; A101-G103 VanDerWaalsContact C-N 3.35Å; A101-K104 PolarHBondContact O-N 3.25Å; A101-L105 WeakPolarHBondContact O-CG 3.43Å; A101-L105 PolarHBondContact O-N 3.23Å; A101-Y129 HydrophobicContact CB-CD1 4Å
102	H	92.5	Very high	90.2	Very high	66 Å²	66	44.9 Å²	44.9	31%	0.306	26%	0.26	S	S	.	.	H	α-helix	trans	-62.1	-41.1	171.6	-178.6	-89.3	0	0	0	111.8	Y74 Q98 E100 K104 L105 V106	Y74-H102 HydrophobicContact CD2-CB 4.06Å; Y74-H102 HydrophobicContact CE2-CB 3.76Å; Q98-H102 WeakPolarHBondContact O-CB 3.47Å; Q98-H102 PolarHBondContact O-N 2.78Å; E100-H102 VanDerWaalsContact C-N 3.31Å; E100-H102 PolarHBondContact O-N 2.92Å; H102-K104 PolarHBondContact O-N 3Å; H102-L105 PolarHBondContact O-N 2.93Å; H102-V106 WeakPolarHBondContact O-CG2 3.43Å; H102-V106 PolarHBondContact O-N 2.68Å
103	G	90.4	Very high	89.7	Confident	37 Å²	37	45.4 Å²	45.4	38%	0.381	26%	0.262	S	S	.	.	H	α-helix	trans	-58.3	-42.5	172.9	0	0	0	0	0	113.8	E99 E100 A101 L107	E99-G103 PolarHBondContact O-N 3.43Å; E100-G103 CarbonylContact O-C 3.34Å; E100-G103 VanDerWaalsContact O-CA 3.29Å; E100-G103 WeakPolarHBondContact O-CA 3.31Å; E100-G103 PolarHBondContact O-N 3.41Å; A101-G103 VanDerWaalsContact C-N 3.35Å; G103-L107 PolarHBondContact O-N 3.32Å
104	K	90.1	Very high	89.5	Confident	44 Å²	44	42.2 Å²	42.2	19%	0.191	23%	0.229	C	C	.	.	H	α-helix	trans	-68.3	-38.3	172.9	-49.6	-61.3	162.3	149.3	0	111.4	D94 S95 E100 A101 H102 V106 L107 W108 Y129	D94-K104 WeakPolarHBondContact O-CE 3.49Å; D94-K104 PolarHBondContact O-NZ 3.41Å; S95-K104 WeakPolarHBondContact OG-CG 3.43Å; E100-K104 WeakPolarHBondContact O-CG 3.21Å; E100-K104 PolarHBondContact O-N 3.25Å; E100-K104 WeakPolarHBondContact OE1-CE 3.24Å; E100-K104 IonicContact OE1-NZ 3.85Å; E100-K104 PolarHBondContact OE1-NZ 3.4Å; A101-K104 PolarHBondContact O-N 3.25Å; H102-K104 PolarHBondContact O-N 3Å; K104-V106 VanDerWaalsContact C-N 3.32Å; K104-V106 PolarHBondContact O-N 3.37Å; K104-L107 CarbonylContact O-C 3.13Å; K104-L107 WeakPolarHBondContact O-CA 3.43Å; K104-L107 VanDerWaalsContact O-CB 3.25Å; K104-L107 WeakPolarHBondContact O-CB 3.48Å; K104-L107 PolarHBondContact O-N 3.21Å; K104-W108 PolarHBondContact O-N 3.29Å; K104-Y129 HydrophobicContact CB-CD1 4.27Å; K104-Y129 HydrophobicContact CB-CE1 3.52Å; K104-Y129 HydrophobicContact CG-CE1 3.78Å
105	L	91.3	Very high	89.3	Confident	4 Å²	4	40.3 Å²	40.3	2%	0.021	22%	0.219	C	C	.	.	H	α-helix	trans	-61.5	-39.4	176.4	-76.9	172	0	0	0	112.4	L78 A101 H102 L107 W108 S109 L125 Y129 M130	L78-L105 HydrophobicContact CD1-CD2 4.21Å; L78-L105 HydrophobicContact CD2-CB 4.14Å; L78-L105 HydrophobicContact CD2-CD2 4.15Å; L78-L105 HydrophobicContact CG-CD2 4.19Å; A101-L105 WeakPolarHBondContact O-CG 3.43Å; A101-L105 PolarHBondContact O-N 3.23Å; H102-L105 PolarHBondContact O-N 2.93Å; L105-L107 VanDerWaalsContact C-N 3.3Å; L105-L107 PolarHBondContact O-N 3.32Å; L105-W108 PolarHBondContact O-N 3.18Å; L105-S109 PolarHBondContact O-N 3.4Å; L105-S109 VanDerWaalsContact O-N 3.08Å; L105-L125 HydrophobicContact CD2-CB 3.84Å; L105-Y129 HydrophobicContact CD2-CD2 3.75Å; L105-Y129 HydrophobicContact CD2-CG 4.02Å; L105-Y129 HydrophobicContact CG-CD2 4.17Å; L105-Y129 HydrophobicContact CG-CG 3.98Å; L105-M130 HydrophobicContact CD1-CG 3.9Å; L105-M130 HydrophobicContact CD1-SD 3.58Å; L105-M130 VanDerWaalsContact CD1-SD 3.58Å
106	V	88.1	Confident	89.2	Confident	84 Å²	84	45.7 Å²	45.7	51%	0.509	24%	0.239	S	C	.	.	H	α-helix	trans	-60.7	-41.9	171	172.1	0	0	0	0	110.8	H102 K104 S109	H102-V106 WeakPolarHBondContact O-CG2 3.43Å; H102-V106 PolarHBondContact O-N 2.68Å; K104-V106 VanDerWaalsContact C-N 3.32Å; K104-V106 PolarHBondContact O-N 3.37Å; V106-S109 VanDerWaalsContact O-CB 3.32Å; V106-S109 WeakPolarHBondContact O-CB 3.19Å; V106-S109 PolarHBondContact O-N 3.13Å; V106-S109 PolarHBondContact O-OG 2.96Å
107	L	85.3	Confident	89	Confident	50 Å²	50	38.6 Å²	38.6	26%	0.262	20%	0.201	S	C	.	.	H	α-helix	trans	-66.1	-43.7	178.7	-163.1	57.8	0	0	0	112.9	G103 K104 L105 S109 G110	G103-L107 PolarHBondContact O-N 3.32Å; K104-L107 CarbonylContact O-C 3.13Å; K104-L107 WeakPolarHBondContact O-CA 3.43Å; K104-L107 VanDerWaalsContact O-CB 3.25Å; K104-L107 WeakPolarHBondContact O-CB 3.48Å; K104-L107 PolarHBondContact O-N 3.21Å; L105-L107 VanDerWaalsContact C-N 3.3Å; L105-L107 PolarHBondContact O-N 3.32Å; L107-S109 PolarHBondContact O-N 3.44Å; L107-G110 PolarHBondContact O-N 2.87Å
108	W	87.8	Confident	88.9	Confident	13 Å²	13	36.5 Å²	36.5	5%	0.049	19%	0.186	C	C	.	.	H	α-helix	trans	-65.8	-20.8	173.4	-77.1	110.1	0	0	0	112.9	K104 L105 G110 L111 I121 L125 Y129 V156 P163 L166 I495	K104-W108 PolarHBondContact O-N 3.29Å; L105-W108 PolarHBondContact O-N 3.18Å; W108-G110 PolarHBondContact O-N 3.14Å; W108-G110 VanDerWaalsContact O-N 3.17Å; W108-L111 HydrophobicContact CE3-CD1 3.69Å; W108-L111 HydrophobicContact CZ3-CD1 3.97Å; W108-L111 WeakPolarHBondContact O-CB 3.29Å; W108-L111 PolarHBondContact O-N 2.98Å; W108-L111 VanDerWaalsContact O-N 3.11Å; W108-I121 HydrophobicContact CE3-CD1 4.42Å; W108-I121 HydrophobicContact CZ3-CD1 4.38Å; W108-L125 HydrophobicContact CB-CD1 3.77Å; W108-L125 HydrophobicContact CB-CD2 4.08Å; W108-L125 HydrophobicContact CD2-CD2 3.87Å; W108-L125 HydrophobicContact CE3-CD2 4.44Å; W108-L125 HydrophobicContact CG-CD1 4.27Å; W108-L125 HydrophobicContact CG-CD2 3.68Å; W108-Y129 AromaticContact CD1-CE2 3.68Å; W108-Y129 AromaticContact CD1-CZ 3.9Å; W108-Y129 AromaticContact NE1-CE2 3.62Å; W108-Y129 AromaticContact NE1-CZ 3.61Å; W108-Y129 PolarHBondContact NE1-OH 2.83Å; W108-V156 HydrophobicContact CH2-CG1 3.8Å; W108-V156 HydrophobicContact CZ3-CG1 3.77Å; W108-V156 HydrophobicContact CZ3-CG2 4.17Å; W108-P163 HydrophobicContact CZ2-CG 4.29Å; W108-L166 HydrophobicContact CH2-CD1 4Å; W108-L166 HydrophobicContact CZ2-CD1 3.54Å; W108-I495 HydrophobicContact CE3-CG2 4.29Å; W108-I495 HydrophobicContact CH2-CG2 4.36Å; W108-I495 HydrophobicContact CZ3-CG2 4.01Å
109	S	85.6	Confident	88.7	Confident	32 Å²	32	38.1 Å²	38.1	22%	0.224	20%	0.202	C	C	.	.	G	3₁₀ helix	trans	-66.1	-12.1	176.7	85.8	0	0	0	0	114.5	L105 V106 L107 L111 R112	L105-S109 PolarHBondContact O-N 3.4Å; L105-S109 VanDerWaalsContact O-N 3.08Å; V106-S109 VanDerWaalsContact O-CB 3.32Å; V106-S109 WeakPolarHBondContact O-CB 3.19Å; V106-S109 PolarHBondContact O-N 3.13Å; V106-S109 PolarHBondContact O-OG 2.96Å; L107-S109 PolarHBondContact O-N 3.44Å; S109-L111 PolarHBondContact O-N 2.99Å; S109-R112 WeakPolarHBondContact O-CB 3.24Å; S109-R112 PolarHBondContact O-N 2.97Å
110	G	80.9	Confident	88.6	Confident	17 Å²	17	36.1 Å²	36.1	18%	0.175	20%	0.195	C	C	.	.	G	3₁₀ helix	trans	-60.4	-19.4	167.7	0	0	0	0	0	114.2	L107 W108 R112	L107-G110 PolarHBondContact O-N 2.87Å; W108-G110 PolarHBondContact O-N 3.14Å; W108-G110 VanDerWaalsContact O-N 3.17Å; G110-R112 PolarHBondContact O-N 3.48Å
111	L	85.3	Confident	88.6	Confident	1 Å²	1	32.8 Å²	32.8	1%	0.005	18%	0.179	C	C	.	.	G	3₁₀ helix	trans	-71.8	-3.9	171.3	-75.7	170	0	0	0	114.2	W108 S109 N113 A114 W118 I121 I155 V156 V493 I495	W108-L111 HydrophobicContact CE3-CD1 3.69Å; W108-L111 HydrophobicContact CZ3-CD1 3.97Å; W108-L111 WeakPolarHBondContact O-CB 3.29Å; W108-L111 PolarHBondContact O-N 2.98Å; W108-L111 VanDerWaalsContact O-N 3.11Å; S109-L111 PolarHBondContact O-N 2.99Å; L111-N113 PolarHBondContact O-N 2.9Å; L111-A114 PolarHBondContact O-N 3.31Å; L111-W118 HydrophobicContact CB-CE3 3.97Å; L111-W118 HydrophobicContact CB-CZ3 4.45Å; L111-I121 HydrophobicContact CD1-CD1 3.56Å; L111-I121 HydrophobicContact CD1-CG2 4.34Å; L111-I155 HydrophobicContact CD2-CG2 3.84Å; L111-V156 HydrophobicContact CD1-CG2 3.81Å; L111-V156 HydrophobicContact CD2-CG2 4.1Å; L111-V493 HydrophobicContact CD2-CG1 3.96Å; L111-I495 HydrophobicContact CD2-CD1 3.92Å; L111-I495 HydrophobicContact CD2-CG1 4.4Å; L111-I495 HydrophobicContact CG-CD1 4.35Å; L111-I495 HydrophobicContact CG-CG1 4.47Å
112	R	86.8	Confident	88.6	Confident	111 Å²	111	32.9 Å²	32.9	42%	0.419	18%	0.179	S	C	.	.	G	3₁₀ helix	trans	-53.3	-26.8	174.5	-175.5	-178.7	-60.2	-161.5	2.2	113.1	S109 G110 A114 W118 G190 Q191	S109-R112 WeakPolarHBondContact O-CB 3.24Å; S109-R112 PolarHBondContact O-N 2.97Å; G110-R112 PolarHBondContact O-N 3.48Å; R112-A114 VanDerWaalsContact C-N 3.25Å; R112-A114 PolarHBondContact O-N 3.47Å; R112-W118 HydrophobicContact CB-CD2 4.35Å; R112-G190 CarbonylContact O-C 3.53Å; R112-G190 WeakPolarHBondContact O-CA 3.43Å; R112-Q191 PolarHBondContact O-N 3.31Å; R112-Q191 VanDerWaalsContact O-N 3.12Å
113	N	82.5	Confident	88.7	Confident	15 Å²	15	30.8 Å²	30.8	8%	0.08	17%	0.171	C	C	.	.	G	3₁₀ helix	trans	-80.8	-3.7	-177.4	-62.5	-6.4	0	0	0	113.5	L111 Q191 E193 C212 A491	L111-N113 PolarHBondContact O-N 2.9Å; N113-Q191 CarbonylContact C-O 3.45Å; N113-Q191 VanDerWaalsContact CA-O 3.27Å; N113-Q191 WeakPolarHBondContact CA-O 3.39Å; N113-E193 WeakPolarHBondContact ND2-CG 3.48Å; N113-C212 PolarHBondContact O-SG 3.41Å; N113-A491 VanDerWaalsContact CB-O 3.27Å; N113-A491 WeakPolarHBondContact CB-O 3.49Å; N113-A491 PolarHBondContact ND2-O 2.95Å
114	A	86.5	Confident	88.9	Confident	1 Å²	1	29 Å²	29	1%	0.008	15%	0.154	C	C	.	.	S	Bend	trans	-116.3	83.9	169.3	0	0	0	0	0	109.1	L111 R112 R116 C117 W118 V209	L111-A114 PolarHBondContact O-N 3.31Å; R112-A114 VanDerWaalsContact C-N 3.25Å; R112-A114 PolarHBondContact O-N 3.47Å; A114-R116 VanDerWaalsContact C-N 3.29Å; A114-R116 PolarHBondContact O-N 3.26Å; A114-R116 VanDerWaalsContact O-N 3.16Å; A114-C117 HydrophobicContact CB-CB 4.09Å; A114-C117 WeakPolarHBondContact O-CB 3.46Å; A114-C117 PolarHBondContact O-N 3.22Å; A114-C117 VanDerWaalsContact O-N 3.1Å; A114-W118 WeakPolarHBondContact O-CB 3.48Å; A114-W118 PolarHBondContact O-N 3.02Å; A114-V209 HydrophobicContact CB-CG1 4.11Å
115	P	88	Confident	89.1	Confident	9 Å²	9	27 Å²	27	6%	0.058	15%	0.145	C	C	.	.	H	α-helix	trans	-63.1	-29.4	-164.3	23.7	-33.9	0	0	0	114.2	A119 C212	P115-A119 PolarHBondContact O-N 3.15Å; P115-C212 WeakPolarHBondContact CD-SG 3.5Å
116	R	89.6	Confident	89.3	Confident	117 Å²	117	26.8 Å²	26.8	44%	0.442	14%	0.144	S	C	.	.	H	α-helix	trans	-71.8	-40.5	176.7	-72.8	-91.8	47	153.8	-2.6	112.1	A114 P152 E210	A114-R116 VanDerWaalsContact C-N 3.29Å; A114-R116 PolarHBondContact O-N 3.26Å; A114-R116 VanDerWaalsContact O-N 3.16Å; R116-P152 HydrophobicContact CB-CB 4.34Å; R116-E210 HydrophobicContact CB-CB 3.76Å; R116-E210 WeakPolarHBondContact CB-O 3.44Å; R116-E210 HydrophobicContact CG-CB 4.2Å; R116-E210 PolarHBondContact N-O 2.95Å
117	C	90.2	Very high	89.6	Confident	1 Å²	1	23.2 Å²	23.2	1%	0.007	12%	0.123	C	C	.	.	H	α-helix	trans	-65.5	-50.3	171.3	173.8	0	0	0	0	111.1	A114 A119 V120 I121 P152 C153	A114-C117 HydrophobicContact CB-CB 4.09Å; A114-C117 WeakPolarHBondContact O-CB 3.46Å; A114-C117 PolarHBondContact O-N 3.22Å; A114-C117 VanDerWaalsContact O-N 3.1Å; C117-A119 VanDerWaalsContact C-N 3.31Å; C117-A119 PolarHBondContact O-N 3.38Å; C117-V120 VanDerWaalsContact O-CG2 3.26Å; C117-V120 WeakPolarHBondContact O-CG2 3.39Å; C117-V120 PolarHBondContact O-N 2.75Å; C117-I121 WeakPolarHBondContact O-CB 3.41Å; C117-I121 PolarHBondContact O-N 3.1Å; C117-P152 WeakPolarHBondContact CB-O 3.37Å; C117-C153 WeakPolarHBondContact CA-SG 3.47Å; C117-C153 HydrophobicContact CB-CB 4Å; C117-C153 WeakPolarHBondContact CB-SG 3.49Å; C117-C153 VanDerWaalsContact SG-CA 3.55Å; C117-C153 WeakPolarHBondContact SG-CB 3.21Å; C117-C153 CovalentContact SG-SG 2.04Å; C117-C153 PolarHBondContact SG-SG 3.23Å
118	W	91	Very high	90.1	Very high	2 Å²	2	21 Å²	21	1%	0.008	11%	0.111	C	C	.	.	H	α-helix	trans	-52.4	-48.7	-175.4	-174.4	-115.3	0	0	0	112.3	L78 L111 R112 A114 V120 I121 Q122 S188	L78-W118 HydrophobicContact CD1-CH2 3.93Å; L78-W118 HydrophobicContact CD2-CH2 4.06Å; L78-W118 HydrophobicContact CG-CH2 4.4Å; L111-W118 HydrophobicContact CB-CE3 3.97Å; L111-W118 HydrophobicContact CB-CZ3 4.45Å; R112-W118 HydrophobicContact CB-CD2 4.35Å; A114-W118 WeakPolarHBondContact O-CB 3.48Å; A114-W118 PolarHBondContact O-N 3.02Å; W118-V120 PolarHBondContact O-N 3.06Å; W118-I121 HydrophobicContact CE3-CG2 4.05Å; W118-I121 HydrophobicContact CZ3-CG2 4.47Å; W118-I121 PolarHBondContact O-N 3.44Å; W118-Q122 HydrophobicContact CD2-CG 3.87Å; W118-Q122 VanDerWaalsContact CE2-CD 3.42Å; W118-Q122 HydrophobicContact CE3-CG 4.23Å; W118-Q122 HydrophobicContact CG-CG 4.42Å; W118-Q122 HydrophobicContact CH2-CG 3.95Å; W118-Q122 HydrophobicContact CZ2-CG 3.56Å; W118-Q122 HydrophobicContact CZ3-CG 4.26Å; W118-Q122 VanDerWaalsContact O-CG 3.32Å; W118-Q122 WeakPolarHBondContact O-CG 3.48Å; W118-Q122 PolarHBondContact O-N 3.16Å; W118-Q122 VanDerWaalsContact O-N 3.12Å; W118-Q122 PolarHBondContact O-OE1 2.67Å; W118-S188 PolarHBondContact NE1-O 3.17Å
119	A	90.8	Very high	90.4	Very high	46 Å²	46	20.5 Å²	20.5	38%	0.38	11%	0.109	S	C	.	.	H	α-helix	trans	-60.5	-27.7	-179.5	0	0	0	0	0	114.6	P115 C117	P115-A119 PolarHBondContact O-N 3.15Å; C117-A119 VanDerWaalsContact C-N 3.31Å; C117-A119 PolarHBondContact O-N 3.38Å
120	V	92.1	Very high	90.9	Very high	36 Å²	36	19.4 Å²	19.4	22%	0.218	10%	0.101	C	C	.	.	H	α-helix	trans	-100	-22.4	179.2	-57.4	0	0	0	0	113.6	C117 W118 P123 T149 P152	C117-V120 VanDerWaalsContact O-CG2 3.26Å; C117-V120 WeakPolarHBondContact O-CG2 3.39Å; C117-V120 PolarHBondContact O-N 2.75Å; W118-V120 PolarHBondContact O-N 3.06Å; V120-P123 WeakPolarHBondContact O-CD 3.5Å; V120-T149 HydrophobicContact CG2-CG2 4.29Å; V120-T149 WeakPolarHBondContact O-CG2 3.36Å; V120-P152 HydrophobicContact CG2-CB 4.49Å; V120-P152 HydrophobicContact CG2-CG 3.53Å
121	I	93.1	Very high	91.6	Very high	1 Å²	1	18.7 Å²	18.7	1%	0.005	9%	0.093	C	C	.	.	H	α-helix	trans	-85.5	-28.1	-179.4	-150.7	179.1	0	0	0	112.3	W108 L111 C117 W118 L124 L125 T149 V156 W162	W108-I121 HydrophobicContact CE3-CD1 4.42Å; W108-I121 HydrophobicContact CZ3-CD1 4.38Å; L111-I121 HydrophobicContact CD1-CD1 3.56Å; L111-I121 HydrophobicContact CD1-CG2 4.34Å; C117-I121 WeakPolarHBondContact O-CB 3.41Å; C117-I121 PolarHBondContact O-N 3.1Å; W118-I121 HydrophobicContact CE3-CG2 4.05Å; W118-I121 HydrophobicContact CZ3-CG2 4.47Å; W118-I121 PolarHBondContact O-N 3.44Å; I121-L124 PolarHBondContact O-N 3.39Å; I121-L124 VanDerWaalsContact O-N 3.17Å; I121-L125 HydrophobicContact CG1-CD1 4.21Å; I121-L125 HydrophobicContact CG1-CG 4.15Å; I121-L125 HydrophobicContact CG2-CD1 4.02Å; I121-L125 WeakPolarHBondContact O-CG 3.21Å; I121-L125 PolarHBondContact O-N 2.93Å; I121-T149 HydrophobicContact CB-CG2 4.37Å; I121-T149 HydrophobicContact CG1-CG2 4.22Å; I121-V156 HydrophobicContact CD1-CG2 4.45Å; I121-W162 HydrophobicContact CD1-CH2 3.98Å; I121-W162 HydrophobicContact CD1-CZ3 4.25Å
122	Q	93.2	Very high	92	Very high	3 Å²	3	20.2 Å²	20.2	1%	0.014	10%	0.1	C	C	.	.	H	α-helix	trans	-51	-50	177.4	-79	174.3	-70.3	0	0	114	L78 W118 L124 L125 C126 F186	L78-Q122 HydrophobicContact CB-CG 4.48Å; L78-Q122 HydrophobicContact CD1-CB 4.25Å; L78-Q122 HydrophobicContact CD1-CG 4.02Å; W118-Q122 HydrophobicContact CD2-CG 3.87Å; W118-Q122 VanDerWaalsContact CE2-CD 3.42Å; W118-Q122 HydrophobicContact CE3-CG 4.23Å; W118-Q122 HydrophobicContact CG-CG 4.42Å; W118-Q122 HydrophobicContact CH2-CG 3.95Å; W118-Q122 HydrophobicContact CZ2-CG 3.56Å; W118-Q122 HydrophobicContact CZ3-CG 4.26Å; W118-Q122 VanDerWaalsContact O-CG 3.32Å; W118-Q122 WeakPolarHBondContact O-CG 3.48Å; W118-Q122 PolarHBondContact O-N 3.16Å; W118-Q122 VanDerWaalsContact O-N 3.12Å; W118-Q122 PolarHBondContact O-OE1 2.67Å; Q122-L124 PolarHBondContact O-N 3.37Å; Q122-L125 PolarHBondContact O-N 2.6Å; Q122-C126 PolarHBondContact O-N 2.91Å; Q122-C126 VanDerWaalsContact O-N 3.11Å; Q122-C126 PolarHBondContact O-SG 3.49Å; Q122-C126 VanDerWaalsContact O-SG 3.42Å; Q122-F186 HydrophobicContact CB-CB 4.48Å; Q122-F186 HydrophobicContact CB-CD1 3.84Å; Q122-F186 HydrophobicContact CB-CE1 4.22Å; Q122-F186 HydrophobicContact CB-CG 4.04Å; Q122-F186 HydrophobicContact CG-CD1 4.46Å
123	P	93.9	Very high	92.3	Very high	22 Å²	22	15.2 Å²	15.2	14%	0.143	8%	0.082	C	C	.	.	H	α-helix	trans	-70.6	-32.7	-179	-10.5	26.2	0	0	0	112.1	V120 A127 L145 V181 F186	V120-P123 WeakPolarHBondContact O-CD 3.5Å; P123-A127 VanDerWaalsContact O-CB 3.27Å; P123-A127 WeakPolarHBondContact O-CB 3.02Å; P123-A127 PolarHBondContact O-N 3.29Å; P123-L145 HydrophobicContact CB-CD1 4.12Å; P123-V181 HydrophobicContact CB-CB 4.2Å; P123-V181 HydrophobicContact CB-CG2 4.02Å; P123-F186 HydrophobicContact CB-CD2 4.23Å; P123-F186 HydrophobicContact CB-CE2 3.68Å; P123-F186 HydrophobicContact CB-CZ 4.36Å; P123-F186 HydrophobicContact CG-CD2 3.76Å; P123-F186 HydrophobicContact CG-CE2 3.74Å
124	L	95	Very high	92.8	Very high	1 Å²	1	19.9 Å²	19.9	1%	0.005	10%	0.103	C	C	.	.	H	α-helix	trans	-64.7	-44.6	174.8	-179.8	65.9	0	0	0	111.4	I121 Q122 A127 V128 L145 C146 T149 L166 F173	I121-L124 PolarHBondContact O-N 3.39Å; I121-L124 VanDerWaalsContact O-N 3.17Å; Q122-L124 PolarHBondContact O-N 3.37Å; L124-A127 PolarHBondContact O-N 3.5Å; L124-V128 HydrophobicContact CD1-CG2 4.37Å; L124-V128 WeakPolarHBondContact O-CG2 3.26Å; L124-V128 PolarHBondContact O-N 3.49Å; L124-L145 HydrophobicContact CB-CG 4.4Å; L124-L145 HydrophobicContact CD1-CD2 4.42Å; L124-L145 HydrophobicContact CD1-CG 4.23Å; L124-C146 HydrophobicContact CD1-CB 4.33Å; L124-T149 HydrophobicContact CB-CG2 4.11Å; L124-T149 HydrophobicContact CD2-CG2 3.56Å; L124-T149 HydrophobicContact CG-CG2 4.46Å; L124-L166 HydrophobicContact CD2-CD2 4.48Å; L124-L166 HydrophobicContact CG-CD2 4.5Å; L124-F173 HydrophobicContact CD1-CE1 3.6Å; L124-F173 HydrophobicContact CD1-CZ 4.16Å
125	L	95	Very high	93	Very high	1 Å²	1	26.7 Å²	26.7	1%	0.005	14%	0.14	C	C	.	.	H	α-helix	trans	-62.3	-46.4	178	-70.4	168.7	0	0	0	111.2	L78 L105 W108 I121 Q122 A127 V128 Y129	L78-L125 HydrophobicContact CD1-CB 3.95Å; L78-L125 HydrophobicContact CD1-CD1 3.91Å; L105-L125 HydrophobicContact CD2-CB 3.84Å; W108-L125 HydrophobicContact CB-CD1 3.77Å; W108-L125 HydrophobicContact CB-CD2 4.08Å; W108-L125 HydrophobicContact CD2-CD2 3.87Å; W108-L125 HydrophobicContact CE3-CD2 4.44Å; W108-L125 HydrophobicContact CG-CD1 4.27Å; W108-L125 HydrophobicContact CG-CD2 3.68Å; I121-L125 HydrophobicContact CG1-CD1 4.21Å; I121-L125 HydrophobicContact CG1-CG 4.15Å; I121-L125 HydrophobicContact CG2-CD1 4.02Å; I121-L125 WeakPolarHBondContact O-CG 3.21Å; I121-L125 PolarHBondContact O-N 2.93Å; Q122-L125 PolarHBondContact O-N 2.6Å; L125-A127 VanDerWaalsContact C-N 3.34Å; L125-A127 PolarHBondContact O-N 3.01Å; L125-V128 PolarHBondContact O-N 2.96Å; L125-Y129 HydrophobicContact CB-CD2 4.47Å; L125-Y129 HydrophobicContact CD2-CD2 4.09Å; L125-Y129 HydrophobicContact CD2-CE2 3.79Å; L125-Y129 WeakPolarHBondContact O-CB 3.43Å; L125-Y129 WeakPolarHBondContact O-CD2 3.42Å; L125-Y129 PolarHBondContact O-N 3.47Å
126	C	94.8	Very high	93.2	Very high	0 Å²	0	31.2 Å²	31.2	0%	0	16%	0.163	C	C	.	.	H	α-helix	trans	-63.9	-38.5	176.3	-63.6	0	0	0	0	112.4	C77 Q122 V128 M130 V181 F186	C77-C126 HydrophobicContact CB-CB 3.94Å; C77-C126 WeakPolarHBondContact CB-SG 3.36Å; C77-C126 WeakPolarHBondContact SG-CA 3.44Å; C77-C126 WeakPolarHBondContact SG-CB 3.26Å; C77-C126 CovalentContact SG-SG 2.04Å; C77-C126 PolarHBondContact SG-SG 3.28Å; Q122-C126 PolarHBondContact O-N 2.91Å; Q122-C126 VanDerWaalsContact O-N 3.11Å; Q122-C126 PolarHBondContact O-SG 3.49Å; Q122-C126 VanDerWaalsContact O-SG 3.42Å; C126-V128 PolarHBondContact O-N 3.4Å; C126-M130 CarbonylContact O-C 3.49Å; C126-M130 WeakPolarHBondContact O-CA 3.5Å; C126-M130 PolarHBondContact O-N 3.31Å; C126-V181 HydrophobicContact CB-CG1 4.36Å; C126-F186 HydrophobicContact CB-CZ 4.18Å
127	A	94.8	Very high	93.3	Very high	9 Å²	9	29.3 Å²	29.3	7%	0.074	16%	0.156	C	C	.	.	H	α-helix	trans	-70.1	-9.3	177.4	0	0	0	0	0	114.8	P123 L124 L125 P141 L145 V181	P123-A127 VanDerWaalsContact O-CB 3.27Å; P123-A127 WeakPolarHBondContact O-CB 3.02Å; P123-A127 PolarHBondContact O-N 3.29Å; L124-A127 PolarHBondContact O-N 3.5Å; L125-A127 VanDerWaalsContact C-N 3.34Å; L125-A127 PolarHBondContact O-N 3.01Å; A127-P141 HydrophobicContact CB-CB 4Å; A127-L145 HydrophobicContact CB-CD2 4.02Å; A127-V181 HydrophobicContact CB-CG1 3.82Å; A127-V181 HydrophobicContact CB-CG2 3.97Å
128	V	95.1	Very high	93.5	Very high	2 Å²	2	29.3 Å²	29.3	1%	0.012	16%	0.156	C	C	.	.	H	α-helix	trans	-113.1	-43.6	-180	172.4	0	0	0	0	111.9	L91 L124 L125 C126 P141 F165 L166 F173	L91-V128 HydrophobicContact CB-CG1 4.32Å; L91-V128 WeakPolarHBondContact CB-O 3.4Å; L124-V128 HydrophobicContact CD1-CG2 4.37Å; L124-V128 WeakPolarHBondContact O-CG2 3.26Å; L124-V128 PolarHBondContact O-N 3.49Å; L125-V128 PolarHBondContact O-N 2.96Å; C126-V128 PolarHBondContact O-N 3.4Å; V128-P141 HydrophobicContact CG2-CG 4.12Å; V128-F165 HydrophobicContact CG1-CD2 3.79Å; V128-F165 HydrophobicContact CG1-CE2 4.08Å; V128-L166 HydrophobicContact CB-CD2 4.36Å; V128-L166 HydrophobicContact CG1-CD2 4.12Å; V128-L166 HydrophobicContact CG2-CD2 4.09Å; V128-F173 HydrophobicContact CG2-CE1 4.36Å; V128-F173 HydrophobicContact CG2-CZ 4.27Å
129	Y	95.3	Very high	93.5	Very high	3 Å²	3	31.8 Å²	31.8	1%	0.012	17%	0.168	C	C	.	.	H	α-helix	trans	-86.1	-25.8	-179.3	-74.9	-76.2	0	0	0	113.9	A92 D94 A101 K104 L105 W108 L125 F165	A92-Y129 HydrophobicContact CB-CD1 3.57Å; A92-Y129 HydrophobicContact CB-CE1 3.74Å; A92-Y129 HydrophobicContact CB-CG 4.35Å; D94-Y129 VanDerWaalsContact OD1-CE1 3.29Å; D94-Y129 WeakPolarHBondContact OD1-CE1 3.34Å; D94-Y129 PolarHBondContact OD1-OH 3.2Å; D94-Y129 PolarHBondContact OD2-OH 2.9Å; A101-Y129 HydrophobicContact CB-CD1 4Å; K104-Y129 HydrophobicContact CB-CD1 4.27Å; K104-Y129 HydrophobicContact CB-CE1 3.52Å; K104-Y129 HydrophobicContact CG-CE1 3.78Å; L105-Y129 HydrophobicContact CD2-CD2 3.75Å; L105-Y129 HydrophobicContact CD2-CG 4.02Å; L105-Y129 HydrophobicContact CG-CD2 4.17Å; L105-Y129 HydrophobicContact CG-CG 3.98Å; W108-Y129 AromaticContact CD1-CE2 3.68Å; W108-Y129 AromaticContact CD1-CZ 3.9Å; W108-Y129 AromaticContact NE1-CE2 3.62Å; W108-Y129 AromaticContact NE1-CZ 3.61Å; W108-Y129 PolarHBondContact NE1-OH 2.83Å; L125-Y129 HydrophobicContact CB-CD2 4.47Å; L125-Y129 HydrophobicContact CD2-CD2 4.09Å; L125-Y129 HydrophobicContact CD2-CE2 3.79Å; L125-Y129 WeakPolarHBondContact O-CB 3.43Å; L125-Y129 WeakPolarHBondContact O-CD2 3.42Å; L125-Y129 PolarHBondContact O-N 3.47Å; Y129-F165 HydrophobicContact CE2-CE2 4.43Å; Y129-F165 AromaticContact CZ-CE2 3.98Å; Y129-F165 WeakPolarHBondContact OH-CZ 3.47Å
130	M	95.2	Very high	93.6	Very high	9 Å²	9	30 Å²	30	4%	0.044	15%	0.152	C	C	.	.	S	Bend	trans	-138.2	52	-179	-59.5	178.2	77.8	0	0	111.4	L72 Y74 C77 L82 Y84 L105 C126	L72-M130 HydrophobicContact CD2-CE 3.7Å; Y74-M130 WeakPolarHBondContact O-CE 3.39Å; C77-M130 HydrophobicContact CB-SD 3.77Å; L82-M130 HydrophobicContact CD1-CB 4.16Å; L82-M130 HydrophobicContact CD1-CE 3.73Å; L82-M130 HydrophobicContact CD1-SD 4.44Å; Y84-M130 WeakPolarHBondContact CE2-O 3.47Å; Y84-M130 PolarHBondContact OH-O 3.32Å; L105-M130 HydrophobicContact CD1-CG 3.9Å; L105-M130 HydrophobicContact CD1-SD 3.58Å; L105-M130 VanDerWaalsContact CD1-SD 3.58Å; C126-M130 CarbonylContact O-C 3.49Å; C126-M130 WeakPolarHBondContact O-CA 3.5Å; C126-M130 PolarHBondContact O-N 3.31Å
131	P	95.2	Very high	93.8	Very high	3 Å²	3	28.7 Å²	28.7	2%	0.019	14%	0.144	C	C	.	.			trans	-66.1	158.9	-177	31.4	-37.7	0	0	0	112.2	T87 S88 L91 C133 V138	T87-P131 VanDerWaalsContact CA-O 3.3Å; T87-P131 WeakPolarHBondContact CA-O 3.28Å; T87-P131 PolarHBondContact OG1-O 2.86Å; S88-P131 WeakPolarHBondContact O-CD 3.49Å; S88-P131 VanDerWaalsContact O-CG 3.26Å; S88-P131 WeakPolarHBondContact O-CG 3.47Å; L91-P131 HydrophobicContact CD1-CB 3.94Å; L91-P131 HydrophobicContact CD1-CG 3.99Å; L91-P131 HydrophobicContact CG-CG 4.33Å; P131-C133 PolarHBondContact O-N 3.23Å; P131-V138 HydrophobicContact CB-CG2 3.59Å; P131-V138 HydrophobicContact CG-CG2 3.43Å; P131-V138 VanDerWaalsContact CG-CG2 3.43Å
132	K	94.3	Very high	93.8	Very high	32 Å²	32	28.7 Å²	28.7	14%	0.139	14%	0.144	C	C	.	.			trans	-69.7	128.9	170.1	179.8	173.3	158.5	-147	0	110.1	Y84 E134 E139 E180	Y84-K132 HydrophobicContact CD1-CB 3.76Å; Y84-K132 HydrophobicContact CD1-CD 3.93Å; Y84-K132 HydrophobicContact CD1-CG 3.94Å; Y84-K132 HydrophobicContact CD2-CB 4.11Å; Y84-K132 HydrophobicContact CD2-CG 4.42Å; Y84-K132 HydrophobicContact CE1-CB 3.87Å; Y84-K132 HydrophobicContact CE2-CB 4.2Å; Y84-K132 HydrophobicContact CG-CB 3.9Å; Y84-K132 HydrophobicContact CG-CD 4.28Å; Y84-K132 HydrophobicContact CG-CG 3.88Å; K132-E134 IonicContact NZ-OE2 2.77Å; K132-E139 HydrophobicContact CB-CG 4.44Å; K132-E139 WeakPolarHBondContact CD-OE1 3.48Å; K132-E139 VanDerWaalsContact CE-OE1 3.28Å; K132-E139 WeakPolarHBondContact CE-OE1 3.49Å; K132-E139 IonicContact NZ-OE1 3.98Å; K132-E139 PolarHBondContact NZ-OE1 3.02Å; K132-E139 PolarHBondContact O-N 3.44Å; K132-E180 HydrophobicContact CD-CB 4.42Å; K132-E180 HydrophobicContact CD-CG 4Å; K132-E180 IonicContact NZ-OE1 3.82Å; K132-E180 PolarHBondContact NZ-OE1 2.98Å
133	C	93.6	Very high	93.8	Very high	7 Å²	7	32 Å²	32	5%	0.047	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	128.2	172.8	-163.7	0	0	0	0	110	C69 A86 P131 R137	C69-C133 WeakPolarHBondContact CA-SG 3.36Å; C69-C133 HydrophobicContact CB-CB 3.75Å; C69-C133 WeakPolarHBondContact CB-SG 3.38Å; C69-C133 WeakPolarHBondContact SG-CB 3.23Å; C69-C133 CovalentContact SG-SG 2.04Å; C69-C133 PolarHBondContact SG-SG 3.48Å; A86-C133 PolarHBondContact O-N 3.23Å; P131-C133 PolarHBondContact O-N 3.23Å; C133-R137 WeakPolarHBondContact CA-O 3.47Å
134	E	92.9	Very high	93.8	Very high	112 Å²	112	34.7 Å²	34.7	52%	0.523	17%	0.172	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.3	129.9	-178.1	-161.4	-176.8	157.8	0	0	109.8	C69 K132 D136 R137	C69-E134 PolarHBondContact SG-N 2.9Å; C69-E134 VanDerWaalsContact SG-N 3.43Å; K132-E134 IonicContact NZ-OE2 2.77Å; E134-D136 PolarHBondContact O-N 3.29Å; E134-R137 PolarHBondContact N-O 3.01Å; E134-R137 WeakPolarHBondContact O-CB 3.4Å; E134-R137 PolarHBondContact O-N 3.32Å
135	N	90.9	Very high	93.7	Very high	145 Å²	145	35.5 Å²	35.5	78%	0.775	18%	0.177	S	C	*	.	T	Hydrogen-bonded Turn	trans	52.4	51.9	-179.3	-53.8	-55.9	0	0	0	113.9	R137	N135-R137 PolarHBondContact O-N 3.03Å; N135-R137 VanDerWaalsContact O-N 3.17Å
136	D	91.6	Very high	93.7	Very high	104 Å²	104	35.4 Å²	35.4	56%	0.556	18%	0.176	S	C	*	.	T	Hydrogen-bonded Turn	trans	52.3	31.6	-176.4	-64.5	-39.5	0	0	0	114.8	A66 A67 C69 E134	A66-D136 WeakPolarHBondContact CA-O 3.46Å; A67-D136 PolarHBondContact N-O 3.48Å; A67-D136 CarbonylContact O-C 3.53Å; A67-D136 WeakPolarHBondContact O-CA 3.35Å; C69-D136 PolarHBondContact N-OD1 2.95Å; E134-D136 PolarHBondContact O-N 3.29Å
137	R	92.1	Very high	93.7	Very high	76 Å²	76	39.7 Å²	39.7	29%	0.287	20%	0.196	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.4	122.8	177.6	-172.8	173.7	173	-160.7	-11.1	110.5	P59 L60 R65 C133 E134 N135	P59-R137 PolarHBondContact O-NH1 3.43Å; P59-R137 PolarHBondContact O-NH2 3.36Å; P59-R137 VanDerWaalsContact O-NH2 3.09Å; L60-R137 PolarHBondContact O-NH2 3.01Å; R65-R137 CarbonylContact O-C 3.54Å; R65-R137 WeakPolarHBondContact O-CA 3.34Å; C133-R137 WeakPolarHBondContact CA-O 3.47Å; E134-R137 PolarHBondContact N-O 3.01Å; E134-R137 WeakPolarHBondContact O-CB 3.4Å; E134-R137 PolarHBondContact O-N 3.32Å; N135-R137 PolarHBondContact O-N 3.03Å; N135-R137 VanDerWaalsContact O-N 3.17Å
138	V	93.6	Very high	93.6	Very high	1 Å²	1	41.9 Å²	41.9	1%	0.006	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91	135.9	174.5	66.3	0	0	0	0	110.4	G64 R65 A67 L91 P131	G64-V138 CarbonylContact C-O 3.5Å; G64-V138 WeakPolarHBondContact CA-O 3.34Å; R65-V138 HydrophobicContact CB-CG1 4Å; R65-V138 PolarHBondContact N-O 2.97Å; R65-V138 PolarHBondContact O-N 3.46Å; A67-V138 HydrophobicContact CB-CB 4.18Å; A67-V138 HydrophobicContact CB-CG1 3.83Å; L91-V138 HydrophobicContact CD1-CG2 4.18Å; L91-V138 HydrophobicContact CD2-CG1 4.27Å; L91-V138 HydrophobicContact CG-CG2 4.33Å; P131-V138 HydrophobicContact CB-CG2 3.59Å; P131-V138 HydrophobicContact CG-CG2 3.43Å; P131-V138 VanDerWaalsContact CG-CG2 3.43Å
139	E	92	Very high	93.5	Very high	54 Å²	54	41.8 Å²	41.8	25%	0.252	21%	0.213	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.3	137.7	173.8	-68.2	-177.1	177.8	0	0	111.1	K132	K132-E139 HydrophobicContact CB-CG 4.44Å; K132-E139 WeakPolarHBondContact CD-OE1 3.48Å; K132-E139 VanDerWaalsContact CE-OE1 3.28Å; K132-E139 WeakPolarHBondContact CE-OE1 3.49Å; K132-E139 IonicContact NZ-OE1 3.98Å; K132-E139 PolarHBondContact NZ-OE1 3.02Å; K132-E139 PolarHBondContact O-N 3.44Å
140	L	92.9	Very high	93.3	Very high	10 Å²	10	44.2 Å²	44.2	5%	0.052	22%	0.223	C	C	.	.	P	Polyproline II helix	trans	-95.6	130.9	176.3	-70.5	171.8	0	0	0	111.3	C63 L91 P174	C63-L140 PolarHBondContact O-N 3.14Å; L91-L140 HydrophobicContact CD1-CD2 4.33Å; L91-L140 HydrophobicContact CD2-CD2 3.55Å; L140-P174 HydrophobicContact CB-CG 3.95Å; L140-P174 HydrophobicContact CD1-CG 4.25Å
141	P	94.8	Very high	93	Very high	7 Å²	7	45.9 Å²	45.9	5%	0.045	24%	0.242	C	C	.	.	P	Polyproline II helix	trans	-62.4	142.1	174.3	24.2	-33	0	0	0	111.9	A127 V128 L145 F173	A127-P141 HydrophobicContact CB-CB 4Å; V128-P141 HydrophobicContact CG2-CG 4.12Å; P141-L145 HydrophobicContact CB-CD2 4.18Å; P141-F173 HydrophobicContact CB-CD1 3.93Å; P141-F173 HydrophobicContact CB-CE1 3.87Å; P141-F173 HydrophobicContact CG-CD1 3.65Å; P141-F173 HydrophobicContact CG-CE1 3.39Å; P141-F173 HydrophobicContact CG-CZ 4.34Å; P141-F173 WeakPolarHBondContact O-CA 3.35Å
142	S	94.3	Very high	92.7	Very high	1 Å²	1	47 Å²	47	1%	0.007	25%	0.25	C	C	.	.	P	Polyproline II helix	trans	-70.7	157	178.6	69.2	0	0	0	0	113.6	T144 L145 C146 P174 N179	S142-T144 PolarHBondContact O-N 3.46Å; S142-T144 PolarHBondContact OG-OG1 3.34Å; S142-L145 PolarHBondContact O-N 3.46Å; S142-L145 PolarHBondContact OG-N 2.91Å; S142-C146 PolarHBondContact O-N 3.47Å; S142-P174 CarbonylContact C-O 3.52Å; S142-P174 WeakPolarHBondContact CA-O 3.49Å; S142-N179 VanDerWaalsContact CB-OD1 3.27Å; S142-N179 WeakPolarHBondContact CB-OD1 3.38Å; S142-N179 PolarHBondContact N-OD1 3.22Å; S142-N179 PolarHBondContact OG-ND2 2.94Å; S142-N179 PolarHBondContact OG-OD1 3.03Å
143	R	93.5	Very high	92.5	Very high	73 Å²	73	45.5 Å²	45.5	28%	0.275	24%	0.243	S	C	.	.	H	α-helix	trans	-60.7	-38	173.3	-173.8	145.7	154.1	148.1	1	114.3	L145 C146 Q147 F173 P174 E175	R143-L145 VanDerWaalsContact C-N 3.32Å; R143-L145 PolarHBondContact O-N 3.02Å; R143-C146 PolarHBondContact O-N 3.4Å; R143-Q147 HydrophobicContact CG-CG 4.17Å; R143-Q147 WeakPolarHBondContact O-CB 3.29Å; R143-Q147 WeakPolarHBondContact O-CG 3.49Å; R143-Q147 PolarHBondContact O-N 3.48Å; R143-F173 HydrophobicContact CB-CB 4.41Å; R143-F173 WeakPolarHBondContact CB-O 3.2Å; R143-P174 PolarHBondContact N-O 3.43Å; R143-E175 HydrophobicContact CB-CG 4.23Å; R143-E175 WeakPolarHBondContact CB-OE1 3.44Å; R143-E175 WeakPolarHBondContact CD-OE1 3.43Å; R143-E175 VanDerWaalsContact CG-OE1 3.23Å; R143-E175 WeakPolarHBondContact CG-OE1 3.37Å; R143-E175 IonicContact NE-OE1 2.8Å; R143-E175 PolarHBondContact NE-OE1 2.91Å; R143-E175 VanDerWaalsContact NE-OE1 3.11Å
144	T	92.9	Very high	92.2	Very high	78 Å²	78	47.2 Å²	47.2	48%	0.479	26%	0.258	S	S	.	.	H	α-helix	trans	-63.7	-38.5	178.6	55.6	0	0	0	0	111.8	S142 Q147 A148	S142-T144 PolarHBondContact O-N 3.46Å; S142-T144 PolarHBondContact OG-OG1 3.34Å; T144-Q147 PolarHBondContact O-N 3.41Å; T144-A148 WeakPolarHBondContact O-CB 3.4Å; T144-A148 PolarHBondContact O-N 2.99Å
145	L	93.2	Very high	91.8	Very high	18 Å²	18	42 Å²	42	9%	0.094	23%	0.233	C	C	.	.	H	α-helix	trans	-62.4	-43.3	173.8	-179.7	64.1	0	0	0	111.8	P123 L124 A127 P141 S142 R143 N179 V181	P123-L145 HydrophobicContact CB-CD1 4.12Å; L124-L145 HydrophobicContact CB-CG 4.4Å; L124-L145 HydrophobicContact CD1-CD2 4.42Å; L124-L145 HydrophobicContact CD1-CG 4.23Å; A127-L145 HydrophobicContact CB-CD2 4.02Å; P141-L145 HydrophobicContact CB-CD2 4.18Å; S142-L145 PolarHBondContact O-N 3.46Å; S142-L145 PolarHBondContact OG-N 2.91Å; R143-L145 VanDerWaalsContact C-N 3.32Å; R143-L145 PolarHBondContact O-N 3.02Å; L145-N179 HydrophobicContact CD2-CB 4.5Å; L145-V181 HydrophobicContact CD2-CG2 3.76Å
146	C	94.7	Very high	91.6	Very high	0 Å²	0	35.1 Å²	35.1	0%	0	20%	0.196	C	C	.	.	H	α-helix	trans	-66.1	-46.5	176.3	-171.6	0	0	0	0	112	L124 S142 R143 A148 T149 C168 F173	L124-C146 HydrophobicContact CD1-CB 4.33Å; S142-C146 PolarHBondContact O-N 3.47Å; R143-C146 PolarHBondContact O-N 3.4Å; C146-A148 VanDerWaalsContact C-N 3.33Å; C146-A148 PolarHBondContact O-N 2.87Å; C146-T149 PolarHBondContact O-N 2.85Å; C146-T149 PolarHBondContact O-OG1 2.92Å; C146-C168 HydrophobicContact CB-CB 3.83Å; C146-C168 WeakPolarHBondContact CB-SG 3.48Å; C146-C168 WeakPolarHBondContact SG-CA 3.32Å; C146-C168 WeakPolarHBondContact SG-CB 3.31Å; C146-C168 CovalentContact SG-SG 2.04Å; C146-C168 PolarHBondContact SG-SG 3.38Å; C146-F173 HydrophobicContact CB-CB 4.37Å; C146-F173 HydrophobicContact CB-CD1 3.56Å; C146-F173 HydrophobicContact CB-CD2 4.31Å; C146-F173 HydrophobicContact CB-CE1 3.85Å; C146-F173 HydrophobicContact CB-CG 3.82Å; C146-F173 HydrophobicContact CB-CZ 4.34Å
147	Q	94.2	Very high	91.4	Very high	90 Å²	90	35.9 Å²	35.9	42%	0.421	20%	0.197	S	C	.	.	H	α-helix	trans	-62.5	-36.5	-178.7	-75.5	179.1	-17.7	0	0	112.9	R143 T144 T149 R150	R143-Q147 HydrophobicContact CG-CG 4.17Å; R143-Q147 WeakPolarHBondContact O-CB 3.29Å; R143-Q147 WeakPolarHBondContact O-CG 3.49Å; R143-Q147 PolarHBondContact O-N 3.48Å; T144-Q147 PolarHBondContact O-N 3.41Å; Q147-T149 PolarHBondContact O-N 3.11Å; Q147-R150 PolarHBondContact O-N 3.4Å
148	A	93.1	Very high	90.9	Very high	54 Å²	54	39.8 Å²	39.8	45%	0.446	21%	0.211	S	C	.	.	H	α-helix	trans	-56.5	-24.8	177.1	0	0	0	0	0	113.8	T144 C146	T144-A148 WeakPolarHBondContact O-CB 3.4Å; T144-A148 PolarHBondContact O-N 2.99Å; C146-A148 VanDerWaalsContact C-N 3.33Å; C146-A148 PolarHBondContact O-N 2.87Å
149	T	93.3	Very high	90.2	Very high	0 Å²	0	44.1 Å²	44.1	0%	0	23%	0.232	C	C	.	.	H	α-helix	trans	-80.4	-24.7	176.6	65.8	0	0	0	0	114.1	V120 I121 L124 C146 Q147 G151 C153	V120-T149 HydrophobicContact CG2-CG2 4.29Å; V120-T149 WeakPolarHBondContact O-CG2 3.36Å; I121-T149 HydrophobicContact CB-CG2 4.37Å; I121-T149 HydrophobicContact CG1-CG2 4.22Å; L124-T149 HydrophobicContact CB-CG2 4.11Å; L124-T149 HydrophobicContact CD2-CG2 3.56Å; L124-T149 HydrophobicContact CG-CG2 4.46Å; C146-T149 PolarHBondContact O-N 2.85Å; C146-T149 PolarHBondContact O-OG1 2.92Å; Q147-T149 PolarHBondContact O-N 3.11Å; T149-G151 PolarHBondContact O-N 2.94Å; T149-C153 WeakPolarHBondContact O-CB 3.11Å; T149-C153 PolarHBondContact O-N 2.82Å
150	R	91.9	Very high	89.6	Confident	55 Å²	55	48.3 Å²	48.3	21%	0.208	25%	0.245	C	C	.	.	H	α-helix	trans	-66.9	-34.6	-164.8	-65.4	-58	108.5	140.3	15.1	114.4	Q147 W162 L166	Q147-R150 PolarHBondContact O-N 3.4Å; R150-W162 VanDerWaalsContact CZ-CE2 3.44Å; R150-W162 VanDerWaalsContact NH1-CG 3.26Å; R150-L166 VanDerWaalsContact CZ-O 3.32Å; R150-L166 PolarHBondContact NH1-O 3.4Å; R150-L166 PolarHBondContact NH2-O 3.15Å
151	G	89.1	Confident	89.3	Confident	44 Å²	44	49 Å²	49	45%	0.454	25%	0.254	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.3	-73.9	173.3	0	0	0	0	0	111.9	T149 C153 A154	T149-G151 PolarHBondContact O-N 2.94Å; G151-C153 PolarHBondContact O-N 2.98Å; G151-C153 VanDerWaalsContact O-N 3.12Å; G151-A154 PolarHBondContact O-N 3.06Å; G151-A154 VanDerWaalsContact O-N 3.15Å
152	P	88.9	Confident	89.1	Confident	27 Å²	27	49.2 Å²	49.2	18%	0.175	25%	0.254	C	S	.	.	T	Hydrogen-bonded Turn	trans	-67.5	-17.7	-169.6	28.2	-38.3	0	0	0	114.8	R116 C117 V120 E210	R116-P152 HydrophobicContact CB-CB 4.34Å; C117-P152 WeakPolarHBondContact CB-O 3.37Å; V120-P152 HydrophobicContact CG2-CB 4.49Å; V120-P152 HydrophobicContact CG2-CG 3.53Å; P152-E210 WeakPolarHBondContact CA-OE2 3.48Å; P152-E210 WeakPolarHBondContact CB-OE2 3.48Å
153	C	89.9	Confident	89	Confident	0 Å²	0	50.6 Å²	50.6	0%	0	26%	0.264	C	S	.	.	T	Hydrogen-bonded Turn	trans	-101.7	28.5	175.7	-59.6	0	0	0	0	113.7	C117 T149 G151 I155 V156 W162	C117-C153 WeakPolarHBondContact CA-SG 3.47Å; C117-C153 HydrophobicContact CB-CB 4Å; C117-C153 WeakPolarHBondContact CB-SG 3.49Å; C117-C153 VanDerWaalsContact SG-CA 3.55Å; C117-C153 WeakPolarHBondContact SG-CB 3.21Å; C117-C153 CovalentContact SG-SG 2.04Å; C117-C153 PolarHBondContact SG-SG 3.23Å; T149-C153 WeakPolarHBondContact O-CB 3.11Å; T149-C153 PolarHBondContact O-N 2.82Å; G151-C153 PolarHBondContact O-N 2.98Å; G151-C153 VanDerWaalsContact O-N 3.12Å; C153-I155 PolarHBondContact O-N 3.4Å; C153-I155 VanDerWaalsContact O-N 3.08Å; C153-V156 HydrophobicContact CB-CG2 4.08Å; C153-V156 WeakPolarHBondContact O-CB 3.32Å; C153-V156 PolarHBondContact O-N 3.47Å; C153-W162 HydrophobicContact CB-CH2 4.04Å; C153-W162 HydrophobicContact CB-CZ2 3.9Å
154	A	87.4	Confident	88.9	Confident	43 Å²	43	51.6 Å²	51.6	36%	0.355	27%	0.274	S	S	.	.	H	α-helix	trans	-51.9	-29.8	175.7	0	0	0	0	0	113.7	G151 V156 E157 R158	G151-A154 PolarHBondContact O-N 3.06Å; G151-A154 VanDerWaalsContact O-N 3.15Å; A154-V156 PolarHBondContact O-N 3.42Å; A154-E157 WeakPolarHBondContact O-CB 3.4Å; A154-E157 PolarHBondContact O-N 3.49Å; A154-R158 PolarHBondContact O-N 3.11Å; A154-R158 VanDerWaalsContact O-N 3.08Å
155	I	83.7	Confident	88.9	Confident	2 Å²	2	48.9 Å²	48.9	1%	0.01	26%	0.256	C	S	.	.	H	α-helix	trans	-53.7	-35.2	173.5	-167.2	157.6	0	0	0	113.7	L111 C153 E157 E159 D208 V209 L488 V493	L111-I155 HydrophobicContact CD2-CG2 3.84Å; C153-I155 PolarHBondContact O-N 3.4Å; C153-I155 VanDerWaalsContact O-N 3.08Å; I155-E157 VanDerWaalsContact C-N 3.31Å; I155-E157 PolarHBondContact O-N 2.97Å; I155-E159 HydrophobicContact CG1-CG 4Å; I155-E159 WeakPolarHBondContact O-CB 3.42Å; I155-E159 WeakPolarHBondContact O-CG 3.47Å; I155-E159 PolarHBondContact O-N 3.17Å; I155-D208 WeakPolarHBondContact CB-O 3.36Å; I155-V209 HydrophobicContact CD1-CG2 4.13Å; I155-L488 HydrophobicContact CD1-CD2 4.47Å; I155-V493 HydrophobicContact CD1-CB 4.35Å; I155-V493 HydrophobicContact CD1-CG1 3.88Å; I155-V493 HydrophobicContact CD1-CG2 4.23Å; I155-V493 HydrophobicContact CG1-CG1 4.33Å
156	V	86.2	Confident	89	Confident	0 Å²	0	48 Å²	48	0%	0	25%	0.252	C	S	.	.	H	α-helix	trans	-65.9	-38.5	177.9	-177.7	0	0	0	0	110.5	W108 L111 I121 C153 A154 R160 G161 W162 I495	W108-V156 HydrophobicContact CH2-CG1 3.8Å; W108-V156 HydrophobicContact CZ3-CG1 3.77Å; W108-V156 HydrophobicContact CZ3-CG2 4.17Å; L111-V156 HydrophobicContact CD1-CG2 3.81Å; L111-V156 HydrophobicContact CD2-CG2 4.1Å; I121-V156 HydrophobicContact CD1-CG2 4.45Å; C153-V156 HydrophobicContact CB-CG2 4.08Å; C153-V156 WeakPolarHBondContact O-CB 3.32Å; C153-V156 PolarHBondContact O-N 3.47Å; A154-V156 PolarHBondContact O-N 3.42Å; V156-R160 PolarHBondContact O-N 2.99Å; V156-G161 WeakPolarHBondContact O-CA 3.23Å; V156-G161 PolarHBondContact O-N 3.1Å; V156-W162 HydrophobicContact CB-CD2 4.34Å; V156-W162 HydrophobicContact CB-CH2 4.02Å; V156-W162 HydrophobicContact CB-CZ2 3.81Å; V156-W162 HydrophobicContact CB-CZ3 4.37Å; V156-W162 HydrophobicContact CG1-CD2 3.83Å; V156-W162 HydrophobicContact CG1-CE3 3.75Å; V156-W162 HydrophobicContact CG1-CH2 4.03Å; V156-W162 HydrophobicContact CG1-CZ2 4.1Å; V156-W162 HydrophobicContact CG1-CZ3 3.85Å; V156-W162 HydrophobicContact CG2-CH2 4.08Å; V156-W162 HydrophobicContact CG2-CZ2 4.23Å; V156-I495 HydrophobicContact CG2-CD1 4.11Å
157	E	86.9	Confident	89	Confident	120 Å²	120	53.8 Å²	53.8	56%	0.561	27%	0.273	S	S	*	.	H	α-helix	trans	-72.9	-41.1	-179.8	-165.4	160.7	165.6	0	0	112.2	A154 I155 G161 W162	A154-E157 WeakPolarHBondContact O-CB 3.4Å; A154-E157 PolarHBondContact O-N 3.49Å; I155-E157 VanDerWaalsContact C-N 3.31Å; I155-E157 PolarHBondContact O-N 2.97Å; E157-G161 WeakPolarHBondContact O-CA 3.4Å; E157-G161 PolarHBondContact O-N 3.32Å; E157-W162 PolarHBondContact OE2-NE1 3.32Å
158	R	81.9	Confident	89	Confident	158 Å²	158	50.9 Å²	50.9	60%	0.596	26%	0.263	S	S	*	.	H	α-helix	trans	-71.7	-46.5	-178.8	-170.3	-171.3	-64.2	-86.7	13.9	113.2	A154 D208	A154-R158 PolarHBondContact O-N 3.11Å; A154-R158 VanDerWaalsContact O-N 3.08Å; R158-D208 WeakPolarHBondContact CD-OD2 3.33Å; R158-D208 IonicContact CZ-OD1 3.78Å; R158-D208 IonicContact CZ-OD2 3.73Å; R158-D208 IonicContact NE-OD1 3.43Å; R158-D208 PolarHBondContact NE-OD1 3.41Å; R158-D208 IonicContact NE-OD2 2.68Å; R158-D208 PolarHBondContact NE-OD2 3.48Å; R158-D208 IonicContact NH2-OD1 3.92Å; R158-D208 PolarHBondContact NH2-OD1 3.3Å; R158-D208 IonicContact NH2-OD2 3.12Å
159	E	78.4	Confident	89	Confident	93 Å²	93	50.4 Å²	50.4	44%	0.435	25%	0.254	S	S	.	.	H	α-helix	trans	-90.1	-27.9	-168.5	-58.4	-61.5	140.9	0	0	113	I155 R484	I155-E159 HydrophobicContact CG1-CG 4Å; I155-E159 WeakPolarHBondContact O-CB 3.42Å; I155-E159 WeakPolarHBondContact O-CG 3.47Å; I155-E159 PolarHBondContact O-N 3.17Å; E159-R484 IonicContact OE1-CZ 2.64Å; E159-R484 IonicContact OE1-NH1 3.04Å; E159-R484 IonicContact OE1-NH2 3.12Å; E159-R484 PolarHBondContact OE1-NH2 2.74Å
160	R	80.3	Confident	88.8	Confident	141 Å²	141	54.8 Å²	54.8	53%	0.532	28%	0.282	S	S	.	.	T	Hydrogen-bonded Turn	trans	-129.4	-29.4	179.2	-169.8	175.3	-177.7	96	0.7	114.8	V156 I495 G496	V156-R160 PolarHBondContact O-N 2.99Å; R160-I495 WeakPolarHBondContact CD-O 3.49Å; R160-I495 PolarHBondContact NH1-O 2.91Å; R160-G496 VanDerWaalsContact NH1-CA 3.35Å; R160-G496 PolarHBondContact NH1-O 3.3Å
161	G	86.9	Confident	88.6	Confident	24 Å²	24	56.5 Å²	56.5	25%	0.247	30%	0.296	C	S	.	.			trans	80.8	143.6	-166.8	0	0	0	0	0	112.1	V156 E157 P163	V156-G161 WeakPolarHBondContact O-CA 3.23Å; V156-G161 PolarHBondContact O-N 3.1Å; E157-G161 WeakPolarHBondContact O-CA 3.4Å; E157-G161 PolarHBondContact O-N 3.32Å; G161-P163 WeakPolarHBondContact O-CD 3.3Å
162	W	90.4	Very high	88.7	Confident	12 Å²	12	58.9 Å²	58.9	5%	0.045	29%	0.291	C	S	.	.			trans	-68.9	124.9	177.6	-72	104.8	0	0	0	111.6	I121 R150 C153 V156 E157 L166 R167	I121-W162 HydrophobicContact CD1-CH2 3.98Å; I121-W162 HydrophobicContact CD1-CZ3 4.25Å; R150-W162 VanDerWaalsContact CZ-CE2 3.44Å; R150-W162 VanDerWaalsContact NH1-CG 3.26Å; C153-W162 HydrophobicContact CB-CH2 4.04Å; C153-W162 HydrophobicContact CB-CZ2 3.9Å; V156-W162 HydrophobicContact CB-CD2 4.34Å; V156-W162 HydrophobicContact CB-CH2 4.02Å; V156-W162 HydrophobicContact CB-CZ2 3.81Å; V156-W162 HydrophobicContact CB-CZ3 4.37Å; V156-W162 HydrophobicContact CG1-CD2 3.83Å; V156-W162 HydrophobicContact CG1-CE3 3.75Å; V156-W162 HydrophobicContact CG1-CH2 4.03Å; V156-W162 HydrophobicContact CG1-CZ2 4.1Å; V156-W162 HydrophobicContact CG1-CZ3 3.85Å; V156-W162 HydrophobicContact CG2-CH2 4.08Å; V156-W162 HydrophobicContact CG2-CZ2 4.23Å; E157-W162 PolarHBondContact OE2-NE1 3.32Å; W162-L166 HydrophobicContact CE3-CB 4Å; W162-L166 HydrophobicContact CZ3-CB 4.48Å; W162-R167 HydrophobicContact CB-CG 4.12Å; W162-R167 PolarHBondContact O-NE 2.88Å; W162-R167 PolarHBondContact O-NH2 3.44Å
163	P	92.3	Very high	88.9	Confident	31 Å²	31	57.7 Å²	57.7	20%	0.201	28%	0.283	C	S	.	.			trans	-59.9	150.4	171.9	-23.4	34.1	0	0	0	112.2	W108 G161 F165 L166 R167	W108-P163 HydrophobicContact CZ2-CG 4.29Å; G161-P163 WeakPolarHBondContact O-CD 3.3Å; P163-F165 VanDerWaalsContact C-N 3.25Å; P163-F165 HydrophobicContact CB-CD1 3.79Å; P163-F165 HydrophobicContact CB-CE1 3.41Å; P163-F165 VanDerWaalsContact CB-CE1 3.41Å; P163-F165 HydrophobicContact CB-CZ 4.03Å; P163-F165 HydrophobicContact CG-CE1 4.21Å; P163-F165 HydrophobicContact CG-CZ 4.43Å; P163-F165 PolarHBondContact O-N 3.37Å; P163-F165 VanDerWaalsContact O-N 3.15Å; P163-L166 HydrophobicContact CG-CD1 4.37Å; P163-L166 CarbonylContact O-C 3.56Å; P163-L166 WeakPolarHBondContact O-CA 3.22Å; P163-L166 PolarHBondContact O-N 2.87Å; P163-R167 PolarHBondContact O-N 2.97Å
164	D	92	Very high	89.1	Confident	94 Å²	94	58.2 Å²	58.2	50%	0.503	29%	0.287	S	S	.	.	G	3₁₀ helix	trans	-58	-33.8	-173.5	-70.2	-51.7	0	0	0	114.3	L166 R167	D164-L166 VanDerWaalsContact C-N 3.3Å; D164-L166 PolarHBondContact O-N 3.07Å; D164-R167 PolarHBondContact O-N 3.16Å; D164-R167 IonicContact OD1-CZ 2.74Å; D164-R167 IonicContact OD1-NE 3.11Å; D164-R167 PolarHBondContact OD1-NE 3.37Å; D164-R167 IonicContact OD1-NH1 2.91Å; D164-R167 PolarHBondContact OD1-NH1 3.39Å; D164-R167 IonicContact OD1-NH2 2.76Å
165	F	93	Very high	89.3	Confident	20 Å²	20	60.9 Å²	60.9	9%	0.088	29%	0.292	C	S	.	.	G	3₁₀ helix	trans	-74.9	-15.7	176.4	67.7	-85.6	0	0	0	114	D94 V128 Y129 P163 F173	D94-F165 HydrophobicContact CB-CE1 3.76Å; D94-F165 HydrophobicContact CB-CZ 4.04Å; D94-F165 WeakPolarHBondContact OD1-CZ 3.46Å; D94-F165 WeakPolarHBondContact OD2-CZ 3.36Å; V128-F165 HydrophobicContact CG1-CD2 3.79Å; V128-F165 HydrophobicContact CG1-CE2 4.08Å; Y129-F165 HydrophobicContact CE2-CE2 4.43Å; Y129-F165 AromaticContact CZ-CE2 3.98Å; Y129-F165 WeakPolarHBondContact OH-CZ 3.47Å; P163-F165 VanDerWaalsContact C-N 3.25Å; P163-F165 HydrophobicContact CB-CD1 3.79Å; P163-F165 HydrophobicContact CB-CE1 3.41Å; P163-F165 VanDerWaalsContact CB-CE1 3.41Å; P163-F165 HydrophobicContact CB-CZ 4.03Å; P163-F165 HydrophobicContact CG-CE1 4.21Å; P163-F165 HydrophobicContact CG-CZ 4.43Å; P163-F165 PolarHBondContact O-N 3.37Å; P163-F165 VanDerWaalsContact O-N 3.15Å; F165-F173 WeakPolarHBondContact O-CE2 3.25Å
166	L	94.5	Very high	89.3	Confident	1 Å²	1	64 Å²	64	1%	0.005	32%	0.324	C	S	.	.	G	3₁₀ helix	trans	-105.1	9.2	174.2	-68.9	173.8	0	0	0	113.3	W108 L124 V128 R150 W162 P163 D164	W108-L166 HydrophobicContact CH2-CD1 4Å; W108-L166 HydrophobicContact CZ2-CD1 3.54Å; L124-L166 HydrophobicContact CD2-CD2 4.48Å; L124-L166 HydrophobicContact CG-CD2 4.5Å; V128-L166 HydrophobicContact CB-CD2 4.36Å; V128-L166 HydrophobicContact CG1-CD2 4.12Å; V128-L166 HydrophobicContact CG2-CD2 4.09Å; R150-L166 VanDerWaalsContact CZ-O 3.32Å; R150-L166 PolarHBondContact NH1-O 3.4Å; R150-L166 PolarHBondContact NH2-O 3.15Å; W162-L166 HydrophobicContact CE3-CB 4Å; W162-L166 HydrophobicContact CZ3-CB 4.48Å; P163-L166 HydrophobicContact CG-CD1 4.37Å; P163-L166 CarbonylContact O-C 3.56Å; P163-L166 WeakPolarHBondContact O-CA 3.22Å; P163-L166 PolarHBondContact O-N 2.87Å; D164-L166 VanDerWaalsContact C-N 3.3Å; D164-L166 PolarHBondContact O-N 3.07Å
167	R	93.7	Very high	89.4	Confident	120 Å²	120	64.4 Å²	64.4	45%	0.453	33%	0.327	S	S	.	.	S	Bend	trans	-83.9	132	170.6	-68.4	176.1	-172.3	-179.4	-8.8	109.6	W162 P163 D164 T169 F173	W162-R167 HydrophobicContact CB-CG 4.12Å; W162-R167 PolarHBondContact O-NE 2.88Å; W162-R167 PolarHBondContact O-NH2 3.44Å; P163-R167 PolarHBondContact O-N 2.97Å; D164-R167 PolarHBondContact O-N 3.16Å; D164-R167 IonicContact OD1-CZ 2.74Å; D164-R167 IonicContact OD1-NE 3.11Å; D164-R167 PolarHBondContact OD1-NE 3.37Å; D164-R167 IonicContact OD1-NH1 2.91Å; D164-R167 PolarHBondContact OD1-NH1 3.39Å; D164-R167 IonicContact OD1-NH2 2.76Å; R167-T169 HydrophobicContact CB-CG2 4.14Å; R167-T169 PolarHBondContact O-N 2.78Å; R167-T169 PolarHBondContact O-OG1 3.46Å; R167-F173 WeakPolarHBondContact O-CD2 3.47Å; R167-F173 WeakPolarHBondContact O-CE2 3.09Å
168	C	94.6	Very high	89.3	Confident	30 Å²	30	63.9 Å²	63.9	20%	0.203	33%	0.332	C	S	.	.			trans	-72	61.3	-175	-48.7	0	0	0	0	113.4	C146	C146-C168 HydrophobicContact CB-CB 3.83Å; C146-C168 WeakPolarHBondContact CB-SG 3.48Å; C146-C168 WeakPolarHBondContact SG-CA 3.32Å; C146-C168 WeakPolarHBondContact SG-CB 3.31Å; C146-C168 CovalentContact SG-SG 2.04Å; C146-C168 PolarHBondContact SG-SG 3.38Å
169	T	93.3	Very high	89.5	Confident	43 Å²	43	57 Å²	57	26%	0.264	31%	0.307	S	S	.	.			trans	-92.4	140.2	-177.8	48.8	0	0	0	0	109.7	R167 D171 R172 F173	R167-T169 HydrophobicContact CB-CG2 4.14Å; R167-T169 PolarHBondContact O-N 2.78Å; R167-T169 PolarHBondContact O-OG1 3.46Å; T169-D171 WeakPolarHBondContact CB-OD1 3.43Å; T169-D171 PolarHBondContact O-N 3.13Å; T169-D171 PolarHBondContact OG1-OD1 3.09Å; T169-R172 PolarHBondContact O-N 3.21Å; T169-R172 VanDerWaalsContact O-N 3.12Å; T169-R172 WeakPolarHBondContact OG1-CD 3.5Å; T169-R172 WeakPolarHBondContact OG1-CG 3.45Å; T169-R172 PolarHBondContact OG1-NE 3.03Å; T169-F173 PolarHBondContact O-N 3.08Å
170	P	89.6	Confident	89.6	Confident	92 Å²	92	55.3 Å²	55.3	60%	0.597	30%	0.299	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.3	-19.1	-168.4	28.2	-35.5	0	0	0	114.3
171	D	88.1	Confident	89.7	Confident	92 Å²	92	48.9 Å²	48.9	49%	0.492	28%	0.275	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.7	-22.4	174.6	57	-63.2	0	0	0	113.8	R65 T169	R65-D171 PolarHBondContact NH2-O 3.07Å; T169-D171 WeakPolarHBondContact CB-OD1 3.43Å; T169-D171 PolarHBondContact O-N 3.13Å; T169-D171 PolarHBondContact OG1-OD1 3.09Å
172	R	89.9	Confident	89.4	Confident	93 Å²	93	54 Å²	54	35%	0.351	29%	0.293	S	S	.	.	T	Hydrogen-bonded Turn	trans	-106.9	-37.2	179.2	-51.4	-179.2	-157.7	-129.7	-1	111.8	T169 P174	T169-R172 PolarHBondContact O-N 3.21Å; T169-R172 VanDerWaalsContact O-N 3.12Å; T169-R172 WeakPolarHBondContact OG1-CD 3.5Å; T169-R172 WeakPolarHBondContact OG1-CG 3.45Å; T169-R172 PolarHBondContact OG1-NE 3.03Å; R172-P174 WeakPolarHBondContact O-CD 3.47Å
173	F	94.6	Very high	89	Confident	2 Å²	2	59.1 Å²	59.1	1%	0.009	32%	0.321	C	S	.	.	S	Bend	trans	-121.5	82	-179.1	-61.5	-84.2	0	0	0	110	L124 V128 P141 R143 C146 F165 R167 T169	L124-F173 HydrophobicContact CD1-CE1 3.6Å; L124-F173 HydrophobicContact CD1-CZ 4.16Å; V128-F173 HydrophobicContact CG2-CE1 4.36Å; V128-F173 HydrophobicContact CG2-CZ 4.27Å; P141-F173 HydrophobicContact CB-CD1 3.93Å; P141-F173 HydrophobicContact CB-CE1 3.87Å; P141-F173 HydrophobicContact CG-CD1 3.65Å; P141-F173 HydrophobicContact CG-CE1 3.39Å; P141-F173 HydrophobicContact CG-CZ 4.34Å; P141-F173 WeakPolarHBondContact O-CA 3.35Å; R143-F173 HydrophobicContact CB-CB 4.41Å; R143-F173 WeakPolarHBondContact CB-O 3.2Å; C146-F173 HydrophobicContact CB-CB 4.37Å; C146-F173 HydrophobicContact CB-CD1 3.56Å; C146-F173 HydrophobicContact CB-CD2 4.31Å; C146-F173 HydrophobicContact CB-CE1 3.85Å; C146-F173 HydrophobicContact CB-CG 3.82Å; C146-F173 HydrophobicContact CB-CZ 4.34Å; F165-F173 WeakPolarHBondContact O-CE2 3.25Å; R167-F173 WeakPolarHBondContact O-CD2 3.47Å; R167-F173 WeakPolarHBondContact O-CE2 3.09Å; T169-F173 PolarHBondContact O-N 3.08Å
174	P	93.1	Very high	88.7	Confident	11 Å²	11	58.4 Å²	58.4	7%	0.071	32%	0.316	C	S	.	.			trans	-65.3	157.2	175.1	24.5	-34.1	0	0	0	113.3	L140 S142 R143 R172 C177	L140-P174 HydrophobicContact CB-CG 3.95Å; L140-P174 HydrophobicContact CD1-CG 4.25Å; S142-P174 CarbonylContact C-O 3.52Å; S142-P174 WeakPolarHBondContact CA-O 3.49Å; R143-P174 PolarHBondContact N-O 3.43Å; R172-P174 WeakPolarHBondContact O-CD 3.47Å; P174-C177 WeakPolarHBondContact CG-SG 3.22Å
175	E	91	Very high	88.4	Confident	100 Å²	100	62.8 Å²	62.8	47%	0.467	33%	0.33	S	S	.	.	S	Bend	trans	-84	149.9	174.4	-70.9	-69.9	-178.2	0	0	111.6	R143 C177	R143-E175 HydrophobicContact CB-CG 4.23Å; R143-E175 WeakPolarHBondContact CB-OE1 3.44Å; R143-E175 WeakPolarHBondContact CD-OE1 3.43Å; R143-E175 VanDerWaalsContact CG-OE1 3.23Å; R143-E175 WeakPolarHBondContact CG-OE1 3.37Å; R143-E175 IonicContact NE-OE1 2.8Å; R143-E175 PolarHBondContact NE-OE1 2.91Å; R143-E175 VanDerWaalsContact NE-OE1 3.11Å; E175-C177 VanDerWaalsContact C-N 3.28Å; E175-C177 PolarHBondContact O-N 2.83Å
176	G	85.6	Confident	88.1	Confident	66 Å²	66	63.8 Å²	63.8	68%	0.68	34%	0.335	S	S	*	.	S	Bend	trans	75.2	3.3	172.2	0	0	0	0	0	116.9
177	C	87	Confident	87.3	Confident	10 Å²	10	70.8 Å²	70.8	7%	0.068	37%	0.372	C	S	.	.			trans	-79.1	144	179.4	-57.7	0	0	0	0	113.3	C63 P174 E175	C63-C177 WeakPolarHBondContact CA-SG 3.23Å; C63-C177 HydrophobicContact CB-CB 3.71Å; C63-C177 WeakPolarHBondContact CB-SG 3.49Å; C63-C177 WeakPolarHBondContact SG-CA 3.33Å; C63-C177 WeakPolarHBondContact SG-CB 3.22Å; C63-C177 CovalentContact SG-SG 2.03Å; C63-C177 PolarHBondContact SG-SG 2.85Å; P174-C177 WeakPolarHBondContact CG-SG 3.22Å; E175-C177 VanDerWaalsContact C-N 3.28Å; E175-C177 PolarHBondContact O-N 2.83Å
178	T	84.9	Confident	86.5	Confident	108 Å²	108	67.1 Å²	67.1	66%	0.663	37%	0.365	S	S	*	.			trans	-72.1	132.5	172.6	46.8	0	0	0	0	110.6
179	N	85.5	Confident	85.6	Confident	13 Å²	13	69.8 Å²	69.8	7%	0.07	38%	0.384	C	S	.	.			trans	-105.6	108.6	177	-49.7	-91.7	0	0	0	109.4	S142 L145 V181 Q182	S142-N179 VanDerWaalsContact CB-OD1 3.27Å; S142-N179 WeakPolarHBondContact CB-OD1 3.38Å; S142-N179 PolarHBondContact N-OD1 3.22Å; S142-N179 PolarHBondContact OG-ND2 2.94Å; S142-N179 PolarHBondContact OG-OD1 3.03Å; L145-N179 HydrophobicContact CD2-CB 4.5Å; N179-V181 HydrophobicContact CB-CG2 3.97Å; N179-V181 PolarHBondContact O-N 2.8Å; N179-V181 VanDerWaalsContact O-N 3.12Å; N179-Q182 HydrophobicContact CB-CG 4.02Å; N179-Q182 PolarHBondContact ND2-NE2 2.93Å; N179-Q182 VanDerWaalsContact ND2-NE2 3.15Å; N179-Q182 WeakPolarHBondContact O-CB 3.45Å; N179-Q182 PolarHBondContact O-N 3.42Å
180	E	81.2	Confident	85	Confident	58 Å²	58	68 Å²	68	27%	0.271	37%	0.373	S	S	.	.	G	3₁₀ helix	trans	-60	-26.9	178.4	-159.8	75.5	112.8	0	0	112.1	Y84 K132 Q182 N183	Y84-E180 HydrophobicContact CD1-CG 4.42Å; Y84-E180 HydrophobicContact CE1-CG 4.42Å; K132-E180 HydrophobicContact CD-CB 4.42Å; K132-E180 HydrophobicContact CD-CG 4Å; K132-E180 IonicContact NZ-OE1 3.82Å; K132-E180 PolarHBondContact NZ-OE1 2.98Å; E180-Q182 PolarHBondContact O-N 3.07Å; E180-N183 WeakPolarHBondContact O-CB 3.36Å; E180-N183 PolarHBondContact O-N 3.26Å; E180-N183 PolarHBondContact OE2-ND2 3.16Å
181	V	82.3	Confident	84.7	Confident	6 Å²	6	69.6 Å²	69.6	4%	0.036	37%	0.373	C	S	.	.	G	3₁₀ helix	trans	-64.1	-15	174	-62.4	0	0	0	0	114.8	P123 C126 A127 L145 N179 N183 I184	P123-V181 HydrophobicContact CB-CB 4.2Å; P123-V181 HydrophobicContact CB-CG2 4.02Å; C126-V181 HydrophobicContact CB-CG1 4.36Å; A127-V181 HydrophobicContact CB-CG1 3.82Å; A127-V181 HydrophobicContact CB-CG2 3.97Å; L145-V181 HydrophobicContact CD2-CG2 3.76Å; N179-V181 HydrophobicContact CB-CG2 3.97Å; N179-V181 PolarHBondContact O-N 2.8Å; N179-V181 VanDerWaalsContact O-N 3.12Å; V181-N183 PolarHBondContact O-N 2.97Å; V181-I184 HydrophobicContact CB-CD1 4.5Å; V181-I184 HydrophobicContact CG1-CD1 4.23Å; V181-I184 PolarHBondContact O-N 3Å
182	Q	80.5	Confident	84.7	Confident	131 Å²	131	66.5 Å²	66.5	61%	0.612	36%	0.359	S	S	*	.	G	3₁₀ helix	trans	-70.1	-23.9	171.4	-74.2	172	-3.6	0	0	112.3	N179 E180 I184	N179-Q182 HydrophobicContact CB-CG 4.02Å; N179-Q182 PolarHBondContact ND2-NE2 2.93Å; N179-Q182 VanDerWaalsContact ND2-NE2 3.15Å; N179-Q182 WeakPolarHBondContact O-CB 3.45Å; N179-Q182 PolarHBondContact O-N 3.42Å; E180-Q182 PolarHBondContact O-N 3.07Å; Q182-I184 VanDerWaalsContact C-N 3.27Å
183	N	82.2	Confident	84.3	Confident	121 Å²	121	66.2 Å²	66.2	65%	0.647	36%	0.361	S	S	*	.	G	3₁₀ helix	trans	-78.1	-14.9	174.3	-62.1	-39.2	0	0	0	112	E180 V181	E180-N183 WeakPolarHBondContact O-CB 3.36Å; E180-N183 PolarHBondContact O-N 3.26Å; E180-N183 PolarHBondContact OE2-ND2 3.16Å; V181-N183 PolarHBondContact O-N 2.97Å
184	I	86.5	Confident	83.6	Confident	15 Å²	15	70.9 Å²	70.9	8%	0.077	39%	0.389	C	S	.	.	S	Bend	trans	-89.3	118.1	-180	-54.2	179.7	0	0	0	109.5	L82 P83 V181 Q182 F186	L82-I184 HydrophobicContact CD2-CD1 3.75Å; P83-I184 HydrophobicContact CG-CG1 4.46Å; V181-I184 HydrophobicContact CB-CD1 4.5Å; V181-I184 HydrophobicContact CG1-CD1 4.23Å; V181-I184 PolarHBondContact O-N 3Å; Q182-I184 VanDerWaalsContact C-N 3.27Å; I184-F186 HydrophobicContact CB-CE2 3.93Å; I184-F186 HydrophobicContact CB-CZ 4.19Å; I184-F186 HydrophobicContact CG2-CD2 4.36Å; I184-F186 HydrophobicContact CG2-CE1 4.2Å; I184-F186 HydrophobicContact CG2-CE2 3.79Å; I184-F186 HydrophobicContact CG2-CZ 3.71Å; I184-F186 WeakPolarHBondContact O-CD2 3.4Å; I184-F186 PolarHBondContact O-N 3.11Å
185	K	85.7	Confident	83.3	Confident	187 Å²	187	70.4 Å²	70.4	81%	0.813	39%	0.386	S	S	*	.			trans	-83.1	116.8	174.1	-68.8	-177.5	179.3	178.8	0	110.3	S80	S80-K185 PolarHBondContact OG-O 3.42Å
186	F	86.4	Confident	83.2	Confident	41 Å²	41	66 Å²	66	18%	0.18	37%	0.366	C	S	.	.			trans	-91.3	104.4	171.7	-64.5	-84.8	0	0	0	109.5	Q122 P123 C126 I184	Q122-F186 HydrophobicContact CB-CB 4.48Å; Q122-F186 HydrophobicContact CB-CD1 3.84Å; Q122-F186 HydrophobicContact CB-CE1 4.22Å; Q122-F186 HydrophobicContact CB-CG 4.04Å; Q122-F186 HydrophobicContact CG-CD1 4.46Å; P123-F186 HydrophobicContact CB-CD2 4.23Å; P123-F186 HydrophobicContact CB-CE2 3.68Å; P123-F186 HydrophobicContact CB-CZ 4.36Å; P123-F186 HydrophobicContact CG-CD2 3.76Å; P123-F186 HydrophobicContact CG-CE2 3.74Å; C126-F186 HydrophobicContact CB-CZ 4.18Å; I184-F186 HydrophobicContact CB-CE2 3.93Å; I184-F186 HydrophobicContact CB-CZ 4.19Å; I184-F186 HydrophobicContact CG2-CD2 4.36Å; I184-F186 HydrophobicContact CG2-CE1 4.2Å; I184-F186 HydrophobicContact CG2-CE2 3.79Å; I184-F186 HydrophobicContact CG2-CZ 3.71Å; I184-F186 WeakPolarHBondContact O-CD2 3.4Å; I184-F186 PolarHBondContact O-N 3.11Å
187	N	78.7	Confident	83.5	Confident	147 Å²	147	65.1 Å²	65.1	79%	0.786	35%	0.347	S	S	*	.			trans	-92.4	-10.4	-177.3	-159.4	24.2	0	0	0	113.1	S189	N187-S189 VanDerWaalsContact C-N 3.33Å; N187-S189 PolarHBondContact O-N 3.47Å
188	S	75.4	Confident	83.7	Confident	43 Å²	43	70.6 Å²	70.6	30%	0.301	37%	0.367	S	S	.	.			trans	-76.1	80.4	-179	-54.3	0	0	0	0	111.5	W118	W118-S188 PolarHBondContact NE1-O 3.17Å
189	S	77.1	Confident	84	Confident	87 Å²	87	65.7 Å²	65.7	61%	0.608	34%	0.336	S	S	*	.			trans	-58.2	137.5	169.6	-71.1	0	0	0	0	111.2	N187	N187-S189 VanDerWaalsContact C-N 3.33Å; N187-S189 PolarHBondContact O-N 3.47Å
190	G	79.6	Confident	84.2	Confident	4 Å²	4	71.3 Å²	71.3	4%	0.041	37%	0.366	C	S	.	.			trans	-65.9	158.8	172.2	0	0	0	0	0	112.5	R112 R198	R112-G190 CarbonylContact O-C 3.53Å; R112-G190 WeakPolarHBondContact O-CA 3.43Å; G190-R198 PolarHBondContact O-NH1 2.86Å; G190-R198 VanDerWaalsContact O-NH1 3.09Å
191	Q	83.9	Confident	84.6	Confident	126 Å²	126	70.8 Å²	70.8	59%	0.589	37%	0.366	S	S	*	.			trans	-112.1	170.2	175.5	-69.2	177.5	-19.8	0	0	108.9	R112 N113	R112-Q191 PolarHBondContact O-N 3.31Å; R112-Q191 VanDerWaalsContact O-N 3.12Å; N113-Q191 CarbonylContact C-O 3.45Å; N113-Q191 VanDerWaalsContact CA-O 3.27Å; N113-Q191 WeakPolarHBondContact CA-O 3.39Å
192	C	86.8	Confident	85	Confident	28 Å²	28	74.6 Å²	74.6	19%	0.189	39%	0.391	C	S	.	.			trans	-115.7	127.3	168.6	-58	0	0	0	0	106.5	L196 R198 C212	C192-L196 HydrophobicContact CB-CB 4.25Å; C192-R198 WeakPolarHBondContact SG-CA 3.38Å; C192-C212 HydrophobicContact CB-CB 3.92Å; C192-C212 WeakPolarHBondContact CB-SG 3.32Å; C192-C212 WeakPolarHBondContact SG-CB 3.44Å; C192-C212 CovalentContact SG-SG 2.04Å; C192-C212 PolarHBondContact SG-SG 3.25Å
193	E	82.2	Confident	85.3	Confident	87 Å²	87	75 Å²	75	41%	0.407	39%	0.39	S	S	.	.			trans	-85.7	149.5	175	-69.8	-66	177.2	0	0	110.8	N113 L196	N113-E193 WeakPolarHBondContact ND2-CG 3.48Å; E193-L196 WeakPolarHBondContact O-CA 3.21Å; E193-L196 WeakPolarHBondContact O-CB 3.34Å; E193-L196 PolarHBondContact O-N 3.4Å
194	V	79.8	Confident	85.7	Confident	99 Å²	99	69.8 Å²	69.8	60%	0.6	36%	0.363	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.6	130.3	174.8	-179.7	0	0	0	0	108.8
195	P	86.2	Confident	85.9	Confident	1 Å²	1	72.7 Å²	72.7	1%	0.006	37%	0.373	C	S	.	.	T	Hydrogen-bonded Turn	cis	-93.6	10.6	18.9	38.1	-38.4	0	0	0	116.1	I214 Q215 P219 Y486 V487	P195-I214 HydrophobicContact CB-CD1 4.03Å; P195-I214 HydrophobicContact CG-CD1 4.08Å; P195-Q215 WeakPolarHBondContact O-CB 3.47Å; P195-Q215 VanDerWaalsContact O-CG 3.28Å; P195-Q215 WeakPolarHBondContact O-CG 3.39Å; P195-Q215 PolarHBondContact O-N 3.46Å; P195-P219 HydrophobicContact CB-CB 3.52Å; P195-P219 HydrophobicContact CB-CG 3.82Å; P195-P219 HydrophobicContact CG-CB 4.36Å; P195-P219 HydrophobicContact CG-CG 4.35Å; P195-Y486 HydrophobicContact CG-CE1 4.37Å; P195-V487 HydrophobicContact CG-CG2 3.98Å
196	L	89.6	Confident	86	Confident	8 Å²	8	65.3 Å²	65.3	4%	0.042	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91	143.5	-177.9	-59.3	175.3	0	0	0	111.8	C192 E193 Y206 V209 C212 G213 I214 V487 A491	C192-L196 HydrophobicContact CB-CB 4.25Å; E193-L196 WeakPolarHBondContact O-CA 3.21Å; E193-L196 WeakPolarHBondContact O-CB 3.34Å; E193-L196 PolarHBondContact O-N 3.4Å; L196-Y206 HydrophobicContact CD2-CD1 4.38Å; L196-Y206 HydrophobicContact CD2-CD2 4.45Å; L196-Y206 HydrophobicContact CD2-CG 3.99Å; L196-V209 HydrophobicContact CD1-CB 4.33Å; L196-V209 HydrophobicContact CD1-CG1 4.01Å; L196-V209 HydrophobicContact CD1-CG2 4.36Å; L196-C212 HydrophobicContact CB-CB 3.97Å; L196-C212 HydrophobicContact CD1-CB 4.17Å; L196-G213 CarbonylContact C-O 3.6Å; L196-G213 VanDerWaalsContact CA-O 3.31Å; L196-G213 WeakPolarHBondContact CA-O 3.4Å; L196-I214 HydrophobicContact CD2-CD1 4.17Å; L196-V487 HydrophobicContact CD1-CG1 4.21Å; L196-V487 HydrophobicContact CD2-CG1 4.06Å; L196-V487 HydrophobicContact CG-CG1 4.2Å; L196-A491 HydrophobicContact CD1-CB 4.32Å
197	V	92.2	Very high	85.6	Confident	48 Å²	48	68.5 Å²	68.5	29%	0.291	36%	0.356	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117	143.8	174.9	65.1	0	0	0	0	109.7	T199 C212 G213 Q215 T299	V197-T199 PolarHBondContact O-N 2.9Å; V197-C212 CarbonylContact O-C 3.04Å; V197-C212 WeakPolarHBondContact O-CA 3.36Å; V197-G213 PolarHBondContact N-O 3.09Å; V197-G213 PolarHBondContact O-N 3.31Å; V197-Q215 HydrophobicContact CG1-CB 4.43Å; V197-T299 HydrophobicContact CG1-CG2 3.63Å
198	R	90.8	Very high	85.5	Confident	124 Å²	124	62.8 Å²	62.8	47%	0.468	33%	0.325	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67	129.4	177.9	-172	-177.1	179.4	117.1	-2.2	110.4	G190 C192	G190-R198 PolarHBondContact O-NH1 2.86Å; G190-R198 VanDerWaalsContact O-NH1 3.09Å; C192-R198 WeakPolarHBondContact SG-CA 3.38Å
199	T	91.4	Very high	85.9	Confident	5 Å²	5	60.8 Å²	60.8	3%	0.031	31%	0.311	C	S	.	.			trans	-140.6	135.6	172.7	-178.2	0	0	0	0	111.2	V197 N201 W205 G211 D297 T299	V197-T199 PolarHBondContact O-N 2.9Å; T199-N201 VanDerWaalsContact C-N 3.3Å; T199-N201 PolarHBondContact OG1-N 3.47Å; T199-W205 PolarHBondContact O-NE1 3.49Å; T199-G211 PolarHBondContact N-O 3.29Å; T199-G211 VanDerWaalsContact N-O 3.13Å; T199-D297 PolarHBondContact OG1-OD2 2.93Å; T199-T299 HydrophobicContact CG2-CG2 4.17Å
200	D	90.1	Very high	86.3	Confident	131 Å²	131	59.6 Å²	59.6	70%	0.701	30%	0.296	S	S	*	.			trans	-84.7	-5.4	174.2	-61.2	-52	0	0	0	112.2	P202	D200-P202 WeakPolarHBondContact O-CD 3.38Å
201	N	90.1	Very high	86.7	Confident	48 Å²	48	59.6 Å²	59.6	26%	0.257	30%	0.296	S	S	.	.			trans	-82.7	114.8	178.5	-179.5	5.7	0	0	0	111.5	T199 K203 S204 W205	T199-N201 VanDerWaalsContact C-N 3.3Å; T199-N201 PolarHBondContact OG1-N 3.47Å; N201-K203 PolarHBondContact O-N 3.34Å; N201-K203 VanDerWaalsContact O-N 3.14Å; N201-K203 WeakPolarHBondContact OD1-CB 3.12Å; N201-K203 PolarHBondContact OD1-N 3.12Å; N201-S204 PolarHBondContact ND2-OG 2.68Å; N201-S204 VanDerWaalsContact ND2-OG 3.1Å; N201-S204 PolarHBondContact O-N 3.07Å; N201-W205 PolarHBondContact O-NE1 3.34Å
202	P	89.4	Confident	87	Confident	86 Å²	86	53.6 Å²	53.6	56%	0.558	27%	0.268	S	S	*	.	G	3₁₀ helix	trans	-62.3	-24	179.4	-22.6	35	0	0	0	114.2	D200 S204 W205	D200-P202 WeakPolarHBondContact O-CD 3.38Å; P202-S204 VanDerWaalsContact C-N 3.26Å; P202-S204 PolarHBondContact O-N 2.89Å; P202-W205 HydrophobicContact CB-CD2 4.33Å; P202-W205 HydrophobicContact CB-CE3 4.07Å; P202-W205 HydrophobicContact CB-CH2 3.97Å; P202-W205 HydrophobicContact CB-CZ2 4.22Å; P202-W205 HydrophobicContact CB-CZ3 3.9Å; P202-W205 HydrophobicContact CG-CH2 3.9Å; P202-W205 HydrophobicContact CG-CZ2 4.02Å; P202-W205 HydrophobicContact CG-CZ3 4.34Å
203	K	87.5	Confident	87.2	Confident	140 Å²	140	52.2 Å²	52.2	61%	0.609	26%	0.259	S	S	*	.	G	3₁₀ helix	trans	-79.9	-4.2	175.9	-61.2	-174.7	178.5	-177.5	0	113.8	N201 R295 T306	N201-K203 PolarHBondContact O-N 3.34Å; N201-K203 VanDerWaalsContact O-N 3.14Å; N201-K203 WeakPolarHBondContact OD1-CB 3.12Å; N201-K203 PolarHBondContact OD1-N 3.12Å; K203-R295 PolarHBondContact O-NH1 3.37Å; K203-T306 HydrophobicContact CD-CG2 4.47Å
204	S	90.2	Very high	87.7	Confident	11 Å²	11	48.6 Å²	48.6	8%	0.077	24%	0.242	C	C	.	.	G	3₁₀ helix	trans	-109.7	-4.5	176.6	-62.5	0	0	0	0	112.6	N201 P202 G213 R295 D297 T299	N201-S204 PolarHBondContact ND2-OG 2.68Å; N201-S204 VanDerWaalsContact ND2-OG 3.1Å; N201-S204 PolarHBondContact O-N 3.07Å; P202-S204 VanDerWaalsContact C-N 3.26Å; P202-S204 PolarHBondContact O-N 2.89Å; S204-G213 WeakPolarHBondContact O-CA 3.44Å; S204-R295 PolarHBondContact OG-NH1 3.44Å; S204-D297 WeakPolarHBondContact CB-OD2 3.34Å; S204-D297 PolarHBondContact OG-OD2 3.09Å; S204-T299 PolarHBondContact OG-OG1 3.13Å
205	W	90.5	Very high	88.3	Confident	75 Å²	75	46.3 Å²	46.3	28%	0.284	23%	0.225	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-65.8	139	-179.6	-65.6	-20.9	0	0	0	112	T199 N201 P202 E210 C212	T199-W205 PolarHBondContact O-NE1 3.49Å; N201-W205 PolarHBondContact O-NE1 3.34Å; P202-W205 HydrophobicContact CB-CD2 4.33Å; P202-W205 HydrophobicContact CB-CE3 4.07Å; P202-W205 HydrophobicContact CB-CH2 3.97Å; P202-W205 HydrophobicContact CB-CZ2 4.22Å; P202-W205 HydrophobicContact CB-CZ3 3.9Å; P202-W205 HydrophobicContact CG-CH2 3.9Å; P202-W205 HydrophobicContact CG-CZ2 4.02Å; P202-W205 HydrophobicContact CG-CZ3 4.34Å; W205-E210 HydrophobicContact CE3-CB 4.19Å; W205-E210 HydrophobicContact CE3-CG 3.89Å; W205-E210 HydrophobicContact CZ3-CB 4.43Å; W205-E210 HydrophobicContact CZ3-CG 4.13Å; W205-C212 WeakPolarHBondContact CA-O 3.48Å
206	Y	87.3	Confident	88.7	Confident	32 Å²	32	46.9 Å²	46.9	13%	0.125	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.3	145.6	172.5	-171.7	-98.2	0	0	0	109.7	L196 D208 V209 C212 I214 F483 V487	L196-Y206 HydrophobicContact CD2-CD1 4.38Å; L196-Y206 HydrophobicContact CD2-CD2 4.45Å; L196-Y206 HydrophobicContact CD2-CG 3.99Å; Y206-D208 PolarHBondContact O-N 3.36Å; Y206-V209 HydrophobicContact CD1-CG2 4.41Å; Y206-V209 PolarHBondContact O-N 3.23Å; Y206-V209 VanDerWaalsContact O-N 3.08Å; Y206-C212 PolarHBondContact N-O 3.41Å; Y206-I214 HydrophobicContact CD2-CB 4.2Å; Y206-F483 HydrophobicContact CE2-CE1 4.13Å; Y206-V487 HydrophobicContact CD1-CG1 4.09Å; Y206-V487 HydrophobicContact CE1-CB 4.19Å; Y206-V487 HydrophobicContact CE1-CG1 3.63Å
207	E	80	Confident	89	Confident	108 Å²	108	50.8 Å²	50.8	51%	0.505	25%	0.247	S	C	.	.	T	Hydrogen-bonded Turn	trans	-53.4	134.4	-179.5	-68	169.4	-134.2	0	0	110.6	V209 K394	E207-V209 PolarHBondContact O-N 3.1Å; E207-V209 VanDerWaalsContact O-N 3.11Å; E207-K394 IonicContact OE1-NZ 2.73Å; E207-K394 PolarHBondContact OE1-NZ 2.95Å
208	D	76.2	Confident	89	Confident	27 Å²	27	49.8 Å²	49.8	14%	0.144	24%	0.24	C	C	.	.	T	Hydrogen-bonded Turn	trans	66	-9.3	-175.7	-49.2	-47.6	0	0	0	117.2	I155 R158 Y206 R484	I155-D208 WeakPolarHBondContact CB-O 3.36Å; R158-D208 WeakPolarHBondContact CD-OD2 3.33Å; R158-D208 IonicContact CZ-OD1 3.78Å; R158-D208 IonicContact CZ-OD2 3.73Å; R158-D208 IonicContact NE-OD1 3.43Å; R158-D208 PolarHBondContact NE-OD1 3.41Å; R158-D208 IonicContact NE-OD2 2.68Å; R158-D208 PolarHBondContact NE-OD2 3.48Å; R158-D208 IonicContact NH2-OD1 3.92Å; R158-D208 PolarHBondContact NH2-OD1 3.3Å; R158-D208 IonicContact NH2-OD2 3.12Å; Y206-D208 PolarHBondContact O-N 3.36Å; D208-R484 IonicContact OD2-CZ 3.9Å; D208-R484 IonicContact OD2-NE 3.07Å; D208-R484 IonicContact OD2-NH2 3.56Å; D208-R484 PolarHBondContact OD2-NH2 3.27Å
209	V	83.3	Confident	89	Confident	1 Å²	1	45.1 Å²	45.1	1%	0.006	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	79.3	-177.8	-168.1	0	0	0	0	112.5	A114 I155 L196 Y206 E207 G211 C212	A114-V209 HydrophobicContact CB-CG1 4.11Å; I155-V209 HydrophobicContact CD1-CG2 4.13Å; L196-V209 HydrophobicContact CD1-CB 4.33Å; L196-V209 HydrophobicContact CD1-CG1 4.01Å; L196-V209 HydrophobicContact CD1-CG2 4.36Å; Y206-V209 HydrophobicContact CD1-CG2 4.41Å; Y206-V209 PolarHBondContact O-N 3.23Å; Y206-V209 VanDerWaalsContact O-N 3.08Å; E207-V209 PolarHBondContact O-N 3.1Å; E207-V209 VanDerWaalsContact O-N 3.11Å; V209-G211 PolarHBondContact O-N 3.12Å; V209-C212 HydrophobicContact CG1-CB 4.01Å; V209-C212 PolarHBondContact O-N 3.36Å; V209-C212 VanDerWaalsContact O-O 3.09Å
210	E	86.3	Confident	88.9	Confident	62 Å²	62	45.7 Å²	45.7	29%	0.29	23%	0.228	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-63.3	134.7	179.8	-70.3	-168.4	-164.8	0	0	113.7	R116 P152 W205 C212	R116-E210 HydrophobicContact CB-CB 3.76Å; R116-E210 WeakPolarHBondContact CB-O 3.44Å; R116-E210 HydrophobicContact CG-CB 4.2Å; R116-E210 PolarHBondContact N-O 2.95Å; P152-E210 WeakPolarHBondContact CA-OE2 3.48Å; P152-E210 WeakPolarHBondContact CB-OE2 3.48Å; W205-E210 HydrophobicContact CE3-CB 4.19Å; W205-E210 HydrophobicContact CE3-CG 3.89Å; W205-E210 HydrophobicContact CZ3-CB 4.43Å; W205-E210 HydrophobicContact CZ3-CG 4.13Å; E210-C212 VanDerWaalsContact C-N 3.35Å
211	G	87	Confident	89	Confident	4 Å²	4	40.4 Å²	40.4	4%	0.041	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	89.8	-6.3	-179.5	0	0	0	0	0	114.7	T199 V209	T199-G211 PolarHBondContact N-O 3.29Å; T199-G211 VanDerWaalsContact N-O 3.13Å; V209-G211 PolarHBondContact O-N 3.12Å
212	C	90.3	Very high	89.2	Confident	0 Å²	0	41.9 Å²	41.9	0%	0	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	140.8	170.3	-55	0	0	0	0	110	N113 P115 C192 L196 V197 W205 Y206 V209 E210	N113-C212 PolarHBondContact O-SG 3.41Å; P115-C212 WeakPolarHBondContact CD-SG 3.5Å; C192-C212 HydrophobicContact CB-CB 3.92Å; C192-C212 WeakPolarHBondContact CB-SG 3.32Å; C192-C212 WeakPolarHBondContact SG-CB 3.44Å; C192-C212 CovalentContact SG-SG 2.04Å; C192-C212 PolarHBondContact SG-SG 3.25Å; L196-C212 HydrophobicContact CB-CB 3.97Å; L196-C212 HydrophobicContact CD1-CB 4.17Å; V197-C212 CarbonylContact O-C 3.04Å; V197-C212 WeakPolarHBondContact O-CA 3.36Å; W205-C212 WeakPolarHBondContact CA-O 3.48Å; Y206-C212 PolarHBondContact N-O 3.41Å; V209-C212 HydrophobicContact CG1-CB 4.01Å; V209-C212 PolarHBondContact O-N 3.36Å; V209-C212 VanDerWaalsContact O-O 3.09Å; E210-C212 VanDerWaalsContact C-N 3.35Å
213	G	91.7	Very high	89.4	Confident	0 Å²	0	42 Å²	42	0%	0	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	167.1	172	0	0	0	0	0	110.8	L196 V197 S204	L196-G213 CarbonylContact C-O 3.6Å; L196-G213 VanDerWaalsContact CA-O 3.31Å; L196-G213 WeakPolarHBondContact CA-O 3.4Å; V197-G213 PolarHBondContact N-O 3.09Å; V197-G213 PolarHBondContact O-N 3.31Å; S204-G213 WeakPolarHBondContact O-CA 3.44Å
214	I	91.8	Very high	89.8	Confident	10 Å²	10	38.6 Å²	38.6	5%	0.051	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.1	133.1	174.8	-169.7	63.9	0	0	0	110.4	P195 L196 Y206 P219 T299 M300 F483	P195-I214 HydrophobicContact CB-CD1 4.03Å; P195-I214 HydrophobicContact CG-CD1 4.08Å; L196-I214 HydrophobicContact CD2-CD1 4.17Å; Y206-I214 HydrophobicContact CD2-CB 4.2Å; I214-P219 HydrophobicContact CD1-CG 4.23Å; I214-T299 WeakPolarHBondContact O-CA 3.49Å; I214-T299 VanDerWaalsContact O-CB 3.23Å; I214-T299 WeakPolarHBondContact O-CB 3.37Å; I214-M300 HydrophobicContact CG2-CG 3.7Å; I214-M300 HydrophobicContact CG2-SD 3.6Å; I214-M300 VanDerWaalsContact CG2-SD 3.6Å; I214-M300 PolarHBondContact O-N 3.42Å; I214-F483 HydrophobicContact CD1-CZ 3.74Å; I214-F483 HydrophobicContact CG1-CZ 4.14Å
215	Q	93.6	Very high	90.1	Very high	51 Å²	51	39.9 Å²	39.9	24%	0.238	21%	0.206	C	C	.	.	B	Isolated β-bridge	trans	-59.9	154.8	178.8	72.4	179.7	17.3	0	0	112.3	P195 V197 Q217	P195-Q215 WeakPolarHBondContact O-CB 3.47Å; P195-Q215 VanDerWaalsContact O-CG 3.28Å; P195-Q215 WeakPolarHBondContact O-CG 3.39Å; P195-Q215 PolarHBondContact O-N 3.46Å; V197-Q215 HydrophobicContact CG1-CB 4.43Å; Q215-Q217 VanDerWaalsContact CG-O 3.28Å; Q215-Q217 WeakPolarHBondContact CG-O 3.42Å; Q215-Q217 PolarHBondContact NE2-O 3.39Å; Q215-Q217 PolarHBondContact O-N 3.24Å
216	C	94.5	Very high	90.3	Very high	14 Å²	14	36.4 Å²	36.4	10%	0.095	19%	0.193	C	C	.	.	S	Bend	trans	-62.7	-34.6	179.6	179.7	0	0	0	0	114.8	N218 C294 G298	C216-N218 PolarHBondContact O-N 3.31Å; C216-C294 HydrophobicContact CB-CB 3.64Å; C216-C294 WeakPolarHBondContact CB-SG 3.48Å; C216-C294 WeakPolarHBondContact SG-CA 3.48Å; C216-C294 WeakPolarHBondContact SG-CB 3.36Å; C216-C294 CovalentContact SG-SG 2.03Å; C216-C294 PolarHBondContact SG-SG 2.88Å; C216-G298 WeakPolarHBondContact CB-O 3.24Å; C216-G298 PolarHBondContact N-O 2.88Å
217	Q	94.3	Very high	90.8	Very high	89 Å²	89	40.1 Å²	40.1	42%	0.416	21%	0.211	S	C	.	.	S	Bend	trans	-79.2	118.3	176.4	-73.2	-168.6	-50.6	0	0	110.8	Q215 P219 E223	Q215-Q217 VanDerWaalsContact CG-O 3.28Å; Q215-Q217 WeakPolarHBondContact CG-O 3.42Å; Q215-Q217 PolarHBondContact NE2-O 3.39Å; Q215-Q217 PolarHBondContact O-N 3.24Å; Q217-P219 VanDerWaalsContact O-CD 3.27Å; Q217-P219 WeakPolarHBondContact O-CD 3.43Å; Q217-E223 PolarHBondContact NE2-OE2 2.88Å
218	N	92.4	Very high	91.5	Very high	28 Å²	28	38.6 Å²	38.6	15%	0.15	21%	0.207	C	C	.	.			trans	-54.2	107.9	179.8	-170.6	-25.7	0	0	0	110.9	C216 L220 F221 D383 S384 V385	C216-N218 PolarHBondContact O-N 3.31Å; N218-L220 PolarHBondContact O-N 3.35Å; N218-L220 VanDerWaalsContact O-N 3.16Å; N218-L220 WeakPolarHBondContact OD1-CB 3.5Å; N218-L220 PolarHBondContact OD1-N 2.84Å; N218-F221 HydrophobicContact CB-CD2 4.49Å; N218-F221 PolarHBondContact O-N 3.1Å; N218-D383 PolarHBondContact ND2-OD1 3.16Å; N218-D383 VanDerWaalsContact ND2-OD1 3.08Å; N218-S384 WeakPolarHBondContact CB-OG 3.45Å; N218-S384 PolarHBondContact N-OG 2.78Å; N218-V385 HydrophobicContact CB-CG2 4.04Å
219	P	90.6	Very high	92.5	Very high	25 Å²	25	37.4 Å²	37.4	16%	0.162	20%	0.2	C	C	.	.	T	Hydrogen-bonded Turn	trans	-75.1	-5.5	-169.5	34.5	-41.3	0	0	0	113.6	P195 I214 Q217 F221 F483	P195-P219 HydrophobicContact CB-CB 3.52Å; P195-P219 HydrophobicContact CB-CG 3.82Å; P195-P219 HydrophobicContact CG-CB 4.36Å; P195-P219 HydrophobicContact CG-CG 4.35Å; I214-P219 HydrophobicContact CD1-CG 4.23Å; Q217-P219 VanDerWaalsContact O-CD 3.27Å; Q217-P219 WeakPolarHBondContact O-CD 3.43Å; P219-F221 PolarHBondContact O-N 2.98Å; P219-F483 HydrophobicContact CG-CE2 3.54Å; P219-F483 HydrophobicContact CG-CZ 3.96Å
220	L	90.4	Very high	93.2	Very high	17 Å²	17	38 Å²	38	9%	0.089	20%	0.203	C	C	.	.	T	Hydrogen-bonded Turn	trans	-71.4	-14.3	174	-62.7	174.8	0	0	0	112.4	N218 F483 I508 R511 P512	N218-L220 PolarHBondContact O-N 3.35Å; N218-L220 VanDerWaalsContact O-N 3.16Å; N218-L220 WeakPolarHBondContact OD1-CB 3.5Å; N218-L220 PolarHBondContact OD1-N 2.84Å; L220-F483 HydrophobicContact CD2-CB 4.32Å; L220-F483 HydrophobicContact CD2-CD2 3.7Å; L220-F483 HydrophobicContact CD2-CE2 4.47Å; L220-F483 HydrophobicContact CD2-CG 4.31Å; L220-F483 HydrophobicContact CG-CD2 4.16Å; L220-I508 HydrophobicContact CD2-CD1 4.01Å; L220-I508 HydrophobicContact CD2-CG2 4Å; L220-R511 WeakPolarHBondContact O-CD 3.08Å; L220-R511 PolarHBondContact O-NH1 2.73Å; L220-P512 HydrophobicContact CD1-CG 4.44Å
221	F	92.3	Very high	93.7	Very high	21 Å²	21	38.8 Å²	38.8	9%	0.092	22%	0.215	C	C	.	.	S	Bend	trans	-133.3	141.4	-173.6	-54.8	-71.2	0	0	0	111.9	N218 P219 E225 H226 V385 P512 L514	N218-F221 HydrophobicContact CB-CD2 4.49Å; N218-F221 PolarHBondContact O-N 3.1Å; P219-F221 PolarHBondContact O-N 2.98Å; F221-E225 WeakPolarHBondContact CA-OE2 3.26Å; F221-E225 HydrophobicContact CB-CB 4.25Å; F221-H226 PolarHBondContact O-CE1 3.28Å; F221-V385 HydrophobicContact CB-CG2 4.26Å; F221-V385 HydrophobicContact CD2-CG2 3.52Å; F221-V385 HydrophobicContact CE2-CG2 4.19Å; F221-V385 HydrophobicContact CG-CG2 4.14Å; F221-P512 WeakPolarHBondContact CE1-O 3.36Å; F221-P512 HydrophobicContact CZ-CB 4.11Å; F221-P512 HydrophobicContact CZ-CG 4.26Å; F221-P512 WeakPolarHBondContact CZ-O 3.21Å; F221-L514 HydrophobicContact CD1-CD1 3.64Å; F221-L514 HydrophobicContact CD1-CD2 3.78Å; F221-L514 HydrophobicContact CD1-CG 3.75Å; F221-L514 HydrophobicContact CD2-CD2 4.46Å; F221-L514 HydrophobicContact CE1-CD1 3.94Å; F221-L514 HydrophobicContact CE1-CD2 3.57Å; F221-L514 HydrophobicContact CE1-CG 3.52Å; F221-L514 HydrophobicContact CE2-CD2 4.25Å; F221-L514 HydrophobicContact CG-CD1 4.44Å; F221-L514 HydrophobicContact CG-CD2 4.21Å; F221-L514 HydrophobicContact CZ-CD2 3.8Å; F221-L514 HydrophobicContact CZ-CG 4.21Å
222	T	93.6	Very high	94.3	Very high	79 Å²	79	41 Å²	41	49%	0.485	22%	0.223	S	C	.	.			trans	-71.9	160.8	177.3	59.9	0	0	0	0	111.9	A224 E225 H226	T222-A224 PolarHBondContact O-N 3.17Å; T222-E225 PolarHBondContact N-OE2 3.23Å; T222-E225 PolarHBondContact O-N 3.33Å; T222-E225 WeakPolarHBondContact OG1-CG 3.5Å; T222-E225 PolarHBondContact OG1-N 3.06Å; T222-E225 PolarHBondContact OG1-OE2 3.06Å; T222-H226 PolarHBondContact O-N 3.25Å; T222-H226 PolarHBondContact O-ND1 2.99Å
223	E	94	Very high	94.6	Very high	88 Å²	88	41 Å²	41	41%	0.411	22%	0.223	S	C	.	.	H	α-helix	trans	-61.2	-30.7	174	-179	60.3	-148.3	0	0	112	Q217 H226 Q227	Q217-E223 PolarHBondContact NE2-OE2 2.88Å; E223-H226 WeakPolarHBondContact O-CB 3.48Å; E223-H226 PolarHBondContact O-N 3.04Å; E223-Q227 WeakPolarHBondContact O-CG 3.06Å; E223-Q227 PolarHBondContact O-N 3.44Å; E223-Q227 PolarHBondContact OE1-NE2 3.17Å; E223-Q227 VanDerWaalsContact OE1-NE2 3.1Å
224	A	95.9	Very high	94.9	Very high	68 Å²	68	42.5 Å²	42.5	56%	0.562	24%	0.235	S	C	*	.	H	α-helix	trans	-66.5	-42.3	174.4	0	0	0	0	0	112.2	T222 H226 Q227 D228	T222-A224 PolarHBondContact O-N 3.17Å; A224-H226 VanDerWaalsContact C-N 3.33Å; A224-Q227 PolarHBondContact O-N 2.98Å; A224-D228 WeakPolarHBondContact O-CB 3.47Å; A224-D228 PolarHBondContact O-N 3.1Å
225	E	96	Very high	95.2	Very high	38 Å²	38	44.6 Å²	44.6	18%	0.178	25%	0.254	C	S	.	.	H	α-helix	trans	-64.6	-36.1	174.1	-75.5	166.5	133.4	0	0	111.9	F221 T222 M229 R511 L514	F221-E225 WeakPolarHBondContact CA-OE2 3.26Å; F221-E225 HydrophobicContact CB-CB 4.25Å; T222-E225 PolarHBondContact N-OE2 3.23Å; T222-E225 PolarHBondContact O-N 3.33Å; T222-E225 WeakPolarHBondContact OG1-CG 3.5Å; T222-E225 PolarHBondContact OG1-N 3.06Å; T222-E225 PolarHBondContact OG1-OE2 3.06Å; E225-M229 PolarHBondContact O-N 3.29Å; E225-R511 IonicContact OE1-CZ 3.38Å; E225-R511 VanDerWaalsContact OE1-CZ 3.31Å; E225-R511 IonicContact OE1-NH1 2.68Å; E225-R511 PolarHBondContact OE1-NH1 2.76Å; E225-R511 IonicContact OE1-NH2 3.5Å; E225-R511 PolarHBondContact OE1-NH2 2.83Å; E225-R511 IonicContact OE2-NH1 3.31Å; E225-R511 PolarHBondContact OE2-NH1 2.79Å; E225-R511 VanDerWaalsContact OE2-NH1 3.12Å; E225-L514 HydrophobicContact CB-CD1 3.69Å; E225-L514 HydrophobicContact CG-CD1 3.79Å
226	H	95.6	Very high	95.4	Very high	3 Å²	3	44.5 Å²	44.5	1%	0.014	25%	0.253	C	S	.	.	H	α-helix	trans	-62.2	-51.3	171.3	-76.8	82.2	0	0	0	111.5	F221 T222 E223 A224 D228 M229 H230 S384	F221-H226 PolarHBondContact O-CE1 3.28Å; T222-H226 PolarHBondContact O-N 3.25Å; T222-H226 PolarHBondContact O-ND1 2.99Å; E223-H226 WeakPolarHBondContact O-CB 3.48Å; E223-H226 PolarHBondContact O-N 3.04Å; A224-H226 VanDerWaalsContact C-N 3.33Å; H226-D228 VanDerWaalsContact C-N 3.33Å; H226-D228 PolarHBondContact O-N 2.86Å; H226-M229 PolarHBondContact O-N 3.3Å; H226-M229 VanDerWaalsContact O-N 3.17Å; H226-H230 WeakPolarHBondContact O-CB 3.4Å; H226-H230 PolarHBondContact O-N 2.94Å; H226-H230 PolarHBondContact O-ND1 3.18Å; H226-S384 PolarHBondContact CD2-O 3.45Å; H226-S384 PolarHBondContact NE2-OG 3.18Å
227	Q	96.1	Very high	95.6	Very high	109 Å²	109	43.9 Å²	43.9	51%	0.509	25%	0.248	S	C	.	.	H	α-helix	trans	-62.3	-37	-179.1	-72.1	173.7	16	0	0	113.2	E223 A224 S231	E223-Q227 WeakPolarHBondContact O-CG 3.06Å; E223-Q227 PolarHBondContact O-N 3.44Å; E223-Q227 PolarHBondContact OE1-NE2 3.17Å; E223-Q227 VanDerWaalsContact OE1-NE2 3.1Å; A224-Q227 PolarHBondContact O-N 2.98Å; Q227-S231 VanDerWaalsContact O-CB 3.29Å; Q227-S231 WeakPolarHBondContact O-CB 3.23Å; Q227-S231 PolarHBondContact O-N 2.92Å; Q227-S231 PolarHBondContact O-OG 3.27Å
228	D	96.6	Very high	95.8	Very high	77 Å²	77	41.6 Å²	41.6	41%	0.412	25%	0.245	S	C	.	.	H	α-helix	trans	-64	-47.2	172.4	168.2	38.2	0	0	0	111.3	A224 H226 S231 Y232 K518	A224-D228 WeakPolarHBondContact O-CB 3.47Å; A224-D228 PolarHBondContact O-N 3.1Å; H226-D228 VanDerWaalsContact C-N 3.33Å; H226-D228 PolarHBondContact O-N 2.86Å; D228-S231 PolarHBondContact O-N 3.47Å; D228-Y232 WeakPolarHBondContact O-CB 3.46Å; D228-Y232 PolarHBondContact O-N 3.49Å; D228-K518 IonicContact OD1-NZ 3.31Å; D228-K518 PolarHBondContact OD1-NZ 3.25Å; D228-K518 IonicContact OD2-NZ 2.66Å; D228-K518 PolarHBondContact OD2-NZ 3.05Å
229	M	97.1	Very high	96.1	Very high	1 Å²	1	43.7 Å²	43.7	1%	0.005	26%	0.258	C	S	.	.	H	α-helix	trans	-63.5	-44	175.6	-171	64.7	77.3	0	0	112.4	E225 H226 S231 Y232 I233 V385 L514 E517 K518 L521	E225-M229 PolarHBondContact O-N 3.29Å; H226-M229 PolarHBondContact O-N 3.3Å; H226-M229 VanDerWaalsContact O-N 3.17Å; M229-S231 PolarHBondContact O-N 3.38Å; M229-Y232 WeakPolarHBondContact O-CB 3Å; M229-Y232 PolarHBondContact O-N 3.41Å; M229-I233 HydrophobicContact CG-CD1 3.96Å; M229-I233 WeakPolarHBondContact O-CG1 3.5Å; M229-I233 PolarHBondContact O-N 2.88Å; M229-V385 HydrophobicContact CB-CG1 4.12Å; M229-V385 HydrophobicContact CE-CG1 4.19Å; M229-V385 HydrophobicContact CG-CG1 3.91Å; M229-V385 VanDerWaalsContact CG-O 3.3Å; M229-V385 WeakPolarHBondContact CG-O 3.44Å; M229-L514 HydrophobicContact CE-CB 4.16Å; M229-L514 HydrophobicContact CE-CD2 3.89Å; M229-E517 HydrophobicContact CE-CB 4.26Å; M229-E517 HydrophobicContact CE-CG 4.47Å; M229-K518 HydrophobicContact CE-CG 3.93Å; M229-K518 HydrophobicContact SD-CG 3.92Å; M229-L521 HydrophobicContact SD-CD1 3.73Å
230	H	97.3	Very high	96.4	Very high	13 Å²	13	42.5 Å²	42.5	6%	0.06	25%	0.251	C	S	.	.	H	α-helix	trans	-63.2	-41.1	177.7	-61.9	156.5	0	0	0	111.7	H226 Y232 I233 A234 F284 R289 S384 V385	H226-H230 WeakPolarHBondContact O-CB 3.4Å; H226-H230 PolarHBondContact O-N 2.94Å; H226-H230 PolarHBondContact O-ND1 3.18Å; H230-Y232 VanDerWaalsContact C-N 3.32Å; H230-Y232 PolarHBondContact O-N 3.36Å; H230-I233 PolarHBondContact O-N 3.14Å; H230-A234 WeakPolarHBondContact O-CB 3.18Å; H230-A234 PolarHBondContact O-N 3.06Å; H230-F284 HydrophobicContact CB-CE1 4.14Å; H230-F284 WeakPolarHBondContact O-CE1 3.42Å; H230-F284 VanDerWaalsContact O-CZ 3.22Å; H230-F284 WeakPolarHBondContact O-CZ 3.49Å; H230-R289 PolarHBondContact CE1-NE 3.44Å; H230-R289 PolarHBondContact CE1-NH1 2.91Å; H230-R289 PolarHBondContact ND1-NH1 2.86Å; H230-R289 VanDerWaalsContact ND1-NH1 3.15Å; H230-R289 PolarHBondContact ND1-NH2 3.46Å; H230-R289 PolarHBondContact NE2-NE 3.21Å; H230-S384 PolarHBondContact NE2-O 3.11Å; H230-V385 PolarHBondContact CD2-O 3.35Å; H230-V385 VanDerWaalsContact CD2-O 3.31Å; H230-V385 PolarHBondContact NE2-O 2.93Å
231	S	97.4	Very high	96.8	Very high	79 Å²	79	42.1 Å²	42.1	55%	0.552	25%	0.251	S	S	*	.	H	α-helix	trans	-63.3	-38.7	174.2	-60.1	0	0	0	0	112	Q227 D228 M229 A234 A235	Q227-S231 VanDerWaalsContact O-CB 3.29Å; Q227-S231 WeakPolarHBondContact O-CB 3.23Å; Q227-S231 PolarHBondContact O-N 2.92Å; Q227-S231 PolarHBondContact O-OG 3.27Å; D228-S231 PolarHBondContact O-N 3.47Å; M229-S231 PolarHBondContact O-N 3.38Å; S231-A234 PolarHBondContact O-N 2.98Å; S231-A235 WeakPolarHBondContact O-CB 3.29Å; S231-A235 PolarHBondContact O-N 3.08Å
232	Y	97.9	Very high	97.1	Very high	52 Å²	52	46.9 Å²	46.9	20%	0.204	28%	0.277	C	S	.	.	H	α-helix	trans	-63.1	-48.8	175.9	-166.7	-93.3	0	0	0	111.9	D228 M229 H230 A235 F236 K518 L521	D228-Y232 WeakPolarHBondContact O-CB 3.46Å; D228-Y232 PolarHBondContact O-N 3.49Å; M229-Y232 WeakPolarHBondContact O-CB 3Å; M229-Y232 PolarHBondContact O-N 3.41Å; H230-Y232 VanDerWaalsContact C-N 3.32Å; H230-Y232 PolarHBondContact O-N 3.36Å; Y232-A235 PolarHBondContact O-N 3.13Å; Y232-F236 HydrophobicContact CD1-CD2 4.03Å; Y232-F236 HydrophobicContact CD1-CE2 4.48Å; Y232-F236 HydrophobicContact CD2-CD2 4.27Å; Y232-F236 HydrophobicContact CD2-CE2 4.11Å; Y232-F236 AromaticContact CE1-CD2 3.72Å; Y232-F236 HydrophobicContact CE1-CD2 3.72Å; Y232-F236 AromaticContact CE1-CE2 3.91Å; Y232-F236 HydrophobicContact CE1-CE2 3.91Å; Y232-F236 HydrophobicContact CE1-CG 4.49Å; Y232-F236 AromaticContact CE2-CD2 3.99Å; Y232-F236 HydrophobicContact CE2-CD2 3.99Å; Y232-F236 AromaticContact CE2-CE2 3.49Å; Y232-F236 HydrophobicContact CE2-CE2 3.49Å; Y232-F236 VanDerWaalsContact CE2-CE2 3.49Å; Y232-F236 HydrophobicContact CE2-CZ 4.45Å; Y232-F236 HydrophobicContact CG-CD2 4.28Å; Y232-F236 AromaticContact CZ-CD2 3.69Å; Y232-F236 AromaticContact CZ-CE2 3.36Å; Y232-F236 PolarHBondContact O-N 3.12Å; Y232-F236 WeakPolarHBondContact OH-CE2 3.25Å; Y232-K518 HydrophobicContact CD1-CG 4.09Å; Y232-K518 HydrophobicContact CD2-CD 4.05Å; Y232-K518 HydrophobicContact CD2-CG 4.41Å; Y232-K518 HydrophobicContact CE1-CB 4.07Å; Y232-K518 HydrophobicContact CE1-CG 4.15Å; Y232-K518 HydrophobicContact CE2-CD 4.2Å; Y232-K518 HydrophobicContact CE2-CG 4.46Å; Y232-K518 HydrophobicContact CG-CD 4.25Å; Y232-K518 HydrophobicContact CG-CG 4.23Å; Y232-K518 PolarHBondContact OH-O 3.31Å; Y232-L521 HydrophobicContact CD1-CB 4.49Å; Y232-L521 HydrophobicContact CD1-CD1 4.32Å; Y232-L521 HydrophobicContact CE1-CB 4.09Å
233	I	98.1	Very high	97.3	Very high	0 Å²	0	44.1 Å²	44.1	0%	0	26%	0.261	C	S	.	.	H	α-helix	trans	-63.6	-41.5	177.5	-66	167.3	0	0	0	110.9	M229 H230 A235 G237 W280 F284 S386 L521	M229-I233 HydrophobicContact CG-CD1 3.96Å; M229-I233 WeakPolarHBondContact O-CG1 3.5Å; M229-I233 PolarHBondContact O-N 2.88Å; H230-I233 PolarHBondContact O-N 3.14Å; I233-A235 PolarHBondContact O-N 2.75Å; I233-G237 WeakPolarHBondContact O-CA 3.21Å; I233-G237 PolarHBondContact O-N 2.94Å; I233-W280 HydrophobicContact CD1-CE3 4.29Å; I233-W280 HydrophobicContact CD1-CZ3 4.07Å; I233-W280 HydrophobicContact CG2-CB 4.33Å; I233-W280 HydrophobicContact CG2-CE3 3.97Å; I233-F284 HydrophobicContact CB-CZ 4.3Å; I233-F284 HydrophobicContact CG2-CE2 4.11Å; I233-F284 HydrophobicContact CG2-CZ 4.17Å; I233-S386 VanDerWaalsContact CD1-O 3.3Å; I233-S386 WeakPolarHBondContact CD1-O 3.4Å; I233-L521 HydrophobicContact CD1-CD1 4.16Å; I233-L521 HydrophobicContact CG1-CD1 3.77Å
234	A	98	Very high	97.5	Very high	30 Å²	30	40 Å²	40	25%	0.248	24%	0.241	C	C	.	.	H	α-helix	trans	-59	-48	175.8	0	0	0	0	0	111.6	H230 S231 A238 F284	H230-A234 WeakPolarHBondContact O-CB 3.18Å; H230-A234 PolarHBondContact O-N 3.06Å; S231-A234 PolarHBondContact O-N 2.98Å; A234-A238 WeakPolarHBondContact O-CB 3.4Å; A234-A238 PolarHBondContact O-N 3.14Å; A234-F284 HydrophobicContact CB-CD1 4.5Å; A234-F284 HydrophobicContact CB-CE1 3.89Å; A234-F284 HydrophobicContact CB-CE2 4.01Å; A234-F284 HydrophobicContact CB-CZ 3.65Å
235	A	98.2	Very high	97.6	Very high	55 Å²	55	40.7 Å²	40.7	46%	0.455	24%	0.235	S	C	.	.	H	α-helix	trans	-63.6	-52.9	-179.3	0	0	0	0	0	112.3	S231 Y232 I233 V239	S231-A235 WeakPolarHBondContact O-CB 3.29Å; S231-A235 PolarHBondContact O-N 3.08Å; Y232-A235 PolarHBondContact O-N 3.13Å; I233-A235 PolarHBondContact O-N 2.75Å; A235-V239 WeakPolarHBondContact O-CB 3.39Å; A235-V239 VanDerWaalsContact O-CG2 3.29Å; A235-V239 WeakPolarHBondContact O-CG2 3.5Å; A235-V239 PolarHBondContact O-N 3.38Å
236	F	98	Very high	97.7	Very high	49 Å²	49	42.7 Å²	42.7	22%	0.215	24%	0.244	C	C	.	.	H	α-helix	trans	-70.9	-37.9	-178.4	-83.3	-85.7	0	0	0	112.9	Y232 T240 F522 F525 I529	Y232-F236 HydrophobicContact CD1-CD2 4.03Å; Y232-F236 HydrophobicContact CD1-CE2 4.48Å; Y232-F236 HydrophobicContact CD2-CD2 4.27Å; Y232-F236 HydrophobicContact CD2-CE2 4.11Å; Y232-F236 AromaticContact CE1-CD2 3.72Å; Y232-F236 HydrophobicContact CE1-CD2 3.72Å; Y232-F236 AromaticContact CE1-CE2 3.91Å; Y232-F236 HydrophobicContact CE1-CE2 3.91Å; Y232-F236 HydrophobicContact CE1-CG 4.49Å; Y232-F236 AromaticContact CE2-CD2 3.99Å; Y232-F236 HydrophobicContact CE2-CD2 3.99Å; Y232-F236 AromaticContact CE2-CE2 3.49Å; Y232-F236 HydrophobicContact CE2-CE2 3.49Å; Y232-F236 VanDerWaalsContact CE2-CE2 3.49Å; Y232-F236 HydrophobicContact CE2-CZ 4.45Å; Y232-F236 HydrophobicContact CG-CD2 4.28Å; Y232-F236 AromaticContact CZ-CD2 3.69Å; Y232-F236 AromaticContact CZ-CE2 3.36Å; Y232-F236 PolarHBondContact O-N 3.12Å; Y232-F236 WeakPolarHBondContact OH-CE2 3.25Å; F236-T240 VanDerWaalsContact O-CB 3.27Å; F236-T240 WeakPolarHBondContact O-CB 3.18Å; F236-T240 PolarHBondContact O-N 3.36Å; F236-T240 PolarHBondContact O-OG1 2.77Å; F236-F522 AromaticContact CE1-CD2 3.72Å; F236-F522 HydrophobicContact CE1-CD2 3.72Å; F236-F522 HydrophobicContact CE1-CE2 4.23Å; F236-F522 AromaticContact CZ-CD2 3.88Å; F236-F522 HydrophobicContact CZ-CD2 3.88Å; F236-F522 HydrophobicContact CZ-CE2 4.47Å; F236-F525 HydrophobicContact CB-CB 4Å; F236-F525 HydrophobicContact CB-CD2 3.52Å; F236-F525 HydrophobicContact CB-CE2 4.14Å; F236-F525 HydrophobicContact CB-CG 3.84Å; F236-F525 HydrophobicContact CD1-CB 4.14Å; F236-F525 HydrophobicContact CG-CD2 4.45Å; F236-I529 HydrophobicContact CD1-CD1 4.48Å
237	G	97.9	Very high	97.7	Very high	0 Å²	0	42.6 Å²	42.6	0%	0	24%	0.243	C	C	.	.	H	α-helix	trans	-62.7	-45.6	174.6	0	0	0	0	0	112.2	I233 G241	I233-G237 WeakPolarHBondContact O-CA 3.21Å; I233-G237 PolarHBondContact O-N 2.94Å; G237-G241 PolarHBondContact O-N 3.25Å
238	A	98.3	Very high	97.7	Very high	41 Å²	41	38.4 Å²	38.4	34%	0.339	22%	0.224	S	C	.	.	H	α-helix	trans	-65.9	-46.1	178.2	0	0	0	0	0	112.1	A234 T240 G241 L242	A234-A238 WeakPolarHBondContact O-CB 3.4Å; A234-A238 PolarHBondContact O-N 3.14Å; A238-T240 PolarHBondContact O-N 2.9Å; A238-G241 PolarHBondContact O-N 3.39Å; A238-L242 WeakPolarHBondContact O-CB 3.36Å; A238-L242 VanDerWaalsContact O-CG 3.29Å; A238-L242 WeakPolarHBondContact O-CG 3.43Å; A238-L242 PolarHBondContact O-N 2.85Å
239	V	98.4	Very high	97.7	Very high	72 Å²	72	36.4 Å²	36.4	44%	0.436	22%	0.219	S	C	.	.	H	α-helix	trans	-62.1	-44.8	177.5	172	0	0	0	0	111.1	A235 L242 C243 I529	A235-V239 WeakPolarHBondContact O-CB 3.39Å; A235-V239 VanDerWaalsContact O-CG2 3.29Å; A235-V239 WeakPolarHBondContact O-CG2 3.5Å; A235-V239 PolarHBondContact O-N 3.38Å; V239-L242 PolarHBondContact O-N 2.86Å; V239-C243 WeakPolarHBondContact O-CB 3.31Å; V239-C243 PolarHBondContact O-N 3.13Å; V239-C243 PolarHBondContact O-SG 2.96Å; V239-I529 HydrophobicContact CG1-CD1 3.81Å; V239-I529 HydrophobicContact CG1-CG1 4.29Å
240	T	98.4	Very high	97.6	Very high	0 Å²	0	36.4 Å²	36.4	0%	0	22%	0.218	C	C	.	.	H	α-helix	trans	-65.5	-45.2	178.2	-52.1	0	0	0	0	111.3	F236 A238 L242 C243 T244 F525 I529	F236-T240 VanDerWaalsContact O-CB 3.27Å; F236-T240 WeakPolarHBondContact O-CB 3.18Å; F236-T240 PolarHBondContact O-N 3.36Å; F236-T240 PolarHBondContact O-OG1 2.77Å; A238-T240 PolarHBondContact O-N 2.9Å; T240-L242 PolarHBondContact O-N 2.64Å; T240-C243 PolarHBondContact O-N 2.86Å; T240-T244 HydrophobicContact CG2-CG2 4.12Å; T240-T244 WeakPolarHBondContact O-CB 3.38Å; T240-T244 VanDerWaalsContact O-CG2 3.3Å; T240-T244 WeakPolarHBondContact O-CG2 3.47Å; T240-T244 PolarHBondContact O-N 2.67Å; T240-T244 PolarHBondContact O-OG1 2.9Å; T240-F525 HydrophobicContact CG2-CD1 4.19Å; T240-F525 WeakPolarHBondContact OG1-CB 3.44Å; T240-F525 WeakPolarHBondContact OG1-CD1 3.42Å; T240-I529 HydrophobicContact CG2-CG1 4.38Å; T240-I529 WeakPolarHBondContact OG1-CG1 3.45Å
241	G	98.2	Very high	97.4	Very high	10 Å²	10	35.8 Å²	35.8	10%	0.103	22%	0.216	C	C	.	.	H	α-helix	trans	-57.6	-46.2	176	0	0	0	0	0	112.5	G237 A238 T244 L245	G237-G241 PolarHBondContact O-N 3.25Å; A238-G241 PolarHBondContact O-N 3.39Å; G241-T244 PolarHBondContact O-OG1 3.34Å; G241-L245 WeakPolarHBondContact O-CB 3.15Å; G241-L245 PolarHBondContact O-N 3.17Å
242	L	98.3	Very high	97.2	Very high	120 Å²	120	36.2 Å²	36.2	63%	0.628	22%	0.215	S	C	*	.	H	α-helix	trans	-67	-44.2	177.7	-70.5	171.2	0	0	0	112.8	A238 V239 T240 F246	A238-L242 WeakPolarHBondContact O-CB 3.36Å; A238-L242 VanDerWaalsContact O-CG 3.29Å; A238-L242 WeakPolarHBondContact O-CG 3.43Å; A238-L242 PolarHBondContact O-N 2.85Å; V239-L242 PolarHBondContact O-N 2.86Å; T240-L242 PolarHBondContact O-N 2.64Å; L242-F246 WeakPolarHBondContact O-CB 3.41Å; L242-F246 PolarHBondContact O-N 2.89Å
243	C	98.1	Very high	96.8	Very high	22 Å²	22	35.4 Å²	35.4	15%	0.149	22%	0.219	C	C	.	.	H	α-helix	trans	-67.7	-41.7	-179.2	-67.1	0	0	0	0	112.3	V239 T240 T247 S532	V239-C243 WeakPolarHBondContact O-CB 3.31Å; V239-C243 PolarHBondContact O-N 3.13Å; V239-C243 PolarHBondContact O-SG 2.96Å; T240-C243 PolarHBondContact O-N 2.86Å; C243-T247 PolarHBondContact O-N 3.38Å; C243-T247 VanDerWaalsContact O-N 3.14Å; C243-T247 PolarHBondContact O-OG1 3.13Å; C243-S532 WeakPolarHBondContact CB-OG 3.47Å
244	T	98	Very high	96.4	Very high	0 Å²	0	36.5 Å²	36.5	0%	0	23%	0.225	C	C	.	.	H	α-helix	trans	-68.9	-42.7	175.5	54.6	0	0	0	0	111.1	T240 G241 F246 T247 L248 N270 F273 F274	T240-T244 HydrophobicContact CG2-CG2 4.12Å; T240-T244 WeakPolarHBondContact O-CB 3.38Å; T240-T244 VanDerWaalsContact O-CG2 3.3Å; T240-T244 WeakPolarHBondContact O-CG2 3.47Å; T240-T244 PolarHBondContact O-N 2.67Å; T240-T244 PolarHBondContact O-OG1 2.9Å; G241-T244 PolarHBondContact O-OG1 3.34Å; T244-F246 PolarHBondContact O-N 2.75Å; T244-T247 CarbonylContact O-C 3.47Å; T244-T247 WeakPolarHBondContact O-CA 3.37Å; T244-T247 VanDerWaalsContact O-CB 3.3Å; T244-T247 WeakPolarHBondContact O-CB 3.47Å; T244-T247 PolarHBondContact O-N 3.34Å; T244-L248 WeakPolarHBondContact O-CG 3.13Å; T244-L248 PolarHBondContact O-N 3.31Å; T244-N270 HydrophobicContact CG2-CB 4.48Å; T244-F273 HydrophobicContact CG2-CB 3.91Å; T244-F274 WeakPolarHBondContact OG1-CB 3.28Å
245	L	98	Very high	95.9	Very high	83 Å²	83	39.4 Å²	39.4	44%	0.435	23%	0.229	S	C	.	.	H	α-helix	trans	-58.8	-46	174.4	179.9	59.7	0	0	0	112.5	G241 T247 L248 A249 F274	G241-L245 WeakPolarHBondContact O-CB 3.15Å; G241-L245 PolarHBondContact O-N 3.17Å; L245-T247 PolarHBondContact O-N 3.02Å; L245-L248 PolarHBondContact O-N 3.28Å; L245-A249 WeakPolarHBondContact O-CB 3.47Å; L245-A249 PolarHBondContact O-N 3.43Å; L245-F274 HydrophobicContact CB-CD2 4.06Å; L245-F274 HydrophobicContact CB-CE2 3.76Å; L245-F274 HydrophobicContact CD1-CE2 4.06Å; L245-F274 HydrophobicContact CD1-CZ 3.97Å; L245-F274 HydrophobicContact CD2-CE2 4.4Å; L245-F274 HydrophobicContact CG-CE2 4.28Å
246	F	97.4	Very high	95.2	Very high	81 Å²	81	48.5 Å²	48.5	36%	0.355	25%	0.252	S	S	.	.	H	α-helix	trans	-58	-36.7	173.7	171.9	-103.6	0	0	0	112.1	L242 T244 T250 V535 T540 W544	L242-F246 WeakPolarHBondContact O-CB 3.41Å; L242-F246 PolarHBondContact O-N 2.89Å; T244-F246 PolarHBondContact O-N 2.75Å; F246-T250 WeakPolarHBondContact O-CB 3.27Å; F246-T250 PolarHBondContact O-N 2.96Å; F246-T250 PolarHBondContact O-OG1 3.19Å; F246-V535 HydrophobicContact CD1-CG2 4.1Å; F246-V535 HydrophobicContact CE1-CG2 3.9Å; F246-T540 HydrophobicContact CE1-CG2 4.25Å; F246-T540 HydrophobicContact CZ-CG2 3.72Å; F246-W544 HydrophobicContact CD2-CZ2 4.47Å; F246-W544 HydrophobicContact CE2-CZ2 4.42Å; F246-W544 AromaticContact CE2-NE1 3.47Å; F246-W544 AromaticContact CZ-NE1 3.96Å
247	T	95.8	Very high	94.3	Very high	0 Å²	0	48.3 Å²	48.3	0%	0	25%	0.253	C	S	.	.	H	α-helix	trans	-68.1	-49.7	177.1	-58.5	0	0	0	0	111.6	C243 T244 L245 A249 T250 F251 N270 S532 V535	C243-T247 PolarHBondContact O-N 3.38Å; C243-T247 VanDerWaalsContact O-N 3.14Å; C243-T247 PolarHBondContact O-OG1 3.13Å; T244-T247 CarbonylContact O-C 3.47Å; T244-T247 WeakPolarHBondContact O-CA 3.37Å; T244-T247 VanDerWaalsContact O-CB 3.3Å; T244-T247 WeakPolarHBondContact O-CB 3.47Å; T244-T247 PolarHBondContact O-N 3.34Å; L245-T247 PolarHBondContact O-N 3.02Å; T247-A249 PolarHBondContact O-N 3.47Å; T247-T250 PolarHBondContact O-N 3.18Å; T247-F251 HydrophobicContact CG2-CD2 3.85Å; T247-F251 HydrophobicContact CG2-CE2 3.87Å; T247-F251 WeakPolarHBondContact O-CD2 3.23Å; T247-F251 PolarHBondContact O-N 3.27Å; T247-N270 HydrophobicContact CG2-CB 4.07Å; T247-S532 WeakPolarHBondContact OG1-CA 3.5Å; T247-S532 WeakPolarHBondContact OG1-CB 3.36Å; T247-S532 PolarHBondContact OG1-O 2.98Å; T247-V535 HydrophobicContact CG2-CG1 3.92Å; T247-V535 HydrophobicContact CG2-CG2 3.94Å; T247-V535 WeakPolarHBondContact OG1-CG2 3.5Å
248	L	96.9	Very high	93.6	Very high	21 Å²	21	48.3 Å²	48.3	11%	0.11	25%	0.253	C	S	.	.	H	α-helix	trans	-57.9	-47.8	175.6	-64.2	173.2	0	0	0	111.5	T244 L245 T250 F251 V252 F267 N270 A271 F274	T244-L248 WeakPolarHBondContact O-CG 3.13Å; T244-L248 PolarHBondContact O-N 3.31Å; L245-L248 PolarHBondContact O-N 3.28Å; L248-T250 VanDerWaalsContact C-N 3.31Å; L248-T250 PolarHBondContact O-N 3.39Å; L248-F251 PolarHBondContact O-N 3.02Å; L248-V252 WeakPolarHBondContact O-CG2 3.45Å; L248-V252 PolarHBondContact O-N 3.39Å; L248-F267 HydrophobicContact CB-CE2 4.39Å; L248-F267 HydrophobicContact CD2-CD2 3.54Å; L248-F267 HydrophobicContact CD2-CE2 3.46Å; L248-F267 VanDerWaalsContact CD2-CE2 3.46Å; L248-F267 HydrophobicContact CD2-CG 4.35Å; L248-F267 HydrophobicContact CD2-CZ 4.19Å; L248-F267 WeakPolarHBondContact CD2-O 3.48Å; L248-N270 HydrophobicContact CD2-CB 4.3Å; L248-A271 HydrophobicContact CD2-CB 3.87Å; L248-F274 HydrophobicContact CD1-CB 3.77Å; L248-F274 HydrophobicContact CD1-CD1 3.78Å; L248-F274 HydrophobicContact CD1-CG 3.79Å
249	A	96.1	Very high	92.9	Very high	36 Å²	36	50 Å²	50	30%	0.298	26%	0.256	S	S	.	.	H	α-helix	trans	-59.9	-40	176.8	0	0	0	0	0	112.4	L245 T247 V252 A253 W544	L245-A249 WeakPolarHBondContact O-CB 3.47Å; L245-A249 PolarHBondContact O-N 3.43Å; T247-A249 PolarHBondContact O-N 3.47Å; A249-V252 PolarHBondContact O-N 3.1Å; A249-A253 VanDerWaalsContact O-CB 3.31Å; A249-A253 WeakPolarHBondContact O-CB 3.34Å; A249-A253 PolarHBondContact O-N 3.1Å; A249-W544 HydrophobicContact CB-CH2 4.23Å; A249-W544 HydrophobicContact CB-CZ2 3.92Å
250	T	94.2	Very high	92.1	Very high	0 Å²	0	52 Å²	52	0%	0	26%	0.256	C	S	.	.	H	α-helix	trans	-65.2	-43.5	176.1	-62	0	0	0	0	112.1	F246 T247 L248 A253 D254 V535 T540 W544	F246-T250 WeakPolarHBondContact O-CB 3.27Å; F246-T250 PolarHBondContact O-N 2.96Å; F246-T250 PolarHBondContact O-OG1 3.19Å; T247-T250 PolarHBondContact O-N 3.18Å; L248-T250 VanDerWaalsContact C-N 3.31Å; L248-T250 PolarHBondContact O-N 3.39Å; T250-A253 PolarHBondContact O-N 2.95Å; T250-D254 PolarHBondContact O-N 3.5Å; T250-V535 HydrophobicContact CG2-CB 4.06Å; T250-V535 HydrophobicContact CG2-CG1 4.12Å; T250-T540 HydrophobicContact CG2-CG2 3.6Å; T250-W544 PolarHBondContact OG1-NE1 3.45Å
251	F	92.9	Very high	91.2	Very high	0 Å²	0	54 Å²	54	0%	0	26%	0.264	C	S	.	.	H	α-helix	trans	-65.2	-41	175.5	-91.4	-82.8	0	0	0	112.1	T247 L248 D254 W255 S258 A263 L266 F267 W534 V535	T247-F251 HydrophobicContact CG2-CD2 3.85Å; T247-F251 HydrophobicContact CG2-CE2 3.87Å; T247-F251 WeakPolarHBondContact O-CD2 3.23Å; T247-F251 PolarHBondContact O-N 3.27Å; L248-F251 PolarHBondContact O-N 3.02Å; F251-D254 CarbonylContact O-C 3.42Å; F251-D254 PolarHBondContact O-N 3.46Å; F251-W255 VanDerWaalsContact O-CA 3.25Å; F251-W255 WeakPolarHBondContact O-CA 3.19Å; F251-W255 PolarHBondContact O-N 3.23Å; F251-S258 PolarHBondContact O-OG 3.46Å; F251-A263 WeakPolarHBondContact CZ-O 3.15Å; F251-L266 HydrophobicContact CZ-CB 4.34Å; F251-F267 HydrophobicContact CB-CB 4.4Å; F251-F267 HydrophobicContact CB-CD2 3.54Å; F251-F267 HydrophobicContact CB-CE2 4.24Å; F251-F267 HydrophobicContact CB-CG 4.33Å; F251-F267 HydrophobicContact CD1-CB 3.93Å; F251-F267 HydrophobicContact CD2-CB 4.13Å; F251-F267 HydrophobicContact CD2-CD2 4.38Å; F251-F267 HydrophobicContact CE1-CB 4.18Å; F251-F267 HydrophobicContact CE2-CB 4.36Å; F251-F267 HydrophobicContact CG-CB 3.92Å; F251-F267 AromaticContact CG-CD2 3.97Å; F251-F267 HydrophobicContact CG-CD2 3.97Å; F251-F267 HydrophobicContact CG-CG 4.38Å; F251-F267 HydrophobicContact CZ-CB 4.39Å; F251-W534 AromaticContact CZ-CD1 3.9Å; F251-V535 HydrophobicContact CD2-CG1 3.94Å; F251-V535 HydrophobicContact CE2-CG1 3.64Å; F251-V535 HydrophobicContact CZ-CG1 4.44Å
252	V	93.6	Very high	90.3	Very high	89 Å²	89	53.9 Å²	53.9	54%	0.539	26%	0.261	S	S	.	.	H	α-helix	trans	-66.6	-38.9	177.5	171.4	0	0	0	0	111.3	L248 A249 D254 W255 F267	L248-V252 WeakPolarHBondContact O-CG2 3.45Å; L248-V252 PolarHBondContact O-N 3.39Å; A249-V252 PolarHBondContact O-N 3.1Å; V252-D254 VanDerWaalsContact C-N 3.27Å; V252-D254 PolarHBondContact O-N 3.25Å; V252-W255 WeakPolarHBondContact O-CB 3.4Å; V252-W255 PolarHBondContact O-N 3.11Å; V252-F267 HydrophobicContact CG2-CE2 4.17Å
253	A	90.3	Very high	89.6	Confident	35 Å²	35	48.5 Å²	48.5	29%	0.289	24%	0.235	S	C	.	.	H	α-helix	trans	-62.8	-28	178.4	0	0	0	0	0	114.2	A249 T250 I543	A249-A253 VanDerWaalsContact O-CB 3.31Å; A249-A253 WeakPolarHBondContact O-CB 3.34Å; A249-A253 PolarHBondContact O-N 3.1Å; T250-A253 PolarHBondContact O-N 2.95Å; A253-I543 HydrophobicContact CB-CG2 3.93Å
254	D	88.5	Confident	89.1	Confident	23 Å²	23	47.5 Å²	47.5	12%	0.123	23%	0.227	C	C	.	.	T	Hydrogen-bonded Turn	trans	-115.1	22.6	175.9	-155.3	50.9	0	0	0	112.3	T250 F251 V252 R256 N257 S258 I543 R546	T250-D254 PolarHBondContact O-N 3.5Å; F251-D254 CarbonylContact O-C 3.42Å; F251-D254 PolarHBondContact O-N 3.46Å; V252-D254 VanDerWaalsContact C-N 3.27Å; V252-D254 PolarHBondContact O-N 3.25Å; D254-R256 VanDerWaalsContact C-N 3.29Å; D254-R256 PolarHBondContact O-N 2.96Å; D254-N257 WeakPolarHBondContact O-CA 3.46Å; D254-N257 PolarHBondContact O-N 3.44Å; D254-N257 WeakPolarHBondContact OD2-CB 3.44Å; D254-N257 PolarHBondContact OD2-ND2 3.38Å; D254-S258 PolarHBondContact O-N 3.13Å; D254-S258 PolarHBondContact O-OG 3.08Å; D254-I543 HydrophobicContact CB-CD1 3.89Å; D254-I543 HydrophobicContact CB-CG1 4.2Å; D254-I543 HydrophobicContact CB-CG2 4.14Å; D254-R546 IonicContact OD1-NH1 3.98Å
255	W	87.9	Confident	88.8	Confident	90 Å²	90	47.5 Å²	47.5	34%	0.341	23%	0.227	S	C	.	.	H	α-helix	trans	-49.6	-42.8	-167.8	-177.4	-109.3	0	0	0	114.6	F251 V252 N257 S258 N259 V264 F267	F251-W255 VanDerWaalsContact O-CA 3.25Å; F251-W255 WeakPolarHBondContact O-CA 3.19Å; F251-W255 PolarHBondContact O-N 3.23Å; V252-W255 WeakPolarHBondContact O-CB 3.4Å; V252-W255 PolarHBondContact O-N 3.11Å; W255-N257 PolarHBondContact O-N 2.89Å; W255-S258 WeakPolarHBondContact CA-OG 3.5Å; W255-S258 PolarHBondContact O-N 3.39Å; W255-N259 HydrophobicContact CD2-CB 3.9Å; W255-N259 HydrophobicContact CE3-CB 4.2Å; W255-N259 HydrophobicContact CG-CB 4.44Å; W255-N259 HydrophobicContact CH2-CB 4.11Å; W255-N259 WeakPolarHBondContact CH2-OD1 3.46Å; W255-N259 HydrophobicContact CZ2-CB 3.8Å; W255-N259 WeakPolarHBondContact CZ2-OD1 3.4Å; W255-N259 HydrophobicContact CZ3-CB 4.3Å; W255-N259 WeakPolarHBondContact O-CB 3.21Å; W255-N259 PolarHBondContact O-N 3.14Å; W255-V264 HydrophobicContact CH2-CG2 4.09Å; W255-V264 HydrophobicContact CZ3-CG2 4.26Å; W255-F267 HydrophobicContact CH2-CD1 4.37Å; W255-F267 HydrophobicContact CH2-CE1 4.21Å; W255-F267 HydrophobicContact CZ3-CD1 4.02Å; W255-F267 AromaticContact CZ3-CE1 3.99Å; W255-F267 HydrophobicContact CZ3-CE1 3.99Å; W255-F267 HydrophobicContact CZ3-CE2 4.46Å; W255-F267 HydrophobicContact CZ3-CG 4.29Å; W255-F267 HydrophobicContact CZ3-CZ 4.22Å
256	R	84.3	Confident	88.5	Confident	247 Å²	247	43.6 Å²	43.6	93%	0.932	21%	0.207	S	C	*	.	H	α-helix	trans	-58.8	-19.9	178.7	-64.5	-175	-176.5	175	0.7	113.7	D254	D254-R256 VanDerWaalsContact C-N 3.29Å; D254-R256 PolarHBondContact O-N 2.96Å
257	N	79.5	Confident	88.3	Confident	45 Å²	45	41.2 Å²	41.2	24%	0.241	20%	0.197	C	C	.	.	H	α-helix	trans	-112.1	-33.6	-179.1	178.7	58.4	0	0	0	112.4	D254 W255 R260	D254-N257 WeakPolarHBondContact O-CA 3.46Å; D254-N257 PolarHBondContact O-N 3.44Å; D254-N257 WeakPolarHBondContact OD2-CB 3.44Å; D254-N257 PolarHBondContact OD2-ND2 3.38Å; W255-N257 PolarHBondContact O-N 2.89Å; N257-R260 PolarHBondContact O-NH1 2.94Å; N257-R260 PolarHBondContact OD1-NH1 3.24Å
258	S	82.5	Confident	88.4	Confident	0 Å²	0	43.4 Å²	43.4	0%	0	21%	0.205	C	C	.	.	H	α-helix	trans	-86.8	-16.4	-178	63.9	0	0	0	0	114.9	F251 D254 W255 R260	F251-S258 PolarHBondContact O-OG 3.46Å; D254-S258 PolarHBondContact O-N 3.13Å; D254-S258 PolarHBondContact O-OG 3.08Å; W255-S258 WeakPolarHBondContact CA-OG 3.5Å; W255-S258 PolarHBondContact O-N 3.39Å; S258-R260 PolarHBondContact O-N 3.48Å
259	N	83.2	Confident	88.3	Confident	75 Å²	75	42.6 Å²	42.6	40%	0.401	20%	0.201	S	C	.	.			trans	-73.7	50.1	174.7	-172.4	31	0	0	0	112.5	W255	W255-N259 HydrophobicContact CD2-CB 3.9Å; W255-N259 HydrophobicContact CE3-CB 4.2Å; W255-N259 HydrophobicContact CG-CB 4.44Å; W255-N259 HydrophobicContact CH2-CB 4.11Å; W255-N259 WeakPolarHBondContact CH2-OD1 3.46Å; W255-N259 HydrophobicContact CZ2-CB 3.8Å; W255-N259 WeakPolarHBondContact CZ2-OD1 3.4Å; W255-N259 HydrophobicContact CZ3-CB 4.3Å; W255-N259 WeakPolarHBondContact O-CB 3.21Å; W255-N259 PolarHBondContact O-N 3.14Å
260	R	82.1	Confident	88.3	Confident	114 Å²	114	40.9 Å²	40.9	43%	0.43	19%	0.187	S	C	.	.	S	Bend	trans	-124.9	138.5	175.8	-64.2	-170.6	-179	106.3	-10.3	109.3	N257 S258 A263 V264	N257-R260 PolarHBondContact O-NH1 2.94Å; N257-R260 PolarHBondContact OD1-NH1 3.24Å; S258-R260 PolarHBondContact O-N 3.48Å; R260-A263 PolarHBondContact O-N 2.83Å; R260-V264 PolarHBondContact O-N 3.37Å
261	Y	80.3	Confident	88.5	Confident	42 Å²	42	42 Å²	42	17%	0.165	20%	0.196	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68.4	143.8	168.5	-83.6	-100.2	0	0	0	109.8	V264 I265 T356 F359 H360	Y261-V264 HydrophobicContact CD1-CG1 4.25Å; Y261-V264 HydrophobicContact CD2-CG1 3.47Å; Y261-V264 VanDerWaalsContact CD2-CG1 3.47Å; Y261-V264 HydrophobicContact CE1-CG1 4.19Å; Y261-V264 HydrophobicContact CE2-CG1 3.38Å; Y261-V264 HydrophobicContact CG-CG1 3.9Å; Y261-I265 HydrophobicContact CD1-CD1 3.9Å; Y261-I265 HydrophobicContact CD1-CG1 3.82Å; Y261-I265 HydrophobicContact CE1-CD1 4.03Å; Y261-I265 HydrophobicContact CE1-CG1 3.62Å; Y261-T356 HydrophobicContact CE2-CG2 3.61Å; Y261-F359 HydrophobicContact CD1-CD2 4.36Å; Y261-F359 HydrophobicContact CD1-CE2 4.47Å; Y261-F359 AromaticContact CE1-CD2 3.71Å; Y261-F359 HydrophobicContact CE1-CD2 3.71Å; Y261-F359 HydrophobicContact CE1-CE2 4.25Å; Y261-H360 PolarHBondContact OH-NE2 3.27Å; Y261-H360 VanDerWaalsContact OH-NE2 3.1Å
262	P	78.9	Confident	88.7	Confident	8 Å²	8	42.3 Å²	42.3	5%	0.052	20%	0.198	C	C	.	.	T	Hydrogen-bonded Turn	cis	-88.1	-6.3	1.3	35.7	-35.8	0	0	0	114.5	V264 I265 A337 L352 L451 L602	P262-V264 VanDerWaalsContact C-N 3.28Å; P262-V264 PolarHBondContact O-N 3.13Å; P262-I265 HydrophobicContact CB-CD1 4.07Å; P262-I265 VanDerWaalsContact O-CB 3.3Å; P262-I265 WeakPolarHBondContact O-CB 3.47Å; P262-I265 WeakPolarHBondContact O-CG1 3.28Å; P262-I265 PolarHBondContact O-N 3.34Å; P262-A337 HydrophobicContact CB-CB 4.07Å; P262-L352 HydrophobicContact CB-CD1 4.15Å; P262-L451 HydrophobicContact CG-CD2 4.32Å; P262-L602 HydrophobicContact CG-CD1 3.43Å; P262-L602 VanDerWaalsContact CG-CD1 3.43Å
263	A	82.1	Confident	88.9	Confident	8 Å²	8	39.3 Å²	39.3	7%	0.066	18%	0.178	C	C	.	.	H	α-helix	trans	-59.9	-34.6	-172.9	0	0	0	0	0	113.7	F251 R260 I265 L266	F251-A263 WeakPolarHBondContact CZ-O 3.15Å; R260-A263 PolarHBondContact O-N 2.83Å; A263-I265 PolarHBondContact O-N 3.36Å; A263-L266 PolarHBondContact O-N 3.33Å; A263-L266 VanDerWaalsContact O-N 3.14Å
264	V	89.3	Confident	89.3	Confident	0 Å²	0	40 Å²	40	0%	0	18%	0.175	C	C	.	.	H	α-helix	trans	-63.7	-21.6	177.6	77.6	0	0	0	0	113.6	W255 R260 Y261 P262 L266 F267 Y268	W255-V264 HydrophobicContact CH2-CG2 4.09Å; W255-V264 HydrophobicContact CZ3-CG2 4.26Å; R260-V264 PolarHBondContact O-N 3.37Å; Y261-V264 HydrophobicContact CD1-CG1 4.25Å; Y261-V264 HydrophobicContact CD2-CG1 3.47Å; Y261-V264 VanDerWaalsContact CD2-CG1 3.47Å; Y261-V264 HydrophobicContact CE1-CG1 4.19Å; Y261-V264 HydrophobicContact CE2-CG1 3.38Å; Y261-V264 HydrophobicContact CG-CG1 3.9Å; P262-V264 VanDerWaalsContact C-N 3.28Å; P262-V264 PolarHBondContact O-N 3.13Å; V264-L266 PolarHBondContact O-N 2.97Å; V264-F267 HydrophobicContact CG2-CB 4.49Å; V264-F267 WeakPolarHBondContact O-CB 3.35Å; V264-F267 PolarHBondContact O-N 3.04Å; V264-F267 VanDerWaalsContact O-N 3.13Å; V264-Y268 HydrophobicContact CB-CE2 4.49Å; V264-Y268 HydrophobicContact CG1-CE2 4.34Å; V264-Y268 HydrophobicContact CG2-CD2 4.3Å; V264-Y268 HydrophobicContact CG2-CE2 3.62Å; V264-Y268 WeakPolarHBondContact O-CD2 3.41Å; V264-Y268 PolarHBondContact O-N 2.83Å
265	I	91.5	Very high	89.8	Confident	0 Å²	0	42.2 Å²	42.2	0%	0	19%	0.189	C	C	.	.	H	α-helix	trans	-58.7	-41.9	173.5	-62.5	166.1	0	0	0	110.1	Y261 P262 A263 F267 Y268 V269 W330 V333 L334 A337	Y261-I265 HydrophobicContact CD1-CD1 3.9Å; Y261-I265 HydrophobicContact CD1-CG1 3.82Å; Y261-I265 HydrophobicContact CE1-CD1 4.03Å; Y261-I265 HydrophobicContact CE1-CG1 3.62Å; P262-I265 HydrophobicContact CB-CD1 4.07Å; P262-I265 VanDerWaalsContact O-CB 3.3Å; P262-I265 WeakPolarHBondContact O-CB 3.47Å; P262-I265 WeakPolarHBondContact O-CG1 3.28Å; P262-I265 PolarHBondContact O-N 3.34Å; A263-I265 PolarHBondContact O-N 3.36Å; I265-F267 VanDerWaalsContact C-N 3.28Å; I265-F267 PolarHBondContact O-N 3.25Å; I265-Y268 PolarHBondContact O-N 3.22Å; I265-Y268 VanDerWaalsContact O-N 3.14Å; I265-V269 HydrophobicContact CG2-CG2 4.31Å; I265-V269 WeakPolarHBondContact O-CG2 3.38Å; I265-V269 PolarHBondContact O-N 3.29Å; I265-W330 HydrophobicContact CG1-CZ3 4.28Å; I265-W330 HydrophobicContact CG2-CE3 3.88Å; I265-W330 HydrophobicContact CG2-CZ3 4.34Å; I265-V333 HydrophobicContact CD1-CG1 4.05Å; I265-V333 HydrophobicContact CG1-CG1 4.35Å; I265-L334 HydrophobicContact CB-CD1 4.25Å; I265-L334 HydrophobicContact CG2-CB 3.93Å; I265-L334 HydrophobicContact CG2-CD1 3.84Å; I265-A337 HydrophobicContact CD1-CB 3.44Å; I265-A337 VanDerWaalsContact CD1-CB 3.44Å
266	L	90.6	Very high	90.3	Very high	1 Å²	1	38.4 Å²	38.4	1%	0.005	18%	0.178	C	C	.	.	H	α-helix	trans	-68.8	-26.6	-179.8	-66.5	168.8	0	0	0	112.4	F251 A263 V264 N270 L334 L451 M531 W534	F251-L266 HydrophobicContact CZ-CB 4.34Å; A263-L266 PolarHBondContact O-N 3.33Å; A263-L266 VanDerWaalsContact O-N 3.14Å; V264-L266 PolarHBondContact O-N 2.97Å; L266-N270 WeakPolarHBondContact O-CB 3.29Å; L266-N270 PolarHBondContact O-N 3.1Å; L266-N270 VanDerWaalsContact O-N 3.07Å; L266-N270 PolarHBondContact O-ND2 3.41Å; L266-L334 HydrophobicContact CD2-CD1 3.77Å; L266-L334 HydrophobicContact CD2-CD2 3.84Å; L266-L334 HydrophobicContact CD2-CG 4.49Å; L266-L334 HydrophobicContact CG-CD1 3.96Å; L266-L451 HydrophobicContact CD1-CD1 4.25Å; L266-M531 HydrophobicContact CD2-SD 4.15Å; L266-W534 HydrophobicContact CD1-CB 4.03Å; L266-W534 HydrophobicContact CD1-CD2 3.31Å; L266-W534 HydrophobicContact CD1-CE3 3.68Å; L266-W534 HydrophobicContact CD1-CG 3.44Å; L266-W534 VanDerWaalsContact CD1-CG 3.44Å; L266-W534 HydrophobicContact CD1-CZ2 4.32Å; L266-W534 HydrophobicContact CD1-CZ3 4.32Å
267	F	94.5	Very high	91	Very high	32 Å²	32	26.8 Å²	26.8	14%	0.14	13%	0.134	C	C	.	.	H	α-helix	trans	-63.2	-48.3	169	168.2	-98	0	0	0	110.9	L248 F251 V252 W255 V264 I265 N270 A271	L248-F267 HydrophobicContact CB-CE2 4.39Å; L248-F267 HydrophobicContact CD2-CD2 3.54Å; L248-F267 HydrophobicContact CD2-CE2 3.46Å; L248-F267 VanDerWaalsContact CD2-CE2 3.46Å; L248-F267 HydrophobicContact CD2-CG 4.35Å; L248-F267 HydrophobicContact CD2-CZ 4.19Å; L248-F267 WeakPolarHBondContact CD2-O 3.48Å; F251-F267 HydrophobicContact CB-CB 4.4Å; F251-F267 HydrophobicContact CB-CD2 3.54Å; F251-F267 HydrophobicContact CB-CE2 4.24Å; F251-F267 HydrophobicContact CB-CG 4.33Å; F251-F267 HydrophobicContact CD1-CB 3.93Å; F251-F267 HydrophobicContact CD2-CB 4.13Å; F251-F267 HydrophobicContact CD2-CD2 4.38Å; F251-F267 HydrophobicContact CE1-CB 4.18Å; F251-F267 HydrophobicContact CE2-CB 4.36Å; F251-F267 HydrophobicContact CG-CB 3.92Å; F251-F267 AromaticContact CG-CD2 3.97Å; F251-F267 HydrophobicContact CG-CD2 3.97Å; F251-F267 HydrophobicContact CG-CG 4.38Å; F251-F267 HydrophobicContact CZ-CB 4.39Å; V252-F267 HydrophobicContact CG2-CE2 4.17Å; W255-F267 HydrophobicContact CH2-CD1 4.37Å; W255-F267 HydrophobicContact CH2-CE1 4.21Å; W255-F267 HydrophobicContact CZ3-CD1 4.02Å; W255-F267 AromaticContact CZ3-CE1 3.99Å; W255-F267 HydrophobicContact CZ3-CE1 3.99Å; W255-F267 HydrophobicContact CZ3-CE2 4.46Å; W255-F267 HydrophobicContact CZ3-CG 4.29Å; W255-F267 HydrophobicContact CZ3-CZ 4.22Å; V264-F267 HydrophobicContact CG2-CB 4.49Å; V264-F267 WeakPolarHBondContact O-CB 3.35Å; V264-F267 PolarHBondContact O-N 3.04Å; V264-F267 VanDerWaalsContact O-N 3.13Å; I265-F267 VanDerWaalsContact C-N 3.28Å; I265-F267 PolarHBondContact O-N 3.25Å; F267-N270 PolarHBondContact O-N 3.35Å; F267-A271 WeakPolarHBondContact O-CB 3.5Å; F267-A271 PolarHBondContact O-N 3.36Å
268	Y	96.2	Very high	91.8	Very high	45 Å²	45	28.7 Å²	28.7	18%	0.176	14%	0.144	C	C	.	.	H	α-helix	trans	-67.5	-37.8	178.8	-63.8	-66.6	0	0	0	113.4	V264 I265 A271 C272 W330 H360 W364	V264-Y268 HydrophobicContact CB-CE2 4.49Å; V264-Y268 HydrophobicContact CG1-CE2 4.34Å; V264-Y268 HydrophobicContact CG2-CD2 4.3Å; V264-Y268 HydrophobicContact CG2-CE2 3.62Å; V264-Y268 WeakPolarHBondContact O-CD2 3.41Å; V264-Y268 PolarHBondContact O-N 2.83Å; I265-Y268 PolarHBondContact O-N 3.22Å; I265-Y268 VanDerWaalsContact O-N 3.14Å; Y268-A271 WeakPolarHBondContact O-CB 3.38Å; Y268-A271 PolarHBondContact O-N 3.06Å; Y268-C272 PolarHBondContact O-N 2.88Å; Y268-C272 PolarHBondContact O-SG 3.39Å; Y268-W330 HydrophobicContact CD1-CZ2 4.37Å; Y268-W330 AromaticContact CD2-CH2 3.78Å; Y268-W330 HydrophobicContact CD2-CH2 3.78Å; Y268-W330 AromaticContact CD2-CZ2 3.85Å; Y268-W330 HydrophobicContact CD2-CZ2 3.85Å; Y268-W330 HydrophobicContact CD2-CZ3 4.35Å; Y268-W330 HydrophobicContact CE2-CH2 4.43Å; Y268-W330 HydrophobicContact CG-CH2 4.14Å; Y268-W330 AromaticContact CG-CZ2 3.72Å; Y268-W330 HydrophobicContact CG-CZ2 3.72Å; Y268-H360 AromaticContact CD2-CE1 3.85Å; Y268-H360 AromaticContact CE2-CE1 3.34Å; Y268-H360 WeakPolarHBondContact CE2-CE1 3.48Å; Y268-H360 AromaticContact CE2-NE2 3.87Å; Y268-H360 AromaticContact CZ-CE1 3.44Å; Y268-H360 VanDerWaalsContact CZ-CE1 3.44Å; Y268-W364 AromaticContact CD1-CZ2 3.91Å; Y268-W364 HydrophobicContact CD1-CZ2 3.91Å; Y268-W364 HydrophobicContact CG-CZ2 4.5Å
269	V	95.4	Very high	92.5	Very high	4 Å²	4	28.8 Å²	28.8	2%	0.024	14%	0.144	C	C	.	.	H	α-helix	trans	-57.4	-50.7	171.9	173.5	0	0	0	0	110.5	I265 A271 C272 F273 W330 M531	I265-V269 HydrophobicContact CG2-CG2 4.31Å; I265-V269 WeakPolarHBondContact O-CG2 3.38Å; I265-V269 PolarHBondContact O-N 3.29Å; V269-A271 VanDerWaalsContact C-N 3.28Å; V269-A271 PolarHBondContact O-N 3.04Å; V269-C272 PolarHBondContact O-N 3.39Å; V269-F273 HydrophobicContact CG1-CD2 3.88Å; V269-F273 HydrophobicContact CG1-CE2 3.82Å; V269-F273 VanDerWaalsContact O-CD2 3.28Å; V269-F273 WeakPolarHBondContact O-CD2 3.37Å; V269-F273 PolarHBondContact O-N 3.45Å; V269-F273 VanDerWaalsContact O-N 3.12Å; V269-W330 HydrophobicContact CG2-CB 3.68Å; V269-M531 HydrophobicContact CG1-CB 4Å; V269-M531 HydrophobicContact CG1-CG 3.75Å
270	N	96.8	Very high	93.3	Very high	0 Å²	0	25.7 Å²	25.7	0%	0	13%	0.127	C	C	.	.	H	α-helix	trans	-64.1	-32	177.2	-80.7	-91.4	0	0	0	112.4	T244 T247 L248 L266 F267 F273 F274 M531 S532	T244-N270 HydrophobicContact CG2-CB 4.48Å; T247-N270 HydrophobicContact CG2-CB 4.07Å; L248-N270 HydrophobicContact CD2-CB 4.3Å; L266-N270 WeakPolarHBondContact O-CB 3.29Å; L266-N270 PolarHBondContact O-N 3.1Å; L266-N270 VanDerWaalsContact O-N 3.07Å; L266-N270 PolarHBondContact O-ND2 3.41Å; F267-N270 PolarHBondContact O-N 3.35Å; N270-F273 PolarHBondContact O-N 2.79Å; N270-F274 VanDerWaalsContact O-CB 3.29Å; N270-F274 WeakPolarHBondContact O-CB 3.37Å; N270-F274 PolarHBondContact O-N 3.43Å; N270-M531 PolarHBondContact ND2-O 2.04Å; N270-S532 VanDerWaalsContact OD1-CA 3.23Å; N270-S532 WeakPolarHBondContact OD1-CA 3.38Å; N270-S532 WeakPolarHBondContact OD1-CB 3.25Å; N270-S532 PolarHBondContact OD1-N 2.87Å
271	A	98.1	Very high	94	Very high	24 Å²	24	22.7 Å²	22.7	20%	0.198	12%	0.119	C	C	.	.	H	α-helix	trans	-65.7	-41.4	175.5	0	0	0	0	0	111.8	L248 F267 Y268 V269 F274 V275	L248-A271 HydrophobicContact CD2-CB 3.87Å; F267-A271 WeakPolarHBondContact O-CB 3.5Å; F267-A271 PolarHBondContact O-N 3.36Å; Y268-A271 WeakPolarHBondContact O-CB 3.38Å; Y268-A271 PolarHBondContact O-N 3.06Å; V269-A271 VanDerWaalsContact C-N 3.28Å; V269-A271 PolarHBondContact O-N 3.04Å; A271-F274 PolarHBondContact O-N 3.07Å; A271-V275 WeakPolarHBondContact O-CG2 3.48Å; A271-V275 PolarHBondContact O-N 2.96Å
272	C	98.2	Very high	94.8	Very high	6 Å²	6	21.7 Å²	21.7	4%	0.041	12%	0.119	C	C	.	.	H	α-helix	trans	-61.4	-51.4	174.3	-61.4	0	0	0	0	110.8	Y268 V269 F274 V275 G276 A323	Y268-C272 PolarHBondContact O-N 2.88Å; Y268-C272 PolarHBondContact O-SG 3.39Å; V269-C272 PolarHBondContact O-N 3.39Å; C272-F274 VanDerWaalsContact C-N 3.3Å; C272-F274 PolarHBondContact O-N 3.5Å; C272-V275 PolarHBondContact O-N 3.38Å; C272-G276 PolarHBondContact O-N 2.98Å; C272-A323 WeakPolarHBondContact O-CB 3.27Å
273	F	97.7	Very high	95.7	Very high	27 Å²	27	21.5 Å²	21.5	12%	0.118	12%	0.118	C	C	.	.	H	α-helix	trans	-63.8	-32.1	178.3	-76.8	-71.7	0	0	0	113.6	T244 V269 N270 S277 M524 T527	T244-F273 HydrophobicContact CG2-CB 3.91Å; V269-F273 HydrophobicContact CG1-CD2 3.88Å; V269-F273 HydrophobicContact CG1-CE2 3.82Å; V269-F273 VanDerWaalsContact O-CD2 3.28Å; V269-F273 WeakPolarHBondContact O-CD2 3.37Å; V269-F273 PolarHBondContact O-N 3.45Å; V269-F273 VanDerWaalsContact O-N 3.12Å; N270-F273 PolarHBondContact O-N 2.79Å; F273-S277 WeakPolarHBondContact O-CB 3.3Å; F273-S277 PolarHBondContact O-N 2.97Å; F273-S277 PolarHBondContact O-OG 2.93Å; F273-M524 VanDerWaalsContact CE1-O 3.28Å; F273-M524 WeakPolarHBondContact CE1-O 3.32Å; F273-T527 HydrophobicContact CE1-CG2 4.31Å; F273-T527 HydrophobicContact CE2-CG2 3.77Å; F273-T527 HydrophobicContact CZ-CG2 3.42Å; F273-T527 VanDerWaalsContact CZ-CG2 3.42Å
274	F	98.6	Very high	96.4	Very high	50 Å²	50	24.7 Å²	24.7	22%	0.219	13%	0.13	C	C	.	.	H	α-helix	trans	-65	-49.7	173.8	178.9	-112.8	0	0	0	111.8	T244 L245 L248 N270 A271 C272 G276 S277 I278	T244-F274 WeakPolarHBondContact OG1-CB 3.28Å; L245-F274 HydrophobicContact CB-CD2 4.06Å; L245-F274 HydrophobicContact CB-CE2 3.76Å; L245-F274 HydrophobicContact CD1-CE2 4.06Å; L245-F274 HydrophobicContact CD1-CZ 3.97Å; L245-F274 HydrophobicContact CD2-CE2 4.4Å; L245-F274 HydrophobicContact CG-CE2 4.28Å; L248-F274 HydrophobicContact CD1-CB 3.77Å; L248-F274 HydrophobicContact CD1-CD1 3.78Å; L248-F274 HydrophobicContact CD1-CG 3.79Å; N270-F274 VanDerWaalsContact O-CB 3.29Å; N270-F274 WeakPolarHBondContact O-CB 3.37Å; N270-F274 PolarHBondContact O-N 3.43Å; A271-F274 PolarHBondContact O-N 3.07Å; C272-F274 VanDerWaalsContact C-N 3.3Å; C272-F274 PolarHBondContact O-N 3.5Å; F274-G276 PolarHBondContact O-N 3.17Å; F274-S277 WeakPolarHBondContact O-CB 3.34Å; F274-S277 PolarHBondContact O-N 3.45Å; F274-I278 HydrophobicContact CD1-CD1 4.16Å; F274-I278 HydrophobicContact CE1-CD1 3.7Å; F274-I278 HydrophobicContact CE2-CD1 4.48Å; F274-I278 HydrophobicContact CZ-CD1 3.87Å; F274-I278 PolarHBondContact O-N 3.14Å; F274-I278 VanDerWaalsContact O-N 3.08Å
275	V	98.4	Very high	96.6	Very high	69 Å²	69	31.1 Å²	31.1	42%	0.418	16%	0.162	S	C	.	.	H	α-helix	trans	-62.8	-42.4	177.3	172.3	0	0	0	0	111.3	A271 C272 S277 I278 G279 I319 A323	A271-V275 WeakPolarHBondContact O-CG2 3.48Å; A271-V275 PolarHBondContact O-N 2.96Å; C272-V275 PolarHBondContact O-N 3.38Å; V275-S277 VanDerWaalsContact C-N 3.34Å; V275-S277 PolarHBondContact O-N 2.82Å; V275-I278 WeakPolarHBondContact O-CB 3.43Å; V275-I278 PolarHBondContact O-N 2.8Å; V275-G279 PolarHBondContact O-N 2.75Å; V275-I319 HydrophobicContact CG1-CG2 3.98Å; V275-I319 WeakPolarHBondContact O-CG2 3.35Å; V275-A323 HydrophobicContact CG1-CB 4.41Å
276	G	98	Very high	96.7	Very high	10 Å²	10	39.4 Å²	39.4	10%	0.103	21%	0.206	C	C	.	.	H	α-helix	trans	-60.5	-41.5	173.6	0	0	0	0	0	112.7	C272 F274 I278 G279 W280	C272-G276 PolarHBondContact O-N 2.98Å; F274-G276 PolarHBondContact O-N 3.17Å; G276-I278 VanDerWaalsContact C-N 3.31Å; G276-I278 PolarHBondContact O-N 3.36Å; G276-G279 PolarHBondContact O-N 2.98Å; G276-G279 VanDerWaalsContact O-N 3.13Å; G276-W280 VanDerWaalsContact O-CD1 3.25Å; G276-W280 PolarHBondContact O-N 3.3Å
277	S	98.3	Very high	96.8	Very high	3 Å²	3	42.1 Å²	42.1	2%	0.021	24%	0.235	C	C	.	.	H	α-helix	trans	-62.2	-36.4	176.1	-57.9	0	0	0	0	112.3	F273 F274 V275 W280 L281	F273-S277 WeakPolarHBondContact O-CB 3.3Å; F273-S277 PolarHBondContact O-N 2.97Å; F273-S277 PolarHBondContact O-OG 2.93Å; F274-S277 WeakPolarHBondContact O-CB 3.34Å; F274-S277 PolarHBondContact O-N 3.45Å; V275-S277 VanDerWaalsContact C-N 3.34Å; V275-S277 PolarHBondContact O-N 2.82Å; S277-W280 PolarHBondContact O-N 2.95Å; S277-L281 WeakPolarHBondContact O-CB 3.3Å; S277-L281 VanDerWaalsContact O-CG 3.24Å; S277-L281 WeakPolarHBondContact O-CG 3.41Å; S277-L281 PolarHBondContact O-N 3.05Å
278	I	97.9	Very high	96.8	Very high	85 Å²	85	41.3 Å²	41.3	44%	0.436	23%	0.233	S	C	.	.	H	α-helix	trans	-61.7	-44.6	173	-65.7	167.1	0	0	0	110.6	F274 V275 G276 W280 L281 A282	F274-I278 HydrophobicContact CD1-CD1 4.16Å; F274-I278 HydrophobicContact CE1-CD1 3.7Å; F274-I278 HydrophobicContact CE2-CD1 4.48Å; F274-I278 HydrophobicContact CZ-CD1 3.87Å; F274-I278 PolarHBondContact O-N 3.14Å; F274-I278 VanDerWaalsContact O-N 3.08Å; V275-I278 WeakPolarHBondContact O-CB 3.43Å; V275-I278 PolarHBondContact O-N 2.8Å; G276-I278 VanDerWaalsContact C-N 3.31Å; G276-I278 PolarHBondContact O-N 3.36Å; I278-W280 PolarHBondContact O-N 3.3Å; I278-L281 PolarHBondContact O-N 3.35Å; I278-A282 PolarHBondContact O-N 2.98Å
279	G	97.5	Very high	96.8	Very high	1 Å²	1	42.4 Å²	42.4	1%	0.01	24%	0.237	C	C	.	.	H	α-helix	trans	-59.6	-45.1	177.2	0	0	0	0	0	113.1	V275 G276 L281 A282	V275-G279 PolarHBondContact O-N 2.75Å; G276-G279 PolarHBondContact O-N 2.98Å; G276-G279 VanDerWaalsContact O-N 3.13Å; G279-L281 VanDerWaalsContact C-N 3.35Å; G279-L281 PolarHBondContact O-N 3.35Å; G279-A282 PolarHBondContact O-N 3.48Å
280	W	98.1	Very high	96.8	Very high	10 Å²	10	51.4 Å²	51.4	4%	0.038	27%	0.271	C	S	.	.	H	α-helix	trans	-66	-33.2	175.5	-78.1	106.7	0	0	0	113.7	I233 G276 S277 I278 Q283 V320 I388 L521 M524 F525	I233-W280 HydrophobicContact CD1-CE3 4.29Å; I233-W280 HydrophobicContact CD1-CZ3 4.07Å; I233-W280 HydrophobicContact CG2-CB 4.33Å; I233-W280 HydrophobicContact CG2-CE3 3.97Å; G276-W280 VanDerWaalsContact O-CD1 3.25Å; G276-W280 PolarHBondContact O-N 3.3Å; S277-W280 PolarHBondContact O-N 2.95Å; I278-W280 PolarHBondContact O-N 3.3Å; W280-Q283 PolarHBondContact O-NE2 3.41Å; W280-V320 HydrophobicContact CZ2-CG1 4.36Å; W280-I388 HydrophobicContact CD2-CD1 4.26Å; W280-I388 HydrophobicContact CD2-CG2 4.41Å; W280-I388 HydrophobicContact CE3-CD1 4.05Å; W280-I388 HydrophobicContact CE3-CG1 4.31Å; W280-I388 HydrophobicContact CE3-CG2 3.86Å; W280-I388 HydrophobicContact CH2-CD1 3.39Å; W280-I388 HydrophobicContact CH2-CG1 4.01Å; W280-I388 HydrophobicContact CZ2-CD1 3.63Å; W280-I388 HydrophobicContact CZ3-CD1 3.62Å; W280-I388 HydrophobicContact CZ3-CG1 3.82Å; W280-I388 HydrophobicContact CZ3-CG2 4.19Å; W280-L521 HydrophobicContact CE3-CD2 4.39Å; W280-L521 HydrophobicContact CH2-CD2 3.48Å; W280-L521 VanDerWaalsContact CH2-CD2 3.48Å; W280-L521 HydrophobicContact CZ2-CD2 3.74Å; W280-L521 HydrophobicContact CZ3-CD2 3.83Å; W280-M524 HydrophobicContact CZ2-CE 4.19Å; W280-M524 HydrophobicContact CZ2-SD 4.11Å; W280-F525 HydrophobicContact CB-CE1 4.35Å; W280-F525 HydrophobicContact CB-CZ 3.85Å; W280-F525 AromaticContact CD1-CE1 3.97Å; W280-F525 AromaticContact CD1-CZ 3.75Å; W280-F525 HydrophobicContact CD2-CZ 4.09Å; W280-F525 HydrophobicContact CG-CE1 4.21Å; W280-F525 AromaticContact CG-CZ 3.64Å; W280-F525 HydrophobicContact CG-CZ 3.64Å
281	L	98.1	Very high	96.7	Very high	52 Å²	52	56.4 Å²	56.4	27%	0.272	29%	0.294	S	S	.	.	H	α-helix	trans	-83.1	-15.8	180	-70.8	173.5	0	0	0	114.1	S277 I278 G279 Q283 F284	S277-L281 WeakPolarHBondContact O-CB 3.3Å; S277-L281 VanDerWaalsContact O-CG 3.24Å; S277-L281 WeakPolarHBondContact O-CG 3.41Å; S277-L281 PolarHBondContact O-N 3.05Å; I278-L281 PolarHBondContact O-N 3.35Å; G279-L281 VanDerWaalsContact C-N 3.35Å; G279-L281 PolarHBondContact O-N 3.35Å; L281-Q283 PolarHBondContact O-N 3.42Å; L281-Q283 VanDerWaalsContact O-N 3.13Å; L281-F284 HydrophobicContact CB-CD2 4.45Å; L281-F284 HydrophobicContact CD2-CD2 3.88Å; L281-F284 HydrophobicContact CD2-CE2 3.93Å; L281-F284 WeakPolarHBondContact O-CD2 3.48Å; L281-F284 PolarHBondContact O-N 3.46Å; L281-F284 VanDerWaalsContact O-N 3.11Å
282	A	97.3	Very high	96.6	Very high	20 Å²	20	55.7 Å²	55.7	17%	0.165	29%	0.287	C	S	.	.	G	3₁₀ helix	trans	-57.5	-30.5	-177.9	0	0	0	0	0	113.5	I278 G279 F284 M285 A288 I292 I316	I278-A282 PolarHBondContact O-N 2.98Å; G279-A282 PolarHBondContact O-N 3.48Å; A282-F284 PolarHBondContact O-N 3.18Å; A282-M285 PolarHBondContact O-N 3.43Å; A282-A288 WeakPolarHBondContact O-CB 3.33Å; A282-I292 HydrophobicContact CB-CD1 4.43Å; A282-I316 HydrophobicContact CB-CD1 3.48Å; A282-I316 VanDerWaalsContact CB-CD1 3.48Å; A282-I316 HydrophobicContact CB-CG1 4.47Å
283	Q	96.3	Very high	96.5	Very high	4 Å²	4	55.5 Å²	55.5	2%	0.019	29%	0.285	C	S	.	.	G	3₁₀ helix	trans	-63.2	-18.5	179	72.3	173.5	-79.7	0	0	115	W280 L281 R289 S386 G387	W280-Q283 PolarHBondContact O-NE2 3.41Å; L281-Q283 PolarHBondContact O-N 3.42Å; L281-Q283 VanDerWaalsContact O-N 3.13Å; Q283-R289 HydrophobicContact CB-CB 4.2Å; Q283-R289 HydrophobicContact CB-CG 4.43Å; Q283-S386 PolarHBondContact NE2-O 3.49Å; Q283-G387 WeakPolarHBondContact CB-O 3.41Å
284	F	97.2	Very high	96.4	Very high	75 Å²	75	55.1 Å²	55.1	33%	0.329	29%	0.286	S	S	.	.	G	3₁₀ helix	trans	-88.6	-0.7	-177.1	-58.5	-71.9	0	0	0	113.5	H230 I233 A234 L281 A282	H230-F284 HydrophobicContact CB-CE1 4.14Å; H230-F284 WeakPolarHBondContact O-CE1 3.42Å; H230-F284 VanDerWaalsContact O-CZ 3.22Å; H230-F284 WeakPolarHBondContact O-CZ 3.49Å; I233-F284 HydrophobicContact CB-CZ 4.3Å; I233-F284 HydrophobicContact CG2-CE2 4.11Å; I233-F284 HydrophobicContact CG2-CZ 4.17Å; A234-F284 HydrophobicContact CB-CD1 4.5Å; A234-F284 HydrophobicContact CB-CE1 3.89Å; A234-F284 HydrophobicContact CB-CE2 4.01Å; A234-F284 HydrophobicContact CB-CZ 3.65Å; L281-F284 HydrophobicContact CB-CD2 4.45Å; L281-F284 HydrophobicContact CD2-CD2 3.88Å; L281-F284 HydrophobicContact CD2-CE2 3.93Å; L281-F284 WeakPolarHBondContact O-CD2 3.48Å; L281-F284 PolarHBondContact O-N 3.46Å; L281-F284 VanDerWaalsContact O-N 3.11Å; A282-F284 PolarHBondContact O-N 3.18Å
285	M	95	Very high	96.2	Very high	135 Å²	135	53.4 Å²	53.4	67%	0.665	28%	0.278	S	S	*	.	S	Bend	trans	-70.7	148.6	166.8	-66	174.7	60.1	0	0	110.3	A282 G287 A288	A282-M285 PolarHBondContact O-N 3.43Å; M285-G287 PolarHBondContact O-N 3Å; M285-G287 VanDerWaalsContact O-N 3.14Å; M285-A288 HydrophobicContact CB-CB 3.73Å; M285-A288 WeakPolarHBondContact O-CB 3.3Å; M285-A288 PolarHBondContact O-N 3.27Å
286	D	93.6	Very high	95.9	Very high	175 Å²	175	54.7 Å²	54.7	94%	0.936	30%	0.296	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.9	119.2	-175.8	-67	-38.4	0	0	0	111.8	A288	D286-A288 PolarHBondContact O-N 3.48Å; D286-A288 VanDerWaalsContact O-N 3.12Å
287	G	91.8	Very high	95.5	Very high	58 Å²	58	56.1 Å²	56.1	60%	0.598	30%	0.301	S	S	*	.	T	Hydrogen-bonded Turn	trans	74.7	-15.4	-177.7	0	0	0	0	0	116.1	M285 R289 R290 E291	M285-G287 PolarHBondContact O-N 3Å; M285-G287 VanDerWaalsContact O-N 3.14Å; G287-R289 PolarHBondContact O-N 3.29Å; G287-R290 PolarHBondContact O-N 2.99Å; G287-E291 PolarHBondContact O-N 2.77Å
288	A	95.1	Very high	95.2	Very high	14 Å²	14	57.6 Å²	57.6	12%	0.116	32%	0.317	C	S	.	.	H	α-helix	trans	-60.1	-38.7	-168.4	0	0	0	0	0	113.9	A282 M285 D286 R290 E291 I292	A282-A288 WeakPolarHBondContact O-CB 3.33Å; M285-A288 HydrophobicContact CB-CB 3.73Å; M285-A288 WeakPolarHBondContact O-CB 3.3Å; M285-A288 PolarHBondContact O-N 3.27Å; D286-A288 PolarHBondContact O-N 3.48Å; D286-A288 VanDerWaalsContact O-N 3.12Å; A288-R290 VanDerWaalsContact C-N 3.26Å; A288-R290 PolarHBondContact O-N 3.41Å; A288-E291 PolarHBondContact O-N 2.85Å; A288-E291 VanDerWaalsContact O-N 3.1Å; A288-I292 HydrophobicContact CB-CD1 4.23Å; A288-I292 WeakPolarHBondContact O-CB 3.4Å; A288-I292 WeakPolarHBondContact O-CD1 3.22Å; A288-I292 WeakPolarHBondContact O-CG1 3.38Å; A288-I292 PolarHBondContact O-N 3.14Å
289	R	95.2	Very high	95	Very high	69 Å²	69	53.7 Å²	53.7	26%	0.26	30%	0.297	S	S	.	.	H	α-helix	trans	-54.5	-41.5	175.9	-171.5	-175.3	-63.3	128.9	3.1	112.6	H230 Q283 G287 V293	H230-R289 PolarHBondContact CE1-NE 3.44Å; H230-R289 PolarHBondContact CE1-NH1 2.91Å; H230-R289 PolarHBondContact ND1-NH1 2.86Å; H230-R289 VanDerWaalsContact ND1-NH1 3.15Å; H230-R289 PolarHBondContact ND1-NH2 3.46Å; H230-R289 PolarHBondContact NE2-NE 3.21Å; Q283-R289 HydrophobicContact CB-CB 4.2Å; Q283-R289 HydrophobicContact CB-CG 4.43Å; G287-R289 PolarHBondContact O-N 3.29Å; R289-V293 HydrophobicContact CG-CG2 4.48Å; R289-V293 WeakPolarHBondContact O-CB 3.45Å; R289-V293 WeakPolarHBondContact O-CG2 3.49Å; R289-V293 PolarHBondContact O-N 2.61Å
290	R	95.1	Very high	94.8	Very high	193 Å²	193	55.3 Å²	55.3	73%	0.728	31%	0.305	S	S	*	.	H	α-helix	trans	-70.5	-39.6	178.4	-71.8	-173.5	176.6	-174.5	-1.5	111.2	G287 A288 I292 C294	G287-R290 PolarHBondContact O-N 2.99Å; A288-R290 VanDerWaalsContact C-N 3.26Å; A288-R290 PolarHBondContact O-N 3.41Å; R290-I292 VanDerWaalsContact C-N 3.35Å; R290-C294 WeakPolarHBondContact O-CA 3.41Å; R290-C294 WeakPolarHBondContact O-CB 3.46Å; R290-C294 PolarHBondContact O-N 3.39Å
291	E	95.1	Very high	94.6	Very high	105 Å²	105	55 Å²	55	49%	0.491	30%	0.303	S	S	.	.	H	α-helix	trans	-65.2	-37.5	176	-160.8	-162.4	130	0	0	112.6	G287 A288 R301 S312	G287-E291 PolarHBondContact O-N 2.77Å; A288-E291 PolarHBondContact O-N 2.85Å; A288-E291 VanDerWaalsContact O-N 3.1Å; E291-R301 PolarHBondContact O-NH2 2.98Å; E291-S312 WeakPolarHBondContact OE1-CB 3.02Å; E291-S312 PolarHBondContact OE1-OG 2.96Å
292	I	96	Very high	94.4	Very high	9 Å²	9	55 Å²	55	5%	0.046	30%	0.304	C	S	.	.	H	α-helix	trans	-72.9	-46.2	179.9	-66.8	160	0	0	0	111.3	A282 A288 R290 R301 C313 I316 C389	A282-I292 HydrophobicContact CB-CD1 4.43Å; A288-I292 HydrophobicContact CB-CD1 4.23Å; A288-I292 WeakPolarHBondContact O-CB 3.4Å; A288-I292 WeakPolarHBondContact O-CD1 3.22Å; A288-I292 WeakPolarHBondContact O-CG1 3.38Å; A288-I292 PolarHBondContact O-N 3.14Å; R290-I292 VanDerWaalsContact C-N 3.35Å; I292-R301 VanDerWaalsContact O-CD 3.26Å; I292-R301 WeakPolarHBondContact O-CD 3.49Å; I292-R301 PolarHBondContact O-NE 3.07Å; I292-C313 VanDerWaalsContact O-CB 3.24Å; I292-C313 WeakPolarHBondContact O-CB 3.21Å; I292-I316 HydrophobicContact CD1-CG1 3.94Å; I292-I316 HydrophobicContact CG1-CG1 4.01Å; I292-I316 HydrophobicContact CG2-CB 4.32Å; I292-I316 HydrophobicContact CG2-CG1 4.2Å; I292-I316 HydrophobicContact CG2-CG2 4.48Å; I292-C389 PolarHBondContact O-SG 2.97Å
293	V	96.6	Very high	94.2	Very high	1 Å²	1	55.3 Å²	55.3	1%	0.006	31%	0.309	C	S	.	.	H	α-helix	trans	-99.1	-32.1	-168	179.1	0	0	0	0	113.4	R289 R301	R289-V293 HydrophobicContact CG-CG2 4.48Å; R289-V293 WeakPolarHBondContact O-CB 3.45Å; R289-V293 WeakPolarHBondContact O-CG2 3.49Å; R289-V293 PolarHBondContact O-N 2.61Å; V293-R301 WeakPolarHBondContact O-CB 3.34Å; V293-R301 WeakPolarHBondContact O-CG 3.41Å; V293-R301 PolarHBondContact O-N 3.39Å
294	C	95.4	Very high	94	Very high	20 Å²	20	55.2 Å²	55.2	14%	0.135	31%	0.309	C	S	.	.	B	Isolated β-bridge	trans	-94.9	151.5	-176.9	-44.5	0	0	0	0	111.8	C216 R290 T299 R301	C216-C294 HydrophobicContact CB-CB 3.64Å; C216-C294 WeakPolarHBondContact CB-SG 3.48Å; C216-C294 WeakPolarHBondContact SG-CA 3.48Å; C216-C294 WeakPolarHBondContact SG-CB 3.36Å; C216-C294 CovalentContact SG-SG 2.03Å; C216-C294 PolarHBondContact SG-SG 2.88Å; R290-C294 WeakPolarHBondContact O-CA 3.41Å; R290-C294 WeakPolarHBondContact O-CB 3.46Å; R290-C294 PolarHBondContact O-N 3.39Å; C294-T299 WeakPolarHBondContact CA-O 3.36Å; C294-R301 PolarHBondContact O-NE 2.98Å; C294-R301 PolarHBondContact O-NH2 2.99Å
295	R	94.4	Very high	93.8	Very high	14 Å²	14	54.3 Å²	54.3	5%	0.053	31%	0.31	C	S	.	.			trans	-81	166.5	162.6	-75.3	-169.3	172.4	151.2	5	111.3	K203 S204 D297 G298 T299 R301 L302 E304 T306 E309	K203-R295 PolarHBondContact O-NH1 3.37Å; S204-R295 PolarHBondContact OG-NH1 3.44Å; R295-D297 WeakPolarHBondContact CB-OD1 3.34Å; R295-D297 PolarHBondContact O-N 3.09Å; R295-G298 PolarHBondContact O-N 2.56Å; R295-T299 PolarHBondContact N-O 3.19Å; R295-R301 HydrophobicContact CG-CG 3.71Å; R295-L302 PolarHBondContact NH2-O 3.07Å; R295-E304 IonicContact NE-OE1 3.21Å; R295-E304 IonicContact NH2-OE1 3.71Å; R295-T306 PolarHBondContact NH2-OG1 3.44Å; R295-E309 WeakPolarHBondContact CB-OE1 3.21Å; R295-E309 HydrophobicContact CG-CG 4.1Å
296	A	91.6	Very high	93.5	Very high	95 Å²	95	48.8 Å²	48.8	79%	0.785	28%	0.284	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.6	-25	176	0	0	0	0	0	114	G298 E309	A296-G298 VanDerWaalsContact C-N 3.31Å; A296-E309 PolarHBondContact N-OE2 2.89Å
297	D	90.8	Very high	93	Very high	41 Å²	41	45 Å²	45	22%	0.219	27%	0.271	C	S	.	.	T	Hydrogen-bonded Turn	trans	-82.9	-0.4	176.3	66.8	3.4	0	0	0	114.2	T199 S204 R295 T299	T199-D297 PolarHBondContact OG1-OD2 2.93Å; S204-D297 WeakPolarHBondContact CB-OD2 3.34Å; S204-D297 PolarHBondContact OG-OD2 3.09Å; R295-D297 WeakPolarHBondContact CB-OD1 3.34Å; R295-D297 PolarHBondContact O-N 3.09Å; D297-T299 VanDerWaalsContact C-N 3.34Å; D297-T299 WeakPolarHBondContact OD1-CB 3.33Å; D297-T299 WeakPolarHBondContact OD1-CG2 3.36Å; D297-T299 PolarHBondContact OD1-N 3.01Å; D297-T299 PolarHBondContact OD1-OG1 3.35Å; D297-T299 PolarHBondContact OD2-OG1 3.14Å
298	G	91.3	Very high	92.7	Very high	34 Å²	34	49.1 Å²	49.1	35%	0.351	28%	0.279	S	S	.	.	S	Bend	trans	83.2	2.4	-178	0	0	0	0	0	115.1	C216 R295 A296	C216-G298 WeakPolarHBondContact CB-O 3.24Å; C216-G298 PolarHBondContact N-O 2.88Å; R295-G298 PolarHBondContact O-N 2.56Å; A296-G298 VanDerWaalsContact C-N 3.31Å
299	T	93.9	Very high	92.4	Very high	2 Å²	2	50.2 Å²	50.2	1%	0.012	28%	0.282	C	S	.	.	B	Isolated β-bridge	trans	-80.8	163.1	172.6	65	0	0	0	0	112.3	V197 T199 S204 I214 C294 R295 D297	V197-T299 HydrophobicContact CG1-CG2 3.63Å; T199-T299 HydrophobicContact CG2-CG2 4.17Å; S204-T299 PolarHBondContact OG-OG1 3.13Å; I214-T299 WeakPolarHBondContact O-CA 3.49Å; I214-T299 VanDerWaalsContact O-CB 3.23Å; I214-T299 WeakPolarHBondContact O-CB 3.37Å; C294-T299 WeakPolarHBondContact CA-O 3.36Å; R295-T299 PolarHBondContact N-O 3.19Å; D297-T299 VanDerWaalsContact C-N 3.34Å; D297-T299 WeakPolarHBondContact OD1-CB 3.33Å; D297-T299 WeakPolarHBondContact OD1-CG2 3.36Å; D297-T299 PolarHBondContact OD1-N 3.01Å; D297-T299 PolarHBondContact OD1-OG1 3.35Å; D297-T299 PolarHBondContact OD2-OG1 3.14Å
300	M	93.3	Very high	92.3	Very high	35 Å²	35	50 Å²	50	17%	0.172	29%	0.288	C	S	.	.	B	Isolated β-bridge	trans	-72.5	145.6	172.4	81.2	-171.4	-68	0	0	110.9	I214 L302 G382	I214-M300 HydrophobicContact CG2-CG 3.7Å; I214-M300 HydrophobicContact CG2-SD 3.6Å; I214-M300 VanDerWaalsContact CG2-SD 3.6Å; I214-M300 PolarHBondContact O-N 3.42Å; M300-L302 HydrophobicContact CE-CD2 3.89Å; M300-L302 HydrophobicContact CG-CD1 4.16Å; M300-L302 HydrophobicContact CG-CD2 3.87Å; M300-L302 HydrophobicContact CG-CG 3.78Å; M300-L302 PolarHBondContact O-N 3.38Å; M300-L302 HydrophobicContact SD-CD1 4.43Å; M300-L302 HydrophobicContact SD-CD2 3.95Å; M300-L302 HydrophobicContact SD-CG 4.36Å; M300-G382 VanDerWaalsContact CE-O 3.28Å; M300-G382 WeakPolarHBondContact CE-O 3.29Å
301	R	94.8	Very high	92.3	Very high	3 Å²	3	46 Å²	46	1%	0.011	28%	0.281	C	S	.	.	P	Polyproline II helix	trans	-73.4	122.6	175.2	-73.1	174	-177.3	-120.4	12.3	111.4	E291 I292 V293 C294 R295 E304 T310 G382	E291-R301 PolarHBondContact O-NH2 2.98Å; I292-R301 VanDerWaalsContact O-CD 3.26Å; I292-R301 WeakPolarHBondContact O-CD 3.49Å; I292-R301 PolarHBondContact O-NE 3.07Å; V293-R301 WeakPolarHBondContact O-CB 3.34Å; V293-R301 WeakPolarHBondContact O-CG 3.41Å; V293-R301 PolarHBondContact O-N 3.39Å; C294-R301 PolarHBondContact O-NE 2.98Å; C294-R301 PolarHBondContact O-NH2 2.99Å; R295-R301 HydrophobicContact CG-CG 3.71Å; R301-E304 HydrophobicContact CB-CG 4.05Å; R301-E304 WeakPolarHBondContact CG-OE1 3.49Å; R301-E304 IonicContact NH1-OE1 2.69Å; R301-T310 PolarHBondContact NH1-O 3.34Å; R301-T310 PolarHBondContact NH2-OG1 3Å; R301-G382 PolarHBondContact O-N 3.29Å
302	L	93	Very high	92.3	Very high	53 Å²	53	42.1 Å²	42.1	28%	0.277	27%	0.265	S	S	.	.			trans	-130	133.4	177.7	-61.6	178.2	0	0	0	109.9	R295 M300 D381 K394	R295-L302 PolarHBondContact NH2-O 3.07Å; M300-L302 HydrophobicContact CE-CD2 3.89Å; M300-L302 HydrophobicContact CG-CD1 4.16Å; M300-L302 HydrophobicContact CG-CD2 3.87Å; M300-L302 HydrophobicContact CG-CG 3.78Å; M300-L302 PolarHBondContact O-N 3.38Å; M300-L302 HydrophobicContact SD-CD1 4.43Å; M300-L302 HydrophobicContact SD-CD2 3.95Å; M300-L302 HydrophobicContact SD-CG 4.36Å; L302-D381 WeakPolarHBondContact CA-OD1 3.45Å; L302-D381 HydrophobicContact CD2-CB 4.35Å; L302-K394 HydrophobicContact CD2-CB 4.01Å
303	G	92.1	Very high	92.3	Very high	27 Å²	27	41.7 Å²	41.7	28%	0.278	26%	0.263	S	S	.	.	S	Bend	trans	68	41.7	174.8	0	0	0	0	0	115.2	A378 V380 D381	G303-A378 CarbonylContact C-O 3.59Å; G303-A378 VanDerWaalsContact CA-O 3.24Å; G303-A378 WeakPolarHBondContact CA-O 3.22Å; G303-V380 PolarHBondContact N-O 3.1Å; G303-D381 PolarHBondContact N-OD1 2.93Å
304	E	93.7	Very high	92.3	Very high	2 Å²	2	42.4 Å²	42.4	1%	0.009	27%	0.268	C	S	.	.	B	Isolated β-bridge	trans	-72.6	148.3	174.1	-61.4	-64.5	163.9	0	0	111.5	R295 R301 T306 V314 A378 V380	R295-E304 IonicContact NE-OE1 3.21Å; R295-E304 IonicContact NH2-OE1 3.71Å; R301-E304 HydrophobicContact CB-CG 4.05Å; R301-E304 WeakPolarHBondContact CG-OE1 3.49Å; R301-E304 IonicContact NH1-OE1 2.69Å; E304-T306 PolarHBondContact OE1-OG1 2.72Å; E304-T306 VanDerWaalsContact OE1-OG1 3.14Å; E304-T306 VanDerWaalsContact OE2-CB 3.31Å; E304-T306 WeakPolarHBondContact OE2-CB 3.43Å; E304-T306 PolarHBondContact OE2-N 2.87Å; E304-T306 PolarHBondContact OE2-OG1 3.42Å; E304-V314 HydrophobicContact CB-CG2 4.15Å; E304-A378 CarbonylContact O-C 3.57Å; E304-A378 VanDerWaalsContact O-CA 3.29Å; E304-A378 WeakPolarHBondContact O-CA 3.32Å; E304-V380 HydrophobicContact CB-CB 4.12Å; E304-V380 HydrophobicContact CB-CG1 4.46Å; E304-V380 WeakPolarHBondContact CB-O 3.44Å; E304-V380 PolarHBondContact N-O 2.7Å; E304-V380 PolarHBondContact O-N 2.97Å
305	P	93.1	Very high	92.4	Very high	56 Å²	56	46 Å²	46	36%	0.364	28%	0.284	S	S	.	.	P	Polyproline II helix	cis	-81.9	131.3	9.1	31.2	-35.4	0	0	0	115.6	V314	P305-V314 HydrophobicContact CB-CG2 4Å
306	T	88.9	Confident	92.6	Very high	19 Å²	19	46 Å²	46	12%	0.117	29%	0.285	C	S	.	.	P	Polyproline II helix	trans	-100.9	140.1	174.3	-40	0	0	0	0	111.5	K203 R295 E304 N308	K203-T306 HydrophobicContact CD-CG2 4.47Å; R295-T306 PolarHBondContact NH2-OG1 3.44Å; E304-T306 PolarHBondContact OE1-OG1 2.72Å; E304-T306 VanDerWaalsContact OE1-OG1 3.14Å; E304-T306 VanDerWaalsContact OE2-CB 3.31Å; E304-T306 WeakPolarHBondContact OE2-CB 3.43Å; E304-T306 PolarHBondContact OE2-N 2.87Å; E304-T306 PolarHBondContact OE2-OG1 3.42Å; T306-N308 VanDerWaalsContact C-N 3.3Å; T306-N308 PolarHBondContact O-N 3.34Å
307	S	82.2	Confident	92.9	Very high	96 Å²	96	41.5 Å²	41.5	67%	0.671	25%	0.248	S	C	*	.	T	Hydrogen-bonded Turn	trans	-66.4	-20.3	-174.3	57.2	0	0	0	0	116.6
308	N	84.9	Confident	93.3	Very high	143 Å²	143	42 Å²	42	77%	0.765	25%	0.253	S	S	*	.	T	Hydrogen-bonded Turn	trans	-114.7	4.8	-168.4	-64.2	24.2	0	0	0	113.2	T306	T306-N308 VanDerWaalsContact C-N 3.3Å; T306-N308 PolarHBondContact O-N 3.34Å
309	E	89.5	Confident	93.6	Very high	38 Å²	38	42.8 Å²	42.8	18%	0.178	25%	0.248	C	C	.	.	S	Bend	trans	-116.9	165.7	-175.4	-69.9	-69	164.6	0	0	110.9	R295 A296	R295-E309 WeakPolarHBondContact CB-OE1 3.21Å; R295-E309 HydrophobicContact CG-CG 4.1Å; A296-E309 PolarHBondContact N-OE2 2.89Å
310	T	92.7	Very high	93.8	Very high	63 Å²	63	42.8 Å²	42.8	39%	0.387	25%	0.248	S	C	.	.			trans	-70.6	148.6	178.4	70.6	0	0	0	0	111.7	R301 S312	R301-T310 PolarHBondContact NH1-O 3.34Å; R301-T310 PolarHBondContact NH2-OG1 3Å; T310-S312 PolarHBondContact O-N 3.48Å; T310-S312 VanDerWaalsContact O-N 3.17Å; T310-S312 PolarHBondContact OG1-OG 3.22Å
311	L	94.5	Very high	94.1	Very high	111 Å²	111	41.1 Å²	41.1	58%	0.581	24%	0.24	S	C	*	.	T	Hydrogen-bonded Turn	trans	-74.1	0.4	178	-61.6	179.1	0	0	0	114	C313 V314 I315	L311-C313 VanDerWaalsContact C-N 3.32Å; L311-C313 PolarHBondContact O-N 2.92Å; L311-V314 PolarHBondContact O-N 2.86Å; L311-I315 HydrophobicContact CB-CD1 4.18Å; L311-I315 HydrophobicContact CB-CG1 4.44Å; L311-I315 WeakPolarHBondContact O-CG1 3.33Å; L311-I315 PolarHBondContact O-N 3.19Å
312	S	95.3	Very high	94.2	Very high	22 Å²	22	44.1 Å²	44.1	15%	0.154	25%	0.252	C	S	.	.	H	α-helix	trans	-55.1	-44	-172.7	-41.4	0	0	0	0	112.4	E291 T310 I315 I316	E291-S312 WeakPolarHBondContact OE1-CB 3.02Å; E291-S312 PolarHBondContact OE1-OG 2.96Å; T310-S312 PolarHBondContact O-N 3.48Å; T310-S312 VanDerWaalsContact O-N 3.17Å; T310-S312 PolarHBondContact OG1-OG 3.22Å; S312-I315 PolarHBondContact O-N 2.98Å; S312-I316 WeakPolarHBondContact O-CG1 3.33Å; S312-I316 PolarHBondContact O-N 3.19Å
313	C	96.4	Very high	94.5	Very high	0 Å²	0	41.9 Å²	41.9	0%	0	24%	0.241	C	C	.	.	H	α-helix	trans	-56.8	-50.2	172.2	179.9	0	0	0	0	112.9	I292 L311 I315 I316 F317 C389	I292-C313 VanDerWaalsContact O-CB 3.24Å; I292-C313 WeakPolarHBondContact O-CB 3.21Å; L311-C313 VanDerWaalsContact C-N 3.32Å; L311-C313 PolarHBondContact O-N 2.92Å; C313-I315 PolarHBondContact O-N 3.44Å; C313-I316 PolarHBondContact O-N 3.25Å; C313-F317 WeakPolarHBondContact O-CB 3.26Å; C313-F317 PolarHBondContact O-N 3.38Å; C313-C389 WeakPolarHBondContact CA-SG 3.49Å; C313-C389 HydrophobicContact CB-CB 4.12Å; C313-C389 WeakPolarHBondContact CB-SG 3.4Å; C313-C389 WeakPolarHBondContact O-CB 3.38Å; C313-C389 WeakPolarHBondContact SG-CB 3.37Å; C313-C389 CovalentContact SG-SG 2.03Å; C313-C389 PolarHBondContact SG-SG 2.93Å
314	V	97.2	Very high	94.7	Very high	17 Å²	17	41.4 Å²	41.4	10%	0.103	23%	0.232	C	C	.	.	H	α-helix	trans	-66.2	-38.4	-176.9	179.2	0	0	0	0	111.3	E304 P305 L311 F317 V318 L375	E304-V314 HydrophobicContact CB-CG2 4.15Å; P305-V314 HydrophobicContact CB-CG2 4Å; L311-V314 PolarHBondContact O-N 2.86Å; V314-F317 PolarHBondContact O-N 3.07Å; V314-V318 HydrophobicContact CG1-CG2 4.44Å; V314-V318 VanDerWaalsContact O-CG2 3.26Å; V314-V318 WeakPolarHBondContact O-CG2 3.37Å; V314-V318 PolarHBondContact O-N 3.02Å; V314-L375 HydrophobicContact CG1-CD2 3.7Å
315	I	97.4	Very high	94.9	Very high	94 Å²	94	41.5 Å²	41.5	48%	0.482	23%	0.233	S	C	.	.	H	α-helix	trans	-62.6	-47.8	177	-67.7	165.4	0	0	0	110.6	L311 S312 C313 V318 I319	L311-I315 HydrophobicContact CB-CD1 4.18Å; L311-I315 HydrophobicContact CB-CG1 4.44Å; L311-I315 WeakPolarHBondContact O-CG1 3.33Å; L311-I315 PolarHBondContact O-N 3.19Å; S312-I315 PolarHBondContact O-N 2.98Å; C313-I315 PolarHBondContact O-N 3.44Å; I315-V318 PolarHBondContact O-N 3.13Å; I315-I319 HydrophobicContact CG2-CD1 3.89Å; I315-I319 VanDerWaalsContact O-CG1 3.3Å; I315-I319 WeakPolarHBondContact O-CG1 3.49Å; I315-I319 PolarHBondContact O-N 2.84Å
316	I	98	Very high	95.2	Very high	15 Å²	15	38.9 Å²	38.9	8%	0.077	22%	0.215	C	C	.	.	H	α-helix	trans	-64.9	-41.9	177.8	-62.6	-54.2	0	0	0	111.4	A282 I292 S312 C313 V318 I319 V320 I388	A282-I316 HydrophobicContact CB-CD1 3.48Å; A282-I316 VanDerWaalsContact CB-CD1 3.48Å; A282-I316 HydrophobicContact CB-CG1 4.47Å; I292-I316 HydrophobicContact CD1-CG1 3.94Å; I292-I316 HydrophobicContact CG1-CG1 4.01Å; I292-I316 HydrophobicContact CG2-CB 4.32Å; I292-I316 HydrophobicContact CG2-CG1 4.2Å; I292-I316 HydrophobicContact CG2-CG2 4.48Å; S312-I316 WeakPolarHBondContact O-CG1 3.33Å; S312-I316 PolarHBondContact O-N 3.19Å; C313-I316 PolarHBondContact O-N 3.25Å; I316-V318 PolarHBondContact O-N 3.17Å; I316-I319 HydrophobicContact CD1-CD1 4.45Å; I316-I319 PolarHBondContact O-N 3.08Å; I316-V320 HydrophobicContact CG2-CG2 4.28Å; I316-V320 WeakPolarHBondContact O-CG2 3.34Å; I316-V320 PolarHBondContact O-N 3.47Å; I316-I388 HydrophobicContact CG2-CB 4.1Å; I316-I388 HydrophobicContact CG2-CG2 4.07Å
317	F	98.3	Very high	95.5	Very high	0 Å²	0	38.2 Å²	38.2	0%	0	21%	0.212	C	C	.	.	H	α-helix	trans	-55	-51.1	172.9	161.6	-106.5	0	0	0	111.7	C313 V314 I319 V320 Y321 T371 I374 L375 V380 C389 V391	C313-F317 WeakPolarHBondContact O-CB 3.26Å; C313-F317 PolarHBondContact O-N 3.38Å; V314-F317 PolarHBondContact O-N 3.07Å; F317-I319 VanDerWaalsContact C-N 3.34Å; F317-I319 PolarHBondContact O-N 2.94Å; F317-V320 PolarHBondContact O-N 2.68Å; F317-Y321 HydrophobicContact CE2-CD1 4.35Å; F317-Y321 HydrophobicContact CE2-CD2 4.02Å; F317-Y321 AromaticContact CE2-CG 3.71Å; F317-Y321 HydrophobicContact CE2-CG 3.71Å; F317-Y321 HydrophobicContact CZ-CD1 4.16Å; F317-Y321 AromaticContact CZ-CG 3.98Å; F317-Y321 HydrophobicContact CZ-CG 3.98Å; F317-Y321 WeakPolarHBondContact O-CB 3.09Å; F317-Y321 PolarHBondContact O-N 3.43Å; F317-T371 HydrophobicContact CE1-CG2 4.12Å; F317-I374 HydrophobicContact CE1-CB 4.43Å; F317-I374 HydrophobicContact CE1-CG2 4.01Å; F317-I374 HydrophobicContact CE2-CD1 4.38Å; F317-I374 HydrophobicContact CE2-CG2 4.22Å; F317-I374 HydrophobicContact CZ-CB 3.94Å; F317-I374 HydrophobicContact CZ-CD1 3.81Å; F317-I374 HydrophobicContact CZ-CG1 4.5Å; F317-I374 HydrophobicContact CZ-CG2 3.49Å; F317-I374 VanDerWaalsContact CZ-CG2 3.49Å; F317-L375 HydrophobicContact CD1-CD2 4.05Å; F317-L375 HydrophobicContact CE1-CD2 3.91Å; F317-L375 HydrophobicContact CE1-CG 4.26Å; F317-V380 HydrophobicContact CB-CG1 3.7Å; F317-V380 HydrophobicContact CD1-CG1 4.13Å; F317-V380 HydrophobicContact CD1-CG2 3.59Å; F317-V380 HydrophobicContact CD2-CG1 4.01Å; F317-V380 HydrophobicContact CD2-CG2 4.09Å; F317-V380 HydrophobicContact CE1-CG2 3.63Å; F317-V380 HydrophobicContact CE2-CG2 4.11Å; F317-V380 HydrophobicContact CG-CB 4.43Å; F317-V380 HydrophobicContact CG-CG1 3.64Å; F317-V380 HydrophobicContact CG-CG2 3.84Å; F317-V380 HydrophobicContact CZ-CG2 3.91Å; F317-C389 WeakPolarHBondContact CA-O 3.34Å; F317-C389 HydrophobicContact CB-CB 4.16Å; F317-V391 HydrophobicContact CE2-CB 4.12Å; F317-V391 HydrophobicContact CE2-CG1 4.47Å
318	V	98.5	Very high	96.2	Very high	52 Å²	52	34.1 Å²	34.1	32%	0.315	18%	0.184	S	C	.	.	H	α-helix	trans	-59	-45.5	179.3	169.6	0	0	0	0	110.8	V314 I315 I316 Y322 T371 L375	V314-V318 HydrophobicContact CG1-CG2 4.44Å; V314-V318 VanDerWaalsContact O-CG2 3.26Å; V314-V318 WeakPolarHBondContact O-CG2 3.37Å; V314-V318 PolarHBondContact O-N 3.02Å; I315-V318 PolarHBondContact O-N 3.13Å; I316-V318 PolarHBondContact O-N 3.17Å; V318-Y322 WeakPolarHBondContact O-CB 3.31Å; V318-Y322 PolarHBondContact O-N 3.42Å; V318-T371 HydrophobicContact CB-CG2 4.48Å; V318-T371 HydrophobicContact CG1-CG2 4.4Å; V318-T371 HydrophobicContact CG2-CG2 3.86Å; V318-L375 HydrophobicContact CG2-CD1 4.29Å
319	I	98.3	Very high	96.8	Very high	50 Å²	50	28.2 Å²	28.2	26%	0.256	15%	0.153	S	C	.	.	H	α-helix	trans	-60.1	-51.7	179.1	-69.8	166.6	0	0	0	111.1	V275 I315 I316 F317 A323	V275-I319 HydrophobicContact CG1-CG2 3.98Å; V275-I319 WeakPolarHBondContact O-CG2 3.35Å; I315-I319 HydrophobicContact CG2-CD1 3.89Å; I315-I319 VanDerWaalsContact O-CG1 3.3Å; I315-I319 WeakPolarHBondContact O-CG1 3.49Å; I315-I319 PolarHBondContact O-N 2.84Å; I316-I319 HydrophobicContact CD1-CD1 4.45Å; I316-I319 PolarHBondContact O-N 3.08Å; F317-I319 VanDerWaalsContact C-N 3.34Å; F317-I319 PolarHBondContact O-N 2.94Å; I319-A323 WeakPolarHBondContact O-CB 3.47Å; I319-A323 PolarHBondContact O-N 3.5Å
320	V	98.2	Very high	97.1	Very high	3 Å²	3	26.4 Å²	26.4	2%	0.018	14%	0.144	C	C	.	.	H	α-helix	trans	-71.1	-49.4	-175.4	176	0	0	0	0	111.5	W280 I316 F317 A323 L324 I388 F390	W280-V320 HydrophobicContact CZ2-CG1 4.36Å; I316-V320 HydrophobicContact CG2-CG2 4.28Å; I316-V320 WeakPolarHBondContact O-CG2 3.34Å; I316-V320 PolarHBondContact O-N 3.47Å; F317-V320 PolarHBondContact O-N 2.68Å; V320-A323 PolarHBondContact O-N 3.31Å; V320-L324 WeakPolarHBondContact O-CB 3.49Å; V320-L324 PolarHBondContact O-N 2.68Å; V320-I388 HydrophobicContact CG1-CD1 4.06Å; V320-I388 HydrophobicContact CG2-CD1 4.47Å; V320-F390 HydrophobicContact CG1-CE2 4.38Å
321	Y	98.4	Very high	97.2	Very high	0 Å²	0	23.9 Å²	23.9	0%	0	13%	0.128	C	C	.	.	H	α-helix	trans	-69.1	-43.8	-175.3	-179.4	-89.1	0	0	0	112.3	F317 A323 L324 M325 L370 T371 I374 F390 V391 F402 V403	F317-Y321 HydrophobicContact CE2-CD1 4.35Å; F317-Y321 HydrophobicContact CE2-CD2 4.02Å; F317-Y321 AromaticContact CE2-CG 3.71Å; F317-Y321 HydrophobicContact CE2-CG 3.71Å; F317-Y321 HydrophobicContact CZ-CD1 4.16Å; F317-Y321 AromaticContact CZ-CG 3.98Å; F317-Y321 HydrophobicContact CZ-CG 3.98Å; F317-Y321 WeakPolarHBondContact O-CB 3.09Å; F317-Y321 PolarHBondContact O-N 3.43Å; Y321-A323 PolarHBondContact O-N 3.37Å; Y321-L324 PolarHBondContact O-N 3.49Å; Y321-M325 HydrophobicContact CD1-CG 4.18Å; Y321-M325 HydrophobicContact CD2-CE 4.4Å; Y321-M325 HydrophobicContact CE1-CG 3.65Å; Y321-M325 HydrophobicContact CE2-CE 3.63Å; Y321-M325 HydrophobicContact CE2-CG 4.05Å; Y321-M325 WeakPolarHBondContact O-CB 3.07Å; Y321-M325 WeakPolarHBondContact O-CG 3.42Å; Y321-M325 PolarHBondContact O-N 3.25Å; Y321-L370 HydrophobicContact CE1-CB 4Å; Y321-T371 WeakPolarHBondContact CD1-OG1 3.48Å; Y321-I374 HydrophobicContact CD1-CD1 4.05Å; Y321-I374 HydrophobicContact CD2-CD1 4.18Å; Y321-I374 HydrophobicContact CE1-CD1 3.51Å; Y321-I374 HydrophobicContact CE2-CD1 3.64Å; Y321-I374 HydrophobicContact CG-CD1 4.39Å; Y321-F390 HydrophobicContact CD2-CE2 4.02Å; Y321-F390 HydrophobicContact CD2-CZ 4.1Å; Y321-V391 HydrophobicContact CD2-CG1 4.07Å; Y321-V391 HydrophobicContact CE2-CG1 3.97Å; Y321-F402 PolarHBondContact OH-O 3.19Å; Y321-V403 HydrophobicContact CE2-CG2 4Å
322	Y	98.4	Very high	97.3	Very high	65 Å²	65	19.7 Å²	19.7	26%	0.255	11%	0.107	S	C	.	.	H	α-helix	trans	-64.1	-42.3	177.2	-174.5	-85.1	0	0	0	111.2	V318 M325 A326 W364 P367 F368	V318-Y322 WeakPolarHBondContact O-CB 3.31Å; V318-Y322 PolarHBondContact O-N 3.42Å; Y322-M325 PolarHBondContact O-N 3.36Å; Y322-A326 HydrophobicContact CD1-CB 4.5Å; Y322-A326 HydrophobicContact CE1-CB 4.36Å; Y322-A326 WeakPolarHBondContact O-CB 3.45Å; Y322-A326 PolarHBondContact O-N 2.9Å; Y322-W364 AromaticContact CE1-CE3 3.99Å; Y322-W364 HydrophobicContact CE1-CE3 3.99Å; Y322-W364 HydrophobicContact CE1-CZ3 4.22Å; Y322-W364 PolarHBondContact OH-O 3.25Å; Y322-P367 HydrophobicContact CD2-CB 3.61Å; Y322-P367 HydrophobicContact CE2-CB 3.67Å; Y322-P367 HydrophobicContact CG-CB 4.14Å; Y322-F368 HydrophobicContact CE2-CB 4.05Å
323	A	98.4	Very high	97.2	Very high	7 Å²	7	19 Å²	19	6%	0.058	10%	0.101	C	C	.	.	H	α-helix	trans	-61.7	-43.6	176.2	0	0	0	0	0	112.5	C272 V275 I319 V320 Y321 G327	C272-A323 WeakPolarHBondContact O-CB 3.27Å; V275-A323 HydrophobicContact CG1-CB 4.41Å; I319-A323 WeakPolarHBondContact O-CB 3.47Å; I319-A323 PolarHBondContact O-N 3.5Å; V320-A323 PolarHBondContact O-N 3.31Å; Y321-A323 PolarHBondContact O-N 3.37Å; A323-G327 PolarHBondContact O-N 3.33Å
324	L	97.3	Very high	96.9	Very high	17 Å²	17	19.1 Å²	19.1	9%	0.089	10%	0.102	C	C	.	.	H	α-helix	trans	-60	-52.3	175.5	177.6	64.8	0	0	0	111.2	V320 Y321 G327 V328 F390 M524	V320-L324 WeakPolarHBondContact O-CB 3.49Å; V320-L324 PolarHBondContact O-N 2.68Å; Y321-L324 PolarHBondContact O-N 3.49Å; L324-G327 PolarHBondContact O-N 3.12Å; L324-V328 PolarHBondContact O-N 2.89Å; L324-V328 VanDerWaalsContact O-N 3.08Å; L324-F390 HydrophobicContact CD2-CE2 4.43Å; L324-F390 HydrophobicContact CD2-CZ 4.03Å; L324-M524 HydrophobicContact CD1-CE 4.39Å; L324-M524 HydrophobicContact CD1-CG 4.36Å; L324-M524 HydrophobicContact CD1-SD 4.46Å
325	M	98	Very high	96.7	Very high	4 Å²	4	18.3 Å²	18.3	2%	0.02	10%	0.097	C	C	.	.	H	α-helix	trans	-66.2	-41.7	-177.6	-70.3	-59.5	152.7	0	0	112.4	Y321 Y322 G327 V328 V329 P367 L370 F402 V403 P406	Y321-M325 HydrophobicContact CD1-CG 4.18Å; Y321-M325 HydrophobicContact CD2-CE 4.4Å; Y321-M325 HydrophobicContact CE1-CG 3.65Å; Y321-M325 HydrophobicContact CE2-CE 3.63Å; Y321-M325 HydrophobicContact CE2-CG 4.05Å; Y321-M325 WeakPolarHBondContact O-CB 3.07Å; Y321-M325 WeakPolarHBondContact O-CG 3.42Å; Y321-M325 PolarHBondContact O-N 3.25Å; Y322-M325 PolarHBondContact O-N 3.36Å; M325-G327 VanDerWaalsContact C-N 3.34Å; M325-G327 PolarHBondContact O-N 2.89Å; M325-V328 WeakPolarHBondContact O-CG2 3.3Å; M325-V328 PolarHBondContact O-N 3.45Å; M325-V328 HydrophobicContact SD-CG2 4.37Å; M325-V329 WeakPolarHBondContact O-CG2 3.38Å; M325-V329 PolarHBondContact O-N 2.99Å; M325-V329 VanDerWaalsContact O-N 3.13Å; M325-P367 HydrophobicContact CB-CB 3.82Å; M325-P367 HydrophobicContact CB-CG 4Å; M325-L370 HydrophobicContact CG-CD1 4.42Å; M325-L370 HydrophobicContact SD-CD1 4.35Å; M325-F402 WeakPolarHBondContact CE-O 3.43Å; M325-V403 HydrophobicContact CE-CB 4.39Å; M325-V403 HydrophobicContact CE-CG1 4.25Å; M325-V403 HydrophobicContact CE-CG2 4.39Å; M325-P406 HydrophobicContact SD-CB 4.09Å
326	A	97.9	Very high	96.5	Very high	0 Å²	0	16.8 Å²	16.8	0%	0	9%	0.086	C	C	.	.	H	α-helix	trans	-62.3	-42.2	173.7	0	0	0	0	0	111.4	Y322 V328 V329 W330 W364 P367	Y322-A326 HydrophobicContact CD1-CB 4.5Å; Y322-A326 HydrophobicContact CE1-CB 4.36Å; Y322-A326 WeakPolarHBondContact O-CB 3.45Å; Y322-A326 PolarHBondContact O-N 2.9Å; A326-V328 PolarHBondContact O-N 3.22Å; A326-V329 PolarHBondContact O-N 3.01Å; A326-W330 WeakPolarHBondContact O-CB 3.27Å; A326-W330 PolarHBondContact O-N 3.29Å; A326-W364 HydrophobicContact CB-CE3 4.12Å; A326-W364 HydrophobicContact CB-CZ3 3.78Å; A326-P367 HydrophobicContact CB-CB 4.5Å; A326-P367 HydrophobicContact CB-CG 3.9Å
327	G	96.3	Very high	96	Very high	5 Å²	5	16.1 Å²	16.1	5%	0.052	8%	0.083	C	C	.	.	H	α-helix	trans	-58.5	-45.9	177.6	0	0	0	0	0	113.2	A323 L324 M325 W330 F331	A323-G327 PolarHBondContact O-N 3.33Å; L324-G327 PolarHBondContact O-N 3.12Å; M325-G327 VanDerWaalsContact C-N 3.34Å; M325-G327 PolarHBondContact O-N 2.89Å; G327-W330 PolarHBondContact O-N 3.42Å; G327-F331 PolarHBondContact O-N 3.26Å
328	V	96.1	Very high	95.4	Very high	11 Å²	11	16.5 Å²	16.5	7%	0.067	8%	0.084	C	C	.	.	H	α-helix	trans	-73.3	-31.3	179.7	-60.1	0	0	0	0	113.4	L324 M325 A326 F331 V332 V410	L324-V328 PolarHBondContact O-N 2.89Å; L324-V328 VanDerWaalsContact O-N 3.08Å; M325-V328 WeakPolarHBondContact O-CG2 3.3Å; M325-V328 PolarHBondContact O-N 3.45Å; M325-V328 HydrophobicContact SD-CG2 4.37Å; A326-V328 PolarHBondContact O-N 3.22Å; V328-F331 WeakPolarHBondContact O-CB 3.42Å; V328-F331 PolarHBondContact O-N 3.31Å; V328-V332 PolarHBondContact O-N 3.18Å; V328-V410 HydrophobicContact CB-CG2 3.91Å; V328-V410 HydrophobicContact CG2-CG1 4.37Å; V328-V410 HydrophobicContact CG2-CG2 4.24Å
329	V	97.2	Very high	94.9	Very high	19 Å²	19	15 Å²	15	12%	0.115	7%	0.074	C	C	.	.	H	α-helix	trans	-70.8	-39.8	172.1	-179.7	0	0	0	0	110.8	M325 A326 F331 V332 V333 T363 L366	M325-V329 WeakPolarHBondContact O-CG2 3.38Å; M325-V329 PolarHBondContact O-N 2.99Å; M325-V329 VanDerWaalsContact O-N 3.13Å; A326-V329 PolarHBondContact O-N 3.01Å; V329-F331 VanDerWaalsContact C-N 3.28Å; V329-F331 PolarHBondContact O-N 3.22Å; V329-V332 WeakPolarHBondContact O-CB 3.28Å; V329-V332 PolarHBondContact O-N 3.43Å; V329-V332 VanDerWaalsContact O-N 3.1Å; V329-V333 PolarHBondContact O-N 3.32Å; V329-V333 VanDerWaalsContact O-N 3.09Å; V329-T363 HydrophobicContact CG1-CG2 3.97Å; V329-L366 HydrophobicContact CG1-CD1 4.37Å; V329-L366 HydrophobicContact CG2-CD1 4.44Å
330	W	96.4	Very high	94.3	Very high	0 Å²	0	13.5 Å²	13.5	0%	0	7%	0.067	C	C	.	.	H	α-helix	trans	-62.6	-33	172	-85.1	118.1	0	0	0	112.9	I265 Y268 V269 A326 G327 V333 L334 H360 T363 W364	I265-W330 HydrophobicContact CG1-CZ3 4.28Å; I265-W330 HydrophobicContact CG2-CE3 3.88Å; I265-W330 HydrophobicContact CG2-CZ3 4.34Å; Y268-W330 HydrophobicContact CD1-CZ2 4.37Å; Y268-W330 AromaticContact CD2-CH2 3.78Å; Y268-W330 HydrophobicContact CD2-CH2 3.78Å; Y268-W330 AromaticContact CD2-CZ2 3.85Å; Y268-W330 HydrophobicContact CD2-CZ2 3.85Å; Y268-W330 HydrophobicContact CD2-CZ3 4.35Å; Y268-W330 HydrophobicContact CE2-CH2 4.43Å; Y268-W330 HydrophobicContact CG-CH2 4.14Å; Y268-W330 AromaticContact CG-CZ2 3.72Å; Y268-W330 HydrophobicContact CG-CZ2 3.72Å; V269-W330 HydrophobicContact CG2-CB 3.68Å; A326-W330 WeakPolarHBondContact O-CB 3.27Å; A326-W330 PolarHBondContact O-N 3.29Å; G327-W330 PolarHBondContact O-N 3.42Å; W330-V333 HydrophobicContact CE3-CB 4.05Å; W330-V333 HydrophobicContact CE3-CG1 4.06Å; W330-V333 HydrophobicContact CE3-CG2 4.48Å; W330-V333 HydrophobicContact CZ3-CB 4.43Å; W330-V333 HydrophobicContact CZ3-CG1 3.96Å; W330-V333 PolarHBondContact O-N 3.04Å; W330-L334 WeakPolarHBondContact O-CB 3.5Å; W330-L334 PolarHBondContact O-N 2.87Å; W330-H360 AromaticContact CH2-CE1 3.4Å; W330-H360 WeakPolarHBondContact CH2-CE1 3.38Å; W330-H360 AromaticContact CH2-ND1 3.5Å; W330-H360 AromaticContact CZ2-CE1 3.62Å; W330-H360 AromaticContact CZ2-ND1 3.45Å; W330-H360 WeakPolarHBondContact CZ2-ND1 3.29Å; W330-T363 HydrophobicContact CD2-CG2 3.51Å; W330-T363 HydrophobicContact CE3-CG2 3.74Å; W330-T363 HydrophobicContact CG-CG2 3.98Å; W330-T363 HydrophobicContact CH2-CG2 4.14Å; W330-T363 HydrophobicContact CZ2-CG2 3.93Å; W330-T363 VanDerWaalsContact CZ2-OG1 3.23Å; W330-T363 WeakPolarHBondContact CZ2-OG1 3.1Å; W330-T363 HydrophobicContact CZ3-CG2 4.05Å; W330-W364 AromaticContact CZ2-CZ2 3.98Å; W330-W364 HydrophobicContact CZ2-CZ2 3.98Å; W330-W364 AromaticContact NE1-CH2 3.39Å; W330-W364 AromaticContact NE1-CZ2 3.5Å; W330-W364 AromaticContact NE1-CZ3 3.79Å
331	F	94.9	Very high	93.4	Very high	10 Å²	10	14.3 Å²	14.3	4%	0.044	7%	0.072	C	C	.	.	H	α-helix	trans	-60.8	-42.7	169.9	160.4	-101.3	0	0	0	112.1	G327 V328 V329 V333 L334 T335 L418 A458 F459	G327-F331 PolarHBondContact O-N 3.26Å; V328-F331 WeakPolarHBondContact O-CB 3.42Å; V328-F331 PolarHBondContact O-N 3.31Å; V329-F331 VanDerWaalsContact C-N 3.28Å; V329-F331 PolarHBondContact O-N 3.22Å; F331-V333 PolarHBondContact O-N 3.3Å; F331-L334 WeakPolarHBondContact O-CB 3.4Å; F331-L334 PolarHBondContact O-N 2.92Å; F331-T335 HydrophobicContact CD2-CG2 4.17Å; F331-T335 HydrophobicContact CE1-CG2 4.32Å; F331-T335 HydrophobicContact CE2-CG2 3.57Å; F331-T335 HydrophobicContact CZ-CG2 3.65Å; F331-T335 WeakPolarHBondContact O-CG2 3.36Å; F331-T335 PolarHBondContact O-N 3.47Å; F331-L418 HydrophobicContact CZ-CD1 4.38Å; F331-A458 HydrophobicContact CD2-CB 3.58Å; F331-A458 HydrophobicContact CE2-CB 3.68Å; F331-F459 HydrophobicContact CE2-CB 4.3Å; F331-F459 HydrophobicContact CZ-CB 3.87Å; F331-F459 HydrophobicContact CZ-CD2 4.09Å
332	V	95.8	Very high	92.4	Very high	22 Å²	22	14.4 Å²	14.4	13%	0.133	7%	0.073	C	C	.	.	H	α-helix	trans	-61	-45.4	173.8	180	0	0	0	0	110.9	V328 V329 L334 T335 Y336 V410 V413 F417	V328-V332 PolarHBondContact O-N 3.18Å; V329-V332 WeakPolarHBondContact O-CB 3.28Å; V329-V332 PolarHBondContact O-N 3.43Å; V329-V332 VanDerWaalsContact O-N 3.1Å; V332-L334 VanDerWaalsContact C-N 3.27Å; V332-L334 PolarHBondContact O-N 2.91Å; V332-T335 PolarHBondContact O-N 2.89Å; V332-T335 PolarHBondContact O-OG1 2.85Å; V332-Y336 WeakPolarHBondContact O-CB 3.36Å; V332-Y336 PolarHBondContact O-N 3.28Å; V332-V410 HydrophobicContact CG2-CB 3.5Å; V332-V410 HydrophobicContact CG2-CG1 3.66Å; V332-V413 HydrophobicContact CG1-CB 4.42Å; V332-V413 HydrophobicContact CG1-CG1 3.68Å; V332-F417 HydrophobicContact CG1-CD2 4.41Å; V332-F417 HydrophobicContact CG1-CE2 4.26Å
333	V	93.9	Very high	91.4	Very high	7 Å²	7	18.9 Å²	18.9	4%	0.042	9%	0.094	C	C	.	.	H	α-helix	trans	-59.8	-37	175.9	177.4	0	0	0	0	111.7	I265 V329 W330 F331 A337 F359 T363	I265-V333 HydrophobicContact CD1-CG1 4.05Å; I265-V333 HydrophobicContact CG1-CG1 4.35Å; V329-V333 PolarHBondContact O-N 3.32Å; V329-V333 VanDerWaalsContact O-N 3.09Å; W330-V333 HydrophobicContact CE3-CB 4.05Å; W330-V333 HydrophobicContact CE3-CG1 4.06Å; W330-V333 HydrophobicContact CE3-CG2 4.48Å; W330-V333 HydrophobicContact CZ3-CB 4.43Å; W330-V333 HydrophobicContact CZ3-CG1 3.96Å; W330-V333 PolarHBondContact O-N 3.04Å; F331-V333 PolarHBondContact O-N 3.3Å; V333-A337 VanDerWaalsContact O-CB 3.23Å; V333-A337 WeakPolarHBondContact O-CB 3.49Å; V333-A337 PolarHBondContact O-N 2.95Å; V333-F359 HydrophobicContact CG1-CB 4.21Å; V333-F359 HydrophobicContact CG1-CD1 3.94Å; V333-F359 HydrophobicContact CG1-CE1 4.49Å; V333-F359 HydrophobicContact CG1-CG 3.99Å; V333-F359 HydrophobicContact CG2-CD1 4.4Å; V333-T363 HydrophobicContact CG2-CG2 3.79Å
334	L	91	Very high	90.3	Very high	3 Å²	3	19.3 Å²	19.3	2%	0.016	10%	0.097	C	C	.	.	H	α-helix	trans	-62.4	-47.8	173.8	-173.1	70.9	0	0	0	112	I265 L266 W330 F331 V332 A337 W338 L451 M531	I265-L334 HydrophobicContact CB-CD1 4.25Å; I265-L334 HydrophobicContact CG2-CB 3.93Å; I265-L334 HydrophobicContact CG2-CD1 3.84Å; L266-L334 HydrophobicContact CD2-CD1 3.77Å; L266-L334 HydrophobicContact CD2-CD2 3.84Å; L266-L334 HydrophobicContact CD2-CG 4.49Å; L266-L334 HydrophobicContact CG-CD1 3.96Å; W330-L334 WeakPolarHBondContact O-CB 3.5Å; W330-L334 PolarHBondContact O-N 2.87Å; F331-L334 WeakPolarHBondContact O-CB 3.4Å; F331-L334 PolarHBondContact O-N 2.92Å; V332-L334 VanDerWaalsContact C-N 3.27Å; V332-L334 PolarHBondContact O-N 2.91Å; L334-A337 PolarHBondContact O-N 2.76Å; L334-W338 WeakPolarHBondContact O-CB 3.47Å; L334-W338 PolarHBondContact O-N 2.97Å; L334-L451 HydrophobicContact CD1-CD1 3.85Å; L334-M531 HydrophobicContact CD2-SD 4.3Å
335	T	92.7	Very high	88.9	Confident	1 Å²	1	21 Å²	21	1%	0.006	11%	0.106	C	C	.	.	H	α-helix	trans	-65	-39.3	178.2	63.5	0	0	0	0	112.4	F331 V332 W338 H339 L418	F331-T335 HydrophobicContact CD2-CG2 4.17Å; F331-T335 HydrophobicContact CE1-CG2 4.32Å; F331-T335 HydrophobicContact CE2-CG2 3.57Å; F331-T335 HydrophobicContact CZ-CG2 3.65Å; F331-T335 WeakPolarHBondContact O-CG2 3.36Å; F331-T335 PolarHBondContact O-N 3.47Å; V332-T335 PolarHBondContact O-N 2.89Å; V332-T335 PolarHBondContact O-OG1 2.85Å; T335-W338 PolarHBondContact O-N 3.19Å; T335-H339 PolarHBondContact O-N 3.46Å; T335-L418 HydrophobicContact CG2-CD1 4.05Å; T335-L418 HydrophobicContact CG2-CD2 3.96Å; T335-L418 HydrophobicContact CG2-CG 3.74Å
336	Y	91.8	Very high	87.1	Confident	62 Å²	62	24.8 Å²	24.8	24%	0.243	15%	0.145	C	C	.	.	H	α-helix	trans	-64.2	-46	174.3	172.1	-96.2	0	0	0	112	V332 W338 H339 T340 L352 F359 F417	V332-Y336 WeakPolarHBondContact O-CB 3.36Å; V332-Y336 PolarHBondContact O-N 3.28Å; Y336-W338 VanDerWaalsContact C-N 3.31Å; Y336-W338 PolarHBondContact O-N 3.3Å; Y336-H339 PolarHBondContact O-N 3.03Å; Y336-T340 HydrophobicContact CD2-CG2 4.19Å; Y336-T340 HydrophobicContact CE1-CG2 4.07Å; Y336-T340 HydrophobicContact CE2-CG2 3.69Å; Y336-T340 WeakPolarHBondContact O-CB 3.42Å; Y336-T340 WeakPolarHBondContact O-CG2 3.29Å; Y336-T340 PolarHBondContact O-N 3.11Å; Y336-T340 PolarHBondContact O-OG1 3.14Å; Y336-L352 HydrophobicContact CD1-CD2 4.38Å; Y336-L352 HydrophobicContact CE1-CD2 3.99Å; Y336-F359 AromaticContact CD1-CE1 3.98Å; Y336-F359 HydrophobicContact CD1-CE1 3.98Å; Y336-F359 HydrophobicContact CD1-CZ 4.19Å; Y336-F359 AromaticContact CE1-CE1 3.82Å; Y336-F359 HydrophobicContact CE1-CE1 3.82Å; Y336-F359 AromaticContact CE1-CZ 3.81Å; Y336-F359 HydrophobicContact CE1-CZ 3.81Å; Y336-F417 HydrophobicContact CD2-CD1 4.3Å; Y336-F417 AromaticContact CD2-CE1 3.8Å; Y336-F417 HydrophobicContact CD2-CE1 3.8Å; Y336-F417 HydrophobicContact CD2-CE2 4.09Å; Y336-F417 AromaticContact CD2-CZ 3.69Å; Y336-F417 HydrophobicContact CD2-CZ 3.69Å
337	A	88	Confident	85.5	Confident	1 Å²	1	28.8 Å²	28.8	1%	0.008	17%	0.17	C	C	.	.	H	α-helix	trans	-61	-41.5	176.6	0	0	0	0	0	111.4	P262 I265 V333 L334 T340 S341 L352	P262-A337 HydrophobicContact CB-CB 4.07Å; I265-A337 HydrophobicContact CD1-CB 3.44Å; I265-A337 VanDerWaalsContact CD1-CB 3.44Å; V333-A337 VanDerWaalsContact O-CB 3.23Å; V333-A337 WeakPolarHBondContact O-CB 3.49Å; V333-A337 PolarHBondContact O-N 2.95Å; L334-A337 PolarHBondContact O-N 2.76Å; A337-T340 PolarHBondContact O-OG1 3.4Å; A337-S341 VanDerWaalsContact O-CB 3.29Å; A337-S341 WeakPolarHBondContact O-CB 3.49Å; A337-S341 PolarHBondContact O-N 2.93Å; A337-S341 PolarHBondContact O-OG 2.88Å; A337-L352 HydrophobicContact CB-CD1 3.78Å; A337-L352 HydrophobicContact CB-CD2 4.33Å
338	W	86.6	Confident	83.9	Confident	7 Å²	7	35.7 Å²	35.7	3%	0.027	21%	0.212	C	C	.	.	H	α-helix	trans	-63.2	-48.6	175.9	-177.8	68.2	0	0	0	112.8	L334 T335 Y336 T340 S341 F342 L418 V422 M448 L451 G452 F456	L334-W338 WeakPolarHBondContact O-CB 3.47Å; L334-W338 PolarHBondContact O-N 2.97Å; T335-W338 PolarHBondContact O-N 3.19Å; Y336-W338 VanDerWaalsContact C-N 3.31Å; Y336-W338 PolarHBondContact O-N 3.3Å; W338-T340 PolarHBondContact O-N 3.33Å; W338-S341 PolarHBondContact O-N 3.47Å; W338-F342 HydrophobicContact CD2-CD2 4.34Å; W338-F342 HydrophobicContact CD2-CE2 4.2Å; W338-F342 AromaticContact CE2-CE2 3.45Å; W338-F342 VanDerWaalsContact CE2-CE2 3.45Å; W338-F342 HydrophobicContact CH2-CE2 4.34Å; W338-F342 HydrophobicContact CZ2-CD2 4.29Å; W338-F342 AromaticContact CZ2-CE2 3.56Å; W338-F342 HydrophobicContact CZ2-CE2 3.56Å; W338-F342 AromaticContact NE1-CE2 3.41Å; W338-F342 PolarHBondContact O-N 3.23Å; W338-L418 HydrophobicContact CE3-CD2 3.89Å; W338-L418 HydrophobicContact CZ3-CD2 3.81Å; W338-L418 WeakPolarHBondContact CZ3-O 3.28Å; W338-V422 HydrophobicContact CH2-CG2 3.78Å; W338-V422 HydrophobicContact CZ3-CG2 4.38Å; W338-M448 PolarHBondContact NE1-O 2.98Å; W338-L451 HydrophobicContact CB-CD2 4.35Å; W338-L451 HydrophobicContact CB-CG 4.37Å; W338-L451 HydrophobicContact CG-CD2 4.47Å; W338-L451 HydrophobicContact CG-CG 4.25Å; W338-G452 VanDerWaalsContact NE1-CA 3.29Å; W338-G452 VanDerWaalsContact NE1-N 3.11Å; W338-F456 AromaticContact CH2-CE2 3.94Å; W338-F456 HydrophobicContact CH2-CE2 3.94Å; W338-F456 HydrophobicContact CZ3-CE2 4.43Å
339	H	87.4	Confident	82.6	Confident	22 Å²	22	42.3 Å²	42.3	10%	0.102	24%	0.237	C	C	.	.	H	α-helix	trans	-59.9	-46.9	176.2	171.2	44.8	0	0	0	112.2	T335 Y336 F342 K343 F417 G421	T335-H339 PolarHBondContact O-N 3.46Å; Y336-H339 PolarHBondContact O-N 3.03Å; H339-F342 PolarHBondContact O-N 2.96Å; H339-K343 PolarHBondContact O-N 3.49Å; H339-F417 HydrophobicContact CB-CB 4.38Å; H339-G421 PolarHBondContact ND1-N 3.36Å
340	T	85.2	Confident	81.2	Confident	17 Å²	17	45.8 Å²	45.8	10%	0.104	25%	0.252	C	S	.	.	H	α-helix	trans	-70.2	-35.5	-178.1	50.2	0	0	0	0	112.7	Y336 A337 W338 F342 K343 A344	Y336-T340 HydrophobicContact CD2-CG2 4.19Å; Y336-T340 HydrophobicContact CE1-CG2 4.07Å; Y336-T340 HydrophobicContact CE2-CG2 3.69Å; Y336-T340 WeakPolarHBondContact O-CB 3.42Å; Y336-T340 WeakPolarHBondContact O-CG2 3.29Å; Y336-T340 PolarHBondContact O-N 3.11Å; Y336-T340 PolarHBondContact O-OG1 3.14Å; A337-T340 PolarHBondContact O-OG1 3.4Å; W338-T340 PolarHBondContact O-N 3.33Å; T340-F342 VanDerWaalsContact C-N 3.27Å; T340-F342 PolarHBondContact O-N 2.94Å; T340-K343 PolarHBondContact O-N 2.86Å; T340-A344 PolarHBondContact O-N 3.15Å; T340-A344 VanDerWaalsContact O-N 3.16Å
341	S	80.4	Confident	80	Confident	20 Å²	20	46.7 Å²	46.7	14%	0.14	26%	0.257	C	S	.	.	H	α-helix	trans	-57.7	-38.1	170.1	-73.8	0	0	0	0	112.5	A337 W338 A344 L345	A337-S341 VanDerWaalsContact O-CB 3.29Å; A337-S341 WeakPolarHBondContact O-CB 3.49Å; A337-S341 PolarHBondContact O-N 2.93Å; A337-S341 PolarHBondContact O-OG 2.88Å; W338-S341 PolarHBondContact O-N 3.47Å; S341-A344 PolarHBondContact O-N 3.4Å; S341-L345 PolarHBondContact O-N 2.9Å
342	F	76.2	Confident	79.2	Confident	2 Å²	2	46.9 Å²	46.9	1%	0.009	26%	0.259	C	S	.	.	H	α-helix	trans	-66.1	-41.3	174.8	-89.3	-58.2	0	0	0	113.2	W338 H339 T340 A344 L345 T424 L425 I428 M448	W338-F342 HydrophobicContact CD2-CD2 4.34Å; W338-F342 HydrophobicContact CD2-CE2 4.2Å; W338-F342 AromaticContact CE2-CE2 3.45Å; W338-F342 VanDerWaalsContact CE2-CE2 3.45Å; W338-F342 HydrophobicContact CH2-CE2 4.34Å; W338-F342 HydrophobicContact CZ2-CD2 4.29Å; W338-F342 AromaticContact CZ2-CE2 3.56Å; W338-F342 HydrophobicContact CZ2-CE2 3.56Å; W338-F342 AromaticContact NE1-CE2 3.41Å; W338-F342 PolarHBondContact O-N 3.23Å; H339-F342 PolarHBondContact O-N 2.96Å; T340-F342 VanDerWaalsContact C-N 3.27Å; T340-F342 PolarHBondContact O-N 2.94Å; F342-A344 PolarHBondContact O-N 3.35Å; F342-L345 HydrophobicContact CD1-CD1 3.59Å; F342-L345 HydrophobicContact CD1-CG 4.42Å; F342-L345 HydrophobicContact CE1-CD1 3.93Å; F342-L345 WeakPolarHBondContact O-CB 3.45Å; F342-L345 PolarHBondContact O-N 2.85Å; F342-T424 HydrophobicContact CB-CG2 4.05Å; F342-L425 HydrophobicContact CD1-CB 4.37Å; F342-L425 HydrophobicContact CD1-CD1 4.43Å; F342-L425 HydrophobicContact CE1-CB 4.18Å; F342-L425 HydrophobicContact CE1-CD1 3.66Å; F342-L425 HydrophobicContact CE1-CG 4.34Å; F342-L425 HydrophobicContact CE2-CB 4.37Å; F342-L425 HydrophobicContact CZ-CB 4.16Å; F342-L425 HydrophobicContact CZ-CD1 3.92Å; F342-L425 HydrophobicContact CZ-CD2 4.04Å; F342-L425 HydrophobicContact CZ-CG 4.25Å; F342-I428 WeakPolarHBondContact O-CD1 3.39Å; F342-M448 HydrophobicContact CB-CE 4.34Å; F342-M448 HydrophobicContact CD1-CE 3.48Å; F342-M448 VanDerWaalsContact CD1-CE 3.48Å; F342-M448 HydrophobicContact CD1-SD 4.33Å; F342-M448 HydrophobicContact CD2-CE 4.02Å; F342-M448 HydrophobicContact CE1-CB 3.99Å; F342-M448 HydrophobicContact CE1-CE 3.57Å; F342-M448 HydrophobicContact CE1-SD 4.02Å; F342-M448 HydrophobicContact CE2-CB 4.4Å; F342-M448 HydrophobicContact CE2-CE 4.15Å; F342-M448 HydrophobicContact CG-CE 3.68Å; F342-M448 HydrophobicContact CZ-CB 3.66Å; F342-M448 HydrophobicContact CZ-CE 3.94Å
343	K	77.8	Confident	78.2	Confident	160 Å²	160	49.8 Å²	49.8	70%	0.696	28%	0.28	S	S	*	.	H	α-helix	trans	-64.5	-26.3	177.9	-167.4	179.3	178.7	-172.5	0	112.7	H339 T340	H339-K343 PolarHBondContact O-N 3.49Å; T340-K343 PolarHBondContact O-N 2.86Å
344	A	74.7	Confident	77.5	Confident	15 Å²	15	52.5 Å²	52.5	12%	0.124	31%	0.31	C	S	.	.	H	α-helix	trans	-84.4	-11.9	177.9	0	0	0	0	0	114.6	T340 S341 F342 G346 T347 Y349 P351	T340-A344 PolarHBondContact O-N 3.15Å; T340-A344 VanDerWaalsContact O-N 3.16Å; S341-A344 PolarHBondContact O-N 3.4Å; F342-A344 PolarHBondContact O-N 3.35Å; A344-G346 PolarHBondContact O-N 2.94Å; A344-T347 PolarHBondContact O-N 2.7Å; A344-T347 PolarHBondContact O-OG1 3.14Å; A344-Y349 WeakPolarHBondContact CB-O 3.24Å; A344-P351 HydrophobicContact CB-CG 3.8Å
345	L	68.3	Low	77.1	Confident	54 Å²	54	55.6 Å²	55.6	28%	0.283	32%	0.323	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.6	129.4	178.3	-75.4	-175.1	0	0	0	111.5	S341 F342 T347 I428 I444 M448	S341-L345 PolarHBondContact O-N 2.9Å; F342-L345 HydrophobicContact CD1-CD1 3.59Å; F342-L345 HydrophobicContact CD1-CG 4.42Å; F342-L345 HydrophobicContact CE1-CD1 3.93Å; F342-L345 WeakPolarHBondContact O-CB 3.45Å; F342-L345 PolarHBondContact O-N 2.85Å; L345-T347 VanDerWaalsContact C-N 3.33Å; L345-I428 HydrophobicContact CB-CD1 4.37Å; L345-I444 HydrophobicContact CD2-CG2 3.82Å; L345-M448 HydrophobicContact CD1-CE 4.1Å; L345-M448 HydrophobicContact CD1-SD 3.75Å; L345-M448 HydrophobicContact CD2-CE 4.37Å; L345-M448 HydrophobicContact CD2-SD 3.68Å; L345-M448 HydrophobicContact CG-CE 4.16Å; L345-M448 HydrophobicContact CG-SD 3.97Å
346	G	59.8	Low	76.7	Confident	82 Å²	82	58 Å²	58	85%	0.845	34%	0.338	S	S	*	.	T	Hydrogen-bonded Turn	trans	87.6	-4.2	-176	0	0	0	0	0	114.4	A344	A344-G346 PolarHBondContact O-N 2.94Å
347	T	65.8	Low	76.7	Confident	84 Å²	84	59.4 Å²	59.4	52%	0.515	36%	0.357	S	S	.	.	S	Bend	trans	-111.4	160.2	174.1	75.9	0	0	0	0	111.2	A344 L345 Y349	A344-T347 PolarHBondContact O-N 2.7Å; A344-T347 PolarHBondContact O-OG1 3.14Å; L345-T347 VanDerWaalsContact C-N 3.33Å; T347-Y349 VanDerWaalsContact C-N 3.26Å; T347-Y349 PolarHBondContact OG1-N 2.9Å
348	T	60.9	Low	76.9	Confident	151 Å²	151	67.9 Å²	67.9	93%	0.926	39%	0.39	S	S	*	.	S	Bend	trans	-81.8	-2.9	170.4	48	0	0	0	0	113.2
349	Y	69.8	Low	77.2	Confident	150 Å²	150	68.5 Å²	68.5	59%	0.588	39%	0.393	S	S	*	.			trans	-78.8	125	-174.7	-178.9	-110.4	0	0	0	111.4	A344 T347 P351	A344-Y349 WeakPolarHBondContact CB-O 3.24Å; T347-Y349 VanDerWaalsContact C-N 3.26Å; T347-Y349 PolarHBondContact OG1-N 2.9Å; Y349-P351 HydrophobicContact CD1-CB 4.06Å; Y349-P351 VanDerWaalsContact CE1-CA 3.48Å; Y349-P351 HydrophobicContact CE1-CB 3.68Å; Y349-P351 WeakPolarHBondContact O-CD 3.42Å
350	Q	68.8	Low	77.5	Confident	92 Å²	92	69.2 Å²	69.2	43%	0.43	40%	0.396	S	S	.	.			trans	-96	95.9	173.6	-66	-170.8	5	0	0	110.3	L352 S353 D605	Q350-L352 PolarHBondContact O-N 3.35Å; Q350-L352 VanDerWaalsContact O-N 3.07Å; Q350-S353 PolarHBondContact O-N 3.01Å; Q350-S353 VanDerWaalsContact O-N 3.16Å; Q350-D605 PolarHBondContact NE2-OD1 3.12Å; Q350-D605 PolarHBondContact NE2-OD2 3.47Å; Q350-D605 VanDerWaalsContact NE2-OD2 3.08Å
351	P	71.2	Confident	78	Confident	19 Å²	19	74 Å²	74	12%	0.123	42%	0.42	C	S	.	.	T	Hydrogen-bonded Turn	trans	-68.8	-14.9	-166.4	28.4	-38.1	0	0	0	115.2	A344 Y349 K355	A344-P351 HydrophobicContact CB-CG 3.8Å; Y349-P351 HydrophobicContact CD1-CB 4.06Å; Y349-P351 VanDerWaalsContact CE1-CA 3.48Å; Y349-P351 HydrophobicContact CE1-CB 3.68Å; Y349-P351 WeakPolarHBondContact O-CD 3.42Å; P351-K355 PolarHBondContact O-NZ 2.93Å
352	L	77.5	Confident	78.7	Confident	13 Å²	13	77.1 Å²	77.1	7%	0.068	44%	0.435	C	S	.	.	T	Hydrogen-bonded Turn	trans	-101	-12.2	-178	-60.6	174.2	0	0	0	112.9	P262 Y336 A337 Q350 K355 F359	P262-L352 HydrophobicContact CB-CD1 4.15Å; Y336-L352 HydrophobicContact CD1-CD2 4.38Å; Y336-L352 HydrophobicContact CE1-CD2 3.99Å; A337-L352 HydrophobicContact CB-CD1 3.78Å; A337-L352 HydrophobicContact CB-CD2 4.33Å; Q350-L352 PolarHBondContact O-N 3.35Å; Q350-L352 VanDerWaalsContact O-N 3.07Å; L352-K355 PolarHBondContact O-N 2.96Å; L352-F359 HydrophobicContact CD2-CE2 4.01Å; L352-F359 HydrophobicContact CD2-CZ 3.76Å
353	S	75	Confident	79.6	Confident	83 Å²	83	77 Å²	77	58%	0.58	43%	0.434	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.5	143.2	178	-164.6	0	0	0	0	110.6	Q350 K355	Q350-S353 PolarHBondContact O-N 3.01Å; Q350-S353 VanDerWaalsContact O-N 3.16Å; S353-K355 PolarHBondContact O-N 2.87Å; S353-K355 VanDerWaalsContact O-N 3.12Å
354	G	77.9	Confident	80.6	Confident	65 Å²	65	73 Å²	73	67%	0.67	42%	0.415	S	S	*	.	T	Hydrogen-bonded Turn	trans	72.4	-11.1	-175.6	0	0	0	0	0	116.5
355	K	83.3	Confident	81.6	Confident	68 Å²	68	75.1 Å²	75.1	30%	0.296	43%	0.428	S	S	.	.			trans	-94.9	-3.5	-176.6	-67.4	173.9	-170.7	157.2	0	114.9	P351 L352 S353 S357 Y358 F359	P351-K355 PolarHBondContact O-NZ 2.93Å; L352-K355 PolarHBondContact O-N 2.96Å; S353-K355 PolarHBondContact O-N 2.87Å; S353-K355 VanDerWaalsContact O-N 3.12Å; K355-S357 VanDerWaalsContact C-N 3.3Å; K355-S357 PolarHBondContact O-N 3.39Å; K355-Y358 WeakPolarHBondContact O-CB 3.24Å; K355-Y358 PolarHBondContact O-N 2.9Å; K355-F359 HydrophobicContact CB-CE2 3.81Å; K355-F359 HydrophobicContact CB-CZ 3.93Å; K355-F359 PolarHBondContact O-N 3.37Å
356	T	85.2	Confident	83	Confident	52 Å²	52	76.3 Å²	76.3	32%	0.319	44%	0.435	S	S	.	.	H	α-helix	trans	-45.5	-47.9	-179.4	-57.4	0	0	0	0	113.7	Y261 Y358 F359 H360	Y261-T356 HydrophobicContact CE2-CG2 3.61Å; T356-Y358 VanDerWaalsContact C-N 3.33Å; T356-Y358 PolarHBondContact O-N 3.21Å; T356-F359 PolarHBondContact O-N 3.45Å; T356-H360 PolarHBondContact O-CD2 3.32Å; T356-H360 PolarHBondContact O-N 3.04Å; T356-H360 VanDerWaalsContact O-N 3.13Å
357	S	89.9	Confident	84.8	Confident	91 Å²	91	72.5 Å²	72.5	64%	0.636	40%	0.395	S	S	*	.	H	α-helix	trans	-63	-37.2	-178.3	-50.1	0	0	0	0	112.9	K355 L361	K355-S357 VanDerWaalsContact C-N 3.3Å; K355-S357 PolarHBondContact O-N 3.39Å; S357-L361 VanDerWaalsContact O-CB 3.31Å; S357-L361 WeakPolarHBondContact O-CB 3.45Å; S357-L361 PolarHBondContact O-N 2.98Å
358	Y	92.6	Very high	86.4	Confident	179 Å²	179	74.5 Å²	74.5	70%	0.702	40%	0.397	S	S	*	.	H	α-helix	trans	-67.8	-41.5	177.7	-71.2	-83.6	0	0	0	112	K355 T356 L362	K355-Y358 WeakPolarHBondContact O-CB 3.24Å; K355-Y358 PolarHBondContact O-N 2.9Å; T356-Y358 VanDerWaalsContact C-N 3.33Å; T356-Y358 PolarHBondContact O-N 3.21Å; Y358-L362 WeakPolarHBondContact O-CB 3.3Å; Y358-L362 PolarHBondContact O-N 3.29Å
359	F	93	Very high	88.1	Confident	20 Å²	20	71.7 Å²	71.7	9%	0.088	38%	0.379	C	S	.	.	H	α-helix	trans	-61.6	-48.6	176	-59	-45.9	0	0	0	110.8	Y261 V333 Y336 L352 K355 T356 L362 T363	Y261-F359 HydrophobicContact CD1-CD2 4.36Å; Y261-F359 HydrophobicContact CD1-CE2 4.47Å; Y261-F359 AromaticContact CE1-CD2 3.71Å; Y261-F359 HydrophobicContact CE1-CD2 3.71Å; Y261-F359 HydrophobicContact CE1-CE2 4.25Å; V333-F359 HydrophobicContact CG1-CB 4.21Å; V333-F359 HydrophobicContact CG1-CD1 3.94Å; V333-F359 HydrophobicContact CG1-CE1 4.49Å; V333-F359 HydrophobicContact CG1-CG 3.99Å; V333-F359 HydrophobicContact CG2-CD1 4.4Å; Y336-F359 AromaticContact CD1-CE1 3.98Å; Y336-F359 HydrophobicContact CD1-CE1 3.98Å; Y336-F359 HydrophobicContact CD1-CZ 4.19Å; Y336-F359 AromaticContact CE1-CE1 3.82Å; Y336-F359 HydrophobicContact CE1-CE1 3.82Å; Y336-F359 AromaticContact CE1-CZ 3.81Å; Y336-F359 HydrophobicContact CE1-CZ 3.81Å; L352-F359 HydrophobicContact CD2-CE2 4.01Å; L352-F359 HydrophobicContact CD2-CZ 3.76Å; K355-F359 HydrophobicContact CB-CE2 3.81Å; K355-F359 HydrophobicContact CB-CZ 3.93Å; K355-F359 PolarHBondContact O-N 3.37Å; T356-F359 PolarHBondContact O-N 3.45Å; F359-L362 PolarHBondContact O-N 3.47Å; F359-T363 WeakPolarHBondContact O-CB 3.29Å; F359-T363 WeakPolarHBondContact O-CG2 3.38Å; F359-T363 PolarHBondContact O-N 2.97Å; F359-T363 PolarHBondContact O-OG1 3.28Å
360	H	94	Very high	89.5	Confident	36 Å²	36	66.6 Å²	66.6	17%	0.167	36%	0.362	C	S	.	.	H	α-helix	trans	-61.2	-45.9	178.6	-76.1	-55	0	0	0	113.3	Y261 Y268 W330 T356 L362 T363 W364	Y261-H360 PolarHBondContact OH-NE2 3.27Å; Y261-H360 VanDerWaalsContact OH-NE2 3.1Å; Y268-H360 AromaticContact CD2-CE1 3.85Å; Y268-H360 AromaticContact CE2-CE1 3.34Å; Y268-H360 WeakPolarHBondContact CE2-CE1 3.48Å; Y268-H360 AromaticContact CE2-NE2 3.87Å; Y268-H360 AromaticContact CZ-CE1 3.44Å; Y268-H360 VanDerWaalsContact CZ-CE1 3.44Å; W330-H360 AromaticContact CH2-CE1 3.4Å; W330-H360 WeakPolarHBondContact CH2-CE1 3.38Å; W330-H360 AromaticContact CH2-ND1 3.5Å; W330-H360 AromaticContact CZ2-CE1 3.62Å; W330-H360 AromaticContact CZ2-ND1 3.45Å; W330-H360 WeakPolarHBondContact CZ2-ND1 3.29Å; T356-H360 PolarHBondContact O-CD2 3.32Å; T356-H360 PolarHBondContact O-N 3.04Å; T356-H360 VanDerWaalsContact O-N 3.13Å; H360-L362 VanDerWaalsContact C-N 3.35Å; H360-L362 PolarHBondContact O-N 3.45Å; H360-T363 WeakPolarHBondContact CA-OG1 3.26Å; H360-T363 PolarHBondContact O-N 3.34Å; H360-T363 PolarHBondContact O-OG1 2.93Å; H360-T363 VanDerWaalsContact O-OG1 3.07Å; H360-W364 AromaticContact ND1-NE1 3.42Å; H360-W364 PolarHBondContact ND1-NE1 3.07Å; H360-W364 WeakPolarHBondContact O-CB 3.46Å; H360-W364 PolarHBondContact O-N 3.47Å; H360-W364 VanDerWaalsContact O-N 3.1Å
361	L	95.3	Very high	90.9	Very high	118 Å²	118	62.6 Å²	62.6	62%	0.618	34%	0.344	S	S	*	.	H	α-helix	trans	-58.1	-48.5	177.3	-175.3	145.9	0	0	0	110.6	S357 S365	S357-L361 VanDerWaalsContact O-CB 3.31Å; S357-L361 WeakPolarHBondContact O-CB 3.45Å; S357-L361 PolarHBondContact O-N 2.98Å; L361-S365 WeakPolarHBondContact O-CB 3.45Å; L361-S365 PolarHBondContact O-N 3.32Å; L361-S365 PolarHBondContact O-OG 2.94Å; L361-S365 VanDerWaalsContact O-OG 3.07Å
362	L	95.1	Very high	92.1	Very high	85 Å²	85	65.1 Å²	65.1	45%	0.445	36%	0.359	S	S	.	.	H	α-helix	trans	-62	-47.8	177.7	-171.9	68.8	0	0	0	112.7	Y358 F359 H360 W364 L366	Y358-L362 WeakPolarHBondContact O-CB 3.3Å; Y358-L362 PolarHBondContact O-N 3.29Å; F359-L362 PolarHBondContact O-N 3.47Å; H360-L362 VanDerWaalsContact C-N 3.35Å; H360-L362 PolarHBondContact O-N 3.45Å; L362-W364 VanDerWaalsContact C-N 3.32Å; L362-W364 PolarHBondContact O-N 3.39Å; L362-L366 HydrophobicContact CD1-CD1 3.59Å; L362-L366 HydrophobicContact CD1-CG 4.06Å; L362-L366 HydrophobicContact CG-CD1 3.98Å; L362-L366 WeakPolarHBondContact O-CB 3.24Å; L362-L366 WeakPolarHBondContact O-CG 3.34Å; L362-L366 PolarHBondContact O-N 3.35Å
363	T	95.8	Very high	93.1	Very high	0 Å²	0	66.1 Å²	66.1	0%	0	37%	0.369	C	S	.	.	H	α-helix	trans	-69.3	-26.5	-173.6	54.5	0	0	0	0	114.2	V329 W330 V333 F359 H360 P367	V329-T363 HydrophobicContact CG1-CG2 3.97Å; W330-T363 HydrophobicContact CD2-CG2 3.51Å; W330-T363 HydrophobicContact CE3-CG2 3.74Å; W330-T363 HydrophobicContact CG-CG2 3.98Å; W330-T363 HydrophobicContact CH2-CG2 4.14Å; W330-T363 HydrophobicContact CZ2-CG2 3.93Å; W330-T363 VanDerWaalsContact CZ2-OG1 3.23Å; W330-T363 WeakPolarHBondContact CZ2-OG1 3.1Å; W330-T363 HydrophobicContact CZ3-CG2 4.05Å; V333-T363 HydrophobicContact CG2-CG2 3.79Å; F359-T363 WeakPolarHBondContact O-CB 3.29Å; F359-T363 WeakPolarHBondContact O-CG2 3.38Å; F359-T363 PolarHBondContact O-N 2.97Å; F359-T363 PolarHBondContact O-OG1 3.28Å; H360-T363 WeakPolarHBondContact CA-OG1 3.26Å; H360-T363 PolarHBondContact O-N 3.34Å; H360-T363 PolarHBondContact O-OG1 2.93Å; H360-T363 VanDerWaalsContact O-OG1 3.07Å; T363-P367 WeakPolarHBondContact O-CD 3.36Å; T363-P367 VanDerWaalsContact O-CG 3.27Å; T363-P367 WeakPolarHBondContact O-CG 3.47Å
364	W	97.9	Very high	94.2	Very high	77 Å²	77	62.2 Å²	62.2	29%	0.292	34%	0.342	S	S	.	.	H	α-helix	trans	-101.7	-34.7	-177.5	-57.2	131.9	0	0	0	112.6	Y268 Y322 A326 W330 H360 L362 F368	Y268-W364 AromaticContact CD1-CZ2 3.91Å; Y268-W364 HydrophobicContact CD1-CZ2 3.91Å; Y268-W364 HydrophobicContact CG-CZ2 4.5Å; Y322-W364 AromaticContact CE1-CE3 3.99Å; Y322-W364 HydrophobicContact CE1-CE3 3.99Å; Y322-W364 HydrophobicContact CE1-CZ3 4.22Å; Y322-W364 PolarHBondContact OH-O 3.25Å; A326-W364 HydrophobicContact CB-CE3 4.12Å; A326-W364 HydrophobicContact CB-CZ3 3.78Å; W330-W364 AromaticContact CZ2-CZ2 3.98Å; W330-W364 HydrophobicContact CZ2-CZ2 3.98Å; W330-W364 AromaticContact NE1-CH2 3.39Å; W330-W364 AromaticContact NE1-CZ2 3.5Å; W330-W364 AromaticContact NE1-CZ3 3.79Å; H360-W364 AromaticContact ND1-NE1 3.42Å; H360-W364 PolarHBondContact ND1-NE1 3.07Å; H360-W364 WeakPolarHBondContact O-CB 3.46Å; H360-W364 PolarHBondContact O-N 3.47Å; H360-W364 VanDerWaalsContact O-N 3.1Å; L362-W364 VanDerWaalsContact C-N 3.32Å; L362-W364 PolarHBondContact O-N 3.39Å; W364-F368 WeakPolarHBondContact O-CB 3.38Å; W364-F368 PolarHBondContact O-N 3.32Å
365	S	97.4	Very high	95.1	Very high	58 Å²	58	61.5 Å²	61.5	41%	0.406	32%	0.322	S	S	.	.	H	α-helix	trans	-72.7	-36.7	178.1	-62.4	0	0	0	0	113.2	L361 F368 V369	L361-S365 WeakPolarHBondContact O-CB 3.45Å; L361-S365 PolarHBondContact O-N 3.32Å; L361-S365 PolarHBondContact O-OG 2.94Å; L361-S365 VanDerWaalsContact O-OG 3.07Å; S365-F368 PolarHBondContact O-N 2.99Å; S365-V369 WeakPolarHBondContact O-CG2 3.38Å; S365-V369 PolarHBondContact O-N 2.91Å
366	L	96.8	Very high	95.7	Very high	80 Å²	80	62.4 Å²	62.4	42%	0.419	34%	0.342	S	S	.	.	H	α-helix	trans	-62.7	-51.5	179.6	-73.8	177.4	0	0	0	112.8	V329 L362 F368 V369 L370	V329-L366 HydrophobicContact CG1-CD1 4.37Å; V329-L366 HydrophobicContact CG2-CD1 4.44Å; L362-L366 HydrophobicContact CD1-CD1 3.59Å; L362-L366 HydrophobicContact CD1-CG 4.06Å; L362-L366 HydrophobicContact CG-CD1 3.98Å; L362-L366 WeakPolarHBondContact O-CB 3.24Å; L362-L366 WeakPolarHBondContact O-CG 3.34Å; L362-L366 PolarHBondContact O-N 3.35Å; L366-F368 VanDerWaalsContact C-N 3.3Å; L366-F368 PolarHBondContact O-N 2.98Å; L366-V369 PolarHBondContact O-N 3.03Å; L366-L370 WeakPolarHBondContact O-CG 3.44Å; L366-L370 PolarHBondContact O-N 3.49Å; L366-L370 VanDerWaalsContact O-N 3.14Å
367	P	98.1	Very high	96.2	Very high	1 Å²	1	62.8 Å²	62.8	1%	0.006	34%	0.344	C	S	.	.	H	α-helix	trans	-60.2	-38.2	174	-25.2	36.7	0	0	0	112.8	Y322 M325 A326 T363 L370 T371	Y322-P367 HydrophobicContact CD2-CB 3.61Å; Y322-P367 HydrophobicContact CE2-CB 3.67Å; Y322-P367 HydrophobicContact CG-CB 4.14Å; M325-P367 HydrophobicContact CB-CB 3.82Å; M325-P367 HydrophobicContact CB-CG 4Å; A326-P367 HydrophobicContact CB-CB 4.5Å; A326-P367 HydrophobicContact CB-CG 3.9Å; T363-P367 WeakPolarHBondContact O-CD 3.36Å; T363-P367 VanDerWaalsContact O-CG 3.27Å; T363-P367 WeakPolarHBondContact O-CG 3.47Å; P367-L370 PolarHBondContact O-N 3.46Å; P367-T371 WeakPolarHBondContact O-CB 3.35Å; P367-T371 PolarHBondContact O-N 3.49Å; P367-T371 PolarHBondContact O-OG1 2.99Å
368	F	98.1	Very high	96.5	Very high	126 Å²	126	59.9 Å²	59.9	55%	0.553	33%	0.326	S	S	*	.	H	α-helix	trans	-60.2	-50	178.7	178.5	-102.2	0	0	0	112.1	Y322 W364 S365 L366 L370 T371 V372	Y322-F368 HydrophobicContact CE2-CB 4.05Å; W364-F368 WeakPolarHBondContact O-CB 3.38Å; W364-F368 PolarHBondContact O-N 3.32Å; S365-F368 PolarHBondContact O-N 2.99Å; L366-F368 VanDerWaalsContact C-N 3.3Å; L366-F368 PolarHBondContact O-N 2.98Å; F368-L370 VanDerWaalsContact C-N 3.34Å; F368-L370 PolarHBondContact O-N 3.01Å; F368-T371 PolarHBondContact O-N 2.85Å; F368-V372 HydrophobicContact CD1-CG2 4.48Å; F368-V372 HydrophobicContact CD2-CG2 4.41Å; F368-V372 HydrophobicContact CE1-CG2 4.1Å; F368-V372 HydrophobicContact CE2-CG2 4.03Å; F368-V372 HydrophobicContact CZ-CG2 3.86Å; F368-V372 WeakPolarHBondContact O-CG2 3.43Å; F368-V372 PolarHBondContact O-N 3.25Å
369	V	98.3	Very high	96.6	Very high	92 Å²	92	52.9 Å²	52.9	56%	0.558	30%	0.3	S	S	*	.	H	α-helix	trans	-62.3	-41.7	179	172.4	0	0	0	0	111.2	S365 L366 V372 A373	S365-V369 WeakPolarHBondContact O-CG2 3.38Å; S365-V369 PolarHBondContact O-N 2.91Å; L366-V369 PolarHBondContact O-N 3.03Å; V369-V372 PolarHBondContact O-N 3.5Å; V369-A373 WeakPolarHBondContact O-CB 3.3Å; V369-A373 PolarHBondContact O-N 3.29Å
370	L	97.8	Very high	96.8	Very high	44 Å²	44	51.9 Å²	51.9	23%	0.23	30%	0.295	C	S	.	.	H	α-helix	trans	-63.3	-46.2	176.5	-68.6	172.4	0	0	0	112.1	Y321 M325 L366 P367 F368 V372 A373 I374 F402 P406	Y321-L370 HydrophobicContact CE1-CB 4Å; M325-L370 HydrophobicContact CG-CD1 4.42Å; M325-L370 HydrophobicContact SD-CD1 4.35Å; L366-L370 WeakPolarHBondContact O-CG 3.44Å; L366-L370 PolarHBondContact O-N 3.49Å; L366-L370 VanDerWaalsContact O-N 3.14Å; P367-L370 PolarHBondContact O-N 3.46Å; F368-L370 VanDerWaalsContact C-N 3.34Å; F368-L370 PolarHBondContact O-N 3.01Å; L370-V372 PolarHBondContact O-N 2.9Å; L370-A373 PolarHBondContact O-N 3.34Å; L370-I374 WeakPolarHBondContact O-CG1 3.24Å; L370-I374 PolarHBondContact O-N 3.38Å; L370-F402 HydrophobicContact CD2-CD1 4.15Å; L370-P406 HydrophobicContact CD1-CG 4.37Å
371	T	97.9	Very high	96.8	Very high	8 Å²	8	50.3 Å²	50.3	5%	0.049	29%	0.288	C	S	.	.	H	α-helix	trans	-60.7	-45.7	176.9	-58.8	0	0	0	0	111.5	F317 V318 Y321 P367 F368 A373 I374 L375	F317-T371 HydrophobicContact CE1-CG2 4.12Å; V318-T371 HydrophobicContact CB-CG2 4.48Å; V318-T371 HydrophobicContact CG1-CG2 4.4Å; V318-T371 HydrophobicContact CG2-CG2 3.86Å; Y321-T371 WeakPolarHBondContact CD1-OG1 3.48Å; P367-T371 WeakPolarHBondContact O-CB 3.35Å; P367-T371 PolarHBondContact O-N 3.49Å; P367-T371 PolarHBondContact O-OG1 2.99Å; F368-T371 PolarHBondContact O-N 2.85Å; T371-A373 VanDerWaalsContact C-N 3.34Å; T371-A373 PolarHBondContact O-N 3.04Å; T371-I374 PolarHBondContact O-N 2.94Å; T371-L375 HydrophobicContact CG2-CD1 4.3Å; T371-L375 WeakPolarHBondContact O-CG 3.34Å; T371-L375 PolarHBondContact O-N 2.66Å; T371-L375 VanDerWaalsContact O-N 3.07Å
372	V	98	Very high	96.8	Very high	71 Å²	71	44.7 Å²	44.7	43%	0.43	26%	0.259	S	S	.	.	H	α-helix	trans	-63.3	-40.4	177.9	171.9	0	0	0	0	111.3	F368 V369 L370 I374 L375 A376	F368-V372 HydrophobicContact CD1-CG2 4.48Å; F368-V372 HydrophobicContact CD2-CG2 4.41Å; F368-V372 HydrophobicContact CE1-CG2 4.1Å; F368-V372 HydrophobicContact CE2-CG2 4.03Å; F368-V372 HydrophobicContact CZ-CG2 3.86Å; F368-V372 WeakPolarHBondContact O-CG2 3.43Å; F368-V372 PolarHBondContact O-N 3.25Å; V369-V372 PolarHBondContact O-N 3.5Å; L370-V372 PolarHBondContact O-N 2.9Å; V372-I374 VanDerWaalsContact C-N 3.34Å; V372-I374 PolarHBondContact O-N 3.48Å; V372-L375 PolarHBondContact O-N 3.49Å; V372-A376 WeakPolarHBondContact O-CB 3.13Å; V372-A376 PolarHBondContact O-N 3.01Å
373	A	97.7	Very high	96.9	Very high	35 Å²	35	41.3 Å²	41.3	29%	0.289	24%	0.241	S	C	.	.	H	α-helix	trans	-62.4	-38.8	176.3	0	0	0	0	0	112.6	V369 L370 T371 A376 V377 F402	V369-A373 WeakPolarHBondContact O-CB 3.3Å; V369-A373 PolarHBondContact O-N 3.29Å; L370-A373 PolarHBondContact O-N 3.34Å; T371-A373 VanDerWaalsContact C-N 3.34Å; T371-A373 PolarHBondContact O-N 3.04Å; A373-A376 PolarHBondContact O-N 3.4Å; A373-V377 PolarHBondContact O-N 3.24Å; A373-F402 HydrophobicContact CB-CE1 3.89Å; A373-F402 HydrophobicContact CB-CZ 4.1Å
374	I	97.8	Very high	96.8	Very high	0 Å²	0	41.7 Å²	41.7	0%	0	24%	0.244	C	C	.	.	H	α-helix	trans	-66.3	-43.4	176	-66	162.2	0	0	0	111.4	F317 Y321 L370 T371 V372 A376 V377 A378 V380 V391 F402	F317-I374 HydrophobicContact CE1-CB 4.43Å; F317-I374 HydrophobicContact CE1-CG2 4.01Å; F317-I374 HydrophobicContact CE2-CD1 4.38Å; F317-I374 HydrophobicContact CE2-CG2 4.22Å; F317-I374 HydrophobicContact CZ-CB 3.94Å; F317-I374 HydrophobicContact CZ-CD1 3.81Å; F317-I374 HydrophobicContact CZ-CG1 4.5Å; F317-I374 HydrophobicContact CZ-CG2 3.49Å; F317-I374 VanDerWaalsContact CZ-CG2 3.49Å; Y321-I374 HydrophobicContact CD1-CD1 4.05Å; Y321-I374 HydrophobicContact CD2-CD1 4.18Å; Y321-I374 HydrophobicContact CE1-CD1 3.51Å; Y321-I374 HydrophobicContact CE2-CD1 3.64Å; Y321-I374 HydrophobicContact CG-CD1 4.39Å; L370-I374 WeakPolarHBondContact O-CG1 3.24Å; L370-I374 PolarHBondContact O-N 3.38Å; T371-I374 PolarHBondContact O-N 2.94Å; V372-I374 VanDerWaalsContact C-N 3.34Å; V372-I374 PolarHBondContact O-N 3.48Å; I374-A376 VanDerWaalsContact C-N 3.27Å; I374-A376 PolarHBondContact O-N 3.18Å; I374-V377 VanDerWaalsContact O-CG2 3.24Å; I374-V377 WeakPolarHBondContact O-CG2 3.44Å; I374-V377 PolarHBondContact O-N 3.28Å; I374-A378 PolarHBondContact O-N 3.34Å; I374-A378 VanDerWaalsContact O-N 3.12Å; I374-V380 HydrophobicContact CG2-CG2 3.67Å; I374-V391 HydrophobicContact CD1-CB 4.23Å; I374-V391 HydrophobicContact CD1-CG1 4.19Å; I374-V391 HydrophobicContact CD1-CG2 4.21Å; I374-V391 HydrophobicContact CG1-CG2 4.14Å; I374-V391 HydrophobicContact CG2-CB 4Å; I374-V391 HydrophobicContact CG2-CG2 3.73Å; I374-F402 HydrophobicContact CD1-CB 3.87Å; I374-F402 HydrophobicContact CD1-CD1 4.15Å; I374-F402 HydrophobicContact CD1-CD2 4.38Å; I374-F402 HydrophobicContact CD1-CG 3.9Å; I374-F402 HydrophobicContact CG1-CB 4.07Å; I374-F402 HydrophobicContact CG1-CD1 3.75Å; I374-F402 HydrophobicContact CG1-CD2 3.64Å; I374-F402 HydrophobicContact CG1-CE1 4.02Å; I374-F402 HydrophobicContact CG1-CE2 3.89Å; I374-F402 HydrophobicContact CG1-CG 3.56Å; I374-F402 HydrophobicContact CG1-CZ 4.08Å
375	L	96.8	Very high	96.7	Very high	51 Å²	51	38.4 Å²	38.4	27%	0.267	23%	0.232	S	C	.	.	H	α-helix	trans	-65.1	-33	176.8	-64.6	175.4	0	0	0	111.9	V314 F317 V318 T371 V372 A378 V380	V314-L375 HydrophobicContact CG1-CD2 3.7Å; F317-L375 HydrophobicContact CD1-CD2 4.05Å; F317-L375 HydrophobicContact CE1-CD2 3.91Å; F317-L375 HydrophobicContact CE1-CG 4.26Å; V318-L375 HydrophobicContact CG2-CD1 4.29Å; T371-L375 HydrophobicContact CG2-CD1 4.3Å; T371-L375 WeakPolarHBondContact O-CG 3.34Å; T371-L375 PolarHBondContact O-N 2.66Å; T371-L375 VanDerWaalsContact O-N 3.07Å; V372-L375 PolarHBondContact O-N 3.49Å; L375-A378 PolarHBondContact O-N 2.92Å; L375-V380 HydrophobicContact CD2-CG2 4.32Å
376	A	96.4	Very high	96.6	Very high	86 Å²	86	35.9 Å²	35.9	71%	0.711	21%	0.214	S	C	*	.	H	α-helix	trans	-69.4	-29.7	176	0	0	0	0	0	113.7	V372 A373 I374	V372-A376 WeakPolarHBondContact O-CB 3.13Å; V372-A376 PolarHBondContact O-N 3.01Å; A373-A376 PolarHBondContact O-N 3.4Å; I374-A376 VanDerWaalsContact C-N 3.27Å; I374-A376 PolarHBondContact O-N 3.18Å
377	V	95.8	Very high	96.5	Very high	60 Å²	60	32 Å²	32	36%	0.364	19%	0.194	S	C	.	.	H	α-helix	trans	-89.1	-8.3	173.9	-60.6	0	0	0	0	113.8	A373 I374 Q379 Y398 F402	A373-V377 PolarHBondContact O-N 3.24Å; I374-V377 VanDerWaalsContact O-CG2 3.24Å; I374-V377 WeakPolarHBondContact O-CG2 3.44Å; I374-V377 PolarHBondContact O-N 3.28Å; V377-Q379 HydrophobicContact CB-CG 4.14Å; V377-Q379 HydrophobicContact CG2-CB 4.06Å; V377-Q379 HydrophobicContact CG2-CG 3.73Å; V377-Q379 WeakPolarHBondContact O-CG 3.29Å; V377-Q379 PolarHBondContact O-N 2.84Å; V377-Q379 PolarHBondContact O-NE2 2.8Å; V377-Y398 HydrophobicContact CB-CE1 4.39Å; V377-Y398 HydrophobicContact CG2-CD1 4.27Å; V377-Y398 HydrophobicContact CG2-CE1 4.24Å; V377-F402 HydrophobicContact CG2-CE2 4.21Å
378	A	95.1	Very high	96.5	Very high	31 Å²	31	32 Å²	32	26%	0.256	19%	0.194	S	C	.	.	T	Hydrogen-bonded Turn	trans	49.2	55.5	-178.3	0	0	0	0	0	113.4	G303 E304 I374 L375	G303-A378 CarbonylContact C-O 3.59Å; G303-A378 VanDerWaalsContact CA-O 3.24Å; G303-A378 WeakPolarHBondContact CA-O 3.22Å; E304-A378 CarbonylContact O-C 3.57Å; E304-A378 VanDerWaalsContact O-CA 3.29Å; E304-A378 WeakPolarHBondContact O-CA 3.32Å; I374-A378 PolarHBondContact O-N 3.34Å; I374-A378 VanDerWaalsContact O-N 3.12Å; L375-A378 PolarHBondContact O-N 2.92Å
379	Q	94.9	Very high	96.4	Very high	31 Å²	31	26 Å²	26	15%	0.145	17%	0.168	C	C	.	.			trans	-118.3	35.8	-179.6	-60.3	-64.4	-51.1	0	0	112	V377 V391 G392 N395 Y398	V377-Q379 HydrophobicContact CB-CG 4.14Å; V377-Q379 HydrophobicContact CG2-CB 4.06Å; V377-Q379 HydrophobicContact CG2-CG 3.73Å; V377-Q379 WeakPolarHBondContact O-CG 3.29Å; V377-Q379 PolarHBondContact O-N 2.84Å; V377-Q379 PolarHBondContact O-NE2 2.8Å; Q379-V391 WeakPolarHBondContact O-CA 3.45Å; Q379-G392 PolarHBondContact O-N 2.93Å; Q379-N395 PolarHBondContact OE1-ND2 3.17Å; Q379-Y398 HydrophobicContact CB-CD1 4.47Å; Q379-Y398 HydrophobicContact CB-CD2 4Å; Q379-Y398 HydrophobicContact CB-CE2 4.49Å; Q379-Y398 HydrophobicContact CB-CG 3.98Å; Q379-Y398 HydrophobicContact CG-CD1 4.02Å; Q379-Y398 HydrophobicContact CG-CD2 3.53Å; Q379-Y398 HydrophobicContact CG-CE1 4Å; Q379-Y398 HydrophobicContact CG-CE2 3.54Å; Q379-Y398 HydrophobicContact CG-CG 3.77Å
380	V	97	Very high	96.4	Very high	0 Å²	0	22.1 Å²	22.1	0%	0	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.1	126.4	172.2	-179.3	0	0	0	0	108.5	G303 E304 F317 I374 L375 C389	G303-V380 PolarHBondContact N-O 3.1Å; E304-V380 HydrophobicContact CB-CB 4.12Å; E304-V380 HydrophobicContact CB-CG1 4.46Å; E304-V380 WeakPolarHBondContact CB-O 3.44Å; E304-V380 PolarHBondContact N-O 2.7Å; E304-V380 PolarHBondContact O-N 2.97Å; F317-V380 HydrophobicContact CB-CG1 3.7Å; F317-V380 HydrophobicContact CD1-CG1 4.13Å; F317-V380 HydrophobicContact CD1-CG2 3.59Å; F317-V380 HydrophobicContact CD2-CG1 4.01Å; F317-V380 HydrophobicContact CD2-CG2 4.09Å; F317-V380 HydrophobicContact CE1-CG2 3.63Å; F317-V380 HydrophobicContact CE2-CG2 4.11Å; F317-V380 HydrophobicContact CG-CB 4.43Å; F317-V380 HydrophobicContact CG-CG1 3.64Å; F317-V380 HydrophobicContact CG-CG2 3.84Å; F317-V380 HydrophobicContact CZ-CG2 3.91Å; I374-V380 HydrophobicContact CG2-CG2 3.67Å; L375-V380 HydrophobicContact CD2-CG2 4.32Å; V380-C389 HydrophobicContact CG1-CB 3.94Å
381	D	95.7	Very high	96.3	Very high	2 Å²	2	20 Å²	20	1%	0.011	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	150.1	-177	-57	-48.8	0	0	0	109.5	L302 G303 C389 F390 Y393 K394	L302-D381 WeakPolarHBondContact CA-OD1 3.45Å; L302-D381 HydrophobicContact CD2-CB 4.35Å; G303-D381 PolarHBondContact N-OD1 2.93Å; D381-C389 CarbonylContact O-C 3.59Å; D381-C389 VanDerWaalsContact O-CA 3.24Å; D381-C389 WeakPolarHBondContact O-CA 3.32Å; D381-F390 PolarHBondContact N-O 3.47Å; D381-F390 PolarHBondContact O-N 3.46Å; D381-Y393 HydrophobicContact CB-CD2 4.02Å; D381-Y393 HydrophobicContact CB-CG 4.43Å; D381-Y393 WeakPolarHBondContact O-CD2 3.34Å; D381-Y393 PolarHBondContact OD2-N 3.2Å; D381-K394 PolarHBondContact OD2-N 3.08Å
382	G	95.6	Very high	96.1	Very high	0 Å²	0	19.6 Å²	19.6	0%	0	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96	139.6	172.2	0	0	0	0	0	111.9	M300 R301	M300-G382 VanDerWaalsContact CE-O 3.28Å; M300-G382 WeakPolarHBondContact CE-O 3.29Å; R301-G382 PolarHBondContact O-N 3.29Å
383	D	95.3	Very high	95.8	Very high	15 Å²	15	18.2 Å²	18.2	8%	0.08	12%	0.117	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	136.2	171.2	164.7	66.2	0	0	0	111.6	N218 V385 S386 G387 I388 Y393	N218-D383 PolarHBondContact ND2-OD1 3.16Å; N218-D383 VanDerWaalsContact ND2-OD1 3.08Å; D383-V385 PolarHBondContact OD1-N 2.69Å; D383-V385 WeakPolarHBondContact OD2-CB 3.12Å; D383-V385 PolarHBondContact OD2-N 2.88Å; D383-S386 PolarHBondContact O-OG 2.95Å; D383-S386 WeakPolarHBondContact OD2-CB 3.38Å; D383-S386 PolarHBondContact OD2-N 2.91Å; D383-S386 PolarHBondContact OD2-OG 2.84Å; D383-G387 VanDerWaalsContact O-CA 3.32Å; D383-G387 WeakPolarHBondContact O-CA 3.36Å; D383-G387 PolarHBondContact O-N 2.82Å; D383-I388 PolarHBondContact N-O 3.38Å; D383-I388 VanDerWaalsContact N-O 3.17Å; D383-Y393 HydrophobicContact CB-CD1 4.43Å; D383-Y393 HydrophobicContact CB-CD2 3.94Å; D383-Y393 HydrophobicContact CB-CE1 4.25Å; D383-Y393 HydrophobicContact CB-CE2 3.74Å; D383-Y393 HydrophobicContact CB-CG 4.3Å
384	S	95.4	Very high	95.4	Very high	8 Å²	8	20.2 Å²	20.2	6%	0.056	12%	0.12	C	C	.	.	T	Hydrogen-bonded Turn	trans	-79.7	-23.6	-174.2	61	0	0	0	0	113.6	N218 H226 H230	N218-S384 WeakPolarHBondContact CB-OG 3.45Å; N218-S384 PolarHBondContact N-OG 2.78Å; H226-S384 PolarHBondContact CD2-O 3.45Å; H226-S384 PolarHBondContact NE2-OG 3.18Å; H230-S384 PolarHBondContact NE2-O 3.11Å
385	V	95.2	Very high	95.1	Very high	7 Å²	7	22.9 Å²	22.9	4%	0.042	13%	0.134	C	C	.	.	T	Hydrogen-bonded Turn	trans	-75	-50.6	-178.2	177.4	0	0	0	0	110	N218 F221 M229 H230 D383 L514	N218-V385 HydrophobicContact CB-CG2 4.04Å; F221-V385 HydrophobicContact CB-CG2 4.26Å; F221-V385 HydrophobicContact CD2-CG2 3.52Å; F221-V385 HydrophobicContact CE2-CG2 4.19Å; F221-V385 HydrophobicContact CG-CG2 4.14Å; M229-V385 HydrophobicContact CB-CG1 4.12Å; M229-V385 HydrophobicContact CE-CG1 4.19Å; M229-V385 HydrophobicContact CG-CG1 3.91Å; M229-V385 VanDerWaalsContact CG-O 3.3Å; M229-V385 WeakPolarHBondContact CG-O 3.44Å; H230-V385 PolarHBondContact CD2-O 3.35Å; H230-V385 VanDerWaalsContact CD2-O 3.31Å; H230-V385 PolarHBondContact NE2-O 2.93Å; D383-V385 PolarHBondContact OD1-N 2.69Å; D383-V385 WeakPolarHBondContact OD2-CB 3.12Å; D383-V385 PolarHBondContact OD2-N 2.88Å; V385-L514 HydrophobicContact CG1-CD2 3.67Å
386	S	94.8	Very high	94.8	Very high	5 Å²	5	22.5 Å²	22.5	4%	0.035	13%	0.129	C	C	.	.	T	Hydrogen-bonded Turn	trans	-72.2	-30.3	170.9	59.1	0	0	0	0	112.4	I233 Q283 D383 I388 Y393	I233-S386 VanDerWaalsContact CD1-O 3.3Å; I233-S386 WeakPolarHBondContact CD1-O 3.4Å; Q283-S386 PolarHBondContact NE2-O 3.49Å; D383-S386 PolarHBondContact O-OG 2.95Å; D383-S386 WeakPolarHBondContact OD2-CB 3.38Å; D383-S386 PolarHBondContact OD2-N 2.91Å; D383-S386 PolarHBondContact OD2-OG 2.84Å; S386-I388 VanDerWaalsContact C-N 3.32Å; S386-Y393 PolarHBondContact OG-OH 3.41Å
387	G	95.7	Very high	94.7	Very high	0 Å²	0	26 Å²	26	0%	0	12%	0.124	C	C	.	.	T	Hydrogen-bonded Turn	trans	74.4	18.9	177.7	0	0	0	0	0	114.3	Q283 D383	Q283-G387 WeakPolarHBondContact CB-O 3.41Å; D383-G387 VanDerWaalsContact O-CA 3.32Å; D383-G387 WeakPolarHBondContact O-CA 3.36Å; D383-G387 PolarHBondContact O-N 2.82Å
388	I	96.8	Very high	94.7	Very high	1 Å²	1	27.2 Å²	27.2	1%	0.005	12%	0.123	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.6	173.1	178.2	63.4	159.1	0	0	0	111	W280 I316 V320 D383 S386 F390	W280-I388 HydrophobicContact CD2-CD1 4.26Å; W280-I388 HydrophobicContact CD2-CG2 4.41Å; W280-I388 HydrophobicContact CE3-CD1 4.05Å; W280-I388 HydrophobicContact CE3-CG1 4.31Å; W280-I388 HydrophobicContact CE3-CG2 3.86Å; W280-I388 HydrophobicContact CH2-CD1 3.39Å; W280-I388 HydrophobicContact CH2-CG1 4.01Å; W280-I388 HydrophobicContact CZ2-CD1 3.63Å; W280-I388 HydrophobicContact CZ3-CD1 3.62Å; W280-I388 HydrophobicContact CZ3-CG1 3.82Å; W280-I388 HydrophobicContact CZ3-CG2 4.19Å; I316-I388 HydrophobicContact CG2-CB 4.1Å; I316-I388 HydrophobicContact CG2-CG2 4.07Å; V320-I388 HydrophobicContact CG1-CD1 4.06Å; V320-I388 HydrophobicContact CG2-CD1 4.47Å; D383-I388 PolarHBondContact N-O 3.38Å; D383-I388 VanDerWaalsContact N-O 3.17Å; S386-I388 VanDerWaalsContact C-N 3.32Å; I388-F390 HydrophobicContact CD1-CD2 4.42Å
389	C	97.5	Very high	94.7	Very high	0 Å²	0	27 Å²	27	0%	0	12%	0.115	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	136.3	165.6	-70.3	0	0	0	0	111.3	I292 C313 F317 V380 D381	I292-C389 PolarHBondContact O-SG 2.97Å; C313-C389 WeakPolarHBondContact CA-SG 3.49Å; C313-C389 HydrophobicContact CB-CB 4.12Å; C313-C389 WeakPolarHBondContact CB-SG 3.4Å; C313-C389 WeakPolarHBondContact O-CB 3.38Å; C313-C389 WeakPolarHBondContact SG-CB 3.37Å; C313-C389 CovalentContact SG-SG 2.03Å; C313-C389 PolarHBondContact SG-SG 2.93Å; F317-C389 WeakPolarHBondContact CA-O 3.34Å; F317-C389 HydrophobicContact CB-CB 4.16Å; V380-C389 HydrophobicContact CG1-CB 3.94Å; D381-C389 CarbonylContact O-C 3.59Å; D381-C389 VanDerWaalsContact O-CA 3.24Å; D381-C389 WeakPolarHBondContact O-CA 3.32Å
390	F	97.3	Very high	94.7	Very high	9 Å²	9	26.3 Å²	26.3	4%	0.039	12%	0.115	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.7	167.4	-177.9	-153.9	-112.7	0	0	0	112	V320 Y321 L324 D381 I388 Y393 V403	V320-F390 HydrophobicContact CG1-CE2 4.38Å; Y321-F390 HydrophobicContact CD2-CE2 4.02Å; Y321-F390 HydrophobicContact CD2-CZ 4.1Å; L324-F390 HydrophobicContact CD2-CE2 4.43Å; L324-F390 HydrophobicContact CD2-CZ 4.03Å; D381-F390 PolarHBondContact N-O 3.47Å; D381-F390 PolarHBondContact O-N 3.46Å; I388-F390 HydrophobicContact CD1-CD2 4.42Å; F390-Y393 HydrophobicContact CB-CD2 4.21Å; F390-Y393 HydrophobicContact CB-CE2 3.41Å; F390-Y393 VanDerWaalsContact CB-CE2 3.41Å; F390-V403 HydrophobicContact CE1-CG2 3.74Å; F390-V403 HydrophobicContact CZ-CG2 3.98Å
391	V	96.6	Very high	94.6	Very high	0 Å²	0	28.4 Å²	28.4	0%	0	14%	0.136	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.3	126.5	-177	56	0	0	0	0	112	F317 Y321 I374 Q379 R399 F402 V403	F317-V391 HydrophobicContact CE2-CB 4.12Å; F317-V391 HydrophobicContact CE2-CG1 4.47Å; Y321-V391 HydrophobicContact CD2-CG1 4.07Å; Y321-V391 HydrophobicContact CE2-CG1 3.97Å; I374-V391 HydrophobicContact CD1-CB 4.23Å; I374-V391 HydrophobicContact CD1-CG1 4.19Å; I374-V391 HydrophobicContact CD1-CG2 4.21Å; I374-V391 HydrophobicContact CG1-CG2 4.14Å; I374-V391 HydrophobicContact CG2-CB 4Å; I374-V391 HydrophobicContact CG2-CG2 3.73Å; Q379-V391 WeakPolarHBondContact O-CA 3.45Å; V391-R399 WeakPolarHBondContact O-CB 3.37Å; V391-F402 HydrophobicContact CG2-CD2 4.28Å; V391-V403 HydrophobicContact CG1-CG2 3.64Å
392	G	92.6	Very high	94.7	Very high	0 Å²	0	30 Å²	30	0%	0	14%	0.143	C	C	.	.	T	Hydrogen-bonded Turn	trans	67.1	49.4	167.6	0	0	0	0	0	115.6	Q379 N395	Q379-G392 PolarHBondContact O-N 2.93Å; G392-N395 WeakPolarHBondContact CA-O 3.41Å
393	Y	91.2	Very high	94.8	Very high	41 Å²	41	30 Å²	30	16%	0.161	14%	0.143	C	C	.	.	S	Bend	trans	-73.7	-37.8	164.4	-72.3	-64.2	0	0	0	111.3	D381 D383 S386 F390 Q476	D381-Y393 HydrophobicContact CB-CD2 4.02Å; D381-Y393 HydrophobicContact CB-CG 4.43Å; D381-Y393 WeakPolarHBondContact O-CD2 3.34Å; D381-Y393 PolarHBondContact OD2-N 3.2Å; D383-Y393 HydrophobicContact CB-CD1 4.43Å; D383-Y393 HydrophobicContact CB-CD2 3.94Å; D383-Y393 HydrophobicContact CB-CE1 4.25Å; D383-Y393 HydrophobicContact CB-CE2 3.74Å; D383-Y393 HydrophobicContact CB-CG 4.3Å; S386-Y393 PolarHBondContact OG-OH 3.41Å; F390-Y393 HydrophobicContact CB-CD2 4.21Å; F390-Y393 HydrophobicContact CB-CE2 3.41Å; F390-Y393 VanDerWaalsContact CB-CE2 3.41Å; Y393-Q476 PolarHBondContact O-NE2 2.85Å
394	K	89.3	Confident	94.8	Very high	78 Å²	78	30.2 Å²	30.2	34%	0.339	14%	0.144	S	C	.	.	S	Bend	trans	-83.2	-29.1	175.8	174	59.6	177.6	171.4	0	112.8	E207 L302 D381	E207-K394 IonicContact OE1-NZ 2.73Å; E207-K394 PolarHBondContact OE1-NZ 2.95Å; L302-K394 HydrophobicContact CD2-CB 4.01Å; D381-K394 PolarHBondContact OD2-N 3.08Å
395	N	91.4	Very high	94.9	Very high	55 Å²	55	32.6 Å²	32.6	29%	0.294	17%	0.165	S	C	.	.			trans	-126.6	90.4	-179	-75.8	-57.1	0	0	0	111.5	Q379 G392 R397 Y398	Q379-N395 PolarHBondContact OE1-ND2 3.17Å; G392-N395 WeakPolarHBondContact CA-O 3.41Å; N395-R397 PolarHBondContact O-N 2.95Å; N395-Y398 HydrophobicContact CB-CD2 3.61Å; N395-Y398 HydrophobicContact CB-CE2 4.04Å; N395-Y398 PolarHBondContact O-N 3.43Å
396	Y	91.7	Very high	95	Very high	44 Å²	44	33.5 Å²	33.5	17%	0.173	17%	0.17	C	C	.	.	H	α-helix	trans	-54.2	-27.3	-176.2	65.7	-91.8	0	0	0	115.1	Y398 R399 A400 F473 Q476 A477	Y396-Y398 VanDerWaalsContact C-N 3.26Å; Y396-Y398 PolarHBondContact O-N 3.32Å; Y396-R399 PolarHBondContact O-N 2.83Å; Y396-A400 PolarHBondContact O-N 2.86Å; Y396-F473 AromaticContact CD2-CD2 3.68Å; Y396-F473 HydrophobicContact CD2-CD2 3.68Å; Y396-F473 AromaticContact CD2-CE2 3.64Å; Y396-F473 HydrophobicContact CD2-CE2 3.64Å; Y396-F473 HydrophobicContact CE2-CD2 4.27Å; Y396-F473 AromaticContact CE2-CE2 3.83Å; Y396-F473 HydrophobicContact CE2-CE2 3.83Å; Y396-Q476 HydrophobicContact CD1-CB 4.19Å; Y396-Q476 HydrophobicContact CD1-CG 4.12Å; Y396-Q476 HydrophobicContact CG-CB 4.2Å; Y396-Q476 HydrophobicContact CG-CG 4.34Å; Y396-A477 HydrophobicContact CE1-CB 4.44Å
397	R	94.1	Very high	95.1	Very high	160 Å²	160	33.3 Å²	33.3	60%	0.604	17%	0.169	S	C	*	.	H	α-helix	trans	-58.7	-37	178.4	-62.4	-176.1	-175.7	87.4	1	112.3	N395 G401	N395-R397 PolarHBondContact O-N 2.95Å; R397-G401 PolarHBondContact O-N 3.32Å
398	Y	95.8	Very high	95.2	Very high	85 Å²	85	33.9 Å²	33.9	33%	0.333	18%	0.175	S	C	.	.	H	α-helix	trans	-75.6	-37.6	177.9	-64.2	-76.9	0	0	0	111.8	V377 Q379 N395 Y396 A400 G401 F402	V377-Y398 HydrophobicContact CB-CE1 4.39Å; V377-Y398 HydrophobicContact CG2-CD1 4.27Å; V377-Y398 HydrophobicContact CG2-CE1 4.24Å; Q379-Y398 HydrophobicContact CB-CD1 4.47Å; Q379-Y398 HydrophobicContact CB-CD2 4Å; Q379-Y398 HydrophobicContact CB-CE2 4.49Å; Q379-Y398 HydrophobicContact CB-CG 3.98Å; Q379-Y398 HydrophobicContact CG-CD1 4.02Å; Q379-Y398 HydrophobicContact CG-CD2 3.53Å; Q379-Y398 HydrophobicContact CG-CE1 4Å; Q379-Y398 HydrophobicContact CG-CE2 3.54Å; Q379-Y398 HydrophobicContact CG-CG 3.77Å; N395-Y398 HydrophobicContact CB-CD2 3.61Å; N395-Y398 HydrophobicContact CB-CE2 4.04Å; N395-Y398 PolarHBondContact O-N 3.43Å; Y396-Y398 VanDerWaalsContact C-N 3.26Å; Y396-Y398 PolarHBondContact O-N 3.32Å; Y398-A400 VanDerWaalsContact C-N 3.3Å; Y398-A400 PolarHBondContact O-N 3.09Å; Y398-G401 PolarHBondContact O-N 3.09Å; Y398-F402 HydrophobicContact CD1-CD2 4.4Å; Y398-F402 HydrophobicContact CD1-CE2 4.02Å; Y398-F402 WeakPolarHBondContact O-CB 3.06Å; Y398-F402 WeakPolarHBondContact O-CD2 2.98Å; Y398-F402 PolarHBondContact O-N 3.12Å
399	R	94.6	Very high	95.2	Very high	25 Å²	25	39 Å²	39	9%	0.094	20%	0.202	C	C	.	.	H	α-helix	trans	-61.1	-40.1	171.4	-161.7	172.5	-177.7	-142.7	1.6	110.8	V391 Y396 V403 L404 H469 D472 E517	V391-R399 WeakPolarHBondContact O-CB 3.37Å; Y396-R399 PolarHBondContact O-N 2.83Å; R399-V403 HydrophobicContact CG-CG2 4.3Å; R399-V403 WeakPolarHBondContact O-CA 3.24Å; R399-V403 WeakPolarHBondContact O-CB 3.43Å; R399-V403 PolarHBondContact O-N 3.09Å; R399-L404 PolarHBondContact O-N 2.73Å; R399-H469 PolarHBondContact NH2-CE1 3.28Å; R399-H469 PolarHBondContact NH2-ND1 3.29Å; R399-D472 IonicContact CZ-OD2 2.68Å; R399-D472 IonicContact NH1-OD2 2.68Å; R399-D472 PolarHBondContact NH1-OD2 3.34Å; R399-D472 IonicContact NH2-OD2 3.82Å; R399-D472 PolarHBondContact NH2-OD2 3.04Å; R399-E517 IonicContact NH2-OE2 3.58Å; R399-E517 PolarHBondContact NH2-OE2 3.25Å
400	A	94.4	Very high	95.2	Very high	18 Å²	18	39.7 Å²	39.7	15%	0.149	21%	0.206	C	C	.	.	I	π-helix	trans	-64.1	-49.5	173.9	0	0	0	0	0	112.8	Y396 Y398 L404 A405 F473	Y396-A400 PolarHBondContact O-N 2.86Å; Y398-A400 VanDerWaalsContact C-N 3.3Å; Y398-A400 PolarHBondContact O-N 3.09Å; A400-L404 WeakPolarHBondContact O-CB 3.5Å; A400-L404 PolarHBondContact O-N 2.81Å; A400-A405 PolarHBondContact O-N 3.04Å; A400-F473 HydrophobicContact CB-CD2 3.49Å; A400-F473 VanDerWaalsContact CB-CD2 3.49Å; A400-F473 HydrophobicContact CB-CE2 3.61Å; A400-F473 HydrophobicContact CB-CG 4.35Å
401	G	96.2	Very high	95.2	Very high	43 Å²	43	40 Å²	40	44%	0.443	21%	0.208	S	C	.	.	I	π-helix	trans	-66	-40.7	-179	0	0	0	0	0	114.1	R397 Y398 P406	R397-G401 PolarHBondContact O-N 3.32Å; Y398-G401 PolarHBondContact O-N 3.09Å; G401-P406 WeakPolarHBondContact O-CD 3.28Å
402	F	97.7	Very high	95.2	Very high	37 Å²	37	46 Å²	46	16%	0.162	24%	0.239	C	C	.	.	I	π-helix	trans	-99.5	-13.2	-173.4	-71.5	-65.5	0	0	0	115.3	Y321 M325 L370 A373 I374 V377 V391 Y398	Y321-F402 PolarHBondContact OH-O 3.19Å; M325-F402 WeakPolarHBondContact CE-O 3.43Å; L370-F402 HydrophobicContact CD2-CD1 4.15Å; A373-F402 HydrophobicContact CB-CE1 3.89Å; A373-F402 HydrophobicContact CB-CZ 4.1Å; I374-F402 HydrophobicContact CD1-CB 3.87Å; I374-F402 HydrophobicContact CD1-CD1 4.15Å; I374-F402 HydrophobicContact CD1-CD2 4.38Å; I374-F402 HydrophobicContact CD1-CG 3.9Å; I374-F402 HydrophobicContact CG1-CB 4.07Å; I374-F402 HydrophobicContact CG1-CD1 3.75Å; I374-F402 HydrophobicContact CG1-CD2 3.64Å; I374-F402 HydrophobicContact CG1-CE1 4.02Å; I374-F402 HydrophobicContact CG1-CE2 3.89Å; I374-F402 HydrophobicContact CG1-CG 3.56Å; I374-F402 HydrophobicContact CG1-CZ 4.08Å; V377-F402 HydrophobicContact CG2-CE2 4.21Å; V391-F402 HydrophobicContact CG2-CD2 4.28Å; Y398-F402 HydrophobicContact CD1-CD2 4.4Å; Y398-F402 HydrophobicContact CD1-CE2 4.02Å; Y398-F402 WeakPolarHBondContact O-CB 3.06Å; Y398-F402 WeakPolarHBondContact O-CD2 2.98Å; Y398-F402 PolarHBondContact O-N 3.12Å
403	V	96.6	Very high	95.5	Very high	0 Å²	0	48.4 Å²	48.4	0%	0	25%	0.253	C	S	.	.	I	π-helix	trans	-120	-57.6	178.7	-173.4	0	0	0	0	110.7	Y321 M325 F390 V391 R399 A405 P406 I407	Y321-V403 HydrophobicContact CE2-CG2 4Å; M325-V403 HydrophobicContact CE-CB 4.39Å; M325-V403 HydrophobicContact CE-CG1 4.25Å; M325-V403 HydrophobicContact CE-CG2 4.39Å; F390-V403 HydrophobicContact CE1-CG2 3.74Å; F390-V403 HydrophobicContact CZ-CG2 3.98Å; V391-V403 HydrophobicContact CG1-CG2 3.64Å; R399-V403 HydrophobicContact CG-CG2 4.3Å; R399-V403 WeakPolarHBondContact O-CA 3.24Å; R399-V403 WeakPolarHBondContact O-CB 3.43Å; R399-V403 PolarHBondContact O-N 3.09Å; V403-A405 PolarHBondContact O-N 2.64Å; V403-P406 WeakPolarHBondContact O-CD 3.47Å; V403-I407 HydrophobicContact CG1-CD1 3.69Å; V403-I407 WeakPolarHBondContact O-CB 3.45Å; V403-I407 WeakPolarHBondContact O-CG1 3.32Å; V403-I407 PolarHBondContact O-N 2.97Å; V403-I407 VanDerWaalsContact O-N 3.11Å
404	L	96.1	Very high	95.7	Very high	18 Å²	18	46.4 Å²	46.4	9%	0.094	25%	0.246	C	C	.	.	I	π-helix	trans	-65.8	-43.4	-174.5	-171.9	66.5	0	0	0	112.3	R399 A400 I407 G408 F466 H469 F470 F473	R399-L404 PolarHBondContact O-N 2.73Å; A400-L404 WeakPolarHBondContact O-CB 3.5Å; A400-L404 PolarHBondContact O-N 2.81Å; L404-I407 PolarHBondContact O-N 3.12Å; L404-G408 PolarHBondContact O-N 3.04Å; L404-F466 HydrophobicContact CD1-CD2 3.53Å; L404-F466 HydrophobicContact CD1-CE2 3.45Å; L404-F466 VanDerWaalsContact CD1-CE2 3.45Å; L404-F466 HydrophobicContact CD1-CG 4.15Å; L404-F466 HydrophobicContact CD1-CZ 4.02Å; L404-F466 HydrophobicContact CG-CD2 4.39Å; L404-F466 HydrophobicContact CG-CE2 3.92Å; L404-F466 HydrophobicContact CG-CZ 4.49Å; L404-H469 HydrophobicContact CD1-CB 3.82Å; L404-F470 HydrophobicContact CD1-CB 4.17Å; L404-F470 HydrophobicContact CD2-CD2 4.24Å; L404-F473 HydrophobicContact CD2-CB 4.28Å; L404-F473 HydrophobicContact CD2-CG 4.39Å
405	A	97.1	Very high	96	Very high	59 Å²	59	43.2 Å²	43.2	49%	0.488	23%	0.234	S	C	.	.	H	α-helix	trans	-67.8	-46	-179.5	0	0	0	0	0	113.7	A400 V403 I407 G408 L409	A400-A405 PolarHBondContact O-N 3.04Å; V403-A405 PolarHBondContact O-N 2.64Å; A405-I407 PolarHBondContact O-N 2.74Å; A405-G408 PolarHBondContact O-N 3.19Å; A405-L409 PolarHBondContact O-N 2.93Å
406	P	97.6	Very high	96.3	Very high	25 Å²	25	46.4 Å²	46.4	16%	0.162	24%	0.243	C	C	.	.	H	α-helix	trans	-59.7	-40.8	171.5	-28.5	37.6	0	0	0	113.6	M325 L370 G401 V403 L409 V410	M325-P406 HydrophobicContact SD-CB 4.09Å; L370-P406 HydrophobicContact CD1-CG 4.37Å; G401-P406 WeakPolarHBondContact O-CD 3.28Å; V403-P406 WeakPolarHBondContact O-CD 3.47Å; P406-L409 PolarHBondContact O-N 3.34Å; P406-V410 PolarHBondContact O-N 3.47Å
407	I	96.9	Very high	96.4	Very high	1 Å²	1	46.1 Å²	46.1	1%	0.005	24%	0.243	C	C	.	.	H	α-helix	trans	-68.6	-35.6	177.2	-64.6	174.9	0	0	0	111.2	V403 L404 A405 V410 L411 V462 T465 F466	V403-I407 HydrophobicContact CG1-CD1 3.69Å; V403-I407 WeakPolarHBondContact O-CB 3.45Å; V403-I407 WeakPolarHBondContact O-CG1 3.32Å; V403-I407 PolarHBondContact O-N 2.97Å; V403-I407 VanDerWaalsContact O-N 3.11Å; L404-I407 PolarHBondContact O-N 3.12Å; A405-I407 PolarHBondContact O-N 2.74Å; I407-V410 WeakPolarHBondContact O-CG2 3.44Å; I407-L411 HydrophobicContact CG2-CD1 4.27Å; I407-L411 WeakPolarHBondContact O-CB 3.49Å; I407-L411 WeakPolarHBondContact O-CG 3.15Å; I407-L411 PolarHBondContact O-N 3.47Å; I407-L411 VanDerWaalsContact O-N 3.1Å; I407-V462 HydrophobicContact CG2-CG1 3.82Å; I407-T465 HydrophobicContact CD1-CG2 4.02Å; I407-F466 HydrophobicContact CB-CD2 4.41Å; I407-F466 HydrophobicContact CG2-CB 3.84Å; I407-F466 HydrophobicContact CG2-CD2 4.04Å; I407-F466 HydrophobicContact CG2-CG 4.45Å
408	G	97.5	Very high	96.4	Very high	13 Å²	13	38.6 Å²	38.6	13%	0.134	22%	0.215	C	C	.	.	H	α-helix	trans	-61.9	-44.2	170.9	0	0	0	0	0	112.2	L404 A405 L411 I412	L404-G408 PolarHBondContact O-N 3.04Å; A405-G408 PolarHBondContact O-N 3.19Å; G408-L411 PolarHBondContact O-N 3.42Å; G408-I412 WeakPolarHBondContact O-CG1 3.42Å; G408-I412 PolarHBondContact O-N 3.35Å
409	L	97.6	Very high	96.2	Very high	108 Å²	108	39.6 Å²	39.6	57%	0.565	23%	0.225	S	C	*	.	H	α-helix	trans	-63.7	-46.2	178.6	-178.9	62.5	0	0	0	112.3	A405 P406 L411 I412 V413	A405-L409 PolarHBondContact O-N 2.93Å; P406-L409 PolarHBondContact O-N 3.34Å; L409-L411 VanDerWaalsContact C-N 3.29Å; L409-L411 PolarHBondContact O-N 3.06Å; L409-I412 PolarHBondContact O-N 3.29Å; L409-V413 HydrophobicContact CD1-CG2 4.05Å; L409-V413 HydrophobicContact CG-CG2 4.49Å; L409-V413 WeakPolarHBondContact O-CG2 3.46Å; L409-V413 PolarHBondContact O-N 3.12Å
410	V	96.4	Very high	96.1	Very high	14 Å²	14	43.8 Å²	43.8	9%	0.085	24%	0.24	C	C	.	.	H	α-helix	trans	-67.6	-28.5	178.5	-60.1	0	0	0	0	112.7	V328 V332 P406 I407 G414 V462	V328-V410 HydrophobicContact CB-CG2 3.91Å; V328-V410 HydrophobicContact CG2-CG1 4.37Å; V328-V410 HydrophobicContact CG2-CG2 4.24Å; V332-V410 HydrophobicContact CG2-CB 3.5Å; V332-V410 HydrophobicContact CG2-CG1 3.66Å; P406-V410 PolarHBondContact O-N 3.47Å; I407-V410 WeakPolarHBondContact O-CG2 3.44Å; V410-G414 WeakPolarHBondContact O-CA 3.07Å; V410-G414 PolarHBondContact O-N 2.94Å; V410-V462 HydrophobicContact CG2-CG1 4.37Å
411	L	97.4	Very high	95.8	Very high	15 Å²	15	42.9 Å²	42.9	8%	0.079	23%	0.233	C	C	.	.	H	α-helix	trans	-67.7	-45.4	170.3	-77.2	169.9	0	0	0	112	I407 G408 L409 G415 F459 V462 L463 F466	I407-L411 HydrophobicContact CG2-CD1 4.27Å; I407-L411 WeakPolarHBondContact O-CB 3.49Å; I407-L411 WeakPolarHBondContact O-CG 3.15Å; I407-L411 PolarHBondContact O-N 3.47Å; I407-L411 VanDerWaalsContact O-N 3.1Å; G408-L411 PolarHBondContact O-N 3.42Å; L409-L411 VanDerWaalsContact C-N 3.29Å; L409-L411 PolarHBondContact O-N 3.06Å; L411-G415 WeakPolarHBondContact O-CA 3.48Å; L411-G415 PolarHBondContact O-N 3.32Å; L411-F459 HydrophobicContact CB-CE2 4.43Å; L411-F459 HydrophobicContact CD2-CD2 3.8Å; L411-F459 HydrophobicContact CD2-CE2 3.6Å; L411-F459 HydrophobicContact CD2-CG 4.43Å; L411-F459 HydrophobicContact CD2-CZ 4.08Å; L411-F459 WeakPolarHBondContact O-CE2 3.4Å; L411-V462 HydrophobicContact CD1-CG1 4.34Å; L411-V462 HydrophobicContact CD2-CB 4.04Å; L411-V462 HydrophobicContact CD2-CG1 3.75Å; L411-V462 HydrophobicContact CG-CG1 3.85Å; L411-L463 HydrophobicContact CD1-CD1 4.18Å; L411-L463 HydrophobicContact CD2-CB 4.15Å; L411-F466 HydrophobicContact CD1-CB 3.53Å; L411-F466 HydrophobicContact CD1-CD1 4.37Å; L411-F466 HydrophobicContact CD1-CD2 4.11Å; L411-F466 HydrophobicContact CD1-CG 3.75Å
412	I	97.9	Very high	95.3	Very high	127 Å²	127	42.6 Å²	42.6	65%	0.651	22%	0.223	S	C	*	.	H	α-helix	trans	-62.1	-49.9	177.9	-66.9	164.1	0	0	0	110.6	G408 L409 Y416	G408-I412 WeakPolarHBondContact O-CG1 3.42Å; G408-I412 PolarHBondContact O-N 3.35Å; L409-I412 PolarHBondContact O-N 3.29Å; I412-Y416 WeakPolarHBondContact O-CB 3.27Å; I412-Y416 PolarHBondContact O-N 2.76Å
413	V	97.6	Very high	94.9	Very high	50 Å²	50	46.3 Å²	46.3	30%	0.303	24%	0.242	S	C	.	.	H	α-helix	trans	-70.8	-45	-176.9	178.6	0	0	0	0	111.8	V332 L409 Y416 F417	V332-V413 HydrophobicContact CG1-CB 4.42Å; V332-V413 HydrophobicContact CG1-CG1 3.68Å; L409-V413 HydrophobicContact CD1-CG2 4.05Å; L409-V413 HydrophobicContact CG-CG2 4.49Å; L409-V413 WeakPolarHBondContact O-CG2 3.46Å; L409-V413 PolarHBondContact O-N 3.12Å; V413-Y416 PolarHBondContact O-N 3.27Å; V413-F417 HydrophobicContact CG1-CD2 4.03Å; V413-F417 HydrophobicContact CG1-CE2 3.53Å; V413-F417 HydrophobicContact CG1-CZ 4.36Å; V413-F417 VanDerWaalsContact O-CD2 3.28Å; V413-F417 WeakPolarHBondContact O-CD2 3.39Å; V413-F417 PolarHBondContact O-N 3.42Å; V413-F417 VanDerWaalsContact O-N 3.15Å
414	G	95.8	Very high	94.3	Very high	0 Å²	0	47.8 Å²	47.8	0%	0	25%	0.251	C	S	.	.	H	α-helix	trans	-66.4	-40.3	177.3	0	0	0	0	0	112.5	V410 F417 L418	V410-G414 WeakPolarHBondContact O-CA 3.07Å; V410-G414 PolarHBondContact O-N 2.94Å; G414-F417 PolarHBondContact O-N 2.85Å; G414-L418 WeakPolarHBondContact O-CB 3.08Å; G414-L418 WeakPolarHBondContact O-CG 3.46Å; G414-L418 PolarHBondContact O-N 2.96Å
415	G	95.9	Very high	93.5	Very high	10 Å²	10	49.1 Å²	49.1	10%	0.103	26%	0.258	C	S	.	.	H	α-helix	trans	-60.8	-43.6	173.6	0	0	0	0	0	112.4	L411 F417 L418 I419	L411-G415 WeakPolarHBondContact O-CA 3.48Å; L411-G415 PolarHBondContact O-N 3.32Å; G415-F417 PolarHBondContact O-N 3.48Å; G415-L418 PolarHBondContact O-N 2.84Å; G415-I419 VanDerWaalsContact O-CG1 3.29Å; G415-I419 WeakPolarHBondContact O-CG1 3.45Å; G415-I419 PolarHBondContact O-N 3.07Å
416	Y	96.9	Very high	92.7	Very high	123 Å²	123	52.6 Å²	52.6	48%	0.482	26%	0.262	S	S	.	.	H	α-helix	trans	-56.9	-49.3	173.1	168.8	-102.7	0	0	0	112.1	I412 V413 L418 I419 R420	I412-Y416 WeakPolarHBondContact O-CB 3.27Å; I412-Y416 PolarHBondContact O-N 2.76Å; V413-Y416 PolarHBondContact O-N 3.27Å; Y416-L418 PolarHBondContact O-N 2.87Å; Y416-I419 PolarHBondContact O-N 3.41Å; Y416-R420 HydrophobicContact CD2-CG 4.02Å; Y416-R420 HydrophobicContact CE1-CG 4.24Å; Y416-R420 HydrophobicContact CE2-CG 3.62Å; Y416-R420 HydrophobicContact CG-CG 4.48Å; Y416-R420 WeakPolarHBondContact O-CB 3.33Å; Y416-R420 WeakPolarHBondContact O-CG 3.47Å; Y416-R420 PolarHBondContact O-N 3.34Å
417	F	94.8	Very high	92	Very high	38 Å²	38	54 Å²	54	17%	0.167	27%	0.273	C	S	.	.	H	α-helix	trans	-65.8	-36.2	177.9	-67.5	-49.1	0	0	0	113	V332 Y336 H339 V413 G414 G415 R420 G421	V332-F417 HydrophobicContact CG1-CD2 4.41Å; V332-F417 HydrophobicContact CG1-CE2 4.26Å; Y336-F417 HydrophobicContact CD2-CD1 4.3Å; Y336-F417 AromaticContact CD2-CE1 3.8Å; Y336-F417 HydrophobicContact CD2-CE1 3.8Å; Y336-F417 HydrophobicContact CD2-CE2 4.09Å; Y336-F417 AromaticContact CD2-CZ 3.69Å; Y336-F417 HydrophobicContact CD2-CZ 3.69Å; H339-F417 HydrophobicContact CB-CB 4.38Å; V413-F417 HydrophobicContact CG1-CD2 4.03Å; V413-F417 HydrophobicContact CG1-CE2 3.53Å; V413-F417 HydrophobicContact CG1-CZ 4.36Å; V413-F417 VanDerWaalsContact O-CD2 3.28Å; V413-F417 WeakPolarHBondContact O-CD2 3.39Å; V413-F417 PolarHBondContact O-N 3.42Å; V413-F417 VanDerWaalsContact O-N 3.15Å; G414-F417 PolarHBondContact O-N 2.85Å; G415-F417 PolarHBondContact O-N 3.48Å; F417-R420 PolarHBondContact O-N 2.92Å; F417-G421 PolarHBondContact O-N 2.94Å
418	L	93.1	Very high	91	Very high	2 Å²	2	56.2 Å²	56.2	1%	0.01	28%	0.284	C	S	.	.	H	α-helix	trans	-63.6	-47	174.7	-75.1	171.1	0	0	0	111.9	F331 T335 W338 G414 G415 Y416 G421 V422 F456 F459	F331-L418 HydrophobicContact CZ-CD1 4.38Å; T335-L418 HydrophobicContact CG2-CD1 4.05Å; T335-L418 HydrophobicContact CG2-CD2 3.96Å; T335-L418 HydrophobicContact CG2-CG 3.74Å; W338-L418 HydrophobicContact CE3-CD2 3.89Å; W338-L418 HydrophobicContact CZ3-CD2 3.81Å; W338-L418 WeakPolarHBondContact CZ3-O 3.28Å; G414-L418 WeakPolarHBondContact O-CB 3.08Å; G414-L418 WeakPolarHBondContact O-CG 3.46Å; G414-L418 PolarHBondContact O-N 2.96Å; G415-L418 PolarHBondContact O-N 2.84Å; Y416-L418 PolarHBondContact O-N 2.87Å; L418-G421 PolarHBondContact O-N 3.47Å; L418-V422 WeakPolarHBondContact O-CG2 3.32Å; L418-V422 PolarHBondContact O-N 3.37Å; L418-F456 HydrophobicContact CB-CE1 4.01Å; L418-F456 HydrophobicContact CB-CZ 3.94Å; L418-F456 HydrophobicContact CD1-CD1 4.32Å; L418-F456 HydrophobicContact CD1-CE1 4.32Å; L418-F456 HydrophobicContact CD2-CD2 4.43Å; L418-F456 HydrophobicContact CD2-CE2 4.23Å; L418-F456 HydrophobicContact CD2-CZ 4.28Å; L418-F459 HydrophobicContact CD1-CB 3.66Å; L418-F459 HydrophobicContact CD1-CD2 3.91Å; L418-F459 HydrophobicContact CD1-CG 3.89Å
419	I	93.1	Very high	89.9	Confident	106 Å²	106	63.3 Å²	63.3	54%	0.544	31%	0.311	S	S	.	.	H	α-helix	trans	-60.9	-48.2	176.6	-67	163.8	0	0	0	110.2	G415 Y416 G421 V422 M423	G415-I419 VanDerWaalsContact O-CG1 3.29Å; G415-I419 WeakPolarHBondContact O-CG1 3.45Å; G415-I419 PolarHBondContact O-N 3.07Å; Y416-I419 PolarHBondContact O-N 3.41Å; I419-G421 VanDerWaalsContact C-N 3.34Å; I419-G421 PolarHBondContact O-N 3.02Å; I419-V422 PolarHBondContact O-N 3.29Å; I419-M423 HydrophobicContact CG2-CG 4.43Å; I419-M423 HydrophobicContact CG2-SD 4.11Å; I419-M423 WeakPolarHBondContact O-CG 3.47Å; I419-M423 PolarHBondContact O-N 3.42Å
420	R	91.6	Very high	88.8	Confident	112 Å²	112	61.9 Å²	61.9	42%	0.423	31%	0.311	S	S	.	.	H	α-helix	trans	-63	-37.4	178.5	-66.9	-72.7	-72	177.7	-5.5	112.4	Y416 F417 T424	Y416-R420 HydrophobicContact CD2-CG 4.02Å; Y416-R420 HydrophobicContact CE1-CG 4.24Å; Y416-R420 HydrophobicContact CE2-CG 3.62Å; Y416-R420 HydrophobicContact CG-CG 4.48Å; Y416-R420 WeakPolarHBondContact O-CB 3.33Å; Y416-R420 WeakPolarHBondContact O-CG 3.47Å; Y416-R420 PolarHBondContact O-N 3.34Å; F417-R420 PolarHBondContact O-N 2.92Å; R420-T424 WeakPolarHBondContact O-CB 3.31Å; R420-T424 PolarHBondContact O-N 2.88Å; R420-T424 PolarHBondContact O-OG1 3.45Å
421	G	87.9	Confident	87.7	Confident	0 Å²	0	65.9 Å²	65.9	0%	0	33%	0.331	C	S	.	.	H	α-helix	trans	-61.5	-47.3	173.5	0	0	0	0	0	112.4	H339 F417 L418 I419 T424 L425	H339-G421 PolarHBondContact ND1-N 3.36Å; F417-G421 PolarHBondContact O-N 2.94Å; L418-G421 PolarHBondContact O-N 3.47Å; I419-G421 VanDerWaalsContact C-N 3.34Å; I419-G421 PolarHBondContact O-N 3.02Å; G421-T424 PolarHBondContact O-N 3.17Å; G421-L425 PolarHBondContact O-N 3.03Å
422	V	86.2	Confident	86.2	Confident	37 Å²	37	70.3 Å²	70.3	22%	0.224	35%	0.352	C	S	.	.	H	α-helix	trans	-62.8	-46	175.8	170.6	0	0	0	0	112.3	W338 L418 I419 T424 L425 F426 F456	W338-V422 HydrophobicContact CH2-CG2 3.78Å; W338-V422 HydrophobicContact CZ3-CG2 4.38Å; L418-V422 WeakPolarHBondContact O-CG2 3.32Å; L418-V422 PolarHBondContact O-N 3.37Å; I419-V422 PolarHBondContact O-N 3.29Å; V422-T424 VanDerWaalsContact C-N 3.28Å; V422-T424 PolarHBondContact O-N 2.96Å; V422-L425 PolarHBondContact O-N 3.5Å; V422-F426 HydrophobicContact CG1-CD2 3.54Å; V422-F426 HydrophobicContact CG1-CE2 3.32Å; V422-F426 HydrophobicContact CG1-CZ 4.46Å; V422-F426 VanDerWaalsContact O-CD2 3.3Å; V422-F426 WeakPolarHBondContact O-CD2 3.43Å; V422-F426 PolarHBondContact O-N 3.05Å; V422-F456 HydrophobicContact CG2-CE2 3.55Å; V422-F456 HydrophobicContact CG2-CZ 3.45Å; V422-F456 VanDerWaalsContact CG2-CZ 3.45Å
423	M	87.8	Confident	84.3	Confident	115 Å²	115	70 Å²	70	57%	0.567	36%	0.358	S	S	*	.	H	α-helix	trans	-60	-40.2	176.8	-67.7	-178.9	89.4	0	0	111.8	I419 F426 S427	I419-M423 HydrophobicContact CG2-CG 4.43Å; I419-M423 HydrophobicContact CG2-SD 4.11Å; I419-M423 WeakPolarHBondContact O-CG 3.47Å; I419-M423 PolarHBondContact O-N 3.42Å; M423-F426 PolarHBondContact O-N 2.95Å; M423-S427 WeakPolarHBondContact O-CB 3.5Å; M423-S427 PolarHBondContact O-N 2.91Å
424	T	84.5	Confident	82.3	Confident	31 Å²	31	71.3 Å²	71.3	19%	0.19	38%	0.381	C	S	.	.	H	α-helix	trans	-64.8	-45.5	176.8	-52.8	0	0	0	0	111.1	F342 R420 G421 V422 F426 S427 I428	F342-T424 HydrophobicContact CB-CG2 4.05Å; R420-T424 WeakPolarHBondContact O-CB 3.31Å; R420-T424 PolarHBondContact O-N 2.88Å; R420-T424 PolarHBondContact O-OG1 3.45Å; G421-T424 PolarHBondContact O-N 3.17Å; V422-T424 VanDerWaalsContact C-N 3.28Å; V422-T424 PolarHBondContact O-N 2.96Å; T424-F426 PolarHBondContact O-N 3.19Å; T424-S427 PolarHBondContact O-N 3.13Å; T424-I428 HydrophobicContact CG2-CD1 3.92Å; T424-I428 WeakPolarHBondContact O-CG1 3.45Å; T424-I428 PolarHBondContact O-N 3.22Å
425	L	79.3	Confident	80.3	Confident	45 Å²	45	77.7 Å²	77.7	24%	0.236	41%	0.414	C	S	.	.	H	α-helix	trans	-58.5	-45.4	175.7	169.8	61.4	0	0	0	112.2	F342 G421 V422 K429	F342-L425 HydrophobicContact CD1-CB 4.37Å; F342-L425 HydrophobicContact CD1-CD1 4.43Å; F342-L425 HydrophobicContact CE1-CB 4.18Å; F342-L425 HydrophobicContact CE1-CD1 3.66Å; F342-L425 HydrophobicContact CE1-CG 4.34Å; F342-L425 HydrophobicContact CE2-CB 4.37Å; F342-L425 HydrophobicContact CZ-CB 4.16Å; F342-L425 HydrophobicContact CZ-CD1 3.92Å; F342-L425 HydrophobicContact CZ-CD2 4.04Å; F342-L425 HydrophobicContact CZ-CG 4.25Å; G421-L425 PolarHBondContact O-N 3.03Å; V422-L425 PolarHBondContact O-N 3.5Å; L425-K429 WeakPolarHBondContact O-CB 3.49Å; L425-K429 PolarHBondContact O-N 3.08Å; L425-K429 VanDerWaalsContact O-N 3.1Å
426	F	81.1	Confident	78.4	Confident	132 Å²	132	81 Å²	81	58%	0.579	43%	0.429	S	S	*	.	H	α-helix	trans	-64.3	-43.3	176.4	-77.6	-57.8	0	0	0	112.2	V422 M423 T424 I428 K429 S430	V422-F426 HydrophobicContact CG1-CD2 3.54Å; V422-F426 HydrophobicContact CG1-CE2 3.32Å; V422-F426 HydrophobicContact CG1-CZ 4.46Å; V422-F426 VanDerWaalsContact O-CD2 3.3Å; V422-F426 WeakPolarHBondContact O-CD2 3.43Å; V422-F426 PolarHBondContact O-N 3.05Å; M423-F426 PolarHBondContact O-N 2.95Å; T424-F426 PolarHBondContact O-N 3.19Å; F426-I428 PolarHBondContact O-N 3.25Å; F426-K429 PolarHBondContact O-N 3.38Å; F426-S430 PolarHBondContact O-N 3.49Å; F426-S430 PolarHBondContact O-OG 3.47Å
427	S	82.8	Confident	76.5	Confident	56 Å²	56	79.3 Å²	79.3	39%	0.392	44%	0.436	S	S	.	.	H	α-helix	trans	-63.6	-38.9	178.1	-174.5	0	0	0	0	113.1	M423 T424 S430 N431	M423-S427 WeakPolarHBondContact O-CB 3.5Å; M423-S427 PolarHBondContact O-N 2.91Å; T424-S427 PolarHBondContact O-N 3.13Å; S427-S430 WeakPolarHBondContact CA-OG 3.33Å; S427-S430 PolarHBondContact O-N 3.43Å; S427-S430 PolarHBondContact O-OG 3.11Å; S427-N431 VanDerWaalsContact O-CB 3.23Å; S427-N431 WeakPolarHBondContact O-CB 3.48Å; S427-N431 PolarHBondContact O-N 2.93Å; S427-N431 PolarHBondContact O-ND2 3.23Å; S427-N431 PolarHBondContact O-OD1 2.85Å; S427-N431 PolarHBondContact OG-ND2 2.91Å
428	I	75.1	Confident	74.8	Confident	46 Å²	46	86 Å²	86	24%	0.236	47%	0.467	C	S	.	.	H	α-helix	trans	-65.8	-42.8	175.9	-68.7	167.3	0	0	0	109.9	F342 L345 T424 F426 S430 N431 H432	F342-I428 WeakPolarHBondContact O-CD1 3.39Å; L345-I428 HydrophobicContact CB-CD1 4.37Å; T424-I428 HydrophobicContact CG2-CD1 3.92Å; T424-I428 WeakPolarHBondContact O-CG1 3.45Å; T424-I428 PolarHBondContact O-N 3.22Å; F426-I428 PolarHBondContact O-N 3.25Å; I428-S430 PolarHBondContact O-N 2.69Å; I428-N431 PolarHBondContact O-N 2.78Å; I428-H432 PolarHBondContact O-N 3.48Å; I428-H432 VanDerWaalsContact O-N 3.13Å
429	K	74.3	Confident	72.9	Confident	162 Å²	162	94.5 Å²	94.5	70%	0.704	50%	0.504	S	S	*	.	H	α-helix	trans	-64.6	-36.2	178.6	-174.8	179	176.7	-176.2	0	112.9	L425 F426	L425-K429 WeakPolarHBondContact O-CB 3.49Å; L425-K429 PolarHBondContact O-N 3.08Å; L425-K429 VanDerWaalsContact O-N 3.1Å; F426-K429 PolarHBondContact O-N 3.38Å
430	S	76.2	Confident	71	Confident	79 Å²	79	91.3 Å²	91.3	55%	0.552	49%	0.494	S	S	*	.	H	α-helix	trans	-76.4	-40.1	177.1	58.5	0	0	0	0	112.9	F426 S427 I428	F426-S430 PolarHBondContact O-N 3.49Å; F426-S430 PolarHBondContact O-OG 3.47Å; S427-S430 WeakPolarHBondContact CA-OG 3.33Å; S427-S430 PolarHBondContact O-N 3.43Å; S427-S430 PolarHBondContact O-OG 3.11Å; I428-S430 PolarHBondContact O-N 2.69Å
431	N	71.7	Confident	69.3	Low	97 Å²	97	86.8 Å²	86.8	52%	0.519	48%	0.48	S	S	.	.	H	α-helix	trans	-92.6	-22.4	-165.3	-59.6	-2.1	0	0	0	113.7	S427 I428 P433	S427-N431 VanDerWaalsContact O-CB 3.23Å; S427-N431 WeakPolarHBondContact O-CB 3.48Å; S427-N431 PolarHBondContact O-N 2.93Å; S427-N431 PolarHBondContact O-ND2 3.23Å; S427-N431 PolarHBondContact O-OD1 2.85Å; S427-N431 PolarHBondContact OG-ND2 2.91Å; I428-N431 PolarHBondContact O-N 2.78Å; N431-P433 VanDerWaalsContact C-CD 3.42Å
432	H	65.7	Low	68	Low	109 Å²	109	90 Å²	90	51%	0.505	50%	0.502	S	S	.	.			trans	-128	56.3	-176.8	-60.3	-57.3	0	0	0	114.3	I428 G434 L435	I428-H432 PolarHBondContact O-N 3.48Å; I428-H432 VanDerWaalsContact O-N 3.13Å; H432-G434 PolarHBondContact O-N 3.23Å; H432-G434 VanDerWaalsContact O-N 3.08Å; H432-L435 HydrophobicContact CB-CB 4.38Å
433	P	58.7	Low	66.7	Low	121 Å²	121	92.6 Å²	92.6	79%	0.786	51%	0.511	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.9	-13	-177	26.8	-35.4	0	0	0	115.2	N431	N431-P433 VanDerWaalsContact C-CD 3.42Å
434	G	56.4	Low	65.4	Low	76 Å²	76	88.7 Å²	88.7	78%	0.784	49%	0.492	S	S	*	.	T	Hydrogen-bonded Turn	trans	-114.7	-2.5	-174.4	0	0	0	0	0	117.2	H432	H432-G434 PolarHBondContact O-N 3.23Å; H432-G434 VanDerWaalsContact O-N 3.08Å
435	L	53.3	Low	64.4	Low	134 Å²	134	90.8 Å²	90.8	70%	0.702	50%	0.502	S	S	*	.	S	Bend	trans	-91.3	-14.1	-166.2	-121.6	163.1	0	0	0	114.9	H432	H432-L435 HydrophobicContact CB-CB 4.38Å
436	L	56.3	Low	64	Low	80 Å²	80	95.2 Å²	95.2	42%	0.419	52%	0.521	S	S	.	.	S	Bend	trans	-111.1	122	179	-61.4	172.3	0	0	0	109.8	E438 A441	L436-E438 PolarHBondContact O-N 2.98Å; L436-A441 HydrophobicContact CB-CB 3.48Å; L436-A441 VanDerWaalsContact CB-CB 3.48Å; L436-A441 HydrophobicContact CD1-CB 4.22Å; L436-A441 HydrophobicContact CG-CB 4.5Å
437	S	56.1	Low	63.4	Low	88 Å²	88	89.9 Å²	89.9	62%	0.615	50%	0.5	S	S	*	.			trans	-51.3	126.6	170.7	177.2	0	0	0	0	109.4	K439 A440 A441	S437-K439 PolarHBondContact O-N 3.36Å; S437-A440 WeakPolarHBondContact O-CA 3.04Å; S437-A440 PolarHBondContact O-N 3.48Å; S437-A441 WeakPolarHBondContact O-CB 3.44Å; S437-A441 PolarHBondContact O-N 3.45Å
438	E	58.8	Low	62.7	Low	177 Å²	177	87.4 Å²	87.4	83%	0.827	48%	0.482	S	S	*	.	H	α-helix	trans	-46.9	-32	-171.6	-160.5	177.9	-147.5	0	0	113.7	L436 S442	L436-E438 PolarHBondContact O-N 2.98Å; E438-S442 WeakPolarHBondContact O-CB 3.32Å; E438-S442 PolarHBondContact O-N 3.29Å; E438-S442 PolarHBondContact O-OG 3.06Å
439	K	54.4	Low	62.6	Low	182 Å²	182	90.2 Å²	90.2	79%	0.791	50%	0.497	S	S	*	.	H	α-helix	trans	-88.2	-18.6	-179	-153.6	156.8	-164.5	147.5	0	115.6	S437	S437-K439 PolarHBondContact O-N 3.36Å
440	A	52.8	Low	62.9	Low	39 Å²	39	85 Å²	85	32%	0.322	47%	0.473	S	S	.	.	H	α-helix	trans	-92.8	-41.1	169.8	0	0	0	0	0	110.7	S437 S442 K443 I444	S437-A440 WeakPolarHBondContact O-CA 3.04Å; S437-A440 PolarHBondContact O-N 3.48Å; A440-S442 PolarHBondContact O-N 3.32Å; A440-K443 PolarHBondContact O-N 3.46Å; A440-I444 WeakPolarHBondContact O-CG1 3.23Å; A440-I444 PolarHBondContact O-N 2.98Å
441	A	55.4	Low	62.9	Low	16 Å²	16	81.5 Å²	81.5	13%	0.132	45%	0.448	C	S	.	.	H	α-helix	trans	-52.5	-53.5	174	0	0	0	0	0	111.7	L436 S437 K443 I444 N445	L436-A441 HydrophobicContact CB-CB 3.48Å; L436-A441 VanDerWaalsContact CB-CB 3.48Å; L436-A441 HydrophobicContact CD1-CB 4.22Å; L436-A441 HydrophobicContact CG-CB 4.5Å; S437-A441 WeakPolarHBondContact O-CB 3.44Å; S437-A441 PolarHBondContact O-N 3.45Å; A441-K443 VanDerWaalsContact C-N 3.29Å; A441-K443 PolarHBondContact O-N 3.4Å; A441-I444 PolarHBondContact O-N 3.42Å; A441-N445 VanDerWaalsContact O-CB 3.24Å; A441-N445 WeakPolarHBondContact O-CB 3.19Å; A441-N445 PolarHBondContact O-N 3.39Å; A441-N445 PolarHBondContact O-ND2 3.49Å
442	S	61.4	Low	63.3	Low	67 Å²	67	77 Å²	77	47%	0.469	43%	0.425	S	S	.	.	H	α-helix	trans	-56.7	-40.3	179.3	42.3	0	0	0	0	112.9	E438 A440 E446	E438-S442 WeakPolarHBondContact O-CB 3.32Å; E438-S442 PolarHBondContact O-N 3.29Å; E438-S442 PolarHBondContact O-OG 3.06Å; A440-S442 PolarHBondContact O-N 3.32Å; S442-E446 WeakPolarHBondContact O-CB 3.26Å; S442-E446 PolarHBondContact O-N 3.45Å
443	K	59	Low	64.3	Low	92 Å²	92	76.4 Å²	76.4	40%	0.4	42%	0.424	S	S	.	.	H	α-helix	trans	-77.5	-35.8	-176.4	-161.8	175.3	-175.1	175.1	0	113.7	A440 A441 T447 D596	A440-K443 PolarHBondContact O-N 3.46Å; A441-K443 VanDerWaalsContact C-N 3.29Å; A441-K443 PolarHBondContact O-N 3.4Å; K443-T447 PolarHBondContact O-N 2.74Å; K443-D596 VanDerWaalsContact NZ-CG 3.31Å; K443-D596 IonicContact NZ-OD2 3.82Å; K443-D596 PolarHBondContact NZ-OD2 3.15Å
444	I	59.8	Low	65.5	Low	34 Å²	34	71.4 Å²	71.4	17%	0.174	39%	0.39	C	S	.	.	H	α-helix	trans	-70.9	-41.6	173.2	-66.2	167.4	0	0	0	109.9	L345 A440 A441 E446 T447 M448 F604	L345-I444 HydrophobicContact CD2-CG2 3.82Å; A440-I444 WeakPolarHBondContact O-CG1 3.23Å; A440-I444 PolarHBondContact O-N 2.98Å; A441-I444 PolarHBondContact O-N 3.42Å; I444-E446 VanDerWaalsContact C-N 3.32Å; I444-E446 PolarHBondContact O-N 3.16Å; I444-T447 PolarHBondContact O-N 3.3Å; I444-T447 PolarHBondContact O-OG1 3.31Å; I444-M448 HydrophobicContact CG2-SD 3.88Å; I444-M448 WeakPolarHBondContact O-CB 3.37Å; I444-M448 WeakPolarHBondContact O-CG 3.2Å; I444-M448 PolarHBondContact O-N 3.02Å; I444-M448 VanDerWaalsContact O-N 3.14Å; I444-F604 HydrophobicContact CD1-CE2 4.04Å; I444-F604 HydrophobicContact CG1-CE2 4.29Å
445	N	64.4	Low	66.9	Low	74 Å²	74	67.9 Å²	67.9	40%	0.396	35%	0.354	S	S	.	.	H	α-helix	trans	-61	-40.2	173.9	-71.7	-15.4	0	0	0	111.6	A441 L449	A441-N445 VanDerWaalsContact O-CB 3.24Å; A441-N445 WeakPolarHBondContact O-CB 3.19Å; A441-N445 PolarHBondContact O-N 3.39Å; A441-N445 PolarHBondContact O-ND2 3.49Å; N445-L449 WeakPolarHBondContact O-CB 3.42Å; N445-L449 PolarHBondContact O-N 2.84Å
446	E	71	Confident	68.7	Low	138 Å²	138	65.9 Å²	65.9	65%	0.645	34%	0.34	S	S	*	.	H	α-helix	trans	-60.4	-48	178.8	-170.6	-177	169.4	0	0	112.6	S442 I444 R450	S442-E446 WeakPolarHBondContact O-CB 3.26Å; S442-E446 PolarHBondContact O-N 3.45Å; I444-E446 VanDerWaalsContact C-N 3.32Å; I444-E446 PolarHBondContact O-N 3.16Å; E446-R450 VanDerWaalsContact O-CB 3.26Å; E446-R450 WeakPolarHBondContact O-CB 3.34Å; E446-R450 PolarHBondContact O-N 3.17Å; E446-R450 VanDerWaalsContact O-N 3.11Å
447	T	67	Low	70.4	Confident	20 Å²	20	65.6 Å²	65.6	12%	0.123	34%	0.338	C	S	.	.	H	α-helix	trans	-71.2	-36.8	-178.5	56.3	0	0	0	0	112.7	K443 I444 L451	K443-T447 PolarHBondContact O-N 2.74Å; I444-T447 PolarHBondContact O-N 3.3Å; I444-T447 PolarHBondContact O-OG1 3.31Å; T447-L451 PolarHBondContact O-N 3.03Å; T447-L451 VanDerWaalsContact O-N 3.07Å
448	M	68.6	Low	72.1	Confident	4 Å²	4	61.5 Å²	61.5	2%	0.02	31%	0.309	C	S	.	.	H	α-helix	trans	-80.5	-33.4	-179.2	-63.3	-173.4	74.7	0	0	113.5	W338 F342 L345 I444 R450 L451 G452 L602	W338-M448 PolarHBondContact NE1-O 2.98Å; F342-M448 HydrophobicContact CB-CE 4.34Å; F342-M448 HydrophobicContact CD1-CE 3.48Å; F342-M448 VanDerWaalsContact CD1-CE 3.48Å; F342-M448 HydrophobicContact CD1-SD 4.33Å; F342-M448 HydrophobicContact CD2-CE 4.02Å; F342-M448 HydrophobicContact CE1-CB 3.99Å; F342-M448 HydrophobicContact CE1-CE 3.57Å; F342-M448 HydrophobicContact CE1-SD 4.02Å; F342-M448 HydrophobicContact CE2-CB 4.4Å; F342-M448 HydrophobicContact CE2-CE 4.15Å; F342-M448 HydrophobicContact CG-CE 3.68Å; F342-M448 HydrophobicContact CZ-CB 3.66Å; F342-M448 HydrophobicContact CZ-CE 3.94Å; L345-M448 HydrophobicContact CD1-CE 4.1Å; L345-M448 HydrophobicContact CD1-SD 3.75Å; L345-M448 HydrophobicContact CD2-CE 4.37Å; L345-M448 HydrophobicContact CD2-SD 3.68Å; L345-M448 HydrophobicContact CG-CE 4.16Å; L345-M448 HydrophobicContact CG-SD 3.97Å; I444-M448 HydrophobicContact CG2-SD 3.88Å; I444-M448 WeakPolarHBondContact O-CB 3.37Å; I444-M448 WeakPolarHBondContact O-CG 3.2Å; I444-M448 PolarHBondContact O-N 3.02Å; I444-M448 VanDerWaalsContact O-N 3.14Å; M448-R450 VanDerWaalsContact C-N 3.32Å; M448-L451 PolarHBondContact O-N 2.99Å; M448-G452 PolarHBondContact O-N 2.79Å; M448-L602 HydrophobicContact CG-CD2 4.19Å
449	L	73.9	Confident	73.9	Confident	106 Å²	106	55.4 Å²	55.4	56%	0.555	28%	0.28	S	S	*	.	H	α-helix	trans	-60.4	-45.3	167.7	-175.1	86.2	0	0	0	109.9	N445 L451 G452 I453	N445-L449 WeakPolarHBondContact O-CB 3.42Å; N445-L449 PolarHBondContact O-N 2.84Å; L449-L451 PolarHBondContact O-N 2.86Å; L449-G452 WeakPolarHBondContact O-CA 3.38Å; L449-G452 PolarHBondContact O-N 3.05Å; L449-G452 VanDerWaalsContact O-N 3.11Å; L449-I453 HydrophobicContact CD2-CD1 4.21Å; L449-I453 HydrophobicContact CG-CD1 4.06Å; L449-I453 WeakPolarHBondContact O-CG1 3.16Å; L449-I453 PolarHBondContact O-N 3.31Å
450	R	80.4	Confident	75.9	Confident	53 Å²	53	48 Å²	48	20%	0.2	26%	0.256	C	S	.	.	H	α-helix	trans	-60.2	-44.3	177.5	-173.4	173.9	-170.7	-119.2	2.3	112.3	E446 M448 G452 I453 F454 T533 W534	E446-R450 VanDerWaalsContact O-CB 3.26Å; E446-R450 WeakPolarHBondContact O-CB 3.34Å; E446-R450 PolarHBondContact O-N 3.17Å; E446-R450 VanDerWaalsContact O-N 3.11Å; M448-R450 VanDerWaalsContact C-N 3.32Å; R450-G452 VanDerWaalsContact C-N 3.27Å; R450-G452 PolarHBondContact O-N 2.96Å; R450-I453 PolarHBondContact O-N 3.35Å; R450-F454 HydrophobicContact CG-CD2 4.08Å; R450-F454 HydrophobicContact CG-CE2 3.66Å; R450-F454 WeakPolarHBondContact O-CD2 3.37Å; R450-F454 PolarHBondContact O-N 3.38Å; R450-F454 VanDerWaalsContact O-N 3.12Å; R450-T533 PolarHBondContact NH2-O 3.18Å; R450-W534 HydrophobicContact CG-CE3 4.45Å; R450-W534 HydrophobicContact CG-CZ3 4.05Å; R450-W534 VanDerWaalsContact CZ-O 3.24Å; R450-W534 PolarHBondContact NH1-O 3Å; R450-W534 PolarHBondContact NH2-O 3.29Å
451	L	75.6	Confident	78	Confident	5 Å²	5	47.6 Å²	47.6	3%	0.026	25%	0.247	C	C	.	.	H	α-helix	trans	-62.7	-35	174.9	-171.1	57.5	0	0	0	112	P262 L266 L334 W338 T447 M448 L449 F454 G455 W534	P262-L451 HydrophobicContact CG-CD2 4.32Å; L266-L451 HydrophobicContact CD1-CD1 4.25Å; L334-L451 HydrophobicContact CD1-CD1 3.85Å; W338-L451 HydrophobicContact CB-CD2 4.35Å; W338-L451 HydrophobicContact CB-CG 4.37Å; W338-L451 HydrophobicContact CG-CD2 4.47Å; W338-L451 HydrophobicContact CG-CG 4.25Å; T447-L451 PolarHBondContact O-N 3.03Å; T447-L451 VanDerWaalsContact O-N 3.07Å; M448-L451 PolarHBondContact O-N 2.99Å; L449-L451 PolarHBondContact O-N 2.86Å; L451-F454 PolarHBondContact O-N 3.17Å; L451-G455 PolarHBondContact O-N 2.83Å; L451-W534 HydrophobicContact CB-CZ3 4.36Å; L451-W534 HydrophobicContact CD1-CZ3 4.32Å
452	G	80.6	Confident	79.9	Confident	3 Å²	3	47.3 Å²	47.3	3%	0.031	24%	0.243	C	C	.	.	H	α-helix	trans	-68.1	-44.9	174.5	0	0	0	0	0	113.5	W338 M448 L449 R450 F454 G455 F456	W338-G452 VanDerWaalsContact NE1-CA 3.29Å; W338-G452 VanDerWaalsContact NE1-N 3.11Å; M448-G452 PolarHBondContact O-N 2.79Å; L449-G452 WeakPolarHBondContact O-CA 3.38Å; L449-G452 PolarHBondContact O-N 3.05Å; L449-G452 VanDerWaalsContact O-N 3.11Å; R450-G452 VanDerWaalsContact C-N 3.27Å; R450-G452 PolarHBondContact O-N 2.96Å; G452-F454 PolarHBondContact O-N 3.26Å; G452-G455 WeakPolarHBondContact O-CA 3.28Å; G452-G455 PolarHBondContact O-N 3.37Å; G452-F456 VanDerWaalsContact O-CD2 3.26Å; G452-F456 WeakPolarHBondContact O-CD2 3.33Å; G452-F456 PolarHBondContact O-N 3.4Å
453	I	85.8	Confident	81.6	Confident	96 Å²	96	47.7 Å²	47.7	49%	0.492	24%	0.24	S	C	.	.	H	α-helix	trans	-56.4	-42.6	174.6	-68.3	162.9	0	0	0	110.2	L449 R450 F456 L457	L449-I453 HydrophobicContact CD2-CD1 4.21Å; L449-I453 HydrophobicContact CG-CD1 4.06Å; L449-I453 WeakPolarHBondContact O-CG1 3.16Å; L449-I453 PolarHBondContact O-N 3.31Å; R450-I453 PolarHBondContact O-N 3.35Å; I453-F456 PolarHBondContact O-N 2.92Å; I453-L457 WeakPolarHBondContact O-CB 3.44Å; I453-L457 PolarHBondContact O-N 3.04Å
454	F	84.1	Confident	83.4	Confident	15 Å²	15	46.4 Å²	46.4	7%	0.066	24%	0.237	C	C	.	.	H	α-helix	trans	-65.9	-40.9	174.2	-73.4	-55.9	0	0	0	113.2	R450 L451 G452 L457 A458 A530 M531 T533 W534	R450-F454 HydrophobicContact CG-CD2 4.08Å; R450-F454 HydrophobicContact CG-CE2 3.66Å; R450-F454 WeakPolarHBondContact O-CD2 3.37Å; R450-F454 PolarHBondContact O-N 3.38Å; R450-F454 VanDerWaalsContact O-N 3.12Å; L451-F454 PolarHBondContact O-N 3.17Å; G452-F454 PolarHBondContact O-N 3.26Å; F454-L457 PolarHBondContact O-N 3.49Å; F454-A458 VanDerWaalsContact O-CB 3.31Å; F454-A458 WeakPolarHBondContact O-CB 3.02Å; F454-A458 PolarHBondContact O-N 2.9Å; F454-A530 VanDerWaalsContact CE1-O 3.25Å; F454-A530 WeakPolarHBondContact CE1-O 3.31Å; F454-M531 HydrophobicContact CB-CE 3.93Å; F454-M531 HydrophobicContact CB-SD 4.45Å; F454-M531 HydrophobicContact CD1-CE 3.79Å; F454-M531 HydrophobicContact CG-CE 4.27Å; F454-M531 WeakPolarHBondContact O-CE 3.45Å; F454-T533 WeakPolarHBondContact CE1-OG1 3.41Å; F454-T533 VanDerWaalsContact CZ-OG1 3.22Å; F454-T533 WeakPolarHBondContact CZ-OG1 3.43Å; F454-W534 AromaticContact CD2-CE3 3.67Å; F454-W534 HydrophobicContact CD2-CE3 3.67Å; F454-W534 HydrophobicContact CD2-CZ3 4.16Å; F454-W534 AromaticContact CE2-CE3 3.66Å; F454-W534 HydrophobicContact CE2-CE3 3.66Å; F454-W534 HydrophobicContact CE2-CZ3 4.34Å
455	G	86.8	Confident	85.1	Confident	2 Å²	2	45.2 Å²	45.2	2%	0.021	23%	0.231	C	C	.	.	H	α-helix	trans	-57.8	-47.3	173.1	0	0	0	0	0	113	L451 G452 F459	L451-G455 PolarHBondContact O-N 2.83Å; G452-G455 WeakPolarHBondContact O-CA 3.28Å; G452-G455 PolarHBondContact O-N 3.37Å; G455-F459 WeakPolarHBondContact O-CB 3.14Å; G455-F459 PolarHBondContact O-N 3.47Å
456	F	91.1	Very high	86.6	Confident	93 Å²	93	44.3 Å²	44.3	41%	0.408	22%	0.223	S	C	.	.	H	α-helix	trans	-69	-37.8	177.3	-78.9	-69.5	0	0	0	113.4	W338 L418 V422 G452 I453 F459 G460	W338-F456 AromaticContact CH2-CE2 3.94Å; W338-F456 HydrophobicContact CH2-CE2 3.94Å; W338-F456 HydrophobicContact CZ3-CE2 4.43Å; L418-F456 HydrophobicContact CB-CE1 4.01Å; L418-F456 HydrophobicContact CB-CZ 3.94Å; L418-F456 HydrophobicContact CD1-CD1 4.32Å; L418-F456 HydrophobicContact CD1-CE1 4.32Å; L418-F456 HydrophobicContact CD2-CD2 4.43Å; L418-F456 HydrophobicContact CD2-CE2 4.23Å; L418-F456 HydrophobicContact CD2-CZ 4.28Å; V422-F456 HydrophobicContact CG2-CE2 3.55Å; V422-F456 HydrophobicContact CG2-CZ 3.45Å; V422-F456 VanDerWaalsContact CG2-CZ 3.45Å; G452-F456 VanDerWaalsContact O-CD2 3.26Å; G452-F456 WeakPolarHBondContact O-CD2 3.33Å; G452-F456 PolarHBondContact O-N 3.4Å; I453-F456 PolarHBondContact O-N 2.92Å; F456-F459 PolarHBondContact O-N 3.29Å; F456-G460 PolarHBondContact O-N 2.73Å
457	L	92.4	Very high	87.9	Confident	73 Å²	73	40.8 Å²	40.8	38%	0.382	21%	0.214	S	C	.	.	H	α-helix	trans	-67.1	-43	177.4	-176.7	58.3	0	0	0	111.5	I453 F454 G460 F461 A530	I453-L457 WeakPolarHBondContact O-CB 3.44Å; I453-L457 PolarHBondContact O-N 3.04Å; F454-L457 PolarHBondContact O-N 3.49Å; L457-G460 PolarHBondContact O-N 2.68Å; L457-F461 HydrophobicContact CD1-CD2 4.22Å; L457-F461 HydrophobicContact CD1-CE2 3.64Å; L457-F461 HydrophobicContact CD1-CZ 4.23Å; L457-F461 HydrophobicContact CG-CD2 4.21Å; L457-F461 HydrophobicContact CG-CE2 3.8Å; L457-F461 WeakPolarHBondContact O-CD2 3.34Å; L457-F461 PolarHBondContact O-N 3.34Å; L457-F461 VanDerWaalsContact O-N 3.14Å; L457-A530 HydrophobicContact CD2-CB 3.68Å; L457-A530 HydrophobicContact CG-CB 4.1Å
458	A	91.6	Very high	89.3	Confident	2 Å²	2	40.3 Å²	40.3	2%	0.017	21%	0.211	C	C	.	.	H	α-helix	trans	-62.4	-44.9	172.6	0	0	0	0	0	111.7	F331 F454 G460 F461 V462 T527 M531	F331-A458 HydrophobicContact CD2-CB 3.58Å; F331-A458 HydrophobicContact CE2-CB 3.68Å; F454-A458 VanDerWaalsContact O-CB 3.31Å; F454-A458 WeakPolarHBondContact O-CB 3.02Å; F454-A458 PolarHBondContact O-N 2.9Å; A458-G460 VanDerWaalsContact C-N 3.31Å; A458-G460 PolarHBondContact O-N 3.43Å; A458-F461 PolarHBondContact O-N 3.25Å; A458-V462 VanDerWaalsContact O-CG2 3.32Å; A458-V462 WeakPolarHBondContact O-CG2 3.34Å; A458-V462 PolarHBondContact O-N 2.83Å; A458-T527 HydrophobicContact CB-CG2 4.44Å; A458-M531 HydrophobicContact CB-CE 3.85Å; A458-M531 HydrophobicContact CB-SD 4.27Å
459	F	95.3	Very high	90.5	Very high	50 Å²	50	40.6 Å²	40.6	22%	0.219	21%	0.213	C	C	.	.	H	α-helix	trans	-56.9	-44.2	175.2	-178.8	-91.3	0	0	0	112.1	F331 L411 L418 G455 F456 F461 V462 L463	F331-F459 HydrophobicContact CE2-CB 4.3Å; F331-F459 HydrophobicContact CZ-CB 3.87Å; F331-F459 HydrophobicContact CZ-CD2 4.09Å; L411-F459 HydrophobicContact CB-CE2 4.43Å; L411-F459 HydrophobicContact CD2-CD2 3.8Å; L411-F459 HydrophobicContact CD2-CE2 3.6Å; L411-F459 HydrophobicContact CD2-CG 4.43Å; L411-F459 HydrophobicContact CD2-CZ 4.08Å; L411-F459 WeakPolarHBondContact O-CE2 3.4Å; L418-F459 HydrophobicContact CD1-CB 3.66Å; L418-F459 HydrophobicContact CD1-CD2 3.91Å; L418-F459 HydrophobicContact CD1-CG 3.89Å; G455-F459 WeakPolarHBondContact O-CB 3.14Å; G455-F459 PolarHBondContact O-N 3.47Å; F456-F459 PolarHBondContact O-N 3.29Å; F459-F461 PolarHBondContact O-N 3Å; F459-V462 PolarHBondContact O-N 3.2Å; F459-L463 HydrophobicContact CE1-CD2 4.32Å; F459-L463 VanDerWaalsContact O-CB 3.32Å; F459-L463 WeakPolarHBondContact O-CB 3.03Å; F459-L463 PolarHBondContact O-N 2.8Å
460	G	96.7	Very high	91.5	Very high	27 Å²	27	40.5 Å²	40.5	28%	0.278	21%	0.208	S	C	.	.	H	α-helix	trans	-60	-44.4	177.2	0	0	0	0	0	112.9	F456 L457 A458 L463 I464	F456-G460 PolarHBondContact O-N 2.73Å; L457-G460 PolarHBondContact O-N 2.68Å; A458-G460 VanDerWaalsContact C-N 3.31Å; A458-G460 PolarHBondContact O-N 3.43Å; G460-L463 PolarHBondContact O-N 3.01Å; G460-I464 WeakPolarHBondContact O-CG1 3.4Å; G460-I464 PolarHBondContact O-N 2.77Å; G460-I464 VanDerWaalsContact O-N 3.12Å
461	F	96.8	Very high	92.3	Very high	29 Å²	29	42 Å²	42	13%	0.127	21%	0.214	C	C	.	.	H	α-helix	trans	-67.2	-44.2	175.7	-72.7	-59	0	0	0	112.9	L457 A458 F459 L463 I464 T465 F522 A523 T527 A530	L457-F461 HydrophobicContact CD1-CD2 4.22Å; L457-F461 HydrophobicContact CD1-CE2 3.64Å; L457-F461 HydrophobicContact CD1-CZ 4.23Å; L457-F461 HydrophobicContact CG-CD2 4.21Å; L457-F461 HydrophobicContact CG-CE2 3.8Å; L457-F461 WeakPolarHBondContact O-CD2 3.34Å; L457-F461 PolarHBondContact O-N 3.34Å; L457-F461 VanDerWaalsContact O-N 3.14Å; A458-F461 PolarHBondContact O-N 3.25Å; F459-F461 PolarHBondContact O-N 3Å; F461-L463 PolarHBondContact O-N 2.76Å; F461-I464 HydrophobicContact CD1-CD1 4.47Å; F461-I464 WeakPolarHBondContact O-CB 3.21Å; F461-I464 PolarHBondContact O-N 3.38Å; F461-I464 VanDerWaalsContact O-N 3.08Å; F461-T465 PolarHBondContact O-N 3.31Å; F461-F522 HydrophobicContact CE1-CD1 4.47Å; F461-F522 AromaticContact CE1-CE1 3.87Å; F461-F522 HydrophobicContact CE1-CE1 3.87Å; F461-F522 HydrophobicContact CE1-CZ 4.27Å; F461-A523 HydrophobicContact CB-CB 4.38Å; F461-A523 HydrophobicContact CD1-CB 4.1Å; F461-T527 WeakPolarHBondContact CB-OG1 3.49Å; F461-A530 HydrophobicContact CE2-CB 3.95Å
462	V	94.8	Very high	93	Very high	10 Å²	10	42.3 Å²	42.3	6%	0.061	22%	0.216	C	C	.	.	H	α-helix	trans	-61.7	-34.2	177.2	178.3	0	0	0	0	111.1	I407 V410 L411 A458 F459 T465 F466	I407-V462 HydrophobicContact CG2-CG1 3.82Å; V410-V462 HydrophobicContact CG2-CG1 4.37Å; L411-V462 HydrophobicContact CD1-CG1 4.34Å; L411-V462 HydrophobicContact CD2-CB 4.04Å; L411-V462 HydrophobicContact CD2-CG1 3.75Å; L411-V462 HydrophobicContact CG-CG1 3.85Å; A458-V462 VanDerWaalsContact O-CG2 3.32Å; A458-V462 WeakPolarHBondContact O-CG2 3.34Å; A458-V462 PolarHBondContact O-N 2.83Å; F459-V462 PolarHBondContact O-N 3.2Å; V462-T465 PolarHBondContact O-N 3.08Å; V462-F466 WeakPolarHBondContact O-CB 3.38Å; V462-F466 PolarHBondContact O-N 3.31Å
463	L	97.4	Very high	93.6	Very high	76 Å²	76	46 Å²	46	40%	0.398	23%	0.231	S	C	.	.	H	α-helix	trans	-67.4	-37.3	174	-179.6	63	0	0	0	112.7	L411 F459 G460 F461 F466 S467	L411-L463 HydrophobicContact CD1-CD1 4.18Å; L411-L463 HydrophobicContact CD2-CB 4.15Å; F459-L463 HydrophobicContact CE1-CD2 4.32Å; F459-L463 VanDerWaalsContact O-CB 3.32Å; F459-L463 WeakPolarHBondContact O-CB 3.03Å; F459-L463 PolarHBondContact O-N 2.8Å; G460-L463 PolarHBondContact O-N 3.01Å; F461-L463 PolarHBondContact O-N 2.76Å; L463-F466 PolarHBondContact O-N 2.99Å; L463-S467 WeakPolarHBondContact O-CB 3.46Å; L463-S467 PolarHBondContact O-N 3.46Å; L463-S467 PolarHBondContact O-OG 2.91Å
464	I	97.7	Very high	94	Very high	65 Å²	65	48.8 Å²	48.8	33%	0.333	24%	0.24	S	C	.	.	H	α-helix	trans	-65.2	-48.3	173.9	-66.9	162.7	0	0	0	109.9	G460 F461 F466 S467 C468 I519 A523	G460-I464 WeakPolarHBondContact O-CG1 3.4Å; G460-I464 PolarHBondContact O-N 2.77Å; G460-I464 VanDerWaalsContact O-N 3.12Å; F461-I464 HydrophobicContact CD1-CD1 4.47Å; F461-I464 WeakPolarHBondContact O-CB 3.21Å; F461-I464 PolarHBondContact O-N 3.38Å; F461-I464 VanDerWaalsContact O-N 3.08Å; I464-F466 VanDerWaalsContact C-N 3.34Å; I464-F466 PolarHBondContact O-N 3.36Å; I464-S467 WeakPolarHBondContact O-CB 3.33Å; I464-S467 PolarHBondContact O-N 3.2Å; I464-C468 PolarHBondContact O-N 3.47Å; I464-C468 PolarHBondContact O-SG 3.09Å; I464-I519 HydrophobicContact CG2-CG2 3.55Å; I464-A523 HydrophobicContact CB-CB 3.92Å; I464-A523 HydrophobicContact CG2-CB 3.74Å
465	T	95.2	Very high	94.4	Very high	8 Å²	8	50.2 Å²	50.2	5%	0.049	25%	0.248	C	C	.	.	H	α-helix	trans	-57.2	-43.7	175.1	-72.2	0	0	0	0	112.3	I407 F461 V462 S467 C468 H469 N520 A523	I407-T465 HydrophobicContact CD1-CG2 4.02Å; F461-T465 PolarHBondContact O-N 3.31Å; V462-T465 PolarHBondContact O-N 3.08Å; T465-S467 VanDerWaalsContact C-N 3.33Å; T465-S467 PolarHBondContact O-N 2.87Å; T465-C468 PolarHBondContact O-N 3.42Å; T465-H469 PolarHBondContact O-CD2 2.8Å; T465-H469 PolarHBondContact O-N 3.04Å; T465-N520 WeakPolarHBondContact CG2-OD1 3.05Å; T465-N520 PolarHBondContact OG1-OD1 2.03Å; T465-A523 WeakPolarHBondContact OG1-CB 3.35Å
466	F	96.7	Very high	94.5	Very high	55 Å²	55	51.5 Å²	51.5	24%	0.241	25%	0.254	C	S	.	.	H	α-helix	trans	-58.8	-44.3	173.1	-179.9	-92.9	0	0	0	112.2	L404 I407 L411 V462 L463 I464 H469 F470	L404-F466 HydrophobicContact CD1-CD2 3.53Å; L404-F466 HydrophobicContact CD1-CE2 3.45Å; L404-F466 VanDerWaalsContact CD1-CE2 3.45Å; L404-F466 HydrophobicContact CD1-CG 4.15Å; L404-F466 HydrophobicContact CD1-CZ 4.02Å; L404-F466 HydrophobicContact CG-CD2 4.39Å; L404-F466 HydrophobicContact CG-CE2 3.92Å; L404-F466 HydrophobicContact CG-CZ 4.49Å; I407-F466 HydrophobicContact CB-CD2 4.41Å; I407-F466 HydrophobicContact CG2-CB 3.84Å; I407-F466 HydrophobicContact CG2-CD2 4.04Å; I407-F466 HydrophobicContact CG2-CG 4.45Å; L411-F466 HydrophobicContact CD1-CB 3.53Å; L411-F466 HydrophobicContact CD1-CD1 4.37Å; L411-F466 HydrophobicContact CD1-CD2 4.11Å; L411-F466 HydrophobicContact CD1-CG 3.75Å; V462-F466 WeakPolarHBondContact O-CB 3.38Å; V462-F466 PolarHBondContact O-N 3.31Å; L463-F466 PolarHBondContact O-N 2.99Å; I464-F466 VanDerWaalsContact C-N 3.34Å; I464-F466 PolarHBondContact O-N 3.36Å; F466-H469 PolarHBondContact O-N 3.11Å; F466-F470 WeakPolarHBondContact O-CB 3.43Å; F466-F470 PolarHBondContact O-N 2.86Å
467	S	97.1	Very high	94.5	Very high	65 Å²	65	48.9 Å²	48.9	46%	0.455	25%	0.25	S	C	.	.	H	α-helix	trans	-64.8	-39.6	-179.9	-55.7	0	0	0	0	112.3	L463 I464 T465 F470 Y471	L463-S467 WeakPolarHBondContact O-CB 3.46Å; L463-S467 PolarHBondContact O-N 3.46Å; L463-S467 PolarHBondContact O-OG 2.91Å; I464-S467 WeakPolarHBondContact O-CB 3.33Å; I464-S467 PolarHBondContact O-N 3.2Å; T465-S467 VanDerWaalsContact C-N 3.33Å; T465-S467 PolarHBondContact O-N 2.87Å; S467-F470 PolarHBondContact O-N 3.46Å; S467-Y471 PolarHBondContact O-N 3.13Å
468	C	96.3	Very high	94.4	Very high	9 Å²	9	49.1 Å²	49.1	6%	0.061	25%	0.249	C	C	.	.	H	α-helix	trans	-63.6	-48.4	173.4	-65.4	0	0	0	0	111.7	I464 T465 F470 Y471 D472 V516 N520	I464-C468 PolarHBondContact O-N 3.47Å; I464-C468 PolarHBondContact O-SG 3.09Å; T465-C468 PolarHBondContact O-N 3.42Å; C468-F470 VanDerWaalsContact C-N 3.28Å; C468-F470 PolarHBondContact O-N 3.48Å; C468-Y471 WeakPolarHBondContact O-CB 3.32Å; C468-Y471 PolarHBondContact O-N 3.33Å; C468-D472 PolarHBondContact O-N 3.17Å; C468-V516 HydrophobicContact CB-CG1 3.83Å; C468-N520 HydrophobicContact CB-CB 3.78Å
469	H	94.3	Very high	94.4	Very high	10 Å²	10	49.9 Å²	49.9	5%	0.046	25%	0.251	C	S	.	.	H	α-helix	trans	-65.6	-29.6	177.7	-71.2	-39.2	0	0	0	113.5	R399 L404 T465 F466 F473 N520	R399-H469 PolarHBondContact NH2-CE1 3.28Å; R399-H469 PolarHBondContact NH2-ND1 3.29Å; L404-H469 HydrophobicContact CD1-CB 3.82Å; T465-H469 PolarHBondContact O-CD2 2.8Å; T465-H469 PolarHBondContact O-N 3.04Å; F466-H469 PolarHBondContact O-N 3.11Å; H469-F473 WeakPolarHBondContact O-CB 3.08Å; H469-F473 PolarHBondContact O-N 2.85Å; H469-N520 PolarHBondContact CE1-ND2 2.82Å
470	F	95.8	Very high	94	Very high	104 Å²	104	50.9 Å²	50.9	46%	0.456	26%	0.257	S	S	.	.	H	α-helix	trans	-70	-40.3	172.4	-174.7	-91.9	0	0	0	111.9	L404 F466 S467 C468 F473 F474	L404-F470 HydrophobicContact CD1-CB 4.17Å; L404-F470 HydrophobicContact CD2-CD2 4.24Å; F466-F470 WeakPolarHBondContact O-CB 3.43Å; F466-F470 PolarHBondContact O-N 2.86Å; S467-F470 PolarHBondContact O-N 3.46Å; C468-F470 VanDerWaalsContact C-N 3.28Å; C468-F470 PolarHBondContact O-N 3.48Å; F470-F473 PolarHBondContact O-N 3.45Å; F470-F474 PolarHBondContact O-N 2.04Å; F470-F474 VanDerWaalsContact O-N 3.1Å
471	Y	95.3	Very high	93.6	Very high	85 Å²	85	56.1 Å²	56.1	33%	0.333	27%	0.268	S	S	.	.	H	α-helix	trans	-60	-47.8	173	172.2	-91.4	0	0	0	111.5	S467 C468 F473 F474 N475 W479 V516	S467-Y471 PolarHBondContact O-N 3.13Å; C468-Y471 WeakPolarHBondContact O-CB 3.32Å; C468-Y471 PolarHBondContact O-N 3.33Å; Y471-F473 PolarHBondContact O-N 3.05Å; Y471-F474 PolarHBondContact O-N 3.05Å; Y471-N475 WeakPolarHBondContact CD2-ND2 3.33Å; Y471-N475 WeakPolarHBondContact CE2-ND2 3.32Å; Y471-N475 PolarHBondContact O-N 2.91Å; Y471-N475 PolarHBondContact O-ND2 2.87Å; Y471-W479 HydrophobicContact CD1-CH2 4.1Å; Y471-W479 AromaticContact CE1-CH2 3.6Å; Y471-W479 HydrophobicContact CE1-CH2 3.6Å; Y471-W479 AromaticContact CE1-CZ2 3.75Å; Y471-W479 HydrophobicContact CE1-CZ2 3.75Å; Y471-V516 HydrophobicContact CD1-CB 4.18Å; Y471-V516 HydrophobicContact CD1-CG1 3.75Å; Y471-V516 HydrophobicContact CD1-CG2 3.99Å; Y471-V516 HydrophobicContact CE1-CB 4.24Å; Y471-V516 HydrophobicContact CE1-CG1 4.32Å; Y471-V516 HydrophobicContact CE1-CG2 3.82Å; Y471-V516 HydrophobicContact CG-CG1 4.34Å
472	D	91.6	Very high	93.2	Very high	11 Å²	11	54.9 Å²	54.9	6%	0.059	26%	0.263	C	S	.	.	H	α-helix	trans	-58.7	-48.5	176.8	-67.8	-9.5	0	0	0	111	R399 C468 F474 N475 Q476	R399-D472 IonicContact CZ-OD2 2.68Å; R399-D472 IonicContact NH1-OD2 2.68Å; R399-D472 PolarHBondContact NH1-OD2 3.34Å; R399-D472 IonicContact NH2-OD2 3.82Å; R399-D472 PolarHBondContact NH2-OD2 3.04Å; C468-D472 PolarHBondContact O-N 3.17Å; D472-F474 VanDerWaalsContact C-N 3.3Å; D472-F474 PolarHBondContact O-N 3.31Å; D472-N475 PolarHBondContact O-N 2.81Å; D472-Q476 WeakPolarHBondContact O-CB 3.05Å; D472-Q476 PolarHBondContact O-N 3.45Å
473	F	93.6	Very high	92.9	Very high	80 Å²	80	56.2 Å²	56.2	35%	0.351	27%	0.268	S	S	.	.	H	α-helix	trans	-55.9	-41.4	179.5	173.3	-104.6	0	0	0	113.2	Y396 A400 L404 H469 F470 Y471	Y396-F473 AromaticContact CD2-CD2 3.68Å; Y396-F473 HydrophobicContact CD2-CD2 3.68Å; Y396-F473 AromaticContact CD2-CE2 3.64Å; Y396-F473 HydrophobicContact CD2-CE2 3.64Å; Y396-F473 HydrophobicContact CE2-CD2 4.27Å; Y396-F473 AromaticContact CE2-CE2 3.83Å; Y396-F473 HydrophobicContact CE2-CE2 3.83Å; A400-F473 HydrophobicContact CB-CD2 3.49Å; A400-F473 VanDerWaalsContact CB-CD2 3.49Å; A400-F473 HydrophobicContact CB-CE2 3.61Å; A400-F473 HydrophobicContact CB-CG 4.35Å; L404-F473 HydrophobicContact CD2-CB 4.28Å; L404-F473 HydrophobicContact CD2-CG 4.39Å; H469-F473 WeakPolarHBondContact O-CB 3.08Å; H469-F473 PolarHBondContact O-N 2.85Å; F470-F473 PolarHBondContact O-N 3.45Å; Y471-F473 PolarHBondContact O-N 3.05Å
474	F	93.4	Very high	92.3	Very high	155 Å²	155	55.9 Å²	55.9	68%	0.68	26%	0.261	S	S	*	.	H	α-helix	trans	-73.1	-34.4	-177.9	-168.6	-95.5	0	0	0	113	F470 Y471 D472	F470-F474 PolarHBondContact O-N 2.04Å; F470-F474 VanDerWaalsContact O-N 3.1Å; Y471-F474 PolarHBondContact O-N 3.05Å; D472-F474 VanDerWaalsContact C-N 3.3Å; D472-F474 PolarHBondContact O-N 3.31Å
475	N	93.4	Very high	91.5	Very high	45 Å²	45	55.8 Å²	55.8	24%	0.241	26%	0.262	C	S	.	.	H	α-helix	trans	-97.6	-18.8	-172.3	-65.6	-82.1	0	0	0	114.2	Y471 D472 A477 E478 W479	Y471-N475 WeakPolarHBondContact CD2-ND2 3.33Å; Y471-N475 WeakPolarHBondContact CE2-ND2 3.32Å; Y471-N475 PolarHBondContact O-N 2.91Å; Y471-N475 PolarHBondContact O-ND2 2.87Å; D472-N475 PolarHBondContact O-N 2.81Å; N475-A477 VanDerWaalsContact C-N 3.3Å; N475-A477 PolarHBondContact O-N 3.41Å; N475-E478 PolarHBondContact O-N 3.43Å; N475-W479 HydrophobicContact CB-CD2 4.14Å; N475-W479 HydrophobicContact CB-CE3 4.4Å; N475-W479 HydrophobicContact CB-CH2 3.64Å; N475-W479 HydrophobicContact CB-CZ2 3.31Å; N475-W479 HydrophobicContact CB-CZ3 4.17Å; N475-W479 PolarHBondContact O-N 3.15Å
476	Q	88.9	Confident	91	Very high	29 Å²	29	57.1 Å²	57.1	14%	0.136	27%	0.266	C	S	.	.	H	α-helix	trans	-53.3	-42.8	-174.3	-166	94	-11.9	0	0	113.6	Y393 Y396 D472 E478 W479 E480	Y393-Q476 PolarHBondContact O-NE2 2.85Å; Y396-Q476 HydrophobicContact CD1-CB 4.19Å; Y396-Q476 HydrophobicContact CD1-CG 4.12Å; Y396-Q476 HydrophobicContact CG-CB 4.2Å; Y396-Q476 HydrophobicContact CG-CG 4.34Å; D472-Q476 WeakPolarHBondContact O-CB 3.05Å; D472-Q476 PolarHBondContact O-N 3.45Å; Q476-E478 PolarHBondContact O-N 3.29Å; Q476-E478 VanDerWaalsContact O-N 3.13Å; Q476-W479 HydrophobicContact CB-CE3 4.39Å; Q476-W479 PolarHBondContact O-N 2.9Å; Q476-W479 VanDerWaalsContact O-N 3.08Å; Q476-E480 HydrophobicContact CG-CG 4.17Å; Q476-E480 WeakPolarHBondContact CG-OE1 3.18Å; Q476-E480 PolarHBondContact O-N 3.46Å
477	A	89.3	Confident	90.3	Very high	39 Å²	39	54.6 Å²	54.6	32%	0.322	26%	0.255	S	S	.	.	H	α-helix	trans	-62.2	-23.4	-177.5	0	0	0	0	0	113.6	Y396 N475	Y396-A477 HydrophobicContact CE1-CB 4.44Å; N475-A477 VanDerWaalsContact C-N 3.3Å; N475-A477 PolarHBondContact O-N 3.41Å
478	E	91	Very high	89.3	Confident	77 Å²	77	52.9 Å²	52.9	36%	0.36	24%	0.24	S	C	.	.	H	α-helix	trans	-88.8	-32.2	175.3	-170.5	57.1	-158.1	0	0	112.1	N475 Q476 R481 S482	N475-E478 PolarHBondContact O-N 3.43Å; Q476-E478 PolarHBondContact O-N 3.29Å; Q476-E478 VanDerWaalsContact O-N 3.13Å; E478-R481 IonicContact OE2-CZ 2.75Å; E478-R481 IonicContact OE2-NH1 2.6Å; E478-R481 PolarHBondContact OE2-NH1 3.1Å; E478-S482 WeakPolarHBondContact O-CB 3.01Å; E478-S482 PolarHBondContact O-N 2.88Å; E478-S482 PolarHBondContact O-OG 3.41Å
479	W	91.6	Very high	88.4	Confident	18 Å²	18	54.7 Å²	54.7	7%	0.068	25%	0.253	C	S	.	.	H	α-helix	trans	-67.5	-41.4	171	-58.1	-30.4	0	0	0	112.1	Y471 N475 Q476 R481 S482 F483 R511 P512	Y471-W479 HydrophobicContact CD1-CH2 4.1Å; Y471-W479 AromaticContact CE1-CH2 3.6Å; Y471-W479 HydrophobicContact CE1-CH2 3.6Å; Y471-W479 AromaticContact CE1-CZ2 3.75Å; Y471-W479 HydrophobicContact CE1-CZ2 3.75Å; N475-W479 HydrophobicContact CB-CD2 4.14Å; N475-W479 HydrophobicContact CB-CE3 4.4Å; N475-W479 HydrophobicContact CB-CH2 3.64Å; N475-W479 HydrophobicContact CB-CZ2 3.31Å; N475-W479 HydrophobicContact CB-CZ3 4.17Å; N475-W479 PolarHBondContact O-N 3.15Å; Q476-W479 HydrophobicContact CB-CE3 4.39Å; Q476-W479 PolarHBondContact O-N 2.9Å; Q476-W479 VanDerWaalsContact O-N 3.08Å; W479-R481 VanDerWaalsContact C-N 3.34Å; W479-R481 PolarHBondContact O-N 3.08Å; W479-S482 PolarHBondContact O-N 3.43Å; W479-F483 VanDerWaalsContact O-CB 3.26Å; W479-F483 WeakPolarHBondContact O-CB 3.35Å; W479-F483 PolarHBondContact O-N 3.12Å; W479-R511 PolarHBondContact NE1-O 3.49Å; W479-P512 HydrophobicContact CB-CG 4.49Å; W479-P512 HydrophobicContact CD2-CB 4.17Å; W479-P512 HydrophobicContact CD2-CG 3.84Å; W479-P512 HydrophobicContact CE3-CB 3.88Å; W479-P512 HydrophobicContact CE3-CG 3.64Å; W479-P512 HydrophobicContact CG-CG 4.22Å; W479-P512 HydrophobicContact CH2-CB 4.15Å; W479-P512 HydrophobicContact CZ2-CB 4.4Å; W479-P512 HydrophobicContact CZ3-CB 3.88Å; W479-P512 HydrophobicContact CZ3-CG 4.15Å
480	E	87.4	Confident	87.5	Confident	71 Å²	71	57.6 Å²	57.6	33%	0.332	27%	0.266	S	S	.	.	H	α-helix	trans	-59.8	-43	174.7	-77	170.7	-161.8	0	0	111.5	Q476 F483 R484	Q476-E480 HydrophobicContact CG-CG 4.17Å; Q476-E480 WeakPolarHBondContact CG-OE1 3.18Å; Q476-E480 PolarHBondContact O-N 3.46Å; E480-F483 PolarHBondContact O-N 3.11Å; E480-R484 PolarHBondContact O-N 3.09Å
481	R	87.4	Confident	86.2	Confident	138 Å²	138	52.7 Å²	52.7	52%	0.521	25%	0.245	S	C	.	.	H	α-helix	trans	-64.3	-50.5	174.2	-179.1	-179.3	-68.2	102.7	9	111.7	E478 W479 F483 R484 D485	E478-R481 IonicContact OE2-CZ 2.75Å; E478-R481 IonicContact OE2-NH1 2.6Å; E478-R481 PolarHBondContact OE2-NH1 3.1Å; W479-R481 VanDerWaalsContact C-N 3.34Å; W479-R481 PolarHBondContact O-N 3.08Å; R481-F483 PolarHBondContact O-N 3.36Å; R481-R484 PolarHBondContact O-N 3.15Å; R481-D485 PolarHBondContact O-N 2.76Å
482	S	88.8	Confident	84.8	Confident	2 Å²	2	52.3 Å²	52.3	1%	0.014	25%	0.249	C	C	.	.	H	α-helix	trans	-59	-35.4	178.6	-60.9	0	0	0	0	112.1	E478 W479 Y486 N510	E478-S482 WeakPolarHBondContact O-CB 3.01Å; E478-S482 PolarHBondContact O-N 2.88Å; E478-S482 PolarHBondContact O-OG 3.41Å; W479-S482 PolarHBondContact O-N 3.43Å; S482-Y486 WeakPolarHBondContact O-CB 3.37Å; S482-Y486 PolarHBondContact O-N 3.46Å; S482-Y486 VanDerWaalsContact O-N 3.11Å; S482-N510 WeakPolarHBondContact CB-O 3.37Å
483	F	87.6	Confident	83.3	Confident	38 Å²	38	52.9 Å²	52.9	17%	0.167	25%	0.252	C	S	.	.	H	α-helix	trans	-72	-42.2	176.1	179.7	-125.7	0	0	0	112.7	Y206 I214 P219 L220 W479 E480 R481 D485 Y486 V487	Y206-F483 HydrophobicContact CE2-CE1 4.13Å; I214-F483 HydrophobicContact CD1-CZ 3.74Å; I214-F483 HydrophobicContact CG1-CZ 4.14Å; P219-F483 HydrophobicContact CG-CE2 3.54Å; P219-F483 HydrophobicContact CG-CZ 3.96Å; L220-F483 HydrophobicContact CD2-CB 4.32Å; L220-F483 HydrophobicContact CD2-CD2 3.7Å; L220-F483 HydrophobicContact CD2-CE2 4.47Å; L220-F483 HydrophobicContact CD2-CG 4.31Å; L220-F483 HydrophobicContact CG-CD2 4.16Å; W479-F483 VanDerWaalsContact O-CB 3.26Å; W479-F483 WeakPolarHBondContact O-CB 3.35Å; W479-F483 PolarHBondContact O-N 3.12Å; E480-F483 PolarHBondContact O-N 3.11Å; R481-F483 PolarHBondContact O-N 3.36Å; F483-D485 PolarHBondContact O-N 3.33Å; F483-Y486 HydrophobicContact CD2-CD1 4.44Å; F483-Y486 PolarHBondContact O-N 3.15Å; F483-V487 HydrophobicContact CD2-CG2 3.91Å; F483-V487 HydrophobicContact CE1-CG2 4.21Å; F483-V487 HydrophobicContact CE2-CG2 3.39Å; F483-V487 HydrophobicContact CG-CG2 4.49Å; F483-V487 HydrophobicContact CZ-CG2 3.58Å; F483-V487 WeakPolarHBondContact O-CG2 3.39Å; F483-V487 PolarHBondContact O-N 2.79Å
484	R	84.8	Confident	81.6	Confident	70 Å²	70	52.5 Å²	52.5	26%	0.264	26%	0.257	S	S	.	.	H	α-helix	trans	-60	-45.7	174.3	-173.1	178.2	-179.6	-82.8	-7.9	111.3	E159 D208 E480 R481 Y486 V487 L488	E159-R484 IonicContact OE1-CZ 2.64Å; E159-R484 IonicContact OE1-NH1 3.04Å; E159-R484 IonicContact OE1-NH2 3.12Å; E159-R484 PolarHBondContact OE1-NH2 2.74Å; D208-R484 IonicContact OD2-CZ 3.9Å; D208-R484 IonicContact OD2-NE 3.07Å; D208-R484 IonicContact OD2-NH2 3.56Å; D208-R484 PolarHBondContact OD2-NH2 3.27Å; E480-R484 PolarHBondContact O-N 3.09Å; R481-R484 PolarHBondContact O-N 3.15Å; R484-Y486 VanDerWaalsContact C-N 3.33Å; R484-Y486 PolarHBondContact O-N 3.14Å; R484-V487 PolarHBondContact O-N 3.36Å; R484-L488 HydrophobicContact CG-CD1 4.08Å; R484-L488 WeakPolarHBondContact O-CG 3.18Å; R484-L488 PolarHBondContact O-N 3.24Å
485	D	82.8	Confident	79.9	Confident	63 Å²	63	46.1 Å²	46.1	34%	0.337	23%	0.23	S	C	.	.	H	α-helix	trans	-56.9	-45.7	175.1	-72.4	3.7	0	0	0	111.5	R481 F483 C489 K509	R481-D485 PolarHBondContact O-N 2.76Å; F483-D485 PolarHBondContact O-N 3.33Å; D485-C489 WeakPolarHBondContact O-CB 3.47Å; D485-C489 PolarHBondContact O-N 3.15Å; D485-K509 IonicContact OD2-NZ 2.73Å; D485-K509 PolarHBondContact OD2-NZ 2.87Å
486	Y	83.9	Confident	77.8	Confident	36 Å²	36	44.6 Å²	44.6	14%	0.141	22%	0.224	C	C	.	.	H	α-helix	trans	-63.9	-45.4	178.8	174.1	-99.7	0	0	0	112.8	P195 S482 F483 R484 C489 Q490 C506 I508	P195-Y486 HydrophobicContact CG-CE1 4.37Å; S482-Y486 WeakPolarHBondContact O-CB 3.37Å; S482-Y486 PolarHBondContact O-N 3.46Å; S482-Y486 VanDerWaalsContact O-N 3.11Å; F483-Y486 HydrophobicContact CD2-CD1 4.44Å; F483-Y486 PolarHBondContact O-N 3.15Å; R484-Y486 VanDerWaalsContact C-N 3.33Å; R484-Y486 PolarHBondContact O-N 3.14Å; Y486-C489 PolarHBondContact O-N 3.22Å; Y486-Q490 HydrophobicContact CD1-CG 4.35Å; Y486-Q490 HydrophobicContact CD2-CG 4.15Å; Y486-Q490 HydrophobicContact CE1-CG 3.9Å; Y486-Q490 HydrophobicContact CE2-CG 3.68Å; Y486-Q490 HydrophobicContact CG-CG 4.46Å; Y486-Q490 WeakPolarHBondContact O-CB 3.5Å; Y486-Q490 WeakPolarHBondContact O-CG 3.48Å; Y486-Q490 PolarHBondContact O-N 3.46Å; Y486-Q490 PolarHBondContact OH-NE2 2.96Å; Y486-Q490 VanDerWaalsContact OH-NE2 3.15Å; Y486-C506 HydrophobicContact CD2-CB 4.31Å; Y486-C506 VanDerWaalsContact CD2-O 3.29Å; Y486-C506 WeakPolarHBondContact CD2-O 3.47Å; Y486-C506 HydrophobicContact CE2-CB 4.35Å; Y486-C506 WeakPolarHBondContact CE2-O 3.29Å; Y486-I508 HydrophobicContact CD1-CG1 4.31Å; Y486-I508 HydrophobicContact CD2-CD1 4.26Å; Y486-I508 HydrophobicContact CD2-CG1 3.43Å; Y486-I508 VanDerWaalsContact CD2-CG1 3.43Å; Y486-I508 HydrophobicContact CE1-CD1 4.46Å; Y486-I508 HydrophobicContact CE2-CD1 4.13Å; Y486-I508 HydrophobicContact CE2-CG1 3.72Å; Y486-I508 HydrophobicContact CG-CD1 4.48Å; Y486-I508 HydrophobicContact CG-CG1 3.76Å
487	V	81.4	Confident	75.8	Confident	1 Å²	1	49.3 Å²	49.3	1%	0.006	25%	0.25	C	C	.	.	H	α-helix	trans	-63.9	-42.6	179	174.8	0	0	0	0	111.1	P195 L196 Y206 F483 R484 C489 Q490 A491	P195-V487 HydrophobicContact CG-CG2 3.98Å; L196-V487 HydrophobicContact CD1-CG1 4.21Å; L196-V487 HydrophobicContact CD2-CG1 4.06Å; L196-V487 HydrophobicContact CG-CG1 4.2Å; Y206-V487 HydrophobicContact CD1-CG1 4.09Å; Y206-V487 HydrophobicContact CE1-CB 4.19Å; Y206-V487 HydrophobicContact CE1-CG1 3.63Å; F483-V487 HydrophobicContact CD2-CG2 3.91Å; F483-V487 HydrophobicContact CE1-CG2 4.21Å; F483-V487 HydrophobicContact CE2-CG2 3.39Å; F483-V487 HydrophobicContact CG-CG2 4.49Å; F483-V487 HydrophobicContact CZ-CG2 3.58Å; F483-V487 WeakPolarHBondContact O-CG2 3.39Å; F483-V487 PolarHBondContact O-N 2.79Å; R484-V487 PolarHBondContact O-N 3.36Å; V487-C489 VanDerWaalsContact C-N 3.34Å; V487-C489 PolarHBondContact O-N 3.47Å; V487-Q490 PolarHBondContact O-N 3.01Å; V487-A491 WeakPolarHBondContact O-CB 3.39Å; V487-A491 PolarHBondContact O-N 2.97Å
488	L	76.6	Confident	73.8	Confident	29 Å²	29	52.4 Å²	52.4	15%	0.152	27%	0.267	C	S	.	.	H	α-helix	trans	-65.8	-36.3	177.2	-69.5	172.2	0	0	0	112.4	I155 R484	I155-L488 HydrophobicContact CD1-CD2 4.47Å; R484-L488 HydrophobicContact CG-CD1 4.08Å; R484-L488 WeakPolarHBondContact O-CG 3.18Å; R484-L488 PolarHBondContact O-N 3.24Å
489	C	77.8	Confident	71.6	Confident	48 Å²	48	52.7 Å²	52.7	32%	0.324	27%	0.274	S	S	.	.	H	α-helix	trans	-64.5	-52.8	173.6	-170.3	0	0	0	0	111.6	D485 Y486 V487 N492 C506	D485-C489 WeakPolarHBondContact O-CB 3.47Å; D485-C489 PolarHBondContact O-N 3.15Å; Y486-C489 PolarHBondContact O-N 3.22Å; V487-C489 VanDerWaalsContact C-N 3.34Å; V487-C489 PolarHBondContact O-N 3.47Å; C489-N492 PolarHBondContact O-N 3.08Å; C489-C506 HydrophobicContact CB-CB 3.79Å; C489-C506 WeakPolarHBondContact CB-SG 3.47Å; C489-C506 VanDerWaalsContact SG-CA 3.53Å; C489-C506 WeakPolarHBondContact SG-CB 3.48Å; C489-C506 CovalentContact SG-SG 2.04Å; C489-C506 PolarHBondContact SG-SG 3.08Å
490	Q	75.7	Confident	69.1	Low	70 Å²	70	62.2 Å²	62.2	33%	0.327	32%	0.316	S	S	.	.	H	α-helix	trans	-66.7	-37.1	-178.6	-74.6	-70.4	13.2	0	0	113.4	Y486 V487 N492 C506	Y486-Q490 HydrophobicContact CD1-CG 4.35Å; Y486-Q490 HydrophobicContact CD2-CG 4.15Å; Y486-Q490 HydrophobicContact CE1-CG 3.9Å; Y486-Q490 HydrophobicContact CE2-CG 3.68Å; Y486-Q490 HydrophobicContact CG-CG 4.46Å; Y486-Q490 WeakPolarHBondContact O-CB 3.5Å; Y486-Q490 WeakPolarHBondContact O-CG 3.48Å; Y486-Q490 PolarHBondContact O-N 3.46Å; Y486-Q490 PolarHBondContact OH-NE2 2.96Å; Y486-Q490 VanDerWaalsContact OH-NE2 3.15Å; V487-Q490 PolarHBondContact O-N 3.01Å; Q490-N492 PolarHBondContact O-N 3.02Å; Q490-C506 HydrophobicContact CG-CB 4.03Å
491	A	66.8	Low	66.8	Low	1 Å²	1	66.6 Å²	66.6	1%	0.008	33%	0.334	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63.4	-4.9	173.8	0	0	0	0	0	112.7	N113 L196 V487 V493	N113-A491 VanDerWaalsContact CB-O 3.27Å; N113-A491 WeakPolarHBondContact CB-O 3.49Å; N113-A491 PolarHBondContact ND2-O 2.95Å; L196-A491 HydrophobicContact CD1-CB 4.32Å; V487-A491 WeakPolarHBondContact O-CB 3.39Å; V487-A491 PolarHBondContact O-N 2.97Å; A491-V493 HydrophobicContact CB-CG2 3.91Å; A491-V493 WeakPolarHBondContact O-CG2 3.31Å; A491-V493 PolarHBondContact O-N 2.77Å
492	N	66.3	Low	64.7	Low	77 Å²	77	65.8 Å²	65.8	41%	0.412	35%	0.346	S	S	.	.	T	Hydrogen-bonded Turn	trans	46.9	37.5	173.8	-166.6	17.6	0	0	0	112.9	C489 Q490 T494	C489-N492 PolarHBondContact O-N 3.08Å; Q490-N492 PolarHBondContact O-N 3.02Å; N492-T494 PolarHBondContact O-N 3.17Å; N492-T494 PolarHBondContact O-OG1 3.27Å; N492-T494 PolarHBondContact OD1-OG1 3.36Å
493	V	61.2	Low	62.9	Low	23 Å²	23	71.5 Å²	71.5	14%	0.139	38%	0.375	C	S	.	.			trans	-80	53.8	176	-167.4	0	0	0	0	108.3	L111 I155 A491 I495	L111-V493 HydrophobicContact CD2-CG1 3.96Å; I155-V493 HydrophobicContact CD1-CB 4.35Å; I155-V493 HydrophobicContact CD1-CG1 3.88Å; I155-V493 HydrophobicContact CD1-CG2 4.23Å; I155-V493 HydrophobicContact CG1-CG1 4.33Å; A491-V493 HydrophobicContact CB-CG2 3.91Å; A491-V493 WeakPolarHBondContact O-CG2 3.31Å; A491-V493 PolarHBondContact O-N 2.77Å; V493-I495 HydrophobicContact CG1-CD1 4.07Å; V493-I495 HydrophobicContact CG1-CG1 3.91Å; V493-I495 PolarHBondContact O-N 3.48Å
494	T	56.6	Low	61.3	Low	73 Å²	73	73.8 Å²	73.8	45%	0.448	39%	0.394	S	S	.	.			trans	-74.4	70.7	179.6	39.3	0	0	0	0	110.1	N492 G496	N492-T494 PolarHBondContact O-N 3.17Å; N492-T494 PolarHBondContact O-OG1 3.27Å; N492-T494 PolarHBondContact OD1-OG1 3.36Å; T494-G496 PolarHBondContact O-N 3.05Å
495	I	58	Low	60.1	Low	21 Å²	21	77.7 Å²	77.7	11%	0.108	42%	0.42	C	S	.	.	T	Hydrogen-bonded Turn	trans	-70.6	80.9	171	-46.3	175.1	0	0	0	108.7	W108 L111 V156 R160 V493	W108-I495 HydrophobicContact CE3-CG2 4.29Å; W108-I495 HydrophobicContact CH2-CG2 4.36Å; W108-I495 HydrophobicContact CZ3-CG2 4.01Å; L111-I495 HydrophobicContact CD2-CD1 3.92Å; L111-I495 HydrophobicContact CD2-CG1 4.4Å; L111-I495 HydrophobicContact CG-CD1 4.35Å; L111-I495 HydrophobicContact CG-CG1 4.47Å; V156-I495 HydrophobicContact CG2-CD1 4.11Å; R160-I495 WeakPolarHBondContact CD-O 3.49Å; R160-I495 PolarHBondContact NH1-O 2.91Å; V493-I495 HydrophobicContact CG1-CD1 4.07Å; V493-I495 HydrophobicContact CG1-CG1 3.91Å; V493-I495 PolarHBondContact O-N 3.48Å
496	G	49.1	Very low	59.7	Low	12 Å²	12	76 Å²	76	12%	0.124	41%	0.413	C	S	.	.	T	Hydrogen-bonded Turn	trans	112.6	37.5	149.1	0	0	0	0	0	118.6	R160 T494	R160-G496 VanDerWaalsContact NH1-CA 3.35Å; R160-G496 PolarHBondContact NH1-O 3.3Å; T494-G496 PolarHBondContact O-N 3.05Å
497	L	48.3	Very low	59.5	Low	128 Å²	128	82.2 Å²	82.2	67%	0.67	44%	0.443	S	S	*	.			trans	-152.3	118.6	154.9	-100.2	142.4	0	0	0	110.2	T499	L497-T499 PolarHBondContact O-N 3.33Å
498	P	46.4	Very low	59.6	Low	105 Å²	105	84 Å²	84	68%	0.682	45%	0.453	S	S	*	.			trans	-70.2	99.7	160.6	29.3	-30.6	0	0	0	107.5	K500	P498-K500 PolarHBondContact O-N 2.83Å; P498-K500 VanDerWaalsContact O-N 3.09Å
499	T	44.3	Very low	60	Low	82 Å²	82	89.2 Å²	89.2	50%	0.503	47%	0.474	S	S	.	.			trans	-61.7	116.3	176.1	45.6	0	0	0	0	109	L497 K501	L497-T499 PolarHBondContact O-N 3.33Å; T499-K501 CarbonylContact C-O 3.48Å; T499-K501 PolarHBondContact O-N 2.59Å; T499-K501 VanDerWaalsContact O-N 3.08Å; T499-K501 PolarHBondContact OG1-O 2.9Å
500	K	39.9	Very low	60.4	Low	218 Å²	218	90.7 Å²	90.7	95%	0.948	48%	0.479	S	S	*	.	S	Bend	trans	-69.9	4.8	171.8	-67.7	-175.6	177	-179.6	0	113.5	P498	P498-K500 PolarHBondContact O-N 2.83Å; P498-K500 VanDerWaalsContact O-N 3.09Å
501	K	39.4	Very low	61.1	Low	164 Å²	164	92.2 Å²	92.2	71%	0.713	48%	0.481	S	S	*	.	S	Bend	trans	-104.2	147.3	167.3	-62.9	-176.7	178.6	-177	0	106.9	T499	T499-K501 CarbonylContact C-O 3.48Å; T499-K501 PolarHBondContact O-N 2.59Å; T499-K501 VanDerWaalsContact O-N 3.08Å; T499-K501 PolarHBondContact OG1-O 2.9Å
502	P	44	Very low	62.3	Low	121 Å²	121	93.8 Å²	93.8	79%	0.786	49%	0.491	S	S	*	.	S	Bend	trans	-49.8	149.9	165.7	25.1	-34.3	0	0	0	109.4
503	I	49.3	Very low	63.6	Low	121 Å²	121	92.2 Å²	92.2	62%	0.621	49%	0.486	S	S	*	.			trans	-37.7	123.6	-179.2	-57	164	0	0	0	108.3	D505	I503-D505 PolarHBondContact O-N 3.47Å
504	P	55.4	Low	65.1	Low	87 Å²	87	92.3 Å²	92.3	57%	0.565	49%	0.486	S	S	*	.			trans	-59.2	117.7	172.8	25.8	-32	0	0	0	106.7	C506	P504-C506 PolarHBondContact O-N 3.42Å
505	D	58.6	Low	67	Low	152 Å²	152	94.4 Å²	94.4	81%	0.813	49%	0.494	S	S	*	.			trans	-50.5	117.3	-177.6	-66.1	-61.6	0	0	0	108.4	I503 E507	I503-D505 PolarHBondContact O-N 3.47Å; D505-E507 PolarHBondContact O-N 2.78Å
506	C	74.4	Confident	68.8	Low	26 Å²	26	94.6 Å²	94.6	18%	0.176	50%	0.496	C	S	.	.			trans	-70.4	81.9	-174.7	-67.4	0	0	0	0	109.1	Y486 C489 Q490 P504	Y486-C506 HydrophobicContact CD2-CB 4.31Å; Y486-C506 VanDerWaalsContact CD2-O 3.29Å; Y486-C506 WeakPolarHBondContact CD2-O 3.47Å; Y486-C506 HydrophobicContact CE2-CB 4.35Å; Y486-C506 WeakPolarHBondContact CE2-O 3.29Å; C489-C506 HydrophobicContact CB-CB 3.79Å; C489-C506 WeakPolarHBondContact CB-SG 3.47Å; C489-C506 VanDerWaalsContact SG-CA 3.53Å; C489-C506 WeakPolarHBondContact SG-CB 3.48Å; C489-C506 CovalentContact SG-SG 2.04Å; C489-C506 PolarHBondContact SG-SG 3.08Å; Q490-C506 HydrophobicContact CG-CB 4.03Å; P504-C506 PolarHBondContact O-N 3.42Å
507	E	80.5	Confident	70.9	Confident	167 Å²	167	95.6 Å²	95.6	78%	0.78	50%	0.497	S	S	*	.			trans	-90.4	136.8	-174	-168	175.6	-168.6	0	0	111.6	D505 K509	D505-E507 PolarHBondContact O-N 2.78Å; E507-K509 PolarHBondContact O-N 2.83Å
508	I	82.9	Confident	73.2	Confident	40 Å²	40	91.1 Å²	91.1	21%	0.205	47%	0.472	C	S	.	.			trans	-79.4	101	177.3	-58.9	165.8	0	0	0	108.7	L220 Y486 N510 R511	L220-I508 HydrophobicContact CD2-CD1 4.01Å; L220-I508 HydrophobicContact CD2-CG2 4Å; Y486-I508 HydrophobicContact CD1-CG1 4.31Å; Y486-I508 HydrophobicContact CD2-CD1 4.26Å; Y486-I508 HydrophobicContact CD2-CG1 3.43Å; Y486-I508 VanDerWaalsContact CD2-CG1 3.43Å; Y486-I508 HydrophobicContact CE1-CD1 4.46Å; Y486-I508 HydrophobicContact CE2-CD1 4.13Å; Y486-I508 HydrophobicContact CE2-CG1 3.72Å; Y486-I508 HydrophobicContact CG-CD1 4.48Å; Y486-I508 HydrophobicContact CG-CG1 3.76Å; I508-N510 PolarHBondContact O-N 2.54Å; I508-R511 HydrophobicContact CG2-CB 3.96Å
509	K	84.6	Confident	75.7	Confident	138 Å²	138	89.5 Å²	89.5	60%	0.6	46%	0.457	S	S	*	.	S	Bend	trans	-50.7	-51.3	-178.1	-62.1	171.1	-174.3	165.8	0	113.5	D485 E507	D485-K509 IonicContact OD2-NZ 2.73Å; D485-K509 PolarHBondContact OD2-NZ 2.87Å; E507-K509 PolarHBondContact O-N 2.83Å
510	N	87.9	Confident	78.2	Confident	79 Å²	79	85.7 Å²	85.7	42%	0.422	43%	0.434	S	S	.	.			trans	-142.4	137.2	-180	-68.5	-60.1	0	0	0	109.5	S482 I508	S482-N510 WeakPolarHBondContact CB-O 3.37Å; I508-N510 PolarHBondContact O-N 2.54Å
511	R	89.5	Confident	80.9	Confident	102 Å²	102	75.3 Å²	75.3	39%	0.385	39%	0.389	S	S	.	.			trans	-136.3	159.2	176.1	63.3	-179.2	-179	144.3	10.2	112	L220 E225 W479 I508	L220-R511 WeakPolarHBondContact O-CD 3.08Å; L220-R511 PolarHBondContact O-NH1 2.73Å; E225-R511 IonicContact OE1-CZ 3.38Å; E225-R511 VanDerWaalsContact OE1-CZ 3.31Å; E225-R511 IonicContact OE1-NH1 2.68Å; E225-R511 PolarHBondContact OE1-NH1 2.76Å; E225-R511 IonicContact OE1-NH2 3.5Å; E225-R511 PolarHBondContact OE1-NH2 2.83Å; E225-R511 IonicContact OE2-NH1 3.31Å; E225-R511 PolarHBondContact OE2-NH1 2.79Å; E225-R511 VanDerWaalsContact OE2-NH1 3.12Å; W479-R511 PolarHBondContact NE1-O 3.49Å; I508-R511 HydrophobicContact CG2-CB 3.96Å
512	P	92.1	Very high	83.7	Confident	34 Å²	34	71.8 Å²	71.8	22%	0.221	37%	0.373	C	S	.	.			trans	-58.3	141.8	177.5	-19.1	29	0	0	0	112.2	L220 F221 W479 L514	L220-P512 HydrophobicContact CD1-CG 4.44Å; F221-P512 WeakPolarHBondContact CE1-O 3.36Å; F221-P512 HydrophobicContact CZ-CB 4.11Å; F221-P512 HydrophobicContact CZ-CG 4.26Å; F221-P512 WeakPolarHBondContact CZ-O 3.21Å; W479-P512 HydrophobicContact CB-CG 4.49Å; W479-P512 HydrophobicContact CD2-CB 4.17Å; W479-P512 HydrophobicContact CD2-CG 3.84Å; W479-P512 HydrophobicContact CE3-CB 3.88Å; W479-P512 HydrophobicContact CE3-CG 3.64Å; W479-P512 HydrophobicContact CG-CG 4.22Å; W479-P512 HydrophobicContact CH2-CB 4.15Å; W479-P512 HydrophobicContact CZ2-CB 4.4Å; W479-P512 HydrophobicContact CZ3-CB 3.88Å; W479-P512 HydrophobicContact CZ3-CG 4.15Å; P512-L514 PolarHBondContact O-N 3.39Å
513	S	93.4	Very high	86.2	Confident	43 Å²	43	66 Å²	66	30%	0.301	34%	0.336	S	S	.	.			trans	-84.3	107	-177.8	-178	0	0	0	0	111.5	L515 V516 E517	S513-L515 PolarHBondContact O-N 2.84Å; S513-L515 VanDerWaalsContact O-N 3.11Å; S513-V516 PolarHBondContact O-N 2.98Å; S513-E517 PolarHBondContact O-N 2.83Å
514	L	93.5	Very high	88.4	Confident	26 Å²	26	61.2 Å²	61.2	14%	0.136	31%	0.311	C	S	.	.	H	α-helix	trans	-55.6	-28.4	174.4	-63.5	177.7	0	0	0	112.9	F221 E225 M229 V385 P512 E517 K518	F221-L514 HydrophobicContact CD1-CD1 3.64Å; F221-L514 HydrophobicContact CD1-CD2 3.78Å; F221-L514 HydrophobicContact CD1-CG 3.75Å; F221-L514 HydrophobicContact CD2-CD2 4.46Å; F221-L514 HydrophobicContact CE1-CD1 3.94Å; F221-L514 HydrophobicContact CE1-CD2 3.57Å; F221-L514 HydrophobicContact CE1-CG 3.52Å; F221-L514 HydrophobicContact CE2-CD2 4.25Å; F221-L514 HydrophobicContact CG-CD1 4.44Å; F221-L514 HydrophobicContact CG-CD2 4.21Å; F221-L514 HydrophobicContact CZ-CD2 3.8Å; F221-L514 HydrophobicContact CZ-CG 4.21Å; E225-L514 HydrophobicContact CB-CD1 3.69Å; E225-L514 HydrophobicContact CG-CD1 3.79Å; M229-L514 HydrophobicContact CE-CB 4.16Å; M229-L514 HydrophobicContact CE-CD2 3.89Å; V385-L514 HydrophobicContact CG1-CD2 3.67Å; P512-L514 PolarHBondContact O-N 3.39Å; L514-E517 PolarHBondContact O-N 2.03Å; L514-K518 WeakPolarHBondContact O-CG 3.1Å; L514-K518 PolarHBondContact O-N 3Å
515	L	95.3	Very high	90.4	Very high	117 Å²	117	57.2 Å²	57.2	61%	0.613	29%	0.285	S	S	*	.	H	α-helix	trans	-65.9	-37.9	175.6	179.9	61.2	0	0	0	111.7	S513 K518 I519	S513-L515 PolarHBondContact O-N 2.84Å; S513-L515 VanDerWaalsContact O-N 3.11Å; L515-K518 PolarHBondContact O-N 3.1Å; L515-I519 HydrophobicContact CD1-CD1 4.37Å; L515-I519 HydrophobicContact CG-CD1 4.1Å; L515-I519 WeakPolarHBondContact O-CD1 3.19Å; L515-I519 VanDerWaalsContact O-CG1 3.25Å; L515-I519 WeakPolarHBondContact O-CG1 3.44Å; L515-I519 PolarHBondContact O-N 3.2Å
516	V	95.9	Very high	92.2	Very high	25 Å²	25	50.3 Å²	50.3	15%	0.152	25%	0.25	C	C	.	.	H	α-helix	trans	-68.9	-40	177.7	178.4	0	0	0	0	110.8	C468 Y471 S513 I519 N520	C468-V516 HydrophobicContact CB-CG1 3.83Å; Y471-V516 HydrophobicContact CD1-CB 4.18Å; Y471-V516 HydrophobicContact CD1-CG1 3.75Å; Y471-V516 HydrophobicContact CD1-CG2 3.99Å; Y471-V516 HydrophobicContact CE1-CB 4.24Å; Y471-V516 HydrophobicContact CE1-CG1 4.32Å; Y471-V516 HydrophobicContact CE1-CG2 3.82Å; Y471-V516 HydrophobicContact CG-CG1 4.34Å; S513-V516 PolarHBondContact O-N 2.98Å; V516-I519 PolarHBondContact O-N 2.82Å; V516-N520 PolarHBondContact O-N 2.93Å
517	E	93.9	Very high	93.2	Very high	32 Å²	32	49.6 Å²	49.6	15%	0.15	24%	0.244	C	C	.	.	H	α-helix	trans	-67.2	-38.5	174.3	-166.5	59.8	-120.9	0	0	111.5	M229 R399 S513 L514 I519 N520 L521	M229-E517 HydrophobicContact CE-CB 4.26Å; M229-E517 HydrophobicContact CE-CG 4.47Å; R399-E517 IonicContact NH2-OE2 3.58Å; R399-E517 PolarHBondContact NH2-OE2 3.25Å; S513-E517 PolarHBondContact O-N 2.83Å; L514-E517 PolarHBondContact O-N 2.03Å; E517-I519 VanDerWaalsContact C-N 3.33Å; E517-I519 PolarHBondContact O-N 3.24Å; E517-N520 WeakPolarHBondContact O-CB 3.19Å; E517-N520 PolarHBondContact O-N 2.92Å; E517-N520 VanDerWaalsContact O-N 3.15Å; E517-N520 PolarHBondContact OE1-ND2 2.92Å; E517-L521 HydrophobicContact CG-CD1 4.41Å; E517-L521 WeakPolarHBondContact O-CB 3.27Å; E517-L521 VanDerWaalsContact O-CG 3.3Å; E517-L521 WeakPolarHBondContact O-CG 3.46Å; E517-L521 PolarHBondContact O-N 3.14Å
518	K	97.1	Very high	94	Very high	34 Å²	34	41.6 Å²	41.6	15%	0.148	21%	0.207	C	C	.	.	H	α-helix	trans	-60.2	-39.9	170.5	-75	-172.9	-173.1	-176.3	0	112.7	D228 M229 Y232 L514 L515 N520 L521 F522	D228-K518 IonicContact OD1-NZ 3.31Å; D228-K518 PolarHBondContact OD1-NZ 3.25Å; D228-K518 IonicContact OD2-NZ 2.66Å; D228-K518 PolarHBondContact OD2-NZ 3.05Å; M229-K518 HydrophobicContact CE-CG 3.93Å; M229-K518 HydrophobicContact SD-CG 3.92Å; Y232-K518 HydrophobicContact CD1-CG 4.09Å; Y232-K518 HydrophobicContact CD2-CD 4.05Å; Y232-K518 HydrophobicContact CD2-CG 4.41Å; Y232-K518 HydrophobicContact CE1-CB 4.07Å; Y232-K518 HydrophobicContact CE1-CG 4.15Å; Y232-K518 HydrophobicContact CE2-CD 4.2Å; Y232-K518 HydrophobicContact CE2-CG 4.46Å; Y232-K518 HydrophobicContact CG-CD 4.25Å; Y232-K518 HydrophobicContact CG-CG 4.23Å; Y232-K518 PolarHBondContact OH-O 3.31Å; L514-K518 WeakPolarHBondContact O-CG 3.1Å; L514-K518 PolarHBondContact O-N 3Å; L515-K518 PolarHBondContact O-N 3.1Å; K518-N520 VanDerWaalsContact C-N 3.34Å; K518-L521 PolarHBondContact O-N 3.11Å; K518-F522 VanDerWaalsContact O-CB 3.29Å; K518-F522 WeakPolarHBondContact O-CB 3.46Å; K518-F522 PolarHBondContact O-N 3.4Å
519	I	97.9	Very high	94.6	Very high	71 Å²	71	41.6 Å²	41.6	36%	0.364	21%	0.207	S	C	.	.	H	α-helix	trans	-65.6	-38.2	174.8	-68.7	162.9	0	0	0	111	I464 L515 V516 E517 F522 A523	I464-I519 HydrophobicContact CG2-CG2 3.55Å; L515-I519 HydrophobicContact CD1-CD1 4.37Å; L515-I519 HydrophobicContact CG-CD1 4.1Å; L515-I519 WeakPolarHBondContact O-CD1 3.19Å; L515-I519 VanDerWaalsContact O-CG1 3.25Å; L515-I519 WeakPolarHBondContact O-CG1 3.44Å; L515-I519 PolarHBondContact O-N 3.2Å; V516-I519 PolarHBondContact O-N 2.82Å; E517-I519 VanDerWaalsContact C-N 3.33Å; E517-I519 PolarHBondContact O-N 3.24Å; I519-F522 WeakPolarHBondContact O-CB 3.25Å; I519-F522 PolarHBondContact O-N 3.12Å; I519-A523 WeakPolarHBondContact O-CB 3.37Å; I519-A523 PolarHBondContact O-N 2.98Å
520	N	96.4	Very high	95.1	Very high	2 Å²	2	35.4 Å²	35.4	1%	0.011	18%	0.182	C	C	.	.	H	α-helix	trans	-63	-50.1	175	-175.2	34.5	0	0	0	111.7	T465 C468 H469 V516 E517 K518 F522 A523 M524	T465-N520 WeakPolarHBondContact CG2-OD1 3.05Å; T465-N520 PolarHBondContact OG1-OD1 2.03Å; C468-N520 HydrophobicContact CB-CB 3.78Å; H469-N520 PolarHBondContact CE1-ND2 2.82Å; V516-N520 PolarHBondContact O-N 2.93Å; E517-N520 WeakPolarHBondContact O-CB 3.19Å; E517-N520 PolarHBondContact O-N 2.92Å; E517-N520 VanDerWaalsContact O-N 3.15Å; E517-N520 PolarHBondContact OE1-ND2 2.92Å; K518-N520 VanDerWaalsContact C-N 3.34Å; N520-F522 VanDerWaalsContact C-N 3.35Å; N520-F522 PolarHBondContact O-N 3.39Å; N520-A523 PolarHBondContact O-N 2.96Å; N520-M524 WeakPolarHBondContact O-CB 3.27Å; N520-M524 PolarHBondContact O-N 2.77Å
521	L	96.9	Very high	95.3	Very high	1 Å²	1	31.8 Å²	31.8	1%	0.005	16%	0.162	C	C	.	.	H	α-helix	trans	-59.9	-43.5	175.5	-68	170	0	0	0	111.5	M229 Y232 I233 W280 E517 K518 A523 M524 F525	M229-L521 HydrophobicContact SD-CD1 3.73Å; Y232-L521 HydrophobicContact CD1-CB 4.49Å; Y232-L521 HydrophobicContact CD1-CD1 4.32Å; Y232-L521 HydrophobicContact CE1-CB 4.09Å; I233-L521 HydrophobicContact CD1-CD1 4.16Å; I233-L521 HydrophobicContact CG1-CD1 3.77Å; W280-L521 HydrophobicContact CE3-CD2 4.39Å; W280-L521 HydrophobicContact CH2-CD2 3.48Å; W280-L521 VanDerWaalsContact CH2-CD2 3.48Å; W280-L521 HydrophobicContact CZ2-CD2 3.74Å; W280-L521 HydrophobicContact CZ3-CD2 3.83Å; E517-L521 HydrophobicContact CG-CD1 4.41Å; E517-L521 WeakPolarHBondContact O-CB 3.27Å; E517-L521 VanDerWaalsContact O-CG 3.3Å; E517-L521 WeakPolarHBondContact O-CG 3.46Å; E517-L521 PolarHBondContact O-N 3.14Å; K518-L521 PolarHBondContact O-N 3.11Å; L521-A523 VanDerWaalsContact C-N 3.32Å; L521-A523 PolarHBondContact O-N 2.83Å; L521-M524 PolarHBondContact O-N 2.71Å; L521-F525 HydrophobicContact CB-CD2 4.28Å; L521-F525 HydrophobicContact CB-CE2 4.38Å; L521-F525 HydrophobicContact CD2-CE2 4.07Å; L521-F525 WeakPolarHBondContact O-CB 3.04Å; L521-F525 WeakPolarHBondContact O-CD2 3.08Å; L521-F525 PolarHBondContact O-N 3.43Å
522	F	97.8	Very high	95.6	Very high	89 Å²	89	26.9 Å²	26.9	39%	0.39	14%	0.144	S	C	.	.	H	α-helix	trans	-56.2	-45.1	173.5	173.8	-105.1	0	0	0	112.1	F236 F461 K518 I519 N520 G526	F236-F522 AromaticContact CE1-CD2 3.72Å; F236-F522 HydrophobicContact CE1-CD2 3.72Å; F236-F522 HydrophobicContact CE1-CE2 4.23Å; F236-F522 AromaticContact CZ-CD2 3.88Å; F236-F522 HydrophobicContact CZ-CD2 3.88Å; F236-F522 HydrophobicContact CZ-CE2 4.47Å; F461-F522 HydrophobicContact CE1-CD1 4.47Å; F461-F522 AromaticContact CE1-CE1 3.87Å; F461-F522 HydrophobicContact CE1-CE1 3.87Å; F461-F522 HydrophobicContact CE1-CZ 4.27Å; K518-F522 VanDerWaalsContact O-CB 3.29Å; K518-F522 WeakPolarHBondContact O-CB 3.46Å; K518-F522 PolarHBondContact O-N 3.4Å; I519-F522 WeakPolarHBondContact O-CB 3.25Å; I519-F522 PolarHBondContact O-N 3.12Å; N520-F522 VanDerWaalsContact C-N 3.35Å; N520-F522 PolarHBondContact O-N 3.39Å; F522-G526 WeakPolarHBondContact O-CA 3.29Å; F522-G526 PolarHBondContact O-N 3.21Å
523	A	97.3	Very high	95.7	Very high	0 Å²	0	27 Å²	27	0%	0	14%	0.144	C	C	.	.	H	α-helix	trans	-68.9	-41.6	179.2	0	0	0	0	0	112.3	F461 I464 T465 I519 N520 L521 T527	F461-A523 HydrophobicContact CB-CB 4.38Å; F461-A523 HydrophobicContact CD1-CB 4.1Å; I464-A523 HydrophobicContact CB-CB 3.92Å; I464-A523 HydrophobicContact CG2-CB 3.74Å; T465-A523 WeakPolarHBondContact OG1-CB 3.35Å; I519-A523 WeakPolarHBondContact O-CB 3.37Å; I519-A523 PolarHBondContact O-N 2.98Å; N520-A523 PolarHBondContact O-N 2.96Å; L521-A523 VanDerWaalsContact C-N 3.32Å; L521-A523 PolarHBondContact O-N 2.83Å; A523-T527 PolarHBondContact O-N 3.12Å; A523-T527 PolarHBondContact O-OG1 2.66Å
524	M	95.6	Very high	95.5	Very high	20 Å²	20	25.2 Å²	25.2	10%	0.099	13%	0.131	C	C	.	.	H	α-helix	trans	-62.3	-56.4	177.6	-169.6	-172.2	-57.4	0	0	111.6	F273 W280 L324 N520 L521 T527	F273-M524 VanDerWaalsContact CE1-O 3.28Å; F273-M524 WeakPolarHBondContact CE1-O 3.32Å; W280-M524 HydrophobicContact CZ2-CE 4.19Å; W280-M524 HydrophobicContact CZ2-SD 4.11Å; L324-M524 HydrophobicContact CD1-CE 4.39Å; L324-M524 HydrophobicContact CD1-CG 4.36Å; L324-M524 HydrophobicContact CD1-SD 4.46Å; N520-M524 WeakPolarHBondContact O-CB 3.27Å; N520-M524 PolarHBondContact O-N 2.77Å; L521-M524 PolarHBondContact O-N 2.71Å; M524-T527 PolarHBondContact O-N 3.22Å
525	F	97.7	Very high	95.4	Very high	4 Å²	4	24 Å²	24	2%	0.018	12%	0.124	C	C	.	.	H	α-helix	trans	-67.8	-39.7	178.2	-72.1	-57.9	0	0	0	112.1	F236 T240 W280 L521 T527 G528 I529	F236-F525 HydrophobicContact CB-CB 4Å; F236-F525 HydrophobicContact CB-CD2 3.52Å; F236-F525 HydrophobicContact CB-CE2 4.14Å; F236-F525 HydrophobicContact CB-CG 3.84Å; F236-F525 HydrophobicContact CD1-CB 4.14Å; F236-F525 HydrophobicContact CG-CD2 4.45Å; T240-F525 HydrophobicContact CG2-CD1 4.19Å; T240-F525 WeakPolarHBondContact OG1-CB 3.44Å; T240-F525 WeakPolarHBondContact OG1-CD1 3.42Å; W280-F525 HydrophobicContact CB-CE1 4.35Å; W280-F525 HydrophobicContact CB-CZ 3.85Å; W280-F525 AromaticContact CD1-CE1 3.97Å; W280-F525 AromaticContact CD1-CZ 3.75Å; W280-F525 HydrophobicContact CD2-CZ 4.09Å; W280-F525 HydrophobicContact CG-CE1 4.21Å; W280-F525 AromaticContact CG-CZ 3.64Å; W280-F525 HydrophobicContact CG-CZ 3.64Å; L521-F525 HydrophobicContact CB-CD2 4.28Å; L521-F525 HydrophobicContact CB-CE2 4.38Å; L521-F525 HydrophobicContact CD2-CE2 4.07Å; L521-F525 WeakPolarHBondContact O-CB 3.04Å; L521-F525 WeakPolarHBondContact O-CD2 3.08Å; L521-F525 PolarHBondContact O-N 3.43Å; F525-T527 VanDerWaalsContact C-N 3.25Å; F525-T527 PolarHBondContact O-N 2.04Å; F525-G528 PolarHBondContact O-N 3.07Å; F525-I529 WeakPolarHBondContact O-CG1 3.36Å; F525-I529 PolarHBondContact O-N 3.2Å
526	G	96.6	Very high	95.2	Very high	7 Å²	7	25.6 Å²	25.6	7%	0.072	12%	0.122	C	C	.	.	H	α-helix	trans	-58.6	-34	176.1	0	0	0	0	0	113.2	F522 A530	F522-G526 WeakPolarHBondContact O-CA 3.29Å; F522-G526 PolarHBondContact O-N 3.21Å; G526-A530 WeakPolarHBondContact O-CB 3.44Å; G526-A530 PolarHBondContact O-N 3.03Å
527	T	95	Very high	94.9	Very high	10 Å²	10	25.6 Å²	25.6	6%	0.061	12%	0.122	C	C	.	.	H	α-helix	trans	-61.8	-49.3	171.2	-54.3	0	0	0	0	111.1	F273 A458 F461 A523 M524 F525 I529 A530 M531	F273-T527 HydrophobicContact CE1-CG2 4.31Å; F273-T527 HydrophobicContact CE2-CG2 3.77Å; F273-T527 HydrophobicContact CZ-CG2 3.42Å; F273-T527 VanDerWaalsContact CZ-CG2 3.42Å; A458-T527 HydrophobicContact CB-CG2 4.44Å; F461-T527 WeakPolarHBondContact CB-OG1 3.49Å; A523-T527 PolarHBondContact O-N 3.12Å; A523-T527 PolarHBondContact O-OG1 2.66Å; M524-T527 PolarHBondContact O-N 3.22Å; F525-T527 VanDerWaalsContact C-N 3.25Å; F525-T527 PolarHBondContact O-N 2.04Å; T527-I529 PolarHBondContact O-N 2.89Å; T527-A530 PolarHBondContact O-N 2.88Å; T527-M531 HydrophobicContact CG2-CG 4.37Å; T527-M531 VanDerWaalsContact O-CG 3.26Å; T527-M531 WeakPolarHBondContact O-CG 3.23Å; T527-M531 PolarHBondContact O-N 2.99Å
528	G	95.8	Very high	94.6	Very high	0 Å²	0	32.8 Å²	32.8	0%	0	15%	0.153	C	C	.	.	H	α-helix	trans	-59.7	-45.7	177.3	0	0	0	0	0	112.7	F525 M531 S532	F525-G528 PolarHBondContact O-N 3.07Å; G528-M531 PolarHBondContact O-N 3.14Å; G528-S532 PolarHBondContact O-N 3.49Å
529	I	96.7	Very high	94	Very high	39 Å²	39	31.9 Å²	31.9	20%	0.2	15%	0.151	C	C	.	.	H	α-helix	trans	-60.7	-48.8	175.5	-63.4	167.2	0	0	0	110.4	F236 V239 T240 F525 T527 M531 S532 T533	F236-I529 HydrophobicContact CD1-CD1 4.48Å; V239-I529 HydrophobicContact CG1-CD1 3.81Å; V239-I529 HydrophobicContact CG1-CG1 4.29Å; T240-I529 HydrophobicContact CG2-CG1 4.38Å; T240-I529 WeakPolarHBondContact OG1-CG1 3.45Å; F525-I529 WeakPolarHBondContact O-CG1 3.36Å; F525-I529 PolarHBondContact O-N 3.2Å; T527-I529 PolarHBondContact O-N 2.89Å; I529-M531 PolarHBondContact O-N 3.28Å; I529-S532 WeakPolarHBondContact O-CB 3.37Å; I529-S532 PolarHBondContact O-N 2.74Å; I529-S532 PolarHBondContact O-OG 3.38Å; I529-T533 PolarHBondContact O-N 3.34Å
530	A	94.9	Very high	93.6	Very high	9 Å²	9	28.7 Å²	28.7	7%	0.074	14%	0.135	C	C	.	.	H	α-helix	trans	-57.1	-48.2	178.4	0	0	0	0	0	112.4	F454 L457 F461 G526 T527 S532 T533	F454-A530 VanDerWaalsContact CE1-O 3.25Å; F454-A530 WeakPolarHBondContact CE1-O 3.31Å; L457-A530 HydrophobicContact CD2-CB 3.68Å; L457-A530 HydrophobicContact CG-CB 4.1Å; F461-A530 HydrophobicContact CE2-CB 3.95Å; G526-A530 WeakPolarHBondContact O-CB 3.44Å; G526-A530 PolarHBondContact O-N 3.03Å; T527-A530 PolarHBondContact O-N 2.88Å; A530-S532 VanDerWaalsContact C-N 3.26Å; A530-S532 PolarHBondContact O-N 3.31Å; A530-T533 PolarHBondContact O-N 3.02Å; A530-T533 VanDerWaalsContact O-N 3.14Å; A530-T533 PolarHBondContact O-OG1 3.17Å
531	M	92.9	Very high	93.4	Very high	2 Å²	2	34.7 Å²	34.7	1%	0.01	17%	0.167	C	C	.	.	H	α-helix	trans	-66.4	-27.5	-179.9	-64.1	-57.6	100.4	0	0	112.8	L266 V269 N270 L334 F454 A458 T527 G528 I529 T533 W534	L266-M531 HydrophobicContact CD2-SD 4.15Å; V269-M531 HydrophobicContact CG1-CB 4Å; V269-M531 HydrophobicContact CG1-CG 3.75Å; N270-M531 PolarHBondContact ND2-O 2.04Å; L334-M531 HydrophobicContact CD2-SD 4.3Å; F454-M531 HydrophobicContact CB-CE 3.93Å; F454-M531 HydrophobicContact CB-SD 4.45Å; F454-M531 HydrophobicContact CD1-CE 3.79Å; F454-M531 HydrophobicContact CG-CE 4.27Å; F454-M531 WeakPolarHBondContact O-CE 3.45Å; A458-M531 HydrophobicContact CB-CE 3.85Å; A458-M531 HydrophobicContact CB-SD 4.27Å; T527-M531 HydrophobicContact CG2-CG 4.37Å; T527-M531 VanDerWaalsContact O-CG 3.26Å; T527-M531 WeakPolarHBondContact O-CG 3.23Å; T527-M531 PolarHBondContact O-N 2.99Å; G528-M531 PolarHBondContact O-N 3.14Å; I529-M531 PolarHBondContact O-N 3.28Å; M531-T533 VanDerWaalsContact C-N 3.3Å; M531-T533 PolarHBondContact O-N 3.04Å; M531-W534 WeakPolarHBondContact O-CB 3.26Å; M531-W534 PolarHBondContact O-N 3.27Å
532	S	95.2	Very high	93	Very high	0 Å²	0	38.3 Å²	38.3	0%	0	19%	0.186	C	C	.	.	H	α-helix	trans	-66.4	-31.2	174.1	83.2	0	0	0	0	112.8	C243 T247 N270 G528 I529 A530 W534 V535	C243-S532 WeakPolarHBondContact CB-OG 3.47Å; T247-S532 WeakPolarHBondContact OG1-CA 3.5Å; T247-S532 WeakPolarHBondContact OG1-CB 3.36Å; T247-S532 PolarHBondContact OG1-O 2.98Å; N270-S532 VanDerWaalsContact OD1-CA 3.23Å; N270-S532 WeakPolarHBondContact OD1-CA 3.38Å; N270-S532 WeakPolarHBondContact OD1-CB 3.25Å; N270-S532 PolarHBondContact OD1-N 2.87Å; G528-S532 PolarHBondContact O-N 3.49Å; I529-S532 WeakPolarHBondContact O-CB 3.37Å; I529-S532 PolarHBondContact O-N 2.74Å; I529-S532 PolarHBondContact O-OG 3.38Å; A530-S532 VanDerWaalsContact C-N 3.26Å; A530-S532 PolarHBondContact O-N 3.31Å; S532-W534 PolarHBondContact O-N 2.82Å; S532-V535 WeakPolarHBondContact O-CG2 3.32Å; S532-V535 PolarHBondContact O-N 2.99Å
533	T	93.2	Very high	92.6	Very high	35 Å²	35	34.4 Å²	34.4	22%	0.215	17%	0.169	C	C	.	.	G	3₁₀ helix	trans	-67.6	-7.2	-178.4	71.3	0	0	0	0	113.4	R450 F454 I529 A530 M531 V535 W536	R450-T533 PolarHBondContact NH2-O 3.18Å; F454-T533 WeakPolarHBondContact CE1-OG1 3.41Å; F454-T533 VanDerWaalsContact CZ-OG1 3.22Å; F454-T533 WeakPolarHBondContact CZ-OG1 3.43Å; I529-T533 PolarHBondContact O-N 3.34Å; A530-T533 PolarHBondContact O-N 3.02Å; A530-T533 VanDerWaalsContact O-N 3.14Å; A530-T533 PolarHBondContact O-OG1 3.17Å; M531-T533 VanDerWaalsContact C-N 3.3Å; M531-T533 PolarHBondContact O-N 3.04Å; T533-V535 PolarHBondContact O-N 3.02Å; T533-W536 HydrophobicContact CG2-CD2 3.97Å; T533-W536 HydrophobicContact CG2-CE3 4.04Å; T533-W536 HydrophobicContact CG2-CH2 4.3Å; T533-W536 HydrophobicContact CG2-CZ2 4.23Å; T533-W536 HydrophobicContact CG2-CZ3 4.21Å; T533-W536 WeakPolarHBondContact O-CB 3.49Å; T533-W536 PolarHBondContact O-N 3.1Å
534	W	89	Confident	92.3	Very high	7 Å²	7	39 Å²	39	3%	0.027	19%	0.186	C	C	.	.	G	3₁₀ helix	trans	-51.6	-43.3	168.2	178.7	-104.8	0	0	0	112.3	F251 L266 R450 L451 F454 M531 S532 W536 T537 P598	F251-W534 AromaticContact CZ-CD1 3.9Å; L266-W534 HydrophobicContact CD1-CB 4.03Å; L266-W534 HydrophobicContact CD1-CD2 3.31Å; L266-W534 HydrophobicContact CD1-CE3 3.68Å; L266-W534 HydrophobicContact CD1-CG 3.44Å; L266-W534 VanDerWaalsContact CD1-CG 3.44Å; L266-W534 HydrophobicContact CD1-CZ2 4.32Å; L266-W534 HydrophobicContact CD1-CZ3 4.32Å; R450-W534 HydrophobicContact CG-CE3 4.45Å; R450-W534 HydrophobicContact CG-CZ3 4.05Å; R450-W534 VanDerWaalsContact CZ-O 3.24Å; R450-W534 PolarHBondContact NH1-O 3Å; R450-W534 PolarHBondContact NH2-O 3.29Å; L451-W534 HydrophobicContact CB-CZ3 4.36Å; L451-W534 HydrophobicContact CD1-CZ3 4.32Å; F454-W534 AromaticContact CD2-CE3 3.67Å; F454-W534 HydrophobicContact CD2-CE3 3.67Å; F454-W534 HydrophobicContact CD2-CZ3 4.16Å; F454-W534 AromaticContact CE2-CE3 3.66Å; F454-W534 HydrophobicContact CE2-CE3 3.66Å; F454-W534 HydrophobicContact CE2-CZ3 4.34Å; M531-W534 WeakPolarHBondContact O-CB 3.26Å; M531-W534 PolarHBondContact O-N 3.27Å; S532-W534 PolarHBondContact O-N 2.82Å; W534-W536 VanDerWaalsContact C-N 3.28Å; W534-W536 PolarHBondContact O-N 2.85Å; W534-T537 WeakPolarHBondContact O-CG2 3.39Å; W534-P598 WeakPolarHBondContact CZ2-O 3.47Å
535	V	91.5	Very high	92	Very high	0 Å²	0	45.9 Å²	45.9	0%	0	21%	0.211	C	C	.	.	G	3₁₀ helix	trans	-84.3	3.9	179.1	-59.7	0	0	0	0	113.5	F246 T247 T250 F251 S532 T533 T537 T540	F246-V535 HydrophobicContact CD1-CG2 4.1Å; F246-V535 HydrophobicContact CE1-CG2 3.9Å; T247-V535 HydrophobicContact CG2-CG1 3.92Å; T247-V535 HydrophobicContact CG2-CG2 3.94Å; T247-V535 WeakPolarHBondContact OG1-CG2 3.5Å; T250-V535 HydrophobicContact CG2-CB 4.06Å; T250-V535 HydrophobicContact CG2-CG1 4.12Å; F251-V535 HydrophobicContact CD2-CG1 3.94Å; F251-V535 HydrophobicContact CE2-CG1 3.64Å; F251-V535 HydrophobicContact CZ-CG1 4.44Å; S532-V535 WeakPolarHBondContact O-CG2 3.32Å; S532-V535 PolarHBondContact O-N 2.99Å; T533-V535 PolarHBondContact O-N 3.02Å; V535-T537 VanDerWaalsContact C-N 3.25Å; V535-T537 PolarHBondContact O-N 3.1Å; V535-T540 WeakPolarHBondContact O-CB 3.46Å; V535-T540 WeakPolarHBondContact O-CG2 3.34Å; V535-T540 PolarHBondContact O-OG1 2.92Å
536	W	92.1	Very high	91.5	Very high	151 Å²	151	49.1 Å²	49.1	57%	0.572	22%	0.223	S	C	*	.			trans	-81.6	74.4	179	-66	22.2	0	0	0	110.2	T533 W534	T533-W536 HydrophobicContact CG2-CD2 3.97Å; T533-W536 HydrophobicContact CG2-CE3 4.04Å; T533-W536 HydrophobicContact CG2-CH2 4.3Å; T533-W536 HydrophobicContact CG2-CZ2 4.23Å; T533-W536 HydrophobicContact CG2-CZ3 4.21Å; T533-W536 WeakPolarHBondContact O-CB 3.49Å; T533-W536 PolarHBondContact O-N 3.1Å; W534-W536 VanDerWaalsContact C-N 3.28Å; W534-W536 PolarHBondContact O-N 2.85Å
537	T	89.2	Confident	91.1	Very high	24 Å²	24	50.2 Å²	50.2	15%	0.147	23%	0.228	C	C	.	.	S	Bend	trans	-139	160.8	-173.6	76.2	0	0	0	0	112.2	W534 V535 A539 T540 P598	W534-T537 WeakPolarHBondContact O-CG2 3.39Å; V535-T537 VanDerWaalsContact C-N 3.25Å; V535-T537 PolarHBondContact O-N 3.1Å; T537-A539 PolarHBondContact O-N 3.16Å; T537-A539 PolarHBondContact OG1-N 3.46Å; T537-T540 WeakPolarHBondContact O-CB 3.37Å; T537-T540 PolarHBondContact O-N 2.67Å; T537-T540 VanDerWaalsContact O-N 3.09Å; T537-T540 PolarHBondContact OG1-OG1 2.86Å; T537-P598 HydrophobicContact CG2-CB 4.31Å; T537-P598 HydrophobicContact CG2-CG 3.77Å
538	K	87.9	Confident	90.8	Very high	184 Å²	184	58.1 Å²	58.1	80%	0.8	26%	0.257	S	S	*	.	H	α-helix	trans	-59.8	-24.4	173.7	-66.8	180	180	174.1	0	113.3
539	A	84.6	Confident	90.4	Very high	14 Å²	14	58.9 Å²	58.9	12%	0.116	26%	0.262	C	S	.	.	H	α-helix	trans	-70.9	-34.4	176	0	0	0	0	0	112.3	T537 L541 L542 I543 P598 V599	T537-A539 PolarHBondContact O-N 3.16Å; T537-A539 PolarHBondContact OG1-N 3.46Å; A539-L541 VanDerWaalsContact C-N 3.34Å; A539-L541 PolarHBondContact O-N 2.93Å; A539-L542 CarbonylContact O-C 3.55Å; A539-L542 WeakPolarHBondContact O-CA 3.41Å; A539-L542 WeakPolarHBondContact O-CB 3.08Å; A539-L542 PolarHBondContact O-N 2.79Å; A539-I543 WeakPolarHBondContact O-CG1 3Å; A539-I543 PolarHBondContact O-N 3.13Å; A539-P598 HydrophobicContact CB-CG 4.43Å; A539-V599 HydrophobicContact CB-CG2 4.28Å
540	T	90.1	Very high	89.8	Confident	4 Å²	4	65.6 Å²	65.6	3%	0.025	29%	0.285	C	S	.	.	H	α-helix	trans	-63.6	-38.8	177.9	-58.9	0	0	0	0	112.1	F246 T250 V535 T537 L542 I543 W544	F246-T540 HydrophobicContact CE1-CG2 4.25Å; F246-T540 HydrophobicContact CZ-CG2 3.72Å; T250-T540 HydrophobicContact CG2-CG2 3.6Å; V535-T540 WeakPolarHBondContact O-CB 3.46Å; V535-T540 WeakPolarHBondContact O-CG2 3.34Å; V535-T540 PolarHBondContact O-OG1 2.92Å; T537-T540 WeakPolarHBondContact O-CB 3.37Å; T537-T540 PolarHBondContact O-N 2.67Å; T537-T540 VanDerWaalsContact O-N 3.09Å; T537-T540 PolarHBondContact OG1-OG1 2.86Å; T540-L542 VanDerWaalsContact C-N 3.26Å; T540-L542 PolarHBondContact O-N 3.22Å; T540-I543 PolarHBondContact O-N 3.06Å; T540-W544 PolarHBondContact O-N 3.41Å
541	L	91.3	Very high	89.5	Confident	128 Å²	128	71.7 Å²	71.7	67%	0.67	32%	0.316	S	S	*	.	H	α-helix	trans	-60.8	-35.3	171.2	-60.6	175.6	0	0	0	112.2	A539 R545	A539-L541 VanDerWaalsContact C-N 3.34Å; A539-L541 PolarHBondContact O-N 2.93Å; L541-R545 VanDerWaalsContact O-CB 3.24Å; L541-R545 WeakPolarHBondContact O-CB 3.44Å; L541-R545 PolarHBondContact O-N 2.81Å
542	L	88.6	Confident	89.2	Confident	78 Å²	78	75 Å²	75	41%	0.408	34%	0.336	S	S	.	.	H	α-helix	trans	-74.5	-33.7	175.6	-64	174.4	0	0	0	112.7	A539 T540 R546	A539-L542 CarbonylContact O-C 3.55Å; A539-L542 WeakPolarHBondContact O-CA 3.41Å; A539-L542 WeakPolarHBondContact O-CB 3.08Å; A539-L542 PolarHBondContact O-N 2.79Å; T540-L542 VanDerWaalsContact C-N 3.26Å; T540-L542 PolarHBondContact O-N 3.22Å; L542-R546 WeakPolarHBondContact O-CB 3.4Å; L542-R546 PolarHBondContact O-N 3.05Å; L542-R546 VanDerWaalsContact O-N 3.12Å
543	I	89.5	Confident	88.1	Confident	6 Å²	6	78 Å²	78	3%	0.031	37%	0.367	C	S	.	.	H	α-helix	trans	-63.4	-56.9	172.4	-68.1	164.4	0	0	0	108.6	A253 D254 A539 T540 R545 R546 T547 V599	A253-I543 HydrophobicContact CB-CG2 3.93Å; D254-I543 HydrophobicContact CB-CD1 3.89Å; D254-I543 HydrophobicContact CB-CG1 4.2Å; D254-I543 HydrophobicContact CB-CG2 4.14Å; A539-I543 WeakPolarHBondContact O-CG1 3Å; A539-I543 PolarHBondContact O-N 3.13Å; T540-I543 PolarHBondContact O-N 3.06Å; I543-R545 VanDerWaalsContact C-N 3.35Å; I543-R545 PolarHBondContact O-N 3.48Å; I543-R546 WeakPolarHBondContact O-CB 3.46Å; I543-R546 PolarHBondContact O-N 3.21Å; I543-T547 PolarHBondContact O-N 3.18Å; I543-T547 PolarHBondContact O-OG1 3.19Å; I543-T547 VanDerWaalsContact O-OG1 3.11Å; I543-V599 HydrophobicContact CD1-CB 4.5Å; I543-V599 HydrophobicContact CD1-CG2 4.2Å
544	W	91.8	Very high	86.6	Confident	98 Å²	98	82.8 Å²	82.8	37%	0.371	39%	0.387	S	S	.	.	H	α-helix	trans	-60.8	-38.7	-179.7	-81.6	100.3	0	0	0	113.4	F246 A249 T250 T540 R546 T547 W548	F246-W544 HydrophobicContact CD2-CZ2 4.47Å; F246-W544 HydrophobicContact CE2-CZ2 4.42Å; F246-W544 AromaticContact CE2-NE1 3.47Å; F246-W544 AromaticContact CZ-NE1 3.96Å; A249-W544 HydrophobicContact CB-CH2 4.23Å; A249-W544 HydrophobicContact CB-CZ2 3.92Å; T250-W544 PolarHBondContact OG1-NE1 3.45Å; T540-W544 PolarHBondContact O-N 3.41Å; W544-R546 PolarHBondContact O-N 3.11Å; W544-T547 PolarHBondContact O-N 3.17Å; W544-W548 VanDerWaalsContact O-CB 3.28Å; W544-W548 WeakPolarHBondContact O-CB 3.36Å; W544-W548 PolarHBondContact O-N 3.01Å
545	R	89.4	Confident	84.6	Confident	163 Å²	163	86.5 Å²	86.5	62%	0.615	41%	0.414	S	S	*	.	H	α-helix	trans	-58.6	-45.8	170.9	177.2	178.5	168.7	171.3	-1.1	111.9	L541 I543 W548 C549	L541-R545 VanDerWaalsContact O-CB 3.24Å; L541-R545 WeakPolarHBondContact O-CB 3.44Å; L541-R545 PolarHBondContact O-N 2.81Å; I543-R545 VanDerWaalsContact C-N 3.35Å; I543-R545 PolarHBondContact O-N 3.48Å; R545-W548 PolarHBondContact O-N 3.34Å; R545-C549 PolarHBondContact O-N 3.3Å; R545-C549 PolarHBondContact O-SG 3.43Å; R545-C549 VanDerWaalsContact O-SG 3.32Å
546	R	85.6	Confident	82.4	Confident	73 Å²	73	91.3 Å²	91.3	28%	0.275	44%	0.44	S	S	.	.	H	α-helix	trans	-68	-39.4	-178.4	-154.1	-168	-47.7	143.2	7.4	111.4	D254 L542 I543 W544 R550	D254-R546 IonicContact OD1-NH1 3.98Å; L542-R546 WeakPolarHBondContact O-CB 3.4Å; L542-R546 PolarHBondContact O-N 3.05Å; L542-R546 VanDerWaalsContact O-N 3.12Å; I543-R546 WeakPolarHBondContact O-CB 3.46Å; I543-R546 PolarHBondContact O-N 3.21Å; W544-R546 PolarHBondContact O-N 3.11Å; R546-R550 WeakPolarHBondContact O-CB 3.44Å; R546-R550 VanDerWaalsContact O-CG 3.27Å; R546-R550 WeakPolarHBondContact O-CG 3.05Å; R546-R550 PolarHBondContact O-N 3.38Å; R546-R550 VanDerWaalsContact O-N 3.09Å
547	T	88.7	Confident	79.9	Confident	29 Å²	29	90.4 Å²	90.4	18%	0.178	45%	0.446	C	S	.	.	H	α-helix	trans	-62.5	-47.1	173.3	-59.9	0	0	0	0	110.8	I543 W544 R550 L551	I543-T547 PolarHBondContact O-N 3.18Å; I543-T547 PolarHBondContact O-OG1 3.19Å; I543-T547 VanDerWaalsContact O-OG1 3.11Å; W544-T547 PolarHBondContact O-N 3.17Å; T547-R550 PolarHBondContact O-N 3.03Å; T547-L551 HydrophobicContact CG2-CD1 3.82Å; T547-L551 WeakPolarHBondContact O-CB 3.04Å; T547-L551 PolarHBondContact O-N 3.08Å
548	W	89.6	Confident	77.4	Confident	177 Å²	177	96.9 Å²	96.9	67%	0.67	48%	0.475	S	S	*	.	H	α-helix	trans	-60.2	-50.4	176.3	-173.8	-96.4	0	0	0	112.4	W544 R545 R550 L551 T552	W544-W548 VanDerWaalsContact O-CB 3.28Å; W544-W548 WeakPolarHBondContact O-CB 3.36Å; W544-W548 PolarHBondContact O-N 3.01Å; R545-W548 PolarHBondContact O-N 3.34Å; W548-R550 VanDerWaalsContact C-N 3.29Å; W548-R550 PolarHBondContact O-N 2.82Å; W548-L551 PolarHBondContact O-N 3.41Å; W548-L551 VanDerWaalsContact O-N 3.09Å; W548-T552 HydrophobicContact CD2-CG2 4.29Å; W548-T552 HydrophobicContact CG-CG2 4.44Å; W548-T552 HydrophobicContact CZ2-CG2 4.17Å; W548-T552 WeakPolarHBondContact O-CG2 3.27Å; W548-T552 PolarHBondContact O-N 3.05Å; W548-T552 PolarHBondContact O-OG1 3.25Å; W548-T552 VanDerWaalsContact O-OG1 3.12Å
549	C	86.2	Confident	75.1	Confident	16 Å²	16	92.2 Å²	92.2	11%	0.108	46%	0.463	C	S	.	.	H	α-helix	trans	-58.8	-38.7	177.4	-69	0	0	0	0	112.7	R545 T552 G553 Q554	R545-C549 PolarHBondContact O-N 3.3Å; R545-C549 PolarHBondContact O-SG 3.43Å; R545-C549 VanDerWaalsContact O-SG 3.32Å; C549-T552 PolarHBondContact O-OG1 3.5Å; C549-G553 PolarHBondContact O-N 2.04Å; C549-Q554 CarbonylContact C-O 3.54Å; C549-Q554 HydrophobicContact CB-CB 4.5Å; C549-Q554 CarbonylContact O-C 3.5Å; C549-Q554 PolarHBondContact O-N 2.96Å; C549-Q554 VanDerWaalsContact O-O 3.1Å
550	R	84.1	Confident	73.1	Confident	180 Å²	180	98.9 Å²	98.9	68%	0.679	49%	0.49	S	S	*	.	H	α-helix	trans	-64.8	-42	173.6	-74.1	171.5	176.2	-177.6	-2.9	112.5	R546 T547 W548 G553	R546-R550 WeakPolarHBondContact O-CB 3.44Å; R546-R550 VanDerWaalsContact O-CG 3.27Å; R546-R550 WeakPolarHBondContact O-CG 3.05Å; R546-R550 PolarHBondContact O-N 3.38Å; R546-R550 VanDerWaalsContact O-N 3.09Å; T547-R550 PolarHBondContact O-N 3.03Å; W548-R550 VanDerWaalsContact C-N 3.29Å; W548-R550 PolarHBondContact O-N 2.82Å; R550-G553 PolarHBondContact O-N 3.48Å
551	L	88.3	Confident	70.5	Confident	137 Å²	137	110 Å²	110	72%	0.717	53%	0.531	S	S	*	.	H	α-helix	trans	-68	-35.6	177.3	-91.9	147.2	0	0	0	112.9	T547 W548 G553	T547-L551 HydrophobicContact CG2-CD1 3.82Å; T547-L551 WeakPolarHBondContact O-CB 3.04Å; T547-L551 PolarHBondContact O-N 3.08Å; W548-L551 PolarHBondContact O-N 3.41Å; W548-L551 VanDerWaalsContact O-N 3.09Å; L551-G553 VanDerWaalsContact C-N 3.27Å; L551-G553 PolarHBondContact O-N 3.17Å
552	T	87.4	Confident	68.6	Low	70 Å²	70	107.4 Å²	107.4	43%	0.429	52%	0.517	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.8	5.2	177.5	60	0	0	0	0	113.9	W548 C549 Q554	W548-T552 HydrophobicContact CD2-CG2 4.29Å; W548-T552 HydrophobicContact CG-CG2 4.44Å; W548-T552 HydrophobicContact CZ2-CG2 4.17Å; W548-T552 WeakPolarHBondContact O-CG2 3.27Å; W548-T552 PolarHBondContact O-N 3.05Å; W548-T552 PolarHBondContact O-OG1 3.25Å; W548-T552 VanDerWaalsContact O-OG1 3.12Å; C549-T552 PolarHBondContact O-OG1 3.5Å; T552-Q554 PolarHBondContact O-N 2.63Å; T552-Q554 VanDerWaalsContact O-N 3.17Å
553	G	72.6	Confident	66.6	Low	64 Å²	64	111.5 Å²	111.5	66%	0.66	53%	0.532	S	S	*	.	T	Hydrogen-bonded Turn	trans	68.6	8	179	0	0	0	0	0	114.8	C549 R550 L551 S555	C549-G553 PolarHBondContact O-N 2.04Å; R550-G553 PolarHBondContact O-N 3.48Å; L551-G553 VanDerWaalsContact C-N 3.27Å; L551-G553 PolarHBondContact O-N 3.17Å; G553-S555 PolarHBondContact O-N 2.91Å; G553-S555 VanDerWaalsContact O-N 3.09Å
554	Q	61.5	Low	64.7	Low	136 Å²	136	119.3 Å²	119.3	64%	0.636	57%	0.565	S	S	*	*			trans	-76.4	94.8	168.3	-75.9	-170.5	-16.4	0	0	108.5	C549 T552 D556	C549-Q554 CarbonylContact C-O 3.54Å; C549-Q554 HydrophobicContact CB-CB 4.5Å; C549-Q554 CarbonylContact O-C 3.5Å; C549-Q554 PolarHBondContact O-N 2.96Å; C549-Q554 VanDerWaalsContact O-O 3.1Å; T552-Q554 PolarHBondContact O-N 2.63Å; T552-Q554 VanDerWaalsContact O-N 3.17Å; Q554-D556 PolarHBondContact O-N 3.45Å
555	S	46.3	Very low	63	Low	84 Å²	84	118.4 Å²	118.4	59%	0.587	57%	0.574	S	S	*	*			trans	-63.5	121.4	172.3	70.4	0	0	0	0	109.5	G553 D557	G553-S555 PolarHBondContact O-N 2.91Å; G553-S555 VanDerWaalsContact O-N 3.09Å; S555-D557 WeakPolarHBondContact CB-OD2 3.35Å; S555-D557 PolarHBondContact O-N 2.86Å; S555-D557 PolarHBondContact OG-OD2 3.21Å
556	D	46.3	Very low	61.4	Low	101 Å²	101	118.1 Å²	118.1	54%	0.54	58%	0.578	S	S	.	*			trans	-78	43.8	173.9	-146.8	16	0	0	0	108.6	Q554 E558	Q554-D556 PolarHBondContact O-N 3.45Å; D556-E558 PolarHBondContact O-N 3.45Å
557	D	39.4	Very low	60	Low	132 Å²	132	117.2 Å²	117.2	71%	0.706	58%	0.577	S	S	*	*			trans	-77.8	35.8	-177.4	-78.4	-33.8	0	0	0	112.2	S555 P559	S555-D557 WeakPolarHBondContact CB-OD2 3.35Å; S555-D557 PolarHBondContact O-N 2.86Å; S555-D557 PolarHBondContact OG-OD2 3.21Å; D557-P559 VanDerWaalsContact C-CD 3.41Å; D557-P559 WeakPolarHBondContact O-CD 3.2Å
558	E	36.7	Very low	58.6	Low	160 Å²	160	119.6 Å²	119.6	75%	0.748	59%	0.588	S	S	*	*			trans	-93.3	88.3	157.8	-173.5	97.3	-158.4	0	0	106.7	D556 K560	D556-E558 PolarHBondContact O-N 3.45Å; E558-K560 PolarHBondContact O-N 2.89Å
559	P	38.5	Very low	57.4	Low	86 Å²	86	114 Å²	114	56%	0.558	58%	0.579	S	S	*	*			trans	-58.5	109.3	176	24.3	-33.9	0	0	0	108	D557 R561 M590	D557-P559 VanDerWaalsContact C-CD 3.41Å; D557-P559 WeakPolarHBondContact O-CD 3.2Å; P559-R561 PolarHBondContact O-N 3.44Å; P559-M590 HydrophobicContact CB-SD 4.43Å
560	K	42.8	Very low	56.1	Low	154 Å²	154	119 Å²	119	67%	0.67	60%	0.599	S	S	*	*			trans	-61.9	87.3	-176	-76.1	-179.2	-176.2	165.4	0	110.1	E558 I562	E558-K560 PolarHBondContact O-N 2.89Å; K560-I562 PolarHBondContact O-N 3.31Å
561	R	36.9	Very low	55	Low	238 Å²	238	111.1 Å²	111.1	90%	0.898	57%	0.573	S	S	*	*			trans	-48.5	107.4	-174	-133.8	174.9	-174.7	169.4	4.2	109.1	P559 K563	P559-R561 PolarHBondContact O-N 3.44Å; R561-K563 PolarHBondContact O-N 3.02Å; R561-K563 VanDerWaalsContact O-N 3.09Å
562	I	49.7	Very low	53.7	Low	74 Å²	74	109.3 Å²	109.3	38%	0.379	56%	0.559	S	S	.	*			trans	-53.9	122.2	178.1	-60	172	0	0	0	106.8	K560 K564 K566 M567	K560-I562 PolarHBondContact O-N 3.31Å; I562-K564 PolarHBondContact O-N 3.34Å; I562-K564 VanDerWaalsContact O-N 3.13Å; I562-K566 HydrophobicContact CG2-CB 4Å; I562-M567 HydrophobicContact CB-CE 4.14Å; I562-M567 HydrophobicContact CG2-CB 4.42Å
563	K	48	Very low	52.8	Low	164 Å²	164	110.4 Å²	110.4	71%	0.713	57%	0.569	S	S	*	*			trans	-51.5	126.3	179.5	-77.8	-174.4	176.7	-179.5	0	108.2	R561 S565 K566 M567	R561-K563 PolarHBondContact O-N 3.02Å; R561-K563 VanDerWaalsContact O-N 3.09Å; K563-S565 PolarHBondContact O-N 2.93Å; K563-K566 PolarHBondContact O-N 3.22Å; K563-M567 PolarHBondContact O-N 3.22Å
564	K	48.9	Very low	52.2	Low	169 Å²	169	110.7 Å²	110.7	74%	0.735	55%	0.553	S	S	*	*	H	α-helix	trans	-47.5	-34.5	-175.2	-68.2	-176.4	175.6	-175.3	0	112.8	I562 M567 I568	I562-K564 PolarHBondContact O-N 3.34Å; I562-K564 VanDerWaalsContact O-N 3.13Å; K564-M567 PolarHBondContact O-N 3.21Å; K564-I568 WeakPolarHBondContact O-CB 3.49Å; K564-I568 WeakPolarHBondContact O-CD1 3.37Å; K564-I568 WeakPolarHBondContact O-CG1 3.27Å; K564-I568 PolarHBondContact O-N 3.32Å
565	S	56.4	Low	52.1	Low	80 Å²	80	110.7 Å²	110.7	56%	0.559	55%	0.547	S	S	*	.	H	α-helix	trans	-59.9	-41	174.3	52.6	0	0	0	0	115	K563 A569	K563-S565 PolarHBondContact O-N 2.93Å; S565-A569 VanDerWaalsContact O-CB 3.31Å; S565-A569 WeakPolarHBondContact O-CB 3.26Å; S565-A569 PolarHBondContact O-N 2.9Å
566	K	55.1	Low	52.6	Low	157 Å²	157	112.4 Å²	112.4	68%	0.683	55%	0.545	S	S	*	.	H	α-helix	trans	-69.4	-36.5	176.3	-83.8	-166.5	169.4	-166.9	0	112.1	I562 K563 A569 K570	I562-K566 HydrophobicContact CG2-CB 4Å; K563-K566 PolarHBondContact O-N 3.22Å; K566-A569 PolarHBondContact O-N 3.19Å; K566-K570 WeakPolarHBondContact O-CB 3.47Å; K566-K570 PolarHBondContact O-N 3.02Å
567	M	57.4	Low	53.4	Low	54 Å²	54	111.4 Å²	111.4	27%	0.266	54%	0.537	S	S	.	.	H	α-helix	trans	-67.6	-44.4	176.7	-169	-178.5	-75.2	0	0	111	I562 K563 K564 K570 A571 F588 W617	I562-M567 HydrophobicContact CB-CE 4.14Å; I562-M567 HydrophobicContact CG2-CB 4.42Å; K563-M567 PolarHBondContact O-N 3.22Å; K564-M567 PolarHBondContact O-N 3.21Å; M567-K570 PolarHBondContact O-N 2.96Å; M567-A571 PolarHBondContact O-N 2.88Å; M567-F588 HydrophobicContact CG-CD1 4.47Å; M567-F588 HydrophobicContact CG-CE1 4.18Å; M567-W617 HydrophobicContact CG-CH2 4.14Å; M567-W617 HydrophobicContact CG-CZ2 4.22Å; M567-W617 HydrophobicContact SD-CH2 3.76Å; M567-W617 HydrophobicContact SD-CZ2 3.37Å; M567-W617 WeakPolarHBondContact SD-CZ2 3.38Å
568	I	59.2	Low	54.2	Low	79 Å²	79	107.3 Å²	107.3	41%	0.405	52%	0.515	S	S	.	.	H	α-helix	trans	-62.4	-43.7	173.3	-67.8	163.2	0	0	0	111	K564 K570 A571 F572	K564-I568 WeakPolarHBondContact O-CB 3.49Å; K564-I568 WeakPolarHBondContact O-CD1 3.37Å; K564-I568 WeakPolarHBondContact O-CG1 3.27Å; K564-I568 PolarHBondContact O-N 3.32Å; I568-K570 PolarHBondContact O-N 3.31Å; I568-A571 PolarHBondContact O-N 3.46Å; I568-F572 HydrophobicContact CG2-CD2 4.3Å; I568-F572 WeakPolarHBondContact O-CB 3.44Å; I568-F572 PolarHBondContact O-N 3.4Å
569	A	64.5	Low	55.1	Low	59 Å²	59	105 Å²	105	49%	0.488	51%	0.508	S	S	.	.	H	α-helix	trans	-61.7	-42.5	177.8	0	0	0	0	0	112.5	S565 K566 A571 F572 S573	S565-A569 VanDerWaalsContact O-CB 3.31Å; S565-A569 WeakPolarHBondContact O-CB 3.26Å; S565-A569 PolarHBondContact O-N 2.9Å; K566-A569 PolarHBondContact O-N 3.19Å; A569-A571 VanDerWaalsContact C-N 3.35Å; A569-F572 PolarHBondContact O-N 2.9Å; A569-S573 PolarHBondContact O-N 3.12Å; A569-S573 PolarHBondContact O-OG 3.25Å
570	K	58.4	Low	56.1	Low	121 Å²	121	108.4 Å²	108.4	53%	0.526	52%	0.516	S	S	.	.	H	α-helix	trans	-68.9	-31.1	177.4	-164.9	175.3	-177.8	-176.7	0	112.7	K566 M567 I568 S573	K566-K570 WeakPolarHBondContact O-CB 3.47Å; K566-K570 PolarHBondContact O-N 3.02Å; M567-K570 PolarHBondContact O-N 2.96Å; I568-K570 PolarHBondContact O-N 3.31Å; K570-S573 WeakPolarHBondContact CA-OG 3.05Å; K570-S573 PolarHBondContact O-OG 3.46Å
571	A	59.9	Low	56.9	Low	15 Å²	15	105.3 Å²	105.3	12%	0.124	51%	0.507	C	S	.	.	H	α-helix	trans	-70.2	-43	170.4	0	0	0	0	0	111.7	M567 I568 A569 S573 K574 R575 F588	M567-A571 PolarHBondContact O-N 2.88Å; I568-A571 PolarHBondContact O-N 3.46Å; A569-A571 VanDerWaalsContact C-N 3.35Å; A571-S573 VanDerWaalsContact C-N 3.35Å; A571-S573 PolarHBondContact O-N 3.25Å; A571-K574 PolarHBondContact O-N 2.9Å; A571-R575 PolarHBondContact O-N 2.93Å; A571-F588 HydrophobicContact CB-CZ 4.4Å
572	F	62.5	Low	57.8	Low	99 Å²	99	99.4 Å²	99.4	43%	0.434	50%	0.499	S	S	.	.	H	α-helix	trans	-63.4	-37.1	177.5	-116.5	-92.2	0	0	0	112.8	I568 A569 K574 R575 A630	I568-F572 HydrophobicContact CG2-CD2 4.3Å; I568-F572 WeakPolarHBondContact O-CB 3.44Å; I568-F572 PolarHBondContact O-N 3.4Å; A569-F572 PolarHBondContact O-N 2.9Å; F572-K574 VanDerWaalsContact C-N 3.28Å; F572-K574 PolarHBondContact O-N 3.18Å; F572-R575 WeakPolarHBondContact O-CB 3.02Å; F572-R575 WeakPolarHBondContact O-CG 3.4Å; F572-R575 PolarHBondContact O-N 3.19Å; F572-A630 HydrophobicContact CE2-CB 4.14Å; F572-A630 HydrophobicContact CZ-CB 3.78Å
573	S	67.8	Low	57.8	Low	92 Å²	92	99.4 Å²	99.4	64%	0.643	52%	0.517	S	S	*	.	H	α-helix	trans	-67.6	-25.1	177.1	55.7	0	0	0	0	113.7	A569 K570 A571	A569-S573 PolarHBondContact O-N 3.12Å; A569-S573 PolarHBondContact O-OG 3.25Å; K570-S573 WeakPolarHBondContact CA-OG 3.05Å; K570-S573 PolarHBondContact O-OG 3.46Å; A571-S573 VanDerWaalsContact C-N 3.35Å; A571-S573 PolarHBondContact O-N 3.25Å
574	K	59.4	Low	58	Low	71 Å²	71	96.7 Å²	96.7	31%	0.309	51%	0.507	S	S	.	.	T	Hydrogen-bonded Turn	trans	-97	14.4	176.2	-80.8	-174.9	162	-79.7	0	113.6	A571 F572 H576 E577 L578 L586	A571-K574 PolarHBondContact O-N 2.9Å; F572-K574 VanDerWaalsContact C-N 3.28Å; F572-K574 PolarHBondContact O-N 3.18Å; K574-H576 PolarHBondContact O-N 3.38Å; K574-H576 VanDerWaalsContact O-N 3.13Å; K574-E577 WeakPolarHBondContact CD-OE2 3.07Å; K574-E577 WeakPolarHBondContact CE-OE2 3.45Å; K574-E577 VanDerWaalsContact CG-OE2 3.24Å; K574-E577 WeakPolarHBondContact CG-OE2 3.18Å; K574-E577 IonicContact NZ-OE1 2.77Å; K574-E577 PolarHBondContact NZ-OE1 2.97Å; K574-E577 IonicContact NZ-OE2 3.85Å; K574-E577 PolarHBondContact NZ-OE2 3.12Å; K574-E577 PolarHBondContact O-N 3.31Å; K574-L578 PolarHBondContact O-N 3.09Å; K574-L586 HydrophobicContact CD-CD2 4.35Å
575	R	60.5	Low	58	Low	136 Å²	136	96 Å²	96	51%	0.513	51%	0.506	S	S	.	.	H	α-helix	trans	-56.6	-31.3	-176.1	72.5	-177.7	-169.9	177.3	0.3	114.9	A571 F572 L579	A571-R575 PolarHBondContact O-N 2.93Å; F572-R575 WeakPolarHBondContact O-CB 3.02Å; F572-R575 WeakPolarHBondContact O-CG 3.4Å; F572-R575 PolarHBondContact O-N 3.19Å; R575-L579 WeakPolarHBondContact O-CG 3.43Å; R575-L579 PolarHBondContact O-N 3.07Å
576	H	56.1	Low	57.7	Low	119 Å²	119	94.4 Å²	94.4	55%	0.551	49%	0.492	S	S	*	.	H	α-helix	trans	-75.9	-34.2	-178.8	-75.6	-81.3	0	0	0	113	K574 L578 L579 Q580	K574-H576 PolarHBondContact O-N 3.38Å; K574-H576 VanDerWaalsContact O-N 3.13Å; H576-L578 VanDerWaalsContact C-N 3.33Å; H576-L579 PolarHBondContact O-N 3.19Å; H576-Q580 PolarHBondContact O-N 2.94Å
577	E	63.1	Low	57.2	Low	80 Å²	80	90.5 Å²	90.5	37%	0.374	48%	0.484	S	S	.	.	H	α-helix	trans	-63.8	-40.7	172.4	-65.2	171.8	164.7	0	0	110.9	K574 L579 Q580 N581	K574-E577 WeakPolarHBondContact CD-OE2 3.07Å; K574-E577 WeakPolarHBondContact CE-OE2 3.45Å; K574-E577 VanDerWaalsContact CG-OE2 3.24Å; K574-E577 WeakPolarHBondContact CG-OE2 3.18Å; K574-E577 IonicContact NZ-OE1 2.77Å; K574-E577 PolarHBondContact NZ-OE1 2.97Å; K574-E577 IonicContact NZ-OE2 3.85Å; K574-E577 PolarHBondContact NZ-OE2 3.12Å; K574-E577 PolarHBondContact O-N 3.31Å; E577-L579 VanDerWaalsContact C-N 3.3Å; E577-L579 PolarHBondContact O-N 2.93Å; E577-Q580 PolarHBondContact O-N 2.97Å; E577-N581 PolarHBondContact O-N 3.48Å
578	L	56.3	Low	56.5	Low	46 Å²	46	89.6 Å²	89.6	24%	0.241	48%	0.478	C	S	.	.	H	α-helix	trans	-67.5	-27.5	178	-62.1	170.7	0	0	0	113.7	K574 H576 N581 L586	K574-L578 PolarHBondContact O-N 3.09Å; H576-L578 VanDerWaalsContact C-N 3.33Å; L578-N581 CarbonylContact O-C 3.6Å; L578-L586 HydrophobicContact CD1-CD1 4.02Å; L578-L586 HydrophobicContact CD2-CD1 3.99Å; L578-L586 HydrophobicContact CD2-CD2 4.03Å; L578-L586 HydrophobicContact CD2-CG 3.84Å
579	L	54.9	Low	55.5	Low	113 Å²	113	88.3 Å²	88.3	59%	0.592	48%	0.476	S	S	*	.	H	α-helix	trans	-74.7	-32.5	174.2	-75.5	165.9	0	0	0	111.7	R575 H576 E577	R575-L579 WeakPolarHBondContact O-CG 3.43Å; R575-L579 PolarHBondContact O-N 3.07Å; H576-L579 PolarHBondContact O-N 3.19Å; E577-L579 VanDerWaalsContact C-N 3.3Å; E577-L579 PolarHBondContact O-N 2.93Å
580	Q	60.3	Low	54.3	Low	156 Å²	156	92.6 Å²	92.6	73%	0.729	49%	0.488	S	S	*	.	H	α-helix	trans	-79.5	-35.8	177.1	-72.7	178.2	-27.6	0	0	112.6	H576 E577	H576-Q580 PolarHBondContact O-N 2.94Å; E577-Q580 PolarHBondContact O-N 2.97Å
581	N	60.1	Low	52.9	Low	89 Å²	89	93.4 Å²	93.4	48%	0.476	49%	0.493	S	S	.	.			trans	-129.3	86.5	178.4	-70.5	-54.4	0	0	0	111.9	E577 L578 G583 Q584	E577-N581 PolarHBondContact O-N 3.48Å; L578-N581 CarbonylContact O-C 3.6Å; N581-G583 PolarHBondContact O-N 3.28Å; N581-G583 VanDerWaalsContact O-N 3.1Å; N581-Q584 HydrophobicContact CB-CB 3.82Å; N581-Q584 WeakPolarHBondContact O-CB 3.49Å; N581-Q584 PolarHBondContact O-N 3.09Å
582	P	55	Low	51.6	Low	115 Å²	115	98.2 Å²	98.2	75%	0.747	52%	0.521	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.3	-13.7	-177.4	25.6	-34.6	0	0	0	114.6
583	G	49.7	Very low	50.2	Low	73 Å²	73	97.9 Å²	97.9	75%	0.753	53%	0.528	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.1	0.3	174.1	0	0	0	0	0	115.2	N581 E585	N581-G583 PolarHBondContact O-N 3.28Å; N581-G583 VanDerWaalsContact O-N 3.1Å; G583-E585 PolarHBondContact O-N 3.5Å
584	Q	53.4	Low	48.6	Very low	107 Å²	107	97.5 Å²	97.5	50%	0.5	53%	0.525	S	S	.	.			trans	-80.2	113.9	-174.9	-168.2	168.8	10.9	0	0	111.6	N581 L586	N581-Q584 HydrophobicContact CB-CB 3.82Å; N581-Q584 WeakPolarHBondContact O-CB 3.49Å; N581-Q584 PolarHBondContact O-N 3.09Å; Q584-L586 PolarHBondContact O-N 2.9Å
585	E	48.9	Very low	47.4	Very low	155 Å²	155	99.2 Å²	99.2	72%	0.724	53%	0.534	S	S	*	.			trans	-68	124.6	177.9	-64.1	-161.6	149.6	0	0	111.8	G583 S587	G583-E585 PolarHBondContact O-N 3.5Å; E585-S587 PolarHBondContact O-N 3.18Å; E585-S587 VanDerWaalsContact O-N 3.13Å
586	L	50	Low	46.3	Very low	47 Å²	47	98.3 Å²	98.3	25%	0.246	54%	0.539	C	S	.	.			trans	-76.3	96.7	170.3	-71.1	173.2	0	0	0	110.1	K574 L578 Q584 F588	K574-L586 HydrophobicContact CD-CD2 4.35Å; L578-L586 HydrophobicContact CD1-CD1 4.02Å; L578-L586 HydrophobicContact CD2-CD1 3.99Å; L578-L586 HydrophobicContact CD2-CD2 4.03Å; L578-L586 HydrophobicContact CD2-CG 3.84Å; Q584-L586 PolarHBondContact O-N 2.9Å; L586-F588 HydrophobicContact CB-CD2 3.97Å; L586-F588 HydrophobicContact CB-CE2 3.49Å; L586-F588 VanDerWaalsContact CB-CE2 3.49Å; L586-F588 HydrophobicContact CB-CZ 4.3Å; L586-F588 HydrophobicContact CD1-CE2 3.87Å; L586-F588 HydrophobicContact CD1-CZ 4.06Å; L586-F588 HydrophobicContact CG-CE2 4.32Å; L586-F588 VanDerWaalsContact O-CD2 3.23Å; L586-F588 WeakPolarHBondContact O-CD2 3.39Å; L586-F588 PolarHBondContact O-N 2.03Å; L586-F588 VanDerWaalsContact O-N 3.07Å
587	S	43.4	Very low	45.5	Very low	74 Å²	74	93.2 Å²	93.2	52%	0.517	52%	0.519	S	S	.	.			trans	-70.4	99.4	169.4	54.6	0	0	0	0	110.9	E585 S589	E585-S587 PolarHBondContact O-N 3.18Å; E585-S587 VanDerWaalsContact O-N 3.13Å; S587-S589 PolarHBondContact O-N 2.94Å
588	F	43.7	Very low	44.5	Very low	35 Å²	35	91.5 Å²	91.5	15%	0.154	52%	0.515	C	S	.	.			trans	-85.5	84.1	169.7	-69.6	-96.3	0	0	0	109.3	M567 A571 L586 M590 V613 W617	M567-F588 HydrophobicContact CG-CD1 4.47Å; M567-F588 HydrophobicContact CG-CE1 4.18Å; A571-F588 HydrophobicContact CB-CZ 4.4Å; L586-F588 HydrophobicContact CB-CD2 3.97Å; L586-F588 HydrophobicContact CB-CE2 3.49Å; L586-F588 VanDerWaalsContact CB-CE2 3.49Å; L586-F588 HydrophobicContact CB-CZ 4.3Å; L586-F588 HydrophobicContact CD1-CE2 3.87Å; L586-F588 HydrophobicContact CD1-CZ 4.06Å; L586-F588 HydrophobicContact CG-CE2 4.32Å; L586-F588 VanDerWaalsContact O-CD2 3.23Å; L586-F588 WeakPolarHBondContact O-CD2 3.39Å; L586-F588 PolarHBondContact O-N 2.03Å; L586-F588 VanDerWaalsContact O-N 3.07Å; F588-M590 PolarHBondContact O-N 2.9Å; F588-V613 VanDerWaalsContact O-CG2 3.22Å; F588-V613 WeakPolarHBondContact O-CG2 3.48Å; F588-W617 AromaticContact CD2-CH2 3.81Å; F588-W617 HydrophobicContact CD2-CH2 3.81Å; F588-W617 AromaticContact CD2-CZ3 3.39Å; F588-W617 HydrophobicContact CD2-CZ3 3.39Å; F588-W617 AromaticContact CE2-CH2 3.61Å; F588-W617 HydrophobicContact CE2-CH2 3.61Å; F588-W617 AromaticContact CE2-CZ3 3.5Å; F588-W617 HydrophobicContact CE2-CZ3 3.5Å; F588-W617 HydrophobicContact CG-CH2 4.45Å; F588-W617 HydrophobicContact CG-CZ3 4.23Å; F588-W617 HydrophobicContact CZ-CH2 4.12Å; F588-W617 HydrophobicContact CZ-CZ3 4.44Å
589	S	37.7	Very low	43.9	Very low	52 Å²	52	89.4 Å²	89.4	36%	0.364	50%	0.504	S	S	.	.			trans	-56.6	131.1	-179.4	84.3	0	0	0	0	111.1	S587 H591 S610	S587-S589 PolarHBondContact O-N 2.94Å; S589-H591 PolarHBondContact O-N 3.4Å; S589-S610 WeakPolarHBondContact CB-O 3.28Å
590	M	38.4	Very low	43.3	Very low	149 Å²	149	85 Å²	85	73%	0.734	48%	0.484	S	S	*	.			trans	-89.3	44	-178.9	-157.6	179.3	69.4	0	0	111.6	P559 F588	P559-M590 HydrophobicContact CB-SD 4.43Å; F588-M590 PolarHBondContact O-N 2.9Å
591	H	30.4	Very low	42.4	Very low	138 Å²	138	79.4 Å²	79.4	64%	0.639	47%	0.468	S	S	*	.			trans	-67.4	137.2	162.2	-92	-72.6	0	0	0	109.9	S589 V593	S589-H591 PolarHBondContact O-N 3.4Å; H591-V593 PolarHBondContact O-N 2.92Å; H591-V593 VanDerWaalsContact O-N 3.14Å
592	T	33	Very low	41.7	Very low	116 Å²	116	78 Å²	78	71%	0.712	46%	0.46	S	S	*	.			trans	-39.1	123.4	165.2	47.6	0	0	0	0	109.2	S594	T592-S594 PolarHBondContact O-N 2.85Å
593	V	32.4	Very low	40.8	Very low	93 Å²	93	74.8 Å²	74.8	56%	0.564	44%	0.443	S	S	*	.			trans	-40.7	113.6	172.7	171.5	0	0	0	0	107.1	H591 H595	H591-V593 PolarHBondContact O-N 2.92Å; H591-V593 VanDerWaalsContact O-N 3.14Å; V593-H595 PolarHBondContact O-N 2.76Å
594	S	33.4	Very low	40.2	Very low	84 Å²	84	79.8 Å²	79.8	59%	0.587	44%	0.444	S	S	*	.			trans	-51	113	179.5	-177.3	0	0	0	0	106.2	T592 D596	T592-S594 PolarHBondContact O-N 2.85Å; S594-D596 PolarHBondContact O-N 2.83Å; S594-D596 VanDerWaalsContact O-N 3.13Å
595	H	35.1	Very low	39.1	Very low	107 Å²	107	80.2 Å²	80.2	50%	0.495	45%	0.45	S	S	.	.			trans	-70	113.8	168.5	-89.4	-84.9	0	0	0	103.8	V593 G597	V593-H595 PolarHBondContact O-N 2.76Å; H595-G597 PolarHBondContact O-N 3.39Å
596	D	37.3	Very low	38.4	Very low	116 Å²	116	80.4 Å²	80.4	62%	0.62	46%	0.455	S	S	*	.			trans	-57.5	72.8	162.1	-61.7	-18.9	0	0	0	108.8	K443 S594	K443-D596 VanDerWaalsContact NZ-CG 3.31Å; K443-D596 IonicContact NZ-OD2 3.82Å; K443-D596 PolarHBondContact NZ-OD2 3.15Å; S594-D596 PolarHBondContact O-N 2.83Å; S594-D596 VanDerWaalsContact O-N 3.13Å
597	G	38.4	Very low	37.5	Very low	13 Å²	13	85.2 Å²	85.2	13%	0.134	48%	0.481	C	S	.	.			trans	-96.1	130.3	-178.7	0	0	0	0	0	108.1	H595 V599 A600 G601	H595-G597 PolarHBondContact O-N 3.39Å; G597-V599 PolarHBondContact O-N 3.36Å; G597-A600 PolarHBondContact O-N 2.95Å; G597-A600 VanDerWaalsContact O-N 3.13Å; G597-G601 PolarHBondContact O-N 3.48Å
598	P	42.2	Very low	36.7	Very low	43 Å²	43	90.4 Å²	90.4	28%	0.279	50%	0.497	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.3	-4.9	-176.3	21.7	-34.9	0	0	0	115.7	W534 T537 A539	W534-P598 WeakPolarHBondContact CZ2-O 3.47Å; T537-P598 HydrophobicContact CG2-CB 4.31Å; T537-P598 HydrophobicContact CG2-CG 3.77Å; A539-P598 HydrophobicContact CB-CG 4.43Å
599	V	43.8	Very low	36	Very low	3 Å²	3	94.1 Å²	94.1	2%	0.018	53%	0.525	C	S	.	.	T	Hydrogen-bonded Turn	trans	-72	-30	174.4	-177	0	0	0	0	112.3	A539 I543 G597	A539-V599 HydrophobicContact CB-CG2 4.28Å; I543-V599 HydrophobicContact CD1-CB 4.5Å; I543-V599 HydrophobicContact CD1-CG2 4.2Å; G597-V599 PolarHBondContact O-N 3.36Å
600	A	43.4	Very low	35.6	Very low	20 Å²	20	94.7 Å²	94.7	17%	0.165	53%	0.529	C	S	.	.	S	Bend	trans	-133.8	17.4	-177.8	0	0	0	0	0	113.7	G597 L602	G597-A600 PolarHBondContact O-N 2.95Å; G597-A600 VanDerWaalsContact O-N 3.13Å; A600-L602 PolarHBondContact O-N 3.17Å
601	G	41.3	Very low	35.4	Very low	38 Å²	38	91.4 Å²	91.4	39%	0.392	53%	0.526	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.2	44.2	-165.5	0	0	0	0	0	117.1	G597	G597-G601 PolarHBondContact O-N 3.48Å
602	L	44.7	Very low	35.5	Very low	60 Å²	60	91.5 Å²	91.5	31%	0.314	53%	0.531	S	S	.	.	T	Hydrogen-bonded Turn	trans	-133.9	13.5	-176.5	-76	171.9	0	0	0	115.4	P262 M448 A600	P262-L602 HydrophobicContact CG-CD1 3.43Å; P262-L602 VanDerWaalsContact CG-CD1 3.43Å; M448-L602 HydrophobicContact CG-CD2 4.19Å; A600-L602 PolarHBondContact O-N 3.17Å
603	A	35.8	Very low	35.5	Very low	48 Å²	48	89.7 Å²	89.7	40%	0.397	52%	0.519	S	S	.	.			trans	-124.5	110.5	171.2	0	0	0	0	0	111.4
604	F	37.9	Very low	36.1	Very low	177 Å²	177	89.1 Å²	89.1	78%	0.776	52%	0.52	S	S	*	.			trans	-92.7	90.4	162	-82.8	-87.3	0	0	0	108.2	I444	I444-F604 HydrophobicContact CD1-CE2 4.04Å; I444-F604 HydrophobicContact CG1-CE2 4.29Å
605	D	30.3	Very low	36.7	Very low	117 Å²	117	89 Å²	89	63%	0.626	52%	0.519	S	S	*	.			trans	-111.6	109.2	172.9	-79.6	-55.1	0	0	0	111.5	Q350	Q350-D605 PolarHBondContact NE2-OD1 3.12Å; Q350-D605 PolarHBondContact NE2-OD2 3.47Å; Q350-D605 VanDerWaalsContact NE2-OD2 3.08Å
606	L	33	Very low	37.3	Very low	158 Å²	158	86.5 Å²	86.5	83%	0.827	52%	0.517	S	S	*	.			trans	-97.1	80.2	164.4	-85.3	163.9	0	0	0	107.9
607	N	32.7	Very low	37.6	Very low	149 Å²	149	85.7 Å²	85.7	80%	0.797	51%	0.505	S	S	*	.			trans	166.8	108.1	146.2	-87.8	-19.6	0	0	0	111.4
608	E	25	Very low	38.4	Very low	182 Å²	182	86.9 Å²	86.9	85%	0.85	51%	0.514	S	S	*	.			trans	-157	126.7	150.5	-146	175.1	-178.8	0	0	108.6
609	P	30.1	Very low	38.8	Very low	114 Å²	114	91 Å²	91	74%	0.74	53%	0.53	S	S	*	.			trans	-92.3	124.9	178.9	33.6	-29.7	0	0	0	111
610	S	29.5	Very low	39	Very low	63 Å²	63	96.4 Å²	96.4	44%	0.441	55%	0.554	S	S	.	*			trans	-137	140.6	163.4	61.3	0	0	0	0	110.6	S589	S589-S610 WeakPolarHBondContact CB-O 3.28Å
611	A	32.7	Very low	39.5	Very low	81 Å²	81	96.5 Å²	96.5	67%	0.669	55%	0.553	S	S	*	*			trans	-80.1	142.8	-167.2	0	0	0	0	0	112.8
612	D	33.3	Very low	40	Very low	139 Å²	139	98.7 Å²	98.7	74%	0.743	56%	0.559	S	S	*	*				162.1	110.5	123.4	-84.8	-12.9	0	0	0	110.1
613	V	33.8	Very low	40.5	Very low	78 Å²	78	102.8 Å²	102.8	47%	0.473	57%	0.574	S	S	.	*			trans	-145.7	144.5	169.7	-153.7	0	0	0	0	109.2	F588 S615	F588-V613 VanDerWaalsContact O-CG2 3.22Å; F588-V613 WeakPolarHBondContact O-CG2 3.48Å; V613-S615 PolarHBondContact O-N 2.97Å
614	S	43.3	Very low	41.4	Very low	82 Å²	82	107 Å²	107	57%	0.573	59%	0.587	S	S	*	*			trans	-52.7	128	-177.9	-179.6	0	0	0	0	113.7	A616 W617	S614-A616 PolarHBondContact O-N 3.28Å; S614-A616 VanDerWaalsContact O-N 3.1Å; S614-W617 PolarHBondContact O-N 2.91Å
615	S	47.7	Very low	42.1	Very low	82 Å²	82	100.7 Å²	100.7	57%	0.573	56%	0.563	S	S	*	*	H	α-helix	trans	-49.6	-34.7	179.9	51.7	0	0	0	0	114.5	V613 W617 A618 Q619	V613-S615 PolarHBondContact O-N 2.97Å; S615-W617 PolarHBondContact O-N 3.25Å; S615-A618 PolarHBondContact O-N 3.04Å; S615-Q619 WeakPolarHBondContact O-CG 3.37Å; S615-Q619 PolarHBondContact O-N 2.04Å
616	A	46.2	Very low	43.3	Very low	54 Å²	54	97.4 Å²	97.4	45%	0.446	55%	0.552	S	S	.	*	H	α-helix	trans	-64.6	-24.4	179.2	0	0	0	0	0	113.9	S614 H620	S614-A616 PolarHBondContact O-N 3.28Å; S614-A616 VanDerWaalsContact O-N 3.1Å; A616-H620 PolarHBondContact O-CD2 2.87Å; A616-H620 VanDerWaalsContact O-CD2 3.29Å
617	W	45.1	Very low	44.2	Very low	98 Å²	98	101 Å²	101	37%	0.371	55%	0.554	S	S	.	*	H	α-helix	trans	-85.9	-39.7	179.2	-166.2	81	0	0	0	111.9	M567 F588 S614 S615 Q619 H620 V621	M567-W617 HydrophobicContact CG-CH2 4.14Å; M567-W617 HydrophobicContact CG-CZ2 4.22Å; M567-W617 HydrophobicContact SD-CH2 3.76Å; M567-W617 HydrophobicContact SD-CZ2 3.37Å; M567-W617 WeakPolarHBondContact SD-CZ2 3.38Å; F588-W617 AromaticContact CD2-CH2 3.81Å; F588-W617 HydrophobicContact CD2-CH2 3.81Å; F588-W617 AromaticContact CD2-CZ3 3.39Å; F588-W617 HydrophobicContact CD2-CZ3 3.39Å; F588-W617 AromaticContact CE2-CH2 3.61Å; F588-W617 HydrophobicContact CE2-CH2 3.61Å; F588-W617 AromaticContact CE2-CZ3 3.5Å; F588-W617 HydrophobicContact CE2-CZ3 3.5Å; F588-W617 HydrophobicContact CG-CH2 4.45Å; F588-W617 HydrophobicContact CG-CZ3 4.23Å; F588-W617 HydrophobicContact CZ-CH2 4.12Å; F588-W617 HydrophobicContact CZ-CZ3 4.44Å; S614-W617 PolarHBondContact O-N 2.91Å; S615-W617 PolarHBondContact O-N 3.25Å; W617-Q619 VanDerWaalsContact C-N 3.31Å; W617-Q619 PolarHBondContact O-N 3.11Å; W617-H620 PolarHBondContact O-N 2.81Å; W617-H620 VanDerWaalsContact O-N 3.16Å; W617-V621 HydrophobicContact CD2-CG2 3.75Å; W617-V621 HydrophobicContact CE3-CG2 3.62Å; W617-V621 HydrophobicContact CH2-CG2 3.34Å; W617-V621 HydrophobicContact CZ2-CG2 3.45Å; W617-V621 VanDerWaalsContact CZ2-CG2 3.45Å; W617-V621 HydrophobicContact CZ3-CG2 3.42Å; W617-V621 VanDerWaalsContact CZ3-CG2 3.42Å; W617-V621 WeakPolarHBondContact O-CG2 3.43Å; W617-V621 PolarHBondContact O-N 2.94Å
618	A	53.4	Low	45	Very low	39 Å²	39	103.2 Å²	103.2	32%	0.322	55%	0.552	S	S	.	*	H	α-helix	trans	-55.6	-45.8	174.3	0	0	0	0	0	111.7	S615 H620	S615-A618 PolarHBondContact O-N 3.04Å; A618-H620 PolarHBondContact O-N 3.42Å; A618-H620 VanDerWaalsContact O-N 3.09Å
619	Q	50.8	Low	46.1	Very low	130 Å²	130	97.1 Å²	97.1	61%	0.607	54%	0.538	S	S	*	.	H	α-helix	trans	-65.2	-10.6	179.9	-68.9	175.1	-3	0	0	115.4	S615 W617	S615-Q619 WeakPolarHBondContact O-CG 3.37Å; S615-Q619 PolarHBondContact O-N 2.04Å; W617-Q619 VanDerWaalsContact C-N 3.31Å; W617-Q619 PolarHBondContact O-N 3.11Å
620	H	49.5	Very low	47	Very low	116 Å²	116	93.7 Å²	93.7	54%	0.537	52%	0.519	S	S	.	.	H	α-helix	trans	-121.5	-11.9	-173.4	-71	-24.3	0	0	0	115	A616 W617 A618 M624	A616-H620 PolarHBondContact O-CD2 2.87Å; A616-H620 VanDerWaalsContact O-CD2 3.29Å; W617-H620 PolarHBondContact O-N 2.81Å; W617-H620 VanDerWaalsContact O-N 3.16Å; A618-H620 PolarHBondContact O-N 3.42Å; A618-H620 VanDerWaalsContact O-N 3.09Å; H620-M624 WeakPolarHBondContact O-CB 3.08Å; H620-M624 PolarHBondContact O-N 3.01Å
621	V	52.8	Low	47.4	Very low	22 Å²	22	95.1 Å²	95.1	13%	0.133	52%	0.521	C	S	.	.	H	α-helix	trans	-62.2	-48.6	177.5	161	0	0	0	0	112.6	W617 K623 M624 V625	W617-V621 HydrophobicContact CD2-CG2 3.75Å; W617-V621 HydrophobicContact CE3-CG2 3.62Å; W617-V621 HydrophobicContact CH2-CG2 3.34Å; W617-V621 HydrophobicContact CZ2-CG2 3.45Å; W617-V621 VanDerWaalsContact CZ2-CG2 3.45Å; W617-V621 HydrophobicContact CZ3-CG2 3.42Å; W617-V621 VanDerWaalsContact CZ3-CG2 3.42Å; W617-V621 WeakPolarHBondContact O-CG2 3.43Å; W617-V621 PolarHBondContact O-N 2.94Å; V621-K623 PolarHBondContact O-N 3.48Å; V621-M624 WeakPolarHBondContact O-CA 3.35Å; V621-M624 WeakPolarHBondContact O-CB 3.09Å; V621-M624 PolarHBondContact O-N 2.95Å; V621-V625 WeakPolarHBondContact O-CG2 3.48Å; V621-V625 PolarHBondContact O-N 2.69Å
622	T	51.4	Low	47.5	Very low	84 Å²	84	98 Å²	98	52%	0.515	52%	0.524	S	S	.	.	H	α-helix	trans	-58.5	-47.2	-179.5	50.3	0	0	0	0	111.3	M624 V625 A626	T622-M624 VanDerWaalsContact C-N 3.3Å; T622-M624 PolarHBondContact O-N 2.91Å; T622-V625 PolarHBondContact O-N 3.09Å; T622-A626 WeakPolarHBondContact O-CB 3.18Å; T622-A626 PolarHBondContact O-N 3.39Å
623	K	56.5	Low	47.7	Very low	146 Å²	146	97.1 Å²	97.1	64%	0.635	53%	0.526	S	S	*	.	H	α-helix	trans	-61.4	-33.1	172.9	-74.8	-178.6	175.1	174.1	0	113.3	V621 R627	V621-K623 PolarHBondContact O-N 3.48Å; K623-R627 WeakPolarHBondContact O-CB 3.3Å; K623-R627 PolarHBondContact O-N 3.12Å; K623-R627 VanDerWaalsContact O-N 3.13Å
624	M	53.4	Low	47.7	Very low	137 Å²	137	101.7 Å²	101.7	68%	0.675	54%	0.542	S	S	*	.	H	α-helix	trans	-75.7	-32.1	179	-157.7	-179.6	-133.9	0	0	113	H620 V621 T622	H620-M624 WeakPolarHBondContact O-CB 3.08Å; H620-M624 PolarHBondContact O-N 3.01Å; V621-M624 WeakPolarHBondContact O-CA 3.35Å; V621-M624 WeakPolarHBondContact O-CB 3.09Å; V621-M624 PolarHBondContact O-N 2.95Å; T622-M624 VanDerWaalsContact C-N 3.3Å; T622-M624 PolarHBondContact O-N 2.91Å
625	V	54.3	Low	47.2	Very low	43 Å²	43	105 Å²	105	26%	0.261	55%	0.553	S	S	.	*	H	α-helix	trans	-72.7	-45.5	172.9	174.4	0	0	0	0	110.5	V621 T622 R627 R628 A630	V621-V625 WeakPolarHBondContact O-CG2 3.48Å; V621-V625 PolarHBondContact O-N 2.69Å; T622-V625 PolarHBondContact O-N 3.09Å; V625-R627 PolarHBondContact O-N 2.77Å; V625-R628 PolarHBondContact O-N 3.26Å; V625-A630 HydrophobicContact CG1-CB 3.81Å
626	A	55.8	Low	46.3	Very low	48 Å²	48	108.6 Å²	108.6	40%	0.397	57%	0.565	S	S	.	*	H	α-helix	trans	-56.3	-45.7	175.4	0	0	0	0	0	112.5	T622 R628 G629 I631	T622-A626 WeakPolarHBondContact O-CB 3.18Å; T622-A626 PolarHBondContact O-N 3.39Å; A626-R628 PolarHBondContact O-N 3.01Å; A626-G629 PolarHBondContact O-N 2.96Å; A626-G629 VanDerWaalsContact O-N 3.14Å; A626-I631 HydrophobicContact CB-CD1 4.16Å
627	R	51.6	Low	45.6	Very low	234 Å²	234	111.7 Å²	111.7	88%	0.883	58%	0.583	S	S	*	*	T	Hydrogen-bonded Turn	trans	-62.6	-5.7	179.3	-98.4	-173.8	169.2	-175.4	-3.2	115.9	K623 V625	K623-R627 WeakPolarHBondContact O-CB 3.3Å; K623-R627 PolarHBondContact O-N 3.12Å; K623-R627 VanDerWaalsContact O-N 3.13Å; V625-R627 PolarHBondContact O-N 2.77Å
628	R	49.8	Very low	44.8	Very low	195 Å²	195	113.1 Å²	113.1	74%	0.736	60%	0.602	S	S	*	*	T	Hydrogen-bonded Turn	trans	-109.4	14.4	177.2	-72.1	-172	168.4	-150.9	-6.7	113.9	V625 A626 A630	V625-R628 PolarHBondContact O-N 3.26Å; A626-R628 PolarHBondContact O-N 3.01Å; R628-A630 VanDerWaalsContact C-N 3.27Å; R628-A630 PolarHBondContact O-N 3.47Å
629	G	47.9	Very low	43.6	Very low	54 Å²	54	117 Å²	117	56%	0.557	62%	0.622	S	S	*	*	T	Hydrogen-bonded Turn	trans	71.8	19.4	178.2	0	0	0	0	0	114	A626 I631	A626-G629 PolarHBondContact O-N 2.96Å; A626-G629 VanDerWaalsContact O-N 3.14Å; G629-I631 VanDerWaalsContact C-N 3.27Å; G629-I631 PolarHBondContact O-N 3.17Å
630	A	48.7	Very low	42.8	Very low	43 Å²	43	116.6 Å²	116.6	36%	0.355	63%	0.631	S	S	.	*			trans	-85.1	2.2	178.9	0	0	0	0	0	113.7	F572 V625 R628	F572-A630 HydrophobicContact CE2-CB 4.14Å; F572-A630 HydrophobicContact CZ-CB 3.78Å; V625-A630 HydrophobicContact CG1-CB 3.81Å; R628-A630 VanDerWaalsContact C-N 3.27Å; R628-A630 PolarHBondContact O-N 3.47Å
631	I	37.5	Very low	41.8	Very low	93 Å²	93	117.5 Å²	117.5	48%	0.477	64%	0.644	S	S	.	*			trans	-135.1	99.6	175.2	-53.3	176.6	0	0	0	106.7	A626 G629	A626-I631 HydrophobicContact CB-CD1 4.16Å; G629-I631 VanDerWaalsContact C-N 3.27Å; G629-I631 PolarHBondContact O-N 3.17Å
632	L	35.6	Very low	40.7	Very low	140 Å²	140	120.6 Å²	120.6	73%	0.733	67%	0.672	S	S	*	*			trans	-101.4	140.6	153.7	-91	107.1	0	0	0	107.4	Q634	L632-Q634 PolarHBondContact O-N 2.95Å
633	P	35.7	Very low	39.9	Very low	121 Å²	121	122.9 Å²	122.9	79%	0.786	69%	0.686	S	S	*	*			trans	-65.3	110.6	156	-7.7	24.6	0	0	0	107.7
634	Q	35.5	Very low	38.6	Very low	175 Å²	175	121.9 Å²	121.9	82%	0.818	70%	0.695	S	S	*	*			trans	-85	128.8	144.1	-65.8	176.9	-33.5	0	0	103.5	L632	L632-Q634 PolarHBondContact O-N 2.95Å
635	D	31.3	Very low	37.6	Very low	150 Å²	150	121.5 Å²	121.5	80%	0.802	70%	0.7	S	S	*	*			cis	-117.1	139.8	41.2	-52	-59.7	0	0	0	116
636	I	29.7	Very low	36.8	Very low	158 Å²	158	124.5 Å²	124.5	81%	0.81	72%	0.72	S	S	*	*			trans	-154.6	115.8	138.8	-89.8	137.4	0	0	0	105.9	V638	I636-V638 HydrophobicContact CG2-CG2 3.83Å
637	S	30.5	Very low	35.7	Very low	120 Å²	120	128.3 Å²	128.3	84%	0.839	74%	0.741	S	S	*	*			trans	-91.3	112.2	170.8	54.1	0	0	0	0	109.7
638	V	28.7	Very low	34.7	Very low	127 Å²	127	125.7 Å²	125.7	77%	0.77	74%	0.739	S	S	*	*			trans	-133	124.6	165.1	-178.3	0	0	0	0	109.4	I636	I636-V638 HydrophobicContact CG2-CG2 3.83Å
639	T	29.2	Very low	33.8	Very low	120 Å²	120	125 Å²	125	74%	0.736	74%	0.744	S	S	*	*			trans	-74.2	157.4	178.2	32.1	0	0	0	0	112.3
640	P	32.8	Very low	32.8	Very low	122 Å²	122	131.4 Å²	131.4	79%	0.792	76%	0.759	S	S	*	*			trans	-82.4	126.3	-175.3	32.3	-33.4	0	0	0	112
641	V	29.7	Very low	31.8	Very low	135 Å²	135	133.6 Å²	133.6	82%	0.818	78%	0.778	S	S	*	*			trans	-138.8	130.9	168.4	-179.3	0	0	0	0	111.1
642	A	30.2	Very low	31.5	Very low	88 Å²	88	136.6 Å²	136.6	73%	0.727	80%	0.795	S	S	*	*			trans	24.3	130.6	160.5	0	0	0	0	0	122.1
643	T	32.9	Very low	31.3	Very low	131 Å²	131	136.7 Å²	136.7	80%	0.804	80%	0.795	S	S	*	*			trans	-66.2	148.2	158.9	47.2	0	0	0	0	113.5
644	P	30.9	Very low	31.1	Very low	125 Å²	125	141.8 Å²	141.8	81%	0.812	80%	0.799	S	S	*	*			trans	-119.8	162.5	136.5	11.6	8.7	0	0	0	112.4
645	V	30.4	Very low	30.7	Very low	130 Å²	130	140.6 Å²	140.6	79%	0.788	80%	0.797	S	S	*	*			trans	-114.6	176.4	176.6	-144.8	0	0	0	0	108.9
646	P	39	Very low	30.8	Very low	105 Å²	105	139.7 Å²	139.7	68%	0.682	80%	0.797	S	S	*	*				-101.9	-168.2	-113.3	41.5	-24.6	0	0	0	114
647	P	32.1	Very low	30.8	Very low	128 Å²	128	140.1 Å²	140.1	83%	0.831	80%	0.795	S	S	*	*				-131	-178.8	125.5	29.7	-14.7	0	0	0	114.3
648	E	30.2	Very low	30.9	Very low	180 Å²	180	138.8 Å²	138.8	84%	0.841	79%	0.792	S	S	*	*			trans	-90.4	166.9	-146.5	-73	169.5	136.7	0	0	119.1
649	E	31.1	Very low	31.1	Very low	179 Å²	179	141.7 Å²	141.7	84%	0.836	80%	0.797	S	S	*	*			trans	28.8	123.5	151.9	-64.3	-166.2	144.6	0	0	122.4
650	Q	27.1	Very low	31.7	Very low	189 Å²	189	141.3 Å²	141.3	88%	0.883	79%	0.789	S	S	*	*				-157.8	140.8	98.2	-112.3	178.7	9.9	0	0	112.7
651	A	28.4	Very low	31.9	Very low	90 Å²	90	138.9 Å²	138.9	74%	0.744	78%	0.775	S	S	*	*			trans	-78.7	141.8	173.8	0	0	0	0	0	111.1
652	N	31.2	Very low	32.6	Very low	156 Å²	156	136.9 Å²	136.9	83%	0.834	77%	0.765	S	S	*	*			trans	-151.2	136.3	143.2	-103.4	-46	0	0	0	112.8
653	L	30.1	Very low	33.6	Very low	142 Å²	142	138 Å²	138	74%	0.743	76%	0.755	S	S	*	*			trans	-89.4	119.5	-171.1	-178	86	0	0	0	110.1
654	W	31.6	Very low	34.4	Very low	228 Å²	228	136.5 Å²	136.5	86%	0.864	74%	0.742	S	S	*	*			trans	-133.9	97.4	157.4	-76.5	101.4	0	0	0	110.8	V656	W654-V656 PolarHBondContact O-N 3.18Å
655	L	28.3	Very low	35.4	Very low	149 Å²	149	136.7 Å²	136.7	78%	0.78	73%	0.732	S	S	*	*			trans	-66	117.8	163.3	-140.9	80.8	0	0	0	107.4
656	V	33.3	Very low	36.5	Very low	132 Å²	132	137.5 Å²	137.5	80%	0.8	73%	0.725	S	S	*	*			trans	-116.9	115.4	164.9	178.7	0	0	0	0	108.6	W654	W654-V656 PolarHBondContact O-N 3.18Å
657	E	28.8	Very low	37	Very low	166 Å²	166	141.3 Å²	141.3	78%	0.776	73%	0.725	S	S	*	*			trans	-78.3	118.6	-171.2	-166.9	160.7	-164	0	0	110.3	E659	E657-E659 PolarHBondContact O-N 2.75Å; E657-E659 VanDerWaalsContact O-N 3.17Å
658	A	33.1	Very low	37.8	Very low	93 Å²	93	140.5 Å²	140.5	77%	0.769	71%	0.714	S	S	*	*			trans	-82.8	91.5	175	0	0	0	0	0	109.7	I660	A658-I660 PolarHBondContact O-N 3.43Å; A658-I660 VanDerWaalsContact O-N 3.15Å
659	E	33	Very low	38.6	Very low	187 Å²	187	133.9 Å²	133.9	87%	0.874	69%	0.693	S	S	*	*			trans	-52.3	117	178.9	-68.8	-170.2	131.8	0	0	112.4	E657 S661	E657-E659 PolarHBondContact O-N 2.75Å; E657-E659 VanDerWaalsContact O-N 3.17Å; E659-S661 PolarHBondContact O-N 3.05Å
660	I	41.1	Very low	39.5	Very low	112 Å²	112	135.3 Å²	135.3	57%	0.574	69%	0.691	S	S	*	*			trans	-84.4	110.3	172.1	-63.1	174.7	0	0	0	108.6	A658 L664	A658-I660 PolarHBondContact O-N 3.43Å; A658-I660 VanDerWaalsContact O-N 3.15Å; I660-L664 HydrophobicContact CG2-CB 4.05Å; I660-L664 HydrophobicContact CG2-CD2 3.96Å
661	S	37.8	Very low	40.5	Very low	72 Å²	72	134.4 Å²	134.4	50%	0.503	68%	0.684	S	S	.	*			trans	-46.5	132.4	176.5	175.2	0	0	0	0	112.8	E659 E663 L664	E659-S661 PolarHBondContact O-N 3.05Å; S661-E663 PolarHBondContact O-N 3.18Å; S661-L664 WeakPolarHBondContact O-CB 3.39Å; S661-L664 PolarHBondContact O-N 3.23Å
662	P	44.9	Very low	41.2	Very low	92 Å²	92	138.4 Å²	138.4	60%	0.597	69%	0.685	S	S	*	*	H	α-helix	trans	-61.8	-16.1	-173.1	22.1	-33.2	0	0	0	114.6	L664 K666	P662-L664 VanDerWaalsContact C-N 3.32Å; P662-L664 PolarHBondContact O-N 3.47Å; P662-K666 PolarHBondContact O-N 3.17Å
663	E	49.6	Very low	41.8	Very low	113 Å²	113	139.2 Å²	139.2	53%	0.528	68%	0.681	S	S	.	*	H	α-helix	trans	-64.6	-33.7	172.4	-132.3	60.3	-128	0	0	112.6	S661 R667	S661-E663 PolarHBondContact O-N 3.18Å; E663-R667 WeakPolarHBondContact O-CG 3.23Å; E663-R667 PolarHBondContact O-N 3.5Å
664	L	51.3	Low	42.3	Very low	98 Å²	98	143.3 Å²	143.3	51%	0.513	69%	0.686	S	S	.	*	H	α-helix	trans	-76	-40	-176.7	-161.7	67	0	0	0	111.4	I660 S661 P662 K666 R667 L668	I660-L664 HydrophobicContact CG2-CB 4.05Å; I660-L664 HydrophobicContact CG2-CD2 3.96Å; S661-L664 WeakPolarHBondContact O-CB 3.39Å; S661-L664 PolarHBondContact O-N 3.23Å; P662-L664 VanDerWaalsContact C-N 3.32Å; P662-L664 PolarHBondContact O-N 3.47Å; L664-K666 PolarHBondContact O-N 3.04Å; L664-R667 PolarHBondContact O-N 3.36Å; L664-L668 PolarHBondContact O-N 3.32Å
665	Q	51.2	Low	42.8	Very low	130 Å²	130	143.4 Å²	143.4	61%	0.607	69%	0.687	S	S	*	*	H	α-helix	trans	-56.6	-47.7	172.4	-141.8	89.2	-29.7	0	0	110.8	R667 L668 G669	Q665-R667 PolarHBondContact O-N 2.04Å; Q665-L668 PolarHBondContact O-N 2.95Å; Q665-G669 PolarHBondContact O-N 3.49Å
666	K	53.4	Low	43.3	Very low	146 Å²	146	143.9 Å²	143.9	64%	0.635	68%	0.682	S	S	*	*	H	α-helix	trans	-61.2	-38.6	177.2	-87.3	174.7	177.7	166.5	0	112.9	P662 L664 R670	P662-K666 PolarHBondContact O-N 3.17Å; L664-K666 PolarHBondContact O-N 3.04Å; K666-R670 PolarHBondContact O-N 2.82Å; K666-R670 VanDerWaalsContact O-N 3.1Å
667	R	49.4	Very low	43.6	Very low	185 Å²	185	148.6 Å²	148.6	70%	0.698	69%	0.686	S	S	*	*	H	α-helix	trans	-72.6	-36.5	179.5	-74.4	-178.2	177.3	-160.4	-0.3	113	E663 L664 Q665 K671	E663-R667 WeakPolarHBondContact O-CG 3.23Å; E663-R667 PolarHBondContact O-N 3.5Å; L664-R667 PolarHBondContact O-N 3.36Å; Q665-R667 PolarHBondContact O-N 2.04Å; R667-K671 PolarHBondContact O-N 2.74Å
668	L	48.9	Very low	44	Very low	112 Å²	112	150.1 Å²	150.1	59%	0.586	69%	0.69	S	S	*	*	H	α-helix	trans	-67.6	-42	172.5	-76.8	161.4	0	0	0	111.6	L664 Q665 R670 K671 K672	L664-L668 PolarHBondContact O-N 3.32Å; Q665-L668 PolarHBondContact O-N 2.95Å; L668-R670 PolarHBondContact O-N 3Å; L668-K671 PolarHBondContact O-N 2.85Å; L668-K672 PolarHBondContact O-N 3.33Å; L668-K672 VanDerWaalsContact O-N 3.11Å
669	G	47.2	Very low	44.1	Very low	40 Å²	40	154.2 Å²	154.2	41%	0.412	69%	0.691	S	S	.	*	H	α-helix	trans	-58	-46.7	174.5	0	0	0	0	0	113.5	Q665 K671 K672 K673	Q665-G669 PolarHBondContact O-N 3.49Å; G669-K671 PolarHBondContact O-N 2.77Å; G669-K672 PolarHBondContact O-N 2.92Å; G669-K673 WeakPolarHBondContact O-CB 3.38Å; G669-K673 PolarHBondContact O-N 3.45Å
670	R	50.6	Low	44	Very low	209 Å²	209	153 Å²	153	79%	0.789	69%	0.685	S	S	*	*	H	α-helix	trans	-63	-36.2	177.8	-76.1	-177.3	174.4	-173.5	-0.9	113.1	K666 L668 K673 R674	K666-R670 PolarHBondContact O-N 2.82Å; K666-R670 VanDerWaalsContact O-N 3.1Å; L668-R670 PolarHBondContact O-N 3Å; R670-K673 PolarHBondContact O-N 3.49Å; R670-R674 PolarHBondContact O-N 2.86Å
671	K	46.7	Very low	43.9	Very low	171 Å²	171	154.3 Å²	154.3	74%	0.743	70%	0.697	S	S	*	*	H	α-helix	trans	-70.4	-37.6	175.6	-86.7	-177.6	174.1	177.8	0	113.1	R667 L668 G669	R667-K671 PolarHBondContact O-N 2.74Å; L668-K671 PolarHBondContact O-N 2.85Å; G669-K671 PolarHBondContact O-N 2.77Å
672	K	43.8	Very low	43.5	Very low	173 Å²	173	156.8 Å²	156.8	75%	0.752	71%	0.713	S	S	*	*	H	α-helix	trans	-65.1	-42.9	171.3	-107.9	177.2	175.6	177.7	0	111.5	L668 G669 R674 R675 K676	L668-K672 PolarHBondContact O-N 3.33Å; L668-K672 VanDerWaalsContact O-N 3.11Å; G669-K672 PolarHBondContact O-N 2.92Å; K672-R674 VanDerWaalsContact C-N 3.34Å; K672-R674 PolarHBondContact O-N 3.14Å; K672-R675 PolarHBondContact O-N 3.35Å; K672-R675 VanDerWaalsContact O-N 3.1Å; K672-K676 PolarHBondContact O-N 3.17Å
673	K	43.5	Very low	43.2	Very low	173 Å²	173	157.3 Å²	157.3	75%	0.752	72%	0.717	S	S	*	*	H	α-helix	trans	-65.3	-28.2	-177.5	-147.8	169.6	-171	175.8	0	114.2	G669 R670	G669-K673 WeakPolarHBondContact O-CB 3.38Å; G669-K673 PolarHBondContact O-N 3.45Å; R670-K673 PolarHBondContact O-N 3.49Å
674	R	40.8	Very low	42.4	Very low	228 Å²	228	160.2 Å²	160.2	86%	0.86	74%	0.735	S	S	*	*	H	α-helix	trans	-80.8	-21	173.7	-159.1	174.2	-177.9	-175.2	0.8	113.6	R670 K672	R670-R674 PolarHBondContact O-N 2.86Å; K672-R674 VanDerWaalsContact C-N 3.34Å; K672-R674 PolarHBondContact O-N 3.14Å
675	R	42	Very low	41.2	Very low	230 Å²	230	160.1 Å²	160.1	87%	0.868	75%	0.748	S	S	*	*	H	α-helix	trans	-88.9	-21.9	178.2	-132.8	177.2	-174.9	-174.5	-0.3	113.4	K672	K672-R675 PolarHBondContact O-N 3.35Å; K672-R675 VanDerWaalsContact O-N 3.1Å
676	K	38.3	Very low	40.5	Very low	159 Å²	159	159.9 Å²	159.9	69%	0.691	76%	0.758	S	S	*	*	S	Bend	trans	-92.2	7.7	176.4	-144.5	-171.6	179.1	-169.4	0	114.9	K672	K672-K676 PolarHBondContact O-N 3.17Å
677	R	39.8	Very low	40.1	Very low	231 Å²	231	158.3 Å²	158.3	87%	0.872	76%	0.763	S	S	*	*	S	Bend	trans	-108.3	22.9	-178.7	-145	-176.2	-168.5	-160.9	3.3	113.9
678	K	37.8	Very low	39.3	Very low	198 Å²	198	155 Å²	155	86%	0.861	77%	0.765	S	S	*	*	S	Bend	trans	-143.7	21.7	179.4	-143.2	-176.3	-176.2	-174	0	114.4
679	K	35.3	Very low	38.2	Very low	180 Å²	180	158 Å²	158	78%	0.783	78%	0.776	S	S	*	*	S	Bend	trans	-150.4	145.5	170	-102.5	-173.5	169.3	-170.6	0	107.3
680	E	29.6	Very low	37.4	Very low	162 Å²	162	164.5 Å²	164.5	76%	0.757	80%	0.801	S	S	*	*			trans	72.7	106.1	-166.1	-60	160.2	-176.8	0	0	111.6
681	V	40	Very low	36.3	Very low	138 Å²	138	163 Å²	163	84%	0.836	80%	0.802	S	S	*	*			cis	83.9	128	29.9	-173.8	0	0	0	0	114.3
682	C	29.1	Very low	36.1	Very low	124 Å²	124	159.8 Å²	159.8	84%	0.838	80%	0.799	S	S	*	*			trans	-173.8	166.2	154.9	-102.3	0	0	0	0	112.6
683	P	39.9	Very low	35.7	Very low	104 Å²	104	157 Å²	157	68%	0.675	80%	0.799	S	S	*	*			trans	-137.7	177.6	-138.1	43.4	-25.9	0	0	0	119.8
684	L	31.8	Very low	34.8	Very low	173 Å²	173	153.3 Å²	153.3	91%	0.906	80%	0.8	S	S	*	*			trans	40.8	134.1	150.8	-89.8	92.8	0	0	0	124.7
685	A	26.8	Very low	34.7	Very low	96 Å²	96	148.4 Å²	148.4	79%	0.793	80%	0.798	S	S	*	*			trans	-167.7	171	138.4	0	0	0	0	0	111.2
686	P	36.8	Very low	33.9	Very low	126 Å²	126	141.9 Å²	141.9	82%	0.818	79%	0.793	S	S	*	*			trans	-127.4	-142.7	-130.6	42.5	-21	0	0	0	117.1
687	P	43.6	Very low	33.6	Very low	112 Å²	112	140.3 Å²	140.3	73%	0.727	80%	0.799	S	S	*	*				-120.7	-169.2	-122.2	38.6	-16	0	0	0	115.9
688	P	33.6	Very low	33	Very low	115 Å²	115	134.9 Å²	134.9	75%	0.747	80%	0.797	S	S	*	*				-151.5	158.5	101.2	37.9	-19.1	0	0	0	119.4
689	E	26.1	Very low	32.5	Very low	176 Å²	176	132.1 Å²	132.1	82%	0.822	80%	0.797	S	S	*	*			trans	42.7	127.4	146.6	-61.5	-174.4	145.7	0	0	126.2
690	L	29.8	Very low	32.3	Very low	176 Å²	176	131.5 Å²	131.5	92%	0.921	80%	0.8	S	S	*	*				-166.2	168.4	109.9	-144	70.6	0	0	0	112.8
691	H	26.2	Very low	32.5	Very low	177 Å²	177	129.1 Å²	129.1	82%	0.819	80%	0.799	S	S	*	*			trans	-97	169.4	-165.2	-96.4	-73.7	0	0	0	116.8
692	P	42.5	Very low	32	Very low	105 Å²	105	134.1 Å²	134.1	68%	0.682	80%	0.803	S	S	*	*			trans	-91.9	-167.4	-173.6	43.2	-39.8	0	0	0	112.6
693	P	35.8	Very low	32.1	Very low	115 Å²	115	136.7 Å²	136.7	75%	0.747	81%	0.807	S	S	*	*			cis	-150.4	172.5	18.6	45	-23.3	0	0	0	121.7
694	A	24.6	Very low	31.7	Very low	95 Å²	95	137 Å²	137	79%	0.785	81%	0.809	S	S	*	*			trans	66.3	174.6	152.8	0	0	0	0	0	118.6
695	P	39.1	Very low	31.8	Very low	124 Å²	124	137.9 Å²	137.9	81%	0.805	81%	0.809	S	S	*	*				-130.4	178	-107.8	35.5	-14.7	0	0	0	118
696	A	26.4	Very low	31.9	Very low	94 Å²	94	141.4 Å²	141.4	78%	0.777	81%	0.813	S	S	*	*			trans	87.4	161.8	169.1	0	0	0	0	0	117.5
697	P	32	Very low	31.6	Very low	125 Å²	125	140.6 Å²	140.6	81%	0.812	81%	0.808	S	S	*	*				-132	141.2	-57.8	36.2	-23	0	0	0	113.5
698	S	25.2	Very low	30.9	Very low	117 Å²	117	146.5 Å²	146.5	82%	0.818	82%	0.816	S	S	*	*			trans	-153.6	120.5	164.1	56	0	0	0	0	112.8
699	T	28.3	Very low	30.6	Very low	140 Å²	140	148.6 Å²	148.6	86%	0.859	82%	0.816	S	S	*	*			trans	-99.4	121	-176.6	25.3	0	0	0	0	111.3
700	I	30.8	Very low	30.6	Very low	168 Å²	168	149.2 Å²	149.2	86%	0.862	82%	0.816	S	S	*	*			trans	-111.8	106.4	169.4	-59	-178.1	0	0	0	108.5
701	P	34.1	Very low	30.5	Very low	112 Å²	112	146.8 Å²	146.8	73%	0.727	81%	0.812	S	S	*	*	P	Polyproline II helix	trans	-92.1	163.8	-173.7	35	-34.3	0	0	0	114
702	R	29.1	Very low	30.5	Very low	243 Å²	243	146.5 Å²	146.5	92%	0.917	82%	0.816	S	S	*	*	P	Polyproline II helix	trans	-59.4	145.8	171.7	-58.6	174.4	175.9	-164	-1.5	111.4	P704	R702-P704 WeakPolarHBondContact O-CD 3.39Å
703	L	31.8	Very low	29.8	Very low	177 Å²	177	147.7 Å²	147.7	93%	0.927	82%	0.821	S	S	*	*	P	Polyproline II helix	trans	-86.8	121.4	172.8	-91.5	147.2	0	0	0	111.9
704	P	30.7	Very low	29.4	Very low	112 Å²	112	147.1 Å²	147.1	73%	0.727	83%	0.826	S	S	*	*	P	Polyproline II helix	trans	-100.7	172.7	172.9	38.7	-32.4	0	0	0	112.9	R702	R702-P704 WeakPolarHBondContact O-CD 3.39Å
705	Q	34.7	Very low	29.6	Very low	190 Å²	190	147.6 Å²	147.6	89%	0.888	83%	0.83	S	S	*	*	P	Polyproline II helix	trans	-76.9	156.8	167.7	-63.5	-162.4	26.8	0	0	112.3
706	L	28	Very low	29.1	Very low	170 Å²	170	145.6 Å²	145.6	89%	0.89	83%	0.831	S	S	*	*			trans	-160.4	160.7	156.3	-98.8	160	0	0	0	111
707	P	31.7	Very low	29.2	Very low	109 Å²	109	145.3 Å²	145.3	71%	0.708	83%	0.829	S	S	*	*			trans	-116.1	171.4	-168.8	42.8	-34.8	0	0	0	116.8
708	R	28.6	Very low	29.1	Very low	237 Å²	237	151.6 Å²	151.6	89%	0.894	84%	0.837	S	S	*	*			trans	47.2	131.6	151.9	-93.7	-174.3	171.1	-175.2	-2.1	122.8
709	Q	27.5	Very low	29.1	Very low	159 Å²	159	149.6 Å²	149.6	74%	0.743	83%	0.834	S	S	*	*			trans	104.9	124.2	145.4	-79.7	-164.7	-11.6	0	0	122.4
710	K	25.6	Very low	29.2	Very low	188 Å²	188	148.2 Å²	148.2	82%	0.817	84%	0.837	S	S	*	*			trans	60.5	135.4	142.9	-66.7	-171.7	177.2	-175.6	0	122.5
711	C	28.8	Very low	28.9	Very low	125 Å²	125	143.3 Å²	143.3	85%	0.845	83%	0.828	S	S	*	*			trans	-79.9	157.9	174.1	-51.3	0	0	0	0	113.6
712	L	25.7	Very low	28.8	Very low	172 Å²	172	146 Å²	146	90%	0.901	84%	0.836	S	S	*	*			trans	-161.1	173.4	136.2	-107.3	166.4	0	0	0	111.4
713	V	27.8	Very low	28.8	Very low	130 Å²	130	139.5 Å²	139.5	79%	0.788	83%	0.828	S	S	*	*			trans	-96.1	155.8	-155.5	171.7	0	0	0	0	114.8
714	A	27.4	Very low	28.5	Very low	103 Å²	103	136.5 Å²	136.5	85%	0.851	82%	0.821	S	S	*	*			trans	-148.8	153.6	152.6	0	0	0	0	0	111.4
715	A	27.3	Very low	28.4	Very low	105 Å²	105	141.1 Å²	141.1	87%	0.868	82%	0.824	S	S	*	*			trans	-151.6	167.8	-172.4	0	0	0	0	0	114.2
716	G	28.6	Very low	28.1	Very low	81 Å²	81	140.3 Å²	140.3	84%	0.835	82%	0.82	S	S	*	*			trans	110.5	148.4	172	0	0	0	0	0	114
717	A	29.7	Very low	28.1	Very low	88 Å²	88	135.7 Å²	135.7	73%	0.727	81%	0.813	S	S	*	*			cis	-149	-178.8	-0.5	0	0	0	0	0	107.8
718	W	29.3	Very low	27.8	Very low	258 Å²	258	135.6 Å²	135.6	98%	0.977	82%	0.821	S	S	*	*			cis	-136	-177.7	20.1	-57.5	59.6	0	0	0	107.6
719	G	26.1	Very low	27.6	Very low	75 Å²	75	136 Å²	136	77%	0.773	82%	0.823	S	S	*	*			cis	146.1	147.2	4.7	0	0	0	0	0	107.6
720	A	28.8	Very low	27.6	Very low	111 Å²	111	134.8 Å²	134.8	92%	0.917	83%	0.827	S	S	*	*			cis	-154.7	-179.5	0.8	0	0	0	0	0	108
721	G	26.2	Very low	27.5	Very low	65 Å²	65	133 Å²	133	67%	0.67	83%	0.825	S	S	*	*			cis	-171	168.6	1.2	0	0	0	0	0	113.9
722	D	31.3	Very low	27.3	Very low	168 Å²	168	133.5 Å²	133.5	90%	0.898	82%	0.824	S	S	*	*			trans	59	137.9	159.6	-58.1	-10.4	0	0	0	121.5
723	S	28.1	Very low	27.4	Very low	106 Å²	106	130 Å²	130	74%	0.741	81%	0.814	S	S	*	*			cis	-156.9	149.9	4.5	-154.3	0	0	0	0	114.8
724	C	27.6	Very low	27.6	Very low	115 Å²	115	131.6 Å²	131.6	78%	0.777	82%	0.818	S	S	*	*			trans	37.2	130	153.1	-93.7	0	0	0	0	121.7
725	R	27.3	Very low	27.8	Very low	209 Å²	209	132.1 Å²	132.1	79%	0.789	81%	0.813	S	S	*	*			cis	-170.5	150.2	42.8	-117.6	-178.7	-176.2	-179.7	-1	112
726	Q	28.6	Very low	27.5	Very low	173 Å²	173	136.8 Å²	136.8	81%	0.808	81%	0.814	S	S	*	*			trans	27.7	132	145.4	-62.5	165.3	-24.5	0	0	120.4
727	G	27.5	Very low	27.4	Very low	73 Å²	73	138.6 Å²	138.6	75%	0.753	81%	0.812	S	S	*	*			cis	164.8	173.3	0.5	0	0	0	0	0	112.6
728	A	26.6	Very low	27.6	Very low	106 Å²	106	140 Å²	140	88%	0.876	81%	0.814	S	S	*	*			trans	75.8	133	178.7	0	0	0	0	0	118.3
729	W	24.7	Very low	27.3	Very low	247 Å²	247	136.7 Å²	136.7	94%	0.936	81%	0.809	S	S	*	*			trans	-126	149.1	-175.1	-71.5	80.1	0	0	0	110.9
730	T	26.1	Very low	27.5	Very low	132 Å²	132	138.6 Å²	138.6	81%	0.81	81%	0.808	S	S	*	*				171.6	115.3	124.4	30	0	0	0	0	109.5
731	L	24.5	Very low	27.3	Very low	151 Å²	151	138.5 Å²	138.5	79%	0.791	80%	0.801	S	S	*	*				81.8	96.1	79.1	-143.1	169.3	0	0	0	113
732	V	25	Very low	28.1	Very low	135 Å²	135	140.7 Å²	140.7	82%	0.818	80%	0.804	S	S	*	*			trans	-105.3	137.4	173.7	172.8	0	0	0	0	109.9
733	S	27.1	Very low	28.7	Very low	99 Å²	99	137.6 Å²	137.6	69%	0.692	79%	0.793	S	S	*	*			trans	-113.1	153.3	164	-66.9	0	0	0	0	109.7
734	N	31.6	Very low	28.8	Very low	164 Å²	164	141.6 Å²	141.6	88%	0.877	80%	0.8	S	S	*	*			trans	-50.2	141	-178.3	-73.2	-7.2	0	0	0	114.3
735	P	31.3	Very low	28.8	Very low	114 Å²	114	143.6 Å²	143.6	74%	0.74	80%	0.803	S	S	*	*			trans	-109.8	137.6	154.7	34.9	-25.2	0	0	0	112.2
736	F	21	Very low	29.6	Very low	203 Å²	203	138.1 Å²	138.1	89%	0.89	79%	0.794	S	S	*	*			trans	-131.7	134.4	156.7	-119.9	-82.1	0	0	0	107.7
737	C	27	Very low	29.5	Very low	118 Å²	118	139.6 Å²	139.6	80%	0.797	80%	0.798	S	S	*	*			trans	79.9	152.6	172.8	-62.8	0	0	0	0	119.2
738	P	33.1	Very low	29.7	Very low	118 Å²	118	143.5 Å²	143.5	77%	0.766	80%	0.801	S	S	*	*			trans	-129.8	163.4	-146.7	41.6	-26	0	0	0	116.6
739	E	24.3	Very low	30.4	Very low	188 Å²	188	143.8 Å²	143.8	88%	0.879	79%	0.794	S	S	*	*			trans	162.8	168.2	152.5	-100.3	-171.9	142.5	0	0	109.3
740	P	30	Very low	30.6	Very low	115 Å²	115	137.1 Å²	137.1	75%	0.747	79%	0.785	S	S	*	*			cis	-127.2	-176.1	-31.1	35.2	-16.9	0	0	0	112.5
741	S	24.8	Very low	30.9	Very low	109 Å²	109	135.4 Å²	135.4	76%	0.762	78%	0.784	S	S	*	*			trans	-93.9	-176.1	171.4	56.4	0	0	0	0	111.7
742	P	42.9	Very low	31.7	Very low	112 Å²	112	134.6 Å²	134.6	73%	0.727	79%	0.788	S	S	*	*			cis	-134.1	-142.4	5.7	45.2	-23.9	0	0	0	111.5
743	P	43.6	Very low	32	Very low	103 Å²	103	132.7 Å²	132.7	67%	0.669	79%	0.786	S	S	*	*			cis	-135.2	160	-18.3	37	-18.5	0	0	0	117.2
744	Q	29.8	Very low	32.7	Very low	190 Å²	190	134.1 Å²	134.1	89%	0.888	79%	0.793	S	S	*	*				171.2	140.6	115.4	-93.8	-175.1	-2.3	0	0	114.5
745	D	27.9	Very low	32.5	Very low	157 Å²	157	132.4 Å²	132.4	84%	0.84	79%	0.789	S	S	*	*			trans	-83.4	-178	177.6	-87.2	-57.5	0	0	0	112.8
746	P	44.4	Very low	32.5	Very low	94 Å²	94	131.8 Å²	131.8	61%	0.61	79%	0.794	S	S	*	*			cis	-136.8	164.5	11.4	40.3	-22.4	0	0	0	117.8
747	F	27	Very low	32.9	Very low	203 Å²	203	133.5 Å²	133.5	89%	0.89	79%	0.794	S	S	*	*				179.8	139.9	112.5	-94.6	-68.4	0	0	0	111.3
748	L	30.7	Very low	33	Very low	156 Å²	156	131.8 Å²	131.8	82%	0.817	79%	0.788	S	S	*	*			trans	-104.9	163.4	-169.7	-100.8	168.3	0	0	0	110.9
749	P	41	Very low	32.8	Very low	112 Å²	112	135.5 Å²	135.5	73%	0.727	80%	0.795	S	S	*	*				-151.4	145.5	58.6	40.5	-18.7	0	0	0	121.1
750	S	29.9	Very low	33.1	Very low	107 Å²	107	130 Å²	130	75%	0.748	79%	0.788	S	S	*	*			trans	50.8	125.6	138.2	67.9	0	0	0	0	123.5
751	A	31.5	Very low	33	Very low	96 Å²	96	136.2 Å²	136.2	79%	0.793	80%	0.797	S	S	*	*			trans	-135	152.8	150.1	0	0	0	0	0	109.9
752	P	41.9	Very low	33.2	Very low	133 Å²	133	140.7 Å²	140.7	86%	0.864	80%	0.797	S	S	*	*	P	Polyproline II helix	trans	-96.7	155.1	175.4	35.6	-31.5	0	0	0	113.8
753	A	31.3	Very low	32.7	Very low	95 Å²	95	143.3 Å²	143.3	79%	0.785	80%	0.8	S	S	*	*	P	Polyproline II helix	trans	-89.3	165.8	-174.6	0	0	0	0	0	113.9
754	P	40.8	Very low	32	Very low	130 Å²	130	141.7 Å²	141.7	84%	0.844	80%	0.802	S	S	*	*	P	Polyproline II helix	trans	-89.3	155.6	-175.4	35.5	-34.7	0	0	0	113.9
755	T	28.7	Very low	32.1	Very low	128 Å²	128	141.7 Å²	141.7	79%	0.785	81%	0.807	S	S	*	*			trans	-119	141.1	174.5	35.2	0	0	0	0	112.4
756	A	30.6	Very low	32.2	Very low	101 Å²	101	137.4 Å²	137.4	84%	0.835	80%	0.799	S	S	*	*			trans	-84.1	147.5	174.5	0	0	0	0	0	111.6
757	W	29	Very low	32.6	Very low	238 Å²	238	139 Å²	139	90%	0.902	81%	0.81	S	S	*	*			trans	-142.1	145.2	169.8	-91.1	78.3	0	0	0	112.2
758	A	28.8	Very low	32.8	Very low	82 Å²	82	137.2 Å²	137.2	68%	0.678	81%	0.808	S	S	*	*			trans	-138.7	159.3	172.8	0	0	0	0	0	110.6
759	H	30.8	Very low	32.7	Very low	197 Å²	197	138.5 Å²	138.5	91%	0.912	81%	0.809	S	S	*	*			trans	70.2	124.7	171.3	-70.8	-29.7	0	0	0	120.9
760	G	28.7	Very low	32.2	Very low	71 Å²	71	137.6 Å²	137.6	73%	0.732	81%	0.806	S	S	*	*				143.2	102.3	116.5	0	0	0	0	0	120.7
761	R	29.5	Very low	32.2	Very low	246 Å²	246	143.5 Å²	143.5	93%	0.928	81%	0.812	S	S	*	*			trans	65.2	156.6	155.4	-75.4	175.6	169.7	178.7	-2.7	117.2
762	R	28.9	Very low	32.3	Very low	203 Å²	203	143.9 Å²	143.9	77%	0.766	80%	0.804	S	S	*	*			cis	-154.9	155.3	22.7	-146.7	-176.6	-176	168.2	5.7	113.2
763	Q	32	Very low	31.6	Very low	167 Å²	167	144.1 Å²	144.1	78%	0.78	80%	0.798	S	S	*	*			trans	10.3	147.2	151.7	-64.8	161.5	-44.6	0	0	121.2
764	G	29.8	Very low	31.5	Very low	69 Å²	69	146.6 Å²	146.6	71%	0.711	80%	0.797	S	S	*	*			cis	148.3	150.1	-2.9	0	0	0	0	0	113.1
765	L	30.5	Very low	30.9	Very low	191 Å²	191	147.7 Å²	147.7	100%	1	79%	0.793	S	S	*	*			trans	-173.9	151.4	161.9	-106.1	155	0	0	0	110.2
766	G	31.1	Very low	31	Very low	66 Å²	66	149 Å²	149	68%	0.68	79%	0.79	S	S	*	*			trans	-119.7	-145.6	-169	0	0	0	0	0	115.8
767	P	52	Low	30.8	Very low	128 Å²	128	148.5 Å²	148.5	83%	0.831	79%	0.787	S	S	*	*				-131.4	159.1	-110.8	39.1	-24.7	0	0	0	116
768	I	30.6	Very low	30.8	Very low	166 Å²	166	147 Å²	147	85%	0.851	79%	0.79	S	S	*	*			trans	-141.8	136.4	167.2	-56.8	-176.7	0	0	0	112.7
769	H	29.9	Very low	30.8	Very low	182 Å²	182	149.9 Å²	149.9	84%	0.843	79%	0.793	S	S	*	*			trans	-33.2	175.2	159.6	-74.8	-74.6	0	0	0	118.4
770	S	30	Very low	30.7	Very low	93 Å²	93	149.3 Å²	149.3	65%	0.65	79%	0.793	S	S	*	*			cis	169.6	142.2	-19.6	176	0	0	0	0	108.3
771	R	30.5	Very low	30.7	Very low	232 Å²	232	152.6 Å²	152.6	88%	0.875	79%	0.793	S	S	*	*			trans	153	107.3	153.5	-91	-177.5	156.4	168.4	-5.1	110.4
772	T	32	Very low	30.8	Very low	103 Å²	103	145.1 Å²	145.1	63%	0.632	78%	0.784	S	S	*	*				82.1	107.3	69.7	61.2	0	0	0	0	115.8
773	N	28	Very low	31.1	Very low	138 Å²	138	142.7 Å²	142.7	74%	0.738	79%	0.786	S	S	*	*				162.4	120.6	124.7	-77.3	-16.7	0	0	0	109
774	L	29.5	Very low	31	Very low	147 Å²	147	139 Å²	139	77%	0.77	78%	0.779	S	S	*	*				58.9	121.9	79	-83.8	142.7	0	0	0	111.1
775	M	29	Very low	31.2	Very low	153 Å²	153	143 Å²	143	75%	0.754	78%	0.784	S	S	*	*			cis	-154.9	169.1	38.1	-103.2	176.6	154.4	0	0	108.9
776	E	28.8	Very low	31.1	Very low	155 Å²	155	147.1 Å²	147.1	72%	0.724	80%	0.795	S	S	*	*			cis	-163.6	162.3	-13.6	-168.9	146	-123	0	0	107.1
777	A	27.9	Very low	31.1	Very low	92 Å²	92	151.2 Å²	151.2	76%	0.76	80%	0.8	S	S	*	*			trans	-126.8	130.1	177.2	0	0	0	0	0	110.1
778	E	29	Very low	30	Very low	207 Å²	207	152.4 Å²	152.4	97%	0.967	80%	0.799	S	S	*	*			trans	-91.6	125.1	165.3	-77.4	-163.5	140.1	0	0	110.5
779	L	29	Very low	30	Very low	141 Å²	141	151.7 Å²	151.7	74%	0.738	80%	0.796	S	S	*	*			trans	-109.2	134.6	175	-161.7	107.7	0	0	0	106.5
780	M	28.9	Very low	30	Very low	185 Å²	185	149.9 Å²	149.9	91%	0.911	79%	0.793	S	S	*	*			trans	-138.5	137.5	157.9	-83.6	-127.4	75.1	0	0	109.7
781	D	27.5	Very low	30	Very low	140 Å²	140	153.4 Å²	153.4	75%	0.749	80%	0.802	S	S	*	*			trans	-80.8	171	-158.9	-86.2	-61.7	0	0	0	115.8
782	A	32.4	Very low	29.9	Very low	89 Å²	89	148.2 Å²	148.2	74%	0.736	80%	0.797	S	S	*	*			trans	-92.3	140.2	164.6	0	0	0	0	0	111.2
783	D	35.3	Very low	29.8	Very low	152 Å²	152	151.4 Å²	151.4	81%	0.813	81%	0.809	S	S	*	*			trans	-158.6	115.2	155.5	-103.4	-18.9	0	0	0	105.3
784	S	29.4	Very low	29.9	Very low	90 Å²	90	152.5 Å²	152.5	63%	0.629	81%	0.814	S	S	*	*				86.6	122.2	83.1	77.7	0	0	0	0	113.3
785	D	33.3	Very low	29.9	Very low	152 Å²	152	152.9 Å²	152.9	81%	0.813	82%	0.818	S	S	*	*			trans	56.8	96.4	162.5	-59.3	-13.2	0	0	0	120.5
786	F	28.9	Very low	30	Very low	279 Å²	279	152.9 Å²	152.9	100%	1.224	82%	0.824	S	S	*	*				-170.6	0	106.9	-118.9	-88.6	0	0	0	113.4

Retrieved 786 of 786 residues in 190.3 ms (Link to these results)

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