A0A096NYN3_PAPAN Loading...

Uronyl 2-sulfotransferase

AlphaFold DB (A0A2K5P860), UniProt , Accession A0A096NYN3, Species PAPAN (Papio anubis, Olive baboon), Gene UST, Length 406 aa.

Structure Viewer

Loading PAE data...

(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	39.5	Very low	31.9	Very low	241 Å²	241	142.8 Å²	142.8	100%	1.187	81%	0.806	S	S	*	*				0	99.4	0	-74	164.5	142.4	0	0	107.2
2	K	30.8	Very low	31.6	Very low	200 Å²	200	138.8 Å²	138.8	87%	0.87	80%	0.804	S	S	*	*				55.7	104.6	105.1	-83.1	-176.9	174.9	176.2	0	112.3
3	K	29.2	Very low	31.8	Very low	177 Å²	177	139.8 Å²	139.8	77%	0.77	81%	0.805	S	S	*	*				68.2	131.2	84	-97.2	-175.4	177.5	176.8	0	110.8
4	K	30.5	Very low	32.4	Very low	149 Å²	149	137.9 Å²	137.9	65%	0.648	80%	0.8	S	S	*	*			cis	-179.8	139.6	49.6	-119.3	-178.6	177.6	-168.2	0	108.6
5	Q	34	Very low	32.2	Very low	121 Å²	121	144.7 Å²	144.7	57%	0.565	81%	0.807	S	S	*	*				72.7	143.1	94.7	-78.3	-178.3	-17.8	0	0	115.2
6	Q	31.8	Very low	33.1	Very low	152 Å²	152	140.9 Å²	140.9	71%	0.71	79%	0.791	S	S	*	*			cis	-167.9	139.4	47	-117.7	137.7	11.7	0	0	109
7	H	32.5	Very low	33	Very low	155 Å²	155	143.6 Å²	143.6	72%	0.718	80%	0.795	S	S	*	*				74.5	159.5	74.4	-87.9	-42	0	0	0	116.3
8	P	43.9	Very low	32.8	Very low	125 Å²	125	139.9 Å²	139.9	81%	0.812	80%	0.796	S	S	*	*			cis	-129.8	164.8	25.1	31.3	-8.1	0	0	0	115
9	G	26.5	Very low	32.8	Very low	79 Å²	79	137.7 Å²	137.7	81%	0.814	80%	0.796	S	S	*	*				103.5	138.9	64.7	0	0	0	0	0	108.5
10	G	25.8	Very low	33.2	Very low	85 Å²	85	136.4 Å²	136.4	88%	0.876	79%	0.792	S	S	*	*			cis	155.6	152.5	4.4	0	0	0	0	0	107.3
11	G	26.3	Very low	33.2	Very low	87 Å²	87	138.2 Å²	138.2	90%	0.897	80%	0.798	S	S	*	*			trans	121.8	139.8	156.8	0	0	0	0	0	118.1
12	A	28.8	Very low	32.7	Very low	95 Å²	95	130.6 Å²	130.6	79%	0.785	78%	0.782	S	S	*	*			trans	-89.8	160.7	-169.5	0	0	0	0	0	115.7
13	D	34.5	Very low	32.6	Very low	152 Å²	152	125 Å²	125	81%	0.813	78%	0.78	S	S	*	*			trans	10.1	145.8	148.1	-65.9	-14.5	0	0	0	120.8
14	P	40.1	Very low	32.6	Very low	113 Å²	113	121.2 Å²	121.2	73%	0.734	78%	0.782	S	S	*	*				-153.8	140.4	83.4	31.1	-8	0	0	0	119.4
15	W	28.2	Very low	33.6	Very low	239 Å²	239	119.7 Å²	119.7	91%	0.905	79%	0.788	S	S	*	*			trans	51.8	170.5	139.6	-67.8	98.1	0	0	0	122
16	P	46.9	Very low	33.8	Very low	84 Å²	84	120.3 Å²	120.3	55%	0.545	80%	0.802	S	S	.	*			cis	-134.8	-169.2	-22	25.4	-0.8	0	0	0	114.5
17	H	32.2	Very low	33.7	Very low	187 Å²	187	116.5 Å²	116.5	87%	0.866	80%	0.804	S	S	*	*			trans	103.9	119.1	162.9	-52.9	-64	0	0	0	114.8
18	G	29.3	Very low	33.7	Very low	78 Å²	78	118 Å²	118	80%	0.804	82%	0.816	S	S	*	*			cis	175.6	133.4	-0.7	0	0	0	0	0	109
19	A	33.2	Very low	33	Very low	97 Å²	97	115.6 Å²	115.6	80%	0.802	81%	0.814	S	S	*	*			trans	-96	156.2	161.2	0	0	0	0	0	108.8
20	P	41	Very low	33.2	Very low	112 Å²	112	116.5 Å²	116.5	73%	0.727	81%	0.808	S	S	*	*				-150.6	144.5	109.1	31.8	-10.9	0	0	0	114.7
21	L	31.4	Very low	33.6	Very low	174 Å²	174	124.7 Å²	124.7	91%	0.911	81%	0.813	S	S	*	*				75.4	136.1	96.4	-63.6	159.7	0	0	0	117.3
22	G	30.2	Very low	34.1	Very low	82 Å²	82	129.3 Å²	129.3	85%	0.845	81%	0.808	S	S	*	*			trans	-78.6	-179.5	176.8	0	0	0	0	0	116.1
23	G	28.6	Very low	34.5	Very low	81 Å²	81	136.4 Å²	136.4	84%	0.835	81%	0.814	S	S	*	*			trans	165.4	122.8	170.6	0	0	0	0	0	111.1
24	A	29.3	Very low	34.6	Very low	98 Å²	98	140.3 Å²	140.3	81%	0.81	82%	0.818	S	S	*	*			trans	-101.6	176.7	156.3	0	0	0	0	0	108
25	P	50.8	Low	34.5	Very low	118 Å²	118	142.4 Å²	142.4	77%	0.766	82%	0.822	S	S	*	*			cis	-117	178.1	-43.5	36.9	-21	0	0	0	110.9
26	P	38.3	Very low	35.1	Very low	133 Å²	133	136.7 Å²	136.7	86%	0.864	82%	0.815	S	S	*	*				-147.5	163.4	104.5	34.4	-15.5	0	0	0	111
27	G	29.3	Very low	34.7	Very low	73 Å²	73	140.2 Å²	140.2	75%	0.753	83%	0.829	S	S	*	*				134.3	144.5	52.1	0	0	0	0	0	107.9
28	L	32.3	Very low	35.4	Very low	186 Å²	186	138.7 Å²	138.7	97%	0.974	83%	0.826	S	S	*	*			trans	-44.9	149.1	-171.7	-84.9	67.8	0	0	0	117.3
29	G	29.3	Very low	36.3	Very low	74 Å²	74	140.4 Å²	140.4	76%	0.763	82%	0.823	S	S	*	*			trans	169.5	88.2	156.5	0	0	0	0	0	116.2
30	S	31.4	Very low	37	Very low	99 Å²	99	144.3 Å²	144.3	69%	0.692	82%	0.822	S	S	*	*			trans	4.6	127.7	150.7	-172.5	0	0	0	0	117.9
31	W	34.9	Very low	37.7	Very low	257 Å²	257	146 Å²	146	97%	0.973	83%	0.825	S	S	*	*				-164.7	136.6	121.9	-97.5	21.1	0	0	0	112.2
32	K	36.4	Very low	38.9	Very low	184 Å²	184	149.1 Å²	149.1	80%	0.8	82%	0.824	S	S	*	*			trans	-68.6	129.3	-169	-66.6	163.5	174.4	169.5	0	112.1
33	R	37.5	Very low	40.1	Very low	244 Å²	244	152.4 Å²	152.4	92%	0.921	82%	0.816	S	S	*	*			trans	-131	108.2	145.8	-78.9	-172.4	-178	-179.5	1.1	109.2	L35	R33-L35 PolarHBondContact O-N 3Å
34	R	36.9	Very low	42.1	Very low	233 Å²	233	151.2 Å²	151.2	88%	0.879	79%	0.794	S	S	*	*			trans	-70.4	117.1	171	-70.4	-178.6	-176.8	-168	0.2	108
35	L	37.5	Very low	44.1	Very low	157 Å²	157	153.9 Å²	153.9	82%	0.822	80%	0.795	S	S	*	*			trans	-105.1	146.4	154.6	-116.9	74.4	0	0	0	107.9	R33	R33-L35 PolarHBondContact O-N 3Å
36	P	39.8	Very low	45.3	Very low	119 Å²	119	158.2 Å²	158.2	77%	0.773	80%	0.795	S	S	*	*	P	Polyproline II helix	trans	-74.5	138.1	-157.9	29.8	-32.4	0	0	0	111.9	L38	P36-L38 PolarHBondContact O-N 3.27Å
37	L	40.1	Very low	47.1	Very low	159 Å²	159	155.8 Å²	155.8	83%	0.832	78%	0.775	S	S	*	*	P	Polyproline II helix	trans	-50.4	122.6	170.1	-79.7	146.6	0	0	0	110.3
38	L	46.6	Very low	49.6	Very low	154 Å²	154	158.9 Å²	158.9	81%	0.806	77%	0.765	S	S	*	*	P	Polyproline II helix	trans	-47.9	140.7	161.5	-77.4	150.2	0	0	0	109.7	P36 F40	P36-L38 PolarHBondContact O-N 3.27Å; L38-F40 PolarHBondContact O-N 2.84Å
39	P	47.7	Very low	52.1	Low	114 Å²	114	151.9 Å²	151.9	74%	0.74	74%	0.738	S	S	*	*	P	Polyproline II helix	trans	-64.6	123.5	179.3	27	-30.9	0	0	0	108.7	L41	P39-L41 PolarHBondContact O-N 3.06Å; P39-L41 VanDerWaalsContact O-N 3.09Å
40	F	48.6	Very low	54.8	Low	179 Å²	179	155.7 Å²	155.7	79%	0.785	73%	0.734	S	S	*	*			trans	-41.7	116.7	168.3	-78.5	-96.2	0	0	0	110.2	L38 R42	L38-F40 PolarHBondContact O-N 2.84Å; F40-R42 VanDerWaalsContact C-N 3.28Å; F40-R42 PolarHBondContact O-N 3.38Å
41	L	55.2	Low	57.3	Low	148 Å²	148	154.2 Å²	154.2	78%	0.775	72%	0.722	S	S	*	*			trans	-56.8	96.9	160.2	-88.5	125.1	0	0	0	107.3	P39 F43	P39-L41 PolarHBondContact O-N 3.06Å; P39-L41 VanDerWaalsContact O-N 3.09Å; L41-F43 HydrophobicContact CB-CD2 4.2Å; L41-F43 HydrophobicContact CD2-CD2 4.18Å; L41-F43 HydrophobicContact CD2-CE2 3.78Å; L41-F43 PolarHBondContact O-N 3.5Å
42	R	55.3	Low	60	Low	239 Å²	239	146.2 Å²	146.2	90%	0.902	70%	0.697	S	S	*	*			trans	-69.7	80.2	163.5	-75.9	-177.7	175.5	175.6	-1.4	107.3	F40 S44	F40-R42 VanDerWaalsContact C-N 3.28Å; F40-R42 PolarHBondContact O-N 3.38Å; R42-S44 PolarHBondContact O-N 2.88Å
43	F	56.2	Low	62.4	Low	151 Å²	151	139.9 Å²	139.9	66%	0.662	68%	0.679	S	S	*	*			trans	-64.1	113	159.5	-96.2	-83.9	0	0	0	106.8	L41 L45 D47	L41-F43 HydrophobicContact CB-CD2 4.2Å; L41-F43 HydrophobicContact CD2-CD2 4.18Å; L41-F43 HydrophobicContact CD2-CE2 3.78Å; L41-F43 PolarHBondContact O-N 3.5Å; F43-L45 PolarHBondContact O-N 3.38Å; F43-D47 HydrophobicContact CD1-CB 4.31Å
44	S	69.9	Low	64.8	Low	56 Å²	56	131.5 Å²	131.5	39%	0.392	66%	0.655	S	S	.	*			trans	-60.1	138.7	172.5	177.9	0	0	0	0	108.4	R42 R46 D47 Y48	R42-S44 PolarHBondContact O-N 2.88Å; S44-R46 PolarHBondContact O-N 2.95Å; S44-R46 WeakPolarHBondContact OG-CB 3.4Å; S44-R46 PolarHBondContact OG-N 3.48Å; S44-D47 VanDerWaalsContact CB-OD2 3.3Å; S44-D47 WeakPolarHBondContact CB-OD2 3.41Å; S44-D47 PolarHBondContact O-N 3.41Å; S44-Y48 PolarHBondContact O-N 3.49Å
45	L	71.8	Confident	67.3	Low	155 Å²	155	124.8 Å²	124.8	81%	0.812	64%	0.636	S	S	*	*	H	α-helix	trans	-50.4	-27.9	169.5	-93.1	155.9	0	0	0	111.7	F43 G49	F43-L45 PolarHBondContact O-N 3.38Å; L45-G49 PolarHBondContact O-N 2.9Å
46	R	75.5	Confident	69.8	Low	208 Å²	208	122.5 Å²	122.5	79%	0.785	62%	0.624	S	S	*	*	H	α-helix	trans	-69.2	-39.2	174.7	-161.6	174.7	109.8	168.4	6.4	113	S44 G49 F50	S44-R46 PolarHBondContact O-N 2.95Å; S44-R46 WeakPolarHBondContact OG-CB 3.4Å; S44-R46 PolarHBondContact OG-N 3.48Å; R46-G49 PolarHBondContact O-N 3.49Å; R46-F50 PolarHBondContact O-N 3.31Å
47	D	76.5	Confident	72.1	Confident	83 Å²	83	121.7 Å²	121.7	44%	0.444	62%	0.617	S	S	.	*	H	α-helix	trans	-75.1	-37.6	179.4	-58.4	-29.4	0	0	0	110.6	F43 S44 F50 C51	F43-D47 HydrophobicContact CD1-CB 4.31Å; S44-D47 VanDerWaalsContact CB-OD2 3.3Å; S44-D47 WeakPolarHBondContact CB-OD2 3.41Å; S44-D47 PolarHBondContact O-N 3.41Å; D47-F50 PolarHBondContact O-N 2.93Å; D47-C51 WeakPolarHBondContact O-CB 3.28Å; D47-C51 PolarHBondContact O-N 3.37Å
48	Y	81.6	Confident	74.3	Confident	138 Å²	138	122 Å²	122	54%	0.541	61%	0.612	S	S	.	*	H	α-helix	trans	-63.4	-43.1	170.1	-176.1	-102.3	0	0	0	111.3	S44 F50 C51 M52	S44-Y48 PolarHBondContact O-N 3.49Å; Y48-F50 PolarHBondContact O-N 2.91Å; Y48-C51 PolarHBondContact O-N 2.94Å; Y48-M52 HydrophobicContact CD1-CG 4Å; Y48-M52 HydrophobicContact CD2-CG 4.33Å; Y48-M52 HydrophobicContact CE1-CG 3.6Å; Y48-M52 HydrophobicContact CE1-SD 4.44Å; Y48-M52 HydrophobicContact CE2-CG 3.96Å; Y48-M52 HydrophobicContact CE2-SD 4.1Å; Y48-M52 HydrophobicContact CG-CG 4.35Å; Y48-M52 WeakPolarHBondContact O-CB 3.34Å; Y48-M52 VanDerWaalsContact O-CG 3.29Å; Y48-M52 WeakPolarHBondContact O-CG 3.32Å; Y48-M52 PolarHBondContact O-N 3.27Å
49	G	85	Confident	76.2	Confident	38 Å²	38	118.3 Å²	118.3	39%	0.392	60%	0.598	S	S	.	*	H	α-helix	trans	-60.1	-43.1	174.5	0	0	0	0	0	112.6	L45 R46 M52 A53	L45-G49 PolarHBondContact O-N 2.9Å; R46-G49 PolarHBondContact O-N 3.49Å; G49-M52 PolarHBondContact O-N 3.39Å; G49-A53 VanDerWaalsContact O-CB 3.25Å; G49-A53 WeakPolarHBondContact O-CB 3.3Å; G49-A53 PolarHBondContact O-N 2.92Å
50	F	86.4	Confident	78	Confident	154 Å²	154	117.2 Å²	117.2	68%	0.675	59%	0.585	S	S	*	*	H	α-helix	trans	-64.5	-42.6	176	-163.3	-95.6	0	0	0	111.7	R46 D47 Y48 A53 T54	R46-F50 PolarHBondContact O-N 3.31Å; D47-F50 PolarHBondContact O-N 2.93Å; Y48-F50 PolarHBondContact O-N 2.91Å; F50-A53 PolarHBondContact O-N 3.47Å; F50-T54 HydrophobicContact CD1-CG2 4.12Å; F50-T54 HydrophobicContact CE1-CG2 3.88Å; F50-T54 HydrophobicContact CZ-CG2 4.43Å; F50-T54 WeakPolarHBondContact O-CG2 3.41Å; F50-T54 PolarHBondContact O-N 3.49Å; F50-T54 PolarHBondContact O-OG1 2.84Å; F50-T54 VanDerWaalsContact O-OG1 3.1Å
51	C	84.1	Confident	79.5	Confident	68 Å²	68	110.6 Å²	110.6	46%	0.459	57%	0.568	S	S	.	*	H	α-helix	trans	-67	-39.9	179	-152.7	0	0	0	0	112.5	D47 Y48 T54 L55	D47-C51 WeakPolarHBondContact O-CB 3.28Å; D47-C51 PolarHBondContact O-N 3.37Å; Y48-C51 PolarHBondContact O-N 2.94Å; C51-T54 WeakPolarHBondContact CA-OG1 3.25Å; C51-T54 PolarHBondContact O-OG1 2.89Å; C51-L55 WeakPolarHBondContact O-CB 3.32Å; C51-L55 PolarHBondContact O-N 3.44Å
52	M	90.7	Very high	80.6	Confident	89 Å²	89	106 Å²	106	44%	0.438	55%	0.548	S	S	.	.	H	α-helix	trans	-71	-34.9	175.9	-68.5	-59.5	-73.5	0	0	111.8	Y48 G49 L55 L56	Y48-M52 HydrophobicContact CD1-CG 4Å; Y48-M52 HydrophobicContact CD2-CG 4.33Å; Y48-M52 HydrophobicContact CE1-CG 3.6Å; Y48-M52 HydrophobicContact CE1-SD 4.44Å; Y48-M52 HydrophobicContact CE2-CG 3.96Å; Y48-M52 HydrophobicContact CE2-SD 4.1Å; Y48-M52 HydrophobicContact CG-CG 4.35Å; Y48-M52 WeakPolarHBondContact O-CB 3.34Å; Y48-M52 VanDerWaalsContact O-CG 3.29Å; Y48-M52 WeakPolarHBondContact O-CG 3.32Å; Y48-M52 PolarHBondContact O-N 3.27Å; G49-M52 PolarHBondContact O-N 3.39Å; M52-L55 HydrophobicContact SD-CD1 4.37Å; M52-L56 VanDerWaalsContact O-CB 3.3Å; M52-L56 WeakPolarHBondContact O-CB 3.33Å; M52-L56 PolarHBondContact O-N 2.85Å
53	A	88.2	Confident	81.9	Confident	52 Å²	52	99 Å²	99	43%	0.43	53%	0.528	S	S	.	.	H	α-helix	trans	-67.2	-42.7	174.4	0	0	0	0	0	111.8	G49 F50 L56 V57	G49-A53 VanDerWaalsContact O-CB 3.25Å; G49-A53 WeakPolarHBondContact O-CB 3.3Å; G49-A53 PolarHBondContact O-N 2.92Å; F50-A53 PolarHBondContact O-N 3.47Å; A53-L56 PolarHBondContact O-N 3.04Å; A53-V57 WeakPolarHBondContact O-CG2 3.29Å; A53-V57 PolarHBondContact O-N 3.21Å
54	T	87.6	Confident	82.8	Confident	67 Å²	67	97.1 Å²	97.1	41%	0.411	53%	0.525	S	S	.	.	H	α-helix	trans	-66.3	-40.5	175.5	51.6	0	0	0	0	111.7	F50 C51 L56 V57 F58	F50-T54 HydrophobicContact CD1-CG2 4.12Å; F50-T54 HydrophobicContact CE1-CG2 3.88Å; F50-T54 HydrophobicContact CZ-CG2 4.43Å; F50-T54 WeakPolarHBondContact O-CG2 3.41Å; F50-T54 PolarHBondContact O-N 3.49Å; F50-T54 PolarHBondContact O-OG1 2.84Å; F50-T54 VanDerWaalsContact O-OG1 3.1Å; C51-T54 WeakPolarHBondContact CA-OG1 3.25Å; C51-T54 PolarHBondContact O-OG1 2.89Å; T54-L56 VanDerWaalsContact C-N 3.35Å; T54-L56 PolarHBondContact O-N 3.18Å; T54-V57 PolarHBondContact O-N 3.24Å; T54-F58 WeakPolarHBondContact O-CB 3.42Å; T54-F58 PolarHBondContact O-N 3.15Å
55	L	89.6	Confident	83	Confident	93 Å²	93	100.3 Å²	100.3	49%	0.487	53%	0.529	S	S	.	.	H	α-helix	trans	-58.1	-46.1	171.5	-100.8	158.4	0	0	0	111.8	C51 M52 V57 F58 C59	C51-L55 WeakPolarHBondContact O-CB 3.32Å; C51-L55 PolarHBondContact O-N 3.44Å; M52-L55 HydrophobicContact SD-CD1 4.37Å; L55-V57 PolarHBondContact O-N 3.44Å; L55-F58 PolarHBondContact O-N 2.92Å; L55-C59 WeakPolarHBondContact O-CB 3.3Å; L55-C59 PolarHBondContact O-N 3.07Å; L55-C59 PolarHBondContact O-SG 3.48Å
56	L	90.1	Very high	83.1	Confident	108 Å²	108	99.3 Å²	99.3	57%	0.565	52%	0.52	S	S	*	.	H	α-helix	trans	-63.8	-41.9	179.7	-169.4	121.1	0	0	0	111.9	M52 A53 T54 F58 C59 L60	M52-L56 VanDerWaalsContact O-CB 3.3Å; M52-L56 WeakPolarHBondContact O-CB 3.33Å; M52-L56 PolarHBondContact O-N 2.85Å; A53-L56 PolarHBondContact O-N 3.04Å; T54-L56 VanDerWaalsContact C-N 3.35Å; T54-L56 PolarHBondContact O-N 3.18Å; L56-F58 VanDerWaalsContact C-N 3.32Å; L56-F58 PolarHBondContact O-N 3.5Å; L56-C59 PolarHBondContact O-N 3.35Å; L56-L60 HydrophobicContact CD2-CD1 3.65Å; L56-L60 HydrophobicContact CG-CD1 4.18Å; L56-L60 WeakPolarHBondContact O-CB 3.29Å; L56-L60 VanDerWaalsContact O-CG 3.32Å; L56-L60 WeakPolarHBondContact O-CG 3.36Å; L56-L60 PolarHBondContact O-N 2.87Å
57	V	88.3	Confident	83.1	Confident	102 Å²	102	95.9 Å²	95.9	62%	0.618	52%	0.517	S	S	*	.	H	α-helix	trans	-62.8	-40.5	173.9	171.1	0	0	0	0	111.1	A53 T54 L55 L60 G61	A53-V57 WeakPolarHBondContact O-CG2 3.29Å; A53-V57 PolarHBondContact O-N 3.21Å; T54-V57 PolarHBondContact O-N 3.24Å; L55-V57 PolarHBondContact O-N 3.44Å; V57-L60 PolarHBondContact O-N 3.31Å; V57-G61 PolarHBondContact O-N 3.26Å
58	F	86	Confident	82.7	Confident	165 Å²	165	96 Å²	96	72%	0.724	52%	0.523	S	S	*	.	H	α-helix	trans	-68	-41.5	178.2	-149.9	-90.4	0	0	0	111.9	T54 L55 L56 G61 S62	T54-F58 WeakPolarHBondContact O-CB 3.42Å; T54-F58 PolarHBondContact O-N 3.15Å; L55-F58 PolarHBondContact O-N 2.92Å; L56-F58 VanDerWaalsContact C-N 3.32Å; L56-F58 PolarHBondContact O-N 3.5Å; F58-G61 PolarHBondContact O-N 3.05Å; F58-S62 WeakPolarHBondContact O-CB 3.33Å; F58-S62 PolarHBondContact O-N 3.29Å
59	C	86.1	Confident	82.1	Confident	77 Å²	77	93 Å²	93	52%	0.52	54%	0.535	S	S	.	.	H	α-helix	trans	-64.8	-43.4	175.3	-69.5	0	0	0	0	111.8	L55 L56 S62 L63	L55-C59 WeakPolarHBondContact O-CB 3.3Å; L55-C59 PolarHBondContact O-N 3.07Å; L55-C59 PolarHBondContact O-SG 3.48Å; L56-C59 PolarHBondContact O-N 3.35Å; C59-S62 PolarHBondContact O-N 2.86Å; C59-L63 WeakPolarHBondContact O-CB 3.49Å; C59-L63 PolarHBondContact O-N 3.3Å
60	L	85.6	Confident	81.3	Confident	91 Å²	91	91.9 Å²	91.9	48%	0.476	52%	0.523	S	S	.	.	H	α-helix	trans	-65	-40.8	174.8	-76.3	169.1	0	0	0	111.5	L56 V57 L63 L64	L56-L60 HydrophobicContact CD2-CD1 3.65Å; L56-L60 HydrophobicContact CG-CD1 4.18Å; L56-L60 WeakPolarHBondContact O-CB 3.29Å; L56-L60 VanDerWaalsContact O-CG 3.32Å; L56-L60 WeakPolarHBondContact O-CG 3.36Å; L56-L60 PolarHBondContact O-N 2.87Å; V57-L60 PolarHBondContact O-N 3.31Å; L60-L63 PolarHBondContact O-N 3.23Å; L60-L64 WeakPolarHBondContact O-CB 3.49Å; L60-L64 VanDerWaalsContact O-CG 3.28Å; L60-L64 WeakPolarHBondContact O-CG 3.43Å; L60-L64 PolarHBondContact O-N 3.49Å
61	G	80.8	Confident	80.5	Confident	40 Å²	40	86.8 Å²	86.8	41%	0.412	51%	0.506	S	S	.	.	H	α-helix	trans	-62	-41.8	174.1	0	0	0	0	0	112.7	V57 F58 L64 Y65	V57-G61 PolarHBondContact O-N 3.26Å; F58-G61 PolarHBondContact O-N 3.05Å; G61-L64 PolarHBondContact O-N 3.48Å; G61-Y65 WeakPolarHBondContact O-CB 3.3Å; G61-Y65 PolarHBondContact O-N 3.38Å
62	S	78.2	Confident	79.8	Confident	53 Å²	53	87 Å²	87	37%	0.371	51%	0.507	S	S	.	.	H	α-helix	trans	-67.7	-39.1	175.5	-173.7	0	0	0	0	112.4	F58 C59 Y65 Q66	F58-S62 WeakPolarHBondContact O-CB 3.33Å; F58-S62 PolarHBondContact O-N 3.29Å; C59-S62 PolarHBondContact O-N 2.86Å; S62-Y65 WeakPolarHBondContact O-CB 3.41Å; S62-Y65 PolarHBondContact O-N 3.23Å; S62-Q66 WeakPolarHBondContact O-CG 3.4Å; S62-Q66 PolarHBondContact O-N 2.92Å
63	L	81.1	Confident	78.7	Confident	90 Å²	90	92.9 Å²	92.9	47%	0.471	52%	0.524	S	S	.	.	H	α-helix	trans	-65.3	-44.1	176.3	-172.9	74.6	0	0	0	110.7	C59 L60 Q66 L67	C59-L63 WeakPolarHBondContact O-CB 3.49Å; C59-L63 PolarHBondContact O-N 3.3Å; L60-L63 PolarHBondContact O-N 3.23Å; L63-Q66 PolarHBondContact O-N 2.94Å; L63-L67 HydrophobicContact CD2-CD1 4.43Å; L63-L67 HydrophobicContact CG-CD1 3.97Å; L63-L67 WeakPolarHBondContact O-CB 3.48Å; L63-L67 VanDerWaalsContact O-CG 3.3Å; L63-L67 WeakPolarHBondContact O-CG 3.47Å; L63-L67 PolarHBondContact O-N 3.32Å
64	L	75.5	Confident	78	Confident	113 Å²	113	97.5 Å²	97.5	59%	0.592	53%	0.534	S	S	*	.	H	α-helix	trans	-61	-45.1	174.3	-73.2	170.1	0	0	0	110.9	L60 G61 Q66 L67 S68	L60-L64 WeakPolarHBondContact O-CB 3.49Å; L60-L64 VanDerWaalsContact O-CG 3.28Å; L60-L64 WeakPolarHBondContact O-CG 3.43Å; L60-L64 PolarHBondContact O-N 3.49Å; G61-L64 PolarHBondContact O-N 3.48Å; L64-Q66 VanDerWaalsContact C-N 3.32Å; L64-Q66 PolarHBondContact O-N 2.81Å; L64-L67 PolarHBondContact O-N 2.87Å; L64-S68 WeakPolarHBondContact O-CB 3.33Å; L64-S68 PolarHBondContact O-N 2.98Å; L64-S68 PolarHBondContact O-OG 3.38Å
65	Y	74.1	Confident	77	Confident	122 Å²	122	98.6 Å²	98.6	48%	0.478	54%	0.537	S	S	.	.	H	α-helix	trans	-57.3	-42.2	176	-179.4	-92.3	0	0	0	113	G61 S62 G69 G70 P71	G61-Y65 WeakPolarHBondContact O-CB 3.3Å; G61-Y65 PolarHBondContact O-N 3.38Å; S62-Y65 WeakPolarHBondContact O-CB 3.41Å; S62-Y65 PolarHBondContact O-N 3.23Å; Y65-G69 PolarHBondContact O-N 3.49Å; Y65-G70 PolarHBondContact O-N 2.9Å; Y65-P71 HydrophobicContact CE2-CB 3.89Å; Y65-P71 HydrophobicContact CE2-CG 4.37Å; Y65-P71 VanDerWaalsContact CE2-N 3.34Å
66	Q	73.9	Confident	75.8	Confident	135 Å²	135	98 Å²	98	63%	0.631	53%	0.534	S	S	*	.	H	α-helix	trans	-71	-38.1	177.5	-74.2	172.8	-20.3	0	0	112.5	S62 L63 L64	S62-Q66 WeakPolarHBondContact O-CG 3.4Å; S62-Q66 PolarHBondContact O-N 2.92Å; L63-Q66 PolarHBondContact O-N 2.94Å; L64-Q66 VanDerWaalsContact C-N 3.32Å; L64-Q66 PolarHBondContact O-N 2.81Å
67	L	76.2	Confident	74.9	Confident	136 Å²	136	97 Å²	97	71%	0.712	53%	0.529	S	S	*	.	H	α-helix	trans	-74.7	-31.3	178.7	-72.4	169.9	0	0	0	113	L63 L64 G69	L63-L67 HydrophobicContact CD2-CD1 4.43Å; L63-L67 HydrophobicContact CG-CD1 3.97Å; L63-L67 WeakPolarHBondContact O-CB 3.48Å; L63-L67 VanDerWaalsContact O-CG 3.3Å; L63-L67 WeakPolarHBondContact O-CG 3.47Å; L63-L67 PolarHBondContact O-N 3.32Å; L64-L67 PolarHBondContact O-N 2.87Å; L67-G69 VanDerWaalsContact C-N 3.3Å
68	S	67.4	Low	73.9	Confident	84 Å²	84	95.6 Å²	95.6	59%	0.587	52%	0.518	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.1	4.3	178	57.7	0	0	0	0	114.2	L64 G70	L64-S68 WeakPolarHBondContact O-CB 3.33Å; L64-S68 PolarHBondContact O-N 2.98Å; L64-S68 PolarHBondContact O-OG 3.38Å; S68-G70 VanDerWaalsContact C-N 3.29Å; S68-G70 PolarHBondContact O-N 2.91Å; S68-G70 PolarHBondContact OG-O 2.88Å
69	G	70.1	Confident	72.6	Confident	75 Å²	75	94.5 Å²	94.5	77%	0.773	51%	0.509	S	S	*	.	T	Hydrogen-bonded Turn	trans	68.2	23.1	175	0	0	0	0	0	114.6	Y65 L67	Y65-G69 PolarHBondContact O-N 3.49Å; L67-G69 VanDerWaalsContact C-N 3.3Å
70	G	67.4	Low	71.4	Confident	15 Å²	15	98.4 Å²	98.4	16%	0.155	52%	0.52	C	S	.	.	S	Bend	trans	139.6	-174.7	179.4	0	0	0	0	0	114.8	Y65 S68	Y65-G70 PolarHBondContact O-N 2.9Å; S68-G70 VanDerWaalsContact C-N 3.29Å; S68-G70 PolarHBondContact O-N 2.91Å; S68-G70 PolarHBondContact OG-O 2.88Å
71	P	69.9	Low	70.1	Confident	47 Å²	47	104.2 Å²	104.2	31%	0.305	54%	0.537	S	S	.	.			trans	-67.1	142.4	-174.9	24.9	-32.3	0	0	0	112.3	Y65 L75 L76	Y65-P71 HydrophobicContact CE2-CB 3.89Å; Y65-P71 HydrophobicContact CE2-CG 4.37Å; Y65-P71 VanDerWaalsContact CE2-N 3.34Å; P71-L75 HydrophobicContact CB-CB 4.35Å; P71-L76 HydrophobicContact CG-CD2 3.79Å; P71-L76 HydrophobicContact CG-CG 4.07Å
72	P	69.9	Low	69.3	Low	74 Å²	74	108.9 Å²	108.9	48%	0.481	55%	0.551	S	S	.	*			trans	-58.2	145.7	172.9	21.2	-32.1	0	0	0	111.7	F74 L75 L76	P72-F74 PolarHBondContact O-N 3.36Å; P72-L75 HydrophobicContact CG-CD1 3.85Å; P72-L75 HydrophobicContact CG-CG 4.08Å; P72-L75 WeakPolarHBondContact O-CB 3.48Å; P72-L75 PolarHBondContact O-N 2.85Å; P72-L76 PolarHBondContact O-N 2.92Å
73	R	66.4	Low	68.2	Low	212 Å²	212	108.3 Å²	108.3	80%	0.8	55%	0.554	S	S	*	*	H	α-helix	trans	-50.2	-37.5	-174.3	-71.5	-176.3	178.8	176.3	-0.8	114.1	L75 L76 D77	R73-L75 VanDerWaalsContact C-N 3.29Å; R73-L75 PolarHBondContact O-N 3.37Å; R73-L76 WeakPolarHBondContact O-CA 3.34Å; R73-L76 WeakPolarHBondContact O-CB 3.39Å; R73-L76 PolarHBondContact O-N 3.19Å; R73-D77 PolarHBondContact O-N 2.83Å
74	F	73.6	Confident	66.6	Low	148 Å²	148	110.4 Å²	110.4	65%	0.649	57%	0.566	S	S	*	*	H	α-helix	trans	-58.2	-36.3	176	174.3	-99.2	0	0	0	113.7	P72 D77 L78	P72-F74 PolarHBondContact O-N 3.36Å; F74-D77 PolarHBondContact O-N 2.96Å; F74-L78 WeakPolarHBondContact O-CB 3.38Å; F74-L78 PolarHBondContact O-N 3.1Å
75	L	66.1	Low	65.2	Low	90 Å²	90	109.5 Å²	109.5	47%	0.471	57%	0.569	S	S	.	*	H	α-helix	trans	-74.4	-29.1	176.2	-67.5	-179.4	0	0	0	112.3	P71 P72 R73 R79	P71-L75 HydrophobicContact CB-CB 4.35Å; P72-L75 HydrophobicContact CG-CD1 3.85Å; P72-L75 HydrophobicContact CG-CG 4.08Å; P72-L75 WeakPolarHBondContact O-CB 3.48Å; P72-L75 PolarHBondContact O-N 2.85Å; R73-L75 VanDerWaalsContact C-N 3.29Å; R73-L75 PolarHBondContact O-N 3.37Å; L75-R79 PolarHBondContact O-N 2.84Å; L75-R79 VanDerWaalsContact O-N 3.15Å
76	L	66.1	Low	64.1	Low	80 Å²	80	109.3 Å²	109.3	42%	0.419	58%	0.581	S	S	.	*	H	α-helix	trans	-70.8	-40.2	171.5	-66	172.1	0	0	0	111.2	P71 P72 R73 R79 Q80	P71-L76 HydrophobicContact CG-CD2 3.79Å; P71-L76 HydrophobicContact CG-CG 4.07Å; P72-L76 PolarHBondContact O-N 2.92Å; R73-L76 WeakPolarHBondContact O-CA 3.34Å; R73-L76 WeakPolarHBondContact O-CB 3.39Å; R73-L76 PolarHBondContact O-N 3.19Å; L76-R79 WeakPolarHBondContact O-CB 3.41Å; L76-R79 PolarHBondContact O-N 3.27Å; L76-Q80 PolarHBondContact O-N 3.24Å
77	D	70.9	Confident	62.9	Low	88 Å²	88	112.3 Å²	112.3	47%	0.471	59%	0.588	S	S	.	*	H	α-helix	trans	-68.4	-37.9	176.2	-66.9	-21.9	0	0	0	111.3	R73 F74 R79 Q80 Y81	R73-D77 PolarHBondContact O-N 2.83Å; F74-D77 PolarHBondContact O-N 2.96Å; D77-R79 VanDerWaalsContact C-N 3.32Å; D77-R79 PolarHBondContact O-N 3.41Å; D77-Q80 VanDerWaalsContact O-CB 3.29Å; D77-Q80 WeakPolarHBondContact O-CB 3.37Å; D77-Q80 PolarHBondContact O-N 2.9Å; D77-Q80 VanDerWaalsContact O-N 3.07Å; D77-Y81 PolarHBondContact O-N 3.29Å
78	L	66.7	Low	61.5	Low	73 Å²	73	112.9 Å²	112.9	38%	0.382	59%	0.591	S	S	.	*	H	α-helix	trans	-64.9	-34.7	174.5	-166.9	69.8	0	0	0	112.1	F74 Q80 Y81 L82	F74-L78 WeakPolarHBondContact O-CB 3.38Å; F74-L78 PolarHBondContact O-N 3.1Å; L78-Q80 PolarHBondContact O-N 3.19Å; L78-Y81 PolarHBondContact O-N 2.94Å; L78-L82 HydrophobicContact CD1-CD1 4.41Å; L78-L82 HydrophobicContact CD2-CD1 4.2Å; L78-L82 HydrophobicContact CG-CD1 3.84Å; L78-L82 HydrophobicContact CG-CG 4.42Å; L78-L82 WeakPolarHBondContact O-CB 3.44Å; L78-L82 WeakPolarHBondContact O-CG 3.43Å; L78-L82 PolarHBondContact O-N 2.9Å
79	R	59	Low	60.7	Low	141 Å²	141	116.4 Å²	116.4	53%	0.532	60%	0.603	S	S	.	*	H	α-helix	trans	-61.7	-33	171	179.6	-177	179.7	166.1	4.7	111.9	L75 L76 D77 Y81 G83	L75-R79 PolarHBondContact O-N 2.84Å; L75-R79 VanDerWaalsContact O-N 3.15Å; L76-R79 WeakPolarHBondContact O-CB 3.41Å; L76-R79 PolarHBondContact O-N 3.27Å; D77-R79 VanDerWaalsContact C-N 3.32Å; D77-R79 PolarHBondContact O-N 3.41Å; R79-Y81 VanDerWaalsContact C-N 3.34Å; R79-G83 PolarHBondContact O-N 3.09Å
80	Q	59.8	Low	59.5	Low	159 Å²	159	118.8 Å²	118.8	74%	0.743	60%	0.598	S	S	*	*	H	α-helix	trans	-71.3	-30.9	177.3	-155.5	165.1	1.3	0	0	112.1	L76 D77 L78	L76-Q80 PolarHBondContact O-N 3.24Å; D77-Q80 VanDerWaalsContact O-CB 3.29Å; D77-Q80 WeakPolarHBondContact O-CB 3.37Å; D77-Q80 PolarHBondContact O-N 2.9Å; D77-Q80 VanDerWaalsContact O-N 3.07Å; L78-Q80 PolarHBondContact O-N 3.19Å
81	Y	59.1	Low	58.9	Low	213 Å²	213	127.7 Å²	127.7	84%	0.835	64%	0.635	S	S	*	*	H	α-helix	trans	-83.9	-30.8	175.6	-86.4	-83.5	0	0	0	114.5	D77 L78 R79	D77-Y81 PolarHBondContact O-N 3.29Å; L78-Y81 PolarHBondContact O-N 2.94Å; R79-Y81 VanDerWaalsContact C-N 3.34Å
82	L	64.4	Low	58.2	Low	138 Å²	138	127.1 Å²	127.1	72%	0.723	64%	0.638	S	S	*	*	H	α-helix	trans	-88.3	-2.9	-179.9	-69.6	172.1	0	0	0	113.9	L78	L78-L82 HydrophobicContact CD1-CD1 4.41Å; L78-L82 HydrophobicContact CD2-CD1 4.2Å; L78-L82 HydrophobicContact CG-CD1 3.84Å; L78-L82 HydrophobicContact CG-CG 4.42Å; L78-L82 WeakPolarHBondContact O-CB 3.44Å; L78-L82 WeakPolarHBondContact O-CG 3.43Å; L78-L82 PolarHBondContact O-N 2.9Å
83	G	53.8	Low	57.6	Low	41 Å²	41	129.3 Å²	129.3	42%	0.423	65%	0.652	S	S	.	*			trans	74.7	160.5	-175.9	0	0	0	0	0	112.7	R79 S85	R79-G83 PolarHBondContact O-N 3.09Å; G83-S85 PolarHBondContact O-N 3.2Å
84	N	47.6	Very low	56.9	Low	134 Å²	134	124.8 Å²	124.8	72%	0.717	65%	0.65	S	S	*	*			trans	-61.7	104.5	177.6	-82.4	-24.1	0	0	0	110.5	T86	N84-T86 PolarHBondContact O-N 3.29Å
85	S	47	Very low	55.8	Low	95 Å²	95	123.3 Å²	123.3	66%	0.664	66%	0.655	S	S	*	*			trans	-64.9	118.4	164	-177.8	0	0	0	0	108.8	G83 Y87	G83-S85 PolarHBondContact O-N 3.2Å; S85-Y87 PolarHBondContact O-N 3.47Å
86	T	50	Low	55.1	Low	118 Å²	118	123.6 Å²	123.6	72%	0.724	67%	0.665	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.9	11.6	178.1	44.5	0	0	0	0	113.5	N84 L88	N84-T86 PolarHBondContact O-N 3.29Å; T86-L88 PolarHBondContact O-N 3.44Å
87	Y	48.6	Very low	54.4	Low	198 Å²	198	129.6 Å²	129.6	78%	0.776	69%	0.688	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.7	-10.7	-165.1	-159.2	-99.9	0	0	0	115.1	S85	S85-Y87 PolarHBondContact O-N 3.47Å
88	L	47.5	Very low	53.8	Low	148 Å²	148	131.3 Å²	131.3	78%	0.775	70%	0.701	S	S	*	*	S	Bend	trans	-132.1	-0.6	-173	-80.1	177.3	0	0	0	118.9	T86	T86-L88 PolarHBondContact O-N 3.44Å
89	D	49.8	Very low	53.5	Low	157 Å²	157	131.2 Å²	131.2	84%	0.84	70%	0.701	S	S	*	*	S	Bend	trans	-150.3	57.1	177.2	-81	-46.5	0	0	0	112.7
90	D	46.1	Very low	54.3	Low	125 Å²	125	130 Å²	130	67%	0.668	71%	0.711	S	S	*	*			trans	-151.2	69.6	171.1	-131.5	-8.1	0	0	0	112.9
91	H	53.6	Low	55.5	Low	202 Å²	202	126 Å²	126	94%	0.935	69%	0.692	S	S	*	*			trans	-94.1	48.3	149.9	-65	-41.1	0	0	0	109.5
92	G	56.4	Low	57.1	Low	36 Å²	36	118.2 Å²	118.2	37%	0.371	67%	0.667	S	S	.	*	S	Bend	trans	-55.5	155.6	144.9	0	0	0	0	0	109.3
93	P	56.4	Low	58.4	Low	120 Å²	120	113 Å²	113	78%	0.779	64%	0.642	S	S	*	*	S	Bend	trans	-48.4	138.4	170.1	21.5	-31.1	0	0	0	108.4
94	P	53.2	Low	60.4	Low	116 Å²	116	112.4 Å²	112.4	75%	0.753	63%	0.628	S	S	*	*	P	Polyproline II helix	trans	-48.7	132.3	-177.4	20.1	-32	0	0	0	108	S96	P94-S96 PolarHBondContact O-N 3.11Å; P94-S96 VanDerWaalsContact O-N 3.07Å
95	P	49.8	Very low	62.8	Low	117 Å²	117	106 Å²	106	76%	0.76	59%	0.594	S	S	*	*	P	Polyproline II helix	trans	-49.9	126.9	-179.1	19.8	-31.5	0	0	0	107.2	K97	P95-K97 PolarHBondContact O-N 3.23Å
96	S	51.4	Low	65.2	Low	97 Å²	97	101.6 Å²	101.6	68%	0.678	56%	0.563	S	S	*	*	P	Polyproline II helix	trans	-48.9	119	179.6	64.3	0	0	0	0	106.1	P94 V98	P94-S96 PolarHBondContact O-N 3.11Å; P94-S96 VanDerWaalsContact O-N 3.07Å; S96-V98 PolarHBondContact O-N 3.05Å
97	K	51.8	Low	67.5	Low	205 Å²	205	96.1 Å²	96.1	89%	0.891	53%	0.529	S	S	*	.			trans	-62.6	88.3	179.4	-73	179.7	-179.6	176.2	0	106.9	P95 L99	P95-K97 PolarHBondContact O-N 3.23Å; K97-L99 PolarHBondContact O-N 3.08Å
98	V	57.3	Low	69.8	Low	125 Å²	125	86.7 Å²	86.7	76%	0.758	49%	0.492	S	S	*	.			trans	-63.4	109.5	170.6	-179	0	0	0	0	103.9	S96	S96-V98 PolarHBondContact O-N 3.05Å
99	L	60	Low	72.1	Confident	71 Å²	71	81.1 Å²	81.1	37%	0.372	46%	0.461	S	S	.	.			trans	-55.6	136.6	175.8	-73.5	171	0	0	0	107.3	K97 F101 P162	K97-L99 PolarHBondContact O-N 3.08Å; L99-F101 WeakPolarHBondContact CB-O 3.43Å; L99-F101 PolarHBondContact O-N 3.18Å; L99-P162 HydrophobicContact CD1-CB 4.19Å; L99-P162 HydrophobicContact CD1-CG 4.39Å
100	P	76.1	Confident	74.3	Confident	115 Å²	115	73.7 Å²	73.7	75%	0.747	42%	0.421	S	S	*	.	S	Bend	trans	-65.3	-3.4	179.6	23.3	-30.1	0	0	0	113.2
101	F	85.6	Confident	76.6	Confident	76 Å²	76	68 Å²	68	33%	0.333	39%	0.392	S	S	.	.	S	Bend	trans	-132.6	154.7	-179.3	-59.4	-80.2	0	0	0	109.3	L99 S103 F297 P299 H300	L99-F101 WeakPolarHBondContact CB-O 3.43Å; L99-F101 PolarHBondContact O-N 3.18Å; F101-S103 PolarHBondContact O-N 2.76Å; F101-F297 WeakPolarHBondContact CD1-O 3.38Å; F101-P299 HydrophobicContact CD1-CG 4.29Å; F101-P299 HydrophobicContact CD2-CG 3.62Å; F101-P299 HydrophobicContact CE1-CG 4.05Å; F101-P299 HydrophobicContact CE2-CG 3.37Å; F101-P299 HydrophobicContact CG-CG 4.09Å; F101-P299 HydrophobicContact CZ-CG 3.6Å; F101-H300 WeakPolarHBondContact CB-CE1 3.49Å
102	P	91.7	Very high	78.5	Confident	49 Å²	49	60.1 Å²	60.1	32%	0.318	36%	0.355	S	S	.	.			trans	-55.1	130.9	-179.1	-25.1	33.2	0	0	0	112.9	V183 L298 H300 Y301	P102-V183 HydrophobicContact CB-CB 4.37Å; P102-V183 HydrophobicContact CB-CG1 3.84Å; P102-V183 HydrophobicContact CB-CG2 3.55Å; P102-V183 HydrophobicContact CG-CG1 3.85Å; P102-V183 HydrophobicContact CG-CG2 4.05Å; P102-L298 HydrophobicContact CB-CD2 4.28Å; P102-L298 HydrophobicContact CG-CD2 4.28Å; P102-H300 PolarHBondContact O-CE1 2.91Å; P102-H300 PolarHBondContact O-NE2 2.83Å; P102-H300 VanDerWaalsContact O-NE2 3.1Å; P102-Y301 WeakPolarHBondContact O-CE2 3.3Å
103	S	93.1	Very high	80.4	Confident	28 Å²	28	58.4 Å²	58.4	20%	0.196	34%	0.337	C	S	.	.	S	Bend	trans	-95.9	-0.8	-179.2	56.8	0	0	0	0	114.6	F101 Q161 P162 Y163 Y301	F101-S103 PolarHBondContact O-N 2.76Å; S103-Q161 PolarHBondContact OG-OE1 2.74Å; S103-P162 VanDerWaalsContact O-CA 3.31Å; S103-P162 WeakPolarHBondContact O-CA 3.36Å; S103-Y163 PolarHBondContact O-N 3.11Å; S103-Y301 PolarHBondContact O-OH 3.32Å
104	Q	95.6	Very high	82.1	Confident	29 Å²	29	53.6 Å²	53.6	14%	0.136	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.5	101.4	-176.4	-60.6	-171.2	62.7	0	0	108.9	Q161 Y163 P182 V183	Q104-Q161 HydrophobicContact CG-CG 4.08Å; Q104-Y163 HydrophobicContact CB-CE1 4Å; Q104-Y163 HydrophobicContact CB-CE2 4.33Å; Q104-Y163 HydrophobicContact CG-CD1 4.41Å; Q104-Y163 HydrophobicContact CG-CE1 3.61Å; Q104-Y163 PolarHBondContact OE1-OH 3.28Å; Q104-P182 HydrophobicContact CB-CB 3.86Å; Q104-P182 WeakPolarHBondContact O-CB 3.34Å; Q104-V183 WeakPolarHBondContact O-CG2 3.49Å; Q104-V183 PolarHBondContact O-N 2.86Å
105	V	97.4	Very high	83.9	Confident	0 Å²	0	48.4 Å²	48.4	0%	0	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	132.3	-175	-177	0	0	0	0	110.3	Y163 L164 F165 V183 I185 L298 Y301	V105-Y163 PolarHBondContact N-O 2.66Å; V105-Y163 VanDerWaalsContact N-O 3.13Å; V105-L164 HydrophobicContact CB-CB 4.42Å; V105-L164 HydrophobicContact CB-CD1 4.3Å; V105-L164 HydrophobicContact CB-CG 4.06Å; V105-L164 HydrophobicContact CG1-CD1 4.01Å; V105-L164 HydrophobicContact CG1-CG 4.02Å; V105-L164 CarbonylContact O-C 3.59Å; V105-L164 WeakPolarHBondContact O-CA 3.44Å; V105-F165 PolarHBondContact O-N 3.07Å; V105-V183 WeakPolarHBondContact CA-O 3.5Å; V105-V183 HydrophobicContact CB-CG2 4.42Å; V105-V183 HydrophobicContact CG2-CG2 3.83Å; V105-I185 HydrophobicContact CG1-CD1 3.92Å; V105-I185 HydrophobicContact CG1-CG1 3.92Å; V105-I185 HydrophobicContact CG1-CG2 4.3Å; V105-L298 HydrophobicContact CG1-CD1 4.16Å; V105-L298 HydrophobicContact CG2-CD1 3.88Å; V105-L298 HydrophobicContact CG2-CD2 4.12Å; V105-Y301 HydrophobicContact CB-CE2 4.46Å; V105-Y301 HydrophobicContact CG2-CD2 4.1Å; V105-Y301 HydrophobicContact CG2-CE2 3.43Å; V105-Y301 VanDerWaalsContact CG2-CE2 3.43Å
106	V	98	Very high	85.8	Confident	1 Å²	1	47 Å²	47	1%	0.006	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	120.5	173.2	173.1	0	0	0	0	110.4	N108 F165 P182 V183 Y184 I185	V106-N108 HydrophobicContact CG1-CB 4.19Å; V106-F165 HydrophobicContact CG1-CD1 4.02Å; V106-F165 HydrophobicContact CG2-CB 4.31Å; V106-F165 HydrophobicContact CG2-CD1 4.34Å; V106-P182 HydrophobicContact CB-CG 4.39Å; V106-P182 HydrophobicContact CG2-CB 3.86Å; V106-P182 HydrophobicContact CG2-CG 3.46Å; V106-P182 VanDerWaalsContact CG2-CG 3.46Å; V106-V183 PolarHBondContact N-O 2.83Å; V106-Y184 HydrophobicContact CB-CD1 4.02Å; V106-Y184 HydrophobicContact CB-CD2 4.2Å; V106-Y184 HydrophobicContact CB-CE1 3.87Å; V106-Y184 HydrophobicContact CB-CE2 4.02Å; V106-Y184 HydrophobicContact CB-CG 4.19Å; V106-Y184 HydrophobicContact CG1-CD1 3.72Å; V106-Y184 HydrophobicContact CG1-CE1 3.27Å; V106-Y184 HydrophobicContact CG1-CE2 4.25Å; V106-Y184 HydrophobicContact CG1-CG 4.39Å; V106-Y184 HydrophobicContact CG2-CE2 4.34Å; V106-Y184 WeakPolarHBondContact O-CA 3.31Å; V106-I185 PolarHBondContact O-N 2.93Å
107	Y	97.9	Very high	87.7	Confident	3 Å²	3	43.4 Å²	43.4	1%	0.012	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	86	167.7	179.4	-151.7	0	0	0	110.5	R109 V118 L122 F165 T166 R167 I185	Y107-R109 HydrophobicContact CD1-CB 4.22Å; Y107-R109 HydrophobicContact CD2-CB 4.07Å; Y107-R109 HydrophobicContact CE1-CB 3.84Å; Y107-R109 HydrophobicContact CE2-CB 3.65Å; Y107-R109 HydrophobicContact CG-CB 4.34Å; Y107-R109 PolarHBondContact O-N 2.86Å; Y107-V118 HydrophobicContact CD1-CG1 4.3Å; Y107-V118 HydrophobicContact CE1-CB 4.07Å; Y107-V118 HydrophobicContact CE1-CG1 3.63Å; Y107-L122 HydrophobicContact CD1-CD1 4.15Å; Y107-F165 PolarHBondContact N-O 3.32Å; Y107-T166 WeakPolarHBondContact O-CA 3.48Å; Y107-T166 PolarHBondContact O-OG1 3.3Å; Y107-T166 VanDerWaalsContact O-OG1 3.1Å; Y107-R167 PolarHBondContact O-N 3.14Å; Y107-I185 HydrophobicContact CD2-CG1 4.42Å; Y107-I185 WeakPolarHBondContact CD2-O 3.38Å; Y107-I185 HydrophobicContact CG-CG1 4.37Å
108	N	97.3	Very high	89.8	Confident	0 Å²	0	33.8 Å²	33.8	0%	0	19%	0.188	C	C	.	.			trans	-78.3	64.7	177.2	74.9	-52	0	0	0	111.5	V106 V110 R167 V169 Y184 N186 Y251	V106-N108 HydrophobicContact CG1-CB 4.19Å; N108-V110 PolarHBondContact O-N 3.22Å; N108-R167 CarbonylContact C-O 3.53Å; N108-R167 VanDerWaalsContact C-O 3.32Å; N108-R167 WeakPolarHBondContact CA-O 3.44Å; N108-V169 HydrophobicContact CB-CG1 4Å; N108-V169 WeakPolarHBondContact CB-O 3.35Å; N108-V169 PolarHBondContact ND2-O 3.46Å; N108-V169 VanDerWaalsContact ND2-O 3.16Å; N108-Y184 HydrophobicContact CB-CD1 4.35Å; N108-Y184 HydrophobicContact CB-CE1 4.02Å; N108-Y184 WeakPolarHBondContact OD1-CD1 3.2Å; N108-N186 PolarHBondContact O-ND2 2.88Å; N108-N186 PolarHBondContact OD1-ND2 2.99Å; N108-Y251 PolarHBondContact ND2-O 3.22Å; N108-Y251 VanDerWaalsContact ND2-O 3.09Å; N108-Y251 WeakPolarHBondContact O-CD1 3.48Å
109	R	95.3	Very high	91.6	Very high	32 Å²	32	28.3 Å²	28.3	12%	0.121	16%	0.155	C	C	.	.	P	Polyproline II helix	trans	-51	127	-166.6	50.8	174	-164.3	-170	1.8	115.2	Y107 V119 T166 R167 H168 Y251	Y107-R109 HydrophobicContact CD1-CB 4.22Å; Y107-R109 HydrophobicContact CD2-CB 4.07Å; Y107-R109 HydrophobicContact CE1-CB 3.84Å; Y107-R109 HydrophobicContact CE2-CB 3.65Å; Y107-R109 HydrophobicContact CG-CB 4.34Å; Y107-R109 PolarHBondContact O-N 2.86Å; R109-V119 VanDerWaalsContact NH1-CG2 3.25Å; R109-T166 WeakPolarHBondContact CD-OG1 3.36Å; R109-R167 WeakPolarHBondContact CG-O 3.18Å; R109-R167 PolarHBondContact N-O 2.76Å; R109-R167 VanDerWaalsContact N-O 3.09Å; R109-H168 PolarHBondContact NE-CE1 3.26Å; R109-H168 PolarHBondContact NE-NE2 3.32Å; R109-H168 PolarHBondContact O-ND1 2.98Å; R109-Y251 WeakPolarHBondContact O-CE1 3.17Å
110	V	96.7	Very high	93.2	Very high	0 Å²	0	26.1 Å²	26.1	0%	0	14%	0.143	C	C	.	.	P	Polyproline II helix	trans	-75.9	136.3	172.3	-175.3	0	0	0	0	110.7	N108 C113 Y247 I248 Y251 F252	N108-V110 PolarHBondContact O-N 3.22Å; V110-C113 HydrophobicContact CB-CB 4.29Å; V110-Y247 HydrophobicContact CG1-CD1 4.02Å; V110-Y247 HydrophobicContact CG1-CE1 3.78Å; V110-I248 HydrophobicContact CG1-CG1 4.37Å; V110-Y251 HydrophobicContact CG1-CD2 4.35Å; V110-Y251 HydrophobicContact CG1-CE2 4.44Å; V110-Y251 HydrophobicContact CG2-CD1 3.9Å; V110-Y251 HydrophobicContact CG2-CD2 4.3Å; V110-Y251 HydrophobicContact CG2-CG 3.76Å; V110-F252 HydrophobicContact CG2-CE2 4.1Å
111	G	93.4	Very high	94.1	Very high	7 Å²	7	20.7 Å²	20.7	7%	0.072	11%	0.108	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63	137.1	177.2	0	0	0	0	0	113	C113	G111-C113 VanDerWaalsContact C-N 3.26Å; G111-C113 PolarHBondContact O-N 3.05Å
112	K	93.9	Very high	94.6	Very high	35 Å²	35	17 Å²	17	15%	0.152	9%	0.092	C	C	.	.	T	Hydrogen-bonded Turn	trans	65.5	20.9	178.4	-44.7	-57.4	-68.6	178.7	0	115.3	R189 R194 S197 N198 F201 T323	K112-R189 WeakPolarHBondContact O-CD 3.38Å; K112-R189 PolarHBondContact O-NH1 3.35Å; K112-R194 HydrophobicContact CB-CG 4.03Å; K112-S197 WeakPolarHBondContact CE-O 3.4Å; K112-S197 WeakPolarHBondContact CE-OG 3.44Å; K112-N198 HydrophobicContact CG-CB 3.87Å; K112-F201 HydrophobicContact CD-CB 4.47Å; K112-F201 HydrophobicContact CD-CD1 4.38Å; K112-F201 HydrophobicContact CD-CG 4.4Å; K112-F201 VanDerWaalsContact NZ-CB 3.26Å; K112-T323 PolarHBondContact NZ-OG1 3.23Å
113	C	96.3	Very high	94.8	Very high	0 Å²	0	17.4 Å²	17.4	0%	0	9%	0.087	C	C	.	.	S	Bend	trans	-105.1	35.5	172.8	-61.2	0	0	0	0	112.7	V110 G111 S115 I187 R189	V110-C113 HydrophobicContact CB-CB 4.29Å; G111-C113 VanDerWaalsContact C-N 3.26Å; G111-C113 PolarHBondContact O-N 3.05Å; C113-S115 VanDerWaalsContact C-N 3.27Å; C113-S115 PolarHBondContact O-N 2.93Å; C113-I187 WeakPolarHBondContact CB-O 3.47Å; C113-R189 HydrophobicContact CB-CB 4.3Å
114	G	92.4	Very high	94.9	Very high	19 Å²	19	19.4 Å²	19.4	20%	0.196	10%	0.095	C	C	.	.	S	Bend	trans	73.6	12.8	178.8	0	0	0	0	0	115.1	R116 T117 V118	G114-R116 VanDerWaalsContact C-N 3.25Å; G114-R116 PolarHBondContact O-N 3.37Å; G114-R116 VanDerWaalsContact O-N 3.15Å; G114-T117 WeakPolarHBondContact O-CB 3.34Å; G114-T117 PolarHBondContact O-N 2.93Å; G114-V118 PolarHBondContact O-N 3Å
115	S	91.1	Very high	95	Very high	7 Å²	7	18 Å²	18	5%	0.049	9%	0.088	C	C	.	.	H	α-helix	trans	-62.6	-26.9	-171.8	70.2	0	0	0	0	115	C113 V119	C113-S115 VanDerWaalsContact C-N 3.27Å; C113-S115 PolarHBondContact O-N 2.93Å; S115-V119 WeakPolarHBondContact O-CG2 3.45Å; S115-V119 PolarHBondContact O-N 2.91Å
116	R	89.8	Confident	95	Very high	89 Å²	89	19 Å²	19	34%	0.336	10%	0.095	S	C	.	.	H	α-helix	trans	-67.7	-49.7	176.2	-73.4	177.5	170.5	174.2	-3.5	110.8	G114 V118 V119 L120 D206 R208 T321	G114-R116 VanDerWaalsContact C-N 3.25Å; G114-R116 PolarHBondContact O-N 3.37Å; G114-R116 VanDerWaalsContact O-N 3.15Å; R116-V118 VanDerWaalsContact C-N 3.29Å; R116-V118 PolarHBondContact O-N 3.19Å; R116-V119 PolarHBondContact O-N 2.78Å; R116-V119 VanDerWaalsContact O-N 3.13Å; R116-L120 WeakPolarHBondContact O-CG 3.46Å; R116-L120 PolarHBondContact O-N 3.07Å; R116-D206 IonicContact CZ-OD2 2.66Å; R116-D206 IonicContact NH1-OD2 3.9Å; R116-D206 PolarHBondContact NH1-OD2 3.04Å; R116-R208 VanDerWaalsContact CZ-NH2 3.27Å; R116-T321 HydrophobicContact CB-CG2 3.95Å
117	T	91.8	Very high	94.9	Very high	20 Å²	20	26.9 Å²	26.9	12%	0.123	13%	0.132	C	C	.	.	H	α-helix	trans	-54	-46.1	173.8	-47	0	0	0	0	111.5	G114 V119 L120 L121 Y309	G114-T117 WeakPolarHBondContact O-CB 3.34Å; G114-T117 PolarHBondContact O-N 2.93Å; T117-V119 PolarHBondContact O-N 3.14Å; T117-L120 WeakPolarHBondContact O-CB 3.47Å; T117-L120 PolarHBondContact O-N 3.28Å; T117-L121 PolarHBondContact O-N 2.9Å; T117-L121 VanDerWaalsContact O-N 3.15Å; T117-Y309 HydrophobicContact CG2-CE2 4.23Å
118	V	95.2	Very high	94.8	Very high	4 Å²	4	32.5 Å²	32.5	2%	0.024	16%	0.156	C	C	.	.	H	α-helix	trans	-64.9	-39.6	178.4	178.8	0	0	0	0	111.9	Y107 G114 R116 L120 L121 L122 I187 L287	Y107-V118 HydrophobicContact CD1-CG1 4.3Å; Y107-V118 HydrophobicContact CE1-CB 4.07Å; Y107-V118 HydrophobicContact CE1-CG1 3.63Å; G114-V118 PolarHBondContact O-N 3Å; R116-V118 VanDerWaalsContact C-N 3.29Å; R116-V118 PolarHBondContact O-N 3.19Å; V118-L120 VanDerWaalsContact C-N 3.32Å; V118-L120 PolarHBondContact O-N 3.45Å; V118-L121 WeakPolarHBondContact O-CB 3.48Å; V118-L121 PolarHBondContact O-N 2.89Å; V118-L122 HydrophobicContact CG1-CD1 4.16Å; V118-L122 HydrophobicContact CG1-CG 4.39Å; V118-L122 VanDerWaalsContact O-CG 3.32Å; V118-L122 WeakPolarHBondContact O-CG 3.45Å; V118-L122 PolarHBondContact O-N 3.34Å; V118-I187 HydrophobicContact CG2-CD1 3.7Å; V118-L287 HydrophobicContact CG2-CD1 4.3Å
119	V	94.1	Very high	94.7	Very high	9 Å²	9	35.4 Å²	35.4	6%	0.055	17%	0.17	C	C	.	.	H	α-helix	trans	-67.3	-33	176.9	166.4	0	0	0	0	112.6	R109 S115 R116 T117 L121 L122 R123 T166	R109-V119 VanDerWaalsContact NH1-CG2 3.25Å; S115-V119 WeakPolarHBondContact O-CG2 3.45Å; S115-V119 PolarHBondContact O-N 2.91Å; R116-V119 PolarHBondContact O-N 2.78Å; R116-V119 VanDerWaalsContact O-N 3.13Å; T117-V119 PolarHBondContact O-N 3.14Å; V119-L121 VanDerWaalsContact C-N 3.34Å; V119-L122 HydrophobicContact CG2-CD1 4.46Å; V119-L122 PolarHBondContact O-N 3.23Å; V119-R123 WeakPolarHBondContact O-CG 3.25Å; V119-R123 PolarHBondContact O-N 2.95Å; V119-T166 HydrophobicContact CG2-CG2 3.94Å
120	L	93.8	Very high	94.7	Very high	25 Å²	25	36.8 Å²	36.8	13%	0.131	19%	0.194	C	C	.	.	H	α-helix	trans	-62.1	-42.7	171.6	-66.9	169.4	0	0	0	111.5	R116 T117 V118 R123 I124 L317	R116-L120 WeakPolarHBondContact O-CG 3.46Å; R116-L120 PolarHBondContact O-N 3.07Å; T117-L120 WeakPolarHBondContact O-CB 3.47Å; T117-L120 PolarHBondContact O-N 3.28Å; V118-L120 VanDerWaalsContact C-N 3.32Å; V118-L120 PolarHBondContact O-N 3.45Å; L120-R123 PolarHBondContact O-N 3.43Å; L120-I124 WeakPolarHBondContact O-CG1 3.41Å; L120-I124 PolarHBondContact O-N 3.36Å; L120-L317 HydrophobicContact CD1-CB 4.41Å; L120-L317 HydrophobicContact CD1-CD2 3.74Å; L120-L317 HydrophobicContact CD1-CG 3.59Å; L120-L317 HydrophobicContact CD2-CD2 3.61Å; L120-L317 HydrophobicContact CD2-CG 4.26Å; L120-L317 HydrophobicContact CG-CD2 4.18Å
121	L	96.1	Very high	94.7	Very high	1 Å²	1	37.1 Å²	37.1	1%	0.005	20%	0.196	C	C	.	.	H	α-helix	trans	-60.2	-46.3	172.6	-67.1	171.9	0	0	0	111.4	T117 V118 V119 R123 I124 L125 L291 V305 I308 Y309 H314	T117-L121 PolarHBondContact O-N 2.9Å; T117-L121 VanDerWaalsContact O-N 3.15Å; V118-L121 WeakPolarHBondContact O-CB 3.48Å; V118-L121 PolarHBondContact O-N 2.89Å; V119-L121 VanDerWaalsContact C-N 3.34Å; L121-R123 VanDerWaalsContact C-N 3.29Å; L121-R123 PolarHBondContact O-N 3Å; L121-I124 PolarHBondContact O-N 3.14Å; L121-L125 HydrophobicContact CB-CD1 4.45Å; L121-L125 WeakPolarHBondContact O-CB 3.46Å; L121-L125 VanDerWaalsContact O-CG 3.25Å; L121-L125 WeakPolarHBondContact O-CG 3.46Å; L121-L125 PolarHBondContact O-N 3.31Å; L121-L291 HydrophobicContact CD1-CD1 3.82Å; L121-L291 HydrophobicContact CD1-CD2 3.98Å; L121-V305 HydrophobicContact CB-CG2 4.48Å; L121-V305 HydrophobicContact CD1-CG2 4.02Å; L121-V305 HydrophobicContact CD2-CG2 4.46Å; L121-I308 HydrophobicContact CD2-CB 4.04Å; L121-I308 HydrophobicContact CD2-CG2 3.66Å; L121-Y309 HydrophobicContact CD1-CD2 4.09Å; L121-H314 WeakPolarHBondContact CD2-CE1 3.36Å; L121-H314 WeakPolarHBondContact CD2-NE2 3.4Å; L121-H314 VanDerWaalsContact CG-CE1 3.49Å; L121-H314 WeakPolarHBondContact CG-CE1 3.42Å
122	L	96.8	Very high	94.8	Very high	0 Å²	0	39.8 Å²	39.8	0%	0	21%	0.208	C	C	.	.	H	α-helix	trans	-62.1	-34.8	-177.8	-72.4	172.7	0	0	0	113	Y107 V118 V119 L125 S126 F131 L133 L164 F302	Y107-L122 HydrophobicContact CD1-CD1 4.15Å; V118-L122 HydrophobicContact CG1-CD1 4.16Å; V118-L122 HydrophobicContact CG1-CG 4.39Å; V118-L122 VanDerWaalsContact O-CG 3.32Å; V118-L122 WeakPolarHBondContact O-CG 3.45Å; V118-L122 PolarHBondContact O-N 3.34Å; V119-L122 HydrophobicContact CG2-CD1 4.46Å; V119-L122 PolarHBondContact O-N 3.23Å; L122-L125 PolarHBondContact O-N 2.65Å; L122-S126 WeakPolarHBondContact O-CB 3.28Å; L122-S126 PolarHBondContact O-N 2.86Å; L122-S126 PolarHBondContact O-OG 3.48Å; L122-F131 HydrophobicContact CD2-CZ 4.46Å; L122-L133 HydrophobicContact CB-CD1 4.02Å; L122-L133 HydrophobicContact CB-CD2 4.08Å; L122-L133 HydrophobicContact CD1-CD1 4.36Å; L122-L164 HydrophobicContact CD1-CD1 4.42Å; L122-L164 HydrophobicContact CD1-CD2 3.73Å; L122-L164 HydrophobicContact CD2-CD1 3.66Å; L122-L164 HydrophobicContact CD2-CD2 4.38Å; L122-F302 HydrophobicContact CD2-CE1 3.63Å; L122-F302 HydrophobicContact CD2-CZ 3.71Å
123	R	94.9	Very high	94.9	Very high	57 Å²	57	39.9 Å²	39.9	22%	0.215	21%	0.21	C	C	.	.	H	α-helix	trans	-64.1	-49.2	175.4	-74.6	174.7	173.9	-177.8	-8	111.8	V119 L120 L121 L125 S126 E127 L133	V119-R123 WeakPolarHBondContact O-CG 3.25Å; V119-R123 PolarHBondContact O-N 2.95Å; L120-R123 PolarHBondContact O-N 3.43Å; L121-R123 VanDerWaalsContact C-N 3.29Å; L121-R123 PolarHBondContact O-N 3Å; R123-L125 VanDerWaalsContact C-N 3.29Å; R123-L125 PolarHBondContact O-N 3.13Å; R123-S126 WeakPolarHBondContact CA-OG 3.4Å; R123-S126 PolarHBondContact O-N 3.47Å; R123-S126 PolarHBondContact O-OG 3.23Å; R123-E127 PolarHBondContact O-N 2.92Å; R123-L133 HydrophobicContact CB-CD2 4.32Å; R123-L133 HydrophobicContact CG-CD2 3.57Å
124	I	95.8	Very high	94.8	Very high	70 Å²	70	41.7 Å²	41.7	36%	0.359	22%	0.221	S	C	.	.	H	α-helix	trans	-61.8	-42.4	177.1	-59.7	167.2	0	0	0	110.1	L120 L121 K128 I308	L120-I124 WeakPolarHBondContact O-CG1 3.41Å; L120-I124 PolarHBondContact O-N 3.36Å; L121-I124 PolarHBondContact O-N 3.14Å; I124-K128 VanDerWaalsContact O-CB 3.31Å; I124-K128 WeakPolarHBondContact O-CB 3.4Å; I124-K128 PolarHBondContact O-N 3.34Å; I124-I308 HydrophobicContact CB-CG2 4.32Å; I124-I308 HydrophobicContact CD1-CG2 3.65Å; I124-I308 HydrophobicContact CG2-CD1 3.9Å; I124-I308 HydrophobicContact CG2-CG1 4.45Å; I124-I308 HydrophobicContact CG2-CG2 4.05Å
125	L	97.1	Very high	94.6	Very high	0 Å²	0	44.2 Å²	44.2	0%	0	23%	0.233	C	C	.	.	H	α-helix	trans	-67.4	-36.2	178.5	-73.3	167.2	0	0	0	112.8	L121 L122 R123 K128 H129 F131 Y301 F302 V305 I308	L121-L125 HydrophobicContact CB-CD1 4.45Å; L121-L125 WeakPolarHBondContact O-CB 3.46Å; L121-L125 VanDerWaalsContact O-CG 3.25Å; L121-L125 WeakPolarHBondContact O-CG 3.46Å; L121-L125 PolarHBondContact O-N 3.31Å; L122-L125 PolarHBondContact O-N 2.65Å; R123-L125 VanDerWaalsContact C-N 3.29Å; R123-L125 PolarHBondContact O-N 3.13Å; L125-K128 PolarHBondContact O-N 3.43Å; L125-H129 WeakPolarHBondContact CD2-NE2 3.47Å; L125-H129 WeakPolarHBondContact O-CB 3.33Å; L125-H129 PolarHBondContact O-CD2 3.44Å; L125-H129 PolarHBondContact O-N 3.02Å; L125-F131 VanDerWaalsContact C-CE1 3.45Å; L125-F131 HydrophobicContact CB-CE1 3.99Å; L125-F131 HydrophobicContact CB-CZ 4.18Å; L125-F131 WeakPolarHBondContact O-CE1 3.18Å; L125-Y301 WeakPolarHBondContact CB-O 3.38Å; L125-F302 HydrophobicContact CD1-CD1 3.99Å; L125-V305 HydrophobicContact CD1-CB 4.05Å; L125-V305 HydrophobicContact CD1-CG2 3.82Å; L125-I308 HydrophobicContact CD2-CD1 3.6Å; L125-I308 HydrophobicContact CG-CD1 3.97Å
126	S	97	Very high	94	Very high	20 Å²	20	44.9 Å²	44.9	14%	0.14	24%	0.237	C	C	.	.	H	α-helix	trans	-64.8	-41.4	177.9	52.4	0	0	0	0	111.9	L122 R123 G130 F131	L122-S126 WeakPolarHBondContact O-CB 3.28Å; L122-S126 PolarHBondContact O-N 2.86Å; L122-S126 PolarHBondContact O-OG 3.48Å; R123-S126 WeakPolarHBondContact CA-OG 3.4Å; R123-S126 PolarHBondContact O-N 3.47Å; R123-S126 PolarHBondContact O-OG 3.23Å; S126-G130 VanDerWaalsContact O-CA 3.3Å; S126-G130 WeakPolarHBondContact O-CA 3.19Å; S126-G130 PolarHBondContact O-N 3.49Å; S126-F131 VanDerWaalsContact CA-CE1 3.43Å; S126-F131 WeakPolarHBondContact CB-O 3.43Å; S126-F131 PolarHBondContact O-N 3.3Å
127	E	96.1	Very high	93.2	Very high	166 Å²	166	47.6 Å²	47.6	78%	0.776	26%	0.259	S	S	*	.	H	α-helix	trans	-66.7	-42.5	175	-67.7	173.8	-170.8	0	0	111.1	R123	R123-E127 PolarHBondContact O-N 2.92Å
128	K	96.1	Very high	92.6	Very high	122 Å²	122	50.7 Å²	50.7	53%	0.53	27%	0.274	S	S	.	.	H	α-helix	trans	-68.2	-39.7	-178	-174.4	174.9	-177.2	175.7	0	113.6	I124 L125	I124-K128 VanDerWaalsContact O-CB 3.31Å; I124-K128 WeakPolarHBondContact O-CB 3.4Å; I124-K128 PolarHBondContact O-N 3.34Å; L125-K128 PolarHBondContact O-N 3.43Å
129	H	95.9	Very high	91.5	Very high	60 Å²	60	55.4 Å²	55.4	28%	0.278	30%	0.295	S	S	.	.	H	α-helix	trans	-106.8	-5.9	-173.1	-59.5	-57	0	0	0	113.8	L125 F131 H300 Y301 K303	L125-H129 WeakPolarHBondContact CD2-NE2 3.47Å; L125-H129 WeakPolarHBondContact O-CB 3.33Å; L125-H129 PolarHBondContact O-CD2 3.44Å; L125-H129 PolarHBondContact O-N 3.02Å; H129-F131 HydrophobicContact CB-CD1 4.08Å; H129-F131 HydrophobicContact CB-CE1 4.47Å; H129-H300 WeakPolarHBondContact CB-O 3.39Å; H129-Y301 PolarHBondContact CD2-O 3.35Å; H129-K303 PolarHBondContact CE1-O 3.31Å; H129-K303 VanDerWaalsContact CE1-O 3.22Å; H129-K303 PolarHBondContact NE2-O 3.03Å
130	G	94.9	Very high	90.6	Very high	62 Å²	62	61.8 Å²	61.8	64%	0.639	33%	0.329	S	S	*	.	T	Hydrogen-bonded Turn	trans	70.4	35.5	174.1	0	0	0	0	0	114.5	S126	S126-G130 VanDerWaalsContact O-CA 3.3Å; S126-G130 WeakPolarHBondContact O-CA 3.19Å; S126-G130 PolarHBondContact O-N 3.49Å
131	F	95.5	Very high	90.3	Very high	7 Å²	7	64.6 Å²	64.6	3%	0.031	34%	0.34	C	S	.	.			trans	-104.1	156.3	172.9	71.1	-99.4	0	0	0	111.3	L122 L125 S126 H129 L133 P162 L164 Y301	L122-F131 HydrophobicContact CD2-CZ 4.46Å; L125-F131 VanDerWaalsContact C-CE1 3.45Å; L125-F131 HydrophobicContact CB-CE1 3.99Å; L125-F131 HydrophobicContact CB-CZ 4.18Å; L125-F131 WeakPolarHBondContact O-CE1 3.18Å; S126-F131 VanDerWaalsContact CA-CE1 3.43Å; S126-F131 WeakPolarHBondContact CB-O 3.43Å; S126-F131 PolarHBondContact O-N 3.3Å; H129-F131 HydrophobicContact CB-CD1 4.08Å; H129-F131 HydrophobicContact CB-CE1 4.47Å; F131-L133 HydrophobicContact CE2-CB 4.23Å; F131-L133 PolarHBondContact O-N 2.76Å; F131-P162 HydrophobicContact CB-CB 4.4Å; F131-P162 HydrophobicContact CB-CG 3.96Å; F131-P162 WeakPolarHBondContact CB-O 3.43Å; F131-L164 HydrophobicContact CD2-CB 4.24Å; F131-L164 HydrophobicContact CE2-CB 3.96Å; F131-Y301 HydrophobicContact CB-CD1 4.07Å; F131-Y301 HydrophobicContact CB-CE1 3.9Å; F131-Y301 AromaticContact CD1-CD1 3.6Å; F131-Y301 HydrophobicContact CD1-CD1 3.6Å; F131-Y301 HydrophobicContact CD1-CE1 4.3Å; F131-Y301 HydrophobicContact CD1-CG 4.41Å; F131-Y301 AromaticContact CD2-CD1 3.56Å; F131-Y301 HydrophobicContact CD2-CD1 3.56Å; F131-Y301 AromaticContact CD2-CE1 3.7Å; F131-Y301 HydrophobicContact CD2-CE1 3.7Å; F131-Y301 AromaticContact CE1-CD1 3.85Å; F131-Y301 HydrophobicContact CE1-CD1 3.85Å; F131-Y301 AromaticContact CE2-CD1 3.83Å; F131-Y301 HydrophobicContact CE2-CD1 3.83Å; F131-Y301 HydrophobicContact CE2-CE1 4.32Å; F131-Y301 AromaticContact CG-CD1 3.46Å; F131-Y301 HydrophobicContact CG-CD1 3.46Å; F131-Y301 VanDerWaalsContact CG-CD1 3.46Å; F131-Y301 AromaticContact CG-CE1 3.71Å; F131-Y301 HydrophobicContact CG-CE1 3.71Å; F131-Y301 AromaticContact CZ-CD1 3.97Å; F131-Y301 HydrophobicContact CZ-CD1 3.97Å
132	N	95.9	Very high	90.2	Very high	62 Å²	62	65.8 Å²	65.8	33%	0.332	35%	0.348	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83	109.1	-178.4	-69.7	-35.5	0	0	0	111.5	V134 E160 P162 Y163 L164	N132-V134 PolarHBondContact O-N 2.89Å; N132-E160 WeakPolarHBondContact ND2-CB 3.39Å; N132-E160 PolarHBondContact ND2-O 3.14Å; N132-P162 PolarHBondContact N-O 3.4Å; N132-Y163 CarbonylContact O-C 3.32Å; N132-Y163 WeakPolarHBondContact O-CA 3.37Å; N132-Y163 WeakPolarHBondContact O-CB 3.37Å; N132-L164 PolarHBondContact O-N 3Å
133	L	96.3	Very high	90	Very high	37 Å²	37	71.2 Å²	71.2	19%	0.194	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.4	98.7	171.7	-179.7	62.9	0	0	0	109.9	L122 R123 F131 T135 L164 T166	L122-L133 HydrophobicContact CB-CD1 4.02Å; L122-L133 HydrophobicContact CB-CD2 4.08Å; L122-L133 HydrophobicContact CD1-CD1 4.36Å; R123-L133 HydrophobicContact CB-CD2 4.32Å; R123-L133 HydrophobicContact CG-CD2 3.57Å; F131-L133 HydrophobicContact CE2-CB 4.23Å; F131-L133 PolarHBondContact O-N 2.76Å; L133-T135 HydrophobicContact CG-CG2 4.33Å; L133-L164 HydrophobicContact CD1-CD2 3.93Å; L133-T166 HydrophobicContact CD1-CG2 4.23Å
134	V	93.7	Very high	90	Very high	38 Å²	38	69.3 Å²	69.3	23%	0.23	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.5	121.7	-178.1	-172.9	0	0	0	0	109.5	N132 A159 L164 F165 T166	N132-V134 PolarHBondContact O-N 2.89Å; V134-A159 HydrophobicContact CG2-CB 3.83Å; V134-L164 PolarHBondContact N-O 3.44Å; V134-F165 HydrophobicContact CB-CB 4.43Å; V134-F165 HydrophobicContact CB-CD2 4.03Å; V134-F165 HydrophobicContact CG1-CD2 3.8Å; V134-F165 HydrophobicContact CG1-CE2 4.42Å; V134-F165 CarbonylContact O-C 3.44Å; V134-F165 WeakPolarHBondContact O-CA 3.49Å; V134-T166 PolarHBondContact O-N 2.95Å
135	T	88.1	Confident	90	Very high	72 Å²	72	69.8 Å²	69.8	44%	0.442	37%	0.368	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	163.9	173.1	74.4	0	0	0	0	110.2	L133 T166	L133-T135 HydrophobicContact CG-CG2 4.33Å; T135-T166 HydrophobicContact CG2-CG2 3.95Å
136	S	78.4	Confident	89.9	Confident	21 Å²	21	76.5 Å²	76.5	15%	0.147	40%	0.397	C	S	.	.			trans	-125.1	131.4	178.6	176.6	0	0	0	0	109.2	I138 H139 R167	S136-I138 PolarHBondContact O-N 2.71Å; S136-I138 VanDerWaalsContact O-N 3.14Å; S136-H139 PolarHBondContact O-CE1 3.45Å; S136-H139 PolarHBondContact O-ND1 3.42Å; S136-R167 PolarHBondContact OG-NH1 3.29Å
137	D	74.6	Confident	89.8	Confident	147 Å²	147	81 Å²	81	79%	0.786	42%	0.42	S	S	*	.	S	Bend	trans	-59.2	-25	178	-52.1	-31.9	0	0	0	112.4	H139	D137-H139 PolarHBondContact O-N 2.9Å; D137-H139 VanDerWaalsContact O-N 3.17Å
138	I	79.5	Confident	89.8	Confident	84 Å²	84	75.6 Å²	75.6	43%	0.431	40%	0.395	S	S	.	.			trans	-82.3	98.6	177.4	-52.5	175.3	0	0	0	109.6	S136 K141 R167	S136-I138 PolarHBondContact O-N 2.71Å; S136-I138 VanDerWaalsContact O-N 3.14Å; I138-K141 HydrophobicContact CG2-CB 3.79Å; I138-R167 PolarHBondContact O-NE 3Å
139	H	70.8	Confident	89.8	Confident	103 Å²	103	70.8 Å²	70.8	48%	0.477	37%	0.374	S	S	.	.			trans	-97.6	-21.9	-177	-55.6	-41.3	0	0	0	115.2	S136 D137	S136-H139 PolarHBondContact O-CE1 3.45Å; S136-H139 PolarHBondContact O-ND1 3.42Å; D137-H139 PolarHBondContact O-N 2.9Å; D137-H139 VanDerWaalsContact O-N 3.17Å
140	N	74.8	Confident	89.7	Confident	144 Å²	144	71.8 Å²	71.8	77%	0.77	38%	0.38	S	S	*	.	S	Bend	trans	-99.2	-19.6	-169.3	60.9	-4.4	0	0	0	114.2	T142	N140-T142 PolarHBondContact O-N 3.29Å
141	K	88.9	Confident	89.7	Confident	83 Å²	83	74.6 Å²	74.6	36%	0.361	38%	0.377	S	S	.	.			trans	-93.6	98.1	-178	-165.6	175.1	-173.2	166.4	0	111.4	I138 R143 L144 E148 R167	I138-K141 HydrophobicContact CG2-CB 3.79Å; K141-R143 WeakPolarHBondContact CE-O 3.47Å; K141-R143 WeakPolarHBondContact CG-O 3.35Å; K141-L144 HydrophobicContact CD-CD2 4.17Å; K141-L144 HydrophobicContact CG-CD2 4.05Å; K141-E148 WeakPolarHBondContact CE-OE1 3.26Å; K141-E148 WeakPolarHBondContact CE-OE2 3.46Å; K141-E148 VanDerWaalsContact NZ-CD 3.27Å; K141-E148 IonicContact NZ-OE1 3.83Å; K141-E148 PolarHBondContact NZ-OE1 2.92Å; K141-E148 IonicContact NZ-OE2 2.84Å; K141-E148 PolarHBondContact NZ-OE2 3.46Å; K141-R167 PolarHBondContact O-NH2 2.86Å
142	T	93	Very high	89.6	Confident	27 Å²	27	74.9 Å²	74.9	17%	0.166	38%	0.378	C	S	.	.			trans	-88.7	-29	179.3	67.2	0	0	0	0	113.6	N140 H168 H170 Y251 Q255	N140-T142 PolarHBondContact O-N 3.29Å; T142-H168 HydrophobicContact CG2-CB 4.34Å; T142-H170 PolarHBondContact O-N 2.79Å; T142-H170 VanDerWaalsContact O-N 3.15Å; T142-H170 PolarHBondContact OG1-NE2 2.92Å; T142-H170 VanDerWaalsContact OG1-NE2 3.17Å; T142-Y251 WeakPolarHBondContact CG2-OH 3.45Å; T142-Q255 PolarHBondContact O-NE2 2.92Å
143	R	93.8	Very high	89.5	Confident	114 Å²	114	72.3 Å²	72.3	43%	0.43	36%	0.364	S	S	.	.	S	Bend	trans	-98.8	125.2	178.9	-65.6	-177.7	178.1	103.3	-2.4	110	K141	K141-R143 WeakPolarHBondContact CE-O 3.47Å; K141-R143 WeakPolarHBondContact CG-O 3.35Å
144	L	95	Very high	89.4	Confident	16 Å²	16	77.4 Å²	77.4	8%	0.084	39%	0.385	C	S	.	.			trans	-120	140.2	-172.7	-58.9	-178.3	0	0	0	111	K141 E148 Q149 L152 V169 L172	K141-L144 HydrophobicContact CD-CD2 4.17Å; K141-L144 HydrophobicContact CG-CD2 4.05Å; L144-E148 HydrophobicContact CB-CB 4Å; L144-E148 HydrophobicContact CD2-CB 4.26Å; L144-Q149 HydrophobicContact CB-CG 3.64Å; L144-Q149 HydrophobicContact CD1-CG 4.41Å; L144-Q149 PolarHBondContact O-NE2 2.93Å; L144-L152 HydrophobicContact CD1-CB 4.46Å; L144-L152 HydrophobicContact CD1-CD2 3.52Å; L144-V169 HydrophobicContact CD1-CG2 3.74Å; L144-V169 HydrophobicContact CG-CG2 4.22Å; L144-L172 HydrophobicContact CD1-CD2 4.38Å
145	T	95.3	Very high	89.3	Confident	80 Å²	80	80 Å²	80	49%	0.491	40%	0.397	S	S	.	.			trans	-67.2	166.2	167.8	68	0	0	0	0	110.5	N147 E148 Q149	T145-N147 VanDerWaalsContact C-N 3.25Å; T145-N147 PolarHBondContact O-N 3.16Å; T145-E148 WeakPolarHBondContact CG2-OE2 3.44Å; T145-E148 PolarHBondContact N-OE2 3.1Å; T145-E148 PolarHBondContact O-N 3.37Å; T145-E148 VanDerWaalsContact OG1-CG 3.28Å; T145-E148 WeakPolarHBondContact OG1-CG 3.21Å; T145-E148 PolarHBondContact OG1-N 3.12Å; T145-E148 PolarHBondContact OG1-OE2 2.72Å; T145-E148 VanDerWaalsContact OG1-OE2 3.14Å; T145-Q149 VanDerWaalsContact O-CG 3.29Å; T145-Q149 WeakPolarHBondContact O-CG 3.42Å; T145-Q149 PolarHBondContact O-N 3.37Å
146	K	94.8	Very high	89.5	Confident	141 Å²	141	76.6 Å²	76.6	61%	0.613	38%	0.377	S	S	*	.	H	α-helix	trans	-56.4	-40.5	179.2	-170.5	-176.5	176.6	-173.2	0	112.3	Q149 M150 F177	K146-Q149 PolarHBondContact O-N 3.42Å; K146-M150 WeakPolarHBondContact O-CG 3.04Å; K146-M150 PolarHBondContact O-N 3.34Å; K146-M150 VanDerWaalsContact O-N 3.09Å; K146-F177 HydrophobicContact CG-CE1 3.83Å; K146-F177 HydrophobicContact CG-CZ 4.3Å
147	N	95.4	Very high	90.2	Very high	114 Å²	114	77.7 Å²	77.7	61%	0.61	38%	0.384	S	S	*	.	H	α-helix	trans	-67.8	-43.9	180	-64.7	-7.6	0	0	0	111.5	T145 Q149 M150 E151	T145-N147 VanDerWaalsContact C-N 3.25Å; T145-N147 PolarHBondContact O-N 3.16Å; N147-Q149 VanDerWaalsContact C-N 3.3Å; N147-Q149 PolarHBondContact O-N 2.64Å; N147-M150 HydrophobicContact CB-CE 4.44Å; N147-M150 WeakPolarHBondContact O-CB 3.44Å; N147-M150 PolarHBondContact O-N 3.11Å; N147-M150 WeakPolarHBondContact OD1-CE 3.44Å; N147-E151 PolarHBondContact O-N 3.46Å
148	E	95	Very high	91	Very high	53 Å²	53	75.7 Å²	75.7	25%	0.248	38%	0.377	C	S	.	.	H	α-helix	trans	-65.3	-33.3	176.6	-67.5	171.8	144.6	0	0	112.5	K141 L144 T145 L152	K141-E148 WeakPolarHBondContact CE-OE1 3.26Å; K141-E148 WeakPolarHBondContact CE-OE2 3.46Å; K141-E148 VanDerWaalsContact NZ-CD 3.27Å; K141-E148 IonicContact NZ-OE1 3.83Å; K141-E148 PolarHBondContact NZ-OE1 2.92Å; K141-E148 IonicContact NZ-OE2 2.84Å; K141-E148 PolarHBondContact NZ-OE2 3.46Å; L144-E148 HydrophobicContact CB-CB 4Å; L144-E148 HydrophobicContact CD2-CB 4.26Å; T145-E148 WeakPolarHBondContact CG2-OE2 3.44Å; T145-E148 PolarHBondContact N-OE2 3.1Å; T145-E148 PolarHBondContact O-N 3.37Å; T145-E148 VanDerWaalsContact OG1-CG 3.28Å; T145-E148 WeakPolarHBondContact OG1-CG 3.21Å; T145-E148 PolarHBondContact OG1-N 3.12Å; T145-E148 PolarHBondContact OG1-OE2 2.72Å; T145-E148 VanDerWaalsContact OG1-OE2 3.14Å; E148-L152 VanDerWaalsContact O-CB 3.24Å; E148-L152 WeakPolarHBondContact O-CB 3.41Å; E148-L152 PolarHBondContact O-N 2.81Å
149	Q	95.5	Very high	91.6	Very high	21 Å²	21	72.7 Å²	72.7	10%	0.098	37%	0.365	C	S	.	.	H	α-helix	trans	-64.3	-46.8	172.5	-69.3	174.9	53.6	0	0	110.9	L144 T145 K146 N147 L152 I153 L172 F177 Q255	L144-Q149 HydrophobicContact CB-CG 3.64Å; L144-Q149 HydrophobicContact CD1-CG 4.41Å; L144-Q149 PolarHBondContact O-NE2 2.93Å; T145-Q149 VanDerWaalsContact O-CG 3.29Å; T145-Q149 WeakPolarHBondContact O-CG 3.42Å; T145-Q149 PolarHBondContact O-N 3.37Å; K146-Q149 PolarHBondContact O-N 3.42Å; N147-Q149 VanDerWaalsContact C-N 3.3Å; N147-Q149 PolarHBondContact O-N 2.64Å; Q149-L152 PolarHBondContact O-N 3.34Å; Q149-I153 VanDerWaalsContact O-CB 3.31Å; Q149-I153 WeakPolarHBondContact O-CB 3.46Å; Q149-I153 WeakPolarHBondContact O-CD1 3.43Å; Q149-I153 VanDerWaalsContact O-CG1 3.23Å; Q149-I153 WeakPolarHBondContact O-CG1 3.26Å; Q149-I153 PolarHBondContact O-N 2.63Å; Q149-L172 HydrophobicContact CB-CD2 4.28Å; Q149-L172 HydrophobicContact CG-CD2 3.72Å; Q149-F177 HydrophobicContact CB-CE2 4.05Å; Q149-F177 HydrophobicContact CB-CZ 3.87Å; Q149-Q255 HydrophobicContact CG-CG 4.19Å
150	M	94.8	Very high	92.6	Very high	81 Å²	81	75 Å²	75	40%	0.399	38%	0.376	S	S	.	.	H	α-helix	trans	-60.8	-45.3	177.1	-71.7	-174.5	-58.8	0	0	112	K146 N147 I153 K154 F177	K146-M150 WeakPolarHBondContact O-CG 3.04Å; K146-M150 PolarHBondContact O-N 3.34Å; K146-M150 VanDerWaalsContact O-N 3.09Å; N147-M150 HydrophobicContact CB-CE 4.44Å; N147-M150 WeakPolarHBondContact O-CB 3.44Å; N147-M150 PolarHBondContact O-N 3.11Å; N147-M150 WeakPolarHBondContact OD1-CE 3.44Å; M150-I153 PolarHBondContact O-N 3.01Å; M150-K154 WeakPolarHBondContact O-CB 3.39Å; M150-K154 PolarHBondContact O-N 2.94Å; M150-F177 HydrophobicContact CG-CD1 3.27Å; M150-F177 HydrophobicContact CG-CE1 3.55Å; M150-F177 HydrophobicContact CG-CG 4.12Å; M150-F177 HydrophobicContact SD-CD1 4.03Å; M150-F177 HydrophobicContact SD-CE1 4.3Å
151	E	93.8	Very high	93.4	Very high	122 Å²	122	72.6 Å²	72.6	57%	0.57	36%	0.36	S	S	*	.	H	α-helix	trans	-62.8	-47.3	178.5	-173.9	-177.9	176.5	0	0	111.5	N147 I153 K154 N155	N147-E151 PolarHBondContact O-N 3.46Å; E151-I153 PolarHBondContact O-N 3.48Å; E151-K154 PolarHBondContact O-N 3Å; E151-N155 WeakPolarHBondContact O-CB 3.49Å; E151-N155 PolarHBondContact O-N 2.96Å; E151-N155 PolarHBondContact O-OD1 3.19Å
152	L	93.9	Very high	93.7	Very high	13 Å²	13	70.3 Å²	70.3	7%	0.068	35%	0.354	C	S	.	.	H	α-helix	trans	-64.4	-43.3	178.7	-179	58.9	0	0	0	111.9	L144 E148 Q149 K154 N155 I156 F165 V169 L172	L144-L152 HydrophobicContact CD1-CB 4.46Å; L144-L152 HydrophobicContact CD1-CD2 3.52Å; E148-L152 VanDerWaalsContact O-CB 3.24Å; E148-L152 WeakPolarHBondContact O-CB 3.41Å; E148-L152 PolarHBondContact O-N 2.81Å; Q149-L152 PolarHBondContact O-N 3.34Å; L152-K154 VanDerWaalsContact C-N 3.34Å; L152-N155 PolarHBondContact O-N 3.2Å; L152-I156 HydrophobicContact CD1-CD1 3.88Å; L152-I156 HydrophobicContact CD1-CG1 4.17Å; L152-I156 HydrophobicContact CG-CD1 3.78Å; L152-I156 HydrophobicContact CG-CG1 4.49Å; L152-I156 WeakPolarHBondContact O-CD1 3.41Å; L152-I156 VanDerWaalsContact O-CG1 3.22Å; L152-I156 WeakPolarHBondContact O-CG1 3.49Å; L152-I156 PolarHBondContact O-N 2.88Å; L152-F165 HydrophobicContact CD1-CE2 4.42Å; L152-F165 HydrophobicContact CD1-CZ 3.99Å; L152-V169 HydrophobicContact CD2-CG2 4.28Å; L152-L172 HydrophobicContact CD2-CD1 3.73Å; L152-L172 HydrophobicContact CG-CD1 4.27Å
153	I	94.7	Very high	93.8	Very high	7 Å²	7	69 Å²	69	4%	0.036	35%	0.346	C	S	.	.	H	α-helix	trans	-59.7	-47.2	175.9	-75.2	164.2	0	0	0	110	Q149 M150 E151 N155 I156 S157 L172 F174 F177	Q149-I153 VanDerWaalsContact O-CB 3.31Å; Q149-I153 WeakPolarHBondContact O-CB 3.46Å; Q149-I153 WeakPolarHBondContact O-CD1 3.43Å; Q149-I153 VanDerWaalsContact O-CG1 3.23Å; Q149-I153 WeakPolarHBondContact O-CG1 3.26Å; Q149-I153 PolarHBondContact O-N 2.63Å; M150-I153 PolarHBondContact O-N 3.01Å; E151-I153 PolarHBondContact O-N 3.48Å; I153-N155 PolarHBondContact O-N 3.21Å; I153-I156 PolarHBondContact O-N 2.96Å; I153-S157 WeakPolarHBondContact O-CB 3.42Å; I153-S157 PolarHBondContact O-N 3.01Å; I153-S157 PolarHBondContact O-OG 3.2Å; I153-S157 VanDerWaalsContact O-OG 3.09Å; I153-L172 HydrophobicContact CD1-CB 4.47Å; I153-L172 HydrophobicContact CG1-CD1 4.48Å; I153-F174 HydrophobicContact CB-CD1 4.35Å; I153-F174 HydrophobicContact CB-CE1 4.27Å; I153-F174 HydrophobicContact CD1-CD2 4.33Å; I153-F174 HydrophobicContact CD1-CG 4.45Å; I153-F174 HydrophobicContact CG1-CD1 4.19Å; I153-F174 HydrophobicContact CG1-CD2 3.96Å; I153-F174 HydrophobicContact CG1-CE1 4.13Å; I153-F174 HydrophobicContact CG1-CE2 3.9Å; I153-F174 HydrophobicContact CG1-CG 4.09Å; I153-F174 HydrophobicContact CG1-CZ 3.99Å; I153-F174 HydrophobicContact CG2-CD1 3.62Å; I153-F174 HydrophobicContact CG2-CE1 3.91Å; I153-F174 HydrophobicContact CG2-CG 4.07Å; I153-F177 HydrophobicContact CD1-CB 4.1Å; I153-F177 HydrophobicContact CD1-CD2 3.25Å; I153-F177 HydrophobicContact CD1-CE2 3.85Å; I153-F177 HydrophobicContact CD1-CG 3.91Å
154	K	93.1	Very high	94	Very high	144 Å²	144	63.6 Å²	63.6	63%	0.626	33%	0.325	S	S	*	.	H	α-helix	trans	-57.5	-48.5	177.4	-175	-178.6	178.9	-174.7	0	111.4	M150 E151 L152 I156 S157 T158	M150-K154 WeakPolarHBondContact O-CB 3.39Å; M150-K154 PolarHBondContact O-N 2.94Å; E151-K154 PolarHBondContact O-N 3Å; L152-K154 VanDerWaalsContact C-N 3.34Å; K154-I156 VanDerWaalsContact C-N 3.31Å; K154-I156 PolarHBondContact O-N 2.74Å; K154-S157 PolarHBondContact O-N 2.84Å; K154-T158 WeakPolarHBondContact O-CG2 3.4Å; K154-T158 PolarHBondContact O-N 3.06Å; K154-T158 PolarHBondContact O-OG1 3.23Å; K154-T158 VanDerWaalsContact O-OG1 3.06Å
155	N	92.1	Very high	94.1	Very high	92 Å²	92	63 Å²	63	49%	0.492	32%	0.323	S	S	.	.	H	α-helix	trans	-61.8	-38.5	-179.7	-67.3	-8.3	0	0	0	112.2	E151 L152 I153 T158	E151-N155 WeakPolarHBondContact O-CB 3.49Å; E151-N155 PolarHBondContact O-N 2.96Å; E151-N155 PolarHBondContact O-OD1 3.19Å; L152-N155 PolarHBondContact O-N 3.2Å; I153-N155 PolarHBondContact O-N 3.21Å; N155-T158 PolarHBondContact O-OG1 2.9Å
156	I	92.9	Very high	94.1	Very high	2 Å²	2	59.3 Å²	59.3	1%	0.01	30%	0.299	C	S	.	.	H	α-helix	trans	-69.9	-46.3	176.5	-65.3	164.6	0	0	0	110.5	L152 I153 K154 T158 A159 Y163 F165 F174	L152-I156 HydrophobicContact CD1-CD1 3.88Å; L152-I156 HydrophobicContact CD1-CG1 4.17Å; L152-I156 HydrophobicContact CG-CD1 3.78Å; L152-I156 HydrophobicContact CG-CG1 4.49Å; L152-I156 WeakPolarHBondContact O-CD1 3.41Å; L152-I156 VanDerWaalsContact O-CG1 3.22Å; L152-I156 WeakPolarHBondContact O-CG1 3.49Å; L152-I156 PolarHBondContact O-N 2.88Å; I153-I156 PolarHBondContact O-N 2.96Å; K154-I156 VanDerWaalsContact C-N 3.31Å; K154-I156 PolarHBondContact O-N 2.74Å; I156-T158 PolarHBondContact O-N 3.31Å; I156-A159 VanDerWaalsContact O-CB 3.26Å; I156-A159 WeakPolarHBondContact O-CB 3.29Å; I156-A159 PolarHBondContact O-N 3.31Å; I156-A159 VanDerWaalsContact O-N 3.11Å; I156-Y163 HydrophobicContact CG2-CE2 3.65Å; I156-F165 HydrophobicContact CD1-CD1 3.56Å; I156-F165 HydrophobicContact CD1-CD2 4.1Å; I156-F165 HydrophobicContact CD1-CE1 3.48Å; I156-F165 VanDerWaalsContact CD1-CE1 3.48Å; I156-F165 HydrophobicContact CD1-CE2 4.02Å; I156-F165 HydrophobicContact CD1-CG 3.88Å; I156-F165 HydrophobicContact CD1-CZ 3.72Å; I156-F165 HydrophobicContact CG1-CD1 4.1Å; I156-F165 HydrophobicContact CG1-CD2 3.76Å; I156-F165 HydrophobicContact CG1-CE1 4.23Å; I156-F165 HydrophobicContact CG1-CE2 3.89Å; I156-F165 HydrophobicContact CG1-CG 3.86Å; I156-F165 HydrophobicContact CG1-CZ 4.12Å; I156-F165 HydrophobicContact CG2-CB 4.19Å; I156-F165 HydrophobicContact CG2-CG 4.36Å; I156-F174 HydrophobicContact CB-CE1 4.13Å; I156-F174 HydrophobicContact CB-CZ 4.12Å; I156-F174 HydrophobicContact CD1-CZ 3.84Å; I156-F174 HydrophobicContact CG2-CE1 3.94Å; I156-F174 HydrophobicContact CG2-CZ 3.92Å
157	S	91.5	Very high	94.1	Very high	43 Å²	43	53 Å²	53	30%	0.301	27%	0.272	S	S	.	.	H	α-helix	trans	-67.5	-22.3	-177.6	-65.2	0	0	0	0	113.6	I153 K154 A159	I153-S157 WeakPolarHBondContact O-CB 3.42Å; I153-S157 PolarHBondContact O-N 3.01Å; I153-S157 PolarHBondContact O-OG 3.2Å; I153-S157 VanDerWaalsContact O-OG 3.09Å; K154-S157 PolarHBondContact O-N 2.84Å; S157-A159 VanDerWaalsContact C-N 3.33Å
158	T	92	Very high	94	Very high	105 Å²	105	49.3 Å²	49.3	64%	0.644	25%	0.251	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.9	-5.6	174.2	51.5	0	0	0	0	114	K154 N155 I156	K154-T158 WeakPolarHBondContact O-CG2 3.4Å; K154-T158 PolarHBondContact O-N 3.06Å; K154-T158 PolarHBondContact O-OG1 3.23Å; K154-T158 VanDerWaalsContact O-OG1 3.06Å; N155-T158 PolarHBondContact O-OG1 2.9Å; I156-T158 PolarHBondContact O-N 3.31Å
159	A	91.8	Very high	94.1	Very high	21 Å²	21	46.8 Å²	46.8	17%	0.174	24%	0.239	C	C	.	.	S	Bend	trans	-67.1	141.5	178	0	0	0	0	0	111.1	V134 I156 S157 Q161 Y163	V134-A159 HydrophobicContact CG2-CB 3.83Å; I156-A159 VanDerWaalsContact O-CB 3.26Å; I156-A159 WeakPolarHBondContact O-CB 3.29Å; I156-A159 PolarHBondContact O-N 3.31Å; I156-A159 VanDerWaalsContact O-N 3.11Å; S157-A159 VanDerWaalsContact C-N 3.33Å; A159-Q161 PolarHBondContact O-N 2.89Å; A159-Y163 HydrophobicContact CB-CD1 3.92Å; A159-Y163 HydrophobicContact CB-CE1 4.47Å; A159-Y163 HydrophobicContact CB-CG 4.07Å
160	E	92.3	Very high	94.2	Very high	151 Å²	151	46.2 Å²	46.2	71%	0.706	24%	0.236	S	C	*	.	P	Polyproline II helix	trans	-68.5	131.6	179	-176.9	177.6	-142.7	0	0	110.2	N132	N132-E160 WeakPolarHBondContact ND2-CB 3.39Å; N132-E160 PolarHBondContact ND2-O 3.14Å
161	Q	91.8	Very high	94.4	Very high	94 Å²	94	42.8 Å²	42.8	44%	0.439	22%	0.219	S	C	.	.	S	Bend	trans	-90.7	148.4	-175.3	-67.1	-179.6	41.8	0	0	111.6	S103 Q104 A159 Y163	S103-Q161 PolarHBondContact OG-OE1 2.74Å; Q104-Q161 HydrophobicContact CG-CG 4.08Å; A159-Q161 PolarHBondContact O-N 2.89Å; Q161-Y163 HydrophobicContact CG-CD1 3.76Å; Q161-Y163 HydrophobicContact CG-CE1 3.97Å
162	P	94.7	Very high	94.6	Very high	35 Å²	35	37 Å²	37	23%	0.227	19%	0.192	C	C	.	.	S	Bend	cis	-75.7	137.9	0.1	30.1	-33.5	0	0	0	112.3	L99 S103 F131 N132 Y301	L99-P162 HydrophobicContact CD1-CB 4.19Å; L99-P162 HydrophobicContact CD1-CG 4.39Å; S103-P162 VanDerWaalsContact O-CA 3.31Å; S103-P162 WeakPolarHBondContact O-CA 3.36Å; F131-P162 HydrophobicContact CB-CB 4.4Å; F131-P162 HydrophobicContact CB-CG 3.96Å; F131-P162 WeakPolarHBondContact CB-O 3.43Å; N132-P162 PolarHBondContact N-O 3.4Å; P162-Y301 HydrophobicContact CB-CE1 4.33Å; P162-Y301 WeakPolarHBondContact CB-OH 3.35Å
163	Y	95.9	Very high	94.7	Very high	0 Å²	0	39.2 Å²	39.2	0%	0	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125	152.3	176.7	72	-102.9	0	0	0	112.6	S103 Q104 V105 N132 I156 A159 Q161 F165 Y301	S103-Y163 PolarHBondContact O-N 3.11Å; Q104-Y163 HydrophobicContact CB-CE1 4Å; Q104-Y163 HydrophobicContact CB-CE2 4.33Å; Q104-Y163 HydrophobicContact CG-CD1 4.41Å; Q104-Y163 HydrophobicContact CG-CE1 3.61Å; Q104-Y163 PolarHBondContact OE1-OH 3.28Å; V105-Y163 PolarHBondContact N-O 2.66Å; V105-Y163 VanDerWaalsContact N-O 3.13Å; N132-Y163 CarbonylContact O-C 3.32Å; N132-Y163 WeakPolarHBondContact O-CA 3.37Å; N132-Y163 WeakPolarHBondContact O-CB 3.37Å; I156-Y163 HydrophobicContact CG2-CE2 3.65Å; A159-Y163 HydrophobicContact CB-CD1 3.92Å; A159-Y163 HydrophobicContact CB-CE1 4.47Å; A159-Y163 HydrophobicContact CB-CG 4.07Å; Q161-Y163 HydrophobicContact CG-CD1 3.76Å; Q161-Y163 HydrophobicContact CG-CE1 3.97Å; Y163-F165 HydrophobicContact CD2-CB 4.31Å; Y163-F165 HydrophobicContact CE2-CB 4.35Å; Y163-Y301 PolarHBondContact N-OH 3.38Å; Y163-Y301 PolarHBondContact O-OH 2.96Å
164	L	97.6	Very high	94.8	Very high	0 Å²	0	38.9 Å²	38.9	0%	0	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	112.3	166	-169.5	155.5	0	0	0	108.7	V105 L122 F131 N132 L133 V134 I185 Y301 F302	V105-L164 HydrophobicContact CB-CB 4.42Å; V105-L164 HydrophobicContact CB-CD1 4.3Å; V105-L164 HydrophobicContact CB-CG 4.06Å; V105-L164 HydrophobicContact CG1-CD1 4.01Å; V105-L164 HydrophobicContact CG1-CG 4.02Å; V105-L164 CarbonylContact O-C 3.59Å; V105-L164 WeakPolarHBondContact O-CA 3.44Å; L122-L164 HydrophobicContact CD1-CD1 4.42Å; L122-L164 HydrophobicContact CD1-CD2 3.73Å; L122-L164 HydrophobicContact CD2-CD1 3.66Å; L122-L164 HydrophobicContact CD2-CD2 4.38Å; F131-L164 HydrophobicContact CD2-CB 4.24Å; F131-L164 HydrophobicContact CE2-CB 3.96Å; N132-L164 PolarHBondContact O-N 3Å; L133-L164 HydrophobicContact CD1-CD2 3.93Å; V134-L164 PolarHBondContact N-O 3.44Å; L164-I185 HydrophobicContact CD1-CD1 4.48Å; L164-Y301 HydrophobicContact CB-CD1 4.14Å; L164-Y301 HydrophobicContact CB-CE1 3.92Å; L164-Y301 HydrophobicContact CD1-CD1 4.24Å; L164-F302 HydrophobicContact CD1-CE2 4.17Å; L164-F302 HydrophobicContact CD1-CZ 3.97Å
165	F	97.1	Very high	94.8	Very high	5 Å²	5	35.5 Å²	35.5	2%	0.022	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.9	133.7	177.8	173.7	-102.8	0	0	0	110.9	V105 V106 Y107 V134 L152 I156 Y163 R167	V105-F165 PolarHBondContact O-N 3.07Å; V106-F165 HydrophobicContact CG1-CD1 4.02Å; V106-F165 HydrophobicContact CG2-CB 4.31Å; V106-F165 HydrophobicContact CG2-CD1 4.34Å; Y107-F165 PolarHBondContact N-O 3.32Å; V134-F165 HydrophobicContact CB-CB 4.43Å; V134-F165 HydrophobicContact CB-CD2 4.03Å; V134-F165 HydrophobicContact CG1-CD2 3.8Å; V134-F165 HydrophobicContact CG1-CE2 4.42Å; V134-F165 CarbonylContact O-C 3.44Å; V134-F165 WeakPolarHBondContact O-CA 3.49Å; L152-F165 HydrophobicContact CD1-CE2 4.42Å; L152-F165 HydrophobicContact CD1-CZ 3.99Å; I156-F165 HydrophobicContact CD1-CD1 3.56Å; I156-F165 HydrophobicContact CD1-CD2 4.1Å; I156-F165 HydrophobicContact CD1-CE1 3.48Å; I156-F165 VanDerWaalsContact CD1-CE1 3.48Å; I156-F165 HydrophobicContact CD1-CE2 4.02Å; I156-F165 HydrophobicContact CD1-CG 3.88Å; I156-F165 HydrophobicContact CD1-CZ 3.72Å; I156-F165 HydrophobicContact CG1-CD1 4.1Å; I156-F165 HydrophobicContact CG1-CD2 3.76Å; I156-F165 HydrophobicContact CG1-CE1 4.23Å; I156-F165 HydrophobicContact CG1-CE2 3.89Å; I156-F165 HydrophobicContact CG1-CG 3.86Å; I156-F165 HydrophobicContact CG1-CZ 4.12Å; I156-F165 HydrophobicContact CG2-CB 4.19Å; I156-F165 HydrophobicContact CG2-CG 4.36Å; Y163-F165 HydrophobicContact CD2-CB 4.31Å; Y163-F165 HydrophobicContact CE2-CB 4.35Å; F165-R167 HydrophobicContact CE1-CB 3.71Å; F165-R167 HydrophobicContact CE2-CB 4.38Å; F165-R167 HydrophobicContact CZ-CB 3.48Å; F165-R167 VanDerWaalsContact CZ-CB 3.48Å; F165-R167 HydrophobicContact CZ-CG 4.34Å
166	T	95.4	Very high	94.8	Very high	1 Å²	1	40.3 Å²	40.3	1%	0.006	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.9	130.9	173.5	-171.5	0	0	0	0	113.9	Y107 R109 V119 L133 V134 T135	Y107-T166 WeakPolarHBondContact O-CA 3.48Å; Y107-T166 PolarHBondContact O-OG1 3.3Å; Y107-T166 VanDerWaalsContact O-OG1 3.1Å; R109-T166 WeakPolarHBondContact CD-OG1 3.36Å; V119-T166 HydrophobicContact CG2-CG2 3.94Å; L133-T166 HydrophobicContact CD1-CG2 4.23Å; V134-T166 PolarHBondContact O-N 2.95Å; T135-T166 HydrophobicContact CG2-CG2 3.95Å
167	R	94.4	Very high	94.8	Very high	10 Å²	10	42.5 Å²	42.5	4%	0.038	22%	0.218	C	C	.	.			trans	-159.9	153.7	177	-175.7	-179.8	168.1	167.1	-10.8	110.9	Y107 N108 R109 S136 I138 K141 F165 V169	Y107-R167 PolarHBondContact O-N 3.14Å; N108-R167 CarbonylContact C-O 3.53Å; N108-R167 VanDerWaalsContact C-O 3.32Å; N108-R167 WeakPolarHBondContact CA-O 3.44Å; R109-R167 WeakPolarHBondContact CG-O 3.18Å; R109-R167 PolarHBondContact N-O 2.76Å; R109-R167 VanDerWaalsContact N-O 3.09Å; S136-R167 PolarHBondContact OG-NH1 3.29Å; I138-R167 PolarHBondContact O-NE 3Å; K141-R167 PolarHBondContact O-NH2 2.86Å; F165-R167 HydrophobicContact CE1-CB 3.71Å; F165-R167 HydrophobicContact CE2-CB 4.38Å; F165-R167 HydrophobicContact CZ-CB 3.48Å; F165-R167 VanDerWaalsContact CZ-CB 3.48Å; F165-R167 HydrophobicContact CZ-CG 4.34Å; R167-V169 HydrophobicContact CB-CG1 4.24Å; R167-V169 HydrophobicContact CG-CB 4.29Å; R167-V169 HydrophobicContact CG-CG1 4.46Å; R167-V169 PolarHBondContact O-N 3.05Å; R167-V169 VanDerWaalsContact O-N 3.12Å
168	H	94.7	Very high	94.7	Very high	35 Å²	35	44.1 Å²	44.1	16%	0.162	24%	0.241	C	C	.	.	S	Bend	trans	-74.3	93.5	163	-64.1	-61.9	0	0	0	109.7	R109 T142	R109-H168 PolarHBondContact NE-CE1 3.26Å; R109-H168 PolarHBondContact NE-NE2 3.32Å; R109-H168 PolarHBondContact O-ND1 2.98Å; T142-H168 HydrophobicContact CG2-CB 4.34Å
169	V	96.6	Very high	94.6	Very high	1 Å²	1	39.9 Å²	39.9	1%	0.006	22%	0.218	C	C	.	.			trans	-148	144.6	-179.8	67.3	0	0	0	0	110.3	N108 L144 L152 R167 L172 Y251	N108-V169 HydrophobicContact CB-CG1 4Å; N108-V169 WeakPolarHBondContact CB-O 3.35Å; N108-V169 PolarHBondContact ND2-O 3.46Å; N108-V169 VanDerWaalsContact ND2-O 3.16Å; L144-V169 HydrophobicContact CD1-CG2 3.74Å; L144-V169 HydrophobicContact CG-CG2 4.22Å; L152-V169 HydrophobicContact CD2-CG2 4.28Å; R167-V169 HydrophobicContact CB-CG1 4.24Å; R167-V169 HydrophobicContact CG-CB 4.29Å; R167-V169 HydrophobicContact CG-CG1 4.46Å; R167-V169 PolarHBondContact O-N 3.05Å; R167-V169 VanDerWaalsContact O-N 3.12Å; V169-L172 HydrophobicContact CG2-CD1 4.41Å; V169-Y251 WeakPolarHBondContact O-CD1 3.48Å
170	H	97.9	Very high	94.6	Very high	8 Å²	8	44.6 Å²	44.6	4%	0.037	24%	0.24	C	C	.	.			trans	-71	153	172.9	-56.1	173.5	0	0	0	110.6	T142 L172 P250 Y251 Q255	T142-H170 PolarHBondContact O-N 2.79Å; T142-H170 VanDerWaalsContact O-N 3.15Å; T142-H170 PolarHBondContact OG1-NE2 2.92Å; T142-H170 VanDerWaalsContact OG1-NE2 3.17Å; H170-L172 PolarHBondContact O-N 3.46Å; H170-P250 WeakPolarHBondContact CB-O 3.23Å; H170-Y251 AromaticContact CD2-CD2 3.86Å; H170-Q255 PolarHBondContact O-NE2 3.09Å; H170-Q255 VanDerWaalsContact O-NE2 3.14Å
171	F	98.3	Very high	94.8	Very high	9 Å²	9	40 Å²	40	4%	0.039	22%	0.219	C	C	.	.			trans	-43.7	134	-179	173.7	-103	0	0	0	113.1	N173 Y184 Y251 G254 N273 N277 F278	F171-N173 HydrophobicContact CE1-CB 4.08Å; F171-N173 HydrophobicContact CZ-CB 4.41Å; F171-Y184 HydrophobicContact CD2-CD1 4.04Å; F171-Y184 HydrophobicContact CD2-CD2 4.36Å; F171-Y184 AromaticContact CD2-CE1 3.8Å; F171-Y184 HydrophobicContact CD2-CE1 3.8Å; F171-Y184 HydrophobicContact CD2-CE2 4.17Å; F171-Y184 HydrophobicContact CD2-CG 4.31Å; F171-Y184 AromaticContact CD2-CZ 3.89Å; F171-Y184 HydrophobicContact CE2-CD1 4.49Å; F171-Y184 HydrophobicContact CE2-CD2 4.01Å; F171-Y184 HydrophobicContact CE2-CE1 4.33Å; F171-Y184 AromaticContact CE2-CE2 3.86Å; F171-Y184 HydrophobicContact CE2-CE2 3.86Å; F171-Y184 HydrophobicContact CE2-CG 4.33Å; F171-Y251 WeakPolarHBondContact CB-O 3.26Å; F171-Y251 PolarHBondContact N-O 3.26Å; F171-G254 VanDerWaalsContact O-CA 3.3Å; F171-G254 WeakPolarHBondContact O-CA 3.49Å; F171-N273 HydrophobicContact CD1-CB 4.42Å; F171-N273 WeakPolarHBondContact CD1-ND2 3.44Å; F171-N273 HydrophobicContact CE1-CB 4.42Å; F171-N277 HydrophobicContact CE2-CB 3.67Å; F171-N277 HydrophobicContact CZ-CB 3.85Å; F171-F278 AromaticContact CD2-CE2 3.81Å; F171-F278 HydrophobicContact CD2-CE2 3.81Å; F171-F278 HydrophobicContact CD2-CZ 4.06Å; F171-F278 HydrophobicContact CE2-CE2 4.26Å; F171-F278 HydrophobicContact CG-CE2 4.48Å
172	L	97.2	Very high	95	Very high	1 Å²	1	35.6 Å²	35.6	1%	0.005	20%	0.199	C	C	.	.			trans	-116.3	129	178.8	-61	171	0	0	0	107.9	L144 Q149 L152 I153 V169 H170 F174 Y184 Q255	L144-L172 HydrophobicContact CD1-CD2 4.38Å; Q149-L172 HydrophobicContact CB-CD2 4.28Å; Q149-L172 HydrophobicContact CG-CD2 3.72Å; L152-L172 HydrophobicContact CD2-CD1 3.73Å; L152-L172 HydrophobicContact CG-CD1 4.27Å; I153-L172 HydrophobicContact CD1-CB 4.47Å; I153-L172 HydrophobicContact CG1-CD1 4.48Å; V169-L172 HydrophobicContact CG2-CD1 4.41Å; H170-L172 PolarHBondContact O-N 3.46Å; L172-F174 HydrophobicContact CB-CD2 4.16Å; L172-F174 HydrophobicContact CB-CE2 3.96Å; L172-Y184 PolarHBondContact O-OH 3.41Å; L172-Q255 HydrophobicContact CD2-CG 3.63Å
173	N	96.3	Very high	95.1	Very high	59 Å²	59	35.7 Å²	35.7	32%	0.316	20%	0.198	S	C	.	.			trans	-92.1	104.3	172.5	-176.7	-46.3	0	0	0	107.8	F171 S175 R176 F177	F171-N173 HydrophobicContact CE1-CB 4.08Å; F171-N173 HydrophobicContact CZ-CB 4.41Å; N173-S175 PolarHBondContact OD1-N 3Å; N173-R176 HydrophobicContact CB-CB 4.16Å; N173-R176 WeakPolarHBondContact OD1-CB 3.27Å; N173-R176 PolarHBondContact OD1-N 2.99Å; N173-F177 VanDerWaalsContact O-CD2 3.26Å; N173-F177 WeakPolarHBondContact O-CD2 3.34Å
174	F	96.3	Very high	95.2	Very high	0 Å²	0	35.7 Å²	35.7	0%	0	20%	0.199	C	C	.	.	S	Bend	trans	-69.9	-39.9	-176.9	-81.3	-126.8	0	0	0	110.8	I153 I156 L172 R176 F177 G178 G179 D180 P182 Y184	I153-F174 HydrophobicContact CB-CD1 4.35Å; I153-F174 HydrophobicContact CB-CE1 4.27Å; I153-F174 HydrophobicContact CD1-CD2 4.33Å; I153-F174 HydrophobicContact CD1-CG 4.45Å; I153-F174 HydrophobicContact CG1-CD1 4.19Å; I153-F174 HydrophobicContact CG1-CD2 3.96Å; I153-F174 HydrophobicContact CG1-CE1 4.13Å; I153-F174 HydrophobicContact CG1-CE2 3.9Å; I153-F174 HydrophobicContact CG1-CG 4.09Å; I153-F174 HydrophobicContact CG1-CZ 3.99Å; I153-F174 HydrophobicContact CG2-CD1 3.62Å; I153-F174 HydrophobicContact CG2-CE1 3.91Å; I153-F174 HydrophobicContact CG2-CG 4.07Å; I156-F174 HydrophobicContact CB-CE1 4.13Å; I156-F174 HydrophobicContact CB-CZ 4.12Å; I156-F174 HydrophobicContact CD1-CZ 3.84Å; I156-F174 HydrophobicContact CG2-CE1 3.94Å; I156-F174 HydrophobicContact CG2-CZ 3.92Å; L172-F174 HydrophobicContact CB-CD2 4.16Å; L172-F174 HydrophobicContact CB-CE2 3.96Å; F174-R176 PolarHBondContact O-N 2.82Å; F174-F177 CarbonylContact O-C 3.52Å; F174-F177 WeakPolarHBondContact O-CA 3.45Å; F174-F177 PolarHBondContact O-N 3.01Å; F174-G178 PolarHBondContact O-N 3.38Å; F174-G179 CarbonylContact C-O 3.46Å; F174-G179 PolarHBondContact O-N 3.33Å; F174-D180 WeakPolarHBondContact CB-O 3.41Å; F174-D180 WeakPolarHBondContact CD1-O 3.42Å; F174-P182 HydrophobicContact CD1-CG 4.21Å; F174-P182 HydrophobicContact CD2-CG 4.17Å; F174-P182 HydrophobicContact CE1-CG 4.11Å; F174-P182 HydrophobicContact CE2-CG 4.05Å; F174-P182 HydrophobicContact CG-CG 4.27Å; F174-P182 HydrophobicContact CZ-CG 4.03Å; F174-Y184 WeakPolarHBondContact CE2-OH 3.16Å
175	S	94	Very high	95.2	Very high	74 Å²	74	36 Å²	36	52%	0.517	20%	0.2	S	C	.	.	G	3₁₀ helix	trans	-58	-34.9	178.7	-54.4	0	0	0	0	112.4	N173 F177 G178 G179	N173-S175 PolarHBondContact OD1-N 3Å; S175-F177 PolarHBondContact O-N 2.84Å; S175-F177 VanDerWaalsContact O-N 3.14Å; S175-G178 PolarHBondContact O-N 2.95Å; S175-G179 WeakPolarHBondContact CA-O 3.4Å; S175-G179 PolarHBondContact N-O 3.49Å
176	R	92.8	Very high	95.3	Very high	192 Å²	192	36 Å²	36	73%	0.725	20%	0.2	S	C	*	.	G	3₁₀ helix	trans	-63.8	-18.7	176.7	-161.4	-176.6	172.3	-162.1	-2.2	113.2	N173 F174	N173-R176 HydrophobicContact CB-CB 4.16Å; N173-R176 WeakPolarHBondContact OD1-CB 3.27Å; N173-R176 PolarHBondContact OD1-N 2.99Å; F174-R176 PolarHBondContact O-N 2.82Å
177	F	91.9	Very high	95.5	Very high	49 Å²	49	36.1 Å²	36.1	22%	0.215	20%	0.201	C	C	.	.	G	3₁₀ helix	trans	-112.3	15.5	177.1	-61.3	-79.8	0	0	0	112.7	K146 Q149 M150 I153 N173 F174 S175 G179	K146-F177 HydrophobicContact CG-CE1 3.83Å; K146-F177 HydrophobicContact CG-CZ 4.3Å; Q149-F177 HydrophobicContact CB-CE2 4.05Å; Q149-F177 HydrophobicContact CB-CZ 3.87Å; M150-F177 HydrophobicContact CG-CD1 3.27Å; M150-F177 HydrophobicContact CG-CE1 3.55Å; M150-F177 HydrophobicContact CG-CG 4.12Å; M150-F177 HydrophobicContact SD-CD1 4.03Å; M150-F177 HydrophobicContact SD-CE1 4.3Å; I153-F177 HydrophobicContact CD1-CB 4.1Å; I153-F177 HydrophobicContact CD1-CD2 3.25Å; I153-F177 HydrophobicContact CD1-CE2 3.85Å; I153-F177 HydrophobicContact CD1-CG 3.91Å; N173-F177 VanDerWaalsContact O-CD2 3.26Å; N173-F177 WeakPolarHBondContact O-CD2 3.34Å; F174-F177 CarbonylContact O-C 3.52Å; F174-F177 WeakPolarHBondContact O-CA 3.45Å; F174-F177 PolarHBondContact O-N 3.01Å; S175-F177 PolarHBondContact O-N 2.84Å; S175-F177 VanDerWaalsContact O-N 3.14Å; F177-G179 VanDerWaalsContact C-N 3.29Å; F177-G179 PolarHBondContact O-N 3.24Å
178	G	90.1	Very high	95.7	Very high	76 Å²	76	35.7 Å²	35.7	78%	0.784	20%	0.199	S	C	*	.	T	Hydrogen-bonded Turn	trans	74.7	14.3	177.9	0	0	0	0	0	114.6	F174 S175	F174-G178 PolarHBondContact O-N 3.38Å; S175-G178 PolarHBondContact O-N 2.95Å
179	G	90.3	Very high	95.8	Very high	16 Å²	16	36.5 Å²	36.5	17%	0.165	20%	0.201	C	C	.	.			trans	-94.2	154.9	172.5	0	0	0	0	0	112.1	F174 S175 F177	F174-G179 CarbonylContact C-O 3.46Å; F174-G179 PolarHBondContact O-N 3.33Å; S175-G179 WeakPolarHBondContact CA-O 3.4Å; S175-G179 PolarHBondContact N-O 3.49Å; F177-G179 VanDerWaalsContact C-N 3.29Å; F177-G179 PolarHBondContact O-N 3.24Å
180	D	91.9	Very high	95.8	Very high	120 Å²	120	37.7 Å²	37.7	64%	0.642	21%	0.207	S	C	*	.			trans	-64.3	135.7	170.1	-65.7	-31.2	0	0	0	110	F174 P182	F174-D180 WeakPolarHBondContact CB-O 3.41Å; F174-D180 WeakPolarHBondContact CD1-O 3.42Å; D180-P182 WeakPolarHBondContact O-CD 3.33Å
181	Q	95.1	Very high	95.8	Very high	54 Å²	54	37.4 Å²	37.4	25%	0.252	21%	0.206	S	C	.	.			trans	-79.1	112.9	-178.2	-172.9	61.4	51.6	0	0	109.9	Y184	Q181-Y184 VanDerWaalsContact NE2-CE2 3.31Å
182	P	96	Very high	95.7	Very high	2 Å²	2	37.2 Å²	37.2	1%	0.013	21%	0.206	C	C	.	.	P	Polyproline II helix	trans	-71.9	158.9	172.8	32.1	-35.7	0	0	0	110	Q104 V106 F174 D180 Y184	Q104-P182 HydrophobicContact CB-CB 3.86Å; Q104-P182 WeakPolarHBondContact O-CB 3.34Å; V106-P182 HydrophobicContact CB-CG 4.39Å; V106-P182 HydrophobicContact CG2-CB 3.86Å; V106-P182 HydrophobicContact CG2-CG 3.46Å; V106-P182 VanDerWaalsContact CG2-CG 3.46Å; F174-P182 HydrophobicContact CD1-CG 4.21Å; F174-P182 HydrophobicContact CD2-CG 4.17Å; F174-P182 HydrophobicContact CE1-CG 4.11Å; F174-P182 HydrophobicContact CE2-CG 4.05Å; F174-P182 HydrophobicContact CG-CG 4.27Å; F174-P182 HydrophobicContact CZ-CG 4.03Å; D180-P182 WeakPolarHBondContact O-CD 3.33Å; P182-Y184 HydrophobicContact CG-CE2 3.98Å; P182-Y184 WeakPolarHBondContact O-CD2 3.1Å
183	V	96.4	Very high	95.6	Very high	37 Å²	37	39.4 Å²	39.4	22%	0.224	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.9	133.2	172.2	-62	0	0	0	0	109.7	P102 Q104 V105 V106 L279	P102-V183 HydrophobicContact CB-CB 4.37Å; P102-V183 HydrophobicContact CB-CG1 3.84Å; P102-V183 HydrophobicContact CB-CG2 3.55Å; P102-V183 HydrophobicContact CG-CG1 3.85Å; P102-V183 HydrophobicContact CG-CG2 4.05Å; Q104-V183 WeakPolarHBondContact O-CG2 3.49Å; Q104-V183 PolarHBondContact O-N 2.86Å; V105-V183 WeakPolarHBondContact CA-O 3.5Å; V105-V183 HydrophobicContact CB-CG2 4.42Å; V105-V183 HydrophobicContact CG2-CG2 3.83Å; V106-V183 PolarHBondContact N-O 2.83Å; V183-L279 HydrophobicContact CB-CB 4.27Å; V183-L279 HydrophobicContact CG2-CD2 4.34Å
184	Y	98.6	Very high	95.6	Very high	1 Å²	1	36.8 Å²	36.8	0%	0.004	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.2	144.7	176.8	-82.5	-110.8	0	0	0	111.5	V106 N108 F171 L172 F174 Q181 P182 N277 F278 L279	V106-Y184 HydrophobicContact CB-CD1 4.02Å; V106-Y184 HydrophobicContact CB-CD2 4.2Å; V106-Y184 HydrophobicContact CB-CE1 3.87Å; V106-Y184 HydrophobicContact CB-CE2 4.02Å; V106-Y184 HydrophobicContact CB-CG 4.19Å; V106-Y184 HydrophobicContact CG1-CD1 3.72Å; V106-Y184 HydrophobicContact CG1-CE1 3.27Å; V106-Y184 HydrophobicContact CG1-CE2 4.25Å; V106-Y184 HydrophobicContact CG1-CG 4.39Å; V106-Y184 HydrophobicContact CG2-CE2 4.34Å; V106-Y184 WeakPolarHBondContact O-CA 3.31Å; N108-Y184 HydrophobicContact CB-CD1 4.35Å; N108-Y184 HydrophobicContact CB-CE1 4.02Å; N108-Y184 WeakPolarHBondContact OD1-CD1 3.2Å; F171-Y184 HydrophobicContact CD2-CD1 4.04Å; F171-Y184 HydrophobicContact CD2-CD2 4.36Å; F171-Y184 AromaticContact CD2-CE1 3.8Å; F171-Y184 HydrophobicContact CD2-CE1 3.8Å; F171-Y184 HydrophobicContact CD2-CE2 4.17Å; F171-Y184 HydrophobicContact CD2-CG 4.31Å; F171-Y184 AromaticContact CD2-CZ 3.89Å; F171-Y184 HydrophobicContact CE2-CD1 4.49Å; F171-Y184 HydrophobicContact CE2-CD2 4.01Å; F171-Y184 HydrophobicContact CE2-CE1 4.33Å; F171-Y184 AromaticContact CE2-CE2 3.86Å; F171-Y184 HydrophobicContact CE2-CE2 3.86Å; F171-Y184 HydrophobicContact CE2-CG 4.33Å; L172-Y184 PolarHBondContact O-OH 3.41Å; F174-Y184 WeakPolarHBondContact CE2-OH 3.16Å; Q181-Y184 VanDerWaalsContact NE2-CE2 3.31Å; P182-Y184 HydrophobicContact CG-CE2 3.98Å; P182-Y184 WeakPolarHBondContact O-CD2 3.1Å; Y184-N277 WeakPolarHBondContact CB-O 3.35Å; Y184-N277 PolarHBondContact N-O 2.78Å; Y184-F278 VanDerWaalsContact CB-CD1 3.44Å; Y184-F278 AromaticContact CD1-CE1 3.92Å; Y184-F278 HydrophobicContact CD1-CE1 3.92Å; Y184-F278 HydrophobicContact CD1-CE2 4.47Å; Y184-F278 AromaticContact CD1-CZ 3.84Å; Y184-F278 HydrophobicContact CD1-CZ 3.84Å; Y184-F278 HydrophobicContact CG-CD1 4.47Å; Y184-F278 HydrophobicContact CG-CE1 4.17Å; Y184-F278 HydrophobicContact CG-CE2 4.43Å; Y184-F278 HydrophobicContact CG-CZ 4.16Å; Y184-F278 CarbonylContact O-C 3.55Å; Y184-F278 VanDerWaalsContact O-CA 3.28Å; Y184-F278 WeakPolarHBondContact O-CA 3.38Å; Y184-L279 PolarHBondContact O-N 3.41Å
185	I	98.6	Very high	95.6	Very high	7 Å²	7	37.1 Å²	37.1	4%	0.036	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	151.8	165.3	61.6	172.3	0	0	0	109.1	V105 V106 Y107 L164 L279 L280 L294 L298 F302	V105-I185 HydrophobicContact CG1-CD1 3.92Å; V105-I185 HydrophobicContact CG1-CG1 3.92Å; V105-I185 HydrophobicContact CG1-CG2 4.3Å; V106-I185 PolarHBondContact O-N 2.93Å; Y107-I185 HydrophobicContact CD2-CG1 4.42Å; Y107-I185 WeakPolarHBondContact CD2-O 3.38Å; Y107-I185 HydrophobicContact CG-CG1 4.37Å; L164-I185 HydrophobicContact CD1-CD1 4.48Å; I185-L279 HydrophobicContact CG2-CB 4.27Å; I185-L280 CarbonylContact C-O 3.53Å; I185-L280 WeakPolarHBondContact CA-O 3.43Å; I185-L294 HydrophobicContact CB-CD2 4.35Å; I185-L294 HydrophobicContact CD1-CD2 4.12Å; I185-L294 HydrophobicContact CG2-CD2 3.91Å; I185-L298 HydrophobicContact CG2-CD1 4.26Å; I185-F302 HydrophobicContact CD1-CE2 4.26Å; I185-F302 HydrophobicContact CD1-CZ 3.88Å
186	N	98.6	Very high	95.7	Very high	3 Å²	3	34.6 Å²	34.6	2%	0.016	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-154.9	165.4	172.5	-139.5	-48.1	0	0	0	112.7	N108 F252 F278 L280 V281 G282	N108-N186 PolarHBondContact O-ND2 2.88Å; N108-N186 PolarHBondContact OD1-ND2 2.99Å; N186-F252 HydrophobicContact CB-CE1 3.81Å; N186-F252 HydrophobicContact CB-CZ 3.7Å; N186-F278 HydrophobicContact CB-CD1 4.18Å; N186-F278 HydrophobicContact CB-CE1 3.96Å; N186-L280 PolarHBondContact N-O 3.1Å; N186-V281 HydrophobicContact CB-CG1 4.3Å; N186-V281 WeakPolarHBondContact O-CA 3.2Å; N186-G282 PolarHBondContact O-N 3.34Å
187	I	98.6	Very high	95.7	Very high	5 Å²	5	25.8 Å²	25.8	3%	0.026	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.5	123.7	174.8	-57.6	170.9	0	0	0	107.1	C113 V118 G282 L284 L287 V290	C113-I187 WeakPolarHBondContact CB-O 3.47Å; V118-I187 HydrophobicContact CG2-CD1 3.7Å; I187-G282 WeakPolarHBondContact CA-O 3.46Å; I187-L284 HydrophobicContact CG2-CB 4.19Å; I187-L287 HydrophobicContact CD1-CD1 3.67Å; I187-V290 HydrophobicContact CD1-CG1 4.07Å; I187-V290 HydrophobicContact CG1-CG1 4.02Å
188	I	98.5	Very high	95.8	Very high	0 Å²	0	25.5 Å²	25.5	0%	0	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	174.6	175.4	67.8	171.1	0	0	0	110.6	I248 F252 V281 G282 I283 L284 F347 Y348 V351	I188-I248 HydrophobicContact CB-CG2 4.15Å; I188-I248 HydrophobicContact CG2-CG2 3.66Å; I188-F252 HydrophobicContact CG2-CE2 3.49Å; I188-F252 VanDerWaalsContact CG2-CE2 3.49Å; I188-F252 HydrophobicContact CG2-CZ 3.49Å; I188-F252 VanDerWaalsContact CG2-CZ 3.49Å; I188-V281 HydrophobicContact CG2-CG1 4.14Å; I188-G282 PolarHBondContact N-O 3.17Å; I188-I283 HydrophobicContact CG1-CG2 4.18Å; I188-I283 CarbonylContact O-C 3.46Å; I188-I283 WeakPolarHBondContact O-CA 3.41Å; I188-L284 WeakPolarHBondContact O-CB 3.37Å; I188-L284 PolarHBondContact O-N 3.13Å; I188-F347 HydrophobicContact CD1-CE1 4.49Å; I188-Y348 HydrophobicContact CD1-CD2 3.71Å; I188-Y348 HydrophobicContact CD1-CE2 4.48Å; I188-Y348 HydrophobicContact CD1-CG 4.48Å; I188-Y348 HydrophobicContact CG1-CD2 4.09Å; I188-Y348 HydrophobicContact CG1-CE2 4.45Å; I188-V351 HydrophobicContact CD1-CB 3.66Å; I188-V351 HydrophobicContact CD1-CG1 3.56Å; I188-V351 HydrophobicContact CD1-CG2 3.98Å; I188-V351 HydrophobicContact CG1-CG1 4.01Å
189	R	97.4	Very high	95.9	Very high	53 Å²	53	22 Å²	22	20%	0.2	12%	0.117	C	C	.	.			trans	-139.9	157.2	-179.3	-176.5	-176.2	-173.9	165.3	3	108.2	K112 C113 R194 I248 L284 E285 Y348	K112-R189 WeakPolarHBondContact O-CD 3.38Å; K112-R189 PolarHBondContact O-NH1 3.35Å; C113-R189 HydrophobicContact CB-CB 4.3Å; R189-R194 HydrophobicContact CB-CB 4.29Å; R189-R194 HydrophobicContact CG-CB 4.46Å; R189-I248 WeakPolarHBondContact O-CD1 3.31Å; R189-L284 HydrophobicContact CB-CB 4.09Å; R189-L284 HydrophobicContact CB-CD2 4.26Å; R189-L284 HydrophobicContact CG-CB 4.24Å; R189-L284 HydrophobicContact CG-CD2 3.97Å; R189-E285 WeakPolarHBondContact CG-OE1 3.38Å; R189-Y348 VanDerWaalsContact C-CE2 3.48Å
190	D	97.8	Very high	96	Very high	25 Å²	25	21.5 Å²	21.5	13%	0.134	11%	0.11	C	C	.	.			trans	-42.6	126.4	168	169.4	-90.4	0	0	0	110.9	V192 N193 R194 E285 Y345 Y348	D190-V192 PolarHBondContact O-N 2.77Å; D190-V192 PolarHBondContact OD1-N 3.34Å; D190-N193 HydrophobicContact CB-CB 4.05Å; D190-N193 PolarHBondContact O-N 2.84Å; D190-N193 WeakPolarHBondContact OD1-CB 3.31Å; D190-N193 PolarHBondContact OD1-N 2.89Å; D190-N193 PolarHBondContact OD1-ND2 2.9Å; D190-R194 WeakPolarHBondContact O-CB 3.23Å; D190-R194 PolarHBondContact O-N 3.05Å; D190-E285 WeakPolarHBondContact CB-OE1 3.34Å; D190-E285 PolarHBondContact N-OE1 3.48Å; D190-Y345 PolarHBondContact OD1-OH 2.88Å; D190-Y345 WeakPolarHBondContact OD2-CE1 3.11Å; D190-Y345 PolarHBondContact OD2-OH 2.92Å; D190-Y348 VanDerWaalsContact N-CE2 3.32Å
191	P	97.8	Very high	95.9	Very high	2 Å²	2	17.4 Å²	17.4	1%	0.013	9%	0.087	C	C	.	.	H	α-helix	trans	-55.1	-44	-172.8	-29.8	34.7	0	0	0	114.6	F195 I248 M341 E344 Y345	P191-F195 WeakPolarHBondContact O-CB 3.4Å; P191-F195 PolarHBondContact O-N 2.97Å; P191-I248 HydrophobicContact CG-CD1 4.35Å; P191-M341 HydrophobicContact CB-SD 3.87Å; P191-E344 HydrophobicContact CB-CB 3.89Å; P191-E344 HydrophobicContact CG-CB 3.83Å; P191-Y345 HydrophobicContact CB-CD2 4.33Å; P191-Y345 HydrophobicContact CB-CE2 4.05Å; P191-Y345 HydrophobicContact CG-CD1 4.13Å; P191-Y345 HydrophobicContact CG-CD2 4.19Å; P191-Y345 HydrophobicContact CG-CE1 4.13Å; P191-Y345 HydrophobicContact CG-CE2 4.19Å; P191-Y345 HydrophobicContact CG-CG 4.14Å
192	V	96.3	Very high	95.5	Very high	6 Å²	6	19.6 Å²	19.6	4%	0.036	9%	0.093	C	C	.	.	H	α-helix	trans	-69.1	-48.4	179.8	168.5	0	0	0	0	110.4	D190 R194 F195 L196 L337 M341 Y345	D190-V192 PolarHBondContact O-N 2.77Å; D190-V192 PolarHBondContact OD1-N 3.34Å; V192-R194 VanDerWaalsContact C-N 3.26Å; V192-R194 PolarHBondContact O-N 2.91Å; V192-F195 CarbonylContact O-C 3.49Å; V192-F195 WeakPolarHBondContact O-CA 3.21Å; V192-F195 WeakPolarHBondContact O-CB 3.48Å; V192-F195 PolarHBondContact O-N 3.15Å; V192-L196 HydrophobicContact CG1-CD1 3.83Å; V192-L196 HydrophobicContact CG1-CG 4.15Å; V192-L196 WeakPolarHBondContact O-CG 3.47Å; V192-L196 PolarHBondContact O-N 3.32Å; V192-L337 HydrophobicContact CG1-CD1 4.21Å; V192-L337 HydrophobicContact CG2-CB 4Å; V192-L337 HydrophobicContact CG2-CD1 4.44Å; V192-M341 HydrophobicContact CG2-CE 4.2Å; V192-Y345 WeakPolarHBondContact CB-OH 3.18Å; V192-Y345 HydrophobicContact CG2-CE2 3.87Å; V192-Y345 VanDerWaalsContact CG2-OH 3.25Å; V192-Y345 WeakPolarHBondContact CG2-OH 3.26Å
193	N	95.1	Very high	95.2	Very high	47 Å²	47	19.7 Å²	19.7	25%	0.251	9%	0.093	S	C	.	.	H	α-helix	trans	-60.6	-36.6	178.1	-74.1	-34.1	0	0	0	112.3	D190 S197	D190-N193 HydrophobicContact CB-CB 4.05Å; D190-N193 PolarHBondContact O-N 2.84Å; D190-N193 WeakPolarHBondContact OD1-CB 3.31Å; D190-N193 PolarHBondContact OD1-N 2.89Å; D190-N193 PolarHBondContact OD1-ND2 2.9Å; N193-S197 VanDerWaalsContact O-CB 3.28Å; N193-S197 WeakPolarHBondContact O-CB 3.46Å; N193-S197 PolarHBondContact O-N 3.17Å
194	R	96.4	Very high	94.7	Very high	4 Å²	4	19.4 Å²	19.4	2%	0.015	9%	0.088	C	C	.	.	H	α-helix	trans	-64.5	-47.7	172.3	-173	-140.5	69.1	83.9	-3.2	111.1	K112 R189 D190 V192 S197 N198 Y247	K112-R194 HydrophobicContact CB-CG 4.03Å; R189-R194 HydrophobicContact CB-CB 4.29Å; R189-R194 HydrophobicContact CG-CB 4.46Å; D190-R194 WeakPolarHBondContact O-CB 3.23Å; D190-R194 PolarHBondContact O-N 3.05Å; V192-R194 VanDerWaalsContact C-N 3.26Å; V192-R194 PolarHBondContact O-N 2.91Å; R194-S197 PolarHBondContact O-N 3.18Å; R194-N198 PolarHBondContact O-N 2.78Å; R194-Y247 VanDerWaalsContact CZ-CG 3.45Å
195	F	96.4	Very high	94	Very high	7 Å²	7	19.3 Å²	19.3	3%	0.031	9%	0.088	C	C	.	.	H	α-helix	trans	-58.3	-52	177	164.7	-103.2	0	0	0	111.7	P191 V192 S197 N198 Y199 I229 E239 C240 L245 L337 M341	P191-F195 WeakPolarHBondContact O-CB 3.4Å; P191-F195 PolarHBondContact O-N 2.97Å; V192-F195 CarbonylContact O-C 3.49Å; V192-F195 WeakPolarHBondContact O-CA 3.21Å; V192-F195 WeakPolarHBondContact O-CB 3.48Å; V192-F195 PolarHBondContact O-N 3.15Å; F195-S197 VanDerWaalsContact C-N 3.32Å; F195-S197 PolarHBondContact O-N 3.25Å; F195-N198 CarbonylContact O-C 3.59Å; F195-N198 WeakPolarHBondContact O-CA 3.3Å; F195-N198 WeakPolarHBondContact O-CB 3.4Å; F195-N198 PolarHBondContact O-N 3.13Å; F195-Y199 HydrophobicContact CZ-CD2 4.13Å; F195-Y199 PolarHBondContact O-N 3.19Å; F195-I229 HydrophobicContact CE1-CD1 4.07Å; F195-I229 HydrophobicContact CZ-CD1 4.36Å; F195-E239 WeakPolarHBondContact CE2-O 3.47Å; F195-C240 HydrophobicContact CZ-CB 4.28Å; F195-L245 HydrophobicContact CD2-CD2 3.43Å; F195-L245 VanDerWaalsContact CD2-CD2 3.43Å; F195-L245 HydrophobicContact CE2-CD2 3.43Å; F195-L245 VanDerWaalsContact CE2-CD2 3.43Å; F195-L245 HydrophobicContact CG-CD2 4.02Å; F195-L245 HydrophobicContact CZ-CD2 4.01Å; F195-L337 HydrophobicContact CD1-CD1 3.77Å; F195-L337 HydrophobicContact CD1-CD2 4.42Å; F195-L337 HydrophobicContact CE1-CD1 3.81Å; F195-L337 HydrophobicContact CE1-CD2 4.18Å; F195-M341 HydrophobicContact CB-CE 3.78Å; F195-M341 HydrophobicContact CD1-CE 4.07Å; F195-M341 HydrophobicContact CG-CE 3.86Å
196	L	94.9	Very high	93.3	Very high	20 Å²	20	19 Å²	19	11%	0.105	9%	0.087	C	C	.	.	H	α-helix	trans	-58.7	-45.6	178	-66.4	175.4	0	0	0	111	V192 N198 Y199 F200 I229 P329	V192-L196 HydrophobicContact CG1-CD1 3.83Å; V192-L196 HydrophobicContact CG1-CG 4.15Å; V192-L196 WeakPolarHBondContact O-CG 3.47Å; V192-L196 PolarHBondContact O-N 3.32Å; L196-N198 PolarHBondContact O-N 3.48Å; L196-Y199 WeakPolarHBondContact O-CB 3.47Å; L196-Y199 PolarHBondContact O-N 3.33Å; L196-Y199 VanDerWaalsContact O-N 3.16Å; L196-F200 HydrophobicContact CB-CE2 4.41Å; L196-F200 HydrophobicContact CD2-CE2 4.34Å; L196-F200 WeakPolarHBondContact O-CD2 3.08Å; L196-F200 PolarHBondContact O-N 2.91Å; L196-F200 VanDerWaalsContact O-N 3.09Å; L196-I229 HydrophobicContact CD2-CD1 4.07Å; L196-I229 HydrophobicContact CD2-CG1 3.85Å; L196-P329 HydrophobicContact CD1-CG 3.97Å; L196-P329 HydrophobicContact CD2-CG 3.49Å; L196-P329 VanDerWaalsContact CD2-CG 3.49Å; L196-P329 HydrophobicContact CG-CG 4.36Å
197	S	92.9	Very high	92.4	Very high	7 Å²	7	22.3 Å²	22.3	5%	0.049	10%	0.099	C	C	.	.	H	α-helix	trans	-59.4	-34.1	175.6	-172.2	0	0	0	0	112.5	K112 N193 R194 F195 F201	K112-S197 WeakPolarHBondContact CE-O 3.4Å; K112-S197 WeakPolarHBondContact CE-OG 3.44Å; N193-S197 VanDerWaalsContact O-CB 3.28Å; N193-S197 WeakPolarHBondContact O-CB 3.46Å; N193-S197 PolarHBondContact O-N 3.17Å; R194-S197 PolarHBondContact O-N 3.18Å; F195-S197 VanDerWaalsContact C-N 3.32Å; F195-S197 PolarHBondContact O-N 3.25Å; S197-F201 WeakPolarHBondContact O-CB 3.37Å; S197-F201 PolarHBondContact O-N 3.44Å
198	N	93.3	Very high	91.1	Very high	43 Å²	43	26 Å²	26	23%	0.23	11%	0.112	C	C	.	.	H	α-helix	trans	-73.9	-42.2	175.3	-169.7	60	0	0	0	112.3	K112 R194 F195 L196 F200 F201 R202	K112-N198 HydrophobicContact CG-CB 3.87Å; R194-N198 PolarHBondContact O-N 2.78Å; F195-N198 CarbonylContact O-C 3.59Å; F195-N198 WeakPolarHBondContact O-CA 3.3Å; F195-N198 WeakPolarHBondContact O-CB 3.4Å; F195-N198 PolarHBondContact O-N 3.13Å; L196-N198 PolarHBondContact O-N 3.48Å; N198-F200 PolarHBondContact O-N 3.4Å; N198-F201 PolarHBondContact O-N 3.31Å; N198-R202 WeakPolarHBondContact O-CG 3.37Å; N198-R202 PolarHBondContact O-N 3.05Å
199	Y	93.4	Very high	89.1	Confident	3 Å²	3	27 Å²	27	1%	0.012	12%	0.124	C	C	.	.	H	α-helix	trans	-54.9	-53.6	179.5	-177.6	-89.4	0	0	0	111	F195 L196 R203 L227 I229 C232 E239	F195-Y199 HydrophobicContact CZ-CD2 4.13Å; F195-Y199 PolarHBondContact O-N 3.19Å; L196-Y199 WeakPolarHBondContact O-CB 3.47Å; L196-Y199 PolarHBondContact O-N 3.33Å; L196-Y199 VanDerWaalsContact O-N 3.16Å; Y199-R203 VanDerWaalsContact CZ-NH1 3.25Å; Y199-R203 WeakPolarHBondContact O-CG 3.34Å; Y199-R203 PolarHBondContact O-NH1 2.86Å; Y199-R203 VanDerWaalsContact OH-CZ 3.31Å; Y199-R203 PolarHBondContact OH-NH2 2.87Å; Y199-L227 PolarHBondContact OH-O 3.02Å; Y199-I229 HydrophobicContact CD1-CD1 3.74Å; Y199-I229 HydrophobicContact CD2-CD1 3.71Å; Y199-I229 HydrophobicContact CE1-CB 4.14Å; Y199-I229 HydrophobicContact CE1-CD1 3.73Å; Y199-I229 HydrophobicContact CE1-CG1 4.41Å; Y199-I229 HydrophobicContact CE2-CD1 3.68Å; Y199-I229 HydrophobicContact CG-CD1 3.73Å; Y199-C232 HydrophobicContact CE2-CB 4.14Å; Y199-E239 VanDerWaalsContact CE2-OE1 3.26Å; Y199-E239 WeakPolarHBondContact CE2-OE1 3.21Å
200	F	91.9	Very high	86.9	Confident	6 Å²	6	28.9 Å²	28.9	3%	0.026	13%	0.134	C	C	.	.	H	α-helix	trans	-73	-31.6	179.3	-64.4	-68.5	0	0	0	112.5	L196 N198 R202 R203 F204 I229 T323 K325 K326 T327	L196-F200 HydrophobicContact CB-CE2 4.41Å; L196-F200 HydrophobicContact CD2-CE2 4.34Å; L196-F200 WeakPolarHBondContact O-CD2 3.08Å; L196-F200 PolarHBondContact O-N 2.91Å; L196-F200 VanDerWaalsContact O-N 3.09Å; N198-F200 PolarHBondContact O-N 3.4Å; F200-R202 VanDerWaalsContact C-N 3.33Å; F200-R202 PolarHBondContact O-N 3.24Å; F200-R203 PolarHBondContact O-N 3.42Å; F200-R203 VanDerWaalsContact O-N 3.12Å; F200-F204 HydrophobicContact CB-CD2 4.38Å; F200-F204 HydrophobicContact CD1-CD2 4.03Å; F200-F204 AromaticContact CD1-CE2 3.86Å; F200-F204 HydrophobicContact CD1-CE2 3.86Å; F200-F204 PolarHBondContact O-N 3.42Å; F200-I229 HydrophobicContact CZ-CB 4.14Å; F200-I229 HydrophobicContact CZ-CG1 4.41Å; F200-I229 HydrophobicContact CZ-CG2 4.33Å; F200-T323 HydrophobicContact CB-CG2 3.59Å; F200-K325 WeakPolarHBondContact CD1-O 3.15Å; F200-K326 HydrophobicContact CB-CG 4.05Å; F200-K326 HydrophobicContact CD2-CB 3.92Å; F200-K326 HydrophobicContact CD2-CG 3.79Å; F200-K326 HydrophobicContact CE2-CB 4.3Å; F200-K326 HydrophobicContact CG-CB 4.31Å; F200-K326 HydrophobicContact CG-CG 4.05Å; F200-T327 WeakPolarHBondContact CE1-OG1 3.19Å; F200-T327 VanDerWaalsContact CE2-O 3.28Å; F200-T327 WeakPolarHBondContact CE2-O 3.23Å; F200-T327 VanDerWaalsContact CZ-N 3.26Å; F200-T327 WeakPolarHBondContact CZ-O 3.29Å; F200-T327 WeakPolarHBondContact CZ-OG1 3.43Å
201	F	89.1	Confident	84.7	Confident	34 Å²	34	35.5 Å²	35.5	15%	0.149	17%	0.165	C	C	.	.	H	α-helix	trans	-64.9	-38.1	177.4	178.5	-105	0	0	0	112.7	K112 S197 N198 R203 G205 D206 H213 T323	K112-F201 HydrophobicContact CD-CB 4.47Å; K112-F201 HydrophobicContact CD-CD1 4.38Å; K112-F201 HydrophobicContact CD-CG 4.4Å; K112-F201 VanDerWaalsContact NZ-CB 3.26Å; S197-F201 WeakPolarHBondContact O-CB 3.37Å; S197-F201 PolarHBondContact O-N 3.44Å; N198-F201 PolarHBondContact O-N 3.31Å; F201-R203 PolarHBondContact O-N 2.82Å; F201-G205 VanDerWaalsContact O-CA 3.3Å; F201-G205 WeakPolarHBondContact O-CA 3.46Å; F201-G205 PolarHBondContact O-N 2.98Å; F201-D206 HydrophobicContact CE2-CB 4.28Å; F201-H213 AromaticContact CE2-CE1 3.65Å; F201-H213 AromaticContact CE2-NE2 3.92Å; F201-H213 AromaticContact CZ-CE1 3.66Å; F201-T323 HydrophobicContact CB-CG2 3.99Å; F201-T323 WeakPolarHBondContact CB-OG1 3.26Å; F201-T323 VanDerWaalsContact N-CG2 3.32Å
202	R	88.1	Confident	82.6	Confident	100 Å²	100	39 Å²	39	38%	0.377	18%	0.183	S	C	.	.	H	α-helix	trans	-66.2	-26.1	175.9	-73.1	-179.3	65.4	-138.6	-6.2	112.3	N198 F200 T217 M220 E239	N198-R202 WeakPolarHBondContact O-CG 3.37Å; N198-R202 PolarHBondContact O-N 3.05Å; F200-R202 VanDerWaalsContact C-N 3.33Å; F200-R202 PolarHBondContact O-N 3.24Å; R202-T217 WeakPolarHBondContact O-CG2 3.47Å; R202-M220 HydrophobicContact CB-CE 4.26Å; R202-E239 IonicContact CZ-OE2 3.8Å; R202-E239 IonicContact NH1-OE2 2.69Å; R202-E239 PolarHBondContact NH1-OE2 2.83Å
203	R	88.5	Confident	80.8	Confident	4 Å²	4	39.1 Å²	39.1	2%	0.015	18%	0.183	C	C	.	.	H	α-helix	trans	-92.1	-46	-176.9	-68.7	171.7	158.3	73.6	6.7	113.1	Y199 F200 F201 M220 E224 R225 E239	Y199-R203 VanDerWaalsContact CZ-NH1 3.25Å; Y199-R203 WeakPolarHBondContact O-CG 3.34Å; Y199-R203 PolarHBondContact O-NH1 2.86Å; Y199-R203 VanDerWaalsContact OH-CZ 3.31Å; Y199-R203 PolarHBondContact OH-NH2 2.87Å; F200-R203 PolarHBondContact O-N 3.42Å; F200-R203 VanDerWaalsContact O-N 3.12Å; F201-R203 PolarHBondContact O-N 2.82Å; R203-M220 HydrophobicContact CG-CE 4.49Å; R203-M220 HydrophobicContact CG-SD 3.97Å; R203-E224 VanDerWaalsContact CZ-O 3.27Å; R203-E224 PolarHBondContact NE-O 3.22Å; R203-E224 PolarHBondContact NH2-O 2.8Å; R203-R225 HydrophobicContact CB-CG 4.22Å; R203-R225 WeakPolarHBondContact CD-O 3.06Å; R203-R225 WeakPolarHBondContact CG-O 3.03Å; R203-R225 PolarHBondContact NE-O 3.34Å; R203-R225 PolarHBondContact O-NH1 2.98Å; R203-E239 IonicContact CZ-OE1 2.7Å; R203-E239 VanDerWaalsContact CZ-OE1 3.25Å; R203-E239 IonicContact NH1-OE1 3.41Å; R203-E239 PolarHBondContact NH1-OE1 3.33Å; R203-E239 IonicContact NH1-OE2 2.94Å; R203-E239 IonicContact NH2-OE1 3.16Å; R203-E239 PolarHBondContact NH2-OE1 2.99Å
204	F	85.8	Confident	79	Confident	30 Å²	30	42.2 Å²	42.2	13%	0.132	20%	0.198	C	C	.	.	H	α-helix	trans	-125.4	-14.3	-167	-50	-58	0	0	0	113.7	F200 R225 Y226 V324 K325	F200-F204 HydrophobicContact CB-CD2 4.38Å; F200-F204 HydrophobicContact CD1-CD2 4.03Å; F200-F204 AromaticContact CD1-CE2 3.86Å; F200-F204 HydrophobicContact CD1-CE2 3.86Å; F200-F204 PolarHBondContact O-N 3.42Å; F204-R225 HydrophobicContact CE1-CG 4.13Å; F204-R225 WeakPolarHBondContact CZ-O 3.37Å; F204-Y226 HydrophobicContact CE1-CD1 4.14Å; F204-Y226 AromaticContact CE1-CE1 3.84Å; F204-Y226 HydrophobicContact CE1-CE1 3.84Å; F204-Y226 HydrophobicContact CZ-CD1 4.22Å; F204-Y226 HydrophobicContact CZ-CE1 4.34Å; F204-V324 HydrophobicContact CB-CG2 3.64Å; F204-V324 WeakPolarHBondContact O-CG2 3.3Å; F204-K325 HydrophobicContact CB-CB 4.29Å; F204-K325 HydrophobicContact CB-CD 4.36Å; F204-K325 HydrophobicContact CD1-CD 4.24Å; F204-K325 HydrophobicContact CD2-CB 3.75Å; F204-K325 HydrophobicContact CE2-CB 4.28Å; F204-K325 HydrophobicContact CG-CB 4.02Å; F204-K325 HydrophobicContact CG-CD 4.19Å
205	G	85.1	Confident	77	Confident	0 Å²	0	47.8 Å²	47.8	0%	0	23%	0.227	C	C	.	.			trans	83.6	-150.8	174.3	0	0	0	0	0	116.4	F201 H213 T323 V324	F201-G205 VanDerWaalsContact O-CA 3.3Å; F201-G205 WeakPolarHBondContact O-CA 3.46Å; F201-G205 PolarHBondContact O-N 2.98Å; G205-H213 WeakPolarHBondContact CA-CD2 3.37Å; G205-H213 WeakPolarHBondContact CA-CE1 3.23Å; G205-H213 VanDerWaalsContact CA-ND1 3.3Å; G205-H213 WeakPolarHBondContact CA-ND1 3.42Å; G205-H213 WeakPolarHBondContact CA-NE2 3.31Å; G205-T323 VanDerWaalsContact O-CA 3.3Å; G205-T323 WeakPolarHBondContact O-CA 3.48Å; G205-V324 PolarHBondContact O-N 3.37Å
206	D	83.7	Confident	75.3	Confident	0 Å²	0	54.2 Å²	54.2	0%	0	25%	0.25	C	S	.	.	B	Isolated β-bridge	trans	-123.1	174	170.3	63.9	0.2	0	0	0	110	R116 F201 R208 H213 V322	R116-D206 IonicContact CZ-OD2 2.66Å; R116-D206 IonicContact NH1-OD2 3.9Å; R116-D206 PolarHBondContact NH1-OD2 3.04Å; F201-D206 HydrophobicContact CE2-CB 4.28Å; D206-R208 PolarHBondContact O-N 2.88Å; D206-R208 IonicContact OD1-NE 3.25Å; D206-R208 IonicContact OD2-CZ 3.81Å; D206-R208 IonicContact OD2-NE 3.79Å; D206-R208 PolarHBondContact OD2-NE 3.4Å; D206-R208 IonicContact OD2-NH2 2.74Å; D206-R208 PolarHBondContact OD2-NH2 3.38Å; D206-H213 IonicContact OD1-NE2 2.63Å; D206-V322 WeakPolarHBondContact CA-O 3.03Å; D206-V322 WeakPolarHBondContact CB-O 3.38Å
207	W	78.4	Confident	73.9	Confident	73 Å²	73	54.5 Å²	54.5	28%	0.277	25%	0.253	S	S	.	.	S	Bend	trans	-63.1	-5.4	-175.6	-72.2	109.8	0	0	0	115.4	G209 M320 V324 T385 P388	W207-G209 PolarHBondContact O-N 3.22Å; W207-M320 PolarHBondContact N-O 3.39Å; W207-V324 HydrophobicContact CD2-CG1 3.57Å; W207-V324 VanDerWaalsContact CE2-CG1 3.44Å; W207-V324 HydrophobicContact CE3-CG1 4.13Å; W207-V324 HydrophobicContact CG-CG1 3.83Å; W207-V324 HydrophobicContact CH2-CG1 4.39Å; W207-V324 HydrophobicContact CZ2-CB 4.49Å; W207-V324 HydrophobicContact CZ2-CG1 3.85Å; W207-T385 HydrophobicContact CZ2-CG2 4.26Å; W207-P388 HydrophobicContact CE3-CG 4.47Å
208	R	71.7	Confident	72.7	Confident	81 Å²	81	59.4 Å²	59.4	31%	0.306	29%	0.285	S	S	.	.	S	Bend	trans	-81	30	179.4	-66.9	-178.7	-71.8	168.7	1.2	113.7	R116 D206 M320	R116-R208 VanDerWaalsContact CZ-NH2 3.27Å; D206-R208 PolarHBondContact O-N 2.88Å; D206-R208 IonicContact OD1-NE 3.25Å; D206-R208 IonicContact OD2-CZ 3.81Å; D206-R208 IonicContact OD2-NE 3.79Å; D206-R208 PolarHBondContact OD2-NE 3.4Å; D206-R208 IonicContact OD2-NH2 2.74Å; D206-R208 PolarHBondContact OD2-NH2 3.38Å; R208-M320 HydrophobicContact CG-CB 3.9Å
209	G	57.4	Low	71.9	Confident	23 Å²	23	62.6 Å²	62.6	24%	0.237	31%	0.311	C	S	.	.			trans	124.6	101.9	172.4	0	0	0	0	0	113.8	W207 Q211 N212	W207-G209 PolarHBondContact O-N 3.22Å; G209-Q211 PolarHBondContact O-N 2.81Å; G209-N212 PolarHBondContact O-N 3.31Å
210	E	51.4	Low	71.4	Confident	92 Å²	92	63.4 Å²	63.4	43%	0.43	32%	0.315	S	S	.	.	H	α-helix	trans	-60.6	-31.7	168.9	-64.4	-152.1	136.9	0	0	111.9	N212 K325	E210-N212 PolarHBondContact O-N 3.11Å; E210-K325 VanDerWaalsContact CD-NZ 3.3Å; E210-K325 VanDerWaalsContact OE1-CE 3.28Å; E210-K325 WeakPolarHBondContact OE1-CE 3.26Å; E210-K325 IonicContact OE1-NZ 2.8Å; E210-K325 PolarHBondContact OE1-NZ 3.49Å; E210-K325 IonicContact OE2-NZ 2.79Å; E210-K325 PolarHBondContact OE2-NZ 3.48Å; E210-K325 VanDerWaalsContact OE2-NZ 3.16Å
211	Q	50.4	Low	71.1	Confident	164 Å²	164	70.5 Å²	70.5	77%	0.766	34%	0.341	S	S	*	.	H	α-helix	trans	-70.6	-30.8	179.4	-60.3	-172	7	0	0	112.9	G209	G209-Q211 PolarHBondContact O-N 2.81Å
212	N	53.3	Low	70.9	Confident	76 Å²	76	74.7 Å²	74.7	41%	0.406	36%	0.361	S	S	.	.	H	α-helix	trans	-83.8	-16.7	-175	-78.3	-30.1	0	0	0	114.1	G209 E210 I215 R216	G209-N212 PolarHBondContact O-N 3.31Å; E210-N212 PolarHBondContact O-N 3.11Å; N212-I215 PolarHBondContact O-N 3.15Å; N212-R216 WeakPolarHBondContact O-CG 3.34Å; N212-R216 PolarHBondContact O-N 3.34Å
213	H	59.2	Low	70.9	Confident	7 Å²	7	76.3 Å²	76.3	3%	0.032	37%	0.373	C	S	.	.	H	α-helix	trans	-80	-28.2	-176	-99.5	-84	0	0	0	114.3	F201 G205 D206 I215 R216 T217	F201-H213 AromaticContact CE2-CE1 3.65Å; F201-H213 AromaticContact CE2-NE2 3.92Å; F201-H213 AromaticContact CZ-CE1 3.66Å; G205-H213 WeakPolarHBondContact CA-CD2 3.37Å; G205-H213 WeakPolarHBondContact CA-CE1 3.23Å; G205-H213 VanDerWaalsContact CA-ND1 3.3Å; G205-H213 WeakPolarHBondContact CA-ND1 3.42Å; G205-H213 WeakPolarHBondContact CA-NE2 3.31Å; D206-H213 IonicContact OD1-NE2 2.63Å; H213-I215 VanDerWaalsContact C-N 3.28Å; H213-I215 PolarHBondContact O-N 3.15Å; H213-R216 PolarHBondContact NE2-NH1 3.44Å; H213-R216 VanDerWaalsContact NE2-NH1 3.19Å; H213-R216 PolarHBondContact O-N 2.03Å; H213-T217 PolarHBondContact O-N 3.06Å; H213-T217 PolarHBondContact O-OG1 2.8Å
214	M	57.5	Low	70.9	Confident	113 Å²	113	80.3 Å²	80.3	56%	0.557	39%	0.392	S	S	*	.	H	α-helix	trans	-62.3	-39.3	168.7	-66.7	-175.3	-72.9	0	0	110.8	R216 T217	M214-R216 PolarHBondContact O-N 3.36Å; M214-T217 CarbonylContact O-C 3.36Å; M214-T217 PolarHBondContact O-N 3.36Å
215	I	55	Low	71	Confident	121 Å²	121	79.6 Å²	79.6	62%	0.621	39%	0.389	S	S	*	.	H	α-helix	trans	-66.2	-35.4	176.9	-56.9	173.6	0	0	0	111.8	N212 H213 T217 P218	N212-I215 PolarHBondContact O-N 3.15Å; H213-I215 VanDerWaalsContact C-N 3.28Å; H213-I215 PolarHBondContact O-N 3.15Å; I215-T217 VanDerWaalsContact C-N 3.34Å; I215-P218 WeakPolarHBondContact O-CD 3.46Å
216	R	60.9	Low	71.2	Confident	141 Å²	141	86.5 Å²	86.5	53%	0.532	42%	0.416	S	S	.	.	H	α-helix	trans	-76.2	-18.4	178.7	-72	175	177.3	168.3	2.6	114.2	N212 H213 M214 P218	N212-R216 WeakPolarHBondContact O-CG 3.34Å; N212-R216 PolarHBondContact O-N 3.34Å; H213-R216 PolarHBondContact NE2-NH1 3.44Å; H213-R216 VanDerWaalsContact NE2-NH1 3.19Å; H213-R216 PolarHBondContact O-N 2.03Å; M214-R216 PolarHBondContact O-N 3.36Å; R216-P218 VanDerWaalsContact C-CD 3.41Å
217	T	65.7	Low	71.7	Confident	26 Å²	26	87.6 Å²	87.6	16%	0.16	42%	0.421	C	S	.	.			trans	-129.2	57.3	178.7	52.2	0	0	0	0	111.2	R202 H213 M214 I215 S219 M220 R225	R202-T217 WeakPolarHBondContact O-CG2 3.47Å; H213-T217 PolarHBondContact O-N 3.06Å; H213-T217 PolarHBondContact O-OG1 2.8Å; M214-T217 CarbonylContact O-C 3.36Å; M214-T217 PolarHBondContact O-N 3.36Å; I215-T217 VanDerWaalsContact C-N 3.34Å; T217-S219 PolarHBondContact O-N 3.43Å; T217-S219 VanDerWaalsContact O-N 3.17Å; T217-M220 PolarHBondContact O-N 3.16Å; T217-M220 VanDerWaalsContact O-N 3.14Å; T217-R225 PolarHBondContact O-NH2 2.98Å; T217-R225 PolarHBondContact OG1-NH1 3.11Å; T217-R225 PolarHBondContact OG1-NH2 3.34Å
218	P	66.4	Low	72.4	Confident	110 Å²	110	87.5 Å²	87.5	71%	0.714	43%	0.426	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.2	-21.1	-170.5	30.2	-34.6	0	0	0	112.2	I215 R216	I215-P218 WeakPolarHBondContact O-CD 3.46Å; R216-P218 VanDerWaalsContact C-CD 3.41Å
219	S	76.8	Confident	73.5	Confident	111 Å²	111	83.7 Å²	83.7	78%	0.776	41%	0.412	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.4	-8.3	178.9	55.4	0	0	0	0	114.7	T217	T217-S219 PolarHBondContact O-N 3.43Å; T217-S219 VanDerWaalsContact O-N 3.17Å
220	M	83.1	Confident	75.4	Confident	19 Å²	19	84.2 Å²	84.2	9%	0.094	41%	0.409	C	S	.	.			trans	-82.5	119.4	-178.3	-177.6	175.5	-75	0	0	110.2	R202 R203 T217 E224 R225	R202-M220 HydrophobicContact CB-CE 4.26Å; R203-M220 HydrophobicContact CG-CE 4.49Å; R203-M220 HydrophobicContact CG-SD 3.97Å; T217-M220 PolarHBondContact O-N 3.16Å; T217-M220 VanDerWaalsContact O-N 3.14Å; M220-E224 HydrophobicContact CG-CB 3.94Å; M220-R225 HydrophobicContact CG-CB 4.22Å; M220-R225 HydrophobicContact SD-CB 4.05Å; M220-R225 HydrophobicContact SD-CG 4.34Å
221	R	86.3	Confident	77.5	Confident	156 Å²	156	84.2 Å²	84.2	59%	0.589	41%	0.409	S	S	*	.			trans	-67.8	157.9	178.3	-60.3	-175.6	-174.3	171.9	3	111.1	E223 E224 R225	R221-E223 HydrophobicContact CB-CG 3.81Å; R221-E223 VanDerWaalsContact CD-OE1 3.25Å; R221-E223 WeakPolarHBondContact CD-OE1 3.45Å; R221-E223 IonicContact NH1-OE1 3.22Å; R221-E223 PolarHBondContact NH1-OE1 2.95Å; R221-E223 PolarHBondContact O-N 3.27Å; R221-E224 HydrophobicContact CB-CB 4.46Å; R221-E224 HydrophobicContact CB-CG 4.18Å; R221-E224 PolarHBondContact N-OE2 2.93Å; R221-E224 PolarHBondContact O-N 3.1Å; R221-R225 WeakPolarHBondContact O-CB 3.35Å; R221-R225 PolarHBondContact O-N 3.45Å
222	Q	85.1	Confident	79.7	Confident	122 Å²	122	76.4 Å²	76.4	57%	0.57	37%	0.373	S	S	*	.	H	α-helix	trans	-60.3	-45.7	178.8	-167.3	71.5	-7.9	0	0	111.8	E224 R225 Y226	Q222-E224 VanDerWaalsContact C-N 3.32Å; Q222-E224 PolarHBondContact O-N 3.39Å; Q222-R225 WeakPolarHBondContact O-CB 3.35Å; Q222-R225 PolarHBondContact O-N 3.13Å; Q222-R225 VanDerWaalsContact O-N 3.09Å; Q222-Y226 VanDerWaalsContact CD-CE2 3.42Å; Q222-Y226 HydrophobicContact CG-CD2 4.09Å; Q222-Y226 HydrophobicContact CG-CE2 4.27Å; Q222-Y226 WeakPolarHBondContact O-CD2 3.4Å; Q222-Y226 PolarHBondContact O-N 2.86Å
223	E	86.8	Confident	81.8	Confident	134 Å²	134	72.8 Å²	72.8	63%	0.626	35%	0.353	S	S	*	.	H	α-helix	trans	-55.4	-43.1	173.4	34.3	179	-163.7	0	0	112.3	R221 L227	R221-E223 HydrophobicContact CB-CG 3.81Å; R221-E223 VanDerWaalsContact CD-OE1 3.25Å; R221-E223 WeakPolarHBondContact CD-OE1 3.45Å; R221-E223 IonicContact NH1-OE1 3.22Å; R221-E223 PolarHBondContact NH1-OE1 2.95Å; R221-E223 PolarHBondContact O-N 3.27Å; E223-L227 PolarHBondContact O-N 3.16Å
224	E	87.9	Confident	83.6	Confident	88 Å²	88	75.5 Å²	75.5	41%	0.411	37%	0.368	S	S	.	.	H	α-helix	trans	-67.4	-40	174	-65.5	177.2	174.5	0	0	112.2	R203 M220 R221 Q222 Y226 L227	R203-E224 VanDerWaalsContact CZ-O 3.27Å; R203-E224 PolarHBondContact NE-O 3.22Å; R203-E224 PolarHBondContact NH2-O 2.8Å; M220-E224 HydrophobicContact CG-CB 3.94Å; R221-E224 HydrophobicContact CB-CB 4.46Å; R221-E224 HydrophobicContact CB-CG 4.18Å; R221-E224 PolarHBondContact N-OE2 2.93Å; R221-E224 PolarHBondContact O-N 3.1Å; Q222-E224 VanDerWaalsContact C-N 3.32Å; Q222-E224 PolarHBondContact O-N 3.39Å; E224-Y226 VanDerWaalsContact C-N 3.33Å; E224-Y226 PolarHBondContact O-N 3.09Å; E224-L227 WeakPolarHBondContact O-CB 3.36Å; E224-L227 PolarHBondContact O-N 3.3Å
225	R	88.4	Confident	85.5	Confident	15 Å²	15	76.7 Å²	76.7	6%	0.057	37%	0.372	C	S	.	.	H	α-helix	trans	-63.8	-38.5	-176.6	-172.9	177.7	-58.2	-80.1	-5	112.1	R203 F204 T217 M220 R221 Q222	R203-R225 HydrophobicContact CB-CG 4.22Å; R203-R225 WeakPolarHBondContact CD-O 3.06Å; R203-R225 WeakPolarHBondContact CG-O 3.03Å; R203-R225 PolarHBondContact NE-O 3.34Å; R203-R225 PolarHBondContact O-NH1 2.98Å; F204-R225 HydrophobicContact CE1-CG 4.13Å; F204-R225 WeakPolarHBondContact CZ-O 3.37Å; T217-R225 PolarHBondContact O-NH2 2.98Å; T217-R225 PolarHBondContact OG1-NH1 3.11Å; T217-R225 PolarHBondContact OG1-NH2 3.34Å; M220-R225 HydrophobicContact CG-CB 4.22Å; M220-R225 HydrophobicContact SD-CB 4.05Å; M220-R225 HydrophobicContact SD-CG 4.34Å; R221-R225 WeakPolarHBondContact O-CB 3.35Å; R221-R225 PolarHBondContact O-N 3.45Å; Q222-R225 WeakPolarHBondContact O-CB 3.35Å; Q222-R225 PolarHBondContact O-N 3.13Å; Q222-R225 VanDerWaalsContact O-N 3.09Å
226	Y	90.5	Very high	87.5	Confident	145 Å²	145	74.9 Å²	74.9	57%	0.569	36%	0.364	S	S	*	.	T	Hydrogen-bonded Turn	trans	-104.4	9.2	-178.3	-65.5	-89.4	0	0	0	113.6	F204 Q222 E224 D228	F204-Y226 HydrophobicContact CE1-CD1 4.14Å; F204-Y226 AromaticContact CE1-CE1 3.84Å; F204-Y226 HydrophobicContact CE1-CE1 3.84Å; F204-Y226 HydrophobicContact CZ-CD1 4.22Å; F204-Y226 HydrophobicContact CZ-CE1 4.34Å; Q222-Y226 VanDerWaalsContact CD-CE2 3.42Å; Q222-Y226 HydrophobicContact CG-CD2 4.09Å; Q222-Y226 HydrophobicContact CG-CE2 4.27Å; Q222-Y226 WeakPolarHBondContact O-CD2 3.4Å; Q222-Y226 PolarHBondContact O-N 2.86Å; E224-Y226 VanDerWaalsContact C-N 3.33Å; E224-Y226 PolarHBondContact O-N 3.09Å; Y226-D228 PolarHBondContact O-N 3.09Å
227	L	92.6	Very high	89.1	Confident	23 Å²	23	72.5 Å²	72.5	12%	0.12	36%	0.355	C	S	.	.			trans	-50.9	125.7	173.3	-179.7	65.1	0	0	0	110.5	Y199 E223 E224 E231 C232 Y237	Y199-L227 PolarHBondContact OH-O 3.02Å; E223-L227 PolarHBondContact O-N 3.16Å; E224-L227 WeakPolarHBondContact O-CB 3.36Å; E224-L227 PolarHBondContact O-N 3.3Å; L227-E231 HydrophobicContact CD1-CB 4.32Å; L227-E231 HydrophobicContact CD1-CG 4.08Å; L227-C232 HydrophobicContact CD2-CB 3.76Å; L227-C232 HydrophobicContact CG-CB 4.18Å; L227-Y237 HydrophobicContact CD1-CE1 4.42Å; L227-Y237 HydrophobicContact CD2-CD1 3.84Å; L227-Y237 HydrophobicContact CD2-CE1 3.92Å; L227-Y237 HydrophobicContact CD2-CG 4.17Å
228	D	93.8	Very high	90.5	Very high	70 Å²	70	74.9 Å²	74.9	37%	0.374	37%	0.371	S	S	.	.			trans	-63.4	138.3	177.7	-178.2	61	0	0	0	110.3	Y226 N230 E231 C232	Y226-D228 PolarHBondContact O-N 3.09Å; D228-N230 VanDerWaalsContact C-N 3.26Å; D228-N230 PolarHBondContact O-N 3.28Å; D228-N230 WeakPolarHBondContact OD2-CA 3.26Å; D228-N230 WeakPolarHBondContact OD2-CB 3.37Å; D228-N230 PolarHBondContact OD2-N 2.84Å; D228-N230 PolarHBondContact OD2-ND2 3.11Å; D228-E231 HydrophobicContact CB-CB 4.14Å; D228-E231 PolarHBondContact O-N 3.39Å; D228-E231 PolarHBondContact OD2-N 3.06Å; D228-C232 PolarHBondContact O-N 3.24Å
229	I	95.3	Very high	91.7	Very high	1 Å²	1	71 Å²	71	1%	0.005	34%	0.344	C	S	.	.	H	α-helix	trans	-66	-32.3	-176.1	-174	55.7	0	0	0	111.7	F195 L196 Y199 F200 I233 P329	F195-I229 HydrophobicContact CE1-CD1 4.07Å; F195-I229 HydrophobicContact CZ-CD1 4.36Å; L196-I229 HydrophobicContact CD2-CD1 4.07Å; L196-I229 HydrophobicContact CD2-CG1 3.85Å; Y199-I229 HydrophobicContact CD1-CD1 3.74Å; Y199-I229 HydrophobicContact CD2-CD1 3.71Å; Y199-I229 HydrophobicContact CE1-CB 4.14Å; Y199-I229 HydrophobicContact CE1-CD1 3.73Å; Y199-I229 HydrophobicContact CE1-CG1 4.41Å; Y199-I229 HydrophobicContact CE2-CD1 3.68Å; Y199-I229 HydrophobicContact CG-CD1 3.73Å; F200-I229 HydrophobicContact CZ-CB 4.14Å; F200-I229 HydrophobicContact CZ-CG1 4.41Å; F200-I229 HydrophobicContact CZ-CG2 4.33Å; I229-I233 HydrophobicContact CD1-CD1 3.94Å; I229-I233 HydrophobicContact CD1-CG1 4.27Å; I229-I233 HydrophobicContact CG1-CD1 3.82Å; I229-I233 VanDerWaalsContact O-CD1 3.28Å; I229-I233 WeakPolarHBondContact O-CD1 3.33Å; I229-I233 WeakPolarHBondContact O-CG1 3.43Å; I229-I233 PolarHBondContact O-N 2.88Å; I229-I233 VanDerWaalsContact O-N 3.15Å; I229-P329 HydrophobicContact CG1-CB 4.45Å; I229-P329 HydrophobicContact CG1-CG 3.91Å; I229-P329 HydrophobicContact CG2-CB 4.26Å; I229-P329 HydrophobicContact CG2-CG 4.2Å
230	N	96.1	Very high	92.6	Very high	34 Å²	34	65.8 Å²	65.8	18%	0.182	31%	0.307	C	S	.	.	H	α-helix	trans	-70.6	-46.2	177.7	-54.7	-73.7	0	0	0	110.5	D228 C232 I233 L234 P329 S330	D228-N230 VanDerWaalsContact C-N 3.26Å; D228-N230 PolarHBondContact O-N 3.28Å; D228-N230 WeakPolarHBondContact OD2-CA 3.26Å; D228-N230 WeakPolarHBondContact OD2-CB 3.37Å; D228-N230 PolarHBondContact OD2-N 2.84Å; D228-N230 PolarHBondContact OD2-ND2 3.11Å; N230-C232 VanDerWaalsContact C-N 3.3Å; N230-C232 PolarHBondContact O-N 3.42Å; N230-I233 PolarHBondContact O-N 2.84Å; N230-I233 VanDerWaalsContact O-N 3.12Å; N230-L234 HydrophobicContact CB-CD1 4.13Å; N230-L234 VanDerWaalsContact O-CB 3.29Å; N230-L234 WeakPolarHBondContact O-CB 3.35Å; N230-L234 VanDerWaalsContact O-CG 3.23Å; N230-L234 WeakPolarHBondContact O-CG 3.33Å; N230-L234 PolarHBondContact O-N 2.84Å; N230-P329 WeakPolarHBondContact OD1-CA 3.28Å; N230-S330 WeakPolarHBondContact OD1-CB 3.07Å; N230-S330 PolarHBondContact OD1-N 3.02Å; N230-S330 PolarHBondContact OD1-OG 2.82Å
231	E	97.1	Very high	93.2	Very high	92 Å²	92	65.5 Å²	65.5	43%	0.43	31%	0.307	S	S	.	.	H	α-helix	trans	-54.7	-48.7	174.4	-174	180	177.4	0	0	110.6	L227 D228 I233 L234 E235 Y237	L227-E231 HydrophobicContact CD1-CB 4.32Å; L227-E231 HydrophobicContact CD1-CG 4.08Å; D228-E231 HydrophobicContact CB-CB 4.14Å; D228-E231 PolarHBondContact O-N 3.39Å; D228-E231 PolarHBondContact OD2-N 3.06Å; E231-I233 VanDerWaalsContact C-N 3.28Å; E231-I233 PolarHBondContact O-N 2.77Å; E231-L234 PolarHBondContact O-N 2.78Å; E231-E235 HydrophobicContact CG-CG 4.17Å; E231-E235 VanDerWaalsContact O-CB 3.24Å; E231-E235 WeakPolarHBondContact O-CB 3.19Å; E231-E235 WeakPolarHBondContact O-CG 3.43Å; E231-E235 PolarHBondContact O-N 2.85Å; E231-Y237 HydrophobicContact CG-CE2 4.36Å
232	C	96.8	Very high	93.5	Very high	0 Å²	0	61.1 Å²	61.1	0%	0	30%	0.295	C	S	.	.	H	α-helix	trans	-55.5	-42.6	177.5	-173.4	0	0	0	0	112.9	Y199 L227 D228 N230 N236 Y237 C240	Y199-C232 HydrophobicContact CE2-CB 4.14Å; L227-C232 HydrophobicContact CD2-CB 3.76Å; L227-C232 HydrophobicContact CG-CB 4.18Å; D228-C232 PolarHBondContact O-N 3.24Å; N230-C232 VanDerWaalsContact C-N 3.3Å; N230-C232 PolarHBondContact O-N 3.42Å; C232-N236 PolarHBondContact O-N 2.75Å; C232-Y237 WeakPolarHBondContact O-CB 3.42Å; C232-Y237 PolarHBondContact O-N 2.86Å; C232-C240 HydrophobicContact CB-CB 4.12Å; C232-C240 WeakPolarHBondContact CB-SG 3.34Å; C232-C240 WeakPolarHBondContact O-CB 3.4Å; C232-C240 WeakPolarHBondContact SG-CB 3.5Å; C232-C240 CovalentContact SG-SG 2.03Å; C232-C240 PolarHBondContact SG-SG 3.14Å
233	I	97.2	Very high	93.9	Very high	0 Å²	0	59 Å²	59	0%	0	29%	0.292	C	S	.	.	H	α-helix	trans	-76.5	-51.5	-176.9	-65.3	162.4	0	0	0	111.5	I229 N230 E231 N236 C240 P329 A333 I336 L337 R340	I229-I233 HydrophobicContact CD1-CD1 3.94Å; I229-I233 HydrophobicContact CD1-CG1 4.27Å; I229-I233 HydrophobicContact CG1-CD1 3.82Å; I229-I233 VanDerWaalsContact O-CD1 3.28Å; I229-I233 WeakPolarHBondContact O-CD1 3.33Å; I229-I233 WeakPolarHBondContact O-CG1 3.43Å; I229-I233 PolarHBondContact O-N 2.88Å; I229-I233 VanDerWaalsContact O-N 3.15Å; N230-I233 PolarHBondContact O-N 2.84Å; N230-I233 VanDerWaalsContact O-N 3.12Å; E231-I233 VanDerWaalsContact C-N 3.28Å; E231-I233 PolarHBondContact O-N 2.77Å; I233-N236 PolarHBondContact O-N 2.92Å; I233-C240 HydrophobicContact CG1-CB 4.11Å; I233-P329 HydrophobicContact CD1-CB 4.08Å; I233-P329 HydrophobicContact CD1-CG 4.22Å; I233-A333 HydrophobicContact CB-CB 4.07Å; I233-A333 HydrophobicContact CD1-CB 3.88Å; I233-A333 HydrophobicContact CG2-CB 3.87Å; I233-A333 WeakPolarHBondContact CG2-O 3.36Å; I233-I336 HydrophobicContact CG2-CB 4.17Å; I233-I336 HydrophobicContact CG2-CG2 3.93Å; I233-L337 HydrophobicContact CD1-CD1 3.54Å; I233-L337 HydrophobicContact CD1-CD2 4.33Å; I233-L337 HydrophobicContact CD1-CG 3.86Å; I233-L337 HydrophobicContact CG1-CD1 4.18Å; I233-L337 HydrophobicContact CG1-CD2 4.04Å; I233-L337 HydrophobicContact CG1-CG 4.08Å; I233-L337 HydrophobicContact CG2-CD2 4.18Å; I233-L337 HydrophobicContact CG2-CG 4Å; I233-R340 PolarHBondContact O-NH1 2.8Å; I233-R340 PolarHBondContact O-NH2 3.12Å
234	L	97.1	Very high	94.2	Very high	64 Å²	64	60 Å²	60	34%	0.335	29%	0.29	S	S	.	.	H	α-helix	trans	-65.4	-45.3	-174.3	-65.8	170.2	0	0	0	110.7	N230 E231 N236 E332 I336	N230-L234 HydrophobicContact CB-CD1 4.13Å; N230-L234 VanDerWaalsContact O-CB 3.29Å; N230-L234 WeakPolarHBondContact O-CB 3.35Å; N230-L234 VanDerWaalsContact O-CG 3.23Å; N230-L234 WeakPolarHBondContact O-CG 3.33Å; N230-L234 PolarHBondContact O-N 2.84Å; E231-L234 PolarHBondContact O-N 2.78Å; L234-N236 PolarHBondContact O-N 2.83Å; L234-E332 HydrophobicContact CD2-CG 4.05Å; L234-I336 HydrophobicContact CD2-CD1 3.58Å
235	E	96.7	Very high	94.5	Very high	138 Å²	138	55.9 Å²	55.9	65%	0.645	27%	0.271	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.6	6.9	178	-57.1	-56.7	143.7	0	0	113.3	E231 Y237	E231-E235 HydrophobicContact CG-CG 4.17Å; E231-E235 VanDerWaalsContact O-CB 3.24Å; E231-E235 WeakPolarHBondContact O-CB 3.19Å; E231-E235 WeakPolarHBondContact O-CG 3.43Å; E231-E235 PolarHBondContact O-N 2.85Å; E235-Y237 VanDerWaalsContact C-N 3.35Å; E235-Y237 HydrophobicContact CB-CD2 3.88Å; E235-Y237 HydrophobicContact CB-CE2 3.72Å; E235-Y237 PolarHBondContact O-N 2.8Å
236	N	96.1	Very high	94.9	Very high	84 Å²	84	55.7 Å²	55.7	45%	0.449	27%	0.27	S	S	.	.	T	Hydrogen-bonded Turn	trans	58.9	39	171.4	-167	50.7	0	0	0	114.4	C232 I233 L234 S241 R340	C232-N236 PolarHBondContact O-N 2.75Å; I233-N236 PolarHBondContact O-N 2.92Å; L234-N236 PolarHBondContact O-N 2.83Å; N236-S241 WeakPolarHBondContact OD1-CB 3.42Å; N236-R340 PolarHBondContact OD1-NH2 3.15Å
237	Y	96.3	Very high	95.2	Very high	90 Å²	90	51.8 Å²	51.8	35%	0.353	26%	0.255	S	S	.	.			trans	-55.3	144.8	176.1	-83.5	-109.9	0	0	0	111.1	L227 E231 C232 E235 E239 C240 S241	L227-Y237 HydrophobicContact CD1-CE1 4.42Å; L227-Y237 HydrophobicContact CD2-CD1 3.84Å; L227-Y237 HydrophobicContact CD2-CE1 3.92Å; L227-Y237 HydrophobicContact CD2-CG 4.17Å; E231-Y237 HydrophobicContact CG-CE2 4.36Å; C232-Y237 WeakPolarHBondContact O-CB 3.42Å; C232-Y237 PolarHBondContact O-N 2.86Å; E235-Y237 VanDerWaalsContact C-N 3.35Å; E235-Y237 HydrophobicContact CB-CD2 3.88Å; E235-Y237 HydrophobicContact CB-CE2 3.72Å; E235-Y237 PolarHBondContact O-N 2.8Å; Y237-E239 PolarHBondContact O-N 3.35Å; Y237-C240 CarbonylContact O-C 3.57Å; Y237-C240 WeakPolarHBondContact O-CA 3.19Å; Y237-C240 PolarHBondContact O-N 3.29Å; Y237-S241 PolarHBondContact O-N 2.81Å; Y237-S241 PolarHBondContact O-OG 3.47Å; Y237-S241 VanDerWaalsContact O-OG 3.07Å
238	P	93.8	Very high	95.5	Very high	77 Å²	77	50.8 Å²	50.8	50%	0.5	25%	0.25	S	C	.	.	T	Hydrogen-bonded Turn	trans	-55.2	-27.8	-172.7	-31	36.7	0	0	0	116	S241 R244	P238-S241 WeakPolarHBondContact CA-OG 3.32Å; P238-R244 WeakPolarHBondContact O-CB 3.39Å; P238-R244 WeakPolarHBondContact O-CD 3.37Å; P238-R244 VanDerWaalsContact O-CG 3.26Å; P238-R244 WeakPolarHBondContact O-CG 3.34Å
239	E	92.6	Very high	95.7	Very high	29 Å²	29	47.4 Å²	47.4	14%	0.136	23%	0.232	C	C	.	.	T	Hydrogen-bonded Turn	trans	-83.1	-19.1	175.9	64	171.9	-166.2	0	0	115.1	F195 Y199 R202 R203 Y237	F195-E239 WeakPolarHBondContact CE2-O 3.47Å; Y199-E239 VanDerWaalsContact CE2-OE1 3.26Å; Y199-E239 WeakPolarHBondContact CE2-OE1 3.21Å; R202-E239 IonicContact CZ-OE2 3.8Å; R202-E239 IonicContact NH1-OE2 2.69Å; R202-E239 PolarHBondContact NH1-OE2 2.83Å; R203-E239 IonicContact CZ-OE1 2.7Å; R203-E239 VanDerWaalsContact CZ-OE1 3.25Å; R203-E239 IonicContact NH1-OE1 3.41Å; R203-E239 PolarHBondContact NH1-OE1 3.33Å; R203-E239 IonicContact NH1-OE2 2.94Å; R203-E239 IonicContact NH2-OE1 3.16Å; R203-E239 PolarHBondContact NH2-OE1 2.99Å; Y237-E239 PolarHBondContact O-N 3.35Å
240	C	95.6	Very high	95.9	Very high	0 Å²	0	47.5 Å²	47.5	0%	0	23%	0.232	C	C	.	.	S	Bend	trans	-100.4	13.4	175.5	-67.5	0	0	0	0	112.1	F195 C232 I233 Y237 L245 R340	F195-C240 HydrophobicContact CZ-CB 4.28Å; C232-C240 HydrophobicContact CB-CB 4.12Å; C232-C240 WeakPolarHBondContact CB-SG 3.34Å; C232-C240 WeakPolarHBondContact O-CB 3.4Å; C232-C240 WeakPolarHBondContact SG-CB 3.5Å; C232-C240 CovalentContact SG-SG 2.03Å; C232-C240 PolarHBondContact SG-SG 3.14Å; I233-C240 HydrophobicContact CG1-CB 4.11Å; Y237-C240 CarbonylContact O-C 3.57Å; Y237-C240 WeakPolarHBondContact O-CA 3.19Å; Y237-C240 PolarHBondContact O-N 3.29Å; C240-L245 WeakPolarHBondContact O-CD1 3.36Å; C240-R340 PolarHBondContact O-NH1 3.23Å
241	S	95.8	Very high	96	Very high	13 Å²	13	46 Å²	46	9%	0.091	22%	0.224	C	C	.	.	S	Bend	trans	-137.4	165.8	-177.1	66.1	0	0	0	0	113.1	N236 Y237 P238 R244 L245	N236-S241 WeakPolarHBondContact OD1-CB 3.42Å; Y237-S241 PolarHBondContact O-N 2.81Å; Y237-S241 PolarHBondContact O-OG 3.47Å; Y237-S241 VanDerWaalsContact O-OG 3.07Å; P238-S241 WeakPolarHBondContact CA-OG 3.32Å; S241-R244 PolarHBondContact O-N 2.89Å; S241-L245 PolarHBondContact O-N 3.26Å
242	N	92.7	Very high	96.1	Very high	64 Å²	64	41.6 Å²	41.6	34%	0.342	20%	0.204	S	C	.	.	T	Hydrogen-bonded Turn	trans	-71.2	144.1	177.2	-78.7	-38.8	0	0	0	110.7	P262 R340	N242-P262 HydrophobicContact CB-CG 4.42Å; N242-R340 PolarHBondContact ND2-O 3.42Å
243	P	92.6	Very high	96.2	Very high	77 Å²	77	41.9 Å²	41.9	50%	0.5	21%	0.205	S	C	.	.	T	Hydrogen-bonded Turn	cis	-89.4	3.4	9	35	-36.4	0	0	0	114.7	L245 F246	P243-L245 VanDerWaalsContact C-N 3.31Å; P243-L245 PolarHBondContact O-N 3.28Å; P243-F246 WeakPolarHBondContact O-CB 3.41Å; P243-F246 PolarHBondContact O-N 3.35Å; P243-F246 VanDerWaalsContact O-N 3.16Å
244	R	93.1	Very high	96.2	Very high	155 Å²	155	42 Å²	42	59%	0.585	21%	0.206	S	C	*	.	T	Hydrogen-bonded Turn	trans	-72.1	-23	-173.4	-61.5	-161.2	-170	154.6	-1.7	114.1	P238 S241 F246	P238-R244 WeakPolarHBondContact O-CB 3.39Å; P238-R244 WeakPolarHBondContact O-CD 3.37Å; P238-R244 VanDerWaalsContact O-CG 3.26Å; P238-R244 WeakPolarHBondContact O-CG 3.34Å; S241-R244 PolarHBondContact O-N 2.89Å; R244-F246 VanDerWaalsContact C-N 3.29Å
245	L	95.3	Very high	96.2	Very high	2 Å²	2	40.3 Å²	40.3	1%	0.01	20%	0.197	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69.8	-27.1	171.9	-63.2	-180	0	0	0	112.8	F195 C240 S241 P243 Y247 L337 R340 M341	F195-L245 HydrophobicContact CD2-CD2 3.43Å; F195-L245 VanDerWaalsContact CD2-CD2 3.43Å; F195-L245 HydrophobicContact CE2-CD2 3.43Å; F195-L245 VanDerWaalsContact CE2-CD2 3.43Å; F195-L245 HydrophobicContact CG-CD2 4.02Å; F195-L245 HydrophobicContact CZ-CD2 4.01Å; C240-L245 WeakPolarHBondContact O-CD1 3.36Å; S241-L245 PolarHBondContact O-N 3.26Å; P243-L245 VanDerWaalsContact C-N 3.31Å; P243-L245 PolarHBondContact O-N 3.28Å; L245-Y247 PolarHBondContact O-N 3.34Å; L245-L337 HydrophobicContact CD1-CD2 3.92Å; L245-L337 HydrophobicContact CD2-CD2 4.29Å; L245-R340 HydrophobicContact CD1-CB 3.67Å; L245-R340 HydrophobicContact CD1-CG 4.44Å; L245-M341 HydrophobicContact CB-CE 4.34Å; L245-M341 HydrophobicContact CB-CG 4.02Å; L245-M341 HydrophobicContact CB-SD 4.43Å; L245-M341 HydrophobicContact CD1-CE 4.07Å; L245-M341 HydrophobicContact CD1-CG 4.13Å; L245-M341 HydrophobicContact CD2-CE 3.78Å; L245-M341 HydrophobicContact CG-CE 4.26Å
246	F	96.9	Very high	96.2	Very high	11 Å²	11	37.7 Å²	37.7	5%	0.048	18%	0.184	C	C	.	.			trans	-75	104.1	179.3	-170	-117.5	0	0	0	110.8	P243 R244 I249 P250 C259 E261 P262 A266 E344	P243-F246 WeakPolarHBondContact O-CB 3.41Å; P243-F246 PolarHBondContact O-N 3.35Å; P243-F246 VanDerWaalsContact O-N 3.16Å; R244-F246 VanDerWaalsContact C-N 3.29Å; F246-I249 HydrophobicContact CD2-CB 4.44Å; F246-I249 HydrophobicContact CD2-CD1 4.4Å; F246-I249 HydrophobicContact CE1-CG2 4.37Å; F246-I249 HydrophobicContact CE2-CB 3.55Å; F246-I249 HydrophobicContact CE2-CD1 3.54Å; F246-I249 HydrophobicContact CE2-CG1 4.13Å; F246-I249 HydrophobicContact CE2-CG2 3.76Å; F246-I249 HydrophobicContact CZ-CB 3.63Å; F246-I249 HydrophobicContact CZ-CD1 4.3Å; F246-I249 HydrophobicContact CZ-CG2 3.38Å; F246-P250 HydrophobicContact CD1-CG 3.59Å; F246-P250 HydrophobicContact CE1-CG 3.54Å; F246-P250 HydrophobicContact CG-CG 4.34Å; F246-P250 HydrophobicContact CZ-CG 4.26Å; F246-C259 WeakPolarHBondContact CE1-O 3.45Å; F246-E261 VanDerWaalsContact CE1-C 3.49Å; F246-E261 VanDerWaalsContact CE1-O 3.31Å; F246-E261 WeakPolarHBondContact CE1-O 3.27Å; F246-P262 HydrophobicContact CB-CB 4.34Å; F246-P262 HydrophobicContact CD2-CB 3.81Å; F246-P262 HydrophobicContact CE2-CB 4.1Å; F246-P262 HydrophobicContact CG-CB 4.01Å; F246-A266 HydrophobicContact CZ-CB 3.99Å; F246-E344 WeakPolarHBondContact CA-OE1 3.41Å; F246-E344 HydrophobicContact CD2-CG 4.27Å
247	Y	96.7	Very high	96.2	Very high	64 Å²	64	37.4 Å²	37.4	25%	0.251	19%	0.187	S	C	.	.			trans	-138.5	-42.9	-167.1	-166.6	-89.2	0	0	0	115.1	V110 R194 L245 Y251 E344	V110-Y247 HydrophobicContact CG1-CD1 4.02Å; V110-Y247 HydrophobicContact CG1-CE1 3.78Å; R194-Y247 VanDerWaalsContact CZ-CG 3.45Å; L245-Y247 PolarHBondContact O-N 3.34Å; Y247-Y251 HydrophobicContact CD1-CE2 4.29Å; Y247-Y251 AromaticContact CE1-CE2 3.77Å; Y247-Y251 HydrophobicContact CE1-CE2 3.77Å; Y247-Y251 AromaticContact CZ-CE2 3.89Å; Y247-Y251 VanDerWaalsContact O-CD2 3.3Å; Y247-Y251 WeakPolarHBondContact O-CD2 3.49Å; Y247-Y251 PolarHBondContact OH-OH 3.34Å; Y247-E344 PolarHBondContact N-OE1 3.22Å
248	I	98.3	Very high	96.2	Very high	1 Å²	1	40.8 Å²	40.8	1%	0.005	20%	0.199	C	C	.	.	H	α-helix	trans	-78.4	-52.6	-174.1	-55.1	172.2	0	0	0	109.7	V110 I188 R189 P191 Y251 F252 E344 F347	V110-I248 HydrophobicContact CG1-CG1 4.37Å; I188-I248 HydrophobicContact CB-CG2 4.15Å; I188-I248 HydrophobicContact CG2-CG2 3.66Å; R189-I248 WeakPolarHBondContact O-CD1 3.31Å; P191-I248 HydrophobicContact CG-CD1 4.35Å; I248-Y251 WeakPolarHBondContact O-CB 3.25Å; I248-Y251 PolarHBondContact O-N 3.41Å; I248-F252 HydrophobicContact CG2-CD2 4.23Å; I248-F252 HydrophobicContact CG2-CE2 3.83Å; I248-F252 WeakPolarHBondContact O-CD2 3.35Å; I248-E344 VanDerWaalsContact CB-OE2 3.27Å; I248-E344 WeakPolarHBondContact CB-OE2 3.28Å; I248-E344 PolarHBondContact N-OE1 2.97Å; I248-E344 PolarHBondContact N-OE2 3.01Å; I248-F347 HydrophobicContact CG2-CD1 4.12Å; I248-F347 HydrophobicContact CG2-CE1 4.02Å
249	I	98.7	Very high	96.3	Very high	0 Å²	0	37.2 Å²	37.2	0%	0	18%	0.176	C	C	.	.	H	α-helix	trans	-49.9	-45.4	-179.7	-73.3	161.7	0	0	0	113.7	F246 Y251 F252 C253 A266 L267 A270 Y343 E344 F347	F246-I249 HydrophobicContact CD2-CB 4.44Å; F246-I249 HydrophobicContact CD2-CD1 4.4Å; F246-I249 HydrophobicContact CE1-CG2 4.37Å; F246-I249 HydrophobicContact CE2-CB 3.55Å; F246-I249 HydrophobicContact CE2-CD1 3.54Å; F246-I249 HydrophobicContact CE2-CG1 4.13Å; F246-I249 HydrophobicContact CE2-CG2 3.76Å; F246-I249 HydrophobicContact CZ-CB 3.63Å; F246-I249 HydrophobicContact CZ-CD1 4.3Å; F246-I249 HydrophobicContact CZ-CG2 3.38Å; I249-Y251 PolarHBondContact O-N 3.23Å; I249-Y251 VanDerWaalsContact O-N 3.13Å; I249-F252 PolarHBondContact O-N 3.39Å; I249-C253 HydrophobicContact CG2-CB 4.24Å; I249-C253 WeakPolarHBondContact O-CB 3.22Å; I249-C253 PolarHBondContact O-N 3.2Å; I249-A266 HydrophobicContact CG2-CB 4.18Å; I249-A266 WeakPolarHBondContact CG2-O 3.38Å; I249-L267 HydrophobicContact CD1-CD1 3.95Å; I249-L267 HydrophobicContact CG1-CD1 4.45Å; I249-A270 HydrophobicContact CG2-CB 3.94Å; I249-Y343 WeakPolarHBondContact CD1-O 3.47Å; I249-E344 WeakPolarHBondContact CG1-OE2 3.22Å; I249-E344 PolarHBondContact N-OE2 3.04Å; I249-E344 VanDerWaalsContact N-OE2 3.11Å; I249-F347 HydrophobicContact CD1-CB 3.86Å; I249-F347 HydrophobicContact CD1-CG 4.46Å; I249-F347 HydrophobicContact CG1-CB 3.64Å; I249-F347 HydrophobicContact CG1-CD1 3.99Å; I249-F347 HydrophobicContact CG1-CD2 4.31Å; I249-F347 HydrophobicContact CG1-CG 3.71Å
250	P	98.3	Very high	96.4	Very high	2 Å²	2	42.4 Å²	42.4	1%	0.013	19%	0.194	C	C	.	.	H	α-helix	trans	-52.8	-33.9	176.6	-28.9	33.8	0	0	0	114.8	H170 F246 F252 G254	H170-P250 WeakPolarHBondContact CB-O 3.23Å; F246-P250 HydrophobicContact CD1-CG 3.59Å; F246-P250 HydrophobicContact CE1-CG 3.54Å; F246-P250 HydrophobicContact CG-CG 4.34Å; F246-P250 HydrophobicContact CZ-CG 4.26Å; P250-F252 PolarHBondContact O-N 3.08Å; P250-G254 PolarHBondContact O-N 3.2Å
251	Y	98.4	Very high	96.3	Very high	3 Å²	3	49 Å²	49	1%	0.012	23%	0.225	C	C	.	.	H	α-helix	trans	-65	-28.9	178.3	-86.2	-103.5	0	0	0	112.9	N108 R109 V110 T142 V169 H170 F171 Y247 I248 I249	N108-Y251 PolarHBondContact ND2-O 3.22Å; N108-Y251 VanDerWaalsContact ND2-O 3.09Å; N108-Y251 WeakPolarHBondContact O-CD1 3.48Å; R109-Y251 WeakPolarHBondContact O-CE1 3.17Å; V110-Y251 HydrophobicContact CG1-CD2 4.35Å; V110-Y251 HydrophobicContact CG1-CE2 4.44Å; V110-Y251 HydrophobicContact CG2-CD1 3.9Å; V110-Y251 HydrophobicContact CG2-CD2 4.3Å; V110-Y251 HydrophobicContact CG2-CG 3.76Å; T142-Y251 WeakPolarHBondContact CG2-OH 3.45Å; V169-Y251 WeakPolarHBondContact O-CD1 3.48Å; H170-Y251 AromaticContact CD2-CD2 3.86Å; F171-Y251 WeakPolarHBondContact CB-O 3.26Å; F171-Y251 PolarHBondContact N-O 3.26Å; Y247-Y251 HydrophobicContact CD1-CE2 4.29Å; Y247-Y251 AromaticContact CE1-CE2 3.77Å; Y247-Y251 HydrophobicContact CE1-CE2 3.77Å; Y247-Y251 AromaticContact CZ-CE2 3.89Å; Y247-Y251 VanDerWaalsContact O-CD2 3.3Å; Y247-Y251 WeakPolarHBondContact O-CD2 3.49Å; Y247-Y251 PolarHBondContact OH-OH 3.34Å; I248-Y251 WeakPolarHBondContact O-CB 3.25Å; I248-Y251 PolarHBondContact O-N 3.41Å; I249-Y251 PolarHBondContact O-N 3.23Å; I249-Y251 VanDerWaalsContact O-N 3.13Å
252	F	98.8	Very high	96.3	Very high	0 Å²	0	50.3 Å²	50.3	0%	0	23%	0.234	C	C	.	.	H	α-helix	trans	-98.5	-38.9	179.9	-64.6	-90.1	0	0	0	112	V110 N186 I188 I248 I249 P250 G254 A270 N273 V274 F278 V281 F347	V110-F252 HydrophobicContact CG2-CE2 4.1Å; N186-F252 HydrophobicContact CB-CE1 3.81Å; N186-F252 HydrophobicContact CB-CZ 3.7Å; I188-F252 HydrophobicContact CG2-CE2 3.49Å; I188-F252 VanDerWaalsContact CG2-CE2 3.49Å; I188-F252 HydrophobicContact CG2-CZ 3.49Å; I188-F252 VanDerWaalsContact CG2-CZ 3.49Å; I248-F252 HydrophobicContact CG2-CD2 4.23Å; I248-F252 HydrophobicContact CG2-CE2 3.83Å; I248-F252 WeakPolarHBondContact O-CD2 3.35Å; I249-F252 PolarHBondContact O-N 3.39Å; P250-F252 PolarHBondContact O-N 3.08Å; F252-G254 VanDerWaalsContact C-N 3.26Å; F252-G254 PolarHBondContact O-N 3.47Å; F252-A270 HydrophobicContact CB-CB 3.79Å; F252-N273 WeakPolarHBondContact O-CB 3.38Å; F252-N273 PolarHBondContact O-ND2 3.03Å; F252-V274 HydrophobicContact CB-CG2 4.37Å; F252-V274 HydrophobicContact CD1-CG2 3.49Å; F252-V274 VanDerWaalsContact CD1-CG2 3.49Å; F252-V274 HydrophobicContact CE1-CG2 4.08Å; F252-V274 HydrophobicContact CG-CG2 4.15Å; F252-F278 HydrophobicContact CD1-CD1 4.26Å; F252-F278 HydrophobicContact CD1-CD2 4.43Å; F252-F278 AromaticContact CD1-CE1 3.71Å; F252-F278 HydrophobicContact CD1-CE1 3.71Å; F252-F278 AromaticContact CD1-CE2 3.89Å; F252-F278 HydrophobicContact CD1-CE2 3.89Å; F252-F278 AromaticContact CD1-CZ 3.5Å; F252-F278 HydrophobicContact CD1-CZ 3.5Å; F252-F278 VanDerWaalsContact CD1-CZ 3.5Å; F252-F278 AromaticContact CE1-CD1 3.92Å; F252-F278 HydrophobicContact CE1-CD1 3.92Å; F252-F278 AromaticContact CE1-CE1 3.52Å; F252-F278 HydrophobicContact CE1-CE1 3.52Å; F252-F278 HydrophobicContact CE1-CE2 4.49Å; F252-F278 AromaticContact CE1-CZ 3.84Å; F252-F278 HydrophobicContact CE1-CZ 3.84Å; F252-F278 HydrophobicContact CG-CZ 4.47Å; F252-V281 HydrophobicContact CE1-CB 4.45Å; F252-V281 HydrophobicContact CE1-CG1 3.78Å; F252-V281 HydrophobicContact CE1-CG2 3.75Å; F252-V281 HydrophobicContact CZ-CG1 3.73Å; F252-F347 HydrophobicContact CB-CE1 4.48Å; F252-F347 HydrophobicContact CB-CE2 4.42Å; F252-F347 HydrophobicContact CB-CZ 3.79Å; F252-F347 HydrophobicContact CD1-CZ 4Å; F252-F347 AromaticContact CD2-CE1 3.47Å; F252-F347 HydrophobicContact CD2-CE1 3.47Å; F252-F347 VanDerWaalsContact CD2-CE1 3.47Å; F252-F347 AromaticContact CD2-CZ 3.55Å; F252-F347 HydrophobicContact CD2-CZ 3.55Å; F252-F347 HydrophobicContact CE1-CZ 4.49Å; F252-F347 AromaticContact CE2-CE1 3.75Å; F252-F347 HydrophobicContact CE2-CE1 3.75Å; F252-F347 HydrophobicContact CE2-CZ 4.1Å; F252-F347 AromaticContact CG-CE1 3.95Å; F252-F347 HydrophobicContact CG-CE1 3.95Å; F252-F347 AromaticContact CG-CZ 3.49Å; F252-F347 HydrophobicContact CG-CZ 3.49Å; F252-F347 VanDerWaalsContact CG-CZ 3.49Å; F252-F347 HydrophobicContact CZ-CE1 4.42Å
253	C	98.6	Very high	96.4	Very high	5 Å²	5	48.1 Å²	48.1	3%	0.034	23%	0.226	C	C	.	.	H	α-helix	trans	-60.6	-37.1	175.9	-177.1	0	0	0	0	111.6	I249 C259 A270 N273	I249-C253 HydrophobicContact CG2-CB 4.24Å; I249-C253 WeakPolarHBondContact O-CB 3.22Å; I249-C253 PolarHBondContact O-N 3.2Å; C253-C259 HydrophobicContact CB-CB 3.64Å; C253-C259 WeakPolarHBondContact CB-SG 3.37Å; C253-C259 PolarHBondContact O-SG 2.88Å; C253-C259 VanDerWaalsContact O-SG 3.36Å; C253-C259 VanDerWaalsContact SG-CA 3.58Å; C253-C259 WeakPolarHBondContact SG-CB 3.43Å; C253-C259 CovalentContact SG-SG 2.03Å; C253-C259 PolarHBondContact SG-SG 2.9Å; C253-A270 HydrophobicContact CB-CB 4.11Å; C253-N273 PolarHBondContact O-ND2 3.3Å; C253-N273 VanDerWaalsContact O-ND2 3.14Å
254	G	97.6	Very high	96.7	Very high	2 Å²	2	51 Å²	51	2%	0.021	23%	0.233	C	C	.	.			trans	101.9	-152.8	171.4	0	0	0	0	0	114.5	F171 P250 F252 H256	F171-G254 VanDerWaalsContact O-CA 3.3Å; F171-G254 WeakPolarHBondContact O-CA 3.49Å; P250-G254 PolarHBondContact O-N 3.2Å; F252-G254 VanDerWaalsContact C-N 3.26Å; F252-G254 PolarHBondContact O-N 3.47Å; G254-H256 VanDerWaalsContact C-N 3.35Å; G254-H256 PolarHBondContact O-N 3.19Å
255	Q	97.4	Very high	96.9	Very high	29 Å²	29	48 Å²	48	14%	0.136	22%	0.221	C	C	.	.	S	Bend	trans	-86.2	0.4	-170.5	-60	-66.3	-14	0	0	114.6	T142 Q149 H170 L172	T142-Q255 PolarHBondContact O-NE2 2.92Å; Q149-Q255 HydrophobicContact CG-CG 4.19Å; H170-Q255 PolarHBondContact O-NE2 3.09Å; H170-Q255 VanDerWaalsContact O-NE2 3.14Å; L172-Q255 HydrophobicContact CD2-CG 3.63Å
256	H	96.3	Very high	97.1	Very high	83 Å²	83	47.9 Å²	47.9	38%	0.384	22%	0.221	S	C	.	.			trans	-67.6	139.9	-177.4	-168.3	-88.2	0	0	0	111.4	G254 R258 C259 W265	G254-H256 VanDerWaalsContact C-N 3.35Å; G254-H256 PolarHBondContact O-N 3.19Å; H256-R258 VanDerWaalsContact C-N 3.27Å; H256-R258 WeakPolarHBondContact ND1-CB 3.5Å; H256-R258 PolarHBondContact ND1-N 3.4Å; H256-R258 VanDerWaalsContact ND1-N 3.15Å; H256-R258 PolarHBondContact O-N 3.03Å; H256-C259 VanDerWaalsContact O-CB 3.22Å; H256-C259 WeakPolarHBondContact O-CB 3.31Å; H256-C259 PolarHBondContact O-N 3.14Å; H256-W265 HydrophobicContact CB-CH2 4.03Å; H256-W265 HydrophobicContact CB-CZ3 4.43Å; H256-W265 AromaticContact CE1-CH2 3.93Å; H256-W265 AromaticContact CG-CH2 3.66Å; H256-W265 AromaticContact ND1-CH2 3.37Å; H256-W265 WeakPolarHBondContact ND1-CH2 3.4Å; H256-W265 AromaticContact ND1-CZ3 3.77Å
257	P	95.7	Very high	97.2	Very high	78 Å²	78	47.4 Å²	47.4	51%	0.506	22%	0.219	S	C	.	.	G	3₁₀ helix	trans	-56.2	-35.7	-179.4	-28.4	35.9	0	0	0	114.6	C259 R260	P257-C259 PolarHBondContact O-N 3.48Å; P257-R260 VanDerWaalsContact O-CB 3.26Å; P257-R260 WeakPolarHBondContact O-CB 3.47Å; P257-R260 WeakPolarHBondContact O-CD 3.24Å; P257-R260 WeakPolarHBondContact O-CG 3.33Å; P257-R260 PolarHBondContact O-N 3.5Å; P257-R260 VanDerWaalsContact O-N 3.08Å
258	R	96.3	Very high	97.2	Very high	161 Å²	161	48.6 Å²	48.6	61%	0.608	23%	0.227	S	C	*	.	G	3₁₀ helix	trans	-64.3	-15.7	174.6	-68.5	-178.6	174	-174.2	-3	114.3	H256 R260 W265	H256-R258 VanDerWaalsContact C-N 3.27Å; H256-R258 WeakPolarHBondContact ND1-CB 3.5Å; H256-R258 PolarHBondContact ND1-N 3.4Å; H256-R258 VanDerWaalsContact ND1-N 3.15Å; H256-R258 PolarHBondContact O-N 3.03Å; R258-R260 PolarHBondContact O-N 3.44Å; R258-W265 HydrophobicContact CB-CD2 4.04Å; R258-W265 HydrophobicContact CB-CE3 3.36Å; R258-W265 HydrophobicContact CB-CH2 4.08Å; R258-W265 HydrophobicContact CB-CZ3 3.41Å; R258-W265 VanDerWaalsContact CB-CZ3 3.41Å; R258-W265 HydrophobicContact CG-CE3 4.37Å
259	C	97.4	Very high	97.3	Very high	2 Å²	2	53.5 Å²	53.5	1%	0.014	25%	0.245	C	C	.	.	G	3₁₀ helix	trans	-77	-0.2	172.8	-57.5	0	0	0	0	113.1	F246 C253 H256 P257	F246-C259 WeakPolarHBondContact CE1-O 3.45Å; C253-C259 HydrophobicContact CB-CB 3.64Å; C253-C259 WeakPolarHBondContact CB-SG 3.37Å; C253-C259 PolarHBondContact O-SG 2.88Å; C253-C259 VanDerWaalsContact O-SG 3.36Å; C253-C259 VanDerWaalsContact SG-CA 3.58Å; C253-C259 WeakPolarHBondContact SG-CB 3.43Å; C253-C259 CovalentContact SG-SG 2.03Å; C253-C259 PolarHBondContact SG-SG 2.9Å; H256-C259 VanDerWaalsContact O-CB 3.22Å; H256-C259 WeakPolarHBondContact O-CB 3.31Å; H256-C259 PolarHBondContact O-N 3.14Å; P257-C259 PolarHBondContact O-N 3.48Å
260	R	94.1	Very high	97.3	Very high	138 Å²	138	53.5 Å²	53.5	52%	0.521	25%	0.245	S	C	.	.	G	3₁₀ helix	trans	-83.9	-21.8	-176.6	-65.3	175.4	-174.5	-172.1	2.5	113.3	P257 R258	P257-R260 VanDerWaalsContact O-CB 3.26Å; P257-R260 WeakPolarHBondContact O-CB 3.47Å; P257-R260 WeakPolarHBondContact O-CD 3.24Å; P257-R260 WeakPolarHBondContact O-CG 3.33Å; P257-R260 PolarHBondContact O-N 3.5Å; P257-R260 VanDerWaalsContact O-N 3.08Å; R258-R260 PolarHBondContact O-N 3.44Å
261	E	93.4	Very high	97.3	Very high	139 Å²	139	54.6 Å²	54.6	65%	0.65	25%	0.25	S	S	*	.	S	Bend	trans	-121.8	146.2	-174.5	-67.7	-177.5	176	0	0	110.5	F246 G263	F246-E261 VanDerWaalsContact CE1-C 3.49Å; F246-E261 VanDerWaalsContact CE1-O 3.31Å; F246-E261 WeakPolarHBondContact CE1-O 3.27Å; E261-G263 PolarHBondContact O-N 2.94Å
262	P	95.6	Very high	97.3	Very high	41 Å²	41	57.4 Å²	57.4	27%	0.266	27%	0.265	S	S	.	.			trans	-64.8	125.2	176.5	26	-32.6	0	0	0	110.5	N242 F246 Y343	N242-P262 HydrophobicContact CB-CG 4.42Å; F246-P262 HydrophobicContact CB-CB 4.34Å; F246-P262 HydrophobicContact CD2-CB 3.81Å; F246-P262 HydrophobicContact CE2-CB 4.1Å; F246-P262 HydrophobicContact CG-CB 4.01Å; P262-Y343 HydrophobicContact CB-CD2 3.94Å; P262-Y343 HydrophobicContact CB-CE2 4.37Å
263	G	95.9	Very high	97.3	Very high	18 Å²	18	57.8 Å²	57.8	19%	0.186	27%	0.267	C	S	.	.	S	Bend	trans	-175.5	159.8	179.1	0	0	0	0	0	112.2	E261 W265 A266 L267	E261-G263 PolarHBondContact O-N 2.94Å; G263-W265 VanDerWaalsContact C-N 3.28Å; G263-W265 PolarHBondContact O-N 2.94Å; G263-A266 PolarHBondContact O-N 3.28Å; G263-A266 VanDerWaalsContact O-N 3.11Å; G263-L267 PolarHBondContact O-N 3.32Å; G263-L267 VanDerWaalsContact O-N 3.15Å
264	E	97.5	Very high	97.3	Very high	138 Å²	138	58.1 Å²	58.1	65%	0.645	27%	0.269	S	S	*	.	H	α-helix	trans	-55.5	-42.3	-178.7	-174	174	-165	0	0	112.2	A266 L267 E268	E264-A266 VanDerWaalsContact C-N 3.32Å; E264-A266 PolarHBondContact O-N 2.91Å; E264-L267 WeakPolarHBondContact O-CB 3.37Å; E264-L267 PolarHBondContact O-N 3.31Å; E264-E268 HydrophobicContact CG-CG 4.38Å; E264-E268 WeakPolarHBondContact O-CG 3.3Å; E264-E268 PolarHBondContact O-N 3.35Å
265	W	98.2	Very high	97.3	Very high	90 Å²	90	62.8 Å²	62.8	34%	0.341	29%	0.293	S	S	.	.	H	α-helix	trans	-58.3	-42.4	177.8	-174.9	91.4	0	0	0	113	H256 R258 G263 R269	H256-W265 HydrophobicContact CB-CH2 4.03Å; H256-W265 HydrophobicContact CB-CZ3 4.43Å; H256-W265 AromaticContact CE1-CH2 3.93Å; H256-W265 AromaticContact CG-CH2 3.66Å; H256-W265 AromaticContact ND1-CH2 3.37Å; H256-W265 WeakPolarHBondContact ND1-CH2 3.4Å; H256-W265 AromaticContact ND1-CZ3 3.77Å; R258-W265 HydrophobicContact CB-CD2 4.04Å; R258-W265 HydrophobicContact CB-CE3 3.36Å; R258-W265 HydrophobicContact CB-CH2 4.08Å; R258-W265 HydrophobicContact CB-CZ3 3.41Å; R258-W265 VanDerWaalsContact CB-CZ3 3.41Å; R258-W265 HydrophobicContact CG-CE3 4.37Å; G263-W265 VanDerWaalsContact C-N 3.28Å; G263-W265 PolarHBondContact O-N 2.94Å; W265-R269 HydrophobicContact CE3-CB 4.46Å; W265-R269 HydrophobicContact CH2-CB 4.35Å; W265-R269 HydrophobicContact CH2-CG 4.16Å; W265-R269 HydrophobicContact CZ3-CB 4.24Å; W265-R269 HydrophobicContact CZ3-CG 4.36Å; W265-R269 VanDerWaalsContact O-CB 3.26Å; W265-R269 WeakPolarHBondContact O-CB 3.39Å; W265-R269 PolarHBondContact O-N 2.93Å
266	A	98.6	Very high	97.2	Very high	1 Å²	1	67.5 Å²	67.5	1%	0.008	32%	0.315	C	S	.	.	H	α-helix	trans	-71	-37.5	-178.7	0	0	0	0	0	111.3	F246 I249 G263 E264 A270	F246-A266 HydrophobicContact CZ-CB 3.99Å; I249-A266 HydrophobicContact CG2-CB 4.18Å; I249-A266 WeakPolarHBondContact CG2-O 3.38Å; G263-A266 PolarHBondContact O-N 3.28Å; G263-A266 VanDerWaalsContact O-N 3.11Å; E264-A266 VanDerWaalsContact C-N 3.32Å; E264-A266 PolarHBondContact O-N 2.91Å; A266-A270 WeakPolarHBondContact O-CB 3.47Å; A266-A270 PolarHBondContact O-N 3.14Å
267	L	98.6	Very high	97.2	Very high	1 Å²	1	64.8 Å²	64.8	1%	0.005	30%	0.303	C	S	.	.	H	α-helix	trans	-61.9	-53.7	174.3	173.4	61.2	0	0	0	111.6	I249 G263 E264 R269 A270 K271 Y343 E346 F347	I249-L267 HydrophobicContact CD1-CD1 3.95Å; I249-L267 HydrophobicContact CG1-CD1 4.45Å; G263-L267 PolarHBondContact O-N 3.32Å; G263-L267 VanDerWaalsContact O-N 3.15Å; E264-L267 WeakPolarHBondContact O-CB 3.37Å; E264-L267 PolarHBondContact O-N 3.31Å; L267-R269 VanDerWaalsContact C-N 3.34Å; L267-R269 PolarHBondContact O-N 3.44Å; L267-A270 WeakPolarHBondContact O-CB 3.22Å; L267-A270 PolarHBondContact O-N 2.99Å; L267-A270 VanDerWaalsContact O-N 3.11Å; L267-K271 HydrophobicContact CD1-CD 4.47Å; L267-K271 HydrophobicContact CD1-CG 4.39Å; L267-K271 HydrophobicContact CG-CD 4.48Å; L267-K271 WeakPolarHBondContact O-CG 3.47Å; L267-K271 PolarHBondContact O-N 3.37Å; L267-Y343 HydrophobicContact CD2-CD1 3.89Å; L267-E346 HydrophobicContact CD2-CB 4.1Å; L267-E346 HydrophobicContact CD2-CG 4.08Å; L267-E346 VanDerWaalsContact CD2-OE1 3.29Å; L267-E346 WeakPolarHBondContact CD2-OE1 3.45Å; L267-E346 WeakPolarHBondContact CD2-OE2 3.47Å; L267-F347 HydrophobicContact CD1-CB 3.57Å; L267-F347 HydrophobicContact CD1-CD2 4.04Å; L267-F347 HydrophobicContact CD1-CG 4.26Å
268	E	98.6	Very high	97.4	Very high	88 Å²	88	62 Å²	62	41%	0.411	28%	0.283	S	S	.	.	H	α-helix	trans	-64.8	-39.7	-178.4	-69	-51	121.5	0	0	111.8	E264 A270 K271 L272	E264-E268 HydrophobicContact CG-CG 4.38Å; E264-E268 WeakPolarHBondContact O-CG 3.3Å; E264-E268 PolarHBondContact O-N 3.35Å; E268-A270 VanDerWaalsContact C-N 3.3Å; E268-A270 PolarHBondContact O-N 2.85Å; E268-K271 PolarHBondContact O-N 3.3Å; E268-K271 IonicContact OE1-NZ 2.64Å; E268-K271 PolarHBondContact OE1-NZ 3.09Å; E268-L272 WeakPolarHBondContact O-CB 3.35Å; E268-L272 PolarHBondContact O-N 2.9Å
269	R	98.6	Very high	97.4	Very high	105 Å²	105	57.1 Å²	57.1	40%	0.396	27%	0.269	S	S	.	.	H	α-helix	trans	-61.8	-39	173.1	176.6	59	83.5	177.3	5.5	112	W265 L267 N273	W265-R269 HydrophobicContact CE3-CB 4.46Å; W265-R269 HydrophobicContact CH2-CB 4.35Å; W265-R269 HydrophobicContact CH2-CG 4.16Å; W265-R269 HydrophobicContact CZ3-CB 4.24Å; W265-R269 HydrophobicContact CZ3-CG 4.36Å; W265-R269 VanDerWaalsContact O-CB 3.26Å; W265-R269 WeakPolarHBondContact O-CB 3.39Å; W265-R269 PolarHBondContact O-N 2.93Å; L267-R269 VanDerWaalsContact C-N 3.34Å; L267-R269 PolarHBondContact O-N 3.44Å; R269-N273 PolarHBondContact O-N 3.12Å
270	A	98.8	Very high	97.4	Very high	0 Å²	0	57.3 Å²	57.3	0%	0	27%	0.27	C	S	.	.	H	α-helix	trans	-65	-46.1	175.7	0	0	0	0	0	112.1	I249 F252 C253 A266 L267 E268 L272 N273 V274 F347	I249-A270 HydrophobicContact CG2-CB 3.94Å; F252-A270 HydrophobicContact CB-CB 3.79Å; C253-A270 HydrophobicContact CB-CB 4.11Å; A266-A270 WeakPolarHBondContact O-CB 3.47Å; A266-A270 PolarHBondContact O-N 3.14Å; L267-A270 WeakPolarHBondContact O-CB 3.22Å; L267-A270 PolarHBondContact O-N 2.99Å; L267-A270 VanDerWaalsContact O-N 3.11Å; E268-A270 VanDerWaalsContact C-N 3.3Å; E268-A270 PolarHBondContact O-N 2.85Å; A270-L272 VanDerWaalsContact C-N 3.31Å; A270-L272 PolarHBondContact O-N 2.63Å; A270-N273 PolarHBondContact O-N 2.98Å; A270-V274 WeakPolarHBondContact O-CG2 3.25Å; A270-V274 PolarHBondContact O-N 2.9Å; A270-F347 HydrophobicContact CB-CD2 4.08Å; A270-F347 HydrophobicContact CB-CE2 3.69Å; A270-F347 HydrophobicContact CB-CZ 4.29Å
271	K	98.8	Very high	97.6	Very high	25 Å²	25	51.3 Å²	51.3	11%	0.109	25%	0.248	C	C	.	.	H	α-helix	trans	-57.7	-44.1	175.5	-67.4	176.8	-174.5	162.7	0	111.3	L267 E268 V274 N275 E346 F347 Y350	L267-K271 HydrophobicContact CD1-CD 4.47Å; L267-K271 HydrophobicContact CD1-CG 4.39Å; L267-K271 HydrophobicContact CG-CD 4.48Å; L267-K271 WeakPolarHBondContact O-CG 3.47Å; L267-K271 PolarHBondContact O-N 3.37Å; E268-K271 PolarHBondContact O-N 3.3Å; E268-K271 IonicContact OE1-NZ 2.64Å; E268-K271 PolarHBondContact OE1-NZ 3.09Å; K271-V274 WeakPolarHBondContact O-CB 3.49Å; K271-V274 PolarHBondContact O-N 3.33Å; K271-N275 PolarHBondContact O-N 3.43Å; K271-N275 VanDerWaalsContact O-N 3.13Å; K271-N275 PolarHBondContact O-ND2 3.43Å; K271-E346 IonicContact NZ-OE1 3.54Å; K271-E346 PolarHBondContact NZ-OE1 3.23Å; K271-F347 HydrophobicContact CG-CD2 4.17Å; K271-F347 HydrophobicContact CG-CE2 4.49Å; K271-Y350 HydrophobicContact CB-CD1 4.35Å; K271-Y350 HydrophobicContact CB-CE1 4.03Å; K271-Y350 HydrophobicContact CD-CD1 4.44Å; K271-Y350 HydrophobicContact CD-CD2 4.16Å; K271-Y350 HydrophobicContact CD-CE2 4.42Å; K271-Y350 HydrophobicContact CD-CG 4.16Å; K271-Y350 HydrophobicContact CG-CD1 3.83Å; K271-Y350 HydrophobicContact CG-CD2 4.41Å; K271-Y350 HydrophobicContact CG-CE1 4.02Å; K271-Y350 HydrophobicContact CG-CG 4.04Å
272	L	98.4	Very high	97.8	Very high	62 Å²	62	44.7 Å²	44.7	33%	0.325	22%	0.217	S	C	.	.	H	α-helix	trans	-62	-47.3	177	-179.7	139.3	0	0	0	112	E268 A270 V274 N275 E276	E268-L272 WeakPolarHBondContact O-CB 3.35Å; E268-L272 PolarHBondContact O-N 2.9Å; A270-L272 VanDerWaalsContact C-N 3.31Å; A270-L272 PolarHBondContact O-N 2.63Å; L272-V274 VanDerWaalsContact C-N 3.3Å; L272-V274 PolarHBondContact O-N 3.22Å; L272-N275 PolarHBondContact O-N 3.17Å; L272-N275 VanDerWaalsContact O-N 3.14Å; L272-E276 VanDerWaalsContact CD2-OE2 3.25Å; L272-E276 WeakPolarHBondContact CD2-OE2 3.29Å; L272-E276 HydrophobicContact CG-CG 4.45Å; L272-E276 WeakPolarHBondContact CG-OE1 3.37Å; L272-E276 WeakPolarHBondContact O-CG 3.43Å; L272-E276 PolarHBondContact O-N 3.15Å
273	N	98.5	Very high	97.9	Very high	8 Å²	8	42.7 Å²	42.7	4%	0.043	21%	0.205	C	C	.	.	H	α-helix	trans	-62	-39	177.9	-72.7	-15.6	0	0	0	112	F171 F252 C253 R269 A270 N275 E276 N277 F278	F171-N273 HydrophobicContact CD1-CB 4.42Å; F171-N273 WeakPolarHBondContact CD1-ND2 3.44Å; F171-N273 HydrophobicContact CE1-CB 4.42Å; F252-N273 WeakPolarHBondContact O-CB 3.38Å; F252-N273 PolarHBondContact O-ND2 3.03Å; C253-N273 PolarHBondContact O-ND2 3.3Å; C253-N273 VanDerWaalsContact O-ND2 3.14Å; R269-N273 PolarHBondContact O-N 3.12Å; A270-N273 PolarHBondContact O-N 2.98Å; N273-N275 VanDerWaalsContact C-N 3.32Å; N273-N275 PolarHBondContact O-N 3.47Å; N273-E276 PolarHBondContact O-N 3.09Å; N273-N277 WeakPolarHBondContact O-CB 3.19Å; N273-N277 PolarHBondContact O-N 3.34Å; N273-N277 PolarHBondContact O-ND2 2.86Å; N273-F278 WeakPolarHBondContact O-CD2 3.43Å
274	V	98.4	Very high	98	Very high	11 Å²	11	43.6 Å²	43.6	7%	0.067	21%	0.205	C	C	.	.	H	α-helix	trans	-55.6	-48	173.5	168.5	0	0	0	0	110.8	F252 A270 K271 L272 F278 V281 F347 Y350	F252-V274 HydrophobicContact CB-CG2 4.37Å; F252-V274 HydrophobicContact CD1-CG2 3.49Å; F252-V274 VanDerWaalsContact CD1-CG2 3.49Å; F252-V274 HydrophobicContact CE1-CG2 4.08Å; F252-V274 HydrophobicContact CG-CG2 4.15Å; A270-V274 WeakPolarHBondContact O-CG2 3.25Å; A270-V274 PolarHBondContact O-N 2.9Å; K271-V274 WeakPolarHBondContact O-CB 3.49Å; K271-V274 PolarHBondContact O-N 3.33Å; L272-V274 VanDerWaalsContact C-N 3.3Å; L272-V274 PolarHBondContact O-N 3.22Å; V274-F278 WeakPolarHBondContact O-CB 3.33Å; V274-F278 PolarHBondContact O-N 3.25Å; V274-V281 HydrophobicContact CG1-CG2 3.97Å; V274-V281 HydrophobicContact CG2-CG2 4.24Å; V274-F347 HydrophobicContact CG2-CE2 3.99Å; V274-F347 HydrophobicContact CG2-CZ 3.76Å; V274-Y350 HydrophobicContact CG1-CE1 4.5Å
275	N	97.3	Very high	97.9	Very high	100 Å²	100	41 Å²	41	54%	0.535	19%	0.193	S	C	.	.	H	α-helix	trans	-69.4	-37	-177.1	-65	-15.9	0	0	0	113.4	K271 L272 N273 Y350	K271-N275 PolarHBondContact O-N 3.43Å; K271-N275 VanDerWaalsContact O-N 3.13Å; K271-N275 PolarHBondContact O-ND2 3.43Å; L272-N275 PolarHBondContact O-N 3.17Å; L272-N275 VanDerWaalsContact O-N 3.14Å; N273-N275 VanDerWaalsContact C-N 3.32Å; N273-N275 PolarHBondContact O-N 3.47Å; N275-Y350 PolarHBondContact ND2-OH 3.2Å; N275-Y350 PolarHBondContact OD1-OH 2.96Å
276	E	96.3	Very high	97.8	Very high	129 Å²	129	38.7 Å²	38.7	60%	0.603	19%	0.186	S	C	*	.	H	α-helix	trans	-87.5	-31	-173.2	-70.4	177.6	177.2	0	0	113.4	L272 N273	L272-E276 VanDerWaalsContact CD2-OE2 3.25Å; L272-E276 WeakPolarHBondContact CD2-OE2 3.29Å; L272-E276 HydrophobicContact CG-CG 4.45Å; L272-E276 WeakPolarHBondContact CG-OE1 3.37Å; L272-E276 WeakPolarHBondContact O-CG 3.43Å; L272-E276 PolarHBondContact O-N 3.15Å; N273-E276 PolarHBondContact O-N 3.09Å
277	N	97	Very high	97.7	Very high	25 Å²	25	39.2 Å²	39.2	13%	0.134	19%	0.189	C	C	.	.	H	α-helix	trans	-125.1	-17.6	-165.5	-56.1	-88.6	0	0	0	114.5	F171 Y184 N273	F171-N277 HydrophobicContact CE2-CB 3.67Å; F171-N277 HydrophobicContact CZ-CB 3.85Å; Y184-N277 WeakPolarHBondContact CB-O 3.35Å; Y184-N277 PolarHBondContact N-O 2.78Å; N273-N277 WeakPolarHBondContact O-CB 3.19Å; N273-N277 PolarHBondContact O-N 3.34Å; N273-N277 PolarHBondContact O-ND2 2.86Å
278	F	98.2	Very high	97.5	Very high	20 Å²	20	43.4 Å²	43.4	9%	0.088	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.4	122.3	-177.7	-68.8	-109.4	0	0	0	110.7	F171 Y184 N186 F252 N273 V274 V281	F171-F278 AromaticContact CD2-CE2 3.81Å; F171-F278 HydrophobicContact CD2-CE2 3.81Å; F171-F278 HydrophobicContact CD2-CZ 4.06Å; F171-F278 HydrophobicContact CE2-CE2 4.26Å; F171-F278 HydrophobicContact CG-CE2 4.48Å; Y184-F278 VanDerWaalsContact CB-CD1 3.44Å; Y184-F278 AromaticContact CD1-CE1 3.92Å; Y184-F278 HydrophobicContact CD1-CE1 3.92Å; Y184-F278 HydrophobicContact CD1-CE2 4.47Å; Y184-F278 AromaticContact CD1-CZ 3.84Å; Y184-F278 HydrophobicContact CD1-CZ 3.84Å; Y184-F278 HydrophobicContact CG-CD1 4.47Å; Y184-F278 HydrophobicContact CG-CE1 4.17Å; Y184-F278 HydrophobicContact CG-CE2 4.43Å; Y184-F278 HydrophobicContact CG-CZ 4.16Å; Y184-F278 CarbonylContact O-C 3.55Å; Y184-F278 VanDerWaalsContact O-CA 3.28Å; Y184-F278 WeakPolarHBondContact O-CA 3.38Å; N186-F278 HydrophobicContact CB-CD1 4.18Å; N186-F278 HydrophobicContact CB-CE1 3.96Å; F252-F278 HydrophobicContact CD1-CD1 4.26Å; F252-F278 HydrophobicContact CD1-CD2 4.43Å; F252-F278 AromaticContact CD1-CE1 3.71Å; F252-F278 HydrophobicContact CD1-CE1 3.71Å; F252-F278 AromaticContact CD1-CE2 3.89Å; F252-F278 HydrophobicContact CD1-CE2 3.89Å; F252-F278 AromaticContact CD1-CZ 3.5Å; F252-F278 HydrophobicContact CD1-CZ 3.5Å; F252-F278 VanDerWaalsContact CD1-CZ 3.5Å; F252-F278 AromaticContact CE1-CD1 3.92Å; F252-F278 HydrophobicContact CE1-CD1 3.92Å; F252-F278 AromaticContact CE1-CE1 3.52Å; F252-F278 HydrophobicContact CE1-CE1 3.52Å; F252-F278 HydrophobicContact CE1-CE2 4.49Å; F252-F278 AromaticContact CE1-CZ 3.84Å; F252-F278 HydrophobicContact CE1-CZ 3.84Å; F252-F278 HydrophobicContact CG-CZ 4.47Å; N273-F278 WeakPolarHBondContact O-CD2 3.43Å; V274-F278 WeakPolarHBondContact O-CB 3.33Å; V274-F278 PolarHBondContact O-N 3.25Å; F278-V281 HydrophobicContact CB-CG2 3.67Å; F278-V281 HydrophobicContact CD1-CG2 3.65Å; F278-V281 HydrophobicContact CG-CG2 3.83Å
279	L	97.1	Very high	97.4	Very high	59 Å²	59	41 Å²	41	31%	0.309	20%	0.198	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-66.1	-41.3	172.7	177.3	63.8	0	0	0	111.4	V183 Y184 I185 F297 L298	V183-L279 HydrophobicContact CB-CB 4.27Å; V183-L279 HydrophobicContact CG2-CD2 4.34Å; Y184-L279 PolarHBondContact O-N 3.41Å; I185-L279 HydrophobicContact CG2-CB 4.27Å; L279-F297 HydrophobicContact CD2-CB 4.02Å; L279-F297 HydrophobicContact CG-CB 4.39Å; L279-L298 HydrophobicContact CD2-CD1 3.77Å; L279-L298 HydrophobicContact CD2-CD2 3.9Å; L279-L298 HydrophobicContact CD2-CG 3.69Å
280	L	97.4	Very high	97.3	Very high	6 Å²	6	36.1 Å²	36.1	3%	0.031	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.1	130.9	177.8	-179.1	64.3	0	0	0	110.7	I185 N186 V290 L293 L294 F297 F355 L358	I185-L280 CarbonylContact C-O 3.53Å; I185-L280 WeakPolarHBondContact CA-O 3.43Å; N186-L280 PolarHBondContact N-O 3.1Å; L280-V290 HydrophobicContact CD2-CG1 4.09Å; L280-L293 HydrophobicContact CD1-CD1 4.41Å; L280-L293 HydrophobicContact CD2-CB 3.95Å; L280-L294 HydrophobicContact CB-CD2 4.37Å; L280-L294 HydrophobicContact CD2-CD2 3.74Å; L280-L294 HydrophobicContact CD2-CG 3.78Å; L280-F297 HydrophobicContact CD1-CE2 4.44Å; L280-F297 HydrophobicContact CD2-CD2 4.49Å; L280-F355 HydrophobicContact CD1-CD2 3.99Å; L280-F355 HydrophobicContact CD1-CE2 4.34Å; L280-L358 HydrophobicContact CD1-CD2 3.55Å
281	V	98.6	Very high	97.3	Very high	11 Å²	11	36.1 Å²	36.1	7%	0.067	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	109	163.7	-170.3	0	0	0	0	108.3	N186 I188 F252 V274 F278 V351	N186-V281 HydrophobicContact CB-CG1 4.3Å; N186-V281 WeakPolarHBondContact O-CA 3.2Å; I188-V281 HydrophobicContact CG2-CG1 4.14Å; F252-V281 HydrophobicContact CE1-CB 4.45Å; F252-V281 HydrophobicContact CE1-CG1 3.78Å; F252-V281 HydrophobicContact CE1-CG2 3.75Å; F252-V281 HydrophobicContact CZ-CG1 3.73Å; V274-V281 HydrophobicContact CG1-CG2 3.97Å; V274-V281 HydrophobicContact CG2-CG2 4.24Å; F278-V281 HydrophobicContact CB-CG2 3.67Å; F278-V281 HydrophobicContact CD1-CG2 3.65Å; F278-V281 HydrophobicContact CG-CG2 3.83Å; V281-V351 HydrophobicContact CB-CG1 3.92Å; V281-V351 HydrophobicContact CG1-CG1 3.53Å; V281-V351 HydrophobicContact CG1-CG2 4.27Å
282	G	97.6	Very high	97.1	Very high	0 Å²	0	36.9 Å²	36.9	0%	0	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.8	171.3	179.7	0	0	0	0	0	113.2	N186 I187 I188	N186-G282 PolarHBondContact O-N 3.34Å; I187-G282 WeakPolarHBondContact CA-O 3.46Å; I188-G282 PolarHBondContact N-O 3.17Å
283	I	97.9	Very high	97	Very high	0 Å²	0	33.9 Å²	33.9	0%	0	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	140.4	170.4	70.5	178.4	0	0	0	110.2	I188 E285 E286 Y348 V351 K352 F355	I188-I283 HydrophobicContact CG1-CG2 4.18Å; I188-I283 CarbonylContact O-C 3.46Å; I188-I283 WeakPolarHBondContact O-CA 3.41Å; I283-E285 WeakPolarHBondContact CB-OE2 3.43Å; I283-E285 HydrophobicContact CD1-CB 4.45Å; I283-E285 PolarHBondContact O-N 3.33Å; I283-E286 HydrophobicContact CD1-CB 4.41Å; I283-E286 HydrophobicContact CD1-CG 4.1Å; I283-E286 WeakPolarHBondContact CD1-OE1 3.43Å; I283-E286 HydrophobicContact CG1-CB 3.98Å; I283-E286 HydrophobicContact CG1-CG 4.21Å; I283-E286 CarbonylContact O-C 3.34Å; I283-E286 PolarHBondContact O-N 2.8Å; I283-E286 VanDerWaalsContact O-N 3.15Å; I283-Y348 HydrophobicContact CB-CE2 4.3Å; I283-Y348 HydrophobicContact CG2-CE2 3.95Å; I283-V351 HydrophobicContact CG2-CG1 4.45Å; I283-K352 HydrophobicContact CD1-CD 3.95Å; I283-K352 HydrophobicContact CD1-CG 3.97Å; I283-K352 HydrophobicContact CG2-CB 4.26Å; I283-F355 HydrophobicContact CG1-CD1 4.2Å; I283-F355 HydrophobicContact CG1-CE1 4.24Å
284	L	96.7	Very high	96.9	Very high	36 Å²	36	33.8 Å²	33.8	19%	0.188	17%	0.169	C	C	.	.	G	3₁₀ helix	trans	-64.2	-31.6	-176.3	-178.1	64.6	0	0	0	111.9	I187 I188 R189 E286 L287	I187-L284 HydrophobicContact CG2-CB 4.19Å; I188-L284 WeakPolarHBondContact O-CB 3.37Å; I188-L284 PolarHBondContact O-N 3.13Å; R189-L284 HydrophobicContact CB-CB 4.09Å; R189-L284 HydrophobicContact CB-CD2 4.26Å; R189-L284 HydrophobicContact CG-CB 4.24Å; R189-L284 HydrophobicContact CG-CD2 3.97Å; L284-E286 PolarHBondContact O-N 2.87Å; L284-E286 VanDerWaalsContact O-N 3.13Å; L284-L287 HydrophobicContact CD1-CB 4.49Å; L284-L287 HydrophobicContact CD1-CD2 4.19Å; L284-L287 PolarHBondContact O-N 3.3Å
285	E	96.1	Very high	96.8	Very high	84 Å²	84	35.5 Å²	35.5	39%	0.393	18%	0.176	S	C	.	.	G	3₁₀ helix	trans	-61.5	-19.1	178.4	-62.1	77.5	-160.8	0	0	112.8	R189 D190 I283 Y348	R189-E285 WeakPolarHBondContact CG-OE1 3.38Å; D190-E285 WeakPolarHBondContact CB-OE1 3.34Å; D190-E285 PolarHBondContact N-OE1 3.48Å; I283-E285 WeakPolarHBondContact CB-OE2 3.43Å; I283-E285 HydrophobicContact CD1-CB 4.45Å; I283-E285 PolarHBondContact O-N 3.33Å; E285-Y348 VanDerWaalsContact CD-OH 3.29Å; E285-Y348 PolarHBondContact OE2-OH 3.4Å
286	E	96.2	Very high	96.6	Very high	42 Å²	42	36 Å²	36	20%	0.196	17%	0.17	C	C	.	.	G	3₁₀ helix	trans	-127	38.9	-179.5	-65.1	176.4	-134.4	0	0	111.1	I283 L284 E288 D289 V290 F355 H356 K359	I283-E286 HydrophobicContact CD1-CB 4.41Å; I283-E286 HydrophobicContact CD1-CG 4.1Å; I283-E286 WeakPolarHBondContact CD1-OE1 3.43Å; I283-E286 HydrophobicContact CG1-CB 3.98Å; I283-E286 HydrophobicContact CG1-CG 4.21Å; I283-E286 CarbonylContact O-C 3.34Å; I283-E286 PolarHBondContact O-N 2.8Å; I283-E286 VanDerWaalsContact O-N 3.15Å; L284-E286 PolarHBondContact O-N 2.87Å; L284-E286 VanDerWaalsContact O-N 3.13Å; E286-E288 VanDerWaalsContact C-N 3.29Å; E286-E288 PolarHBondContact O-N 3.29Å; E286-D289 PolarHBondContact O-N 3.3Å; E286-V290 PolarHBondContact O-N 3.32Å; E286-F355 HydrophobicContact CB-CE1 3.92Å; E286-H356 VanDerWaalsContact CD-NE2 3.31Å; E286-H356 IonicContact OE1-CD2 3.88Å; E286-H356 IonicContact OE1-CE1 3.42Å; E286-H356 PolarHBondContact OE1-CE1 2.89Å; E286-H356 IonicContact OE1-NE2 2.72Å; E286-H356 PolarHBondContact OE1-NE2 3.35Å; E286-H356 IonicContact OE2-CD2 3.65Å; E286-H356 IonicContact OE2-NE2 3.12Å; E286-H356 PolarHBondContact OE2-NE2 2.72Å; E286-H356 VanDerWaalsContact OE2-NE2 3.12Å; E286-K359 IonicContact OE2-NZ 2.56Å; E286-K359 PolarHBondContact OE2-NZ 2.94Å
287	L	95.6	Very high	96.6	Very high	12 Å²	12	31.3 Å²	31.3	6%	0.063	15%	0.148	C	C	.	.	H	α-helix	trans	-55.2	-37.4	-172.7	-177	61.4	0	0	0	113.8	V118 I187 L284 D289 V290 L291 Y309	V118-L287 HydrophobicContact CG2-CD1 4.3Å; I187-L287 HydrophobicContact CD1-CD1 3.67Å; L284-L287 HydrophobicContact CD1-CB 4.49Å; L284-L287 HydrophobicContact CD1-CD2 4.19Å; L284-L287 PolarHBondContact O-N 3.3Å; L287-D289 VanDerWaalsContact C-N 3.32Å; L287-D289 PolarHBondContact O-N 3.38Å; L287-V290 HydrophobicContact CD1-CB 4.48Å; L287-V290 WeakPolarHBondContact O-CB 3.44Å; L287-V290 PolarHBondContact O-N 3.19Å; L287-V290 VanDerWaalsContact O-N 3.17Å; L287-L291 HydrophobicContact CD1-CD2 4.43Å; L287-L291 HydrophobicContact CD1-CG 4.19Å; L287-L291 HydrophobicContact CG-CD1 4.18Å; L287-L291 HydrophobicContact CG-CG 4.23Å; L287-L291 VanDerWaalsContact O-CG 3.31Å; L287-L291 WeakPolarHBondContact O-CG 3.4Å; L287-L291 PolarHBondContact O-N 3.03Å; L287-Y309 HydrophobicContact CD2-CE2 3.91Å
288	E	95.4	Very high	96.5	Very high	88 Å²	88	30.1 Å²	30.1	41%	0.411	14%	0.142	S	C	.	.	H	α-helix	trans	-58.2	-43.9	176.8	-70.6	-167.8	-152	0	0	112.1	E286 V290 L291 L292 L306 Y309 K310	E286-E288 VanDerWaalsContact C-N 3.29Å; E286-E288 PolarHBondContact O-N 3.29Å; E288-V290 VanDerWaalsContact C-N 3.32Å; E288-V290 PolarHBondContact O-N 3.2Å; E288-L291 PolarHBondContact O-N 3.46Å; E288-L292 WeakPolarHBondContact O-CB 3.44Å; E288-L292 PolarHBondContact O-N 3.37Å; E288-L306 HydrophobicContact CB-CD2 4.26Å; E288-Y309 HydrophobicContact CG-CD1 4.08Å; E288-Y309 HydrophobicContact CG-CE1 3.66Å; E288-K310 WeakPolarHBondContact OE2-CE 3.17Å; E288-K310 IonicContact OE2-NZ 3.32Å; E288-K310 PolarHBondContact OE2-NZ 3.47Å
289	D	96.1	Very high	96.4	Very high	39 Å²	39	30.9 Å²	30.9	21%	0.209	15%	0.149	C	C	.	.	H	α-helix	trans	-68.7	-34.4	178.1	-70.3	-47.3	0	0	0	111.7	E286 L287 L292 L293 F355 K359	E286-D289 PolarHBondContact O-N 3.3Å; L287-D289 VanDerWaalsContact C-N 3.32Å; L287-D289 PolarHBondContact O-N 3.38Å; D289-L292 PolarHBondContact O-N 2.93Å; D289-L293 WeakPolarHBondContact O-CG 3.5Å; D289-L293 PolarHBondContact O-N 2.78Å; D289-F355 HydrophobicContact CB-CZ 3.91Å; D289-K359 HydrophobicContact CB-CD 4.12Å; D289-K359 VanDerWaalsContact OD2-CE 3.26Å; D289-K359 WeakPolarHBondContact OD2-CE 3.34Å; D289-K359 IonicContact OD2-NZ 2.64Å; D289-K359 PolarHBondContact OD2-NZ 3.19Å
290	V	97.5	Very high	96.3	Very high	1 Å²	1	30 Å²	30	1%	0.006	14%	0.143	C	C	.	.	H	α-helix	trans	-61.7	-49.5	173.4	-179.7	0	0	0	0	110.3	I187 L280 E286 L287 E288 L292 L293 L294 F355	I187-V290 HydrophobicContact CD1-CG1 4.07Å; I187-V290 HydrophobicContact CG1-CG1 4.02Å; L280-V290 HydrophobicContact CD2-CG1 4.09Å; E286-V290 PolarHBondContact O-N 3.32Å; L287-V290 HydrophobicContact CD1-CB 4.48Å; L287-V290 WeakPolarHBondContact O-CB 3.44Å; L287-V290 PolarHBondContact O-N 3.19Å; L287-V290 VanDerWaalsContact O-N 3.17Å; E288-V290 VanDerWaalsContact C-N 3.32Å; E288-V290 PolarHBondContact O-N 3.2Å; V290-L292 VanDerWaalsContact C-N 3.32Å; V290-L292 PolarHBondContact O-N 3.15Å; V290-L293 PolarHBondContact O-N 3.13Å; V290-L294 HydrophobicContact CG1-CD1 4.14Å; V290-L294 HydrophobicContact CG1-CG 4.48Å; V290-L294 WeakPolarHBondContact O-CG 3.39Å; V290-L294 PolarHBondContact O-N 3.27Å; V290-F355 HydrophobicContact CB-CE2 4.41Å; V290-F355 HydrophobicContact CB-CZ 4.4Å; V290-F355 HydrophobicContact CG2-CE1 4.27Å; V290-F355 HydrophobicContact CG2-CE2 3.68Å; V290-F355 HydrophobicContact CG2-CZ 3.48Å; V290-F355 VanDerWaalsContact CG2-CZ 3.48Å
291	L	97.3	Very high	96.2	Very high	1 Å²	1	29.8 Å²	29.8	1%	0.005	14%	0.142	C	C	.	.	H	α-helix	trans	-62.1	-40.1	179.7	-67.3	178.1	0	0	0	111.6	L121 L287 E288 L294 E295 V305 L306 Y309	L121-L291 HydrophobicContact CD1-CD1 3.82Å; L121-L291 HydrophobicContact CD1-CD2 3.98Å; L287-L291 HydrophobicContact CD1-CD2 4.43Å; L287-L291 HydrophobicContact CD1-CG 4.19Å; L287-L291 HydrophobicContact CG-CD1 4.18Å; L287-L291 HydrophobicContact CG-CG 4.23Å; L287-L291 VanDerWaalsContact O-CG 3.31Å; L287-L291 WeakPolarHBondContact O-CG 3.4Å; L287-L291 PolarHBondContact O-N 3.03Å; E288-L291 PolarHBondContact O-N 3.46Å; L291-L294 PolarHBondContact O-N 3.02Å; L291-E295 PolarHBondContact O-N 3.46Å; L291-V305 HydrophobicContact CB-CG1 3.88Å; L291-V305 HydrophobicContact CB-CG2 4.39Å; L291-V305 HydrophobicContact CD1-CG2 4.27Å; L291-V305 HydrophobicContact CD2-CG2 3.87Å; L291-V305 HydrophobicContact CG-CG2 4.39Å; L291-V305 WeakPolarHBondContact O-CG1 3.41Å; L291-L306 HydrophobicContact CB-CD2 3.93Å; L291-L306 HydrophobicContact CD1-CD2 4.39Å; L291-Y309 HydrophobicContact CD1-CD1 4.05Å; L291-Y309 HydrophobicContact CD1-CD2 4.03Å; L291-Y309 HydrophobicContact CD1-CG 3.69Å
292	L	95.9	Very high	96.2	Very high	40 Å²	40	29.3 Å²	29.3	21%	0.209	14%	0.139	C	C	.	.	H	α-helix	trans	-63.2	-41.4	175.8	-175.5	57.6	0	0	0	112.7	E288 D289 V290 E295 R296 L306 L364	E288-L292 WeakPolarHBondContact O-CB 3.44Å; E288-L292 PolarHBondContact O-N 3.37Å; D289-L292 PolarHBondContact O-N 2.93Å; V290-L292 VanDerWaalsContact C-N 3.32Å; V290-L292 PolarHBondContact O-N 3.15Å; L292-E295 PolarHBondContact O-N 2.94Å; L292-R296 WeakPolarHBondContact O-CG 3.28Å; L292-R296 PolarHBondContact O-N 3.02Å; L292-L306 HydrophobicContact CB-CD1 4.1Å; L292-L306 HydrophobicContact CD1-CD1 3.94Å; L292-L306 HydrophobicContact CG-CD1 4.46Å; L292-L364 HydrophobicContact CD2-CD1 4.01Å; L292-L364 HydrophobicContact CD2-CD2 3.43Å; L292-L364 VanDerWaalsContact CD2-CD2 3.43Å; L292-L364 HydrophobicContact CD2-CG 4.39Å; L292-L364 HydrophobicContact CG-CD1 4.44Å; L292-L364 HydrophobicContact CG-CD2 4.4Å
293	L	95.9	Very high	96.2	Very high	0 Å²	0	35.7 Å²	35.7	0%	0	17%	0.167	C	C	.	.	H	α-helix	trans	-69.1	-38.8	175.9	-74.2	179.8	0	0	0	111.7	L280 D289 V290 E295 R296 F297 F355 L358 K359 F362 L364	L280-L293 HydrophobicContact CD1-CD1 4.41Å; L280-L293 HydrophobicContact CD2-CB 3.95Å; D289-L293 WeakPolarHBondContact O-CG 3.5Å; D289-L293 PolarHBondContact O-N 2.78Å; V290-L293 PolarHBondContact O-N 3.13Å; L293-E295 VanDerWaalsContact C-N 3.32Å; L293-E295 PolarHBondContact O-N 2.75Å; L293-R296 PolarHBondContact O-N 3.02Å; L293-R296 VanDerWaalsContact O-N 3.11Å; L293-F297 HydrophobicContact CB-CD2 4.33Å; L293-F297 HydrophobicContact CB-CE2 3.92Å; L293-F297 HydrophobicContact CD2-CE2 4.38Å; L293-F297 HydrophobicContact CD2-CZ 4.3Å; L293-F297 WeakPolarHBondContact O-CD2 3.48Å; L293-F297 WeakPolarHBondContact O-CG 3.28Å; L293-F297 PolarHBondContact O-N 3.15Å; L293-F355 HydrophobicContact CD1-CD2 4.27Å; L293-F355 HydrophobicContact CD1-CE2 3.76Å; L293-L358 HydrophobicContact CD1-CD2 4.23Å; L293-L358 HydrophobicContact CD1-CG 4.31Å; L293-K359 HydrophobicContact CD1-CG 4.01Å; L293-F362 HydrophobicContact CD2-CB 3.88Å; L293-F362 HydrophobicContact CD2-CD2 4.3Å; L293-F362 HydrophobicContact CD2-CG 4.02Å; L293-L364 HydrophobicContact CD1-CD1 4.4Å; L293-L364 HydrophobicContact CD2-CD1 3.69Å; L293-L364 HydrophobicContact CG-CD1 3.79Å
294	L	97.4	Very high	96.1	Very high	5 Å²	5	36.5 Å²	36.5	3%	0.026	18%	0.175	C	C	.	.	H	α-helix	trans	-60.8	-41.3	173.2	-71.8	173.4	0	0	0	111.7	I185 L280 V290 L291 R296 F297 L298 F302	I185-L294 HydrophobicContact CB-CD2 4.35Å; I185-L294 HydrophobicContact CD1-CD2 4.12Å; I185-L294 HydrophobicContact CG2-CD2 3.91Å; L280-L294 HydrophobicContact CB-CD2 4.37Å; L280-L294 HydrophobicContact CD2-CD2 3.74Å; L280-L294 HydrophobicContact CD2-CG 3.78Å; V290-L294 HydrophobicContact CG1-CD1 4.14Å; V290-L294 HydrophobicContact CG1-CG 4.48Å; V290-L294 WeakPolarHBondContact O-CG 3.39Å; V290-L294 PolarHBondContact O-N 3.27Å; L291-L294 PolarHBondContact O-N 3.02Å; L294-R296 VanDerWaalsContact C-N 3.25Å; L294-R296 PolarHBondContact O-N 3.22Å; L294-F297 PolarHBondContact O-N 3.26Å; L294-L298 CarbonylContact O-C 3.51Å; L294-L298 WeakPolarHBondContact O-CA 3.29Å; L294-L298 WeakPolarHBondContact O-CB 3.39Å; L294-L298 PolarHBondContact O-N 3.39Å; L294-F302 HydrophobicContact CB-CB 4.25Å; L294-F302 HydrophobicContact CB-CD1 4.01Å; L294-F302 HydrophobicContact CB-CD2 3.88Å; L294-F302 HydrophobicContact CB-CE1 4.31Å; L294-F302 HydrophobicContact CB-CE2 4.21Å; L294-F302 HydrophobicContact CB-CG 3.78Å; L294-F302 HydrophobicContact CB-CZ 4.41Å; L294-F302 HydrophobicContact CD1-CD1 4.29Å; L294-F302 HydrophobicContact CD1-CE1 3.85Å; L294-F302 HydrophobicContact CD1-CE2 4.47Å; L294-F302 HydrophobicContact CD1-CZ 3.95Å; L294-F302 HydrophobicContact CD2-CE2 4.34Å
295	E	95.9	Very high	96.1	Very high	48 Å²	48	34.8 Å²	34.8	22%	0.224	17%	0.166	C	C	.	.	H	α-helix	trans	-58.6	-36.6	173.2	176.1	164.5	-158.4	0	0	112.5	L291 L292 L293 P299 F302 K303 G304 V305	L291-E295 PolarHBondContact O-N 3.46Å; L292-E295 PolarHBondContact O-N 2.94Å; L293-E295 VanDerWaalsContact C-N 3.32Å; L293-E295 PolarHBondContact O-N 2.75Å; E295-P299 WeakPolarHBondContact O-CA 3.41Å; E295-P299 WeakPolarHBondContact O-CB 3.46Å; E295-F302 HydrophobicContact CB-CB 4.24Å; E295-K303 WeakPolarHBondContact OE1-CA 3.42Å; E295-G304 PolarHBondContact OE1-N 2.92Å; E295-V305 HydrophobicContact CB-CG1 4.17Å
296	R	93.6	Very high	96.1	Very high	109 Å²	109	32.5 Å²	32.5	41%	0.411	16%	0.156	S	C	.	.	H	α-helix	trans	-75.9	-38.9	177.4	-68.7	-179.8	-177.5	-169.6	1.8	113.3	L292 L293 L294 F362	L292-R296 WeakPolarHBondContact O-CG 3.28Å; L292-R296 PolarHBondContact O-N 3.02Å; L293-R296 PolarHBondContact O-N 3.02Å; L293-R296 VanDerWaalsContact O-N 3.11Å; L294-R296 VanDerWaalsContact C-N 3.25Å; L294-R296 PolarHBondContact O-N 3.22Å; R296-F362 PolarHBondContact NH1-O 3.18Å
297	F	94.7	Very high	96	Very high	32 Å²	32	34.1 Å²	34.1	14%	0.14	17%	0.172	C	C	.	.	H	α-helix	trans	-83.1	-29.2	-177.6	-61.8	-40	0	0	0	113.8	F101 L279 L280 L293 L294 P299 L358 F362	F101-F297 WeakPolarHBondContact CD1-O 3.38Å; L279-F297 HydrophobicContact CD2-CB 4.02Å; L279-F297 HydrophobicContact CG-CB 4.39Å; L280-F297 HydrophobicContact CD1-CE2 4.44Å; L280-F297 HydrophobicContact CD2-CD2 4.49Å; L293-F297 HydrophobicContact CB-CD2 4.33Å; L293-F297 HydrophobicContact CB-CE2 3.92Å; L293-F297 HydrophobicContact CD2-CE2 4.38Å; L293-F297 HydrophobicContact CD2-CZ 4.3Å; L293-F297 WeakPolarHBondContact O-CD2 3.48Å; L293-F297 WeakPolarHBondContact O-CG 3.28Å; L293-F297 PolarHBondContact O-N 3.15Å; L294-F297 PolarHBondContact O-N 3.26Å; F297-P299 VanDerWaalsContact C-CD 3.5Å; F297-L358 HydrophobicContact CE2-CD2 3.65Å; F297-L358 HydrophobicContact CE2-CG 4.33Å; F297-L358 HydrophobicContact CZ-CD1 3.95Å; F297-L358 HydrophobicContact CZ-CD2 3.75Å; F297-L358 HydrophobicContact CZ-CG 3.96Å; F297-F362 HydrophobicContact CD1-CZ 4.45Å; F297-F362 HydrophobicContact CE1-CD2 4.34Å; F297-F362 AromaticContact CE1-CE1 3.89Å; F297-F362 HydrophobicContact CE1-CE1 3.89Å; F297-F362 AromaticContact CE1-CE2 3.59Å; F297-F362 HydrophobicContact CE1-CE2 3.59Å; F297-F362 AromaticContact CE1-CZ 3.36Å; F297-F362 HydrophobicContact CE1-CZ 3.36Å; F297-F362 HydrophobicContact CZ-CD2 4.07Å; F297-F362 AromaticContact CZ-CE2 3.63Å; F297-F362 HydrophobicContact CZ-CE2 3.63Å; F297-F362 AromaticContact CZ-CZ 3.9Å; F297-F362 HydrophobicContact CZ-CZ 3.9Å
298	L	96.6	Very high	96	Very high	0 Å²	0	34.5 Å²	34.5	0%	0	17%	0.174	C	C	.	.			trans	-137	58.6	-172.4	-68.7	177.7	0	0	0	109.8	P102 V105 I185 L279 L294 H300 Y301 F302	P102-L298 HydrophobicContact CB-CD2 4.28Å; P102-L298 HydrophobicContact CG-CD2 4.28Å; V105-L298 HydrophobicContact CG1-CD1 4.16Å; V105-L298 HydrophobicContact CG2-CD1 3.88Å; V105-L298 HydrophobicContact CG2-CD2 4.12Å; I185-L298 HydrophobicContact CG2-CD1 4.26Å; L279-L298 HydrophobicContact CD2-CD1 3.77Å; L279-L298 HydrophobicContact CD2-CD2 3.9Å; L279-L298 HydrophobicContact CD2-CG 3.69Å; L294-L298 CarbonylContact O-C 3.51Å; L294-L298 WeakPolarHBondContact O-CA 3.29Å; L294-L298 WeakPolarHBondContact O-CB 3.39Å; L294-L298 PolarHBondContact O-N 3.39Å; L298-H300 PolarHBondContact O-N 3.44Å; L298-Y301 HydrophobicContact CB-CD2 3.99Å; L298-Y301 HydrophobicContact CD1-CD2 4.5Å; L298-Y301 HydrophobicContact CD2-CD2 4.21Å; L298-Y301 HydrophobicContact CD2-CE2 4.36Å; L298-Y301 HydrophobicContact CG-CD2 4.46Å; L298-Y301 PolarHBondContact O-N 3.41Å; L298-F302 HydrophobicContact CB-CD2 3.74Å; L298-F302 HydrophobicContact CB-CE2 4.17Å; L298-F302 HydrophobicContact CD1-CD2 4.37Å; L298-F302 HydrophobicContact CD1-CE2 3.96Å; L298-F302 PolarHBondContact O-N 3.26Å
299	P	95.3	Very high	96	Very high	36 Å²	36	33.2 Å²	33.2	23%	0.234	17%	0.166	C	C	.	.	H	α-helix	trans	-62.2	-31.1	-171.9	23.2	-34	0	0	0	113.3	F101 E295 F297 Y301 K303	F101-P299 HydrophobicContact CD1-CG 4.29Å; F101-P299 HydrophobicContact CD2-CG 3.62Å; F101-P299 HydrophobicContact CE1-CG 4.05Å; F101-P299 HydrophobicContact CE2-CG 3.37Å; F101-P299 HydrophobicContact CG-CG 4.09Å; F101-P299 HydrophobicContact CZ-CG 3.6Å; E295-P299 WeakPolarHBondContact O-CA 3.41Å; E295-P299 WeakPolarHBondContact O-CB 3.46Å; F297-P299 VanDerWaalsContact C-CD 3.5Å; P299-Y301 PolarHBondContact O-N 3.35Å; P299-K303 WeakPolarHBondContact O-CB 3.5Å; P299-K303 PolarHBondContact O-N 3.39Å
300	H	94.3	Very high	95.9	Very high	41 Å²	41	37.3 Å²	37.3	19%	0.19	18%	0.182	C	C	.	.	H	α-helix	trans	-70.9	-14.4	177.1	62.4	-74.7	0	0	0	113.6	F101 P102 H129 L298	F101-H300 WeakPolarHBondContact CB-CE1 3.49Å; P102-H300 PolarHBondContact O-CE1 2.91Å; P102-H300 PolarHBondContact O-NE2 2.83Å; P102-H300 VanDerWaalsContact O-NE2 3.1Å; H129-H300 WeakPolarHBondContact CB-O 3.39Å; L298-H300 PolarHBondContact O-N 3.44Å
301	Y	96.7	Very high	95.7	Very high	0 Å²	0	40.5 Å²	40.5	0%	0	20%	0.199	C	C	.	.	H	α-helix	trans	-101	-40	170.1	-65.5	-80.9	0	0	0	112.5	P102 S103 V105 L125 H129 F131 P162 Y163 L164 L298 P299	P102-Y301 WeakPolarHBondContact O-CE2 3.3Å; S103-Y301 PolarHBondContact O-OH 3.32Å; V105-Y301 HydrophobicContact CB-CE2 4.46Å; V105-Y301 HydrophobicContact CG2-CD2 4.1Å; V105-Y301 HydrophobicContact CG2-CE2 3.43Å; V105-Y301 VanDerWaalsContact CG2-CE2 3.43Å; L125-Y301 WeakPolarHBondContact CB-O 3.38Å; H129-Y301 PolarHBondContact CD2-O 3.35Å; F131-Y301 HydrophobicContact CB-CD1 4.07Å; F131-Y301 HydrophobicContact CB-CE1 3.9Å; F131-Y301 AromaticContact CD1-CD1 3.6Å; F131-Y301 HydrophobicContact CD1-CD1 3.6Å; F131-Y301 HydrophobicContact CD1-CE1 4.3Å; F131-Y301 HydrophobicContact CD1-CG 4.41Å; F131-Y301 AromaticContact CD2-CD1 3.56Å; F131-Y301 HydrophobicContact CD2-CD1 3.56Å; F131-Y301 AromaticContact CD2-CE1 3.7Å; F131-Y301 HydrophobicContact CD2-CE1 3.7Å; F131-Y301 AromaticContact CE1-CD1 3.85Å; F131-Y301 HydrophobicContact CE1-CD1 3.85Å; F131-Y301 AromaticContact CE2-CD1 3.83Å; F131-Y301 HydrophobicContact CE2-CD1 3.83Å; F131-Y301 HydrophobicContact CE2-CE1 4.32Å; F131-Y301 AromaticContact CG-CD1 3.46Å; F131-Y301 HydrophobicContact CG-CD1 3.46Å; F131-Y301 VanDerWaalsContact CG-CD1 3.46Å; F131-Y301 AromaticContact CG-CE1 3.71Å; F131-Y301 HydrophobicContact CG-CE1 3.71Å; F131-Y301 AromaticContact CZ-CD1 3.97Å; F131-Y301 HydrophobicContact CZ-CD1 3.97Å; P162-Y301 HydrophobicContact CB-CE1 4.33Å; P162-Y301 WeakPolarHBondContact CB-OH 3.35Å; Y163-Y301 PolarHBondContact N-OH 3.38Å; Y163-Y301 PolarHBondContact O-OH 2.96Å; L164-Y301 HydrophobicContact CB-CD1 4.14Å; L164-Y301 HydrophobicContact CB-CE1 3.92Å; L164-Y301 HydrophobicContact CD1-CD1 4.24Å; L298-Y301 HydrophobicContact CB-CD2 3.99Å; L298-Y301 HydrophobicContact CD1-CD2 4.5Å; L298-Y301 HydrophobicContact CD2-CD2 4.21Å; L298-Y301 HydrophobicContact CD2-CE2 4.36Å; L298-Y301 HydrophobicContact CG-CD2 4.46Å; L298-Y301 PolarHBondContact O-N 3.41Å; P299-Y301 PolarHBondContact O-N 3.35Å
302	F	97.6	Very high	95.4	Very high	2 Å²	2	45 Å²	45	1%	0.009	23%	0.228	C	C	.	.	H	α-helix	trans	-116.2	6.6	-163.8	-67.4	-85.5	0	0	0	114.9	L122 L125 L164 I185 L294 E295 L298 G304 V305	L122-F302 HydrophobicContact CD2-CE1 3.63Å; L122-F302 HydrophobicContact CD2-CZ 3.71Å; L125-F302 HydrophobicContact CD1-CD1 3.99Å; L164-F302 HydrophobicContact CD1-CE2 4.17Å; L164-F302 HydrophobicContact CD1-CZ 3.97Å; I185-F302 HydrophobicContact CD1-CE2 4.26Å; I185-F302 HydrophobicContact CD1-CZ 3.88Å; L294-F302 HydrophobicContact CB-CB 4.25Å; L294-F302 HydrophobicContact CB-CD1 4.01Å; L294-F302 HydrophobicContact CB-CD2 3.88Å; L294-F302 HydrophobicContact CB-CE1 4.31Å; L294-F302 HydrophobicContact CB-CE2 4.21Å; L294-F302 HydrophobicContact CB-CG 3.78Å; L294-F302 HydrophobicContact CB-CZ 4.41Å; L294-F302 HydrophobicContact CD1-CD1 4.29Å; L294-F302 HydrophobicContact CD1-CE1 3.85Å; L294-F302 HydrophobicContact CD1-CE2 4.47Å; L294-F302 HydrophobicContact CD1-CZ 3.95Å; L294-F302 HydrophobicContact CD2-CE2 4.34Å; E295-F302 HydrophobicContact CB-CB 4.24Å; L298-F302 HydrophobicContact CB-CD2 3.74Å; L298-F302 HydrophobicContact CB-CE2 4.17Å; L298-F302 HydrophobicContact CD1-CD2 4.37Å; L298-F302 HydrophobicContact CD1-CE2 3.96Å; L298-F302 PolarHBondContact O-N 3.26Å; F302-G304 PolarHBondContact O-N 2.84Å; F302-V305 HydrophobicContact CB-CB 4.4Å; F302-V305 HydrophobicContact CB-CG1 4.25Å; F302-V305 HydrophobicContact CD1-CB 4.48Å; F302-V305 HydrophobicContact CD1-CG2 4.35Å; F302-V305 WeakPolarHBondContact O-CB 3.49Å; F302-V305 VanDerWaalsContact O-CG1 3.23Å; F302-V305 WeakPolarHBondContact O-CG1 3.39Å; F302-V305 PolarHBondContact O-N 3.14Å
303	K	96.8	Very high	95	Very high	134 Å²	134	49.4 Å²	49.4	58%	0.583	25%	0.247	S	C	*	.	T	Hydrogen-bonded Turn	trans	-57.7	127	178.4	-179.3	176.1	-176.6	-177.9	0	111.9	H129 E295 P299 V305	H129-K303 PolarHBondContact CE1-O 3.31Å; H129-K303 VanDerWaalsContact CE1-O 3.22Å; H129-K303 PolarHBondContact NE2-O 3.03Å; E295-K303 WeakPolarHBondContact OE1-CA 3.42Å; P299-K303 WeakPolarHBondContact O-CB 3.5Å; P299-K303 PolarHBondContact O-N 3.39Å; K303-V305 VanDerWaalsContact C-N 3.32Å
304	G	96.1	Very high	94.7	Very high	17 Å²	17	49.8 Å²	49.8	18%	0.175	25%	0.249	C	C	.	.	T	Hydrogen-bonded Turn	trans	71.2	19.8	-176.1	0	0	0	0	0	114.3	E295 F302 L306 S307	E295-G304 PolarHBondContact OE1-N 2.92Å; F302-G304 PolarHBondContact O-N 2.84Å; G304-L306 VanDerWaalsContact C-N 3.29Å; G304-L306 PolarHBondContact O-N 2.92Å; G304-S307 PolarHBondContact O-N 3.16Å; G304-S307 PolarHBondContact O-OG 3.24Å
305	V	97.2	Very high	94.2	Very high	0 Å²	0	57.4 Å²	57.4	0%	0	28%	0.278	C	S	.	.	H	α-helix	trans	-61.9	-36.6	-179.5	63	0	0	0	0	112.5	L121 L125 L291 E295 F302 K303 S307 I308 Y309	L121-V305 HydrophobicContact CB-CG2 4.48Å; L121-V305 HydrophobicContact CD1-CG2 4.02Å; L121-V305 HydrophobicContact CD2-CG2 4.46Å; L125-V305 HydrophobicContact CD1-CB 4.05Å; L125-V305 HydrophobicContact CD1-CG2 3.82Å; L291-V305 HydrophobicContact CB-CG1 3.88Å; L291-V305 HydrophobicContact CB-CG2 4.39Å; L291-V305 HydrophobicContact CD1-CG2 4.27Å; L291-V305 HydrophobicContact CD2-CG2 3.87Å; L291-V305 HydrophobicContact CG-CG2 4.39Å; L291-V305 WeakPolarHBondContact O-CG1 3.41Å; E295-V305 HydrophobicContact CB-CG1 4.17Å; F302-V305 HydrophobicContact CB-CB 4.4Å; F302-V305 HydrophobicContact CB-CG1 4.25Å; F302-V305 HydrophobicContact CD1-CB 4.48Å; F302-V305 HydrophobicContact CD1-CG2 4.35Å; F302-V305 WeakPolarHBondContact O-CB 3.49Å; F302-V305 VanDerWaalsContact O-CG1 3.23Å; F302-V305 WeakPolarHBondContact O-CG1 3.39Å; F302-V305 PolarHBondContact O-N 3.14Å; K303-V305 VanDerWaalsContact C-N 3.32Å; V305-S307 VanDerWaalsContact C-N 3.34Å; V305-S307 PolarHBondContact O-N 3.38Å; V305-I308 PolarHBondContact O-N 3.27Å; V305-Y309 WeakPolarHBondContact O-CB 3.43Å; V305-Y309 PolarHBondContact O-N 2.84Å
306	L	95.1	Very high	93.8	Very high	35 Å²	35	61.1 Å²	61.1	18%	0.183	29%	0.293	C	S	.	.	H	α-helix	trans	-66.2	-34.4	-179	-76	-177.9	0	0	0	113	E288 L291 L292 G304 I308 Y309 K310	E288-L306 HydrophobicContact CB-CD2 4.26Å; L291-L306 HydrophobicContact CB-CD2 3.93Å; L291-L306 HydrophobicContact CD1-CD2 4.39Å; L292-L306 HydrophobicContact CB-CD1 4.1Å; L292-L306 HydrophobicContact CD1-CD1 3.94Å; L292-L306 HydrophobicContact CG-CD1 4.46Å; G304-L306 VanDerWaalsContact C-N 3.29Å; G304-L306 PolarHBondContact O-N 2.92Å; L306-I308 VanDerWaalsContact C-N 3.31Å; L306-Y309 PolarHBondContact O-N 3.4Å; L306-K310 WeakPolarHBondContact O-CB 3.44Å; L306-K310 WeakPolarHBondContact O-CG 3.36Å; L306-K310 PolarHBondContact O-N 2.84Å
307	S	95.5	Very high	93.3	Very high	77 Å²	77	57.9 Å²	57.9	54%	0.538	28%	0.284	S	S	.	.	H	α-helix	trans	-67.1	-37.5	176.4	60.3	0	0	0	0	111.1	G304 V305 D311	G304-S307 PolarHBondContact O-N 3.16Å; G304-S307 PolarHBondContact O-OG 3.24Å; V305-S307 VanDerWaalsContact C-N 3.34Å; V305-S307 PolarHBondContact O-N 3.38Å; S307-D311 PolarHBondContact O-N 3.25Å
308	I	95.2	Very high	92.6	Very high	19 Å²	19	56.7 Å²	56.7	10%	0.097	28%	0.281	C	S	.	.	H	α-helix	trans	-69.9	-41.1	176	-55.8	166.2	0	0	0	110.1	L121 I124 L125 V305 L306 K310 D311 H314	L121-I308 HydrophobicContact CD2-CB 4.04Å; L121-I308 HydrophobicContact CD2-CG2 3.66Å; I124-I308 HydrophobicContact CB-CG2 4.32Å; I124-I308 HydrophobicContact CD1-CG2 3.65Å; I124-I308 HydrophobicContact CG2-CD1 3.9Å; I124-I308 HydrophobicContact CG2-CG1 4.45Å; I124-I308 HydrophobicContact CG2-CG2 4.05Å; L125-I308 HydrophobicContact CD2-CD1 3.6Å; L125-I308 HydrophobicContact CG-CD1 3.97Å; V305-I308 PolarHBondContact O-N 3.27Å; L306-I308 VanDerWaalsContact C-N 3.31Å; I308-K310 VanDerWaalsContact C-N 3.3Å; I308-K310 PolarHBondContact O-N 3.44Å; I308-D311 VanDerWaalsContact O-CB 3.23Å; I308-D311 WeakPolarHBondContact O-CB 3.49Å; I308-D311 PolarHBondContact O-N 3.22Å; I308-H314 VanDerWaalsContact O-CB 3.22Å; I308-H314 WeakPolarHBondContact O-CB 3.28Å
309	Y	94.6	Very high	91.9	Very high	62 Å²	62	61 Å²	61	24%	0.243	30%	0.304	C	S	.	.	H	α-helix	trans	-63.9	-35	179.3	178.3	-112.3	0	0	0	113.3	T117 L121 L287 E288 L291 V305 L306 D311	T117-Y309 HydrophobicContact CG2-CE2 4.23Å; L121-Y309 HydrophobicContact CD1-CD2 4.09Å; L287-Y309 HydrophobicContact CD2-CE2 3.91Å; E288-Y309 HydrophobicContact CG-CD1 4.08Å; E288-Y309 HydrophobicContact CG-CE1 3.66Å; L291-Y309 HydrophobicContact CD1-CD1 4.05Å; L291-Y309 HydrophobicContact CD1-CD2 4.03Å; L291-Y309 HydrophobicContact CD1-CG 3.69Å; V305-Y309 WeakPolarHBondContact O-CB 3.43Å; V305-Y309 PolarHBondContact O-N 2.84Å; L306-Y309 PolarHBondContact O-N 3.4Å; Y309-D311 VanDerWaalsContact C-N 3.32Å
310	K	93.9	Very high	91.2	Very high	124 Å²	124	62.2 Å²	62.2	54%	0.539	31%	0.307	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.4	-6.9	178.5	-67.8	-177.2	-179.2	-170.3	0	113.6	E288 L306 I308	E288-K310 WeakPolarHBondContact OE2-CE 3.17Å; E288-K310 IonicContact OE2-NZ 3.32Å; E288-K310 PolarHBondContact OE2-NZ 3.47Å; L306-K310 WeakPolarHBondContact O-CB 3.44Å; L306-K310 WeakPolarHBondContact O-CG 3.36Å; L306-K310 PolarHBondContact O-N 2.84Å; I308-K310 VanDerWaalsContact C-N 3.3Å; I308-K310 PolarHBondContact O-N 3.44Å
311	D	93.8	Very high	90.6	Very high	68 Å²	68	61.2 Å²	61.2	36%	0.364	30%	0.304	S	S	.	.			trans	-64.2	134.5	178.6	-176	-94.1	0	0	0	111.3	S307 I308 Y309 E313 H314 R315	S307-D311 PolarHBondContact O-N 3.25Å; I308-D311 VanDerWaalsContact O-CB 3.23Å; I308-D311 WeakPolarHBondContact O-CB 3.49Å; I308-D311 PolarHBondContact O-N 3.22Å; Y309-D311 VanDerWaalsContact C-N 3.32Å; D311-E313 VanDerWaalsContact C-N 3.34Å; D311-E313 PolarHBondContact O-N 3.44Å; D311-E313 VanDerWaalsContact OD1-CB 3.28Å; D311-E313 WeakPolarHBondContact OD1-CB 3.35Å; D311-E313 PolarHBondContact OD1-N 3.01Å; D311-H314 HydrophobicContact CB-CB 4.2Å; D311-H314 PolarHBondContact O-N 3.24Å; D311-H314 PolarHBondContact OD1-N 2.97Å; D311-R315 WeakPolarHBondContact O-CB 3.35Å; D311-R315 PolarHBondContact O-N 3.18Å
312	P	91.1	Very high	89.9	Confident	95 Å²	95	64.1 Å²	64.1	62%	0.617	32%	0.322	S	S	*	.	H	α-helix	trans	-58.8	-38.8	-178.8	-25.6	35	0	0	0	114.2	R315 K316	P312-R315 PolarHBondContact O-N 3Å; P312-K316 WeakPolarHBondContact O-CB 3.11Å; P312-K316 PolarHBondContact O-N 2.98Å
313	E	88.4	Confident	89.2	Confident	133 Å²	133	64.3 Å²	64.3	62%	0.621	32%	0.323	S	S	*	.	H	α-helix	trans	-67.7	-44.7	-179.4	-64.3	-57.4	127.1	0	0	110.3	D311 R315 K316 L317	D311-E313 VanDerWaalsContact C-N 3.34Å; D311-E313 PolarHBondContact O-N 3.44Å; D311-E313 VanDerWaalsContact OD1-CB 3.28Å; D311-E313 WeakPolarHBondContact OD1-CB 3.35Å; D311-E313 PolarHBondContact OD1-N 3.01Å; E313-R315 VanDerWaalsContact C-N 3.3Å; E313-R315 PolarHBondContact O-N 3.47Å; E313-K316 PolarHBondContact O-N 3.32Å; E313-L317 PolarHBondContact O-N 2.91Å
314	H	88.8	Confident	88.6	Confident	8 Å²	8	58 Å²	58	4%	0.037	30%	0.295	C	S	.	.	H	α-helix	trans	-60.8	-42.1	173.5	-177	75.7	0	0	0	111.7	L121 I308 D311 L317 G318	L121-H314 WeakPolarHBondContact CD2-CE1 3.36Å; L121-H314 WeakPolarHBondContact CD2-NE2 3.4Å; L121-H314 VanDerWaalsContact CG-CE1 3.49Å; L121-H314 WeakPolarHBondContact CG-CE1 3.42Å; I308-H314 VanDerWaalsContact O-CB 3.22Å; I308-H314 WeakPolarHBondContact O-CB 3.28Å; D311-H314 HydrophobicContact CB-CB 4.2Å; D311-H314 PolarHBondContact O-N 3.24Å; D311-H314 PolarHBondContact OD1-N 2.97Å; H314-L317 PolarHBondContact O-N 3.03Å; H314-G318 PolarHBondContact O-N 3.33Å
315	R	87.4	Confident	87.9	Confident	166 Å²	166	62.4 Å²	62.4	63%	0.626	31%	0.31	S	S	*	.	H	α-helix	trans	-64.9	-41.7	179.1	-173.4	174	177.1	153.4	-3	111.7	D311 P312 E313 G318 N319	D311-R315 WeakPolarHBondContact O-CB 3.35Å; D311-R315 PolarHBondContact O-N 3.18Å; P312-R315 PolarHBondContact O-N 3Å; E313-R315 VanDerWaalsContact C-N 3.3Å; E313-R315 PolarHBondContact O-N 3.47Å; R315-G318 PolarHBondContact O-N 3.43Å; R315-N319 WeakPolarHBondContact O-CB 3.46Å; R315-N319 PolarHBondContact O-N 2.96Å; R315-N319 PolarHBondContact O-ND2 2.98Å; R315-N319 PolarHBondContact O-OD1 2.98Å
316	K	86.6	Confident	87.4	Confident	125 Å²	125	66.6 Å²	66.6	54%	0.543	33%	0.328	S	S	.	.	H	α-helix	trans	-56.6	-51	173.5	-172.8	-178.8	178.7	-173.1	0	110.1	P312 E313 G318 N319 M320	P312-K316 WeakPolarHBondContact O-CB 3.11Å; P312-K316 PolarHBondContact O-N 2.98Å; E313-K316 PolarHBondContact O-N 3.32Å; K316-G318 VanDerWaalsContact C-N 3.35Å; K316-G318 PolarHBondContact O-N 3.07Å; K316-N319 PolarHBondContact O-N 3.4Å; K316-M320 WeakPolarHBondContact O-CG 3.41Å; K316-M320 PolarHBondContact O-N 2.88Å
317	L	83.3	Confident	86.9	Confident	41 Å²	41	68.2 Å²	68.2	22%	0.215	34%	0.34	C	S	.	.	H	α-helix	trans	-63.3	-38.5	178.4	-171.4	58.8	0	0	0	113	L120 E313 H314 M320	L120-L317 HydrophobicContact CD1-CB 4.41Å; L120-L317 HydrophobicContact CD1-CD2 3.74Å; L120-L317 HydrophobicContact CD1-CG 3.59Å; L120-L317 HydrophobicContact CD2-CD2 3.61Å; L120-L317 HydrophobicContact CD2-CG 4.26Å; L120-L317 HydrophobicContact CG-CD2 4.18Å; E313-L317 PolarHBondContact O-N 2.91Å; H314-L317 PolarHBondContact O-N 3.03Å; L317-M320 HydrophobicContact CD1-CE 3.3Å; L317-M320 HydrophobicContact CG-CE 4.49Å; L317-M320 PolarHBondContact O-N 3.14Å
318	G	80.2	Confident	86.6	Confident	8 Å²	8	67.9 Å²	67.9	8%	0.082	33%	0.334	C	S	.	.	H	α-helix	trans	-64.1	-42	175	0	0	0	0	0	112.9	H314 R315 K316 M320 T321	H314-G318 PolarHBondContact O-N 3.33Å; R315-G318 PolarHBondContact O-N 3.43Å; K316-G318 VanDerWaalsContact C-N 3.35Å; K316-G318 PolarHBondContact O-N 3.07Å; G318-M320 PolarHBondContact O-N 3.18Å; G318-T321 WeakPolarHBondContact O-CB 3.48Å; G318-T321 PolarHBondContact O-N 3.16Å; G318-T321 PolarHBondContact O-OG1 3.07Å
319	N	82.4	Confident	86.4	Confident	91 Å²	91	67.2 Å²	67.2	49%	0.487	33%	0.331	S	S	.	.	H	α-helix	trans	-61	-34.8	178	-71.8	-13.3	0	0	0	111.7	R315 K316 T321 V322	R315-N319 WeakPolarHBondContact O-CB 3.46Å; R315-N319 PolarHBondContact O-N 2.96Å; R315-N319 PolarHBondContact O-ND2 2.98Å; R315-N319 PolarHBondContact O-OD1 2.98Å; K316-N319 PolarHBondContact O-N 3.4Å; N319-T321 PolarHBondContact O-N 2.81Å; N319-T321 VanDerWaalsContact O-N 3.07Å; N319-V322 WeakPolarHBondContact O-CB 3.43Å; N319-V322 WeakPolarHBondContact O-CG2 3.47Å; N319-V322 PolarHBondContact O-N 2.99Å
320	M	80.8	Confident	86.4	Confident	60 Å²	60	66 Å²	66	30%	0.296	33%	0.332	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.1	-14.4	175.9	-60.9	-161.7	-64.3	0	0	113.9	W207 R208 K316 L317 G318	W207-M320 PolarHBondContact N-O 3.39Å; R208-M320 HydrophobicContact CG-CB 3.9Å; K316-M320 WeakPolarHBondContact O-CG 3.41Å; K316-M320 PolarHBondContact O-N 2.88Å; L317-M320 HydrophobicContact CD1-CE 3.3Å; L317-M320 HydrophobicContact CG-CE 4.49Å; L317-M320 PolarHBondContact O-N 3.14Å; G318-M320 PolarHBondContact O-N 3.18Å
321	T	80.2	Confident	86.4	Confident	21 Å²	21	64.5 Å²	64.5	13%	0.129	33%	0.334	C	S	.	.	T	Hydrogen-bonded Turn	trans	-88.6	-5.3	177.7	75.2	0	0	0	0	113.7	R116 G318 N319	R116-T321 HydrophobicContact CB-CG2 3.95Å; G318-T321 WeakPolarHBondContact O-CB 3.48Å; G318-T321 PolarHBondContact O-N 3.16Å; G318-T321 PolarHBondContact O-OG1 3.07Å; N319-T321 PolarHBondContact O-N 2.81Å; N319-T321 VanDerWaalsContact O-N 3.07Å
322	V	83.7	Confident	86.5	Confident	61 Å²	61	67.5 Å²	67.5	37%	0.37	35%	0.346	S	S	.	.	S	Bend	trans	-73.1	136	-179.2	179.4	0	0	0	0	110	D206 N319	D206-V322 WeakPolarHBondContact CA-O 3.03Å; D206-V322 WeakPolarHBondContact CB-O 3.38Å; N319-V322 WeakPolarHBondContact O-CB 3.43Å; N319-V322 WeakPolarHBondContact O-CG2 3.47Å; N319-V322 PolarHBondContact O-N 2.99Å
323	T	81.3	Confident	86.7	Confident	5 Å²	5	63 Å²	63	3%	0.031	32%	0.317	C	S	.	.	B	Isolated β-bridge	trans	-72.8	132.9	176.2	-69.2	0	0	0	0	111.6	K112 F200 F201 G205 K326	K112-T323 PolarHBondContact NZ-OG1 3.23Å; F200-T323 HydrophobicContact CB-CG2 3.59Å; F201-T323 HydrophobicContact CB-CG2 3.99Å; F201-T323 WeakPolarHBondContact CB-OG1 3.26Å; F201-T323 VanDerWaalsContact N-CG2 3.32Å; G205-T323 VanDerWaalsContact O-CA 3.3Å; G205-T323 WeakPolarHBondContact O-CA 3.48Å; T323-K326 VanDerWaalsContact CB-CE 3.42Å; T323-K326 HydrophobicContact CG2-CG 4.15Å; T323-K326 WeakPolarHBondContact O-CE 3.42Å; T323-K326 PolarHBondContact O-NZ 2.66Å
324	V	84.5	Confident	87	Confident	1 Å²	1	57.4 Å²	57.4	1%	0.006	29%	0.292	C	S	.	.	P	Polyproline II helix	trans	-87	166.8	-176.5	-53.2	0	0	0	0	112.7	F204 G205 W207 K326	F204-V324 HydrophobicContact CB-CG2 3.64Å; F204-V324 WeakPolarHBondContact O-CG2 3.3Å; G205-V324 PolarHBondContact O-N 3.37Å; W207-V324 HydrophobicContact CD2-CG1 3.57Å; W207-V324 VanDerWaalsContact CE2-CG1 3.44Å; W207-V324 HydrophobicContact CE3-CG1 4.13Å; W207-V324 HydrophobicContact CG-CG1 3.83Å; W207-V324 HydrophobicContact CH2-CG1 4.39Å; W207-V324 HydrophobicContact CZ2-CB 4.49Å; W207-V324 HydrophobicContact CZ2-CG1 3.85Å; V324-K326 VanDerWaalsContact C-N 3.25Å; V324-K326 PolarHBondContact O-N 3.07Å; V324-K326 VanDerWaalsContact O-N 3.14Å
325	K	82.3	Confident	87.4	Confident	110 Å²	110	60.8 Å²	60.8	48%	0.478	31%	0.308	S	S	.	.	S	Bend	trans	52.1	38	169.9	-63.6	172.5	178.4	155.5	0	114	F200 F204 E210	F200-K325 WeakPolarHBondContact CD1-O 3.15Å; F204-K325 HydrophobicContact CB-CB 4.29Å; F204-K325 HydrophobicContact CB-CD 4.36Å; F204-K325 HydrophobicContact CD1-CD 4.24Å; F204-K325 HydrophobicContact CD2-CB 3.75Å; F204-K325 HydrophobicContact CE2-CB 4.28Å; F204-K325 HydrophobicContact CG-CB 4.02Å; F204-K325 HydrophobicContact CG-CD 4.19Å; E210-K325 VanDerWaalsContact CD-NZ 3.3Å; E210-K325 VanDerWaalsContact OE1-CE 3.28Å; E210-K325 WeakPolarHBondContact OE1-CE 3.26Å; E210-K325 IonicContact OE1-NZ 2.8Å; E210-K325 PolarHBondContact OE1-NZ 3.49Å; E210-K325 IonicContact OE2-NZ 2.79Å; E210-K325 PolarHBondContact OE2-NZ 3.48Å; E210-K325 VanDerWaalsContact OE2-NZ 3.16Å
326	K	85.3	Confident	87.8	Confident	88 Å²	88	54.6 Å²	54.6	38%	0.383	29%	0.287	S	S	.	.			trans	-76.6	130.2	177.7	-65.8	178.1	-175.2	152	0	110.1	F200 T323 V324	F200-K326 HydrophobicContact CB-CG 4.05Å; F200-K326 HydrophobicContact CD2-CB 3.92Å; F200-K326 HydrophobicContact CD2-CG 3.79Å; F200-K326 HydrophobicContact CE2-CB 4.3Å; F200-K326 HydrophobicContact CG-CB 4.31Å; F200-K326 HydrophobicContact CG-CG 4.05Å; T323-K326 VanDerWaalsContact CB-CE 3.42Å; T323-K326 HydrophobicContact CG2-CG 4.15Å; T323-K326 WeakPolarHBondContact O-CE 3.42Å; T323-K326 PolarHBondContact O-NZ 2.66Å; V324-K326 VanDerWaalsContact C-N 3.25Å; V324-K326 PolarHBondContact O-N 3.07Å; V324-K326 VanDerWaalsContact O-N 3.14Å
327	T	86.7	Confident	88.3	Confident	70 Å²	70	48.6 Å²	48.6	43%	0.429	26%	0.261	S	S	.	.			trans	-105.6	149.7	167.5	62.1	0	0	0	0	110.2	F200	F200-T327 WeakPolarHBondContact CE1-OG1 3.19Å; F200-T327 VanDerWaalsContact CE2-O 3.28Å; F200-T327 WeakPolarHBondContact CE2-O 3.23Å; F200-T327 VanDerWaalsContact CZ-N 3.26Å; F200-T327 WeakPolarHBondContact CZ-O 3.29Å; F200-T327 WeakPolarHBondContact CZ-OG1 3.43Å
328	V	87.6	Confident	88.8	Confident	69 Å²	69	50.5 Å²	50.5	42%	0.418	27%	0.265	S	S	.	.	P	Polyproline II helix	trans	-90.2	126.4	177.6	-178.4	0	0	0	0	107.9	I379	V328-I379 HydrophobicContact CB-CG2 4.3Å; V328-I379 HydrophobicContact CG1-CB 4.35Å; V328-I379 HydrophobicContact CG1-CD1 4.22Å; V328-I379 HydrophobicContact CG1-CG1 3.96Å; V328-I379 HydrophobicContact CG1-CG2 3.61Å; V328-I379 HydrophobicContact CG2-CG2 3.91Å
329	P	91.7	Very high	89.6	Confident	6 Å²	6	55.9 Å²	55.9	4%	0.039	29%	0.288	C	S	.	.	P	Polyproline II helix	trans	-67.1	160.2	174.5	-12.1	24.9	0	0	0	112.2	L196 I229 N230 I233 A333 V334	L196-P329 HydrophobicContact CD1-CG 3.97Å; L196-P329 HydrophobicContact CD2-CG 3.49Å; L196-P329 VanDerWaalsContact CD2-CG 3.49Å; L196-P329 HydrophobicContact CG-CG 4.36Å; I229-P329 HydrophobicContact CG1-CB 4.45Å; I229-P329 HydrophobicContact CG1-CG 3.91Å; I229-P329 HydrophobicContact CG2-CB 4.26Å; I229-P329 HydrophobicContact CG2-CG 4.2Å; N230-P329 WeakPolarHBondContact OD1-CA 3.28Å; I233-P329 HydrophobicContact CD1-CB 4.08Å; I233-P329 HydrophobicContact CD1-CG 4.22Å; P329-A333 HydrophobicContact CB-CB 3.96Å; P329-V334 HydrophobicContact CB-CG2 3.97Å; P329-V334 HydrophobicContact CG-CG2 4.25Å
330	S	94.5	Very high	90.3	Very high	36 Å²	36	54 Å²	54	25%	0.252	28%	0.275	S	S	.	.	P	Polyproline II helix	trans	-61.6	152.4	173.4	76.5	0	0	0	0	110.7	N230 E332 A333 V334	N230-S330 WeakPolarHBondContact OD1-CB 3.07Å; N230-S330 PolarHBondContact OD1-N 3.02Å; N230-S330 PolarHBondContact OD1-OG 2.82Å; S330-E332 PolarHBondContact O-N 2.99Å; S330-E332 VanDerWaalsContact O-N 3.16Å; S330-A333 PolarHBondContact O-N 2.88Å; S330-A333 WeakPolarHBondContact OG-CB 3.22Å; S330-A333 PolarHBondContact OG-N 3.24Å; S330-V334 WeakPolarHBondContact O-CG2 3.11Å; S330-V334 PolarHBondContact O-N 3.34Å
331	P	94.7	Very high	91	Very high	92 Å²	92	51.4 Å²	51.4	60%	0.597	26%	0.262	S	S	*	.	H	α-helix	trans	-54.9	-35.4	177.7	-26.9	35.3	0	0	0	113.3	Q335	P331-Q335 WeakPolarHBondContact O-CB 3.35Å; P331-Q335 PolarHBondContact O-N 3.4Å
332	E	95.1	Very high	91.9	Very high	131 Å²	131	56.9 Å²	56.9	61%	0.612	28%	0.28	S	S	*	.	H	α-helix	trans	-64.2	-48.5	175.5	-177.4	177.6	-169.1	0	0	111.9	L234 S330 V334 Q335 I336	L234-E332 HydrophobicContact CD2-CG 4.05Å; S330-E332 PolarHBondContact O-N 2.99Å; S330-E332 VanDerWaalsContact O-N 3.16Å; E332-V334 VanDerWaalsContact C-N 3.33Å; E332-V334 PolarHBondContact O-N 3.38Å; E332-Q335 WeakPolarHBondContact O-CB 3.28Å; E332-Q335 PolarHBondContact O-N 3.42Å; E332-I336 HydrophobicContact CG-CD1 4.35Å; E332-I336 WeakPolarHBondContact O-CG1 3.42Å; E332-I336 PolarHBondContact O-N 3.29Å
333	A	96.1	Very high	92.6	Very high	0 Å²	0	55.9 Å²	55.9	0%	0	27%	0.27	C	S	.	.	H	α-helix	trans	-61.9	-41.2	177.3	0	0	0	0	0	111.6	I233 P329 S330 Q335 I336 L337	I233-A333 HydrophobicContact CB-CB 4.07Å; I233-A333 HydrophobicContact CD1-CB 3.88Å; I233-A333 HydrophobicContact CG2-CB 3.87Å; I233-A333 WeakPolarHBondContact CG2-O 3.36Å; P329-A333 HydrophobicContact CB-CB 3.96Å; S330-A333 PolarHBondContact O-N 2.88Å; S330-A333 WeakPolarHBondContact OG-CB 3.22Å; S330-A333 PolarHBondContact OG-N 3.24Å; A333-Q335 VanDerWaalsContact C-N 3.34Å; A333-Q335 PolarHBondContact O-N 3.05Å; A333-I336 PolarHBondContact O-N 3.35Å; A333-L337 PolarHBondContact O-N 3.23Å
334	V	94.6	Very high	93.4	Very high	17 Å²	17	55.9 Å²	55.9	10%	0.103	27%	0.27	C	S	.	.	H	α-helix	trans	-62.8	-41.1	175.5	-179.6	0	0	0	0	111.4	P329 S330 E332 I336 L337 Y338 F377	P329-V334 HydrophobicContact CB-CG2 3.97Å; P329-V334 HydrophobicContact CG-CG2 4.25Å; S330-V334 WeakPolarHBondContact O-CG2 3.11Å; S330-V334 PolarHBondContact O-N 3.34Å; E332-V334 VanDerWaalsContact C-N 3.33Å; E332-V334 PolarHBondContact O-N 3.38Å; V334-I336 VanDerWaalsContact C-N 3.34Å; V334-I336 PolarHBondContact O-N 3.46Å; V334-L337 WeakPolarHBondContact O-CB 3.43Å; V334-L337 PolarHBondContact O-N 3.28Å; V334-Y338 PolarHBondContact O-N 3.19Å; V334-F377 HydrophobicContact CB-CD1 4.47Å; V334-F377 HydrophobicContact CB-CE1 4.29Å; V334-F377 HydrophobicContact CG1-CD1 3.56Å; V334-F377 HydrophobicContact CG1-CE1 3.47Å; V334-F377 VanDerWaalsContact CG1-CE1 3.47Å
335	Q	95.6	Very high	94.1	Very high	78 Å²	78	56.7 Å²	56.7	36%	0.364	27%	0.273	S	S	.	.	H	α-helix	trans	-62.5	-41.5	177.5	-174.8	62	26.3	0	0	111.9	P331 E332 A333 Y338 Q339	P331-Q335 WeakPolarHBondContact O-CB 3.35Å; P331-Q335 PolarHBondContact O-N 3.4Å; E332-Q335 WeakPolarHBondContact O-CB 3.28Å; E332-Q335 PolarHBondContact O-N 3.42Å; A333-Q335 VanDerWaalsContact C-N 3.34Å; A333-Q335 PolarHBondContact O-N 3.05Å; Q335-Y338 WeakPolarHBondContact O-CB 3.4Å; Q335-Y338 PolarHBondContact O-N 2.95Å; Q335-Q339 WeakPolarHBondContact O-CG 3.5Å; Q335-Q339 PolarHBondContact O-N 2.8Å; Q335-Q339 VanDerWaalsContact O-N 3.09Å
336	I	96.8	Very high	94.8	Very high	36 Å²	36	55.4 Å²	55.4	19%	0.185	27%	0.268	C	S	.	.	H	α-helix	trans	-62.5	-44.6	174.8	-71.3	165.4	0	0	0	110.8	I233 L234 E332 A333 V334 Y338 Q339 R340	I233-I336 HydrophobicContact CG2-CB 4.17Å; I233-I336 HydrophobicContact CG2-CG2 3.93Å; L234-I336 HydrophobicContact CD2-CD1 3.58Å; E332-I336 HydrophobicContact CG-CD1 4.35Å; E332-I336 WeakPolarHBondContact O-CG1 3.42Å; E332-I336 PolarHBondContact O-N 3.29Å; A333-I336 PolarHBondContact O-N 3.35Å; V334-I336 VanDerWaalsContact C-N 3.34Å; V334-I336 PolarHBondContact O-N 3.46Å; I336-Y338 VanDerWaalsContact C-N 3.32Å; I336-Y338 PolarHBondContact O-N 2.56Å; I336-Q339 PolarHBondContact O-N 2.83Å; I336-R340 HydrophobicContact CG2-CG 4.37Å; I336-R340 WeakPolarHBondContact O-CG 3.12Å; I336-R340 PolarHBondContact O-N 2.99Å
337	L	96.2	Very high	95.5	Very high	0 Å²	0	51.2 Å²	51.2	0%	0	25%	0.25	C	S	.	.	H	α-helix	trans	-60.3	-42.3	175.8	-77.1	-174.8	0	0	0	112	V192 F195 I233 L245 A333 V334 Q339 R340 M341	V192-L337 HydrophobicContact CG1-CD1 4.21Å; V192-L337 HydrophobicContact CG2-CB 4Å; V192-L337 HydrophobicContact CG2-CD1 4.44Å; F195-L337 HydrophobicContact CD1-CD1 3.77Å; F195-L337 HydrophobicContact CD1-CD2 4.42Å; F195-L337 HydrophobicContact CE1-CD1 3.81Å; F195-L337 HydrophobicContact CE1-CD2 4.18Å; I233-L337 HydrophobicContact CD1-CD1 3.54Å; I233-L337 HydrophobicContact CD1-CD2 4.33Å; I233-L337 HydrophobicContact CD1-CG 3.86Å; I233-L337 HydrophobicContact CG1-CD1 4.18Å; I233-L337 HydrophobicContact CG1-CD2 4.04Å; I233-L337 HydrophobicContact CG1-CG 4.08Å; I233-L337 HydrophobicContact CG2-CD2 4.18Å; I233-L337 HydrophobicContact CG2-CG 4Å; L245-L337 HydrophobicContact CD1-CD2 3.92Å; L245-L337 HydrophobicContact CD2-CD2 4.29Å; A333-L337 PolarHBondContact O-N 3.23Å; V334-L337 WeakPolarHBondContact O-CB 3.43Å; V334-L337 PolarHBondContact O-N 3.28Å; L337-Q339 VanDerWaalsContact C-N 3.34Å; L337-Q339 PolarHBondContact O-N 3.07Å; L337-R340 PolarHBondContact O-N 3.49Å; L337-M341 HydrophobicContact CB-CE 4.08Å; L337-M341 HydrophobicContact CD1-CE 4.28Å; L337-M341 HydrophobicContact CD2-CE 3.78Å; L337-M341 HydrophobicContact CG-CE 4.27Å; L337-M341 VanDerWaalsContact O-CB 3.29Å; L337-M341 WeakPolarHBondContact O-CB 3.35Å; L337-M341 WeakPolarHBondContact O-CG 3.09Å; L337-M341 PolarHBondContact O-N 2.03Å
338	Y	95.1	Very high	96.1	Very high	80 Å²	80	48.3 Å²	48.3	31%	0.314	23%	0.232	S	C	.	.	H	α-helix	trans	-58.4	-46	177	-171.7	-92.5	0	0	0	111.5	V334 Q335 I336 M341 R342 Y345	V334-Y338 PolarHBondContact O-N 3.19Å; Q335-Y338 WeakPolarHBondContact O-CB 3.4Å; Q335-Y338 PolarHBondContact O-N 2.95Å; I336-Y338 VanDerWaalsContact C-N 3.32Å; I336-Y338 PolarHBondContact O-N 2.56Å; Y338-M341 CarbonylContact O-C 3.59Å; Y338-M341 PolarHBondContact O-N 3.17Å; Y338-R342 PolarHBondContact O-N 2.69Å; Y338-R342 VanDerWaalsContact O-N 3.14Å; Y338-Y345 HydrophobicContact CD2-CD1 4.19Å; Y338-Y345 AromaticContact CD2-CD2 3.44Å; Y338-Y345 HydrophobicContact CD2-CD2 3.44Å; Y338-Y345 VanDerWaalsContact CD2-CD2 3.44Å; Y338-Y345 HydrophobicContact CD2-CE1 4.09Å; Y338-Y345 AromaticContact CD2-CE2 3.31Å; Y338-Y345 HydrophobicContact CD2-CE2 3.31Å; Y338-Y345 AromaticContact CD2-CG 3.9Å; Y338-Y345 HydrophobicContact CD2-CG 3.9Å; Y338-Y345 AromaticContact CD2-CZ 3.68Å; Y338-Y345 AromaticContact CE2-CD1 3.63Å; Y338-Y345 HydrophobicContact CE2-CD1 3.63Å; Y338-Y345 AromaticContact CE2-CD2 3.57Å; Y338-Y345 HydrophobicContact CE2-CD2 3.57Å; Y338-Y345 AromaticContact CE2-CE1 3.85Å; Y338-Y345 HydrophobicContact CE2-CE1 3.85Å; Y338-Y345 AromaticContact CE2-CE2 3.78Å; Y338-Y345 HydrophobicContact CE2-CE2 3.78Å; Y338-Y345 AromaticContact CE2-CG 3.49Å; Y338-Y345 HydrophobicContact CE2-CG 3.49Å; Y338-Y345 VanDerWaalsContact CE2-CG 3.49Å; Y338-Y345 AromaticContact CE2-CZ 3.94Å; Y338-Y345 HydrophobicContact CG-CD2 4.2Å; Y338-Y345 HydrophobicContact CG-CE2 4.19Å
339	Q	95.9	Very high	96.6	Very high	121 Å²	121	48.7 Å²	48.7	57%	0.565	23%	0.229	S	C	*	.	H	α-helix	trans	-62.9	-46.3	176.1	-69.7	175.2	-9.1	0	0	112.2	Q335 I336 L337 M341 R342	Q335-Q339 WeakPolarHBondContact O-CG 3.5Å; Q335-Q339 PolarHBondContact O-N 2.8Å; Q335-Q339 VanDerWaalsContact O-N 3.09Å; I336-Q339 PolarHBondContact O-N 2.83Å; L337-Q339 VanDerWaalsContact C-N 3.34Å; L337-Q339 PolarHBondContact O-N 3.07Å; Q339-M341 VanDerWaalsContact C-N 3.27Å; Q339-M341 PolarHBondContact O-N 3.24Å; Q339-R342 PolarHBondContact O-N 2.86Å
340	R	96.9	Very high	96.9	Very high	52 Å²	52	50.6 Å²	50.6	20%	0.196	24%	0.235	C	C	.	.	H	α-helix	trans	-63.7	-32.7	178.1	-70	177.2	-179.2	160.6	10.4	112.2	I233 N236 C240 N242 L245 I336 L337	I233-R340 PolarHBondContact O-NH1 2.8Å; I233-R340 PolarHBondContact O-NH2 3.12Å; N236-R340 PolarHBondContact OD1-NH2 3.15Å; C240-R340 PolarHBondContact O-NH1 3.23Å; N242-R340 PolarHBondContact ND2-O 3.42Å; L245-R340 HydrophobicContact CD1-CB 3.67Å; L245-R340 HydrophobicContact CD1-CG 4.44Å; I336-R340 HydrophobicContact CG2-CG 4.37Å; I336-R340 WeakPolarHBondContact O-CG 3.12Å; I336-R340 PolarHBondContact O-N 2.99Å; L337-R340 PolarHBondContact O-N 3.49Å
341	M	97.3	Very high	97.1	Very high	5 Å²	5	49 Å²	49	3%	0.025	22%	0.224	C	C	.	.	T	Hydrogen-bonded Turn	trans	-98	20.8	-179.6	-63	-165.2	-135.3	0	0	113.7	P191 V192 F195 L245 L337 Y338 Q339 Y343 E344 Y345	P191-M341 HydrophobicContact CB-SD 3.87Å; V192-M341 HydrophobicContact CG2-CE 4.2Å; F195-M341 HydrophobicContact CB-CE 3.78Å; F195-M341 HydrophobicContact CD1-CE 4.07Å; F195-M341 HydrophobicContact CG-CE 3.86Å; L245-M341 HydrophobicContact CB-CE 4.34Å; L245-M341 HydrophobicContact CB-CG 4.02Å; L245-M341 HydrophobicContact CB-SD 4.43Å; L245-M341 HydrophobicContact CD1-CE 4.07Å; L245-M341 HydrophobicContact CD1-CG 4.13Å; L245-M341 HydrophobicContact CD2-CE 3.78Å; L245-M341 HydrophobicContact CG-CE 4.26Å; L337-M341 HydrophobicContact CB-CE 4.08Å; L337-M341 HydrophobicContact CD1-CE 4.28Å; L337-M341 HydrophobicContact CD2-CE 3.78Å; L337-M341 HydrophobicContact CG-CE 4.27Å; L337-M341 VanDerWaalsContact O-CB 3.29Å; L337-M341 WeakPolarHBondContact O-CB 3.35Å; L337-M341 WeakPolarHBondContact O-CG 3.09Å; L337-M341 PolarHBondContact O-N 2.03Å; Y338-M341 CarbonylContact O-C 3.59Å; Y338-M341 PolarHBondContact O-N 3.17Å; Q339-M341 VanDerWaalsContact C-N 3.27Å; Q339-M341 PolarHBondContact O-N 3.24Å; M341-Y343 VanDerWaalsContact C-N 3.26Å; M341-Y343 PolarHBondContact O-N 3.5Å; M341-Y343 VanDerWaalsContact O-N 3.1Å; M341-E344 HydrophobicContact CB-CB 4.2Å; M341-E344 HydrophobicContact CB-CG 4.45Å; M341-E344 WeakPolarHBondContact O-CA 3.45Å; M341-E344 WeakPolarHBondContact O-CB 3.43Å; M341-E344 PolarHBondContact O-N 2.82Å; M341-Y345 HydrophobicContact CB-CD2 4.18Å; M341-Y345 HydrophobicContact CB-CE2 4.43Å; M341-Y345 PolarHBondContact O-N 3.31Å
342	R	97.6	Very high	97.2	Very high	137 Å²	137	47.7 Å²	47.7	52%	0.517	21%	0.209	S	C	.	.	H	α-helix	trans	-49.5	-43.4	-174.7	70	-178.9	-178.9	96.7	-8.5	114.3	Y338 Q339 Y345 E346	Y338-R342 PolarHBondContact O-N 2.69Å; Y338-R342 VanDerWaalsContact O-N 3.14Å; Q339-R342 PolarHBondContact O-N 2.86Å; R342-Y345 PolarHBondContact O-N 3.09Å; R342-E346 PolarHBondContact O-N 2.64Å
343	Y	98.4	Very high	97.3	Very high	40 Å²	40	47.2 Å²	47.2	16%	0.157	21%	0.207	C	C	.	.	H	α-helix	trans	-69.1	-39.1	179.4	-66.8	-60.4	0	0	0	111.9	I249 P262 L267 M341 Y345 E346 F347	I249-Y343 WeakPolarHBondContact CD1-O 3.47Å; P262-Y343 HydrophobicContact CB-CD2 3.94Å; P262-Y343 HydrophobicContact CB-CE2 4.37Å; L267-Y343 HydrophobicContact CD2-CD1 3.89Å; M341-Y343 VanDerWaalsContact C-N 3.26Å; M341-Y343 PolarHBondContact O-N 3.5Å; M341-Y343 VanDerWaalsContact O-N 3.1Å; Y343-Y345 VanDerWaalsContact C-N 3.29Å; Y343-Y345 PolarHBondContact O-N 3.16Å; Y343-E346 PolarHBondContact O-N 3.32Å; Y343-F347 PolarHBondContact O-N 3.49Å
344	E	98.4	Very high	97.3	Very high	4 Å²	4	51 Å²	51	2%	0.019	22%	0.224	C	C	.	.	H	α-helix	trans	-62.7	-39.5	176.1	-64.2	-75.6	-161.6	0	0	111.2	P191 F246 Y247 I248 I249 M341 F347 Y348	P191-E344 HydrophobicContact CB-CB 3.89Å; P191-E344 HydrophobicContact CG-CB 3.83Å; F246-E344 WeakPolarHBondContact CA-OE1 3.41Å; F246-E344 HydrophobicContact CD2-CG 4.27Å; Y247-E344 PolarHBondContact N-OE1 3.22Å; I248-E344 VanDerWaalsContact CB-OE2 3.27Å; I248-E344 WeakPolarHBondContact CB-OE2 3.28Å; I248-E344 PolarHBondContact N-OE1 2.97Å; I248-E344 PolarHBondContact N-OE2 3.01Å; I249-E344 WeakPolarHBondContact CG1-OE2 3.22Å; I249-E344 PolarHBondContact N-OE2 3.04Å; I249-E344 VanDerWaalsContact N-OE2 3.11Å; M341-E344 HydrophobicContact CB-CB 4.2Å; M341-E344 HydrophobicContact CB-CG 4.45Å; M341-E344 WeakPolarHBondContact O-CA 3.45Å; M341-E344 WeakPolarHBondContact O-CB 3.43Å; M341-E344 PolarHBondContact O-N 2.82Å; E344-F347 PolarHBondContact O-N 3.38Å; E344-Y348 VanDerWaalsContact O-CB 3.28Å; E344-Y348 WeakPolarHBondContact O-CB 3.46Å; E344-Y348 PolarHBondContact O-N 3.07Å
345	Y	98.5	Very high	97.4	Very high	18 Å²	18	50.3 Å²	50.3	7%	0.071	22%	0.22	C	C	.	.	H	α-helix	trans	-67	-42.8	174.5	-91.1	-70	0	0	0	112.2	D190 P191 V192 Y338 M341 R342 Y343 F347 Y348 H349	D190-Y345 PolarHBondContact OD1-OH 2.88Å; D190-Y345 WeakPolarHBondContact OD2-CE1 3.11Å; D190-Y345 PolarHBondContact OD2-OH 2.92Å; P191-Y345 HydrophobicContact CB-CD2 4.33Å; P191-Y345 HydrophobicContact CB-CE2 4.05Å; P191-Y345 HydrophobicContact CG-CD1 4.13Å; P191-Y345 HydrophobicContact CG-CD2 4.19Å; P191-Y345 HydrophobicContact CG-CE1 4.13Å; P191-Y345 HydrophobicContact CG-CE2 4.19Å; P191-Y345 HydrophobicContact CG-CG 4.14Å; V192-Y345 WeakPolarHBondContact CB-OH 3.18Å; V192-Y345 HydrophobicContact CG2-CE2 3.87Å; V192-Y345 VanDerWaalsContact CG2-OH 3.25Å; V192-Y345 WeakPolarHBondContact CG2-OH 3.26Å; Y338-Y345 HydrophobicContact CD2-CD1 4.19Å; Y338-Y345 AromaticContact CD2-CD2 3.44Å; Y338-Y345 HydrophobicContact CD2-CD2 3.44Å; Y338-Y345 VanDerWaalsContact CD2-CD2 3.44Å; Y338-Y345 HydrophobicContact CD2-CE1 4.09Å; Y338-Y345 AromaticContact CD2-CE2 3.31Å; Y338-Y345 HydrophobicContact CD2-CE2 3.31Å; Y338-Y345 AromaticContact CD2-CG 3.9Å; Y338-Y345 HydrophobicContact CD2-CG 3.9Å; Y338-Y345 AromaticContact CD2-CZ 3.68Å; Y338-Y345 AromaticContact CE2-CD1 3.63Å; Y338-Y345 HydrophobicContact CE2-CD1 3.63Å; Y338-Y345 AromaticContact CE2-CD2 3.57Å; Y338-Y345 HydrophobicContact CE2-CD2 3.57Å; Y338-Y345 AromaticContact CE2-CE1 3.85Å; Y338-Y345 HydrophobicContact CE2-CE1 3.85Å; Y338-Y345 AromaticContact CE2-CE2 3.78Å; Y338-Y345 HydrophobicContact CE2-CE2 3.78Å; Y338-Y345 AromaticContact CE2-CG 3.49Å; Y338-Y345 HydrophobicContact CE2-CG 3.49Å; Y338-Y345 VanDerWaalsContact CE2-CG 3.49Å; Y338-Y345 AromaticContact CE2-CZ 3.94Å; Y338-Y345 HydrophobicContact CG-CD2 4.2Å; Y338-Y345 HydrophobicContact CG-CE2 4.19Å; M341-Y345 HydrophobicContact CB-CD2 4.18Å; M341-Y345 HydrophobicContact CB-CE2 4.43Å; M341-Y345 PolarHBondContact O-N 3.31Å; R342-Y345 PolarHBondContact O-N 3.09Å; Y343-Y345 VanDerWaalsContact C-N 3.29Å; Y343-Y345 PolarHBondContact O-N 3.16Å; Y345-F347 VanDerWaalsContact C-N 3.3Å; Y345-F347 PolarHBondContact O-N 3.14Å; Y345-Y348 PolarHBondContact O-N 3.28Å; Y345-H349 AromaticContact CD1-NE2 3.71Å; Y345-H349 WeakPolarHBondContact O-CB 3.44Å; Y345-H349 PolarHBondContact O-CD2 2.82Å; Y345-H349 PolarHBondContact O-N 3.2Å
346	E	98.6	Very high	97.5	Very high	84 Å²	84	48.3 Å²	48.3	39%	0.393	21%	0.21	S	C	.	.	H	α-helix	trans	-59	-43.5	175.1	-162.5	-173.1	138.7	0	0	111.5	L267 K271 R342 Y343 Y350	L267-E346 HydrophobicContact CD2-CB 4.1Å; L267-E346 HydrophobicContact CD2-CG 4.08Å; L267-E346 VanDerWaalsContact CD2-OE1 3.29Å; L267-E346 WeakPolarHBondContact CD2-OE1 3.45Å; L267-E346 WeakPolarHBondContact CD2-OE2 3.47Å; K271-E346 IonicContact NZ-OE1 3.54Å; K271-E346 PolarHBondContact NZ-OE1 3.23Å; R342-E346 PolarHBondContact O-N 2.64Å; Y343-E346 PolarHBondContact O-N 3.32Å; E346-Y350 WeakPolarHBondContact O-CB 3.36Å; E346-Y350 PolarHBondContact O-N 2.84Å
347	F	98.8	Very high	97.4	Very high	0 Å²	0	49.8 Å²	49.8	0%	0	22%	0.218	C	C	.	.	H	α-helix	trans	-65	-44.9	174.2	-174.6	-107.8	0	0	0	112.7	I188 I248 I249 F252 L267 A270 K271 V274 Y343 E344 Y345 H349 Y350 V351	I188-F347 HydrophobicContact CD1-CE1 4.49Å; I248-F347 HydrophobicContact CG2-CD1 4.12Å; I248-F347 HydrophobicContact CG2-CE1 4.02Å; I249-F347 HydrophobicContact CD1-CB 3.86Å; I249-F347 HydrophobicContact CD1-CG 4.46Å; I249-F347 HydrophobicContact CG1-CB 3.64Å; I249-F347 HydrophobicContact CG1-CD1 3.99Å; I249-F347 HydrophobicContact CG1-CD2 4.31Å; I249-F347 HydrophobicContact CG1-CG 3.71Å; F252-F347 HydrophobicContact CB-CE1 4.48Å; F252-F347 HydrophobicContact CB-CE2 4.42Å; F252-F347 HydrophobicContact CB-CZ 3.79Å; F252-F347 HydrophobicContact CD1-CZ 4Å; F252-F347 AromaticContact CD2-CE1 3.47Å; F252-F347 HydrophobicContact CD2-CE1 3.47Å; F252-F347 VanDerWaalsContact CD2-CE1 3.47Å; F252-F347 AromaticContact CD2-CZ 3.55Å; F252-F347 HydrophobicContact CD2-CZ 3.55Å; F252-F347 HydrophobicContact CE1-CZ 4.49Å; F252-F347 AromaticContact CE2-CE1 3.75Å; F252-F347 HydrophobicContact CE2-CE1 3.75Å; F252-F347 HydrophobicContact CE2-CZ 4.1Å; F252-F347 AromaticContact CG-CE1 3.95Å; F252-F347 HydrophobicContact CG-CE1 3.95Å; F252-F347 AromaticContact CG-CZ 3.49Å; F252-F347 HydrophobicContact CG-CZ 3.49Å; F252-F347 VanDerWaalsContact CG-CZ 3.49Å; F252-F347 HydrophobicContact CZ-CE1 4.42Å; L267-F347 HydrophobicContact CD1-CB 3.57Å; L267-F347 HydrophobicContact CD1-CD2 4.04Å; L267-F347 HydrophobicContact CD1-CG 4.26Å; A270-F347 HydrophobicContact CB-CD2 4.08Å; A270-F347 HydrophobicContact CB-CE2 3.69Å; A270-F347 HydrophobicContact CB-CZ 4.29Å; K271-F347 HydrophobicContact CG-CD2 4.17Å; K271-F347 HydrophobicContact CG-CE2 4.49Å; V274-F347 HydrophobicContact CG2-CE2 3.99Å; V274-F347 HydrophobicContact CG2-CZ 3.76Å; Y343-F347 PolarHBondContact O-N 3.49Å; E344-F347 PolarHBondContact O-N 3.38Å; Y345-F347 VanDerWaalsContact C-N 3.3Å; Y345-F347 PolarHBondContact O-N 3.14Å; F347-H349 PolarHBondContact O-N 3.39Å; F347-Y350 WeakPolarHBondContact O-CB 3.5Å; F347-Y350 PolarHBondContact O-N 3.15Å; F347-V351 HydrophobicContact CD1-CG2 4.36Å; F347-V351 HydrophobicContact CE1-CG2 3.9Å; F347-V351 HydrophobicContact CE2-CG2 4.15Å; F347-V351 HydrophobicContact CZ-CG2 3.78Å; F347-V351 WeakPolarHBondContact O-CG2 3.36Å; F347-V351 PolarHBondContact O-N 3.4Å
348	Y	98.8	Very high	97.2	Very high	9 Å²	9	51.6 Å²	51.6	4%	0.035	23%	0.228	C	C	.	.	H	α-helix	trans	-60.5	-45.2	178.2	174.1	-97.1	0	0	0	111.6	I188 R189 D190 I283 E285 E344 Y345 V351 K352	I188-Y348 HydrophobicContact CD1-CD2 3.71Å; I188-Y348 HydrophobicContact CD1-CE2 4.48Å; I188-Y348 HydrophobicContact CD1-CG 4.48Å; I188-Y348 HydrophobicContact CG1-CD2 4.09Å; I188-Y348 HydrophobicContact CG1-CE2 4.45Å; R189-Y348 VanDerWaalsContact C-CE2 3.48Å; D190-Y348 VanDerWaalsContact N-CE2 3.32Å; I283-Y348 HydrophobicContact CB-CE2 4.3Å; I283-Y348 HydrophobicContact CG2-CE2 3.95Å; E285-Y348 VanDerWaalsContact CD-OH 3.29Å; E285-Y348 PolarHBondContact OE2-OH 3.4Å; E344-Y348 VanDerWaalsContact O-CB 3.28Å; E344-Y348 WeakPolarHBondContact O-CB 3.46Å; E344-Y348 PolarHBondContact O-N 3.07Å; Y345-Y348 PolarHBondContact O-N 3.28Å; Y348-V351 PolarHBondContact O-N 2.96Å; Y348-K352 HydrophobicContact CE1-CD 4.06Å; Y348-K352 VanDerWaalsContact O-CB 3.27Å; Y348-K352 WeakPolarHBondContact O-CB 3.28Å; Y348-K352 PolarHBondContact O-N 3.36Å
349	H	98.6	Very high	97.1	Very high	77 Å²	77	47.9 Å²	47.9	36%	0.356	21%	0.213	S	C	.	.	H	α-helix	trans	-65.1	-41.9	177.3	-70.9	-51.6	0	0	0	111.8	Y345 F347 V351 K352 E353	Y345-H349 AromaticContact CD1-NE2 3.71Å; Y345-H349 WeakPolarHBondContact O-CB 3.44Å; Y345-H349 PolarHBondContact O-CD2 2.82Å; Y345-H349 PolarHBondContact O-N 3.2Å; F347-H349 PolarHBondContact O-N 3.39Å; H349-V351 PolarHBondContact O-N 3.14Å; H349-K352 PolarHBondContact O-N 2.8Å; H349-E353 WeakPolarHBondContact O-CG 3.24Å; H349-E353 PolarHBondContact O-N 3.3Å
350	Y	98.6	Very high	97	Very high	46 Å²	46	48.6 Å²	48.6	18%	0.18	21%	0.211	C	C	.	.	H	α-helix	trans	-55.4	-52.5	172.6	174.6	-95.1	0	0	0	111.8	K271 V274 N275 E346 F347 K352 E353 Q354	K271-Y350 HydrophobicContact CB-CD1 4.35Å; K271-Y350 HydrophobicContact CB-CE1 4.03Å; K271-Y350 HydrophobicContact CD-CD1 4.44Å; K271-Y350 HydrophobicContact CD-CD2 4.16Å; K271-Y350 HydrophobicContact CD-CE2 4.42Å; K271-Y350 HydrophobicContact CD-CG 4.16Å; K271-Y350 HydrophobicContact CG-CD1 3.83Å; K271-Y350 HydrophobicContact CG-CD2 4.41Å; K271-Y350 HydrophobicContact CG-CE1 4.02Å; K271-Y350 HydrophobicContact CG-CG 4.04Å; V274-Y350 HydrophobicContact CG1-CE1 4.5Å; N275-Y350 PolarHBondContact ND2-OH 3.2Å; N275-Y350 PolarHBondContact OD1-OH 2.96Å; E346-Y350 WeakPolarHBondContact O-CB 3.36Å; E346-Y350 PolarHBondContact O-N 2.84Å; F347-Y350 WeakPolarHBondContact O-CB 3.5Å; F347-Y350 PolarHBondContact O-N 3.15Å; Y350-K352 VanDerWaalsContact C-N 3.35Å; Y350-K352 PolarHBondContact O-N 3.3Å; Y350-E353 PolarHBondContact O-N 2.98Å; Y350-Q354 HydrophobicContact CD1-CG 4.44Å; Y350-Q354 HydrophobicContact CE1-CG 3.98Å; Y350-Q354 HydrophobicContact CE2-CG 4.29Å; Y350-Q354 WeakPolarHBondContact O-CG 3.48Å; Y350-Q354 PolarHBondContact O-N 3.46Å
351	V	98.5	Very high	96.7	Very high	1 Å²	1	54.3 Å²	54.3	1%	0.006	24%	0.237	C	C	.	.	H	α-helix	trans	-61.6	-43.6	178.8	167.3	0	0	0	0	111.4	I188 V281 I283 F347 Y348 H349 E353 Q354 F355	I188-V351 HydrophobicContact CD1-CB 3.66Å; I188-V351 HydrophobicContact CD1-CG1 3.56Å; I188-V351 HydrophobicContact CD1-CG2 3.98Å; I188-V351 HydrophobicContact CG1-CG1 4.01Å; V281-V351 HydrophobicContact CB-CG1 3.92Å; V281-V351 HydrophobicContact CG1-CG1 3.53Å; V281-V351 HydrophobicContact CG1-CG2 4.27Å; I283-V351 HydrophobicContact CG2-CG1 4.45Å; F347-V351 HydrophobicContact CD1-CG2 4.36Å; F347-V351 HydrophobicContact CE1-CG2 3.9Å; F347-V351 HydrophobicContact CE2-CG2 4.15Å; F347-V351 HydrophobicContact CZ-CG2 3.78Å; F347-V351 WeakPolarHBondContact O-CG2 3.36Å; F347-V351 PolarHBondContact O-N 3.4Å; Y348-V351 PolarHBondContact O-N 2.96Å; H349-V351 PolarHBondContact O-N 3.14Å; V351-E353 VanDerWaalsContact C-N 3.34Å; V351-E353 PolarHBondContact O-N 2.94Å; V351-Q354 PolarHBondContact O-N 3.35Å; V351-F355 WeakPolarHBondContact O-CB 3.48Å; V351-F355 PolarHBondContact O-N 2.96Å
352	K	97.9	Very high	96.3	Very high	65 Å²	65	58 Å²	58	28%	0.283	25%	0.253	S	S	.	.	H	α-helix	trans	-59.6	-43.8	178	179.8	166.3	-174	172.6	0	111.8	I283 Y348 H349 Y350 F355 H356	I283-K352 HydrophobicContact CD1-CD 3.95Å; I283-K352 HydrophobicContact CD1-CG 3.97Å; I283-K352 HydrophobicContact CG2-CB 4.26Å; Y348-K352 HydrophobicContact CE1-CD 4.06Å; Y348-K352 VanDerWaalsContact O-CB 3.27Å; Y348-K352 WeakPolarHBondContact O-CB 3.28Å; Y348-K352 PolarHBondContact O-N 3.36Å; H349-K352 PolarHBondContact O-N 2.8Å; Y350-K352 VanDerWaalsContact C-N 3.35Å; Y350-K352 PolarHBondContact O-N 3.3Å; K352-F355 PolarHBondContact O-N 2.74Å; K352-H356 VanDerWaalsContact CE-CE1 3.47Å; K352-H356 WeakPolarHBondContact CE-CE1 3.36Å; K352-H356 WeakPolarHBondContact O-CB 3.26Å; K352-H356 VanDerWaalsContact O-CG 3.28Å; K352-H356 PolarHBondContact O-N 2.66Å
353	E	97.1	Very high	95.9	Very high	122 Å²	122	54.5 Å²	54.5	57%	0.57	26%	0.26	S	S	*	.	H	α-helix	trans	-63.6	-45.5	176.1	-78.4	-179.2	-166	0	0	112.2	H349 Y350 V351 F355 H356 L357	H349-E353 WeakPolarHBondContact O-CG 3.24Å; H349-E353 PolarHBondContact O-N 3.3Å; Y350-E353 PolarHBondContact O-N 2.98Å; V351-E353 VanDerWaalsContact C-N 3.34Å; V351-E353 PolarHBondContact O-N 2.94Å; E353-F355 VanDerWaalsContact C-N 3.34Å; E353-F355 PolarHBondContact O-N 2.77Å; E353-H356 PolarHBondContact O-N 3.24Å; E353-L357 WeakPolarHBondContact O-CB 3.12Å; E353-L357 VanDerWaalsContact O-CG 3.3Å; E353-L357 WeakPolarHBondContact O-CG 3.47Å; E353-L357 PolarHBondContact O-N 3.36Å
354	Q	96.2	Very high	95.3	Very high	79 Å²	79	53.5 Å²	53.5	37%	0.369	26%	0.257	S	S	.	.	H	α-helix	trans	-60.8	-43.7	176.1	-65.9	-51	-46.4	0	0	111.7	Y350 V351 L357 L358	Y350-Q354 HydrophobicContact CD1-CG 4.44Å; Y350-Q354 HydrophobicContact CE1-CG 3.98Å; Y350-Q354 HydrophobicContact CE2-CG 4.29Å; Y350-Q354 WeakPolarHBondContact O-CG 3.48Å; Y350-Q354 PolarHBondContact O-N 3.46Å; V351-Q354 PolarHBondContact O-N 3.35Å; Q354-L357 PolarHBondContact O-N 3.49Å; Q354-L358 WeakPolarHBondContact O-CB 3.08Å; Q354-L358 PolarHBondContact O-N 3.38Å
355	F	96.4	Very high	94.3	Very high	2 Å²	2	62.1 Å²	62.1	1%	0.009	30%	0.295	C	S	.	.	H	α-helix	trans	-61.2	-45.7	176	176.8	-116	0	0	0	111.9	L280 I283 E286 D289 V290 L293 V351 K352 E353 L358 K359	L280-F355 HydrophobicContact CD1-CD2 3.99Å; L280-F355 HydrophobicContact CD1-CE2 4.34Å; I283-F355 HydrophobicContact CG1-CD1 4.2Å; I283-F355 HydrophobicContact CG1-CE1 4.24Å; E286-F355 HydrophobicContact CB-CE1 3.92Å; D289-F355 HydrophobicContact CB-CZ 3.91Å; V290-F355 HydrophobicContact CB-CE2 4.41Å; V290-F355 HydrophobicContact CB-CZ 4.4Å; V290-F355 HydrophobicContact CG2-CE1 4.27Å; V290-F355 HydrophobicContact CG2-CE2 3.68Å; V290-F355 HydrophobicContact CG2-CZ 3.48Å; V290-F355 VanDerWaalsContact CG2-CZ 3.48Å; L293-F355 HydrophobicContact CD1-CD2 4.27Å; L293-F355 HydrophobicContact CD1-CE2 3.76Å; V351-F355 WeakPolarHBondContact O-CB 3.48Å; V351-F355 PolarHBondContact O-N 2.96Å; K352-F355 PolarHBondContact O-N 2.74Å; E353-F355 VanDerWaalsContact C-N 3.34Å; E353-F355 PolarHBondContact O-N 2.77Å; F355-L358 WeakPolarHBondContact O-CB 3.3Å; F355-L358 PolarHBondContact O-N 3.12Å; F355-K359 HydrophobicContact CD1-CD 4.02Å; F355-K359 HydrophobicContact CE1-CD 3.52Å; F355-K359 HydrophobicContact CE1-CG 4.26Å; F355-K359 HydrophobicContact CE2-CD 4.41Å; F355-K359 HydrophobicContact CE2-CG 4.32Å; F355-K359 HydrophobicContact CZ-CD 3.74Å; F355-K359 HydrophobicContact CZ-CG 4.11Å; F355-K359 WeakPolarHBondContact O-CG 3.46Å; F355-K359 PolarHBondContact O-N 3.42Å
356	H	96.3	Very high	92.4	Very high	36 Å²	36	62.6 Å²	62.6	17%	0.167	30%	0.301	C	S	.	.	H	α-helix	trans	-66.6	-36.7	177.4	-73.8	-174.4	0	0	0	113.1	E286 K352 E353 L358 K359 R360	E286-H356 VanDerWaalsContact CD-NE2 3.31Å; E286-H356 IonicContact OE1-CD2 3.88Å; E286-H356 IonicContact OE1-CE1 3.42Å; E286-H356 PolarHBondContact OE1-CE1 2.89Å; E286-H356 IonicContact OE1-NE2 2.72Å; E286-H356 PolarHBondContact OE1-NE2 3.35Å; E286-H356 IonicContact OE2-CD2 3.65Å; E286-H356 IonicContact OE2-NE2 3.12Å; E286-H356 PolarHBondContact OE2-NE2 2.72Å; E286-H356 VanDerWaalsContact OE2-NE2 3.12Å; K352-H356 VanDerWaalsContact CE-CE1 3.47Å; K352-H356 WeakPolarHBondContact CE-CE1 3.36Å; K352-H356 WeakPolarHBondContact O-CB 3.26Å; K352-H356 VanDerWaalsContact O-CG 3.28Å; K352-H356 PolarHBondContact O-N 2.66Å; E353-H356 PolarHBondContact O-N 3.24Å; H356-L358 VanDerWaalsContact C-N 3.32Å; H356-K359 PolarHBondContact O-N 3.04Å; H356-R360 WeakPolarHBondContact O-CG 3.3Å; H356-R360 PolarHBondContact O-N 3.03Å
357	L	94.4	Very high	90.5	Very high	67 Å²	67	66.9 Å²	66.9	35%	0.351	32%	0.32	S	S	.	.	H	α-helix	trans	-60.3	-44	171.3	-77	166.2	0	0	0	111	E353 Q354 R360 K361	E353-L357 WeakPolarHBondContact O-CB 3.12Å; E353-L357 VanDerWaalsContact O-CG 3.3Å; E353-L357 WeakPolarHBondContact O-CG 3.47Å; E353-L357 PolarHBondContact O-N 3.36Å; Q354-L357 PolarHBondContact O-N 3.49Å; L357-R360 PolarHBondContact O-N 3.27Å; L357-K361 WeakPolarHBondContact O-CG 3.28Å; L357-K361 PolarHBondContact O-N 3.06Å
358	L	93.2	Very high	88	Confident	38 Å²	38	71.9 Å²	71.9	20%	0.199	35%	0.351	C	S	.	.	H	α-helix	trans	-64.5	-46.5	177.6	-167.2	62.9	0	0	0	111.6	L280 L293 F297 Q354 F355 H356 R360 K361 F362	L280-L358 HydrophobicContact CD1-CD2 3.55Å; L293-L358 HydrophobicContact CD1-CD2 4.23Å; L293-L358 HydrophobicContact CD1-CG 4.31Å; F297-L358 HydrophobicContact CE2-CD2 3.65Å; F297-L358 HydrophobicContact CE2-CG 4.33Å; F297-L358 HydrophobicContact CZ-CD1 3.95Å; F297-L358 HydrophobicContact CZ-CD2 3.75Å; F297-L358 HydrophobicContact CZ-CG 3.96Å; Q354-L358 WeakPolarHBondContact O-CB 3.08Å; Q354-L358 PolarHBondContact O-N 3.38Å; F355-L358 WeakPolarHBondContact O-CB 3.3Å; F355-L358 PolarHBondContact O-N 3.12Å; H356-L358 VanDerWaalsContact C-N 3.32Å; L358-R360 VanDerWaalsContact C-N 3.28Å; L358-R360 PolarHBondContact O-N 2.99Å; L358-K361 WeakPolarHBondContact O-CB 3.37Å; L358-K361 PolarHBondContact O-N 3.48Å; L358-K361 VanDerWaalsContact O-N 3.11Å; L358-F362 HydrophobicContact CD1-CD2 3.87Å; L358-F362 HydrophobicContact CD1-CE2 3.64Å; L358-F362 HydrophobicContact CG-CD2 4.15Å; L358-F362 HydrophobicContact CG-CE2 4.34Å; L358-F362 WeakPolarHBondContact O-CD2 3.3Å; L358-F362 PolarHBondContact O-N 3.03Å; L358-F362 VanDerWaalsContact O-N 3.08Å
359	K	93.1	Very high	85.3	Confident	2 Å²	2	76.5 Å²	76.5	1%	0.009	38%	0.384	C	S	.	.	H	α-helix	trans	-50.8	-48.1	173.2	-75.5	179.1	66.6	176.2	0	112	E286 D289 L293 F355 H356 F362 G363 L364	E286-K359 IonicContact OE2-NZ 2.56Å; E286-K359 PolarHBondContact OE2-NZ 2.94Å; D289-K359 HydrophobicContact CB-CD 4.12Å; D289-K359 VanDerWaalsContact OD2-CE 3.26Å; D289-K359 WeakPolarHBondContact OD2-CE 3.34Å; D289-K359 IonicContact OD2-NZ 2.64Å; D289-K359 PolarHBondContact OD2-NZ 3.19Å; L293-K359 HydrophobicContact CD1-CG 4.01Å; F355-K359 HydrophobicContact CD1-CD 4.02Å; F355-K359 HydrophobicContact CE1-CD 3.52Å; F355-K359 HydrophobicContact CE1-CG 4.26Å; F355-K359 HydrophobicContact CE2-CD 4.41Å; F355-K359 HydrophobicContact CE2-CG 4.32Å; F355-K359 HydrophobicContact CZ-CD 3.74Å; F355-K359 HydrophobicContact CZ-CG 4.11Å; F355-K359 WeakPolarHBondContact O-CG 3.46Å; F355-K359 PolarHBondContact O-N 3.42Å; H356-K359 PolarHBondContact O-N 3.04Å; K359-F362 CarbonylContact O-C 3.46Å; K359-F362 PolarHBondContact O-N 3.36Å; K359-G363 PolarHBondContact O-N 3.42Å; K359-L364 HydrophobicContact CB-CB 4.06Å; K359-L364 HydrophobicContact CG-CB 4.42Å; K359-L364 HydrophobicContact CG-CD1 4.33Å; K359-L364 PolarHBondContact O-N 2.8Å
360	R	92.7	Very high	82.2	Confident	137 Å²	137	81.5 Å²	81.5	52%	0.517	41%	0.405	S	S	.	.	H	α-helix	trans	-61.4	-45.1	177.9	-73.6	-170.5	-69.3	-102.7	5.1	112.5	H356 L357 L358 F362 G363	H356-R360 WeakPolarHBondContact O-CG 3.3Å; H356-R360 PolarHBondContact O-N 3.03Å; L357-R360 PolarHBondContact O-N 3.27Å; L358-R360 VanDerWaalsContact C-N 3.28Å; L358-R360 PolarHBondContact O-N 2.99Å; R360-F362 PolarHBondContact O-N 3.21Å; R360-G363 PolarHBondContact O-N 3.33Å
361	K	91.8	Very high	79.2	Confident	171 Å²	171	84.6 Å²	84.6	74%	0.743	43%	0.431	S	S	*	.	H	α-helix	trans	-58.5	-31.4	176.5	-72.7	178.2	179.2	-178.1	0	112.5	L357 L358	L357-K361 WeakPolarHBondContact O-CG 3.28Å; L357-K361 PolarHBondContact O-N 3.06Å; L358-K361 WeakPolarHBondContact O-CB 3.37Å; L358-K361 PolarHBondContact O-N 3.48Å; L358-K361 VanDerWaalsContact O-N 3.11Å
362	F	89.2	Confident	76.1	Confident	82 Å²	82	87.5 Å²	87.5	36%	0.36	45%	0.449	S	S	.	.	T	Hydrogen-bonded Turn	trans	-95.3	11.7	179.4	-79.5	-85.2	0	0	0	113.8	L293 R296 F297 L358 K359 R360 L364	L293-F362 HydrophobicContact CD2-CB 3.88Å; L293-F362 HydrophobicContact CD2-CD2 4.3Å; L293-F362 HydrophobicContact CD2-CG 4.02Å; R296-F362 PolarHBondContact NH1-O 3.18Å; F297-F362 HydrophobicContact CD1-CZ 4.45Å; F297-F362 HydrophobicContact CE1-CD2 4.34Å; F297-F362 AromaticContact CE1-CE1 3.89Å; F297-F362 HydrophobicContact CE1-CE1 3.89Å; F297-F362 AromaticContact CE1-CE2 3.59Å; F297-F362 HydrophobicContact CE1-CE2 3.59Å; F297-F362 AromaticContact CE1-CZ 3.36Å; F297-F362 HydrophobicContact CE1-CZ 3.36Å; F297-F362 HydrophobicContact CZ-CD2 4.07Å; F297-F362 AromaticContact CZ-CE2 3.63Å; F297-F362 HydrophobicContact CZ-CE2 3.63Å; F297-F362 AromaticContact CZ-CZ 3.9Å; F297-F362 HydrophobicContact CZ-CZ 3.9Å; L358-F362 HydrophobicContact CD1-CD2 3.87Å; L358-F362 HydrophobicContact CD1-CE2 3.64Å; L358-F362 HydrophobicContact CG-CD2 4.15Å; L358-F362 HydrophobicContact CG-CE2 4.34Å; L358-F362 WeakPolarHBondContact O-CD2 3.3Å; L358-F362 PolarHBondContact O-N 3.03Å; L358-F362 VanDerWaalsContact O-N 3.08Å; K359-F362 CarbonylContact O-C 3.46Å; K359-F362 PolarHBondContact O-N 3.36Å; R360-F362 PolarHBondContact O-N 3.21Å; F362-L364 PolarHBondContact O-N 3.32Å
363	G	87.7	Confident	73.4	Confident	65 Å²	65	93.3 Å²	93.3	67%	0.67	48%	0.483	S	S	*	.	T	Hydrogen-bonded Turn	trans	68.9	16.6	176.6	0	0	0	0	0	114.5	K359 R360	K359-G363 PolarHBondContact O-N 3.42Å; R360-G363 PolarHBondContact O-N 3.33Å
364	L	86.2	Confident	70.5	Confident	19 Å²	19	97.2 Å²	97.2	10%	0.099	49%	0.492	C	S	.	.			trans	-80.9	126.3	173.4	-58.6	-178.4	0	0	0	108.9	L292 L293 K359 F362 S366	L292-L364 HydrophobicContact CD2-CD1 4.01Å; L292-L364 HydrophobicContact CD2-CD2 3.43Å; L292-L364 VanDerWaalsContact CD2-CD2 3.43Å; L292-L364 HydrophobicContact CD2-CG 4.39Å; L292-L364 HydrophobicContact CG-CD1 4.44Å; L292-L364 HydrophobicContact CG-CD2 4.4Å; L293-L364 HydrophobicContact CD1-CD1 4.4Å; L293-L364 HydrophobicContact CD2-CD1 3.69Å; L293-L364 HydrophobicContact CG-CD1 3.79Å; K359-L364 HydrophobicContact CB-CB 4.06Å; K359-L364 HydrophobicContact CG-CB 4.42Å; K359-L364 HydrophobicContact CG-CD1 4.33Å; K359-L364 PolarHBondContact O-N 2.8Å; F362-L364 PolarHBondContact O-N 3.32Å; L364-S366 PolarHBondContact O-N 3.45Å; L364-S366 VanDerWaalsContact O-N 3.14Å
365	K	76.7	Confident	67.5	Low	184 Å²	184	97 Å²	97	80%	0.8	50%	0.498	S	S	*	.			trans	-65.7	115	176.5	-67.5	-176.8	-179	178.7	0	108.3	H367	K365-H367 PolarHBondContact O-N 2.86Å
366	S	60.5	Low	64.7	Low	28 Å²	28	104 Å²	104	20%	0.196	53%	0.53	C	S	.	.			trans	-66	116.8	158.8	50	0	0	0	0	106.6	L364 V368	L364-S366 PolarHBondContact O-N 3.45Å; L364-S366 VanDerWaalsContact O-N 3.14Å; S366-V368 PolarHBondContact O-N 3.25Å; S366-V368 WeakPolarHBondContact OG-CG2 3.38Å
367	H	57.1	Low	62.2	Low	175 Å²	175	106.6 Å²	106.6	81%	0.81	54%	0.541	S	S	*	.			trans	-61.2	92.9	158.8	-78.9	-85.5	0	0	0	106	K365 S369	K365-H367 PolarHBondContact O-N 2.86Å; H367-S369 PolarHBondContact O-N 3.06Å
368	V	45.9	Very low	59.4	Low	105 Å²	105	111.9 Å²	111.9	64%	0.636	56%	0.562	S	S	*	*			trans	-72.7	84.1	173.2	-175.4	0	0	0	0	105.6	S366 K370	S366-V368 PolarHBondContact O-N 3.25Å; S366-V368 WeakPolarHBondContact OG-CG2 3.38Å; V368-K370 PolarHBondContact O-N 3.41Å
369	S	43	Very low	56.8	Low	106 Å²	106	114.1 Å²	114.1	74%	0.741	57%	0.573	S	S	*	*			trans	-57.7	117.2	147.1	29.5	0	0	0	0	105.1	H367	H367-S369 PolarHBondContact O-N 3.06Å
370	K	33	Very low	53.9	Low	181 Å²	181	117.8 Å²	117.8	79%	0.787	60%	0.597	S	S	*	*			trans	-41.3	135.7	176	-77.5	176.3	175.9	176.7	0	108.8	V368 P372	V368-K370 PolarHBondContact O-N 3.41Å; K370-P372 WeakPolarHBondContact O-CD 3.44Å
371	P	35.6	Very low	50.9	Low	111 Å²	111	116.9 Å²	116.9	72%	0.721	61%	0.607	S	S	*	*			trans	-56.4	120.7	173	24.4	-30.5	0	0	0	106.3	L373	P371-L373 PolarHBondContact O-N 3.43Å
372	P	34.8	Very low	48.1	Very low	62 Å²	62	113.8 Å²	113.8	40%	0.403	60%	0.604	S	S	.	*			trans	-70.1	134.8	-177.2	32	-35	0	0	0	107.4	K370 R374 H376	K370-P372 WeakPolarHBondContact O-CD 3.44Å; P372-R374 CarbonylContact C-O 3.48Å; P372-R374 WeakPolarHBondContact CB-O 3.39Å; P372-R374 WeakPolarHBondContact CG-O 3.41Å; P372-R374 PolarHBondContact O-N 3.04Å; P372-H376 HydrophobicContact CB-CB 4.07Å; P372-H376 WeakPolarHBondContact CB-CD2 3.42Å; P372-H376 HydrophobicContact CG-CB 4.08Å
373	L	40.2	Very low	45.4	Very low	187 Å²	187	117.1 Å²	117.1	98%	0.979	63%	0.625	S	S	*	*	S	Bend	trans	-60.8	-1.8	178.1	-83	143.4	0	0	0	113	P371	P371-L373 PolarHBondContact O-N 3.43Å
374	R	35.6	Very low	42.7	Very low	204 Å²	204	121.8 Å²	121.8	77%	0.77	63%	0.629	S	S	*	*	S	Bend	trans	-147.9	153.7	170.7	-63.9	-175	-177.8	176.9	-0.5	107.6	P372 H376	P372-R374 CarbonylContact C-O 3.48Å; P372-R374 WeakPolarHBondContact CB-O 3.39Å; P372-R374 WeakPolarHBondContact CG-O 3.41Å; P372-R374 PolarHBondContact O-N 3.04Å; R374-H376 PolarHBondContact O-N 3.09Å
375	P	34.4	Very low	40.4	Very low	75 Å²	75	124.4 Å²	124.4	49%	0.487	65%	0.646	S	S	.	*			trans	-54.1	104.1	170.2	21.5	-30.4	0	0	0	108.8	F377	P375-F377 VanDerWaalsContact C-N 3.3Å; P375-F377 HydrophobicContact CG-CZ 4.27Å; P375-F377 WeakPolarHBondContact O-CD2 3.46Å; P375-F377 PolarHBondContact O-N 2.87Å
376	H	37	Very low	38.4	Very low	148 Å²	148	123.9 Å²	123.9	69%	0.685	65%	0.646	S	S	*	*			trans	-70.9	100.7	165.7	-88.2	-46.8	0	0	0	105.1	P372 R374 F378	P372-H376 HydrophobicContact CB-CB 4.07Å; P372-H376 WeakPolarHBondContact CB-CD2 3.42Å; P372-H376 HydrophobicContact CG-CB 4.08Å; R374-H376 PolarHBondContact O-N 3.09Å; H376-F378 PolarHBondContact O-N 3.3Å
377	F	44.3	Very low	37.4	Very low	91 Å²	91	130.4 Å²	130.4	40%	0.399	67%	0.674	S	S	.	*			trans	-55.3	97.1	161.4	-53.8	-74.5	0	0	0	106	V334 P375 I379	V334-F377 HydrophobicContact CB-CD1 4.47Å; V334-F377 HydrophobicContact CB-CE1 4.29Å; V334-F377 HydrophobicContact CG1-CD1 3.56Å; V334-F377 HydrophobicContact CG1-CE1 3.47Å; V334-F377 VanDerWaalsContact CG1-CE1 3.47Å; P375-F377 VanDerWaalsContact C-N 3.3Å; P375-F377 HydrophobicContact CG-CZ 4.27Å; P375-F377 WeakPolarHBondContact O-CD2 3.46Å; P375-F377 PolarHBondContact O-N 2.87Å; F377-I379 HydrophobicContact CB-CD1 4.49Å; F377-I379 HydrophobicContact CB-CG1 4.11Å; F377-I379 PolarHBondContact O-N 3.25Å
378	F	35.6	Very low	36.5	Very low	179 Å²	179	126.4 Å²	126.4	79%	0.785	66%	0.663	S	S	*	*			trans	-67.9	80.9	159.3	-120	-89.5	0	0	0	104.6	H376 P380	H376-F378 PolarHBondContact O-N 3.3Å; F378-P380 WeakPolarHBondContact O-CD 3.47Å
379	I	38.1	Very low	36	Very low	85 Å²	85	128.1 Å²	128.1	44%	0.436	67%	0.668	S	S	.	*			trans	-69.6	108.1	155.5	-64.5	170	0	0	0	102.1	V328 F377 T381	V328-I379 HydrophobicContact CB-CG2 4.3Å; V328-I379 HydrophobicContact CG1-CB 4.35Å; V328-I379 HydrophobicContact CG1-CD1 4.22Å; V328-I379 HydrophobicContact CG1-CG1 3.96Å; V328-I379 HydrophobicContact CG1-CG2 3.61Å; V328-I379 HydrophobicContact CG2-CG2 3.91Å; F377-I379 HydrophobicContact CB-CD1 4.49Å; F377-I379 HydrophobicContact CB-CG1 4.11Å; F377-I379 PolarHBondContact O-N 3.25Å; I379-T381 PolarHBondContact O-N 3.24Å
380	P	33.7	Very low	35.9	Very low	79 Å²	79	130.5 Å²	130.5	51%	0.513	67%	0.672	S	S	.	*			trans	-56.2	120.4	163	-11.2	27.6	0	0	0	104.7	F378	F378-P380 WeakPolarHBondContact O-CD 3.47Å
381	T	28	Very low	36	Very low	118 Å²	118	128.6 Å²	128.6	72%	0.724	67%	0.67	S	S	*	*			trans	-42.2	137.2	157.3	-28	0	0	0	0	106.1	I379 L383	I379-T381 PolarHBondContact O-N 3.24Å; T381-L383 PolarHBondContact O-N 2.93Å
382	P	33.7	Very low	36.1	Very low	105 Å²	105	132.4 Å²	132.4	68%	0.682	68%	0.679	S	S	*	*			trans	-49.2	115.3	177	-20.8	30.4	0	0	0	106.7	E384	P382-E384 PolarHBondContact O-N 2.76Å
383	L	32.1	Very low	36.6	Very low	152 Å²	152	137.9 Å²	137.9	80%	0.796	70%	0.699	S	S	*	*			trans	-61.8	105	142	-98.3	98.6	0	0	0	100.9	T381 T385	T381-L383 PolarHBondContact O-N 2.93Å; L383-T385 PolarHBondContact O-N 3.23Å
384	E	31.6	Very low	36.6	Very low	164 Å²	164	137.8 Å²	137.8	77%	0.766	69%	0.693	S	S	*	*			trans	-40.1	104.3	145.5	-77.2	175	152	0	0	104.1	P382 E386	P382-E384 PolarHBondContact O-N 2.76Å; E384-E386 PolarHBondContact O-N 3.3Å
385	T	37.4	Very low	36.9	Very low	74 Å²	74	134.2 Å²	134.2	45%	0.454	69%	0.69	S	S	.	*			trans	-68.8	91.4	173	41	0	0	0	0	103.5	W207 L383 E387	W207-T385 HydrophobicContact CZ2-CG2 4.26Å; L383-T385 PolarHBondContact O-N 3.23Å; T385-E387 PolarHBondContact O-N 3.32Å; T385-E387 VanDerWaalsContact O-N 3.15Å
386	E	35.5	Very low	37.4	Very low	172 Å²	172	136.5 Å²	136.5	80%	0.804	70%	0.697	S	S	*	*	P	Polyproline II helix	trans	-52.6	122.8	166.3	-70.5	-169.1	163.5	0	0	106.3	E384	E384-E386 PolarHBondContact O-N 3.3Å
387	E	38.4	Very low	37.7	Very low	166 Å²	166	136.6 Å²	136.6	78%	0.776	70%	0.698	S	S	*	*	P	Polyproline II helix	trans	-55.7	128.1	171.7	-65.6	179.3	162.6	0	0	106.8	T385 I389	T385-E387 PolarHBondContact O-N 3.32Å; T385-E387 VanDerWaalsContact O-N 3.15Å; E387-I389 PolarHBondContact O-N 3.47Å
388	P	38.3	Very low	37.3	Very low	90 Å²	90	139.4 Å²	139.4	58%	0.584	71%	0.71	S	S	*	*	P	Polyproline II helix	trans	-58.2	126.9	170.3	23.1	-28.7	0	0	0	107.8	W207 D390	W207-P388 HydrophobicContact CE3-CG 4.47Å; P388-D390 PolarHBondContact O-N 3.18Å
389	I	36.8	Very low	37.6	Very low	142 Å²	142	139 Å²	139	73%	0.728	70%	0.704	S	S	*	*	P	Polyproline II helix	trans	-52.2	127.3	177.9	-64.3	166.1	0	0	0	108.5	E387 D391	E387-I389 PolarHBondContact O-N 3.47Å; I389-D391 VanDerWaalsContact C-N 3.25Å; I389-D391 PolarHBondContact O-N 3.5Å
390	D	38.9	Very low	37.7	Very low	155 Å²	155	137.6 Å²	137.6	83%	0.829	70%	0.697	S	S	*	*			trans	-63	82.9	172.1	-96.5	-22.8	0	0	0	109.5	P388	P388-D390 PolarHBondContact O-N 3.18Å
391	D	36.8	Very low	38.1	Very low	141 Å²	141	139.1 Å²	139.1	75%	0.754	70%	0.697	S	S	*	*			trans	-97.3	95.4	163.4	-71.9	-31	0	0	0	107.9	I389	I389-D391 VanDerWaalsContact C-N 3.25Å; I389-D391 PolarHBondContact O-N 3.5Å
392	E	36.7	Very low	39	Very low	192 Å²	192	138 Å²	138	90%	0.897	69%	0.687	S	S	*	*			trans	27.6	97.5	165.2	-63.7	-171.5	165.8	0	0	117.6	Q394	E392-Q394 PolarHBondContact O-N 3.49Å
393	E	45.8	Very low	39.6	Very low	176 Å²	176	135.3 Å²	135.3	82%	0.822	67%	0.666	S	S	*	*			trans	-57.3	87.7	163.2	-71.1	180	139.2	0	0	112.4
394	Q	39.3	Very low	39.9	Very low	185 Å²	185	134.7 Å²	134.7	86%	0.864	65%	0.654	S	S	*	*	S	Bend	trans	-163.6	74.7	156.3	-123.6	154.7	39.5	0	0	115.2	E392	E392-Q394 PolarHBondContact O-N 3.49Å
395	D	41.7	Very low	40.1	Very low	130 Å²	130	134.1 Å²	134.1	70%	0.695	65%	0.649	S	S	*	*	S	Bend	trans	178.2	-14.6	140.9	-118.2	-21.5	0	0	0	113.4	E397	D395-E397 PolarHBondContact O-N 3.3Å
396	D	46.2	Very low	39.9	Very low	122 Å²	122	145 Å²	145	65%	0.652	68%	0.682	S	S	*	*	H	α-helix	trans	-73.5	-22.4	-167.9	-68.8	-15	0	0	0	115.2	L400	D396-L400 WeakPolarHBondContact O-CG 3.46Å
397	E	42.9	Very low	40.1	Very low	151 Å²	151	143.6 Å²	143.6	71%	0.706	68%	0.676	S	S	*	*	H	α-helix	trans	-73.9	-30.4	-178.4	-71.7	-162.5	142.1	0	0	113.2	D395 L400 E401	D395-E397 PolarHBondContact O-N 3.3Å; E397-L400 PolarHBondContact O-N 2.69Å; E397-E401 PolarHBondContact O-N 3.16Å
398	K	35.4	Very low	40.2	Very low	149 Å²	149	142.4 Å²	142.4	65%	0.648	67%	0.67	S	S	*	*	H	α-helix	trans	-70.4	-39	-176.1	-169.2	176.5	179.2	-177	0	111.7	L400 E401 D402	K398-L400 VanDerWaalsContact C-N 3.34Å; K398-E401 PolarHBondContact O-N 2.7Å; K398-D402 PolarHBondContact O-N 3.38Å
399	W	42.2	Very low	40.3	Very low	171 Å²	171	145.3 Å²	145.3	65%	0.648	68%	0.675	S	S	*	*	H	α-helix	trans	-67.9	-35.8	174.5	-174.6	74	0	0	0	111.9	D402 I403	W399-D402 PolarHBondContact O-N 2.94Å; W399-I403 HydrophobicContact CD2-CD1 3.59Å; W399-I403 HydrophobicContact CD2-CG1 4.34Å; W399-I403 HydrophobicContact CE3-CD1 3.35Å; W399-I403 HydrophobicContact CG-CD1 4.48Å; W399-I403 HydrophobicContact CH2-CD1 3.44Å; W399-I403 VanDerWaalsContact CH2-CD1 3.44Å; W399-I403 HydrophobicContact CH2-CG1 4.49Å; W399-I403 HydrophobicContact CZ2-CD1 3.64Å; W399-I403 HydrophobicContact CZ2-CG1 4.28Å; W399-I403 HydrophobicContact CZ3-CD1 3.28Å; W399-I403 WeakPolarHBondContact O-CD1 3.28Å; W399-I403 VanDerWaalsContact O-CG1 3.28Å; W399-I403 WeakPolarHBondContact O-CG1 3.41Å; W399-I403 PolarHBondContact O-N 3.41Å; W399-I403 VanDerWaalsContact O-N 3.14Å
400	L	41.3	Very low	40.5	Very low	55 Å²	55	145.5 Å²	145.5	29%	0.288	67%	0.672	S	S	.	*	H	α-helix	trans	-66.6	-38.7	176.2	-73.3	170.7	0	0	0	112.8	D396 E397 K398 I403 Y404	D396-L400 WeakPolarHBondContact O-CG 3.46Å; E397-L400 PolarHBondContact O-N 2.69Å; K398-L400 VanDerWaalsContact C-N 3.34Å; L400-I403 HydrophobicContact CD2-CD1 4.22Å; L400-I403 PolarHBondContact O-N 3.39Å; L400-Y404 VanDerWaalsContact O-CD2 3.26Å; L400-Y404 WeakPolarHBondContact O-CD2 3.25Å
401	E	41.8	Very low	40.6	Very low	111 Å²	111	144.9 Å²	144.9	52%	0.519	66%	0.662	S	S	.	*	H	α-helix	trans	-62.8	-40.6	172.6	-81.9	-95.9	144.7	0	0	112	E397 K398 I403 Y404 K405	E397-E401 PolarHBondContact O-N 3.16Å; K398-E401 PolarHBondContact O-N 2.7Å; E401-I403 VanDerWaalsContact C-N 3.28Å; E401-I403 PolarHBondContact O-N 3.17Å; E401-Y404 PolarHBondContact O-N 3.14Å; E401-K405 PolarHBondContact O-N 3.45Å; E401-K405 WeakPolarHBondContact OE2-CE 3.37Å; E401-K405 IonicContact OE2-NZ 2.74Å; E401-K405 PolarHBondContact OE2-NZ 3.42Å
402	D	46	Very low	40.8	Very low	96 Å²	96	145.2 Å²	145.2	51%	0.513	66%	0.656	S	S	.	*	H	α-helix	trans	-68.1	-26.9	179.4	-74.2	-18.9	0	0	0	112.7	K398 W399 Y404	K398-D402 PolarHBondContact O-N 3.38Å; W399-D402 PolarHBondContact O-N 2.94Å; D402-Y404 VanDerWaalsContact C-N 3.34Å; D402-Y404 PolarHBondContact O-N 3.17Å
403	I	46.3	Very low	41.1	Very low	48 Å²	48	141.9 Å²	141.9	25%	0.246	64%	0.639	C	S	.	*	H	α-helix	trans	-70.2	-24.3	174.4	-71.9	162.2	0	0	0	113.5	W399 L400 E401	W399-I403 HydrophobicContact CD2-CD1 3.59Å; W399-I403 HydrophobicContact CD2-CG1 4.34Å; W399-I403 HydrophobicContact CE3-CD1 3.35Å; W399-I403 HydrophobicContact CG-CD1 4.48Å; W399-I403 HydrophobicContact CH2-CD1 3.44Å; W399-I403 VanDerWaalsContact CH2-CD1 3.44Å; W399-I403 HydrophobicContact CH2-CG1 4.49Å; W399-I403 HydrophobicContact CZ2-CD1 3.64Å; W399-I403 HydrophobicContact CZ2-CG1 4.28Å; W399-I403 HydrophobicContact CZ3-CD1 3.28Å; W399-I403 WeakPolarHBondContact O-CD1 3.28Å; W399-I403 VanDerWaalsContact O-CG1 3.28Å; W399-I403 WeakPolarHBondContact O-CG1 3.41Å; W399-I403 PolarHBondContact O-N 3.41Å; W399-I403 VanDerWaalsContact O-N 3.14Å; L400-I403 HydrophobicContact CD2-CD1 4.22Å; L400-I403 PolarHBondContact O-N 3.39Å; E401-I403 VanDerWaalsContact C-N 3.28Å; E401-I403 PolarHBondContact O-N 3.17Å
404	Y	38.6	Very low	40.7	Very low	139 Å²	139	139.2 Å²	139.2	55%	0.545	63%	0.625	S	S	.	*	H	α-helix	trans	-105.6	-0.9	-177.7	-71.4	-82.1	0	0	0	113.8	L400 E401 D402	L400-Y404 VanDerWaalsContact O-CD2 3.26Å; L400-Y404 WeakPolarHBondContact O-CD2 3.25Å; E401-Y404 PolarHBondContact O-N 3.14Å; D402-Y404 VanDerWaalsContact C-N 3.34Å; D402-Y404 PolarHBondContact O-N 3.17Å
405	K	35.8	Very low	40.9	Very low	151 Å²	151	135.4 Å²	135.4	66%	0.657	61%	0.605	S	S	*	*			trans	-103	5.3	178.4	-80.2	-179.3	-174.5	153.5	0	114.9	E401	E401-K405 PolarHBondContact O-N 3.45Å; E401-K405 WeakPolarHBondContact OE2-CE 3.37Å; E401-K405 IonicContact OE2-NZ 2.74Å; E401-K405 PolarHBondContact OE2-NZ 3.42Å
406	R	32.2	Very low	40.8	Very low	302 Å²	302	135.9 Å²	135.9	100%	1.14	60%	0.596	S	S	*	*			trans	-121.9	0	178.3	-80	-172	179.2	-175.5	2	113.9

Retrieved 406 of 406 residues in 80.2 ms (Link to these results)

U.S. Privacy Notice - Disclaimer / Registrations / Copyright Statement - Linking Policy - Notice of Privacy Practices (HIPAA) - Notice of Non‑Discrimination
© Copyright 2026 St. Jude Children's Research Hospital, a not-for-profit, section 501(c)(3).