A0A096NH90_PAPAN Loading...

DCN1-like protein

Contributes to the neddylation of all cullins by transferring NEDD8 from N-terminally acetylated NEDD8-conjugating E2s enzyme to different cullin C-terminal domain-RBX complexes and may play a role in the cell cycle progression by regulating the SCF ubiquitin E3 ligase complex, after UV damage. At the cell membrane, can promote and as well inhibit cullins neddylation.

AlphaFold DB (Q5R9G1), UniProt , Accession A0A096NH90, Species PAPAN (Papio anubis, Olive baboon), Gene DCUN1D3, Length 304 aa.

Structure Viewer

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	40.8	Very low	52.3	Low	248 Å²	248	74.1 Å²	74.1	100%	1.222	39%	0.394	S	S	*	.				0	65.6	0	-66	-174.8	-83.5	0	0	109.2
2	G	45.6	Very low	52.2	Low	36 Å²	36	72.5 Å²	72.5	37%	0.371	39%	0.393	S	S	.	.			trans	168.6	-10.2	-172.5	0	0	0	0	0	114.4	T6	G2-T6 PolarHBondContact O-N 3.09Å; G2-T6 PolarHBondContact O-OG1 3.03Å; G2-T6 VanDerWaalsContact O-OG1 3.08Å
3	Q	48.9	Very low	51.7	Low	134 Å²	134	72.3 Å²	72.3	63%	0.626	40%	0.4	S	S	*	.	H	α-helix	trans	-70.9	-33.9	179.7	-70.6	-178.9	-2.2	0	0	112.4	T6 K7	Q3-T6 WeakPolarHBondContact CA-OG1 3.34Å; Q3-T6 PolarHBondContact O-OG1 3.15Å; Q3-K7 WeakPolarHBondContact O-CB 3.4Å; Q3-K7 WeakPolarHBondContact O-CG 3.47Å; Q3-K7 PolarHBondContact O-N 3.05Å
4	C	46.1	Very low	51.5	Low	11 Å²	11	71.3 Å²	71.3	7%	0.074	40%	0.397	C	S	.	.	H	α-helix	trans	-72.3	-40.3	178.2	-87	0	0	0	0	113.5	T6 K7 C8 E112	C4-T6 VanDerWaalsContact C-N 3.29Å; C4-T6 PolarHBondContact O-N 3.31Å; C4-K7 PolarHBondContact O-N 2.69Å; C4-K7 VanDerWaalsContact O-N 3.16Å; C4-C8 WeakPolarHBondContact O-CB 3.36Å; C4-C8 PolarHBondContact O-N 3.21Å; C4-C8 PolarHBondContact O-SG 3.33Å; C4-C8 VanDerWaalsContact O-SG 3.38Å; C4-E112 HydrophobicContact CB-CB 4.47Å; C4-E112 VanDerWaalsContact SG-CB 3.57Å; C4-E112 WeakPolarHBondContact SG-CG 3.35Å
5	V	49.9	Very low	51	Low	39 Å²	39	74 Å²	74	24%	0.236	41%	0.41	C	S	.	.	H	α-helix	trans	-58.5	-46.5	173.3	-172.4	0	0	0	0	110	K9 E108	V5-K9 HydrophobicContact CG1-CD 3.8Å; V5-K9 HydrophobicContact CG1-CG 4.22Å; V5-K9 WeakPolarHBondContact O-CA 3.13Å; V5-K9 WeakPolarHBondContact O-CB 3.4Å; V5-K9 PolarHBondContact O-N 3.15Å; V5-E108 HydrophobicContact CG2-CG 4.49Å; V5-E108 WeakPolarHBondContact CG2-OE1 3.29Å; V5-E108 WeakPolarHBondContact CG2-OE2 3.39Å
6	T	55.6	Low	49.9	Very low	72 Å²	72	73.1 Å²	73.1	44%	0.442	42%	0.423	S	S	.	.	H	α-helix	trans	-68.2	-35.4	177	53.9	0	0	0	0	112.6	G2 Q3 C4 N10	G2-T6 PolarHBondContact O-N 3.09Å; G2-T6 PolarHBondContact O-OG1 3.03Å; G2-T6 VanDerWaalsContact O-OG1 3.08Å; Q3-T6 WeakPolarHBondContact CA-OG1 3.34Å; Q3-T6 PolarHBondContact O-OG1 3.15Å; C4-T6 VanDerWaalsContact C-N 3.29Å; C4-T6 PolarHBondContact O-N 3.31Å; T6-N10 CarbonylContact O-C 3.43Å; T6-N10 WeakPolarHBondContact O-CA 3.2Å; T6-N10 WeakPolarHBondContact O-CB 3.4Å; T6-N10 PolarHBondContact O-N 2.88Å
7	K	60	Low	48.9	Very low	51 Å²	51	76.2 Å²	76.2	22%	0.222	45%	0.45	C	S	.	.	H	α-helix	trans	-73.6	-36.7	-179.8	-78.7	-179.6	176.1	-169.7	0	112.6	Q3 C4 P11 T123	Q3-K7 WeakPolarHBondContact O-CB 3.4Å; Q3-K7 WeakPolarHBondContact O-CG 3.47Å; Q3-K7 PolarHBondContact O-N 3.05Å; C4-K7 PolarHBondContact O-N 2.69Å; C4-K7 VanDerWaalsContact O-N 3.16Å; K7-P11 WeakPolarHBondContact O-CA 3.41Å; K7-T123 HydrophobicContact CB-CG2 3.96Å; K7-T123 WeakPolarHBondContact O-CG2 3.15Å
8	C	54.5	Low	48.2	Very low	21 Å²	21	82.9 Å²	82.9	14%	0.142	47%	0.472	C	S	.	.	H	α-helix	trans	-88.3	-40	-177.9	-61.2	0	0	0	0	112.5	C4 C140	C4-C8 WeakPolarHBondContact O-CB 3.36Å; C4-C8 PolarHBondContact O-N 3.21Å; C4-C8 PolarHBondContact O-SG 3.33Å; C4-C8 VanDerWaalsContact O-SG 3.38Å; C8-C140 WeakPolarHBondContact CB-SG 3.39Å
9	K	60.1	Low	47.7	Very low	113 Å²	113	87.2 Å²	87.2	49%	0.491	49%	0.494	S	S	.	.	H	α-helix	trans	-82.8	-18.4	174.1	-59.1	-169.4	176.4	-172.7	0	112.8	V5	V5-K9 HydrophobicContact CG1-CD 3.8Å; V5-K9 HydrophobicContact CG1-CG 4.22Å; V5-K9 WeakPolarHBondContact O-CA 3.13Å; V5-K9 WeakPolarHBondContact O-CB 3.4Å; V5-K9 PolarHBondContact O-N 3.15Å
10	N	59.1	Low	47.2	Very low	70 Å²	70	86.8 Å²	86.8	37%	0.374	51%	0.509	S	S	.	.			trans	-139.4	61.7	-179.9	-144.6	-3.1	0	0	0	113.1	T6 S12 S13 E203	T6-N10 CarbonylContact O-C 3.43Å; T6-N10 WeakPolarHBondContact O-CA 3.2Å; T6-N10 WeakPolarHBondContact O-CB 3.4Å; T6-N10 PolarHBondContact O-N 2.88Å; N10-S12 PolarHBondContact O-N 3.17Å; N10-S13 PolarHBondContact O-N 2.83Å; N10-S13 VanDerWaalsContact O-N 3.09Å; N10-S13 PolarHBondContact O-OG 2.76Å; N10-E203 PolarHBondContact OD1-OE2 3.5Å
11	P	55.1	Low	46.8	Very low	20 Å²	20	90.1 Å²	90.1	13%	0.13	53%	0.525	C	S	.	.	G	3₁₀ helix	trans	-56.8	-20.6	-174.5	21.7	-35	0	0	0	115	K7 S13 T14 A207	K7-P11 WeakPolarHBondContact O-CA 3.41Å; P11-S13 PolarHBondContact O-N 2.8Å; P11-S13 VanDerWaalsContact O-N 3.12Å; P11-T14 PolarHBondContact O-N 3.05Å; P11-A207 HydrophobicContact CB-CB 3.55Å; P11-A207 HydrophobicContact CG-CB 3.14Å
12	S	50.7	Low	46.9	Very low	55 Å²	55	90.3 Å²	90.3	39%	0.385	51%	0.512	S	S	.	.	G	3₁₀ helix	trans	-55.5	-26.9	174.4	-50.8	0	0	0	0	113.6	N10 T14	N10-S12 PolarHBondContact O-N 3.17Å; S12-T14 VanDerWaalsContact C-N 3.3Å; S12-T14 PolarHBondContact O-N 2.83Å
13	S	45.9	Very low	46.7	Very low	70 Å²	70	95.8 Å²	95.8	49%	0.49	53%	0.533	S	S	.	.	G	3₁₀ helix	trans	-70.8	-16.5	-174.7	56.8	0	0	0	0	115	N10 P11	N10-S13 PolarHBondContact O-N 2.83Å; N10-S13 VanDerWaalsContact O-N 3.09Å; N10-S13 PolarHBondContact O-OG 2.76Å; P11-S13 PolarHBondContact O-N 2.8Å; P11-S13 VanDerWaalsContact O-N 3.12Å
14	T	49.2	Very low	46.7	Very low	58 Å²	58	94.4 Å²	94.4	36%	0.356	54%	0.536	S	S	.	.	G	3₁₀ helix	trans	-102.3	-7.2	-173.6	-25.3	0	0	0	0	114.2	P11 S12	P11-T14 PolarHBondContact O-N 3.05Å; S12-T14 VanDerWaalsContact C-N 3.3Å; S12-T14 PolarHBondContact O-N 2.83Å
15	L	44	Very low	46.4	Very low	112 Å²	112	99 Å²	99	59%	0.586	57%	0.568	S	S	*	*	S	Bend	trans	-96	8.3	-171	-84.4	166.2	0	0	0	115.5	K210	L15-K210 HydrophobicContact CD1-CD 3.92Å
16	G	33	Very low	46	Very low	60 Å²	60	104.1 Å²	104.1	62%	0.619	59%	0.594	S	S	*	*			trans	-152.1	84.6	-178.6	0	0	0	0	0	113.4
17	S	33.1	Very low	45.3	Very low	126 Å²	126	110.1 Å²	110.1	88%	0.881	61%	0.614	S	S	*	*			trans	-156.3	77.7	166.1	-78.5	0	0	0	0	111.1
18	K	35.7	Very low	44.7	Very low	196 Å²	196	113.2 Å²	113.2	85%	0.852	64%	0.642	S	S	*	*			trans	-159.3	89.2	153.4	-161.3	168.1	175.5	177.9	0	109
19	N	38.7	Very low	44.3	Very low	165 Å²	165	121.2 Å²	121.2	88%	0.882	68%	0.677	S	S	*	*			trans	-179.2	109.8	142.4	-87.9	-13.4	0	0	0	111.2
20	G	37.9	Very low	43.5	Very low	78 Å²	78	121 Å²	121	80%	0.804	69%	0.69	S	S	*	*				67.1	102.2	128.7	0	0	0	0	0	120.1
21	D	39.5	Very low	42.7	Very low	158 Å²	158	128.1 Å²	128.1	85%	0.845	71%	0.711	S	S	*	*			trans	-18	129.2	150.6	-86.6	-81	0	0	0	117.6
22	R	41.6	Very low	41.9	Very low	251 Å²	251	139 Å²	139	95%	0.947	75%	0.749	S	S	*	*				-175	124.9	119.7	-98.7	170.2	-174.4	-163.1	2.2	111.4
23	D	42.3	Very low	41.3	Very low	151 Å²	151	140.3 Å²	140.3	81%	0.807	77%	0.772	S	S	*	*			trans	-100	-175	-172.7	-142.8	-7.7	0	0	0	110.5
24	P	48.3	Very low	40.9	Very low	105 Å²	105	142.4 Å²	142.4	68%	0.682	79%	0.794	S	S	*	*				-127.5	178	-95.9	40.5	-25.4	0	0	0	114.2
25	S	39.4	Very low	40.5	Very low	107 Å²	107	143.5 Å²	143.5	75%	0.748	82%	0.817	S	S	*	*			trans	-174.6	149.5	144.1	52.9	0	0	0	0	115.4
26	N	41.9	Very low	40.4	Very low	147 Å²	147	145.8 Å²	145.8	79%	0.786	82%	0.824	S	S	*	*			trans	100.4	86.7	156.8	-70	-15.2	0	0	0	121.8
27	K	42.2	Very low	40.8	Very low	199 Å²	199	154.4 Å²	154.4	87%	0.865	84%	0.838	S	S	*	*				16.3	127.9	122.1	-70.4	176.4	174.4	173.4	0	118.7
28	S	46.9	Very low	40.9	Very low	116 Å²	116	155.9 Å²	155.9	81%	0.811	83%	0.831	S	S	*	*				179.4	135.1	105.4	54.5	0	0	0	0	114.9
29	H	46.2	Very low	41	Very low	189 Å²	189	155.5 Å²	155.5	88%	0.875	83%	0.832	S	S	*	*			trans	-21.9	143.6	163.6	-64	-87.2	0	0	0	120.2
30	S	41.9	Very low	41	Very low	108 Å²	108	156 Å²	156	76%	0.755	83%	0.829	S	S	*	*				172.4	121.5	93.9	-162.9	0	0	0	0	115
31	R	43.7	Very low	41.2	Very low	220 Å²	220	158.7 Å²	158.7	83%	0.83	83%	0.83	S	S	*	*			trans	34	122.4	137.7	-64.3	-176	174.9	-174.8	-0	123.5
32	R	37.1	Very low	41.3	Very low	247 Å²	247	156.3 Å²	156.3	93%	0.932	82%	0.823	S	S	*	*				58.3	121.8	121.5	-67.5	-173.8	178.3	-167.4	-1.7	120.4
33	G	38.1	Very low	41.4	Very low	84 Å²	84	149.8 Å²	149.8	87%	0.866	81%	0.813	S	S	*	*			trans	-164.2	104.7	147.8	0	0	0	0	0	110.4
34	A	38.7	Very low	41	Very low	114 Å²	114	149.4 Å²	149.4	94%	0.942	82%	0.821	S	S	*	*			trans	-92.6	137.9	174.1	0	0	0	0	0	109.6
35	G	41	Very low	40.5	Very low	81 Å²	81	147.8 Å²	147.8	84%	0.835	82%	0.823	S	S	*	*			trans	-146.5	106.9	173.6	0	0	0	0	0	109.8
36	H	41.1	Very low	40.6	Very low	160 Å²	160	152.4 Å²	152.4	74%	0.741	83%	0.829	S	S	*	*			trans	-89.6	135.8	179.7	-152.9	-65.1	0	0	0	108.7	E38	H36-E38 IonicContact CE1-OE2 2.71Å; H36-E38 PolarHBondContact CE1-OE2 2.81Å; H36-E38 VanDerWaalsContact CE1-OE2 3.27Å; H36-E38 IonicContact ND1-OE2 2.75Å
37	R	41.6	Very low	40.6	Very low	240 Å²	240	151.6 Å²	151.6	91%	0.906	83%	0.832	S	S	*	*			trans	-158	113.1	149.6	-115.9	-175.6	-177.5	-148.4	-0.3	111
38	E	35.8	Very low	40.3	Very low	158 Å²	158	146 Å²	146	74%	0.738	83%	0.832	S	S	*	*			trans	-71.3	147.3	163.8	-76.4	157.5	99	0	0	110.4	H36	H36-E38 IonicContact CE1-OE2 2.71Å; H36-E38 PolarHBondContact CE1-OE2 2.81Å; H36-E38 VanDerWaalsContact CE1-OE2 3.27Å; H36-E38 IonicContact ND1-OE2 2.75Å
39	E	37.7	Very low	39.8	Very low	188 Å²	188	144.4 Å²	144.4	88%	0.879	83%	0.833	S	S	*	*			trans	-145	150.3	147.9	-154.5	165.7	124.7	0	0	110.3
40	Q	37.6	Very low	39.2	Very low	176 Å²	176	142.7 Å²	142.7	82%	0.822	83%	0.83	S	S	*	*			trans	-92.4	132	-151	-70.7	161.4	-0.3	0	0	114.6
41	V	42.9	Very low	38.9	Very low	133 Å²	133	145.5 Å²	145.5	81%	0.806	84%	0.835	S	S	*	*				11	164.8	120.1	-135.6	0	0	0	0	119.1
42	P	40.6	Very low	38.6	Very low	109 Å²	109	142.2 Å²	142.2	71%	0.708	83%	0.834	S	S	*	*				-133.5	-126.5	-86.2	43.7	-21.9	0	0	0	111.1
43	P	43.7	Very low	38.8	Very low	114 Å²	114	136.7 Å²	136.7	74%	0.74	83%	0.827	S	S	*	*				-120.3	167.9	-70.6	36.6	-17.9	0	0	0	114.2
44	C	35.8	Very low	38.4	Very low	143 Å²	143	140.1 Å²	140.1	97%	0.966	83%	0.825	S	S	*	*			trans	179.4	147.5	153.9	-124.5	0	0	0	0	108.3
45	G	37.1	Very low	38.2	Very low	71 Å²	71	138.4 Å²	138.4	73%	0.732	82%	0.819	S	S	*	*			cis	-168.7	165.6	8.6	0	0	0	0	0	109.4
46	K	40.6	Very low	37.7	Very low	203 Å²	203	141.1 Å²	141.1	88%	0.883	82%	0.819	S	S	*	*			trans	-80	-161.2	-170.4	-58.5	175.5	174	175.8	0	113.6
47	P	41.8	Very low	37.7	Very low	130 Å²	130	143.5 Å²	143.5	84%	0.844	83%	0.828	S	S	*	*				-128.7	-177.8	-75.4	37.9	-20.1	0	0	0	111.8
48	G	37.6	Very low	37.1	Very low	83 Å²	83	140.5 Å²	140.5	86%	0.856	82%	0.821	S	S	*	*			trans	169.4	126.8	158.7	0	0	0	0	0	116.3
49	G	36.3	Very low	37.3	Very low	82 Å²	82	138 Å²	138	85%	0.845	83%	0.827	S	S	*	*			trans	131.2	72.1	153.1	0	0	0	0	0	117.3
50	D	32	Very low	36.9	Very low	152 Å²	152	136.8 Å²	136.8	81%	0.813	82%	0.822	S	S	*	*			trans	-70.4	148.5	157.1	-69.1	-55.2	0	0	0	111.2
51	I	37.2	Very low	37	Very low	167 Å²	167	133.2 Å²	133.2	86%	0.856	82%	0.823	S	S	*	*			trans	-178	95.9	147.2	-84.3	142.2	0	0	0	105.1
52	L	36.6	Very low	36.8	Very low	152 Å²	152	131.8 Å²	131.8	80%	0.796	82%	0.824	S	S	*	*				55.7	113.1	79.3	-88.3	164.1	0	0	0	117.5
53	V	40.5	Very low	36.6	Very low	131 Å²	131	132.9 Å²	132.9	79%	0.794	83%	0.829	S	S	*	*				111.5	130.7	124.1	124.1	0	0	0	0	120.5
54	N	29.3	Very low	36.5	Very low	155 Å²	155	136.6 Å²	136.6	83%	0.829	84%	0.837	S	S	*	*			trans	-46.3	156.4	174.7	-75.8	-16	0	0	0	116.7
55	G	35.2	Very low	36.6	Very low	78 Å²	78	133.9 Å²	133.9	80%	0.804	83%	0.825	S	S	*	*			trans	-161.8	82.7	164.3	0	0	0	0	0	114.1
56	T	31.5	Very low	36.7	Very low	138 Å²	138	136.8 Å²	136.8	85%	0.847	83%	0.832	S	S	*	*			trans	-68.9	128.1	166.3	-32	0	0	0	0	109.7
57	K	39.6	Very low	36.7	Very low	211 Å²	211	135.5 Å²	135.5	92%	0.917	83%	0.83	S	S	*	*			trans	-117.1	114.3	164.6	-96.4	-176.1	177.3	178	0	110
58	K	30.3	Very low	36.7	Very low	176 Å²	176	136.3 Å²	136.3	77%	0.765	83%	0.826	S	S	*	*			trans	-84.4	136.3	165.9	-160.9	-173.8	-175.5	-155.9	0	107.5	E60	K58-E60 IonicContact NZ-OE1 3.25Å
59	A	39.2	Very low	36.9	Very low	105 Å²	105	137.3 Å²	137.3	87%	0.868	82%	0.817	S	S	*	*			trans	-134.2	120.2	165.1	0	0	0	0	0	108.7
60	E	30.1	Very low	36.9	Very low	163 Å²	163	140 Å²	140	76%	0.762	82%	0.818	S	S	*	*			trans	-93.1	145.8	175.4	-72.2	172.3	131.3	0	0	110.6	K58	K58-E60 IonicContact NZ-OE1 3.25Å
61	A	38.5	Very low	37.9	Very low	102 Å²	102	138 Å²	138	84%	0.843	82%	0.816	S	S	*	*			trans	164.9	139.2	151.8	0	0	0	0	0	107
62	A	40.2	Very low	38.3	Very low	102 Å²	102	135.9 Å²	135.9	84%	0.843	82%	0.816	S	S	*	*			cis	-158.5	161.4	6.4	0	0	0	0	0	109.6
63	T	35.4	Very low	38.9	Very low	132 Å²	132	132.2 Å²	132.2	81%	0.81	82%	0.815	S	S	*	*			trans	-84.9	149.3	-171.5	-40.4	0	0	0	0	113.8
64	E	42	Very low	39.7	Very low	192 Å²	192	132.5 Å²	132.5	90%	0.897	81%	0.812	S	S	*	*			trans	179.6	104	138.9	-100.6	176.9	164.4	0	0	108.2
65	A	37.1	Very low	41.1	Very low	87 Å²	87	128.7 Å²	128.7	72%	0.719	80%	0.802	S	S	*	*				88.2	107.7	79.7	0	0	0	0	0	114.9
66	C	39.7	Very low	42.2	Very low	132 Å²	132	127.3 Å²	127.3	89%	0.892	79%	0.787	S	S	*	*			trans	174.7	107.8	131.5	-96.4	0	0	0	0	113.8
67	Q	40.3	Very low	43.5	Very low	176 Å²	176	130.7 Å²	130.7	82%	0.822	78%	0.784	S	S	*	*			trans	3.6	146.1	137.4	-71.5	179.5	25.9	0	0	119
68	L	42	Very low	44.5	Very low	147 Å²	147	127.2 Å²	127.2	77%	0.77	77%	0.771	S	S	*	*			cis	-175.3	-173.1	20.8	-92.7	151.2	0	0	0	106.6
69	P	41	Very low	46.1	Very low	104 Å²	104	122.9 Å²	122.9	68%	0.675	76%	0.763	S	S	*	*			cis	-127.6	162.5	-45	35.5	-17.2	0	0	0	114.8
70	T	37.8	Very low	47.6	Very low	138 Å²	138	125.1 Å²	125.1	85%	0.847	75%	0.753	S	S	*	*			trans	9.3	123.2	155.2	59	0	0	0	0	121.9
71	S	52.4	Low	49.9	Very low	111 Å²	111	120.1 Å²	120.1	78%	0.776	74%	0.736	S	S	*	*			trans	-161.1	107.4	151.2	164.1	0	0	0	0	111.5
72	S	46.4	Very low	52.1	Low	122 Å²	122	120 Å²	120	85%	0.853	72%	0.722	S	S	*	*			trans	36.3	110.8	137.5	-42.9	0	0	0	0	119.7
73	G	47.5	Very low	54.3	Low	75 Å²	75	118.1 Å²	118.1	77%	0.773	71%	0.706	S	S	*	*			trans	-176	54.7	170.1	0	0	0	0	0	116.4
74	D	57.5	Low	56.8	Low	137 Å²	137	118.2 Å²	118.2	73%	0.733	70%	0.697	S	S	*	*			trans	-86.5	-17.8	178.2	-147.9	4	0	0	0	113.5	G76	D74-G76 VanDerWaalsContact C-N 3.34Å; D74-G76 PolarHBondContact O-N 3.08Å
75	A	58.7	Low	59.1	Low	75 Å²	75	114.3 Å²	114.3	62%	0.62	68%	0.679	S	S	*	*	H	α-helix	trans	-74.4	-18.1	-177.2	0	0	0	0	0	114.8	S79	A75-S79 PolarHBondContact O-OG 3.31Å
76	G	58.5	Low	61.7	Low	48 Å²	48	112.9 Å²	112.9	50%	0.495	66%	0.663	S	S	.	*	H	α-helix	trans	-79.8	-18.2	-177	0	0	0	0	0	114.4	D74	D74-G76 VanDerWaalsContact C-N 3.34Å; D74-G76 PolarHBondContact O-N 3.08Å
77	R	58.8	Low	64.3	Low	209 Å²	209	108.5 Å²	108.5	79%	0.789	63%	0.634	S	S	*	*	H	α-helix	trans	-83.8	-38.9	-176.8	-162.7	171.9	-176.3	177.8	-0.7	112	K80 S81	R77-K80 PolarHBondContact O-N 3.24Å; R77-S81 PolarHBondContact O-N 2.96Å
78	E	60.4	Low	66.9	Low	138 Å²	138	103.7 Å²	103.7	65%	0.645	61%	0.614	S	S	*	*	H	α-helix	trans	-68.2	-36.4	177.9	-63.7	-172.1	150.1	0	0	112.9	K80 S81 N82	E78-K80 VanDerWaalsContact C-N 3.29Å; E78-K80 PolarHBondContact O-N 3.37Å; E78-S81 PolarHBondContact O-N 3.38Å; E78-S81 PolarHBondContact O-OG 3.17Å; E78-N82 PolarHBondContact O-N 2.87Å
79	S	64.2	Low	69.5	Low	85 Å²	85	101.9 Å²	101.9	59%	0.594	60%	0.602	S	S	*	*	H	α-helix	trans	-65.9	-32.4	-179.9	-64	0	0	0	0	112.5	A75 A83	A75-S79 PolarHBondContact O-OG 3.31Å; S79-A83 PolarHBondContact O-N 2.94Å
80	K	72.2	Confident	72.2	Confident	152 Å²	152	102.8 Å²	102.8	66%	0.661	59%	0.592	S	S	*	*	H	α-helix	trans	-74.4	-42	177.6	-72.1	-175.6	178.1	-176.9	0	112	R77 E78 N82 A83 E84	R77-K80 PolarHBondContact O-N 3.24Å; E78-K80 VanDerWaalsContact C-N 3.29Å; E78-K80 PolarHBondContact O-N 3.37Å; K80-N82 VanDerWaalsContact C-N 3.32Å; K80-N82 PolarHBondContact O-N 3.05Å; K80-A83 PolarHBondContact O-N 3.38Å; K80-E84 PolarHBondContact O-N 3.49Å; K80-E84 VanDerWaalsContact O-N 3.09Å
81	S	78.1	Confident	75	Confident	58 Å²	58	96.4 Å²	96.4	41%	0.406	55%	0.552	S	S	.	*	H	α-helix	trans	-62.5	-40.4	178.3	53.8	0	0	0	0	112	R77 E78 A83 E84 E85	R77-S81 PolarHBondContact O-N 2.96Å; E78-S81 PolarHBondContact O-N 3.38Å; E78-S81 PolarHBondContact O-OG 3.17Å; S81-A83 PolarHBondContact O-N 2.79Å; S81-E84 PolarHBondContact O-N 2.7Å; S81-E85 WeakPolarHBondContact O-CB 3.29Å; S81-E85 PolarHBondContact O-N 3.38Å
82	N	84.5	Confident	77.2	Confident	101 Å²	101	93.5 Å²	93.5	54%	0.54	53%	0.526	S	S	.	.	H	α-helix	trans	-66.1	-37.4	178.5	-73.8	-6.7	0	0	0	112.8	E78 K80 S86	E78-N82 PolarHBondContact O-N 2.87Å; K80-N82 VanDerWaalsContact C-N 3.32Å; K80-N82 PolarHBondContact O-N 3.05Å; N82-S86 WeakPolarHBondContact O-CB 3.46Å; N82-S86 PolarHBondContact O-N 3.4Å
83	A	86.8	Confident	79.7	Confident	61 Å²	61	93.9 Å²	93.9	50%	0.504	52%	0.515	S	S	.	.	H	α-helix	trans	-68.6	-41.5	177.6	0	0	0	0	0	112	S79 K80 S81 S86 S87	S79-A83 PolarHBondContact O-N 2.94Å; K80-A83 PolarHBondContact O-N 3.38Å; S81-A83 PolarHBondContact O-N 2.79Å; A83-S86 PolarHBondContact O-N 3.47Å; A83-S87 WeakPolarHBondContact O-CB 3.32Å; A83-S87 PolarHBondContact O-N 2.87Å
84	E	87.7	Confident	82.1	Confident	134 Å²	134	91.1 Å²	91.1	63%	0.626	48%	0.482	S	S	*	.	H	α-helix	trans	-64.7	-42.6	175.2	-72.1	-179.7	-177.8	0	0	111.6	K80 S81 S87 L88	K80-E84 PolarHBondContact O-N 3.49Å; K80-E84 VanDerWaalsContact O-N 3.09Å; S81-E84 PolarHBondContact O-N 2.7Å; E84-S87 PolarHBondContact O-N 3.33Å; E84-L88 WeakPolarHBondContact O-CG 3.28Å; E84-L88 PolarHBondContact O-N 3.42Å
85	E	89.9	Confident	84	Confident	110 Å²	110	84.6 Å²	84.6	51%	0.514	45%	0.447	S	S	.	.	H	α-helix	trans	-63.6	-44.4	176.6	-172.2	172.9	-173.5	0	0	111.9	S81 S87 L88 Q89	S81-E85 WeakPolarHBondContact O-CB 3.29Å; S81-E85 PolarHBondContact O-N 3.38Å; E85-S87 VanDerWaalsContact C-N 3.33Å; E85-S87 PolarHBondContact O-N 2.89Å; E85-L88 PolarHBondContact O-N 2.94Å; E85-Q89 WeakPolarHBondContact O-CG 3.43Å; E85-Q89 PolarHBondContact O-N 3.45Å
86	S	92.6	Very high	85.9	Confident	57 Å²	57	88.4 Å²	88.4	40%	0.399	45%	0.445	S	S	.	.	H	α-helix	trans	-61.8	-40.5	174.9	-179	0	0	0	0	112.2	N82 A83 Q89 R90	N82-S86 WeakPolarHBondContact O-CB 3.46Å; N82-S86 PolarHBondContact O-N 3.4Å; A83-S86 PolarHBondContact O-N 3.47Å; S86-Q89 PolarHBondContact O-N 2.92Å; S86-R90 WeakPolarHBondContact O-CG 3.12Å; S86-R90 PolarHBondContact O-N 3.24Å; S86-R90 VanDerWaalsContact O-N 3.07Å
87	S	93.5	Very high	87.8	Confident	40 Å²	40	93 Å²	93	28%	0.28	45%	0.448	S	S	.	.	H	α-helix	trans	-63.9	-42.8	175.7	-174	0	0	0	0	112.1	A83 E84 E85 Q89 R90 L91 D157	A83-S87 WeakPolarHBondContact O-CB 3.32Å; A83-S87 PolarHBondContact O-N 2.87Å; E84-S87 PolarHBondContact O-N 3.33Å; E85-S87 VanDerWaalsContact C-N 3.33Å; E85-S87 PolarHBondContact O-N 2.89Å; S87-Q89 VanDerWaalsContact C-N 3.34Å; S87-Q89 PolarHBondContact O-N 3.42Å; S87-R90 PolarHBondContact O-N 2.92Å; S87-L91 WeakPolarHBondContact O-CB 3.34Å; S87-L91 PolarHBondContact O-N 3.36Å; S87-D157 WeakPolarHBondContact CA-OD2 3.37Å; S87-D157 VanDerWaalsContact CB-OD2 3.28Å; S87-D157 WeakPolarHBondContact CB-OD2 3.48Å; S87-D157 PolarHBondContact OG-OD2 3.31Å
88	L	94.9	Very high	89.7	Confident	76 Å²	76	83.1 Å²	83.1	40%	0.398	41%	0.411	S	S	.	.	H	α-helix	trans	-63	-38.6	175.6	-72.7	174	0	0	0	112.5	E84 E85 L91 E92	E84-L88 WeakPolarHBondContact O-CG 3.28Å; E84-L88 PolarHBondContact O-N 3.42Å; E85-L88 PolarHBondContact O-N 2.94Å; L88-L91 PolarHBondContact O-N 2.87Å; L88-E92 WeakPolarHBondContact O-CB 3.46Å; L88-E92 PolarHBondContact O-N 2.97Å
89	Q	96.7	Very high	91.5	Very high	108 Å²	108	79.1 Å²	79.1	51%	0.505	39%	0.391	S	S	.	.	H	α-helix	trans	-63.4	-46.1	175.3	-72.9	174.8	-0.1	0	0	111.6	E85 S86 S87 L91 E92 E93	E85-Q89 WeakPolarHBondContact O-CG 3.43Å; E85-Q89 PolarHBondContact O-N 3.45Å; S86-Q89 PolarHBondContact O-N 2.92Å; S87-Q89 VanDerWaalsContact C-N 3.34Å; S87-Q89 PolarHBondContact O-N 3.42Å; Q89-L91 VanDerWaalsContact C-N 3.29Å; Q89-L91 PolarHBondContact O-N 3Å; Q89-E92 PolarHBondContact O-N 3.46Å; Q89-E93 WeakPolarHBondContact O-CG 3.44Å; Q89-E93 PolarHBondContact O-N 3.39Å
90	R	97.6	Very high	93.1	Very high	124 Å²	124	76.9 Å²	76.9	47%	0.468	37%	0.372	S	S	.	.	H	α-helix	trans	-60.4	-40.3	175.2	-69.9	-171.4	-64.2	-174.8	0	112.1	S86 S87 E93 L94 D157	S86-R90 WeakPolarHBondContact O-CG 3.12Å; S86-R90 PolarHBondContact O-N 3.24Å; S86-R90 VanDerWaalsContact O-N 3.07Å; S87-R90 PolarHBondContact O-N 2.92Å; R90-E93 PolarHBondContact O-N 3.49Å; R90-L94 WeakPolarHBondContact O-CB 3.3Å; R90-L94 PolarHBondContact O-N 3.05Å; R90-D157 HydrophobicContact CB-CB 4.39Å; R90-D157 IonicContact CZ-OD1 3.01Å; R90-D157 IonicContact CZ-OD2 3.17Å; R90-D157 IonicContact NE-OD1 2.66Å; R90-D157 IonicContact NE-OD2 3.87Å; R90-D157 PolarHBondContact NE-OD2 3.4Å; R90-D157 VanDerWaalsContact NE-OD2 3.12Å; R90-D157 IonicContact NH2-OD1 3.85Å; R90-D157 PolarHBondContact NH2-OD1 2.67Å; R90-D157 IonicContact NH2-OD2 2.81Å; R90-D157 PolarHBondContact NH2-OD2 3.37Å
91	L	97.3	Very high	94.3	Very high	3 Å²	3	78.5 Å²	78.5	2%	0.016	38%	0.382	C	S	.	.	H	α-helix	trans	-67.9	-36.3	178.2	-173	57.2	0	0	0	112.6	S87 L88 Q89 L94 F95 F147 F148 C151 D157	S87-L91 WeakPolarHBondContact O-CB 3.34Å; S87-L91 PolarHBondContact O-N 3.36Å; L88-L91 PolarHBondContact O-N 2.87Å; Q89-L91 VanDerWaalsContact C-N 3.29Å; Q89-L91 PolarHBondContact O-N 3Å; L91-L94 HydrophobicContact CD1-CD2 4.48Å; L91-L94 PolarHBondContact O-N 3.14Å; L91-F95 WeakPolarHBondContact O-CB 3.48Å; L91-F95 PolarHBondContact O-N 3.31Å; L91-F147 HydrophobicContact CD1-CD1 4.08Å; L91-F147 HydrophobicContact CD1-CE1 3.65Å; L91-F148 HydrophobicContact CB-CE1 4.21Å; L91-F148 HydrophobicContact CD2-CB 4.3Å; L91-F148 HydrophobicContact CD2-CD1 3.48Å; L91-F148 VanDerWaalsContact CD2-CD1 3.48Å; L91-F148 HydrophobicContact CD2-CE1 3.94Å; L91-F148 HydrophobicContact CD2-CG 3.95Å; L91-F148 HydrophobicContact CG-CD1 3.8Å; L91-F148 HydrophobicContact CG-CE1 3.81Å; L91-F148 HydrophobicContact CG-CG 4.2Å; L91-F148 HydrophobicContact CG-CZ 4.22Å; L91-C151 HydrophobicContact CD1-CB 3.44Å; L91-C151 VanDerWaalsContact CD1-CB 3.44Å; L91-C151 VanDerWaalsContact CD1-SG 3.59Å; L91-C151 HydrophobicContact CD2-CB 3.99Å; L91-C151 HydrophobicContact CG-CB 4.38Å; L91-D157 HydrophobicContact CB-CB 4.36Å
92	E	97.9	Very high	95.2	Very high	51 Å²	51	86.8 Å²	86.8	24%	0.238	41%	0.405	C	S	.	.	H	α-helix	trans	-65.5	-44	173.1	177.1	60.5	-152.2	0	0	112.2	L88 Q89 L94 F95 R96 R144 F148	L88-E92 WeakPolarHBondContact O-CB 3.46Å; L88-E92 PolarHBondContact O-N 2.97Å; Q89-E92 PolarHBondContact O-N 3.46Å; E92-L94 VanDerWaalsContact C-N 3.34Å; E92-F95 PolarHBondContact O-N 3.02Å; E92-R96 WeakPolarHBondContact O-CB 3.33Å; E92-R96 PolarHBondContact O-N 3.37Å; E92-R96 IonicContact OE1-CZ 3.96Å; E92-R96 IonicContact OE1-NH2 3.15Å; E92-R96 PolarHBondContact OE1-NH2 3.44Å; E92-R96 VanDerWaalsContact OE1-NH2 3.15Å; E92-R144 IonicContact OE1-NH1 2.79Å; E92-R144 IonicContact OE1-NH2 3.16Å; E92-R144 IonicContact OE2-CZ 3.77Å; E92-R144 IonicContact OE2-NH1 2.81Å; E92-R144 PolarHBondContact OE2-NH1 2.98Å; E92-F148 HydrophobicContact CB-CZ 4.16Å; E92-F148 VanDerWaalsContact OE2-CZ 3.29Å; E92-F148 WeakPolarHBondContact OE2-CZ 3.37Å
93	E	97.9	Very high	95.8	Very high	129 Å²	129	86.3 Å²	86.3	60%	0.603	40%	0.399	S	S	*	.	H	α-helix	trans	-61.6	-43.6	174	-71	176.5	-179.2	0	0	111.6	Q89 R90 R96 R97	Q89-E93 WeakPolarHBondContact O-CG 3.44Å; Q89-E93 PolarHBondContact O-N 3.39Å; R90-E93 PolarHBondContact O-N 3.49Å; E93-R96 PolarHBondContact O-N 2.96Å; E93-R97 PolarHBondContact O-N 3.31Å; E93-R97 VanDerWaalsContact O-N 3.15Å
94	L	98.2	Very high	96.3	Very high	17 Å²	17	87.3 Å²	87.3	9%	0.089	40%	0.396	C	S	.	.	H	α-helix	trans	-62.4	-46.6	177	-174.3	67.4	0	0	0	111.6	R90 L91 E92 R96 R97 Y98 F147 I159 I162	R90-L94 WeakPolarHBondContact O-CB 3.3Å; R90-L94 PolarHBondContact O-N 3.05Å; L91-L94 HydrophobicContact CD1-CD2 4.48Å; L91-L94 PolarHBondContact O-N 3.14Å; E92-L94 VanDerWaalsContact C-N 3.34Å; L94-R96 PolarHBondContact O-N 3.33Å; L94-R97 WeakPolarHBondContact O-CB 3.46Å; L94-R97 PolarHBondContact O-N 2.95Å; L94-Y98 HydrophobicContact CD1-CE2 3.67Å; L94-Y98 HydrophobicContact CG-CE2 4.13Å; L94-Y98 WeakPolarHBondContact O-CD2 3.34Å; L94-Y98 WeakPolarHBondContact O-CE2 3.25Å; L94-F147 HydrophobicContact CD2-CE1 4.24Å; L94-F147 HydrophobicContact CD2-CZ 3.89Å; L94-F147 HydrophobicContact CG-CE1 4.32Å; L94-F147 HydrophobicContact CG-CZ 3.98Å; L94-I159 HydrophobicContact CD1-CD1 4.09Å; L94-I159 HydrophobicContact CD1-CG1 3.91Å; L94-I162 HydrophobicContact CD2-CD1 4.35Å
95	F	98.6	Very high	96.8	Very high	0 Å²	0	81.1 Å²	81.1	0%	0	37%	0.368	C	S	.	.	H	α-helix	trans	-60.6	-46.3	176.7	-179.4	-103.9	0	0	0	111.1	L91 E92 R97 Y98 K99 I106 R144 F147 F148	L91-F95 WeakPolarHBondContact O-CB 3.48Å; L91-F95 PolarHBondContact O-N 3.31Å; E92-F95 PolarHBondContact O-N 3.02Å; F95-R97 PolarHBondContact O-N 3.5Å; F95-Y98 PolarHBondContact O-N 3.28Å; F95-K99 HydrophobicContact CD1-CB 4.15Å; F95-K99 HydrophobicContact CD1-CD 4.28Å; F95-K99 HydrophobicContact CD1-CG 4.27Å; F95-K99 HydrophobicContact CE1-CB 3.89Å; F95-K99 HydrophobicContact CE1-CD 3.73Å; F95-K99 HydrophobicContact CE1-CG 3.58Å; F95-K99 HydrophobicContact CZ-CB 4.32Å; F95-K99 HydrophobicContact CZ-CG 4.01Å; F95-K99 WeakPolarHBondContact O-CB 3.18Å; F95-K99 PolarHBondContact O-N 3.49Å; F95-I106 HydrophobicContact CD2-CD1 3.87Å; F95-I106 HydrophobicContact CD2-CG1 3.98Å; F95-I106 HydrophobicContact CE2-CD1 4.03Å; F95-I106 HydrophobicContact CE2-CG1 3.71Å; F95-R144 VanDerWaalsContact CD1-CZ 3.42Å; F95-R144 HydrophobicContact CE1-CB 3.99Å; F95-R144 HydrophobicContact CE1-CG 4.22Å; F95-R144 VanDerWaalsContact CE1-NH2 3.25Å; F95-R144 HydrophobicContact CE2-CB 4.18Å; F95-R144 VanDerWaalsContact CZ-CA 3.48Å; F95-R144 HydrophobicContact CZ-CB 3.63Å; F95-R144 HydrophobicContact CZ-CG 4.26Å; F95-F147 HydrophobicContact CB-CD1 3.88Å; F95-F147 HydrophobicContact CB-CE1 3.89Å; F95-F147 HydrophobicContact CD2-CB 3.81Å; F95-F147 AromaticContact CD2-CD1 3.56Å; F95-F147 HydrophobicContact CD2-CD1 3.56Å; F95-F147 HydrophobicContact CD2-CD2 4.45Å; F95-F147 HydrophobicContact CD2-CE1 4.21Å; F95-F147 AromaticContact CD2-CG 3.68Å; F95-F147 HydrophobicContact CD2-CG 3.68Å; F95-F147 HydrophobicContact CE2-CB 4.01Å; F95-F147 HydrophobicContact CE2-CG 4.33Å; F95-F147 HydrophobicContact CG-CD1 4.17Å; F95-F148 HydrophobicContact CB-CE2 3.72Å; F95-F148 HydrophobicContact CB-CZ 4.37Å; F95-F148 HydrophobicContact CD1-CE2 4.23Å; F95-F148 HydrophobicContact CD2-CE2 4.35Å; F95-F148 AromaticContact CG-CE2 3.84Å; F95-F148 HydrophobicContact CG-CE2 3.84Å
96	R	98.2	Very high	97.3	Very high	155 Å²	155	75.9 Å²	75.9	59%	0.585	34%	0.343	S	S	*	.	H	α-helix	trans	-59.1	-31.7	-179.7	-170.7	-179.8	-63.7	147.5	6	113.1	E92 E93 L94 Y98	E92-R96 WeakPolarHBondContact O-CB 3.33Å; E92-R96 PolarHBondContact O-N 3.37Å; E92-R96 IonicContact OE1-CZ 3.96Å; E92-R96 IonicContact OE1-NH2 3.15Å; E92-R96 PolarHBondContact OE1-NH2 3.44Å; E92-R96 VanDerWaalsContact OE1-NH2 3.15Å; E93-R96 PolarHBondContact O-N 2.96Å; L94-R96 PolarHBondContact O-N 3.33Å; R96-Y98 PolarHBondContact O-N 3.07Å
97	R	98.1	Very high	97.5	Very high	145 Å²	145	74.8 Å²	74.8	55%	0.547	33%	0.333	S	S	.	.	H	α-helix	trans	-60.1	-31.1	176	-179.2	176.8	169.9	148.9	1	113.1	E93 L94 F95 R113 D117	E93-R97 PolarHBondContact O-N 3.31Å; E93-R97 VanDerWaalsContact O-N 3.15Å; L94-R97 WeakPolarHBondContact O-CB 3.46Å; L94-R97 PolarHBondContact O-N 2.95Å; F95-R97 PolarHBondContact O-N 3.5Å; R97-R113 PolarHBondContact O-NH2 3.45Å; R97-R113 VanDerWaalsContact O-NH2 3.09Å; R97-D117 IonicContact CZ-OD2 2.6Å; R97-D117 IonicContact NE-OD2 3.05Å; R97-D117 PolarHBondContact NE-OD2 2.96Å; R97-D117 IonicContact NH2-OD1 3.27Å; R97-D117 PolarHBondContact NH2-OD1 2.93Å; R97-D117 IonicContact NH2-OD2 2.92Å; R97-D117 PolarHBondContact NH2-OD2 2.95Å
98	Y	98.5	Very high	97.6	Very high	1 Å²	1	76.1 Å²	76.1	0%	0.004	33%	0.334	C	S	.	.	H	α-helix	trans	-112.9	-16.7	-175.3	-50.1	-66.9	0	0	0	113.8	L94 F95 R96 I106 G110 R113 F114 D117 I159	L94-Y98 HydrophobicContact CD1-CE2 3.67Å; L94-Y98 HydrophobicContact CG-CE2 4.13Å; L94-Y98 WeakPolarHBondContact O-CD2 3.34Å; L94-Y98 WeakPolarHBondContact O-CE2 3.25Å; F95-Y98 PolarHBondContact O-N 3.28Å; R96-Y98 PolarHBondContact O-N 3.07Å; Y98-I106 HydrophobicContact CD2-CD1 4.49Å; Y98-G110 WeakPolarHBondContact O-CA 3.41Å; Y98-R113 HydrophobicContact CD1-CB 3.98Å; Y98-R113 HydrophobicContact CE1-CB 4.18Å; Y98-F114 HydrophobicContact CD1-CB 3.88Å; Y98-F114 HydrophobicContact CD2-CB 4.36Å; Y98-F114 AromaticContact CD2-CD2 3.88Å; Y98-F114 HydrophobicContact CD2-CD2 3.88Å; Y98-F114 HydrophobicContact CE1-CB 4.09Å; Y98-F114 HydrophobicContact CE1-CD2 4.45Å; Y98-F114 AromaticContact CE2-CD2 3.62Å; Y98-F114 HydrophobicContact CE2-CD2 3.62Å; Y98-F114 HydrophobicContact CE2-CE2 4.35Å; Y98-F114 HydrophobicContact CG-CB 4.04Å; Y98-F114 HydrophobicContact CG-CD2 4.41Å; Y98-F114 AromaticContact CZ-CD2 3.94Å; Y98-D117 VanDerWaalsContact CE1-OD2 3.28Å; Y98-D117 WeakPolarHBondContact CE1-OD2 3.4Å; Y98-D117 PolarHBondContact OH-OD2 3.09Å; Y98-I159 HydrophobicContact CE2-CD1 4.28Å; Y98-I159 WeakPolarHBondContact OH-CD1 3.4Å
99	K	98.5	Very high	97.7	Very high	55 Å²	55	77 Å²	77	24%	0.239	34%	0.337	C	S	.	.			trans	-54.2	140.9	179.4	-172	-162.9	170.6	-62	0	111.4	F95 E103 D104	F95-K99 HydrophobicContact CD1-CB 4.15Å; F95-K99 HydrophobicContact CD1-CD 4.28Å; F95-K99 HydrophobicContact CD1-CG 4.27Å; F95-K99 HydrophobicContact CE1-CB 3.89Å; F95-K99 HydrophobicContact CE1-CD 3.73Å; F95-K99 HydrophobicContact CE1-CG 3.58Å; F95-K99 HydrophobicContact CZ-CB 4.32Å; F95-K99 HydrophobicContact CZ-CG 4.01Å; F95-K99 WeakPolarHBondContact O-CB 3.18Å; F95-K99 PolarHBondContact O-N 3.49Å; K99-E103 PolarHBondContact NZ-O 3.48Å; K99-D104 WeakPolarHBondContact CE-OD1 3.43Å
100	D	98.4	Very high	97.8	Very high	37 Å²	37	72.1 Å²	72.1	20%	0.198	32%	0.315	C	S	.	.			trans	-65.2	152.4	169.8	-177.2	-103.9	0	0	0	112.1	R102 E103 A105 L107	D100-R102 VanDerWaalsContact C-N 3.32Å; D100-R102 PolarHBondContact O-N 3.18Å; D100-R102 WeakPolarHBondContact OD1-CA 3.3Å; D100-R102 WeakPolarHBondContact OD1-CB 3.12Å; D100-R102 PolarHBondContact OD1-N 3.34Å; D100-E103 HydrophobicContact CB-CB 4.39Å; D100-E103 PolarHBondContact OD1-N 3.18Å; D100-A105 WeakPolarHBondContact CB-O 3.33Å; D100-A105 PolarHBondContact N-O 3.45Å; D100-L107 HydrophobicContact CB-CB 4.41Å; D100-L107 HydrophobicContact CB-CD1 3.9Å; D100-L107 HydrophobicContact CB-CG 3.87Å
101	E	97.3	Very high	97.8	Very high	186 Å²	186	66.9 Å²	66.9	87%	0.869	30%	0.296	S	S	*	.	S	Bend	trans	-70.1	-30.6	-179.5	-65.5	-177.6	170.1	0	0	112.4
102	R	96.4	Very high	97.8	Very high	232 Å²	232	70.9 Å²	70.9	88%	0.875	32%	0.315	S	S	*	.	S	Bend	trans	-104.7	-38.6	-171.8	-56.1	-179.2	-179.6	-169.5	0.6	112.2	D100	D100-R102 VanDerWaalsContact C-N 3.32Å; D100-R102 PolarHBondContact O-N 3.18Å; D100-R102 WeakPolarHBondContact OD1-CA 3.3Å; D100-R102 WeakPolarHBondContact OD1-CB 3.12Å; D100-R102 PolarHBondContact OD1-N 3.34Å
103	E	97	Very high	97.8	Very high	92 Å²	92	73.5 Å²	73.5	43%	0.43	32%	0.322	S	S	.	.	S	Bend	trans	-102.7	152.4	-178	-67	-168.2	-143.5	0	0	112.6	K99 D100 A105 L107	K99-E103 PolarHBondContact NZ-O 3.48Å; D100-E103 HydrophobicContact CB-CB 4.39Å; D100-E103 PolarHBondContact OD1-N 3.18Å; E103-A105 PolarHBondContact O-N 2.9Å; E103-L107 HydrophobicContact CB-CD1 4.35Å; E103-L107 HydrophobicContact CG-CD1 4.42Å
104	D	98.1	Very high	97.8	Very high	82 Å²	82	67.5 Å²	67.5	44%	0.439	29%	0.294	S	S	.	.	S	Bend	trans	-85.3	51	173.5	-160.7	40.8	0	0	0	111.8	K99 R144	K99-D104 WeakPolarHBondContact CE-OD1 3.43Å; D104-R144 PolarHBondContact O-N 3.13Å; D104-R144 VanDerWaalsContact O-N 3.12Å; D104-R144 IonicContact OD1-CZ 2.74Å; D104-R144 VanDerWaalsContact OD1-CZ 3.25Å; D104-R144 IonicContact OD1-NE 2.7Å; D104-R144 PolarHBondContact OD1-NE 3.47Å; D104-R144 IonicContact OD1-NH2 2.69Å; D104-R144 PolarHBondContact OD1-NH2 3.42Å; D104-R144 VanDerWaalsContact OD2-CD 3.3Å; D104-R144 WeakPolarHBondContact OD2-CD 3.21Å; D104-R144 IonicContact OD2-CZ 3.72Å; D104-R144 IonicContact OD2-NE 3.76Å; D104-R144 PolarHBondContact OD2-NE 3.22Å
105	A	98.2	Very high	97.8	Very high	3 Å²	3	66.7 Å²	66.7	3%	0.025	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.4	158.4	-176.7	0	0	0	0	0	110.5	D100 E103 L107 K141 F142	D100-A105 WeakPolarHBondContact CB-O 3.33Å; D100-A105 PolarHBondContact N-O 3.45Å; E103-A105 PolarHBondContact O-N 2.9Å; A105-L107 HydrophobicContact CB-CD2 4.05Å; A105-K141 HydrophobicContact CB-CG 4.42Å; A105-F142 CarbonylContact C-O 3.57Å; A105-F142 WeakPolarHBondContact CA-O 3.46Å
106	I	98.5	Very high	97.8	Very high	0 Å²	0	72.3 Å²	72.3	0%	0	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.1	114.1	163.4	-59.9	172.3	0	0	0	106.2	F95 Y98 G110 M111 K141 F142 F147	F95-I106 HydrophobicContact CD2-CD1 3.87Å; F95-I106 HydrophobicContact CD2-CG1 3.98Å; F95-I106 HydrophobicContact CE2-CD1 4.03Å; F95-I106 HydrophobicContact CE2-CG1 3.71Å; Y98-I106 HydrophobicContact CD2-CD1 4.49Å; I106-G110 VanDerWaalsContact CG2-C 3.45Å; I106-M111 HydrophobicContact CG2-CB 4.44Å; I106-K141 VanDerWaalsContact O-CA 3.29Å; I106-K141 WeakPolarHBondContact O-CA 3.35Å; I106-F142 HydrophobicContact CB-CB 4.34Å; I106-F142 PolarHBondContact N-O 3.3Å; I106-F142 PolarHBondContact O-N 3.41Å; I106-F147 HydrophobicContact CD1-CD2 3.45Å; I106-F147 VanDerWaalsContact CD1-CD2 3.45Å; I106-F147 HydrophobicContact CD1-CE2 3.63Å; I106-F147 HydrophobicContact CD1-CG 4.05Å; I106-F147 HydrophobicContact CD1-CZ 4.35Å
107	L	97.6	Very high	97.8	Very high	35 Å²	35	67.2 Å²	67.2	18%	0.183	31%	0.305	C	S	.	.			trans	-98	-163.5	176.2	-57.4	-175.5	0	0	0	110.8	D100 E103 A105 E109 G110 M111 C140 K141	D100-L107 HydrophobicContact CB-CB 4.41Å; D100-L107 HydrophobicContact CB-CD1 3.9Å; D100-L107 HydrophobicContact CB-CG 3.87Å; E103-L107 HydrophobicContact CB-CD1 4.35Å; E103-L107 HydrophobicContact CG-CD1 4.42Å; A105-L107 HydrophobicContact CB-CD2 4.05Å; L107-E109 PolarHBondContact O-N 2.66Å; L107-G110 PolarHBondContact O-N 3.12Å; L107-M111 VanDerWaalsContact O-CB 3.29Å; L107-M111 WeakPolarHBondContact O-CB 3.32Å; L107-M111 PolarHBondContact O-N 2.81Å; L107-C140 CarbonylContact C-O 3.52Å; L107-C140 VanDerWaalsContact C-O 3.24Å; L107-C140 WeakPolarHBondContact CA-O 3.29Å; L107-K141 HydrophobicContact CD2-CD 4.3Å; L107-K141 HydrophobicContact CD2-CG 4.05Å
108	E	95.6	Very high	97.8	Very high	67 Å²	67	60.6 Å²	60.6	31%	0.313	28%	0.28	S	S	.	.	H	α-helix	trans	-57	-45.5	-170.9	59.5	-169.9	-132.9	0	0	114.5	V5 M111 E112 C140	V5-E108 HydrophobicContact CG2-CG 4.49Å; V5-E108 WeakPolarHBondContact CG2-OE1 3.29Å; V5-E108 WeakPolarHBondContact CG2-OE2 3.39Å; E108-M111 PolarHBondContact O-N 2.97Å; E108-E112 PolarHBondContact O-N 3.48Å; E108-C140 HydrophobicContact CB-CB 4.35Å; E108-C140 PolarHBondContact N-O 2.98Å
109	E	97	Very high	97.8	Very high	96 Å²	96	65.9 Å²	65.9	45%	0.449	32%	0.316	S	S	.	.	H	α-helix	trans	-69.7	-36.6	178.9	-61.2	81.2	-179	0	0	111.8	L107 R113	L107-E109 PolarHBondContact O-N 2.66Å; E109-R113 VanDerWaalsContact C-NH1 3.31Å; E109-R113 WeakPolarHBondContact O-CG 3.47Å; E109-R113 PolarHBondContact O-N 3.12Å; E109-R113 PolarHBondContact O-NH1 3.38Å
110	G	98.1	Very high	97.7	Very high	4 Å²	4	63.8 Å²	63.8	4%	0.041	31%	0.307	C	S	.	.	H	α-helix	trans	-65.9	-42.4	175.1	0	0	0	0	0	111.9	Y98 I106 L107 R113 F114	Y98-G110 WeakPolarHBondContact O-CA 3.41Å; I106-G110 VanDerWaalsContact CG2-C 3.45Å; L107-G110 PolarHBondContact O-N 3.12Å; G110-R113 PolarHBondContact O-N 3.4Å; G110-F114 VanDerWaalsContact O-CB 3.32Å; G110-F114 WeakPolarHBondContact O-CB 3.41Å; G110-F114 PolarHBondContact O-N 2.95Å
111	M	98.1	Very high	97.6	Very high	15 Å²	15	64.6 Å²	64.6	7%	0.074	31%	0.312	C	S	.	.	H	α-helix	trans	-64.6	-41.5	177.9	-173.5	65.3	63.4	0	0	111.6	I106 L107 E108 F114 C115 F142	I106-M111 HydrophobicContact CG2-CB 4.44Å; L107-M111 VanDerWaalsContact O-CB 3.29Å; L107-M111 WeakPolarHBondContact O-CB 3.32Å; L107-M111 PolarHBondContact O-N 2.81Å; E108-M111 PolarHBondContact O-N 2.97Å; M111-F114 PolarHBondContact O-N 2.78Å; M111-F114 HydrophobicContact SD-CD1 4.23Å; M111-C115 WeakPolarHBondContact O-CB 3.39Å; M111-C115 PolarHBondContact O-N 2.91Å; M111-C115 PolarHBondContact O-SG 2.6Å; M111-F142 HydrophobicContact CE-CD1 4.07Å; M111-F142 HydrophobicContact CE-CD2 3.38Å; M111-F142 HydrophobicContact CE-CE1 4.06Å; M111-F142 HydrophobicContact CE-CE2 3.4Å; M111-F142 VanDerWaalsContact CE-CE2 3.4Å; M111-F142 HydrophobicContact CE-CG 3.73Å; M111-F142 HydrophobicContact CE-CZ 3.76Å; M111-F142 HydrophobicContact SD-CD2 4.23Å; M111-F142 HydrophobicContact SD-CE2 3.77Å; M111-F142 HydrophobicContact SD-CZ 4.2Å
112	E	97.4	Very high	97.5	Very high	87 Å²	87	57.1 Å²	57.1	41%	0.407	28%	0.279	S	S	.	.	H	α-helix	trans	-59.1	-49.5	174.8	-175.4	173.1	-175	0	0	111.1	C4 E108 F114 C115 N116	C4-E112 HydrophobicContact CB-CB 4.47Å; C4-E112 VanDerWaalsContact SG-CB 3.57Å; C4-E112 WeakPolarHBondContact SG-CG 3.35Å; E108-E112 PolarHBondContact O-N 3.48Å; E112-F114 VanDerWaalsContact C-N 3.35Å; E112-F114 PolarHBondContact O-N 2.8Å; E112-C115 PolarHBondContact O-N 3.16Å; E112-N116 WeakPolarHBondContact O-CB 3.49Å; E112-N116 PolarHBondContact O-N 2.88Å
113	R	98	Very high	97.4	Very high	106 Å²	106	48 Å²	48	40%	0.4	25%	0.249	S	C	.	.	H	α-helix	trans	-62.5	-42	176.7	-66.6	-168.6	-48.6	-85.4	11	112	R97 Y98 E109 G110 N116 D117	R97-R113 PolarHBondContact O-NH2 3.45Å; R97-R113 VanDerWaalsContact O-NH2 3.09Å; Y98-R113 HydrophobicContact CD1-CB 3.98Å; Y98-R113 HydrophobicContact CE1-CB 4.18Å; E109-R113 VanDerWaalsContact C-NH1 3.31Å; E109-R113 WeakPolarHBondContact O-CG 3.47Å; E109-R113 PolarHBondContact O-N 3.12Å; E109-R113 PolarHBondContact O-NH1 3.38Å; G110-R113 PolarHBondContact O-N 3.4Å; R113-N116 PolarHBondContact O-N 2.85Å; R113-D117 WeakPolarHBondContact O-CB 3.2Å; R113-D117 PolarHBondContact O-N 2.82Å
114	F	98.4	Very high	97.4	Very high	2 Å²	2	45.8 Å²	45.8	1%	0.009	24%	0.239	C	C	.	.	H	α-helix	trans	-61.3	-46.7	177.9	179	-116.7	0	0	0	111.9	Y98 G110 M111 E112 N116 D117 L118 L130 F142 F147 I159 I162	Y98-F114 HydrophobicContact CD1-CB 3.88Å; Y98-F114 HydrophobicContact CD2-CB 4.36Å; Y98-F114 AromaticContact CD2-CD2 3.88Å; Y98-F114 HydrophobicContact CD2-CD2 3.88Å; Y98-F114 HydrophobicContact CE1-CB 4.09Å; Y98-F114 HydrophobicContact CE1-CD2 4.45Å; Y98-F114 AromaticContact CE2-CD2 3.62Å; Y98-F114 HydrophobicContact CE2-CD2 3.62Å; Y98-F114 HydrophobicContact CE2-CE2 4.35Å; Y98-F114 HydrophobicContact CG-CB 4.04Å; Y98-F114 HydrophobicContact CG-CD2 4.41Å; Y98-F114 AromaticContact CZ-CD2 3.94Å; G110-F114 VanDerWaalsContact O-CB 3.32Å; G110-F114 WeakPolarHBondContact O-CB 3.41Å; G110-F114 PolarHBondContact O-N 2.95Å; M111-F114 PolarHBondContact O-N 2.78Å; M111-F114 HydrophobicContact SD-CD1 4.23Å; E112-F114 VanDerWaalsContact C-N 3.35Å; E112-F114 PolarHBondContact O-N 2.8Å; F114-N116 VanDerWaalsContact C-N 3.34Å; F114-N116 PolarHBondContact O-N 3.03Å; F114-D117 PolarHBondContact O-N 2.62Å; F114-L118 HydrophobicContact CD1-CD1 3.88Å; F114-L118 HydrophobicContact CD2-CD1 4.32Å; F114-L118 HydrophobicContact CE1-CD1 3.48Å; F114-L118 VanDerWaalsContact CE1-CD1 3.48Å; F114-L118 HydrophobicContact CE2-CD1 3.98Å; F114-L118 HydrophobicContact CE2-CG 4.3Å; F114-L118 HydrophobicContact CG-CD1 4.29Å; F114-L118 HydrophobicContact CZ-CD1 3.55Å; F114-L118 HydrophobicContact CZ-CG 4.33Å; F114-L118 WeakPolarHBondContact O-CB 3.36Å; F114-L118 VanDerWaalsContact O-CG 3.3Å; F114-L118 WeakPolarHBondContact O-CG 3.25Å; F114-L118 PolarHBondContact O-N 3.41Å; F114-L130 HydrophobicContact CE1-CD1 4.23Å; F114-F142 HydrophobicContact CD1-CE2 4.31Å; F114-F142 AromaticContact CE1-CE2 3.98Å; F114-F142 HydrophobicContact CE1-CE2 3.98Å; F114-F147 AromaticContact CE2-CE2 3.97Å; F114-F147 HydrophobicContact CE2-CE2 3.97Å; F114-F147 HydrophobicContact CE2-CZ 4.38Å; F114-F147 HydrophobicContact CZ-CE2 4.06Å; F114-I159 HydrophobicContact CD2-CD1 3.87Å; F114-I159 HydrophobicContact CE2-CD1 3.75Å; F114-I162 HydrophobicContact CE2-CD1 3.9Å; F114-I162 HydrophobicContact CZ-CD1 3.87Å
115	C	98.2	Very high	97.4	Very high	1 Å²	1	42.4 Å²	42.4	1%	0.007	22%	0.221	C	C	.	.	H	α-helix	trans	-64.1	-39.5	176	-65.2	0	0	0	0	111.9	M111 E112 L118 C119 V120 P122	M111-C115 WeakPolarHBondContact O-CB 3.39Å; M111-C115 PolarHBondContact O-N 2.91Å; M111-C115 PolarHBondContact O-SG 2.6Å; E112-C115 PolarHBondContact O-N 3.16Å; C115-L118 CarbonylContact O-C 3.59Å; C115-L118 PolarHBondContact O-N 3.18Å; C115-C119 PolarHBondContact O-N 2.89Å; C115-C119 VanDerWaalsContact O-N 3.14Å; C115-V120 HydrophobicContact CB-CG2 4Å; C115-V120 WeakPolarHBondContact O-CG2 3.33Å; C115-V120 PolarHBondContact O-N 2.85Å; C115-P122 HydrophobicContact CB-CB 4.48Å; C115-P122 HydrophobicContact CB-CG 3.94Å
116	N	98.1	Very high	97.4	Very high	118 Å²	118	46.5 Å²	46.5	63%	0.631	24%	0.235	S	C	*	.	H	α-helix	trans	-62.4	-45.8	175.8	-176.5	52.1	0	0	0	111.9	E112 R113 F114 L118 C119	E112-N116 WeakPolarHBondContact O-CB 3.49Å; E112-N116 PolarHBondContact O-N 2.88Å; R113-N116 PolarHBondContact O-N 2.85Å; F114-N116 VanDerWaalsContact C-N 3.34Å; F114-N116 PolarHBondContact O-N 3.03Å; N116-L118 VanDerWaalsContact C-N 3.27Å; N116-L118 PolarHBondContact O-N 2.96Å; N116-C119 PolarHBondContact O-N 3.11Å
117	D	98.4	Very high	97.4	Very high	48 Å²	48	47.3 Å²	47.3	26%	0.257	24%	0.24	S	C	.	.	H	α-helix	trans	-65.9	-30.9	177.9	-74.4	-26.7	0	0	0	112.1	R97 Y98 R113 F114 C119 I159	R97-D117 IonicContact CZ-OD2 2.6Å; R97-D117 IonicContact NE-OD2 3.05Å; R97-D117 PolarHBondContact NE-OD2 2.96Å; R97-D117 IonicContact NH2-OD1 3.27Å; R97-D117 PolarHBondContact NH2-OD1 2.93Å; R97-D117 IonicContact NH2-OD2 2.92Å; R97-D117 PolarHBondContact NH2-OD2 2.95Å; Y98-D117 VanDerWaalsContact CE1-OD2 3.28Å; Y98-D117 WeakPolarHBondContact CE1-OD2 3.4Å; Y98-D117 PolarHBondContact OH-OD2 3.09Å; R113-D117 WeakPolarHBondContact O-CB 3.2Å; R113-D117 PolarHBondContact O-N 2.82Å; F114-D117 PolarHBondContact O-N 2.62Å; D117-C119 PolarHBondContact O-N 3.43Å; D117-I159 HydrophobicContact CB-CD1 4.23Å; D117-I159 HydrophobicContact CB-CG1 4.32Å; D117-I159 VanDerWaalsContact O-CG2 3.25Å; D117-I159 WeakPolarHBondContact O-CG2 3.38Å
118	L	98.2	Very high	97.4	Very high	6 Å²	6	45.8 Å²	45.8	3%	0.031	23%	0.232	C	C	.	.	T	Hydrogen-bonded Turn	trans	-75.3	-7.7	171.3	-72.2	171.4	0	0	0	113.9	F114 C115 N116 V120 L130 I159 I162 F166	F114-L118 HydrophobicContact CD1-CD1 3.88Å; F114-L118 HydrophobicContact CD2-CD1 4.32Å; F114-L118 HydrophobicContact CE1-CD1 3.48Å; F114-L118 VanDerWaalsContact CE1-CD1 3.48Å; F114-L118 HydrophobicContact CE2-CD1 3.98Å; F114-L118 HydrophobicContact CE2-CG 4.3Å; F114-L118 HydrophobicContact CG-CD1 4.29Å; F114-L118 HydrophobicContact CZ-CD1 3.55Å; F114-L118 HydrophobicContact CZ-CG 4.33Å; F114-L118 WeakPolarHBondContact O-CB 3.36Å; F114-L118 VanDerWaalsContact O-CG 3.3Å; F114-L118 WeakPolarHBondContact O-CG 3.25Å; F114-L118 PolarHBondContact O-N 3.41Å; C115-L118 CarbonylContact O-C 3.59Å; C115-L118 PolarHBondContact O-N 3.18Å; N116-L118 VanDerWaalsContact C-N 3.27Å; N116-L118 PolarHBondContact O-N 2.96Å; L118-V120 VanDerWaalsContact C-N 3.35Å; L118-V120 HydrophobicContact CB-CG1 4.36Å; L118-V120 HydrophobicContact CB-CG2 3.79Å; L118-V120 HydrophobicContact CD1-CG2 4.37Å; L118-V120 PolarHBondContact O-N 3.19Å; L118-L130 HydrophobicContact CD1-CD1 3.63Å; L118-I159 HydrophobicContact CD2-CD1 4.1Å; L118-I159 HydrophobicContact CD2-CG2 4.17Å; L118-I159 HydrophobicContact CG-CD1 4.23Å; L118-I162 HydrophobicContact CD2-CB 3.86Å; L118-I162 HydrophobicContact CD2-CG2 3.6Å; L118-F166 HydrophobicContact CD1-CZ 4.45Å; L118-F166 HydrophobicContact CD2-CE2 4.47Å; L118-F166 HydrophobicContact CD2-CZ 4.4Å
119	C	97.8	Very high	97.6	Very high	112 Å²	112	42.6 Å²	42.6	76%	0.757	22%	0.217	S	C	*	.	T	Hydrogen-bonded Turn	trans	56.8	42.6	-173.3	-62	0	0	0	0	113.5	C115 N116 D117	C115-C119 PolarHBondContact O-N 2.89Å; C115-C119 VanDerWaalsContact O-N 3.14Å; N116-C119 PolarHBondContact O-N 3.11Å; D117-C119 PolarHBondContact O-N 3.43Å
120	V	97.3	Very high	97.6	Very high	10 Å²	10	38.1 Å²	38.1	6%	0.061	20%	0.197	C	C	.	.			trans	-124.8	146.4	179.2	-63.1	0	0	0	0	111.3	C115 L118 E124 V127 F166	C115-V120 HydrophobicContact CB-CG2 4Å; C115-V120 WeakPolarHBondContact O-CG2 3.33Å; C115-V120 PolarHBondContact O-N 2.85Å; L118-V120 VanDerWaalsContact C-N 3.35Å; L118-V120 HydrophobicContact CB-CG1 4.36Å; L118-V120 HydrophobicContact CB-CG2 3.79Å; L118-V120 HydrophobicContact CD1-CG2 4.37Å; L118-V120 PolarHBondContact O-N 3.19Å; V120-E124 HydrophobicContact CB-CG 4.3Å; V120-E124 WeakPolarHBondContact CB-OE1 3.44Å; V120-E124 WeakPolarHBondContact CG1-OE1 3.4Å; V120-V127 HydrophobicContact CB-CG2 4.22Å; V120-V127 HydrophobicContact CG2-CG2 3.59Å; V120-F166 HydrophobicContact CG1-CE2 4.07Å; V120-F166 HydrophobicContact CG1-CZ 4.1Å
121	D	96.7	Very high	97.6	Very high	55 Å²	55	38 Å²	38	29%	0.294	20%	0.195	S	C	.	.			trans	-72.8	133.9	169.4	-177.8	-83.9	0	0	0	109.6	T123 E124 V127	D121-T123 PolarHBondContact O-N 3.41Å; D121-T123 WeakPolarHBondContact OD1-CA 3.16Å; D121-T123 WeakPolarHBondContact OD1-CB 3.47Å; D121-T123 PolarHBondContact OD1-N 2.88Å; D121-T123 PolarHBondContact OD1-OG1 3.19Å; D121-E124 HydrophobicContact CB-CB 4.33Å; D121-E124 PolarHBondContact N-OE2 3.47Å; D121-E124 VanDerWaalsContact N-OE2 3.11Å; D121-E124 WeakPolarHBondContact O-CG 3.28Å; D121-E124 PolarHBondContact O-N 3.4Å; D121-V127 WeakPolarHBondContact O-CG2 3.12Å
122	P	95.3	Very high	97.7	Very high	28 Å²	28	37.5 Å²	37.5	18%	0.182	19%	0.192	C	C	.	.	T	Hydrogen-bonded Turn	trans	-56.4	-19.7	-178.2	-27.5	34.9	0	0	0	115.5	C115	C115-P122 HydrophobicContact CB-CB 4.48Å; C115-P122 HydrophobicContact CB-CG 3.94Å
123	T	93.9	Very high	97.7	Very high	41 Å²	41	35.3 Å²	35.3	25%	0.252	18%	0.181	S	C	.	.	T	Hydrogen-bonded Turn	trans	-100.7	1.5	-178.1	69.3	0	0	0	0	113.6	K7 D121 L211	K7-T123 HydrophobicContact CB-CG2 3.96Å; K7-T123 WeakPolarHBondContact O-CG2 3.15Å; D121-T123 PolarHBondContact O-N 3.41Å; D121-T123 WeakPolarHBondContact OD1-CA 3.16Å; D121-T123 WeakPolarHBondContact OD1-CB 3.47Å; D121-T123 PolarHBondContact OD1-N 2.88Å; D121-T123 PolarHBondContact OD1-OG1 3.19Å; T123-L211 WeakPolarHBondContact O-CD1 3.38Å
124	E	96.3	Very high	97.8	Very high	45 Å²	45	30.4 Å²	30.4	21%	0.21	16%	0.163	C	C	.	.	S	Bend	trans	-85.1	164	-176.6	84.6	-177.9	-149.2	0	0	113.4	V120 D121 R126 V127 L128	V120-E124 HydrophobicContact CB-CG 4.3Å; V120-E124 WeakPolarHBondContact CB-OE1 3.44Å; V120-E124 WeakPolarHBondContact CG1-OE1 3.4Å; D121-E124 HydrophobicContact CB-CB 4.33Å; D121-E124 PolarHBondContact N-OE2 3.47Å; D121-E124 VanDerWaalsContact N-OE2 3.11Å; D121-E124 WeakPolarHBondContact O-CG 3.28Å; D121-E124 PolarHBondContact O-N 3.4Å; E124-R126 VanDerWaalsContact C-N 3.3Å; E124-R126 VanDerWaalsContact CD-NH2 3.33Å; E124-R126 HydrophobicContact CG-CB 4.28Å; E124-R126 PolarHBondContact O-N 2.73Å; E124-R126 WeakPolarHBondContact OE1-CB 3.35Å; E124-R126 IonicContact OE1-CZ 3.62Å; E124-R126 IonicContact OE1-NE 3.65Å; E124-R126 PolarHBondContact OE1-NE 2.61Å; E124-R126 IonicContact OE1-NH2 3.61Å; E124-R126 PolarHBondContact OE1-NH2 3.31Å; E124-R126 IonicContact OE2-NH2 3.38Å; E124-R126 PolarHBondContact OE2-NH2 3.39Å; E124-V127 HydrophobicContact CG-CG2 4.26Å; E124-V127 PolarHBondContact O-N 3.48Å; E124-V127 VanDerWaalsContact O-N 3.08Å; E124-L128 PolarHBondContact O-N 3.48Å
125	F	98.3	Very high	97.7	Very high	12 Å²	12	36 Å²	36	5%	0.053	19%	0.189	C	C	.	.	H	α-helix	trans	-61.9	-32.6	-171.9	-175.7	-114.7	0	0	0	114.2	V127 L128 L129 L170 A173 L182 L211 T214 Q215	F125-V127 VanDerWaalsContact C-N 3.26Å; F125-V127 PolarHBondContact O-N 3.46Å; F125-L128 HydrophobicContact CD2-CD2 4.16Å; F125-L128 HydrophobicContact CE2-CD2 4.23Å; F125-L128 WeakPolarHBondContact O-CB 3.35Å; F125-L128 PolarHBondContact O-N 3.35Å; F125-L129 HydrophobicContact CD1-CD1 4.07Å; F125-L129 HydrophobicContact CD1-CG 4.19Å; F125-L129 HydrophobicContact CE1-CD1 3.7Å; F125-L129 HydrophobicContact CE1-CD2 3.9Å; F125-L129 HydrophobicContact CE1-CG 3.83Å; F125-L129 HydrophobicContact CE2-CD2 4.3Å; F125-L129 HydrophobicContact CZ-CD1 4.38Å; F125-L129 HydrophobicContact CZ-CD2 3.7Å; F125-L129 HydrophobicContact CZ-CG 4.08Å; F125-L129 WeakPolarHBondContact O-CG 3.17Å; F125-L129 PolarHBondContact O-N 3.2Å; F125-L170 HydrophobicContact CD1-CD2 3.8Å; F125-L170 HydrophobicContact CE1-CD2 3.98Å; F125-A173 HydrophobicContact CZ-CB 4.32Å; F125-L182 HydrophobicContact CE2-CD2 4.03Å; F125-L182 HydrophobicContact CZ-CD2 3.85Å; F125-L211 HydrophobicContact CB-CD1 4.06Å; F125-L211 HydrophobicContact CD2-CG 4.47Å; F125-L211 WeakPolarHBondContact CD2-O 3.32Å; F125-T214 HydrophobicContact CB-CG2 3.94Å; F125-T214 HydrophobicContact CD1-CG2 4.33Å; F125-T214 HydrophobicContact CG-CG2 4.12Å; F125-Q215 HydrophobicContact CD1-CG 4.31Å; F125-Q215 HydrophobicContact CE1-CG 3.88Å; F125-Q215 VanDerWaalsContact CE1-NE2 3.33Å
126	R	98.3	Very high	97.7	Very high	89 Å²	89	36 Å²	36	34%	0.336	19%	0.19	S	C	.	.	H	α-helix	trans	-62.3	-33.4	177.4	-75.1	177.7	-75.7	179.6	4.8	112.3	E124 L129 L130 F166 L170	E124-R126 VanDerWaalsContact C-N 3.3Å; E124-R126 VanDerWaalsContact CD-NH2 3.33Å; E124-R126 HydrophobicContact CG-CB 4.28Å; E124-R126 PolarHBondContact O-N 2.73Å; E124-R126 WeakPolarHBondContact OE1-CB 3.35Å; E124-R126 IonicContact OE1-CZ 3.62Å; E124-R126 IonicContact OE1-NE 3.65Å; E124-R126 PolarHBondContact OE1-NE 2.61Å; E124-R126 IonicContact OE1-NH2 3.61Å; E124-R126 PolarHBondContact OE1-NH2 3.31Å; E124-R126 IonicContact OE2-NH2 3.38Å; E124-R126 PolarHBondContact OE2-NH2 3.39Å; R126-L129 PolarHBondContact O-N 2.98Å; R126-L130 PolarHBondContact O-N 2.91Å; R126-F166 HydrophobicContact CB-CD1 3.87Å; R126-F166 HydrophobicContact CB-CE1 3.72Å; R126-F166 HydrophobicContact CB-CZ 4.3Å; R126-F166 HydrophobicContact CG-CD1 3.9Å; R126-F166 HydrophobicContact CG-CE1 4.26Å; R126-F166 HydrophobicContact CG-CG 4.25Å; R126-L170 HydrophobicContact CG-CD2 4.47Å
127	V	98.1	Very high	97.6	Very high	16 Å²	16	32.9 Å²	32.9	10%	0.097	18%	0.18	C	C	.	.	H	α-helix	trans	-71.4	-40.3	176.6	-179.7	0	0	0	0	110.7	V120 D121 E124 F125 L129 L130 A131	V120-V127 HydrophobicContact CB-CG2 4.22Å; V120-V127 HydrophobicContact CG2-CG2 3.59Å; D121-V127 WeakPolarHBondContact O-CG2 3.12Å; E124-V127 HydrophobicContact CG-CG2 4.26Å; E124-V127 PolarHBondContact O-N 3.48Å; E124-V127 VanDerWaalsContact O-N 3.08Å; F125-V127 VanDerWaalsContact C-N 3.26Å; F125-V127 PolarHBondContact O-N 3.46Å; V127-L129 VanDerWaalsContact C-N 3.3Å; V127-L129 PolarHBondContact O-N 3.31Å; V127-L130 PolarHBondContact O-N 3.4Å; V127-L130 VanDerWaalsContact O-N 3.17Å; V127-A131 PolarHBondContact O-N 3.36Å
128	L	98.4	Very high	97.3	Very high	4 Å²	4	32 Å²	32	2%	0.021	18%	0.177	C	C	.	.	H	α-helix	trans	-59.4	-41.2	171.5	178	63.6	0	0	0	111.6	E124 F125 A131 W132 L182 F185 T186 F189 L211 V212	E124-L128 PolarHBondContact O-N 3.48Å; F125-L128 HydrophobicContact CD2-CD2 4.16Å; F125-L128 HydrophobicContact CE2-CD2 4.23Å; F125-L128 WeakPolarHBondContact O-CB 3.35Å; F125-L128 PolarHBondContact O-N 3.35Å; L128-A131 PolarHBondContact O-N 3.25Å; L128-W132 WeakPolarHBondContact O-CB 3.05Å; L128-W132 PolarHBondContact O-N 2.82Å; L128-L182 HydrophobicContact CG-CD1 4.28Å; L128-F185 HydrophobicContact CD1-CE1 4.32Å; L128-T186 HydrophobicContact CD1-CG2 4.23Å; L128-T186 HydrophobicContact CD2-CG2 4.21Å; L128-F189 HydrophobicContact CD1-CD1 3.83Å; L128-F189 HydrophobicContact CD1-CE1 4.16Å; L128-L211 HydrophobicContact CB-CD2 3.96Å; L128-L211 HydrophobicContact CB-CG 4.41Å; L128-L211 HydrophobicContact CD2-CD2 3.98Å; L128-L211 HydrophobicContact CD2-CG 3.94Å; L128-L211 HydrophobicContact CG-CD2 4.48Å; L128-V212 HydrophobicContact CD2-CB 4.42Å
129	L	98.6	Very high	97.1	Very high	0 Å²	0	33.6 Å²	33.6	0%	0	18%	0.184	C	C	.	.	H	α-helix	trans	-62.4	-41.6	174.8	-66.9	-176.2	0	0	0	112	F125 R126 V127 W132 K133 L169 L170 A173 L182	F125-L129 HydrophobicContact CD1-CD1 4.07Å; F125-L129 HydrophobicContact CD1-CG 4.19Å; F125-L129 HydrophobicContact CE1-CD1 3.7Å; F125-L129 HydrophobicContact CE1-CD2 3.9Å; F125-L129 HydrophobicContact CE1-CG 3.83Å; F125-L129 HydrophobicContact CE2-CD2 4.3Å; F125-L129 HydrophobicContact CZ-CD1 4.38Å; F125-L129 HydrophobicContact CZ-CD2 3.7Å; F125-L129 HydrophobicContact CZ-CG 4.08Å; F125-L129 WeakPolarHBondContact O-CG 3.17Å; F125-L129 PolarHBondContact O-N 3.2Å; R126-L129 PolarHBondContact O-N 2.98Å; V127-L129 VanDerWaalsContact C-N 3.3Å; V127-L129 PolarHBondContact O-N 3.31Å; L129-W132 HydrophobicContact CD2-CE3 4.03Å; L129-W132 HydrophobicContact CD2-CZ3 4.41Å; L129-W132 WeakPolarHBondContact O-CB 2.99Å; L129-W132 PolarHBondContact O-N 3.18Å; L129-K133 WeakPolarHBondContact O-CG 3.35Å; L129-K133 PolarHBondContact O-N 3.19Å; L129-L169 HydrophobicContact CD1-CB 4.13Å; L129-L170 HydrophobicContact CD1-CD2 3.85Å; L129-L170 HydrophobicContact CD1-CG 4.21Å; L129-A173 HydrophobicContact CD1-CB 4.41Å; L129-A173 HydrophobicContact CD2-CB 3.64Å; L129-L182 HydrophobicContact CD2-CD1 4.18Å; L129-L182 HydrophobicContact CD2-CD2 3.66Å
130	L	98.5	Very high	96.9	Very high	2 Å²	2	29.2 Å²	29.2	1%	0.01	16%	0.155	C	C	.	.	H	α-helix	trans	-61.7	-48.1	175	-73.5	175.6	0	0	0	111.5	F114 L118 R126 V127 W132 K133 F134 I154 I162 F166 L169	F114-L130 HydrophobicContact CE1-CD1 4.23Å; L118-L130 HydrophobicContact CD1-CD1 3.63Å; R126-L130 PolarHBondContact O-N 2.91Å; V127-L130 PolarHBondContact O-N 3.4Å; V127-L130 VanDerWaalsContact O-N 3.17Å; L130-W132 PolarHBondContact O-N 3.36Å; L130-K133 PolarHBondContact O-N 3.44Å; L130-K133 VanDerWaalsContact O-N 3.14Å; L130-F134 HydrophobicContact CD2-CE1 4.25Å; L130-F134 VanDerWaalsContact O-CB 3.29Å; L130-F134 WeakPolarHBondContact O-CB 3.09Å; L130-F134 VanDerWaalsContact O-CD1 3.26Å; L130-F134 WeakPolarHBondContact O-CD1 3.44Å; L130-F134 WeakPolarHBondContact O-CG 3.5Å; L130-F134 PolarHBondContact O-N 2.73Å; L130-I154 HydrophobicContact CD2-CD1 4.21Å; L130-I162 HydrophobicContact CD1-CG2 4.14Å; L130-I162 HydrophobicContact CD2-CG2 3.7Å; L130-F166 HydrophobicContact CD1-CE1 3.81Å; L130-F166 HydrophobicContact CD1-CZ 3.9Å; L130-F166 HydrophobicContact CD2-CE1 4.18Å; L130-F166 HydrophobicContact CG-CE1 3.86Å; L130-F166 HydrophobicContact CG-CZ 4.44Å; L130-L169 HydrophobicContact CD2-CD1 4.36Å
131	A	98.6	Very high	96.9	Very high	1 Å²	1	30.6 Å²	30.6	1%	0.008	16%	0.16	C	C	.	.	H	α-helix	trans	-55.9	-42.3	176.1	0	0	0	0	0	111.6	V127 L128 F134 Q135 A136 F142 F185 F189	V127-A131 PolarHBondContact O-N 3.36Å; L128-A131 PolarHBondContact O-N 3.25Å; A131-F134 CarbonylContact O-C 2.97Å; A131-F134 PolarHBondContact O-N 3.09Å; A131-Q135 PolarHBondContact O-N 2.99Å; A131-A136 HydrophobicContact CB-CB 4.1Å; A131-A136 PolarHBondContact O-N 2.84Å; A131-F142 HydrophobicContact CB-CE1 4.2Å; A131-F142 HydrophobicContact CB-CZ 4.47Å; A131-F185 HydrophobicContact CB-CE1 4.16Å; A131-F185 HydrophobicContact CB-CZ 4.1Å; A131-F185 VanDerWaalsContact O-CZ 3.23Å; A131-F185 WeakPolarHBondContact O-CZ 3.44Å; A131-F189 HydrophobicContact CB-CD2 4.19Å; A131-F189 HydrophobicContact CB-CE1 4.08Å; A131-F189 HydrophobicContact CB-CE2 3.67Å; A131-F189 HydrophobicContact CB-CZ 3.6Å
132	W	98.6	Very high	97	Very high	5 Å²	5	28.2 Å²	28.2	2%	0.019	15%	0.147	C	C	.	.	H	α-helix	trans	-63.2	-47.7	175	171.8	53.7	0	0	0	112.5	L128 L129 L130 F134 Q135 E172 K178 D181 L182 F185	L128-W132 WeakPolarHBondContact O-CB 3.05Å; L128-W132 PolarHBondContact O-N 2.82Å; L129-W132 HydrophobicContact CD2-CE3 4.03Å; L129-W132 HydrophobicContact CD2-CZ3 4.41Å; L129-W132 WeakPolarHBondContact O-CB 2.99Å; L129-W132 PolarHBondContact O-N 3.18Å; L130-W132 PolarHBondContact O-N 3.36Å; W132-F134 PolarHBondContact O-N 3.25Å; W132-Q135 PolarHBondContact O-N 2.98Å; W132-Q135 VanDerWaalsContact O-N 3.14Å; W132-Q135 PolarHBondContact O-NE2 3.2Å; W132-E172 HydrophobicContact CH2-CG 4.2Å; W132-K178 HydrophobicContact CH2-CB 4.11Å; W132-K178 HydrophobicContact CH2-CD 4.24Å; W132-K178 HydrophobicContact CZ2-CB 4.49Å; W132-K178 HydrophobicContact CZ2-CD 4.37Å; W132-D181 PolarHBondContact NE1-OD2 2.76Å; W132-L182 HydrophobicContact CB-CD1 3.65Å; W132-L182 HydrophobicContact CD2-CB 4.15Å; W132-L182 HydrophobicContact CD2-CD1 3.87Å; W132-L182 HydrophobicContact CE3-CD1 4.16Å; W132-L182 HydrophobicContact CG-CB 4.47Å; W132-L182 HydrophobicContact CG-CD1 3.65Å; W132-L182 HydrophobicContact CZ2-CB 4.43Å; W132-F185 HydrophobicContact CB-CD1 3.61Å; W132-F185 HydrophobicContact CB-CE1 3.71Å; W132-F185 HydrophobicContact CB-CG 4.19Å; W132-F185 HydrophobicContact CB-CZ 4.36Å; W132-F185 AromaticContact CD1-CD1 3.92Å; W132-F185 AromaticContact CD1-CG 3.65Å; W132-F185 HydrophobicContact CG-CD1 4.12Å; W132-F185 HydrophobicContact CG-CG 4.3Å
133	K	98.5	Very high	97.1	Very high	40 Å²	40	29 Å²	29	17%	0.174	15%	0.151	C	C	.	.	H	α-helix	trans	-65.1	-30.2	177.4	-62.9	-47.8	-64	-163.8	0	112.7	L129 L130 Q135 I154 L169 E172	L129-K133 WeakPolarHBondContact O-CG 3.35Å; L129-K133 PolarHBondContact O-N 3.19Å; L130-K133 PolarHBondContact O-N 3.44Å; L130-K133 VanDerWaalsContact O-N 3.14Å; K133-Q135 VanDerWaalsContact C-N 3.28Å; K133-I154 HydrophobicContact CB-CG2 3.86Å; K133-I154 HydrophobicContact CG-CG2 3.98Å; K133-L169 HydrophobicContact CD-CD2 3.83Å; K133-L169 HydrophobicContact CG-CD1 4.23Å; K133-L169 HydrophobicContact CG-CD2 3.65Å; K133-E172 VanDerWaalsContact NZ-CD 3.28Å; K133-E172 IonicContact NZ-OE1 3.73Å; K133-E172 PolarHBondContact NZ-OE1 3.14Å; K133-E172 IonicContact NZ-OE2 3.78Å; K133-E172 PolarHBondContact NZ-OE2 3.33Å
134	F	98.5	Very high	97.3	Very high	4 Å²	4	29.7 Å²	29.7	2%	0.018	15%	0.149	C	C	.	.	H	α-helix	trans	-86.2	-6.2	-180	-72.8	27.6	0	0	0	111.7	L130 A131 W132 A136 F142 E146 F147 C151 I154	L130-F134 HydrophobicContact CD2-CE1 4.25Å; L130-F134 VanDerWaalsContact O-CB 3.29Å; L130-F134 WeakPolarHBondContact O-CB 3.09Å; L130-F134 VanDerWaalsContact O-CD1 3.26Å; L130-F134 WeakPolarHBondContact O-CD1 3.44Å; L130-F134 WeakPolarHBondContact O-CG 3.5Å; L130-F134 PolarHBondContact O-N 2.73Å; A131-F134 CarbonylContact O-C 2.97Å; A131-F134 PolarHBondContact O-N 3.09Å; W132-F134 PolarHBondContact O-N 3.25Å; F134-A136 PolarHBondContact O-N 3.2Å; F134-F142 HydrophobicContact CB-CE1 4.43Å; F134-F142 HydrophobicContact CD2-CD1 4.4Å; F134-F142 HydrophobicContact CD2-CD2 4.07Å; F134-F142 HydrophobicContact CD2-CE1 4.4Å; F134-F142 HydrophobicContact CD2-CE2 4.03Å; F134-F142 HydrophobicContact CD2-CG 4.26Å; F134-F142 HydrophobicContact CD2-CZ 4.21Å; F134-F142 HydrophobicContact CE2-CD2 4.4Å; F134-F142 HydrophobicContact CE2-CE2 4.33Å; F134-E146 WeakPolarHBondContact O-CB 3.42Å; F134-F147 HydrophobicContact CD2-CD2 4.34Å; F134-F147 AromaticContact CE2-CD2 3.69Å; F134-F147 HydrophobicContact CE2-CD2 3.69Å; F134-F147 HydrophobicContact CE2-CE2 4.11Å; F134-F147 HydrophobicContact CE2-CG 4.33Å; F134-C151 VanDerWaalsContact CZ-SG 3.59Å; F134-I154 HydrophobicContact CE1-CD1 3.96Å; F134-I154 HydrophobicContact CE1-CG1 4.49Å; F134-I154 HydrophobicContact CZ-CD1 4.48Å
135	Q	98.1	Very high	97.4	Very high	119 Å²	119	34.5 Å²	34.5	56%	0.556	17%	0.17	S	C	*	.	T	Hydrogen-bonded Turn	trans	53.5	41.3	-175.7	-62.8	-72.4	-70.4	0	0	111.9	A131 W132 K133 A137	A131-Q135 PolarHBondContact O-N 2.99Å; W132-Q135 PolarHBondContact O-N 2.98Å; W132-Q135 VanDerWaalsContact O-N 3.14Å; W132-Q135 PolarHBondContact O-NE2 3.2Å; K133-Q135 VanDerWaalsContact C-N 3.28Å; Q135-A137 PolarHBondContact O-N 2.91Å
136	A	97.6	Very high	97.4	Very high	2 Å²	2	35.3 Å²	35.3	2%	0.017	17%	0.173	C	C	.	.			trans	-63.4	125.5	-177	0	0	0	0	0	111.3	A131 F134 F142 E146 F185 F189	A131-A136 HydrophobicContact CB-CB 4.1Å; A131-A136 PolarHBondContact O-N 2.84Å; F134-A136 PolarHBondContact O-N 3.2Å; A136-F142 HydrophobicContact CB-CD1 3.64Å; A136-F142 HydrophobicContact CB-CE1 3.5Å; A136-E146 WeakPolarHBondContact CA-OE1 3.22Å; A136-F185 WeakPolarHBondContact O-CE2 3.31Å; A136-F185 WeakPolarHBondContact O-CZ 3.47Å; A136-F189 HydrophobicContact CB-CD2 4.26Å; A136-F189 HydrophobicContact CB-CE2 4.03Å
137	A	95.1	Very high	97.5	Very high	52 Å²	52	31 Å²	31	43%	0.43	16%	0.157	S	C	.	.	S	Bend	trans	-76.9	-28	-178	0	0	0	0	0	113.5	Q135 E146	Q135-A137 PolarHBondContact O-N 2.91Å; A137-E146 PolarHBondContact N-OE1 3.38Å
138	T	92.7	Very high	97.5	Very high	30 Å²	30	31.5 Å²	31.5	18%	0.184	16%	0.158	C	C	.	.	S	Bend	trans	-138.5	137.6	-170.2	-49.5	0	0	0	0	110.8	K141	T138-K141 PolarHBondContact O-N 3.42Å
139	M	93.9	Very high	97.5	Very high	38 Å²	38	34.7 Å²	34.7	19%	0.187	18%	0.175	C	C	.	.	T	Hydrogen-bonded Turn	trans	-54.9	146.8	170.9	-76.4	-177	-64	0	0	111.6	K141 F189 G190 I204	M139-K141 PolarHBondContact O-N 3.45Å; M139-F189 HydrophobicContact CB-CE2 4.47Å; M139-F189 HydrophobicContact CB-CZ 4.29Å; M139-F189 HydrophobicContact CG-CD1 3.96Å; M139-F189 HydrophobicContact CG-CD2 4.33Å; M139-F189 HydrophobicContact CG-CE1 3.63Å; M139-F189 HydrophobicContact CG-CE2 4.02Å; M139-F189 HydrophobicContact CG-CG 4.3Å; M139-F189 HydrophobicContact CG-CZ 3.67Å; M139-F189 WeakPolarHBondContact CG-O 3.47Å; M139-G190 WeakPolarHBondContact CE-O 3.2Å; M139-I204 HydrophobicContact CE-CD1 4.34Å; M139-I204 HydrophobicContact CE-CG2 4.24Å
140	C	94.8	Very high	97.5	Very high	21 Å²	21	34.7 Å²	34.7	14%	0.142	18%	0.175	C	C	.	.	T	Hydrogen-bonded Turn	trans	63.1	10.9	-179.2	-59.3	0	0	0	0	116.1	C8 L107 E108	C8-C140 WeakPolarHBondContact CB-SG 3.39Å; L107-C140 CarbonylContact C-O 3.52Å; L107-C140 VanDerWaalsContact C-O 3.24Å; L107-C140 WeakPolarHBondContact CA-O 3.29Å; E108-C140 HydrophobicContact CB-CB 4.35Å; E108-C140 PolarHBondContact N-O 2.98Å
141	K	96.4	Very high	97.5	Very high	39 Å²	39	34.6 Å²	34.6	17%	0.17	18%	0.175	C	C	.	.			trans	-135.3	126.9	-176.2	-178	173.5	175.7	177.5	0	111	A105 I106 L107 T138 M139 E194	A105-K141 HydrophobicContact CB-CG 4.42Å; I106-K141 VanDerWaalsContact O-CA 3.29Å; I106-K141 WeakPolarHBondContact O-CA 3.35Å; L107-K141 HydrophobicContact CD2-CD 4.3Å; L107-K141 HydrophobicContact CD2-CG 4.05Å; T138-K141 PolarHBondContact O-N 3.42Å; M139-K141 PolarHBondContact O-N 3.45Å; K141-E194 IonicContact NZ-OE1 3.19Å; K141-E194 PolarHBondContact NZ-OE1 2.87Å
142	F	98.1	Very high	97.4	Very high	4 Å²	4	40 Å²	40	2%	0.018	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	111.8	159.5	-63.6	-34.7	0	0	0	108.6	A105 I106 M111 F114 A131 F134 A136 F147	A105-F142 CarbonylContact C-O 3.57Å; A105-F142 WeakPolarHBondContact CA-O 3.46Å; I106-F142 HydrophobicContact CB-CB 4.34Å; I106-F142 PolarHBondContact N-O 3.3Å; I106-F142 PolarHBondContact O-N 3.41Å; M111-F142 HydrophobicContact CE-CD1 4.07Å; M111-F142 HydrophobicContact CE-CD2 3.38Å; M111-F142 HydrophobicContact CE-CE1 4.06Å; M111-F142 HydrophobicContact CE-CE2 3.4Å; M111-F142 VanDerWaalsContact CE-CE2 3.4Å; M111-F142 HydrophobicContact CE-CG 3.73Å; M111-F142 HydrophobicContact CE-CZ 3.76Å; M111-F142 HydrophobicContact SD-CD2 4.23Å; M111-F142 HydrophobicContact SD-CE2 3.77Å; M111-F142 HydrophobicContact SD-CZ 4.2Å; F114-F142 HydrophobicContact CD1-CE2 4.31Å; F114-F142 AromaticContact CE1-CE2 3.98Å; F114-F142 HydrophobicContact CE1-CE2 3.98Å; A131-F142 HydrophobicContact CB-CE1 4.2Å; A131-F142 HydrophobicContact CB-CZ 4.47Å; F134-F142 HydrophobicContact CB-CE1 4.43Å; F134-F142 HydrophobicContact CD2-CD1 4.4Å; F134-F142 HydrophobicContact CD2-CD2 4.07Å; F134-F142 HydrophobicContact CD2-CE1 4.4Å; F134-F142 HydrophobicContact CD2-CE2 4.03Å; F134-F142 HydrophobicContact CD2-CG 4.26Å; F134-F142 HydrophobicContact CD2-CZ 4.21Å; F134-F142 HydrophobicContact CE2-CD2 4.4Å; F134-F142 HydrophobicContact CE2-CE2 4.33Å; A136-F142 HydrophobicContact CB-CD1 3.64Å; A136-F142 HydrophobicContact CB-CE1 3.5Å; F142-F147 HydrophobicContact CB-CB 4.4Å; F142-F147 HydrophobicContact CD2-CD2 4.25Å
143	T	98.1	Very high	97.4	Very high	45 Å²	45	43 Å²	43	28%	0.276	22%	0.224	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-60	157.1	167	64.5	0	0	0	0	110	K145 E146 F147	T143-K145 PolarHBondContact O-N 3.38Å; T143-E146 WeakPolarHBondContact CB-OE2 3.14Å; T143-E146 WeakPolarHBondContact CG2-OE2 3.45Å; T143-E146 PolarHBondContact N-OE2 3.2Å; T143-E146 PolarHBondContact O-N 3.12Å; T143-E146 WeakPolarHBondContact OG1-CB 3.2Å; T143-E146 VanDerWaalsContact OG1-CG 3.22Å; T143-E146 WeakPolarHBondContact OG1-CG 3.36Å; T143-E146 PolarHBondContact OG1-N 3.01Å; T143-E146 PolarHBondContact OG1-OE2 3.04Å; T143-F147 PolarHBondContact O-N 2.85Å
144	R	98.5	Very high	97.3	Very high	56 Å²	56	41.5 Å²	41.5	21%	0.211	22%	0.218	C	C	.	.	H	α-helix	trans	-48	-46.5	172.6	176.6	177	-65.4	-78.4	5.4	112.3	E92 F95 D104 F147 F148	E92-R144 IonicContact OE1-NH1 2.79Å; E92-R144 IonicContact OE1-NH2 3.16Å; E92-R144 IonicContact OE2-CZ 3.77Å; E92-R144 IonicContact OE2-NH1 2.81Å; E92-R144 PolarHBondContact OE2-NH1 2.98Å; F95-R144 VanDerWaalsContact CD1-CZ 3.42Å; F95-R144 HydrophobicContact CE1-CB 3.99Å; F95-R144 HydrophobicContact CE1-CG 4.22Å; F95-R144 VanDerWaalsContact CE1-NH2 3.25Å; F95-R144 HydrophobicContact CE2-CB 4.18Å; F95-R144 VanDerWaalsContact CZ-CA 3.48Å; F95-R144 HydrophobicContact CZ-CB 3.63Å; F95-R144 HydrophobicContact CZ-CG 4.26Å; D104-R144 PolarHBondContact O-N 3.13Å; D104-R144 VanDerWaalsContact O-N 3.12Å; D104-R144 IonicContact OD1-CZ 2.74Å; D104-R144 VanDerWaalsContact OD1-CZ 3.25Å; D104-R144 IonicContact OD1-NE 2.7Å; D104-R144 PolarHBondContact OD1-NE 3.47Å; D104-R144 IonicContact OD1-NH2 2.69Å; D104-R144 PolarHBondContact OD1-NH2 3.42Å; D104-R144 VanDerWaalsContact OD2-CD 3.3Å; D104-R144 WeakPolarHBondContact OD2-CD 3.21Å; D104-R144 IonicContact OD2-CZ 3.72Å; D104-R144 IonicContact OD2-NE 3.76Å; D104-R144 PolarHBondContact OD2-NE 3.22Å; R144-F147 PolarHBondContact O-N 2.96Å; R144-F148 HydrophobicContact CG-CD2 3.82Å; R144-F148 HydrophobicContact CG-CE2 3.89Å; R144-F148 WeakPolarHBondContact O-CB 3.29Å; R144-F148 WeakPolarHBondContact O-CD2 3.24Å; R144-F148 PolarHBondContact O-N 3.34Å
145	K	98.4	Very high	97.3	Very high	146 Å²	146	45.5 Å²	45.5	64%	0.635	25%	0.246	S	C	*	.	H	α-helix	trans	-61.2	-50.4	-178.3	177.7	171.5	163.3	49.8	0	111.6	T143 F147 F148 D149	T143-K145 PolarHBondContact O-N 3.38Å; K145-F147 VanDerWaalsContact C-N 3.34Å; K145-F147 PolarHBondContact O-N 2.94Å; K145-F148 PolarHBondContact O-N 3.17Å; K145-D149 WeakPolarHBondContact CG-OD2 3.22Å; K145-D149 IonicContact NZ-OD2 3.48Å; K145-D149 PolarHBondContact NZ-OD2 3.34Å; K145-D149 VanDerWaalsContact O-CB 3.31Å; K145-D149 WeakPolarHBondContact O-CB 3.44Å; K145-D149 PolarHBondContact O-N 3.08Å
146	E	98.5	Very high	97.3	Very high	28 Å²	28	40.2 Å²	40.2	13%	0.131	22%	0.223	C	C	.	.	H	α-helix	trans	-59.7	-44.2	178.8	-70.4	159.8	153.5	0	0	111.6	F134 A136 A137 T143 G150	F134-E146 WeakPolarHBondContact O-CB 3.42Å; A136-E146 WeakPolarHBondContact CA-OE1 3.22Å; A137-E146 PolarHBondContact N-OE1 3.38Å; T143-E146 WeakPolarHBondContact CB-OE2 3.14Å; T143-E146 WeakPolarHBondContact CG2-OE2 3.45Å; T143-E146 PolarHBondContact N-OE2 3.2Å; T143-E146 PolarHBondContact O-N 3.12Å; T143-E146 WeakPolarHBondContact OG1-CB 3.2Å; T143-E146 VanDerWaalsContact OG1-CG 3.22Å; T143-E146 WeakPolarHBondContact OG1-CG 3.36Å; T143-E146 PolarHBondContact OG1-N 3.01Å; T143-E146 PolarHBondContact OG1-OE2 3.04Å; E146-G150 WeakPolarHBondContact O-CA 3.26Å; E146-G150 PolarHBondContact O-N 2.95Å
147	F	98.7	Very high	97.3	Very high	0 Å²	0	41.1 Å²	41.1	0%	0	23%	0.227	C	C	.	.	H	α-helix	trans	-63	-47.5	179	-171.1	-95.5	0	0	0	112.1	L91 L94 F95 I106 F114 F134 F142 T143 R144 K145 C151	L91-F147 HydrophobicContact CD1-CD1 4.08Å; L91-F147 HydrophobicContact CD1-CE1 3.65Å; L94-F147 HydrophobicContact CD2-CE1 4.24Å; L94-F147 HydrophobicContact CD2-CZ 3.89Å; L94-F147 HydrophobicContact CG-CE1 4.32Å; L94-F147 HydrophobicContact CG-CZ 3.98Å; F95-F147 HydrophobicContact CB-CD1 3.88Å; F95-F147 HydrophobicContact CB-CE1 3.89Å; F95-F147 HydrophobicContact CD2-CB 3.81Å; F95-F147 AromaticContact CD2-CD1 3.56Å; F95-F147 HydrophobicContact CD2-CD1 3.56Å; F95-F147 HydrophobicContact CD2-CD2 4.45Å; F95-F147 HydrophobicContact CD2-CE1 4.21Å; F95-F147 AromaticContact CD2-CG 3.68Å; F95-F147 HydrophobicContact CD2-CG 3.68Å; F95-F147 HydrophobicContact CE2-CB 4.01Å; F95-F147 HydrophobicContact CE2-CG 4.33Å; F95-F147 HydrophobicContact CG-CD1 4.17Å; I106-F147 HydrophobicContact CD1-CD2 3.45Å; I106-F147 VanDerWaalsContact CD1-CD2 3.45Å; I106-F147 HydrophobicContact CD1-CE2 3.63Å; I106-F147 HydrophobicContact CD1-CG 4.05Å; I106-F147 HydrophobicContact CD1-CZ 4.35Å; F114-F147 AromaticContact CE2-CE2 3.97Å; F114-F147 HydrophobicContact CE2-CE2 3.97Å; F114-F147 HydrophobicContact CE2-CZ 4.38Å; F114-F147 HydrophobicContact CZ-CE2 4.06Å; F134-F147 HydrophobicContact CD2-CD2 4.34Å; F134-F147 AromaticContact CE2-CD2 3.69Å; F134-F147 HydrophobicContact CE2-CD2 3.69Å; F134-F147 HydrophobicContact CE2-CE2 4.11Å; F134-F147 HydrophobicContact CE2-CG 4.33Å; F142-F147 HydrophobicContact CB-CB 4.4Å; F142-F147 HydrophobicContact CD2-CD2 4.25Å; T143-F147 PolarHBondContact O-N 2.85Å; R144-F147 PolarHBondContact O-N 2.96Å; K145-F147 VanDerWaalsContact C-N 3.34Å; K145-F147 PolarHBondContact O-N 2.94Å; F147-C151 VanDerWaalsContact O-CB 3.22Å; F147-C151 WeakPolarHBondContact O-CB 3.48Å; F147-C151 PolarHBondContact O-N 3.38Å; F147-C151 PolarHBondContact O-SG 3.43Å; F147-C151 VanDerWaalsContact O-SG 3.34Å
148	F	98.4	Very high	97.4	Very high	26 Å²	26	40.6 Å²	40.6	11%	0.114	22%	0.221	C	C	.	.	H	α-helix	trans	-68.7	-46.7	-178.4	-87.1	-108.7	0	0	0	112.4	L91 E92 F95 R144 K145 G150 K152	L91-F148 HydrophobicContact CB-CE1 4.21Å; L91-F148 HydrophobicContact CD2-CB 4.3Å; L91-F148 HydrophobicContact CD2-CD1 3.48Å; L91-F148 VanDerWaalsContact CD2-CD1 3.48Å; L91-F148 HydrophobicContact CD2-CE1 3.94Å; L91-F148 HydrophobicContact CD2-CG 3.95Å; L91-F148 HydrophobicContact CG-CD1 3.8Å; L91-F148 HydrophobicContact CG-CE1 3.81Å; L91-F148 HydrophobicContact CG-CG 4.2Å; L91-F148 HydrophobicContact CG-CZ 4.22Å; E92-F148 HydrophobicContact CB-CZ 4.16Å; E92-F148 VanDerWaalsContact OE2-CZ 3.29Å; E92-F148 WeakPolarHBondContact OE2-CZ 3.37Å; F95-F148 HydrophobicContact CB-CE2 3.72Å; F95-F148 HydrophobicContact CB-CZ 4.37Å; F95-F148 HydrophobicContact CD1-CE2 4.23Å; F95-F148 HydrophobicContact CD2-CE2 4.35Å; F95-F148 AromaticContact CG-CE2 3.84Å; F95-F148 HydrophobicContact CG-CE2 3.84Å; R144-F148 HydrophobicContact CG-CD2 3.82Å; R144-F148 HydrophobicContact CG-CE2 3.89Å; R144-F148 WeakPolarHBondContact O-CB 3.29Å; R144-F148 WeakPolarHBondContact O-CD2 3.24Å; R144-F148 PolarHBondContact O-N 3.34Å; K145-F148 PolarHBondContact O-N 3.17Å; F148-G150 VanDerWaalsContact C-N 3.33Å; F148-K152 WeakPolarHBondContact O-CB 3.45Å; F148-K152 VanDerWaalsContact O-CG 3.24Å; F148-K152 WeakPolarHBondContact O-CG 3.33Å; F148-K152 PolarHBondContact O-N 3.42Å
149	D	98.5	Very high	97.7	Very high	70 Å²	70	40.4 Å²	40.4	37%	0.374	22%	0.218	S	C	.	.	H	α-helix	trans	-66.7	-39	179.7	-70.5	-11.7	0	0	0	110.9	K145 K152 A153	K145-D149 WeakPolarHBondContact CG-OD2 3.22Å; K145-D149 IonicContact NZ-OD2 3.48Å; K145-D149 PolarHBondContact NZ-OD2 3.34Å; K145-D149 VanDerWaalsContact O-CB 3.31Å; K145-D149 WeakPolarHBondContact O-CB 3.44Å; K145-D149 PolarHBondContact O-N 3.08Å; D149-K152 PolarHBondContact O-N 3.33Å; D149-A153 VanDerWaalsContact O-CB 3.28Å; D149-A153 WeakPolarHBondContact O-CB 3.27Å; D149-A153 PolarHBondContact O-N 2.89Å
150	G	98.5	Very high	97.9	Very high	1 Å²	1	45 Å²	45	1%	0.01	24%	0.243	C	C	.	.	H	α-helix	trans	-62.6	-50	175.6	0	0	0	0	0	113.1	E146 F148 K152 A153 I154	E146-G150 WeakPolarHBondContact O-CA 3.26Å; E146-G150 PolarHBondContact O-N 2.95Å; F148-G150 VanDerWaalsContact C-N 3.33Å; G150-K152 VanDerWaalsContact C-N 3.33Å; G150-K152 PolarHBondContact O-N 3.41Å; G150-A153 WeakPolarHBondContact O-CB 3.33Å; G150-A153 PolarHBondContact O-N 3.02Å; G150-A153 VanDerWaalsContact O-N 3.12Å; G150-I154 WeakPolarHBondContact O-CG1 3.44Å; G150-I154 PolarHBondContact O-N 3.43Å
151	C	98.4	Very high	98.1	Very high	0 Å²	0	44.9 Å²	44.9	0%	0	25%	0.246	C	C	.	.	H	α-helix	trans	-58.2	-42.8	174.9	-81.8	0	0	0	0	112.2	L91 F134 F147 I154 S155 A156	L91-C151 HydrophobicContact CD1-CB 3.44Å; L91-C151 VanDerWaalsContact CD1-CB 3.44Å; L91-C151 VanDerWaalsContact CD1-SG 3.59Å; L91-C151 HydrophobicContact CD2-CB 3.99Å; L91-C151 HydrophobicContact CG-CB 4.38Å; F134-C151 VanDerWaalsContact CZ-SG 3.59Å; F147-C151 VanDerWaalsContact O-CB 3.22Å; F147-C151 WeakPolarHBondContact O-CB 3.48Å; F147-C151 PolarHBondContact O-N 3.38Å; F147-C151 PolarHBondContact O-SG 3.43Å; F147-C151 VanDerWaalsContact O-SG 3.34Å; C151-I154 CarbonylContact O-C 3.49Å; C151-I154 PolarHBondContact O-N 3.12Å; C151-S155 PolarHBondContact O-N 3.04Å; C151-A156 CarbonylContact C-O 3.24Å; C151-A156 VanDerWaalsContact CB-O 3.25Å; C151-A156 WeakPolarHBondContact CB-O 3.43Å; C151-A156 PolarHBondContact O-N 3.04Å
152	K	97.4	Very high	98.2	Very high	114 Å²	114	43 Å²	43	50%	0.496	24%	0.238	S	C	.	.	H	α-helix	trans	-62.5	-43.3	172.6	-72.9	171.2	-176.2	175.4	0	112.1	F148 D149 G150 I154 S155	F148-K152 WeakPolarHBondContact O-CB 3.45Å; F148-K152 VanDerWaalsContact O-CG 3.24Å; F148-K152 WeakPolarHBondContact O-CG 3.33Å; F148-K152 PolarHBondContact O-N 3.42Å; D149-K152 PolarHBondContact O-N 3.33Å; G150-K152 VanDerWaalsContact C-N 3.33Å; G150-K152 PolarHBondContact O-N 3.41Å; K152-I154 VanDerWaalsContact C-N 3.26Å; K152-I154 PolarHBondContact O-N 2.96Å; K152-S155 PolarHBondContact O-N 2.8Å
153	A	97.6	Very high	98.2	Very high	67 Å²	67	44.7 Å²	44.7	55%	0.554	25%	0.25	S	C	*	.	H	α-helix	trans	-64.2	-29.9	-179	0	0	0	0	0	113.1	D149 G150	D149-A153 VanDerWaalsContact O-CB 3.28Å; D149-A153 WeakPolarHBondContact O-CB 3.27Å; D149-A153 PolarHBondContact O-N 2.89Å; G150-A153 WeakPolarHBondContact O-CB 3.33Å; G150-A153 PolarHBondContact O-N 3.02Å; G150-A153 VanDerWaalsContact O-N 3.12Å
154	I	98	Very high	98.2	Very high	10 Å²	10	45.9 Å²	45.9	5%	0.051	26%	0.264	C	S	.	.	T	Hydrogen-bonded Turn	trans	-98	6	174.1	70.1	172.6	0	0	0	113	L130 K133 F134 G150 C151 K152 A156 I162 R165 L169	L130-I154 HydrophobicContact CD2-CD1 4.21Å; K133-I154 HydrophobicContact CB-CG2 3.86Å; K133-I154 HydrophobicContact CG-CG2 3.98Å; F134-I154 HydrophobicContact CE1-CD1 3.96Å; F134-I154 HydrophobicContact CE1-CG1 4.49Å; F134-I154 HydrophobicContact CZ-CD1 4.48Å; G150-I154 WeakPolarHBondContact O-CG1 3.44Å; G150-I154 PolarHBondContact O-N 3.43Å; C151-I154 CarbonylContact O-C 3.49Å; C151-I154 PolarHBondContact O-N 3.12Å; K152-I154 VanDerWaalsContact C-N 3.26Å; K152-I154 PolarHBondContact O-N 2.96Å; I154-A156 HydrophobicContact CD1-CB 4.13Å; I154-A156 HydrophobicContact CG1-CB 3.96Å; I154-A156 PolarHBondContact O-N 2.98Å; I154-I162 HydrophobicContact CD1-CB 4.45Å; I154-I162 HydrophobicContact CD1-CG1 4.09Å; I154-I162 HydrophobicContact CD1-CG2 4.17Å; I154-R165 HydrophobicContact CB-CG 4.25Å; I154-R165 WeakPolarHBondContact O-CD 3.46Å; I154-R165 WeakPolarHBondContact O-CG 3.23Å; I154-R165 PolarHBondContact O-NE 3.23Å; I154-L169 HydrophobicContact CG2-CD1 4.48Å; I154-L169 HydrophobicContact CG2-CD2 4.19Å
155	S	97.2	Very high	98.2	Very high	87 Å²	87	48 Å²	48	61%	0.608	27%	0.272	S	S	*	.	T	Hydrogen-bonded Turn	trans	48.9	55.4	-178.3	-56.9	0	0	0	0	112.7	C151 K152 R165	C151-S155 PolarHBondContact O-N 3.04Å; K152-S155 PolarHBondContact O-N 2.8Å; S155-R165 PolarHBondContact O-NH2 3.33Å
156	A	97.9	Very high	98.2	Very high	8 Å²	8	41.6 Å²	41.6	7%	0.066	24%	0.244	C	C	.	.			trans	-137.8	139.9	176.9	0	0	0	0	0	111.3	C151 I154 I162	C151-A156 CarbonylContact C-O 3.24Å; C151-A156 VanDerWaalsContact CB-O 3.25Å; C151-A156 WeakPolarHBondContact CB-O 3.43Å; C151-A156 PolarHBondContact O-N 3.04Å; I154-A156 HydrophobicContact CD1-CB 4.13Å; I154-A156 HydrophobicContact CG1-CB 3.96Å; I154-A156 PolarHBondContact O-N 2.98Å; A156-I162 HydrophobicContact CB-CG1 3.76Å
157	D	97.6	Very high	98.2	Very high	21 Å²	21	44.2 Å²	44.2	11%	0.112	26%	0.264	C	S	.	.	S	Bend	trans	-134	19.8	177.3	59	4.8	0	0	0	112.4	S87 R90 L91	S87-D157 WeakPolarHBondContact CA-OD2 3.37Å; S87-D157 VanDerWaalsContact CB-OD2 3.28Å; S87-D157 WeakPolarHBondContact CB-OD2 3.48Å; S87-D157 PolarHBondContact OG-OD2 3.31Å; R90-D157 HydrophobicContact CB-CB 4.39Å; R90-D157 IonicContact CZ-OD1 3.01Å; R90-D157 IonicContact CZ-OD2 3.17Å; R90-D157 IonicContact NE-OD1 2.66Å; R90-D157 IonicContact NE-OD2 3.87Å; R90-D157 PolarHBondContact NE-OD2 3.4Å; R90-D157 VanDerWaalsContact NE-OD2 3.12Å; R90-D157 IonicContact NH2-OD1 3.85Å; R90-D157 PolarHBondContact NH2-OD1 2.67Å; R90-D157 IonicContact NH2-OD2 2.81Å; R90-D157 PolarHBondContact NH2-OD2 3.37Å; L91-D157 HydrophobicContact CB-CB 4.36Å
158	S	98.2	Very high	98.2	Very high	42 Å²	42	47.1 Å²	47.1	29%	0.294	28%	0.284	S	S	.	.	S	Bend	trans	-152.6	161.1	178.2	57.7	0	0	0	0	110.5	D160 G161 I162	S158-D160 PolarHBondContact O-N 2.92Å; S158-G161 PolarHBondContact O-N 3.06Å; S158-G161 PolarHBondContact OG-N 3.35Å; S158-I162 WeakPolarHBondContact O-CG1 3.45Å; S158-I162 PolarHBondContact O-N 2.99Å
159	I	98.5	Very high	98.2	Very high	26 Å²	26	46.1 Å²	46.1	13%	0.133	28%	0.28	C	S	.	.	H	α-helix	trans	-57.5	-47.8	175.8	-68.2	-61.2	0	0	0	111.3	L94 Y98 F114 D117 L118 G161 I162 C163	L94-I159 HydrophobicContact CD1-CD1 4.09Å; L94-I159 HydrophobicContact CD1-CG1 3.91Å; Y98-I159 HydrophobicContact CE2-CD1 4.28Å; Y98-I159 WeakPolarHBondContact OH-CD1 3.4Å; F114-I159 HydrophobicContact CD2-CD1 3.87Å; F114-I159 HydrophobicContact CE2-CD1 3.75Å; D117-I159 HydrophobicContact CB-CD1 4.23Å; D117-I159 HydrophobicContact CB-CG1 4.32Å; D117-I159 VanDerWaalsContact O-CG2 3.25Å; D117-I159 WeakPolarHBondContact O-CG2 3.38Å; L118-I159 HydrophobicContact CD2-CD1 4.1Å; L118-I159 HydrophobicContact CD2-CG2 4.17Å; L118-I159 HydrophobicContact CG-CD1 4.23Å; I159-G161 VanDerWaalsContact C-N 3.27Å; I159-G161 PolarHBondContact O-N 2.88Å; I159-I162 PolarHBondContact O-N 3.18Å; I159-I162 VanDerWaalsContact O-N 3.13Å; I159-C163 PolarHBondContact O-N 3.36Å; I159-C163 PolarHBondContact O-SG 3.39Å; I159-C163 VanDerWaalsContact O-SG 3.41Å
160	D	98.3	Very high	98.2	Very high	133 Å²	133	45.2 Å²	45.2	71%	0.711	28%	0.275	S	S	*	.	H	α-helix	trans	-60.4	-39.5	176.9	-65.4	-22.7	0	0	0	111.9	S158 C163 A164	S158-D160 PolarHBondContact O-N 2.92Å; D160-C163 PolarHBondContact O-N 2.96Å; D160-A164 WeakPolarHBondContact O-CB 3.48Å; D160-A164 PolarHBondContact O-N 3.14Å
161	G	98.3	Very high	98.2	Very high	19 Å²	19	49.1 Å²	49.1	20%	0.196	30%	0.298	C	S	.	.	H	α-helix	trans	-60	-44.6	174.7	0	0	0	0	0	112.4	S158 I159 A164 R165	S158-G161 PolarHBondContact O-N 3.06Å; S158-G161 PolarHBondContact OG-N 3.35Å; I159-G161 VanDerWaalsContact C-N 3.27Å; I159-G161 PolarHBondContact O-N 2.88Å; G161-A164 PolarHBondContact O-N 3.33Å; G161-R165 WeakPolarHBondContact O-CG 3.37Å; G161-R165 PolarHBondContact O-N 2.6Å
162	I	98.5	Very high	98.2	Very high	0 Å²	0	51.2 Å²	51.2	0%	0	31%	0.308	C	S	.	.	H	α-helix	trans	-65.6	-47.2	177.3	-63.4	169.8	0	0	0	110.1	L94 F114 L118 L130 I154 A156 S158 I159 A164 R165 F166	L94-I162 HydrophobicContact CD2-CD1 4.35Å; F114-I162 HydrophobicContact CE2-CD1 3.9Å; F114-I162 HydrophobicContact CZ-CD1 3.87Å; L118-I162 HydrophobicContact CD2-CB 3.86Å; L118-I162 HydrophobicContact CD2-CG2 3.6Å; L130-I162 HydrophobicContact CD1-CG2 4.14Å; L130-I162 HydrophobicContact CD2-CG2 3.7Å; I154-I162 HydrophobicContact CD1-CB 4.45Å; I154-I162 HydrophobicContact CD1-CG1 4.09Å; I154-I162 HydrophobicContact CD1-CG2 4.17Å; A156-I162 HydrophobicContact CB-CG1 3.76Å; S158-I162 WeakPolarHBondContact O-CG1 3.45Å; S158-I162 PolarHBondContact O-N 2.99Å; I159-I162 PolarHBondContact O-N 3.18Å; I159-I162 VanDerWaalsContact O-N 3.13Å; I162-A164 VanDerWaalsContact C-N 3.28Å; I162-A164 PolarHBondContact O-N 3.13Å; I162-R165 WeakPolarHBondContact O-CB 3.48Å; I162-R165 PolarHBondContact O-N 2.95Å; I162-F166 HydrophobicContact CG2-CZ 4.45Å
163	C	98.5	Very high	98.2	Very high	40 Å²	40	45.9 Å²	45.9	27%	0.27	29%	0.285	S	S	.	.	H	α-helix	trans	-56.6	-41.7	177.5	-73.6	0	0	0	0	112.4	I159 D160 R165 F166	I159-C163 PolarHBondContact O-N 3.36Å; I159-C163 PolarHBondContact O-SG 3.39Å; I159-C163 VanDerWaalsContact O-SG 3.41Å; D160-C163 PolarHBondContact O-N 2.96Å; C163-R165 PolarHBondContact O-N 3.35Å; C163-F166 HydrophobicContact CB-CD2 4.39Å; C163-F166 HydrophobicContact CB-CE2 4.38Å; C163-F166 WeakPolarHBondContact O-CD2 3.5Å; C163-F166 PolarHBondContact O-N 3.35Å
164	A	98.5	Very high	98.2	Very high	70 Å²	70	49 Å²	49	58%	0.579	29%	0.287	S	S	*	.	H	α-helix	trans	-63.9	-19.4	177.7	0	0	0	0	0	113.5	D160 G161 I162	D160-A164 WeakPolarHBondContact O-CB 3.48Å; D160-A164 PolarHBondContact O-N 3.14Å; G161-A164 PolarHBondContact O-N 3.33Å; I162-A164 VanDerWaalsContact C-N 3.28Å; I162-A164 PolarHBondContact O-N 3.13Å
165	R	98.4	Very high	98.2	Very high	99 Å²	99	53.9 Å²	53.9	37%	0.374	31%	0.309	S	S	.	.	H	α-helix	trans	-85	-20.6	177.2	-60.6	-58.3	-178	-166.6	-3.8	113.7	I154 S155 G161 I162 C163 P167 S168 L169	I154-R165 HydrophobicContact CB-CG 4.25Å; I154-R165 WeakPolarHBondContact O-CD 3.46Å; I154-R165 WeakPolarHBondContact O-CG 3.23Å; I154-R165 PolarHBondContact O-NE 3.23Å; S155-R165 PolarHBondContact O-NH2 3.33Å; G161-R165 WeakPolarHBondContact O-CG 3.37Å; G161-R165 PolarHBondContact O-N 2.6Å; I162-R165 WeakPolarHBondContact O-CB 3.48Å; I162-R165 PolarHBondContact O-N 2.95Å; C163-R165 PolarHBondContact O-N 3.35Å; R165-P167 VanDerWaalsContact C-CD 3.48Å; R165-S168 PolarHBondContact O-N 3.33Å; R165-S168 PolarHBondContact O-OG 2.84Å; R165-L169 HydrophobicContact CB-CD1 4.32Å; R165-L169 HydrophobicContact CB-CG 4.36Å; R165-L169 WeakPolarHBondContact O-CG 3.45Å; R165-L169 PolarHBondContact O-N 2.88Å
166	F	98.4	Very high	98.2	Very high	12 Å²	12	55.5 Å²	55.5	5%	0.053	31%	0.307	C	S	.	.	H	α-helix	trans	-51.3	-44.6	-176.5	-71.7	-50.1	0	0	0	114.5	L118 V120 R126 L130 I162 C163 S168 L169 L170	L118-F166 HydrophobicContact CD1-CZ 4.45Å; L118-F166 HydrophobicContact CD2-CE2 4.47Å; L118-F166 HydrophobicContact CD2-CZ 4.4Å; V120-F166 HydrophobicContact CG1-CE2 4.07Å; V120-F166 HydrophobicContact CG1-CZ 4.1Å; R126-F166 HydrophobicContact CB-CD1 3.87Å; R126-F166 HydrophobicContact CB-CE1 3.72Å; R126-F166 HydrophobicContact CB-CZ 4.3Å; R126-F166 HydrophobicContact CG-CD1 3.9Å; R126-F166 HydrophobicContact CG-CE1 4.26Å; R126-F166 HydrophobicContact CG-CG 4.25Å; L130-F166 HydrophobicContact CD1-CE1 3.81Å; L130-F166 HydrophobicContact CD1-CZ 3.9Å; L130-F166 HydrophobicContact CD2-CE1 4.18Å; L130-F166 HydrophobicContact CG-CE1 3.86Å; L130-F166 HydrophobicContact CG-CZ 4.44Å; I162-F166 HydrophobicContact CG2-CZ 4.45Å; C163-F166 HydrophobicContact CB-CD2 4.39Å; C163-F166 HydrophobicContact CB-CE2 4.38Å; C163-F166 WeakPolarHBondContact O-CD2 3.5Å; C163-F166 PolarHBondContact O-N 3.35Å; F166-S168 VanDerWaalsContact C-N 3.3Å; F166-S168 PolarHBondContact O-N 3.31Å; F166-L169 PolarHBondContact O-N 3.33Å; F166-L170 WeakPolarHBondContact O-CB 3.27Å; F166-L170 VanDerWaalsContact O-CG 3.27Å; F166-L170 WeakPolarHBondContact O-CG 3.47Å; F166-L170 PolarHBondContact O-N 3.35Å
167	P	98.4	Very high	98.2	Very high	84 Å²	84	61 Å²	61	55%	0.545	34%	0.335	S	S	.	.	H	α-helix	trans	-60	-39.6	178	-24.8	35.5	0	0	0	113.3	R165 T171	R165-P167 VanDerWaalsContact C-CD 3.48Å; P167-T171 PolarHBondContact O-N 3.14Å; P167-T171 VanDerWaalsContact O-N 3.17Å; P167-T171 PolarHBondContact O-OG1 2.97Å
168	S	98.3	Very high	98.2	Very high	61 Å²	61	64.2 Å²	64.2	43%	0.427	35%	0.348	S	S	.	.	H	α-helix	trans	-69.5	-40.6	177.4	68.6	0	0	0	0	112	R165 F166 T171 E172	R165-S168 PolarHBondContact O-N 3.33Å; R165-S168 PolarHBondContact O-OG 2.84Å; F166-S168 VanDerWaalsContact C-N 3.3Å; F166-S168 PolarHBondContact O-N 3.31Å; S168-T171 PolarHBondContact O-N 2.88Å; S168-E172 PolarHBondContact O-N 3.3Å
169	L	98.4	Very high	98.2	Very high	5 Å²	5	62.9 Å²	62.9	3%	0.026	34%	0.337	C	S	.	.	H	α-helix	trans	-66.2	-41.2	177.6	-64.2	179.6	0	0	0	112	L129 L130 K133 I154 R165 F166 T171 E172 A173	L129-L169 HydrophobicContact CD1-CB 4.13Å; L130-L169 HydrophobicContact CD2-CD1 4.36Å; K133-L169 HydrophobicContact CD-CD2 3.83Å; K133-L169 HydrophobicContact CG-CD1 4.23Å; K133-L169 HydrophobicContact CG-CD2 3.65Å; I154-L169 HydrophobicContact CG2-CD1 4.48Å; I154-L169 HydrophobicContact CG2-CD2 4.19Å; R165-L169 HydrophobicContact CB-CD1 4.32Å; R165-L169 HydrophobicContact CB-CG 4.36Å; R165-L169 WeakPolarHBondContact O-CG 3.45Å; R165-L169 PolarHBondContact O-N 2.88Å; F166-L169 PolarHBondContact O-N 3.33Å; L169-T171 VanDerWaalsContact C-N 3.27Å; L169-T171 PolarHBondContact O-N 2.83Å; L169-E172 PolarHBondContact O-N 3.31Å; L169-A173 WeakPolarHBondContact O-CB 3.07Å; L169-A173 PolarHBondContact O-N 2.92Å
170	L	98.5	Very high	98.2	Very high	50 Å²	50	64 Å²	64	26%	0.262	34%	0.341	S	S	.	.	H	α-helix	trans	-59.8	-40	174.1	-73	167	0	0	0	111.2	F125 R126 L129 F166 Q215	F125-L170 HydrophobicContact CD1-CD2 3.8Å; F125-L170 HydrophobicContact CE1-CD2 3.98Å; R126-L170 HydrophobicContact CG-CD2 4.47Å; L129-L170 HydrophobicContact CD1-CD2 3.85Å; L129-L170 HydrophobicContact CD1-CG 4.21Å; F166-L170 WeakPolarHBondContact O-CB 3.27Å; F166-L170 VanDerWaalsContact O-CG 3.27Å; F166-L170 WeakPolarHBondContact O-CG 3.47Å; F166-L170 PolarHBondContact O-N 3.35Å; L170-Q215 PolarHBondContact O-NE2 3.36Å; L170-Q215 PolarHBondContact O-OE1 3.42Å
171	T	98.5	Very high	98.2	Very high	83 Å²	83	61.2 Å²	61.2	51%	0.509	33%	0.326	S	S	.	.	H	α-helix	trans	-70.9	-41.6	177.3	-56	0	0	0	0	112.2	P167 S168 L169 A173 K174	P167-T171 PolarHBondContact O-N 3.14Å; P167-T171 VanDerWaalsContact O-N 3.17Å; P167-T171 PolarHBondContact O-OG1 2.97Å; S168-T171 PolarHBondContact O-N 2.88Å; L169-T171 VanDerWaalsContact C-N 3.27Å; L169-T171 PolarHBondContact O-N 2.83Å; T171-A173 VanDerWaalsContact C-N 3.31Å; T171-A173 PolarHBondContact O-N 3.36Å; T171-K174 PolarHBondContact O-N 3.4Å
172	E	98.3	Very high	98.2	Very high	44 Å²	44	60.3 Å²	60.3	21%	0.206	32%	0.317	C	S	.	.	H	α-helix	trans	-58.7	-44.8	175.3	-175.1	-177.9	-177.7	0	0	110.5	W132 K133 S168 L169 K174 Q175 K178	W132-E172 HydrophobicContact CH2-CG 4.2Å; K133-E172 VanDerWaalsContact NZ-CD 3.28Å; K133-E172 IonicContact NZ-OE1 3.73Å; K133-E172 PolarHBondContact NZ-OE1 3.14Å; K133-E172 IonicContact NZ-OE2 3.78Å; K133-E172 PolarHBondContact NZ-OE2 3.33Å; S168-E172 PolarHBondContact O-N 3.3Å; L169-E172 PolarHBondContact O-N 3.31Å; E172-K174 PolarHBondContact O-N 3.17Å; E172-K174 VanDerWaalsContact O-N 3.14Å; E172-Q175 WeakPolarHBondContact O-CB 3.33Å; E172-Q175 WeakPolarHBondContact O-CG 3.28Å; E172-Q175 PolarHBondContact O-N 2.6Å; E172-K178 HydrophobicContact CG-CB 4.34Å; E172-K178 HydrophobicContact CG-CD 4.09Å; E172-K178 HydrophobicContact CG-CG 3.92Å; E172-K178 VanDerWaalsContact O-CB 3.23Å; E172-K178 WeakPolarHBondContact O-CB 3.45Å; E172-K178 WeakPolarHBondContact OE1-CE 3.29Å; E172-K178 IonicContact OE1-NZ 3.84Å; E172-K178 PolarHBondContact OE1-NZ 3.32Å
173	A	98.2	Very high	98.2	Very high	2 Å²	2	60.4 Å²	60.4	2%	0.017	32%	0.317	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66.5	-12.7	-178.4	0	0	0	0	0	114.6	F125 L129 L169 T171 L182	F125-A173 HydrophobicContact CZ-CB 4.32Å; L129-A173 HydrophobicContact CD1-CB 4.41Å; L129-A173 HydrophobicContact CD2-CB 3.64Å; L169-A173 WeakPolarHBondContact O-CB 3.07Å; L169-A173 PolarHBondContact O-N 2.92Å; T171-A173 VanDerWaalsContact C-N 3.31Å; T171-A173 PolarHBondContact O-N 3.36Å; A173-L182 HydrophobicContact CB-CD2 4.07Å
174	K	98	Very high	98.2	Very high	133 Å²	133	65 Å²	65	58%	0.578	33%	0.329	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.4	-17.7	172.7	-67.2	-177.1	-173.4	-174.3	0	113.3	T171 E172	T171-K174 PolarHBondContact O-N 3.4Å; E172-K174 PolarHBondContact O-N 3.17Å; E172-K174 VanDerWaalsContact O-N 3.14Å
175	Q	98.2	Very high	98.2	Very high	113 Å²	113	62.7 Å²	62.7	53%	0.528	31%	0.306	S	S	.	.	S	Bend	trans	-69.6	134.2	178.9	-54.6	-57.1	-54	0	0	109.2	E172 D177 K178 F179	E172-Q175 WeakPolarHBondContact O-CB 3.33Å; E172-Q175 WeakPolarHBondContact O-CG 3.28Å; E172-Q175 PolarHBondContact O-N 2.6Å; Q175-D177 PolarHBondContact O-N 3.24Å; Q175-K178 HydrophobicContact CB-CB 4.08Å; Q175-K178 HydrophobicContact CB-CG 3.95Å; Q175-K178 CarbonylContact O-C 3.59Å; Q175-K178 WeakPolarHBondContact O-CB 3.45Å; Q175-K178 PolarHBondContact O-N 2.9Å; Q175-F179 WeakPolarHBondContact O-CB 3.42Å; Q175-F179 PolarHBondContact O-N 2.89Å
176	E	96.5	Very high	98.2	Very high	120 Å²	120	58 Å²	58	56%	0.561	29%	0.288	S	S	*	.	H	α-helix	trans	-54.9	-50.1	-168.9	-171.1	-173	155.7	0	0	113.5	K178 F179 K180	E176-K178 VanDerWaalsContact C-N 3.31Å; E176-K178 PolarHBondContact O-N 2.96Å; E176-F179 PolarHBondContact O-N 2.85Å; E176-K180 HydrophobicContact CG-CD 4.38Å; E176-K180 WeakPolarHBondContact O-CG 3.29Å; E176-K180 PolarHBondContact O-N 3.44Å; E176-K180 WeakPolarHBondContact OE1-CE 3.29Å; E176-K180 IonicContact OE1-NZ 2.61Å; E176-K180 PolarHBondContact OE1-NZ 3.46Å
177	D	97.6	Very high	98.2	Very high	124 Å²	124	57.4 Å²	57.4	66%	0.663	29%	0.286	S	S	*	.	H	α-helix	trans	-65.5	-36	-179.8	-68.4	-39.1	0	0	0	112.3	Q175 K180 D181	Q175-D177 PolarHBondContact O-N 3.24Å; D177-K180 PolarHBondContact O-N 3.16Å; D177-D181 PolarHBondContact O-N 3.48Å
178	K	98.3	Very high	98	Very high	88 Å²	88	56.6 Å²	56.6	38%	0.383	27%	0.274	S	S	.	.	H	α-helix	trans	-71	-38.6	177.5	-63.4	-65.6	-174.4	153.4	0	111.5	W132 E172 Q175 E176 D181 L182	W132-K178 HydrophobicContact CH2-CB 4.11Å; W132-K178 HydrophobicContact CH2-CD 4.24Å; W132-K178 HydrophobicContact CZ2-CB 4.49Å; W132-K178 HydrophobicContact CZ2-CD 4.37Å; E172-K178 HydrophobicContact CG-CB 4.34Å; E172-K178 HydrophobicContact CG-CD 4.09Å; E172-K178 HydrophobicContact CG-CG 3.92Å; E172-K178 VanDerWaalsContact O-CB 3.23Å; E172-K178 WeakPolarHBondContact O-CB 3.45Å; E172-K178 WeakPolarHBondContact OE1-CE 3.29Å; E172-K178 IonicContact OE1-NZ 3.84Å; E172-K178 PolarHBondContact OE1-NZ 3.32Å; Q175-K178 HydrophobicContact CB-CB 4.08Å; Q175-K178 HydrophobicContact CB-CG 3.95Å; Q175-K178 CarbonylContact O-C 3.59Å; Q175-K178 WeakPolarHBondContact O-CB 3.45Å; Q175-K178 PolarHBondContact O-N 2.9Å; E176-K178 VanDerWaalsContact C-N 3.31Å; E176-K178 PolarHBondContact O-N 2.96Å; K178-D181 PolarHBondContact O-N 3.38Å; K178-L182 WeakPolarHBondContact O-CB 3.15Å; K178-L182 PolarHBondContact O-N 3.42Å
179	F	98.5	Very high	97.9	Very high	14 Å²	14	54.8 Å²	54.8	6%	0.061	26%	0.259	C	S	.	.	H	α-helix	trans	-64	-44.8	173.5	-176	-100.5	0	0	0	111.1	Q175 E176 D181 L182 Y183 V212 F213 N216 L247	Q175-F179 WeakPolarHBondContact O-CB 3.42Å; Q175-F179 PolarHBondContact O-N 2.89Å; E176-F179 PolarHBondContact O-N 2.85Å; F179-D181 VanDerWaalsContact C-N 3.29Å; F179-D181 PolarHBondContact O-N 3.27Å; F179-L182 PolarHBondContact O-N 2.88Å; F179-Y183 HydrophobicContact CE1-CD2 4.49Å; F179-Y183 HydrophobicContact CZ-CD2 4.49Å; F179-Y183 VanDerWaalsContact O-CB 3.23Å; F179-Y183 WeakPolarHBondContact O-CB 3.49Å; F179-Y183 PolarHBondContact O-N 3.27Å; F179-V212 HydrophobicContact CE2-CG2 4.35Å; F179-V212 WeakPolarHBondContact CE2-O 3.41Å; F179-V212 HydrophobicContact CZ-CG2 4.49Å; F179-F213 HydrophobicContact CE1-CD1 4.29Å; F179-F213 AromaticContact CE1-CE1 3.81Å; F179-F213 HydrophobicContact CE1-CE1 3.81Å; F179-F213 AromaticContact CZ-CD1 3.6Å; F179-F213 HydrophobicContact CZ-CD1 3.6Å; F179-F213 AromaticContact CZ-CE1 3.55Å; F179-F213 HydrophobicContact CZ-CE1 3.55Å; F179-F213 HydrophobicContact CZ-CZ 4.43Å; F179-N216 WeakPolarHBondContact CE2-ND2 3.49Å; F179-N216 WeakPolarHBondContact CE2-OD1 3.31Å; F179-N216 WeakPolarHBondContact CZ-ND2 3.44Å; F179-L247 HydrophobicContact CD1-CD1 4.39Å; F179-L247 HydrophobicContact CE1-CD1 3.75Å
180	K	98.1	Very high	97.8	Very high	50 Å²	50	54.6 Å²	54.6	22%	0.217	26%	0.259	C	S	.	.	H	α-helix	trans	-58.9	-39.7	174.7	-77.7	169.8	170.7	168	0	112	E176 D177 R184 L247	E176-K180 HydrophobicContact CG-CD 4.38Å; E176-K180 WeakPolarHBondContact O-CG 3.29Å; E176-K180 PolarHBondContact O-N 3.44Å; E176-K180 WeakPolarHBondContact OE1-CE 3.29Å; E176-K180 IonicContact OE1-NZ 2.61Å; E176-K180 PolarHBondContact OE1-NZ 3.46Å; D177-K180 PolarHBondContact O-N 3.16Å; K180-R184 WeakPolarHBondContact O-CG 3.48Å; K180-R184 PolarHBondContact O-N 2.97Å; K180-R184 PolarHBondContact O-NH1 3.13Å; K180-L247 HydrophobicContact CG-CD2 3.96Å
181	D	98.3	Very high	97.5	Very high	74 Å²	74	52.6 Å²	52.6	40%	0.396	25%	0.248	S	C	.	.	H	α-helix	trans	-66.3	-51.3	174.8	-173.3	64.8	0	0	0	112.1	W132 D177 K178 F179 Y183 R184 F185	W132-D181 PolarHBondContact NE1-OD2 2.76Å; D177-D181 PolarHBondContact O-N 3.48Å; K178-D181 PolarHBondContact O-N 3.38Å; F179-D181 VanDerWaalsContact C-N 3.29Å; F179-D181 PolarHBondContact O-N 3.27Å; D181-Y183 VanDerWaalsContact C-N 3.27Å; D181-Y183 PolarHBondContact O-N 3.44Å; D181-R184 PolarHBondContact O-N 2.82Å; D181-F185 WeakPolarHBondContact O-CB 3.44Å; D181-F185 PolarHBondContact O-N 2.82Å
182	L	98.6	Very high	96.9	Very high	0 Å²	0	50.6 Å²	50.6	0%	0	23%	0.234	C	C	.	.	H	α-helix	trans	-54.4	-42.6	174.3	172.5	63.2	0	0	0	112	F125 L128 L129 W132 A173 K178 F179 F185 T186 V212	F125-L182 HydrophobicContact CE2-CD2 4.03Å; F125-L182 HydrophobicContact CZ-CD2 3.85Å; L128-L182 HydrophobicContact CG-CD1 4.28Å; L129-L182 HydrophobicContact CD2-CD1 4.18Å; L129-L182 HydrophobicContact CD2-CD2 3.66Å; W132-L182 HydrophobicContact CB-CD1 3.65Å; W132-L182 HydrophobicContact CD2-CB 4.15Å; W132-L182 HydrophobicContact CD2-CD1 3.87Å; W132-L182 HydrophobicContact CE3-CD1 4.16Å; W132-L182 HydrophobicContact CG-CB 4.47Å; W132-L182 HydrophobicContact CG-CD1 3.65Å; W132-L182 HydrophobicContact CZ2-CB 4.43Å; A173-L182 HydrophobicContact CB-CD2 4.07Å; K178-L182 WeakPolarHBondContact O-CB 3.15Å; K178-L182 PolarHBondContact O-N 3.42Å; F179-L182 PolarHBondContact O-N 2.88Å; L182-F185 WeakPolarHBondContact O-CB 3.35Å; L182-F185 PolarHBondContact O-N 3.19Å; L182-T186 WeakPolarHBondContact O-CB 3.31Å; L182-T186 PolarHBondContact O-N 3.42Å; L182-T186 PolarHBondContact O-OG1 2.88Å; L182-V212 HydrophobicContact CG-CG2 4.26Å
183	Y	98.7	Very high	96	Very high	2 Å²	2	50.9 Å²	50.9	1%	0.008	24%	0.241	C	C	.	.	H	α-helix	trans	-63.6	-42.5	-179.9	-175	-90.7	0	0	0	112.2	F179 D181 T186 W209 V212 F213 W243 L247	F179-Y183 HydrophobicContact CE1-CD2 4.49Å; F179-Y183 HydrophobicContact CZ-CD2 4.49Å; F179-Y183 VanDerWaalsContact O-CB 3.23Å; F179-Y183 WeakPolarHBondContact O-CB 3.49Å; F179-Y183 PolarHBondContact O-N 3.27Å; D181-Y183 VanDerWaalsContact C-N 3.27Å; D181-Y183 PolarHBondContact O-N 3.44Å; Y183-T186 PolarHBondContact O-N 2.95Å; Y183-W209 AromaticContact CZ-NE1 3.84Å; Y183-W209 PolarHBondContact OH-NE1 3.46Å; Y183-V212 HydrophobicContact CD2-CG1 3.84Å; Y183-V212 HydrophobicContact CD2-CG2 4.08Å; Y183-V212 HydrophobicContact CE2-CG1 4Å; Y183-F213 HydrophobicContact CD2-CE2 4.5Å; Y183-F213 HydrophobicContact CD2-CZ 4.23Å; Y183-F213 AromaticContact CE2-CE2 3.79Å; Y183-F213 HydrophobicContact CE2-CE2 3.79Å; Y183-F213 AromaticContact CE2-CZ 3.74Å; Y183-F213 HydrophobicContact CE2-CZ 3.74Å; Y183-W243 AromaticContact CD1-CD1 3.95Å; Y183-W243 AromaticContact CD1-NE1 3.45Å; Y183-W243 HydrophobicContact CD2-CZ2 4.4Å; Y183-W243 AromaticContact CE1-CD1 3.34Å; Y183-W243 HydrophobicContact CE1-CD2 4.47Å; Y183-W243 AromaticContact CE1-CE2 3.89Å; Y183-W243 HydrophobicContact CE1-CG 4.17Å; Y183-W243 AromaticContact CE1-NE1 3.13Å; Y183-W243 WeakPolarHBondContact CE1-O 3.46Å; Y183-W243 HydrophobicContact CE2-CZ2 4.07Å; Y183-W243 AromaticContact CZ-CD1 3.86Å; Y183-W243 AromaticContact CZ-CE2 3.72Å; Y183-W243 AromaticContact CZ-NE1 3.47Å; Y183-W243 PolarHBondContact O-NE1 3.4Å; Y183-W243 PolarHBondContact OH-O 2.85Å; Y183-L247 HydrophobicContact CD1-CB 4.01Å; Y183-L247 HydrophobicContact CD1-CD2 3.87Å; Y183-L247 HydrophobicContact CD1-CG 4.49Å; Y183-L247 HydrophobicContact CE1-CB 3.64Å; Y183-L247 HydrophobicContact CE1-CD2 4.38Å; Y183-L247 HydrophobicContact CE2-CB 4.37Å; Y183-L247 HydrophobicContact CG-CD2 4.02Å
184	R	97.9	Very high	95.2	Very high	138 Å²	138	57.3 Å²	57.3	52%	0.521	27%	0.271	S	S	.	.	H	α-helix	trans	-68.7	-41.6	175.1	-69.4	178.3	-170.7	111	-2.2	111.9	K180 D181 T186 F187	K180-R184 WeakPolarHBondContact O-CG 3.48Å; K180-R184 PolarHBondContact O-N 2.97Å; K180-R184 PolarHBondContact O-NH1 3.13Å; D181-R184 PolarHBondContact O-N 2.82Å; R184-T186 VanDerWaalsContact C-N 3.3Å; R184-T186 PolarHBondContact O-N 3.32Å; R184-F187 PolarHBondContact O-N 3.44Å
185	F	98.2	Very high	94.5	Very high	21 Å²	21	57.5 Å²	57.5	9%	0.092	27%	0.274	C	S	.	.	H	α-helix	trans	-57	-45.2	174.8	168.3	-93.2	0	0	0	111.1	L128 A131 W132 A136 D181 L182 F187 Q188 F189	L128-F185 HydrophobicContact CD1-CE1 4.32Å; A131-F185 HydrophobicContact CB-CE1 4.16Å; A131-F185 HydrophobicContact CB-CZ 4.1Å; A131-F185 VanDerWaalsContact O-CZ 3.23Å; A131-F185 WeakPolarHBondContact O-CZ 3.44Å; W132-F185 HydrophobicContact CB-CD1 3.61Å; W132-F185 HydrophobicContact CB-CE1 3.71Å; W132-F185 HydrophobicContact CB-CG 4.19Å; W132-F185 HydrophobicContact CB-CZ 4.36Å; W132-F185 AromaticContact CD1-CD1 3.92Å; W132-F185 AromaticContact CD1-CG 3.65Å; W132-F185 HydrophobicContact CG-CD1 4.12Å; W132-F185 HydrophobicContact CG-CG 4.3Å; A136-F185 WeakPolarHBondContact O-CE2 3.31Å; A136-F185 WeakPolarHBondContact O-CZ 3.47Å; D181-F185 WeakPolarHBondContact O-CB 3.44Å; D181-F185 PolarHBondContact O-N 2.82Å; L182-F185 WeakPolarHBondContact O-CB 3.35Å; L182-F185 PolarHBondContact O-N 3.19Å; F185-F187 VanDerWaalsContact C-N 3.26Å; F185-F187 PolarHBondContact O-N 3.22Å; F185-Q188 WeakPolarHBondContact O-CA 3.4Å; F185-Q188 WeakPolarHBondContact O-CB 3.49Å; F185-Q188 PolarHBondContact O-N 3.36Å; F185-F189 HydrophobicContact CD1-CB 4.28Å; F185-F189 HydrophobicContact CE1-CB 3.71Å; F185-F189 HydrophobicContact CE1-CD1 4.41Å; F185-F189 HydrophobicContact CE1-CD2 4.33Å; F185-F189 AromaticContact CE1-CG 3.91Å; F185-F189 HydrophobicContact CE1-CG 3.91Å; F185-F189 HydrophobicContact CE2-CB 4.44Å; F185-F189 HydrophobicContact CZ-CB 3.79Å; F185-F189 AromaticContact CZ-CD2 3.95Å; F185-F189 HydrophobicContact CZ-CD2 3.95Å; F185-F189 AromaticContact CZ-CG 3.95Å; F185-F189 HydrophobicContact CZ-CG 3.95Å; F185-F189 WeakPolarHBondContact O-CB 3.43Å; F185-F189 PolarHBondContact O-N 3.48Å
186	T	98.4	Very high	93.9	Very high	0 Å²	0	54.7 Å²	54.7	0%	0	28%	0.275	C	S	.	.	H	α-helix	trans	-57.1	-38.5	-176.2	-59.4	0	0	0	0	112.3	L128 L182 Y183 R184 F189 G190 L208 V212 W243	L128-T186 HydrophobicContact CD1-CG2 4.23Å; L128-T186 HydrophobicContact CD2-CG2 4.21Å; L182-T186 WeakPolarHBondContact O-CB 3.31Å; L182-T186 PolarHBondContact O-N 3.42Å; L182-T186 PolarHBondContact O-OG1 2.88Å; Y183-T186 PolarHBondContact O-N 2.95Å; R184-T186 VanDerWaalsContact C-N 3.3Å; R184-T186 PolarHBondContact O-N 3.32Å; T186-F189 PolarHBondContact O-N 3.45Å; T186-G190 PolarHBondContact O-N 3.49Å; T186-L208 HydrophobicContact CG2-CB 3.87Å; T186-L208 HydrophobicContact CG2-CD1 4.19Å; T186-L208 HydrophobicContact CG2-CD2 4Å; T186-L208 HydrophobicContact CG2-CG 4.24Å; T186-V212 HydrophobicContact CG2-CB 4.33Å; T186-W243 HydrophobicContact CG2-CH2 4.05Å; T186-W243 HydrophobicContact CG2-CZ2 3.84Å
187	F	97.6	Very high	93.4	Very high	0 Å²	0	51.4 Å²	51.4	0%	0	26%	0.26	C	S	.	.	H	α-helix	trans	-62.1	-46.4	174	-179.8	-88.3	0	0	0	112.2	R184 F185 F189 G190 L191 L200 R240 W243	R184-F187 PolarHBondContact O-N 3.44Å; F185-F187 VanDerWaalsContact C-N 3.26Å; F185-F187 PolarHBondContact O-N 3.22Å; F187-F189 VanDerWaalsContact C-N 3.35Å; F187-G190 PolarHBondContact O-N 2.86Å; F187-L191 HydrophobicContact CE1-CD2 4.24Å; F187-L191 HydrophobicContact CZ-CD1 4.49Å; F187-L191 PolarHBondContact O-N 3.4Å; F187-L200 HydrophobicContact CD2-CD1 3.41Å; F187-L200 VanDerWaalsContact CD2-CD1 3.41Å; F187-L200 HydrophobicContact CD2-CG 3.76Å; F187-L200 HydrophobicContact CE2-CB 4.43Å; F187-L200 HydrophobicContact CE2-CD1 3.77Å; F187-L200 HydrophobicContact CE2-CG 3.64Å; F187-L200 HydrophobicContact CG-CD1 4.18Å; F187-L200 HydrophobicContact CG-CG 4.48Å; F187-L200 HydrophobicContact CZ-CG 4.26Å; F187-R240 HydrophobicContact CD1-CB 4.29Å; F187-R240 HydrophobicContact CD1-CG 4.14Å; F187-R240 HydrophobicContact CE1-CB 3.63Å; F187-R240 HydrophobicContact CE1-CG 3.94Å; F187-R240 HydrophobicContact CE2-CB 4.32Å; F187-R240 HydrophobicContact CZ-CB 3.65Å; F187-R240 HydrophobicContact CZ-CG 4.38Å; F187-R240 VanDerWaalsContact CZ-N 3.32Å; F187-W243 HydrophobicContact CB-CD2 4.06Å; F187-W243 HydrophobicContact CB-CG 3.88Å; F187-W243 HydrophobicContact CD2-CB 3.46Å; F187-W243 VanDerWaalsContact CD2-CB 3.46Å; F187-W243 AromaticContact CD2-CD2 3.85Å; F187-W243 HydrophobicContact CD2-CD2 3.85Å; F187-W243 HydrophobicContact CD2-CE3 4.26Å; F187-W243 AromaticContact CD2-CG 3.49Å; F187-W243 HydrophobicContact CD2-CG 3.49Å; F187-W243 VanDerWaalsContact CD2-CG 3.49Å; F187-W243 HydrophobicContact CE2-CB 3.95Å; F187-W243 HydrophobicContact CE2-CG 4.43Å; F187-W243 HydrophobicContact CG-CB 4.31Å; F187-W243 HydrophobicContact CG-CD2 4.45Å; F187-W243 HydrophobicContact CG-CG 4.04Å
188	Q	95.8	Very high	93.2	Very high	66 Å²	66	56 Å²	56	31%	0.308	27%	0.268	S	S	.	.	H	α-helix	trans	-66.4	-40.8	-179	-174.7	57	51	0	0	111.3	F185 G190 L191 S193	F185-Q188 WeakPolarHBondContact O-CA 3.4Å; F185-Q188 WeakPolarHBondContact O-CB 3.49Å; F185-Q188 PolarHBondContact O-N 3.36Å; Q188-G190 VanDerWaalsContact C-N 3.34Å; Q188-G190 PolarHBondContact O-N 2.95Å; Q188-L191 WeakPolarHBondContact O-CB 3.5Å; Q188-L191 PolarHBondContact O-N 2.92Å; Q188-S193 PolarHBondContact NE2-OG 3.36Å
189	F	95.6	Very high	93	Very high	23 Å²	23	54.1 Å²	54.1	10%	0.101	27%	0.266	C	S	.	.	H	α-helix	trans	-61.5	-41.4	177.7	-179.8	-119.2	0	0	0	112.2	L128 A131 A136 M139 F185 T186 F187 L191	L128-F189 HydrophobicContact CD1-CD1 3.83Å; L128-F189 HydrophobicContact CD1-CE1 4.16Å; A131-F189 HydrophobicContact CB-CD2 4.19Å; A131-F189 HydrophobicContact CB-CE1 4.08Å; A131-F189 HydrophobicContact CB-CE2 3.67Å; A131-F189 HydrophobicContact CB-CZ 3.6Å; A136-F189 HydrophobicContact CB-CD2 4.26Å; A136-F189 HydrophobicContact CB-CE2 4.03Å; M139-F189 HydrophobicContact CB-CE2 4.47Å; M139-F189 HydrophobicContact CB-CZ 4.29Å; M139-F189 HydrophobicContact CG-CD1 3.96Å; M139-F189 HydrophobicContact CG-CD2 4.33Å; M139-F189 HydrophobicContact CG-CE1 3.63Å; M139-F189 HydrophobicContact CG-CE2 4.02Å; M139-F189 HydrophobicContact CG-CG 4.3Å; M139-F189 HydrophobicContact CG-CZ 3.67Å; M139-F189 WeakPolarHBondContact CG-O 3.47Å; F185-F189 HydrophobicContact CD1-CB 4.28Å; F185-F189 HydrophobicContact CE1-CB 3.71Å; F185-F189 HydrophobicContact CE1-CD1 4.41Å; F185-F189 HydrophobicContact CE1-CD2 4.33Å; F185-F189 AromaticContact CE1-CG 3.91Å; F185-F189 HydrophobicContact CE1-CG 3.91Å; F185-F189 HydrophobicContact CE2-CB 4.44Å; F185-F189 HydrophobicContact CZ-CB 3.79Å; F185-F189 AromaticContact CZ-CD2 3.95Å; F185-F189 HydrophobicContact CZ-CD2 3.95Å; F185-F189 AromaticContact CZ-CG 3.95Å; F185-F189 HydrophobicContact CZ-CG 3.95Å; F185-F189 WeakPolarHBondContact O-CB 3.43Å; F185-F189 PolarHBondContact O-N 3.48Å; T186-F189 PolarHBondContact O-N 3.45Å; F187-F189 VanDerWaalsContact C-N 3.35Å; F189-L191 PolarHBondContact O-N 3.04Å
190	G	95.4	Very high	92.9	Very high	2 Å²	2	53.6 Å²	53.6	2%	0.021	26%	0.264	C	S	.	.	T	Hydrogen-bonded Turn	trans	-71.9	-13.1	177.8	0	0	0	0	0	115.3	M139 T186 F187 Q188 L200	M139-G190 WeakPolarHBondContact CE-O 3.2Å; T186-G190 PolarHBondContact O-N 3.49Å; F187-G190 PolarHBondContact O-N 2.86Å; Q188-G190 VanDerWaalsContact C-N 3.34Å; Q188-G190 PolarHBondContact O-N 2.95Å; G190-L200 WeakPolarHBondContact O-CD2 3.11Å
191	L	93.4	Very high	92.8	Very high	8 Å²	8	55.6 Å²	55.6	4%	0.042	27%	0.274	C	S	.	.	S	Bend	trans	-86.6	126.7	-171.6	-166.3	69.3	0	0	0	110.5	F187 Q188 F189 S193 Q197 L200	F187-L191 HydrophobicContact CE1-CD2 4.24Å; F187-L191 HydrophobicContact CZ-CD1 4.49Å; F187-L191 PolarHBondContact O-N 3.4Å; Q188-L191 WeakPolarHBondContact O-CB 3.5Å; Q188-L191 PolarHBondContact O-N 2.92Å; F189-L191 PolarHBondContact O-N 3.04Å; L191-S193 PolarHBondContact O-N 2.7Å; L191-S193 PolarHBondContact O-OG 3.07Å; L191-Q197 HydrophobicContact CD1-CB 4.26Å; L191-Q197 WeakPolarHBondContact CD2-O 3.37Å; L191-Q197 WeakPolarHBondContact CG-O 3.27Å; L191-L200 HydrophobicContact CB-CD2 4.18Å; L191-L200 HydrophobicContact CD1-CD2 4.25Å
192	D	85.9	Confident	92.7	Very high	40 Å²	40	54.1 Å²	54.1	21%	0.214	26%	0.263	C	S	.	.			trans	-75.8	75.9	169.9	-157.3	-30.8	0	0	0	110.3	E194 E195 G196 Q197	D192-E194 VanDerWaalsContact C-N 3.27Å; D192-E194 PolarHBondContact O-N 2.95Å; D192-E195 HydrophobicContact CB-CB 4.32Å; D192-E195 PolarHBondContact O-N 3.44Å; D192-E195 WeakPolarHBondContact OD1-CG 3.35Å; D192-E195 PolarHBondContact OD1-N 3.3Å; D192-G196 PolarHBondContact O-N 3.47Å; D192-Q197 HydrophobicContact CB-CG 4.25Å; D192-Q197 WeakPolarHBondContact O-CB 3.38Å; D192-Q197 PolarHBondContact O-N 3.21Å; D192-Q197 VanDerWaalsContact O-N 3.16Å
193	S	78.5	Confident	92.6	Very high	50 Å²	50	57.9 Å²	57.9	35%	0.35	28%	0.28	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71	-27	-175.5	-58.6	0	0	0	0	111.6	Q188 L191 E195 G196	Q188-S193 PolarHBondContact NE2-OG 3.36Å; L191-S193 PolarHBondContact O-N 2.7Å; L191-S193 PolarHBondContact O-OG 3.07Å; S193-E195 VanDerWaalsContact C-N 3.33Å; S193-G196 PolarHBondContact O-N 2.86Å; S193-G196 VanDerWaalsContact O-N 3.13Å
194	E	81.3	Confident	92.5	Very high	137 Å²	137	58.7 Å²	58.7	64%	0.64	29%	0.285	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.1	-34.5	176.4	-64.7	-173.2	172.8	0	0	110.7	K141 D192 G196	K141-E194 IonicContact NZ-OE1 3.19Å; K141-E194 PolarHBondContact NZ-OE1 2.87Å; D192-E194 VanDerWaalsContact C-N 3.27Å; D192-E194 PolarHBondContact O-N 2.95Å; E194-G196 PolarHBondContact O-N 3.33Å
195	E	83.7	Confident	92.5	Very high	137 Å²	137	52.1 Å²	52.1	64%	0.64	26%	0.26	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.8	1.3	171.4	-67.8	-169.4	175.5	0	0	114.2	D192 S193 Q197	D192-E195 HydrophobicContact CB-CB 4.32Å; D192-E195 PolarHBondContact O-N 3.44Å; D192-E195 WeakPolarHBondContact OD1-CG 3.35Å; D192-E195 PolarHBondContact OD1-N 3.3Å; S193-E195 VanDerWaalsContact C-N 3.33Å; E195-Q197 VanDerWaalsContact C-N 3.3Å; E195-Q197 HydrophobicContact CB-CG 4.28Å; E195-Q197 PolarHBondContact O-N 3.41Å
196	G	85.7	Confident	92.5	Very high	55 Å²	55	52.2 Å²	52.2	57%	0.567	26%	0.261	S	S	*	.	T	Hydrogen-bonded Turn	trans	74.8	16.3	178.7	0	0	0	0	0	114.3	D192 S193 E194	D192-G196 PolarHBondContact O-N 3.47Å; S193-G196 PolarHBondContact O-N 2.86Å; S193-G196 VanDerWaalsContact O-N 3.13Å; E194-G196 PolarHBondContact O-N 3.33Å
197	Q	86.5	Confident	92.4	Very high	51 Å²	51	52.9 Å²	52.9	24%	0.238	27%	0.267	C	S	.	.			trans	-66.4	138.1	177.4	-59.9	-164	-17.8	0	0	111	L191 D192 E195 H201	L191-Q197 HydrophobicContact CD1-CB 4.26Å; L191-Q197 WeakPolarHBondContact CD2-O 3.37Å; L191-Q197 WeakPolarHBondContact CG-O 3.27Å; D192-Q197 HydrophobicContact CB-CG 4.25Å; D192-Q197 WeakPolarHBondContact O-CB 3.38Å; D192-Q197 PolarHBondContact O-N 3.21Å; D192-Q197 VanDerWaalsContact O-N 3.16Å; E195-Q197 VanDerWaalsContact C-N 3.3Å; E195-Q197 HydrophobicContact CB-CG 4.28Å; E195-Q197 PolarHBondContact O-N 3.41Å; Q197-H201 PolarHBondContact NE2-NE2 3.44Å; Q197-H201 PolarHBondContact OE1-CD2 2.87Å; Q197-H201 VanDerWaalsContact OE1-CD2 3.27Å; Q197-H201 PolarHBondContact OE1-NE2 2.76Å
198	R	92.2	Very high	92.5	Very high	220 Å²	220	53.4 Å²	53.4	83%	0.83	27%	0.269	S	S	*	.			trans	-109.6	0	178.2	-61.6	-173.7	178.4	-155.8	-0.8	113.2
199	S	94.9	Very high	92.6	Very high	49 Å²	49	50.2 Å²	50.2	34%	0.343	25%	0.254	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.5	142.6	-177.8	-60.2	0	0	0	0	109	I238	S199-I238 CarbonylContact C-O 3.51Å; S199-I238 VanDerWaalsContact CA-O 3.24Å; S199-I238 WeakPolarHBondContact CA-O 3.36Å; S199-I238 WeakPolarHBondContact CB-O 3.04Å
200	L	96.1	Very high	92.7	Very high	2 Å²	2	54 Å²	54	1%	0.01	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.7	137.8	174.5	-70	176.7	0	0	0	109.7	F187 G190 L191 R202 I204 A205 L208 G237 I238 W243	F187-L200 HydrophobicContact CD2-CD1 3.41Å; F187-L200 VanDerWaalsContact CD2-CD1 3.41Å; F187-L200 HydrophobicContact CD2-CG 3.76Å; F187-L200 HydrophobicContact CE2-CB 4.43Å; F187-L200 HydrophobicContact CE2-CD1 3.77Å; F187-L200 HydrophobicContact CE2-CG 3.64Å; F187-L200 HydrophobicContact CG-CD1 4.18Å; F187-L200 HydrophobicContact CG-CG 4.48Å; F187-L200 HydrophobicContact CZ-CG 4.26Å; G190-L200 WeakPolarHBondContact O-CD2 3.11Å; L191-L200 HydrophobicContact CB-CD2 4.18Å; L191-L200 HydrophobicContact CD1-CD2 4.25Å; L200-R202 PolarHBondContact O-N 3.29Å; L200-I204 HydrophobicContact CD2-CG2 4.44Å; L200-A205 HydrophobicContact CB-CB 4.04Å; L200-A205 HydrophobicContact CD1-CB 4.22Å; L200-L208 HydrophobicContact CD1-CD1 4.4Å; L200-G237 CarbonylContact O-C 3.34Å; L200-G237 WeakPolarHBondContact O-CA 3.45Å; L200-I238 HydrophobicContact CB-CB 4.48Å; L200-I238 PolarHBondContact N-O 3.48Å; L200-I238 PolarHBondContact O-N 3.47Å; L200-W243 HydrophobicContact CD1-CE3 3.91Å; L200-W243 HydrophobicContact CD1-CZ3 4.06Å
201	H	95.6	Very high	92.8	Very high	93 Å²	93	55.5 Å²	55.5	43%	0.431	28%	0.278	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-55.4	138.8	165.5	-79	-90	0	0	0	110.3	Q197 E203 I204 A205	Q197-H201 PolarHBondContact NE2-NE2 3.44Å; Q197-H201 PolarHBondContact OE1-CD2 2.87Å; Q197-H201 VanDerWaalsContact OE1-CD2 3.27Å; Q197-H201 PolarHBondContact OE1-NE2 2.76Å; H201-E203 VanDerWaalsContact C-N 3.27Å; H201-E203 PolarHBondContact O-N 3.46Å; H201-I204 HydrophobicContact CB-CB 4.33Å; H201-I204 HydrophobicContact CB-CD1 4.05Å; H201-I204 HydrophobicContact CB-CG1 4.09Å; H201-I204 PolarHBondContact O-N 2.8Å; H201-A205 PolarHBondContact O-N 2.71Å
202	R	96.8	Very high	93.1	Very high	43 Å²	43	55.1 Å²	55.1	16%	0.162	28%	0.276	C	S	.	.	H	α-helix	trans	-49.9	-45.9	-176.8	-178.5	-176.9	61.8	73.9	12.5	112.9	L200 A205 I206 L228 N231 K236	L200-R202 PolarHBondContact O-N 3.29Å; R202-A205 PolarHBondContact O-N 2.98Å; R202-I206 HydrophobicContact CG-CD1 4.1Å; R202-I206 VanDerWaalsContact O-CG1 3.29Å; R202-I206 WeakPolarHBondContact O-CG1 3.37Å; R202-I206 PolarHBondContact O-N 3.47Å; R202-L228 VanDerWaalsContact CD-O 3.29Å; R202-L228 WeakPolarHBondContact CD-O 3.39Å; R202-L228 PolarHBondContact NH1-O 3.24Å; R202-N231 PolarHBondContact NE-ND2 3.06Å; R202-K236 PolarHBondContact N-O 2.96Å
203	E	96.4	Very high	93.7	Very high	79 Å²	79	53.5 Å²	53.5	37%	0.369	27%	0.267	S	S	.	.	H	α-helix	trans	-68.3	-37.9	-178.7	-66.2	179.1	-167.9	0	0	112.8	N10 H201 A207	N10-E203 PolarHBondContact OD1-OE2 3.5Å; H201-E203 VanDerWaalsContact C-N 3.27Å; H201-E203 PolarHBondContact O-N 3.46Å; E203-A207 PolarHBondContact O-N 3.47Å; E203-A207 VanDerWaalsContact O-N 3.13Å
204	I	95.9	Very high	94.6	Very high	19 Å²	19	55 Å²	55	10%	0.097	27%	0.274	C	S	.	.	H	α-helix	trans	-65.3	-44.6	173.4	-61.5	180	0	0	0	109.7	M139 L200 H201 I206 A207 L208	M139-I204 HydrophobicContact CE-CD1 4.34Å; M139-I204 HydrophobicContact CE-CG2 4.24Å; L200-I204 HydrophobicContact CD2-CG2 4.44Å; H201-I204 HydrophobicContact CB-CB 4.33Å; H201-I204 HydrophobicContact CB-CD1 4.05Å; H201-I204 HydrophobicContact CB-CG1 4.09Å; H201-I204 PolarHBondContact O-N 2.8Å; I204-I206 PolarHBondContact O-N 3.38Å; I204-A207 PolarHBondContact O-N 3.11Å; I204-L208 HydrophobicContact CG2-CD1 3.71Å; I204-L208 HydrophobicContact CG2-CG 4.14Å; I204-L208 WeakPolarHBondContact O-CB 3.41Å; I204-L208 VanDerWaalsContact O-CG 3.31Å; I204-L208 WeakPolarHBondContact O-CG 3.36Å; I204-L208 PolarHBondContact O-N 2.81Å
205	A	97.9	Very high	95.4	Very high	0 Å²	0	51.4 Å²	51.4	0%	0	26%	0.257	C	S	.	.	H	α-helix	trans	-61.1	-44.8	178.1	0	0	0	0	0	112.1	L200 H201 R202 A207 L208 W209 I238 W243	L200-A205 HydrophobicContact CB-CB 4.04Å; L200-A205 HydrophobicContact CD1-CB 4.22Å; H201-A205 PolarHBondContact O-N 2.71Å; R202-A205 PolarHBondContact O-N 2.98Å; A205-A207 VanDerWaalsContact C-N 3.35Å; A205-A207 PolarHBondContact O-N 3.07Å; A205-L208 PolarHBondContact O-N 2.79Å; A205-W209 HydrophobicContact CB-CE3 4.04Å; A205-W209 HydrophobicContact CB-CZ3 3.8Å; A205-W209 WeakPolarHBondContact O-CB 3.4Å; A205-W209 VanDerWaalsContact O-CE3 3.26Å; A205-W209 PolarHBondContact O-N 2.76Å; A205-I238 HydrophobicContact CB-CB 4Å; A205-I238 HydrophobicContact CB-CG1 3.58Å; A205-W243 HydrophobicContact CB-CZ3 4.5Å
206	I	98.1	Very high	95.9	Very high	23 Å²	23	48.2 Å²	48.2	12%	0.118	25%	0.245	C	C	.	.	H	α-helix	trans	-55.7	-49.8	175.4	-72.5	165.7	0	0	0	110.7	R202 I204 W209 K210 L225 L228	R202-I206 HydrophobicContact CG-CD1 4.1Å; R202-I206 VanDerWaalsContact O-CG1 3.29Å; R202-I206 WeakPolarHBondContact O-CG1 3.37Å; R202-I206 PolarHBondContact O-N 3.47Å; I204-I206 PolarHBondContact O-N 3.38Å; I206-W209 PolarHBondContact O-N 3.01Å; I206-K210 PolarHBondContact O-N 3.04Å; I206-L225 HydrophobicContact CB-CD2 4.41Å; I206-L225 HydrophobicContact CG2-CD2 4.18Å; I206-L228 HydrophobicContact CD1-CB 3.74Å; I206-L228 HydrophobicContact CG1-CB 3.73Å; I206-L228 HydrophobicContact CG1-CD1 3.99Å
207	A	97.5	Very high	96.4	Very high	14 Å²	14	49.7 Å²	49.7	12%	0.116	24%	0.24	C	C	.	.	H	α-helix	trans	-66.1	-42.2	-179.5	0	0	0	0	0	112.6	P11 E203 I204 A205 K210 L211	P11-A207 HydrophobicContact CB-CB 3.55Å; P11-A207 HydrophobicContact CG-CB 3.14Å; E203-A207 PolarHBondContact O-N 3.47Å; E203-A207 VanDerWaalsContact O-N 3.13Å; I204-A207 PolarHBondContact O-N 3.11Å; A205-A207 VanDerWaalsContact C-N 3.35Å; A205-A207 PolarHBondContact O-N 3.07Å; A207-K210 PolarHBondContact O-N 3.26Å; A207-L211 VanDerWaalsContact O-CB 3.27Å; A207-L211 WeakPolarHBondContact O-CB 3.39Å; A207-L211 PolarHBondContact O-N 3.37Å
208	L	98.4	Very high	96.9	Very high	10 Å²	10	48 Å²	48	5%	0.052	23%	0.233	C	C	.	.	H	α-helix	trans	-68.2	-34.7	178.7	-71.3	179.8	0	0	0	112.6	T186 L200 I204 A205 L211 V212 W243	T186-L208 HydrophobicContact CG2-CB 3.87Å; T186-L208 HydrophobicContact CG2-CD1 4.19Å; T186-L208 HydrophobicContact CG2-CD2 4Å; T186-L208 HydrophobicContact CG2-CG 4.24Å; L200-L208 HydrophobicContact CD1-CD1 4.4Å; I204-L208 HydrophobicContact CG2-CD1 3.71Å; I204-L208 HydrophobicContact CG2-CG 4.14Å; I204-L208 WeakPolarHBondContact O-CB 3.41Å; I204-L208 VanDerWaalsContact O-CG 3.31Å; I204-L208 WeakPolarHBondContact O-CG 3.36Å; I204-L208 PolarHBondContact O-N 2.81Å; A205-L208 PolarHBondContact O-N 2.79Å; L208-L211 HydrophobicContact CD2-CD2 4.4Å; L208-L211 PolarHBondContact O-N 2.9Å; L208-V212 WeakPolarHBondContact O-CB 3.24Å; L208-V212 WeakPolarHBondContact O-CG1 3.23Å; L208-V212 PolarHBondContact O-N 2.9Å; L208-W243 HydrophobicContact CB-CH2 3.78Å; L208-W243 HydrophobicContact CB-CZ3 4.25Å
209	W	98.6	Very high	97	Very high	0 Å²	0	41.4 Å²	41.4	0%	0	22%	0.219	C	C	.	.	H	α-helix	trans	-64.7	-46.7	171.9	-90.2	-46.6	0	0	0	111.8	Y183 A205 I206 L211 V212 F213 L221 W224 L225 L228 I238 W243 F246	Y183-W209 AromaticContact CZ-NE1 3.84Å; Y183-W209 PolarHBondContact OH-NE1 3.46Å; A205-W209 HydrophobicContact CB-CE3 4.04Å; A205-W209 HydrophobicContact CB-CZ3 3.8Å; A205-W209 WeakPolarHBondContact O-CB 3.4Å; A205-W209 VanDerWaalsContact O-CE3 3.26Å; A205-W209 PolarHBondContact O-N 2.76Å; I206-W209 PolarHBondContact O-N 3.01Å; W209-L211 PolarHBondContact O-N 3.44Å; W209-V212 PolarHBondContact O-N 3.14Å; W209-F213 AromaticContact CD1-CE2 3.9Å; W209-F213 WeakPolarHBondContact O-CD2 2.9Å; W209-F213 PolarHBondContact O-N 3.24Å; W209-L221 HydrophobicContact CB-CD1 4.27Å; W209-W224 AromaticContact CD2-NE1 3.68Å; W209-W224 AromaticContact CE2-NE1 3.89Å; W209-W224 AromaticContact CE3-NE1 3.4Å; W209-W224 AromaticContact CH2-CE2 3.88Å; W209-W224 AromaticContact CH2-CZ2 3.52Å; W209-W224 HydrophobicContact CH2-CZ2 3.52Å; W209-W224 AromaticContact CH2-NE1 3.61Å; W209-W224 HydrophobicContact CZ2-CZ2 4.11Å; W209-W224 AromaticContact CZ2-NE1 3.85Å; W209-W224 AromaticContact CZ3-CE2 3.95Å; W209-W224 AromaticContact CZ3-CZ2 3.9Å; W209-W224 HydrophobicContact CZ3-CZ2 3.9Å; W209-W224 AromaticContact CZ3-NE1 3.41Å; W209-L225 HydrophobicContact CB-CD2 3.81Å; W209-L225 HydrophobicContact CE3-CD2 4.37Å; W209-L228 HydrophobicContact CE3-CD1 3.74Å; W209-L228 HydrophobicContact CH2-CD1 4.21Å; W209-L228 HydrophobicContact CZ3-CD1 3.28Å; W209-I238 HydrophobicContact CH2-CB 4.22Å; W209-I238 HydrophobicContact CH2-CD1 3.86Å; W209-I238 HydrophobicContact CH2-CG1 3.73Å; W209-I238 HydrophobicContact CH2-CG2 3.54Å; W209-I238 HydrophobicContact CZ2-CG2 4.1Å; W209-I238 HydrophobicContact CZ3-CD1 4.07Å; W209-I238 HydrophobicContact CZ3-CG1 3.77Å; W209-I238 HydrophobicContact CZ3-CG2 4.34Å; W209-W243 AromaticContact CD1-CH2 3.63Å; W209-W243 AromaticContact CD1-CZ3 3.59Å; W209-W243 AromaticContact CD2-CE3 3.91Å; W209-W243 HydrophobicContact CD2-CE3 3.91Å; W209-W243 HydrophobicContact CD2-CH2 4.31Å; W209-W243 AromaticContact CD2-CZ3 3.54Å; W209-W243 HydrophobicContact CD2-CZ3 3.54Å; W209-W243 AromaticContact CE2-CE3 3.37Å; W209-W243 AromaticContact CE2-CZ3 3.48Å; W209-W243 VanDerWaalsContact CE2-CZ3 3.48Å; W209-W243 HydrophobicContact CE3-CZ3 4.19Å; W209-W243 HydrophobicContact CG-CE3 4.36Å; W209-W243 AromaticContact CG-CH2 3.94Å; W209-W243 HydrophobicContact CG-CH2 3.94Å; W209-W243 AromaticContact CG-CZ3 3.65Å; W209-W243 HydrophobicContact CG-CZ3 3.65Å; W209-W243 HydrophobicContact CH2-CE3 4.23Å; W209-W243 HydrophobicContact CZ2-CD2 4.29Å; W209-W243 AromaticContact CZ2-CE3 3.59Å; W209-W243 HydrophobicContact CZ2-CE3 3.59Å; W209-W243 HydrophobicContact CZ2-CZ3 4.13Å; W209-W243 AromaticContact NE1-CD2 3.85Å; W209-W243 AromaticContact NE1-CE3 3.47Å; W209-W243 AromaticContact NE1-CH2 3.84Å; W209-W243 AromaticContact NE1-CZ3 3.47Å; W209-F246 AromaticContact CD1-CD1 3.92Å; W209-F246 AromaticContact CE2-CD1 3.85Å; W209-F246 HydrophobicContact CZ2-CB 4.1Å; W209-F246 HydrophobicContact CZ2-CD1 4.27Å; W209-F246 HydrophobicContact CZ2-CG 4.17Å; W209-F246 AromaticContact NE1-CD1 3.39Å
210	K	97.9	Very high	97.1	Very high	102 Å²	102	39.3 Å²	39.3	44%	0.443	20%	0.204	S	C	.	.	H	α-helix	trans	-57.5	-39.5	174.1	-173	173.1	-178.3	173.4	0	111.5	L15 I206 A207 L225	L15-K210 HydrophobicContact CD1-CD 3.92Å; I206-K210 PolarHBondContact O-N 3.04Å; A207-K210 PolarHBondContact O-N 3.26Å; K210-L225 HydrophobicContact CB-CD1 3.92Å; K210-L225 HydrophobicContact CG-CD1 4.46Å
211	L	98.1	Very high	97.2	Very high	33 Å²	33	39.4 Å²	39.4	17%	0.173	21%	0.205	C	C	.	.	H	α-helix	trans	-71.7	-49.7	-178.9	-167	60.4	0	0	0	112.2	T123 F125 L128 A207 L208 W209 F213 T214	T123-L211 WeakPolarHBondContact O-CD1 3.38Å; F125-L211 HydrophobicContact CB-CD1 4.06Å; F125-L211 HydrophobicContact CD2-CG 4.47Å; F125-L211 WeakPolarHBondContact CD2-O 3.32Å; L128-L211 HydrophobicContact CB-CD2 3.96Å; L128-L211 HydrophobicContact CB-CG 4.41Å; L128-L211 HydrophobicContact CD2-CD2 3.98Å; L128-L211 HydrophobicContact CD2-CG 3.94Å; L128-L211 HydrophobicContact CG-CD2 4.48Å; A207-L211 VanDerWaalsContact O-CB 3.27Å; A207-L211 WeakPolarHBondContact O-CB 3.39Å; A207-L211 PolarHBondContact O-N 3.37Å; L208-L211 HydrophobicContact CD2-CD2 4.4Å; L208-L211 PolarHBondContact O-N 2.9Å; W209-L211 PolarHBondContact O-N 3.44Å; L211-F213 VanDerWaalsContact C-N 3.29Å; L211-F213 PolarHBondContact O-N 2.99Å; L211-T214 VanDerWaalsContact O-CB 3.29Å; L211-T214 WeakPolarHBondContact O-CB 3.24Å; L211-T214 PolarHBondContact O-N 3.24Å; L211-T214 VanDerWaalsContact O-N 3.14Å; L211-T214 PolarHBondContact O-OG1 2.89Å
212	V	98.5	Very high	97.2	Very high	0 Å²	0	39.1 Å²	39.1	0%	0	21%	0.206	C	C	.	.	H	α-helix	trans	-65.6	-33.5	-174.4	75.1	0	0	0	0	112.1	L128 F179 L182 Y183 T186 L208 W209 T214 W243	L128-V212 HydrophobicContact CD2-CB 4.42Å; F179-V212 HydrophobicContact CE2-CG2 4.35Å; F179-V212 WeakPolarHBondContact CE2-O 3.41Å; F179-V212 HydrophobicContact CZ-CG2 4.49Å; L182-V212 HydrophobicContact CG-CG2 4.26Å; Y183-V212 HydrophobicContact CD2-CG1 3.84Å; Y183-V212 HydrophobicContact CD2-CG2 4.08Å; Y183-V212 HydrophobicContact CE2-CG1 4Å; T186-V212 HydrophobicContact CG2-CB 4.33Å; L208-V212 WeakPolarHBondContact O-CB 3.24Å; L208-V212 WeakPolarHBondContact O-CG1 3.23Å; L208-V212 PolarHBondContact O-N 2.9Å; W209-V212 PolarHBondContact O-N 3.14Å; V212-T214 VanDerWaalsContact C-N 3.28Å; V212-T214 PolarHBondContact O-N 2.79Å; V212-W243 HydrophobicContact CG1-CZ2 4.45Å
213	F	98.3	Very high	97.2	Very high	7 Å²	7	39.3 Å²	39.3	3%	0.031	21%	0.209	C	C	.	.	T	Hydrogen-bonded Turn	trans	-86.3	14.6	177.3	-72.6	-66	0	0	0	114.4	F179 Y183 W209 L211 Q215 N216 N217 P218 L221 F246 L247 T250	F179-F213 HydrophobicContact CE1-CD1 4.29Å; F179-F213 AromaticContact CE1-CE1 3.81Å; F179-F213 HydrophobicContact CE1-CE1 3.81Å; F179-F213 AromaticContact CZ-CD1 3.6Å; F179-F213 HydrophobicContact CZ-CD1 3.6Å; F179-F213 AromaticContact CZ-CE1 3.55Å; F179-F213 HydrophobicContact CZ-CE1 3.55Å; F179-F213 HydrophobicContact CZ-CZ 4.43Å; Y183-F213 HydrophobicContact CD2-CE2 4.5Å; Y183-F213 HydrophobicContact CD2-CZ 4.23Å; Y183-F213 AromaticContact CE2-CE2 3.79Å; Y183-F213 HydrophobicContact CE2-CE2 3.79Å; Y183-F213 AromaticContact CE2-CZ 3.74Å; Y183-F213 HydrophobicContact CE2-CZ 3.74Å; W209-F213 AromaticContact CD1-CE2 3.9Å; W209-F213 WeakPolarHBondContact O-CD2 2.9Å; W209-F213 PolarHBondContact O-N 3.24Å; L211-F213 VanDerWaalsContact C-N 3.29Å; L211-F213 PolarHBondContact O-N 2.99Å; F213-Q215 PolarHBondContact O-N 3.19Å; F213-N216 CarbonylContact O-C 3.6Å; F213-N216 PolarHBondContact O-N 2.87Å; F213-N216 VanDerWaalsContact O-N 3.11Å; F213-N217 PolarHBondContact O-N 3.48Å; F213-P218 HydrophobicContact CD1-CG 4.07Å; F213-P218 HydrophobicContact CE1-CG 4.03Å; F213-P218 HydrophobicContact CG-CG 4.35Å; F213-P218 HydrophobicContact CZ-CG 4.28Å; F213-L221 HydrophobicContact CB-CD2 3.63Å; F213-L221 HydrophobicContact CD2-CD1 3.84Å; F213-L221 HydrophobicContact CD2-CD2 3.94Å; F213-L221 HydrophobicContact CE2-CD1 4.27Å; F213-L221 HydrophobicContact CG-CD2 4.1Å; F213-F246 HydrophobicContact CE2-CD1 4.21Å; F213-F246 AromaticContact CE2-CE1 3.91Å; F213-F246 HydrophobicContact CE2-CE1 3.91Å; F213-F246 HydrophobicContact CZ-CE1 4.5Å; F213-L247 HydrophobicContact CE1-CD1 4.17Å; F213-L247 HydrophobicContact CZ-CD1 4.11Å; F213-T250 HydrophobicContact CZ-CG2 4.19Å
214	T	98.2	Very high	97.2	Very high	81 Å²	81	35.6 Å²	35.6	50%	0.497	19%	0.191	S	C	.	.	T	Hydrogen-bonded Turn	trans	-50.5	-37.8	-177.5	-69.3	0	0	0	0	113.6	F125 L211 V212	F125-T214 HydrophobicContact CB-CG2 3.94Å; F125-T214 HydrophobicContact CD1-CG2 4.33Å; F125-T214 HydrophobicContact CG-CG2 4.12Å; L211-T214 VanDerWaalsContact O-CB 3.29Å; L211-T214 WeakPolarHBondContact O-CB 3.24Å; L211-T214 PolarHBondContact O-N 3.24Å; L211-T214 VanDerWaalsContact O-N 3.14Å; L211-T214 PolarHBondContact O-OG1 2.89Å; V212-T214 VanDerWaalsContact C-N 3.28Å; V212-T214 PolarHBondContact O-N 2.79Å
215	Q	97.5	Very high	97.3	Very high	61 Å²	61	35.3 Å²	35.3	29%	0.285	19%	0.19	S	C	.	.	T	Hydrogen-bonded Turn	trans	-95.2	-13.4	-175.5	-61.3	-164.6	86.2	0	0	114.2	F125 L170 F213	F125-Q215 HydrophobicContact CD1-CG 4.31Å; F125-Q215 HydrophobicContact CE1-CG 3.88Å; F125-Q215 VanDerWaalsContact CE1-NE2 3.33Å; L170-Q215 PolarHBondContact O-NE2 3.36Å; L170-Q215 PolarHBondContact O-OE1 3.42Å; F213-Q215 PolarHBondContact O-N 3.19Å
216	N	94.5	Very high	97.3	Very high	70 Å²	70	39.7 Å²	39.7	37%	0.374	21%	0.214	S	C	.	.	S	Bend	trans	-151.6	61.6	-167.8	60	-24	0	0	0	110.7	F179 F213 P218	F179-N216 WeakPolarHBondContact CE2-ND2 3.49Å; F179-N216 WeakPolarHBondContact CE2-OD1 3.31Å; F179-N216 WeakPolarHBondContact CZ-ND2 3.44Å; F213-N216 CarbonylContact O-C 3.6Å; F213-N216 PolarHBondContact O-N 2.87Å; F213-N216 VanDerWaalsContact O-N 3.11Å; N216-P218 WeakPolarHBondContact O-CD 3.44Å
217	N	96.3	Very high	97.3	Very high	86 Å²	86	38.7 Å²	38.7	46%	0.46	21%	0.208	S	C	.	.			trans	-63.7	111.1	-178.8	-170.6	12.3	0	0	0	111.5	F213 L221	F213-N217 PolarHBondContact O-N 3.48Å; N217-L221 WeakPolarHBondContact OD1-CB 3.44Å; N217-L221 WeakPolarHBondContact OD1-CD2 3.4Å
218	P	96.4	Very high	97.3	Very high	15 Å²	15	38.1 Å²	38.1	10%	0.097	20%	0.203	C	C	.	.			trans	-73.4	149.5	177.7	29.2	-30	0	0	0	110.6	F213 N216 V220 L221 T250	F213-P218 HydrophobicContact CD1-CG 4.07Å; F213-P218 HydrophobicContact CE1-CG 4.03Å; F213-P218 HydrophobicContact CG-CG 4.35Å; F213-P218 HydrophobicContact CZ-CG 4.28Å; N216-P218 WeakPolarHBondContact O-CD 3.44Å; P218-V220 PolarHBondContact O-N 3.02Å; P218-L221 HydrophobicContact CG-CB 4.04Å; P218-L221 WeakPolarHBondContact O-CB 3.36Å; P218-L221 PolarHBondContact O-N 2.89Å; P218-T250 HydrophobicContact CB-CG2 4.18Å; P218-T250 HydrophobicContact CG-CG2 3.74Å
219	P	95.8	Very high	97.3	Very high	82 Å²	82	41.7 Å²	41.7	53%	0.532	23%	0.226	S	C	.	.	T	Hydrogen-bonded Turn	trans	-55.4	-26.1	-172.9	-29.4	36.2	0	0	0	116.1	Q223 P255	P219-Q223 PolarHBondContact O-OE1 3.47Å; P219-P255 HydrophobicContact CB-CB 3.85Å; P219-P255 HydrophobicContact CG-CB 4.42Å
220	V	96.5	Very high	97.3	Very high	5 Å²	5	47.3 Å²	47.3	3%	0.03	25%	0.252	C	S	.	.	T	Hydrogen-bonded Turn	trans	-87.5	-12	-176.9	71.2	0	0	0	0	113.8	P218 D222 Q223 W224 F246 F249 T250 I253 L257 F273	P218-V220 PolarHBondContact O-N 3.02Å; V220-D222 PolarHBondContact O-N 3.36Å; V220-Q223 PolarHBondContact O-N 3.17Å; V220-Q223 PolarHBondContact O-OE1 2.85Å; V220-W224 WeakPolarHBondContact O-CB 3.42Å; V220-W224 PolarHBondContact O-N 3.21Å; V220-F246 HydrophobicContact CG1-CZ 4.42Å; V220-F249 HydrophobicContact CG2-CE1 4.06Å; V220-T250 HydrophobicContact CG1-CG2 4.01Å; V220-I253 HydrophobicContact CB-CG2 4.1Å; V220-I253 HydrophobicContact CG1-CG2 4.19Å; V220-I253 HydrophobicContact CG2-CG2 4.14Å; V220-L257 HydrophobicContact CG2-CD2 3.87Å; V220-F273 HydrophobicContact CG2-CE1 3.56Å; V220-F273 HydrophobicContact CG2-CZ 3.58Å
221	L	97.3	Very high	97.2	Very high	5 Å²	5	44.2 Å²	44.2	3%	0.026	24%	0.24	C	C	.	.	H	α-helix	trans	-62.1	-46.3	-169.3	-173.9	62.6	0	0	0	112.2	W209 F213 N217 P218 Q223 W224 L225 F246	W209-L221 HydrophobicContact CB-CD1 4.27Å; F213-L221 HydrophobicContact CB-CD2 3.63Å; F213-L221 HydrophobicContact CD2-CD1 3.84Å; F213-L221 HydrophobicContact CD2-CD2 3.94Å; F213-L221 HydrophobicContact CE2-CD1 4.27Å; F213-L221 HydrophobicContact CG-CD2 4.1Å; N217-L221 WeakPolarHBondContact OD1-CB 3.44Å; N217-L221 WeakPolarHBondContact OD1-CD2 3.4Å; P218-L221 HydrophobicContact CG-CB 4.04Å; P218-L221 WeakPolarHBondContact O-CB 3.36Å; P218-L221 PolarHBondContact O-N 2.89Å; L221-Q223 VanDerWaalsContact C-N 3.32Å; L221-Q223 PolarHBondContact O-N 2.91Å; L221-W224 WeakPolarHBondContact O-CB 3.36Å; L221-W224 PolarHBondContact O-N 2.99Å; L221-L225 HydrophobicContact CD1-CD1 4.12Å; L221-L225 HydrophobicContact CD1-CD2 4.25Å; L221-L225 HydrophobicContact CD1-CG 3.99Å; L221-L225 HydrophobicContact CD2-CD1 4.32Å; L221-L225 HydrophobicContact CG-CD1 3.87Å; L221-L225 HydrophobicContact CG-CG 4.1Å; L221-L225 VanDerWaalsContact O-CG 3.27Å; L221-L225 WeakPolarHBondContact O-CG 3.23Å; L221-L225 PolarHBondContact O-N 3.39Å; L221-F246 HydrophobicContact CD1-CE1 3.95Å; L221-F246 HydrophobicContact CD1-CZ 4.16Å
222	D	96.2	Very high	97	Very high	86 Å²	86	45.8 Å²	45.8	46%	0.46	25%	0.253	S	S	.	.	H	α-helix	trans	-63.6	-41.6	-173.8	-69.3	-30.9	0	0	0	111	V220 L225 N226	V220-D222 PolarHBondContact O-N 3.36Å; D222-L225 PolarHBondContact O-N 2.89Å; D222-N226 WeakPolarHBondContact O-CB 3.44Å; D222-N226 PolarHBondContact O-N 2.94Å; D222-N226 PolarHBondContact O-ND2 3.36Å; D222-N226 VanDerWaalsContact O-ND2 3.17Å
223	Q	95.8	Very high	96.8	Very high	48 Å²	48	48.6 Å²	48.6	22%	0.224	27%	0.272	C	S	.	.	H	α-helix	trans	-66.8	-42.7	176.5	-61.7	75.3	12.5	0	0	110.7	P219 V220 L221 N226 F227 F273	P219-Q223 PolarHBondContact O-OE1 3.47Å; V220-Q223 PolarHBondContact O-N 3.17Å; V220-Q223 PolarHBondContact O-OE1 2.85Å; L221-Q223 VanDerWaalsContact C-N 3.32Å; L221-Q223 PolarHBondContact O-N 2.91Å; Q223-N226 PolarHBondContact O-N 3.18Å; Q223-F227 WeakPolarHBondContact O-CB 3.17Å; Q223-F227 PolarHBondContact O-N 2.79Å; Q223-F273 HydrophobicContact CB-CE2 4.01Å; Q223-F273 HydrophobicContact CB-CZ 4.06Å
224	W	97.9	Very high	96.7	Very high	0 Å²	0	50.6 Å²	50.6	0%	0	29%	0.294	C	S	.	.	H	α-helix	trans	-58.8	-47.4	175.2	170.3	-109.4	0	0	0	112.3	W209 V220 L221 N226 F227 L228 F246 L269 F270 F273	W209-W224 AromaticContact CD2-NE1 3.68Å; W209-W224 AromaticContact CE2-NE1 3.89Å; W209-W224 AromaticContact CE3-NE1 3.4Å; W209-W224 AromaticContact CH2-CE2 3.88Å; W209-W224 AromaticContact CH2-CZ2 3.52Å; W209-W224 HydrophobicContact CH2-CZ2 3.52Å; W209-W224 AromaticContact CH2-NE1 3.61Å; W209-W224 HydrophobicContact CZ2-CZ2 4.11Å; W209-W224 AromaticContact CZ2-NE1 3.85Å; W209-W224 AromaticContact CZ3-CE2 3.95Å; W209-W224 AromaticContact CZ3-CZ2 3.9Å; W209-W224 HydrophobicContact CZ3-CZ2 3.9Å; W209-W224 AromaticContact CZ3-NE1 3.41Å; V220-W224 WeakPolarHBondContact O-CB 3.42Å; V220-W224 PolarHBondContact O-N 3.21Å; L221-W224 WeakPolarHBondContact O-CB 3.36Å; L221-W224 PolarHBondContact O-N 2.99Å; W224-N226 VanDerWaalsContact C-N 3.33Å; W224-N226 PolarHBondContact O-N 3.22Å; W224-F227 AromaticContact CE3-CD1 3.91Å; W224-F227 HydrophobicContact CE3-CD1 3.91Å; W224-F227 HydrophobicContact CE3-CE1 4.38Å; W224-F227 HydrophobicContact CH2-CE1 4.42Å; W224-F227 AromaticContact CZ3-CD1 3.85Å; W224-F227 HydrophobicContact CZ3-CD1 3.85Å; W224-F227 AromaticContact CZ3-CE1 3.84Å; W224-F227 HydrophobicContact CZ3-CE1 3.84Å; W224-F227 WeakPolarHBondContact O-CB 3.36Å; W224-F227 PolarHBondContact O-N 3.29Å; W224-L228 HydrophobicContact CD2-CD1 4.11Å; W224-L228 HydrophobicContact CD2-CG 4.26Å; W224-L228 VanDerWaalsContact CE2-CD1 3.42Å; W224-L228 HydrophobicContact CG-CD1 4.43Å; W224-L228 HydrophobicContact CH2-CD2 4.11Å; W224-L228 HydrophobicContact CH2-CG 4.48Å; W224-L228 HydrophobicContact CZ2-CD1 3.68Å; W224-L228 HydrophobicContact CZ2-CD2 3.99Å; W224-L228 HydrophobicContact CZ2-CG 4.07Å; W224-L228 VanDerWaalsContact NE1-CD1 3.31Å; W224-L228 WeakPolarHBondContact O-CG 3.4Å; W224-L228 PolarHBondContact O-N 3.32Å; W224-F246 HydrophobicContact CB-CE2 3.89Å; W224-F246 HydrophobicContact CB-CZ 3.82Å; W224-F246 AromaticContact CD1-CE1 3.85Å; W224-F246 AromaticContact CD1-CE2 3.5Å; W224-F246 VanDerWaalsContact CD1-CE2 3.5Å; W224-F246 AromaticContact CD1-CZ 3.23Å; W224-F246 AromaticContact CD2-CD2 3.99Å; W224-F246 HydrophobicContact CD2-CD2 3.99Å; W224-F246 AromaticContact CD2-CE2 3.42Å; W224-F246 HydrophobicContact CD2-CE2 3.42Å; W224-F246 VanDerWaalsContact CD2-CE2 3.42Å; W224-F246 HydrophobicContact CD2-CZ 4Å; W224-F246 AromaticContact CE2-CD2 3.79Å; W224-F246 AromaticContact CE2-CE2 3.63Å; W224-F246 HydrophobicContact CE3-CD2 4.49Å; W224-F246 HydrophobicContact CE3-CE2 4.05Å; W224-F246 HydrophobicContact CG-CD2 4.27Å; W224-F246 HydrophobicContact CG-CE1 4.41Å; W224-F246 AromaticContact CG-CE2 3.32Å; W224-F246 HydrophobicContact CG-CE2 3.32Å; W224-F246 AromaticContact CG-CZ 3.4Å; W224-F246 HydrophobicContact CG-CZ 3.4Å; W224-F246 VanDerWaalsContact CG-CZ 3.4Å; W224-F246 HydrophobicContact CZ2-CD2 4.15Å; W224-F246 HydrophobicContact CZ2-CE2 4.4Å; W224-F246 AromaticContact NE1-CD2 3.97Å; W224-F246 AromaticContact NE1-CE2 3.65Å; W224-F246 AromaticContact NE1-CZ 3.69Å; W224-L269 HydrophobicContact CH2-CD2 3.7Å; W224-L269 HydrophobicContact CH2-CG 3.9Å; W224-L269 HydrophobicContact CZ2-CD2 4.42Å; W224-L269 HydrophobicContact CZ3-CG 4.36Å; W224-F270 AromaticContact CH2-CD1 3.86Å; W224-F270 HydrophobicContact CH2-CD1 3.86Å; W224-F270 AromaticContact CH2-CE1 3.8Å; W224-F270 HydrophobicContact CH2-CE1 3.8Å; W224-F270 HydrophobicContact CZ2-CE1 4.34Å; W224-F270 AromaticContact CZ3-CD1 3.96Å; W224-F270 HydrophobicContact CZ3-CD1 3.96Å; W224-F270 HydrophobicContact CZ3-CE1 4.29Å; W224-F273 HydrophobicContact CB-CE2 4.3Å; W224-F273 HydrophobicContact CB-CZ 4.32Å; W224-F273 HydrophobicContact CE3-CB 3.96Å; W224-F273 HydrophobicContact CE3-CD1 4.02Å; W224-F273 AromaticContact CE3-CD2 3.91Å; W224-F273 HydrophobicContact CE3-CD2 3.91Å; W224-F273 HydrophobicContact CE3-CE2 4.46Å; W224-F273 AromaticContact CE3-CG 3.66Å; W224-F273 HydrophobicContact CE3-CG 3.66Å; W224-F273 HydrophobicContact CZ3-CB 3.77Å; W224-F273 HydrophobicContact CZ3-CD1 4.45Å; W224-F273 AromaticContact CZ3-CG 4Å; W224-F273 HydrophobicContact CZ3-CG 4Å
225	L	98.1	Very high	96.6	Very high	14 Å²	14	48.5 Å²	48.5	7%	0.073	28%	0.28	C	S	.	.	H	α-helix	trans	-66.9	-35.5	178.9	-63.4	-178.1	0	0	0	111.7	I206 W209 K210 L221 D222 T229	I206-L225 HydrophobicContact CB-CD2 4.41Å; I206-L225 HydrophobicContact CG2-CD2 4.18Å; W209-L225 HydrophobicContact CB-CD2 3.81Å; W209-L225 HydrophobicContact CE3-CD2 4.37Å; K210-L225 HydrophobicContact CB-CD1 3.92Å; K210-L225 HydrophobicContact CG-CD1 4.46Å; L221-L225 HydrophobicContact CD1-CD1 4.12Å; L221-L225 HydrophobicContact CD1-CD2 4.25Å; L221-L225 HydrophobicContact CD1-CG 3.99Å; L221-L225 HydrophobicContact CD2-CD1 4.32Å; L221-L225 HydrophobicContact CG-CD1 3.87Å; L221-L225 HydrophobicContact CG-CG 4.1Å; L221-L225 VanDerWaalsContact O-CG 3.27Å; L221-L225 WeakPolarHBondContact O-CG 3.23Å; L221-L225 PolarHBondContact O-N 3.39Å; D222-L225 PolarHBondContact O-N 2.89Å; L225-T229 WeakPolarHBondContact O-CB 3.48Å; L225-T229 PolarHBondContact O-N 2.87Å; L225-T229 PolarHBondContact O-OG1 3.49Å
226	N	97.2	Very high	96.4	Very high	92 Å²	92	54.8 Å²	54.8	49%	0.492	31%	0.306	S	S	.	.	H	α-helix	trans	-64.2	-47.1	173.7	-71.5	-22	0	0	0	111.7	D222 Q223 W224 L228 T229 E230 W276	D222-N226 WeakPolarHBondContact O-CB 3.44Å; D222-N226 PolarHBondContact O-N 2.94Å; D222-N226 PolarHBondContact O-ND2 3.36Å; D222-N226 VanDerWaalsContact O-ND2 3.17Å; Q223-N226 PolarHBondContact O-N 3.18Å; W224-N226 VanDerWaalsContact C-N 3.33Å; W224-N226 PolarHBondContact O-N 3.22Å; N226-L228 VanDerWaalsContact C-N 3.35Å; N226-L228 PolarHBondContact O-N 3.38Å; N226-T229 WeakPolarHBondContact O-CB 3.46Å; N226-T229 PolarHBondContact O-N 3.34Å; N226-E230 PolarHBondContact O-N 2.66Å; N226-W276 HydrophobicContact CB-CH2 3.95Å
227	F	98.2	Very high	96.4	Very high	2 Å²	2	52.6 Å²	52.6	1%	0.009	30%	0.301	C	S	.	.	H	α-helix	trans	-54.3	-49.5	174.6	162.3	-106.5	0	0	0	111.9	Q223 W224 T229 E230 N231 P232 L269 T272 F273 W276	Q223-F227 WeakPolarHBondContact O-CB 3.17Å; Q223-F227 PolarHBondContact O-N 2.79Å; W224-F227 AromaticContact CE3-CD1 3.91Å; W224-F227 HydrophobicContact CE3-CD1 3.91Å; W224-F227 HydrophobicContact CE3-CE1 4.38Å; W224-F227 HydrophobicContact CH2-CE1 4.42Å; W224-F227 AromaticContact CZ3-CD1 3.85Å; W224-F227 HydrophobicContact CZ3-CD1 3.85Å; W224-F227 AromaticContact CZ3-CE1 3.84Å; W224-F227 HydrophobicContact CZ3-CE1 3.84Å; W224-F227 WeakPolarHBondContact O-CB 3.36Å; W224-F227 PolarHBondContact O-N 3.29Å; F227-T229 VanDerWaalsContact C-N 3.26Å; F227-T229 PolarHBondContact O-N 3.02Å; F227-E230 PolarHBondContact O-N 2.74Å; F227-N231 PolarHBondContact O-N 3.19Å; F227-P232 HydrophobicContact CD2-CG 3.68Å; F227-P232 HydrophobicContact CE2-CG 3.38Å; F227-P232 HydrophobicContact CZ-CG 4.37Å; F227-P232 VanDerWaalsContact O-CD 3.31Å; F227-P232 WeakPolarHBondContact O-CD 3.33Å; F227-L269 HydrophobicContact CE1-CD1 3.75Å; F227-L269 HydrophobicContact CE1-CG 4.11Å; F227-L269 HydrophobicContact CZ-CD1 3.76Å; F227-T272 HydrophobicContact CE2-CG2 4Å; F227-T272 HydrophobicContact CZ-CG2 3.95Å; F227-F273 HydrophobicContact CB-CD2 3.63Å; F227-F273 HydrophobicContact CB-CE2 4.16Å; F227-F273 HydrophobicContact CD1-CB 3.84Å; F227-F273 AromaticContact CD1-CD2 3.9Å; F227-F273 HydrophobicContact CD1-CD2 3.9Å; F227-F273 HydrophobicContact CD1-CG 4.27Å; F227-F273 HydrophobicContact CD2-CB 4.41Å; F227-F273 HydrophobicContact CD2-CD2 4.34Å; F227-F273 HydrophobicContact CE1-CB 3.78Å; F227-F273 HydrophobicContact CE2-CB 4.33Å; F227-F273 HydrophobicContact CG-CB 4.16Å; F227-F273 AromaticContact CG-CD2 3.71Å; F227-F273 HydrophobicContact CG-CD2 3.71Å; F227-F273 HydrophobicContact CG-CG 4.42Å; F227-F273 HydrophobicContact CZ-CB 4.03Å; F227-W276 HydrophobicContact CB-CD2 4.01Å; F227-W276 HydrophobicContact CB-CE3 3.63Å; F227-W276 HydrophobicContact CB-CH2 4.08Å; F227-W276 HydrophobicContact CB-CZ2 4.41Å; F227-W276 HydrophobicContact CB-CZ3 3.69Å; F227-W276 HydrophobicContact CD2-CB 3.81Å; F227-W276 AromaticContact CD2-CD2 3.74Å; F227-W276 HydrophobicContact CD2-CD2 3.74Å; F227-W276 HydrophobicContact CD2-CE3 4.03Å; F227-W276 AromaticContact CD2-CG 3.65Å; F227-W276 HydrophobicContact CD2-CG 3.65Å; F227-W276 HydrophobicContact CE2-CB 4.05Å; F227-W276 HydrophobicContact CE2-CG 4.28Å; F227-W276 HydrophobicContact CG-CD2 4.36Å; F227-W276 HydrophobicContact CG-CE3 4.26Å
228	L	98.3	Very high	96.5	Very high	1 Å²	1	48.6 Å²	48.6	1%	0.005	28%	0.279	C	S	.	.	H	α-helix	trans	-66.6	-29	178.2	-68.1	177.8	0	0	0	112.9	R202 I206 W209 W224 N226 I235 I238 L269	R202-L228 VanDerWaalsContact CD-O 3.29Å; R202-L228 WeakPolarHBondContact CD-O 3.39Å; R202-L228 PolarHBondContact NH1-O 3.24Å; I206-L228 HydrophobicContact CD1-CB 3.74Å; I206-L228 HydrophobicContact CG1-CB 3.73Å; I206-L228 HydrophobicContact CG1-CD1 3.99Å; W209-L228 HydrophobicContact CE3-CD1 3.74Å; W209-L228 HydrophobicContact CH2-CD1 4.21Å; W209-L228 HydrophobicContact CZ3-CD1 3.28Å; W224-L228 HydrophobicContact CD2-CD1 4.11Å; W224-L228 HydrophobicContact CD2-CG 4.26Å; W224-L228 VanDerWaalsContact CE2-CD1 3.42Å; W224-L228 HydrophobicContact CG-CD1 4.43Å; W224-L228 HydrophobicContact CH2-CD2 4.11Å; W224-L228 HydrophobicContact CH2-CG 4.48Å; W224-L228 HydrophobicContact CZ2-CD1 3.68Å; W224-L228 HydrophobicContact CZ2-CD2 3.99Å; W224-L228 HydrophobicContact CZ2-CG 4.07Å; W224-L228 VanDerWaalsContact NE1-CD1 3.31Å; W224-L228 WeakPolarHBondContact O-CG 3.4Å; W224-L228 PolarHBondContact O-N 3.32Å; N226-L228 VanDerWaalsContact C-N 3.35Å; N226-L228 PolarHBondContact O-N 3.38Å; L228-I235 HydrophobicContact CD2-CD1 3.72Å; L228-I238 HydrophobicContact CD2-CD1 4.18Å; L228-L269 HydrophobicContact CD2-CD2 4.33Å
229	T	97.7	Very high	96.5	Very high	86 Å²	86	49.7 Å²	49.7	53%	0.528	29%	0.287	S	S	.	.	H	α-helix	trans	-71.7	-45.9	177	-60.3	0	0	0	0	110.9	L225 N226 F227 N231	L225-T229 WeakPolarHBondContact O-CB 3.48Å; L225-T229 PolarHBondContact O-N 2.87Å; L225-T229 PolarHBondContact O-OG1 3.49Å; N226-T229 WeakPolarHBondContact O-CB 3.46Å; N226-T229 PolarHBondContact O-N 3.34Å; F227-T229 VanDerWaalsContact C-N 3.26Å; F227-T229 PolarHBondContact O-N 3.02Å; T229-N231 VanDerWaalsContact C-N 3.28Å; T229-N231 PolarHBondContact O-N 2.71Å
230	E	97.4	Very high	96.6	Very high	117 Å²	117	50.8 Å²	50.8	55%	0.547	28%	0.281	S	S	.	.	H	α-helix	trans	-65.1	-34.3	174.5	-172.9	176.1	164.9	0	0	111.7	N226 F227 W276	N226-E230 PolarHBondContact O-N 2.66Å; F227-E230 PolarHBondContact O-N 2.74Å; E230-W276 VanDerWaalsContact OE2-CZ2 3.24Å; E230-W276 WeakPolarHBondContact OE2-CZ2 3.23Å; E230-W276 PolarHBondContact OE2-NE1 3.4Å
231	N	96.7	Very high	96.6	Very high	37 Å²	37	55 Å²	55	20%	0.198	30%	0.303	C	S	.	.			trans	55.6	52.6	175.6	-165.3	25.9	0	0	0	114.1	R202 F227 T229 S233 G234 I235	R202-N231 PolarHBondContact NE-ND2 3.06Å; F227-N231 PolarHBondContact O-N 3.19Å; T229-N231 VanDerWaalsContact C-N 3.28Å; T229-N231 PolarHBondContact O-N 2.71Å; N231-S233 PolarHBondContact O-N 2.75Å; N231-G234 PolarHBondContact O-N 3.46Å; N231-G234 PolarHBondContact OD1-N 3.37Å; N231-I235 PolarHBondContact ND2-O 3.01Å; N231-I235 VanDerWaalsContact OD1-CG1 3.23Å; N231-I235 WeakPolarHBondContact OD1-CG1 3.42Å; N231-I235 PolarHBondContact OD1-N 2.98Å
232	P	95	Very high	96.7	Very high	67 Å²	67	55.6 Å²	55.6	44%	0.435	31%	0.307	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.6	-31.4	-173.5	26.2	-36.2	0	0	0	113.5	F227 W276	F227-P232 HydrophobicContact CD2-CG 3.68Å; F227-P232 HydrophobicContact CE2-CG 3.38Å; F227-P232 HydrophobicContact CZ-CG 4.37Å; F227-P232 VanDerWaalsContact O-CD 3.31Å; F227-P232 WeakPolarHBondContact O-CD 3.33Å; P232-W276 HydrophobicContact CG-CG 4.36Å
233	S	93.3	Very high	96.8	Very high	58 Å²	58	51.5 Å²	51.5	41%	0.406	29%	0.285	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.2	1	178	53.3	0	0	0	0	114.3	N231 I235	N231-S233 PolarHBondContact O-N 2.75Å; S233-I235 VanDerWaalsContact C-N 3.33Å; S233-I235 PolarHBondContact O-N 3.42Å
234	G	95.9	Very high	96.9	Very high	49 Å²	49	51.5 Å²	51.5	51%	0.505	29%	0.286	S	S	.	.			trans	65.3	30.4	175.2	0	0	0	0	0	114.6	N231	N231-G234 PolarHBondContact O-N 3.46Å; N231-G234 PolarHBondContact OD1-N 3.37Å
235	I	96.1	Very high	96.9	Very high	37 Å²	37	54 Å²	54	19%	0.19	30%	0.298	C	S	.	.			trans	-65.4	143.1	-180	62.9	163.8	0	0	0	111.4	L228 N231 S233 I238 L269	L228-I235 HydrophobicContact CD2-CD1 3.72Å; N231-I235 PolarHBondContact ND2-O 3.01Å; N231-I235 VanDerWaalsContact OD1-CG1 3.23Å; N231-I235 WeakPolarHBondContact OD1-CG1 3.42Å; N231-I235 PolarHBondContact OD1-N 2.98Å; S233-I235 VanDerWaalsContact C-N 3.33Å; S233-I235 PolarHBondContact O-N 3.42Å; I235-I238 HydrophobicContact CD1-CD1 3.66Å; I235-L269 HydrophobicContact CD1-CD1 4.17Å; I235-L269 HydrophobicContact CD1-CD2 3.75Å; I235-L269 HydrophobicContact CG2-CD1 4.04Å
236	K	92.8	Very high	96.9	Very high	193 Å²	193	53.3 Å²	53.3	84%	0.839	30%	0.295	S	S	*	.			trans	-90.4	-27.9	178.2	-64.9	-175.7	179.7	179.1	0	112.8	R202	R202-K236 PolarHBondContact N-O 2.96Å
237	G	95.3	Very high	96.9	Very high	25 Å²	25	49.3 Å²	49.3	26%	0.258	27%	0.274	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-169	175.8	-175.7	0	0	0	0	0	113.6	L200	L200-G237 CarbonylContact O-C 3.34Å; L200-G237 WeakPolarHBondContact O-CA 3.45Å
238	I	98.1	Very high	96.8	Very high	1 Å²	1	52 Å²	52	1%	0.005	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	123.9	-176.2	-61.7	-60.3	0	0	0	109.1	S199 L200 A205 W209 L228 I235 T242 W243 L269	S199-I238 CarbonylContact C-O 3.51Å; S199-I238 VanDerWaalsContact CA-O 3.24Å; S199-I238 WeakPolarHBondContact CA-O 3.36Å; S199-I238 WeakPolarHBondContact CB-O 3.04Å; L200-I238 HydrophobicContact CB-CB 4.48Å; L200-I238 PolarHBondContact N-O 3.48Å; L200-I238 PolarHBondContact O-N 3.47Å; A205-I238 HydrophobicContact CB-CB 4Å; A205-I238 HydrophobicContact CB-CG1 3.58Å; W209-I238 HydrophobicContact CH2-CB 4.22Å; W209-I238 HydrophobicContact CH2-CD1 3.86Å; W209-I238 HydrophobicContact CH2-CG1 3.73Å; W209-I238 HydrophobicContact CH2-CG2 3.54Å; W209-I238 HydrophobicContact CZ2-CG2 4.1Å; W209-I238 HydrophobicContact CZ3-CD1 4.07Å; W209-I238 HydrophobicContact CZ3-CG1 3.77Å; W209-I238 HydrophobicContact CZ3-CG2 4.34Å; L228-I238 HydrophobicContact CD2-CD1 4.18Å; I235-I238 HydrophobicContact CD1-CD1 3.66Å; I238-T242 HydrophobicContact CG2-CG2 4.26Å; I238-W243 HydrophobicContact CG2-CB 4.16Å; I238-L269 HydrophobicContact CD1-CD2 3.81Å
239	S	97.1	Very high	96.8	Very high	38 Å²	38	52 Å²	52	27%	0.266	29%	0.288	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.3	160.8	176.1	83.7	0	0	0	0	111.5	D241 T242 W243	S239-D241 PolarHBondContact O-N 3.07Å; S239-D241 PolarHBondContact OG-N 3.36Å; S239-T242 PolarHBondContact O-N 3.28Å; S239-T242 PolarHBondContact OG-N 3.23Å; S239-T242 VanDerWaalsContact OG-N 3.14Å; S239-T242 PolarHBondContact OG-OG1 3.14Å; S239-W243 PolarHBondContact O-N 2.93Å
240	R	97.2	Very high	96.7	Very high	106 Å²	106	48.8 Å²	48.8	40%	0.4	27%	0.269	S	S	.	.	H	α-helix	trans	-58.4	-39.6	174.8	-175.5	-179.1	-61.8	-83.6	1.4	112.2	F187 W243 N244	F187-R240 HydrophobicContact CD1-CB 4.29Å; F187-R240 HydrophobicContact CD1-CG 4.14Å; F187-R240 HydrophobicContact CE1-CB 3.63Å; F187-R240 HydrophobicContact CE1-CG 3.94Å; F187-R240 HydrophobicContact CE2-CB 4.32Å; F187-R240 HydrophobicContact CZ-CB 3.65Å; F187-R240 HydrophobicContact CZ-CG 4.38Å; F187-R240 VanDerWaalsContact CZ-N 3.32Å; R240-W243 PolarHBondContact O-N 3.31Å; R240-N244 WeakPolarHBondContact O-CB 3.36Å; R240-N244 VanDerWaalsContact O-CG 3.23Å; R240-N244 PolarHBondContact O-N 2.79Å; R240-N244 PolarHBondContact O-ND2 3.41Å
241	D	97.6	Very high	96.5	Very high	94 Å²	94	48.7 Å²	48.7	50%	0.503	27%	0.268	S	S	.	.	H	α-helix	trans	-64.1	-52.1	-179.9	-179.7	69.9	0	0	0	110.9	S239 W243 N244 M245	S239-D241 PolarHBondContact O-N 3.07Å; S239-D241 PolarHBondContact OG-N 3.36Å; D241-W243 VanDerWaalsContact C-N 3.3Å; D241-W243 PolarHBondContact O-N 3.12Å; D241-N244 PolarHBondContact O-N 3.45Å; D241-N244 VanDerWaalsContact O-N 3.12Å; D241-M245 WeakPolarHBondContact O-CB 3.48Å; D241-M245 PolarHBondContact O-N 3.36Å
242	T	98.2	Very high	96.4	Very high	16 Å²	16	49.7 Å²	49.7	10%	0.098	28%	0.275	C	S	.	.	H	α-helix	trans	-55.2	-44.8	175.4	-48.8	0	0	0	0	111.9	I238 S239 F246 P267 L269 F270	I238-T242 HydrophobicContact CG2-CG2 4.26Å; S239-T242 PolarHBondContact O-N 3.28Å; S239-T242 PolarHBondContact OG-N 3.23Å; S239-T242 VanDerWaalsContact OG-N 3.14Å; S239-T242 PolarHBondContact OG-OG1 3.14Å; T242-F246 WeakPolarHBondContact O-CB 3.2Å; T242-F246 PolarHBondContact O-N 3.35Å; T242-P267 HydrophobicContact CG2-CB 4.46Å; T242-L269 HydrophobicContact CG2-CD2 3.98Å; T242-F270 HydrophobicContact CG2-CE1 3.78Å; T242-F270 HydrophobicContact CG2-CZ 4.27Å; T242-F270 WeakPolarHBondContact O-CZ 3.16Å
243	W	98.6	Very high	96.2	Very high	0 Å²	0	46.6 Å²	46.6	0%	0	26%	0.255	C	S	.	.	H	α-helix	trans	-59.5	-51.6	175.8	179.2	-85.4	0	0	0	111.8	Y183 T186 F187 L200 A205 L208 W209 V212 I238 S239 R240 D241 M245 F246	Y183-W243 AromaticContact CD1-CD1 3.95Å; Y183-W243 AromaticContact CD1-NE1 3.45Å; Y183-W243 HydrophobicContact CD2-CZ2 4.4Å; Y183-W243 AromaticContact CE1-CD1 3.34Å; Y183-W243 HydrophobicContact CE1-CD2 4.47Å; Y183-W243 AromaticContact CE1-CE2 3.89Å; Y183-W243 HydrophobicContact CE1-CG 4.17Å; Y183-W243 AromaticContact CE1-NE1 3.13Å; Y183-W243 WeakPolarHBondContact CE1-O 3.46Å; Y183-W243 HydrophobicContact CE2-CZ2 4.07Å; Y183-W243 AromaticContact CZ-CD1 3.86Å; Y183-W243 AromaticContact CZ-CE2 3.72Å; Y183-W243 AromaticContact CZ-NE1 3.47Å; Y183-W243 PolarHBondContact O-NE1 3.4Å; Y183-W243 PolarHBondContact OH-O 2.85Å; T186-W243 HydrophobicContact CG2-CH2 4.05Å; T186-W243 HydrophobicContact CG2-CZ2 3.84Å; F187-W243 HydrophobicContact CB-CD2 4.06Å; F187-W243 HydrophobicContact CB-CG 3.88Å; F187-W243 HydrophobicContact CD2-CB 3.46Å; F187-W243 VanDerWaalsContact CD2-CB 3.46Å; F187-W243 AromaticContact CD2-CD2 3.85Å; F187-W243 HydrophobicContact CD2-CD2 3.85Å; F187-W243 HydrophobicContact CD2-CE3 4.26Å; F187-W243 AromaticContact CD2-CG 3.49Å; F187-W243 HydrophobicContact CD2-CG 3.49Å; F187-W243 VanDerWaalsContact CD2-CG 3.49Å; F187-W243 HydrophobicContact CE2-CB 3.95Å; F187-W243 HydrophobicContact CE2-CG 4.43Å; F187-W243 HydrophobicContact CG-CB 4.31Å; F187-W243 HydrophobicContact CG-CD2 4.45Å; F187-W243 HydrophobicContact CG-CG 4.04Å; L200-W243 HydrophobicContact CD1-CE3 3.91Å; L200-W243 HydrophobicContact CD1-CZ3 4.06Å; A205-W243 HydrophobicContact CB-CZ3 4.5Å; L208-W243 HydrophobicContact CB-CH2 3.78Å; L208-W243 HydrophobicContact CB-CZ3 4.25Å; W209-W243 AromaticContact CD1-CH2 3.63Å; W209-W243 AromaticContact CD1-CZ3 3.59Å; W209-W243 AromaticContact CD2-CE3 3.91Å; W209-W243 HydrophobicContact CD2-CE3 3.91Å; W209-W243 HydrophobicContact CD2-CH2 4.31Å; W209-W243 AromaticContact CD2-CZ3 3.54Å; W209-W243 HydrophobicContact CD2-CZ3 3.54Å; W209-W243 AromaticContact CE2-CE3 3.37Å; W209-W243 AromaticContact CE2-CZ3 3.48Å; W209-W243 VanDerWaalsContact CE2-CZ3 3.48Å; W209-W243 HydrophobicContact CE3-CZ3 4.19Å; W209-W243 HydrophobicContact CG-CE3 4.36Å; W209-W243 AromaticContact CG-CH2 3.94Å; W209-W243 HydrophobicContact CG-CH2 3.94Å; W209-W243 AromaticContact CG-CZ3 3.65Å; W209-W243 HydrophobicContact CG-CZ3 3.65Å; W209-W243 HydrophobicContact CH2-CE3 4.23Å; W209-W243 HydrophobicContact CZ2-CD2 4.29Å; W209-W243 AromaticContact CZ2-CE3 3.59Å; W209-W243 HydrophobicContact CZ2-CE3 3.59Å; W209-W243 HydrophobicContact CZ2-CZ3 4.13Å; W209-W243 AromaticContact NE1-CD2 3.85Å; W209-W243 AromaticContact NE1-CE3 3.47Å; W209-W243 AromaticContact NE1-CH2 3.84Å; W209-W243 AromaticContact NE1-CZ3 3.47Å; V212-W243 HydrophobicContact CG1-CZ2 4.45Å; I238-W243 HydrophobicContact CG2-CB 4.16Å; S239-W243 PolarHBondContact O-N 2.93Å; R240-W243 PolarHBondContact O-N 3.31Å; D241-W243 VanDerWaalsContact C-N 3.3Å; D241-W243 PolarHBondContact O-N 3.12Å; W243-M245 PolarHBondContact O-N 2.98Å; W243-F246 PolarHBondContact O-N 3.14Å
244	N	97.7	Very high	95.7	Very high	48 Å²	48	44.9 Å²	44.9	26%	0.257	25%	0.246	S	C	.	.	H	α-helix	trans	-63.3	-42.9	-177.7	-73.4	-20.6	0	0	0	112.4	R240 D241 F246 L247	R240-N244 WeakPolarHBondContact O-CB 3.36Å; R240-N244 VanDerWaalsContact O-CG 3.23Å; R240-N244 PolarHBondContact O-N 2.79Å; R240-N244 PolarHBondContact O-ND2 3.41Å; D241-N244 PolarHBondContact O-N 3.45Å; D241-N244 VanDerWaalsContact O-N 3.12Å; N244-F246 VanDerWaalsContact C-N 3.3Å; N244-F246 PolarHBondContact O-N 3.48Å; N244-L247 PolarHBondContact O-N 3.48Å
245	M	97.9	Very high	95.2	Very high	52 Å²	52	46.9 Å²	46.9	26%	0.256	25%	0.251	S	S	.	.	H	α-helix	trans	-68.5	-27.7	179.1	-72	-60.6	96.2	0	0	112.9	D241 W243 L247 N248 F249 W266 P267 F270	D241-M245 WeakPolarHBondContact O-CB 3.48Å; D241-M245 PolarHBondContact O-N 3.36Å; W243-M245 PolarHBondContact O-N 2.98Å; M245-L247 PolarHBondContact O-N 2.86Å; M245-N248 WeakPolarHBondContact CE-ND2 3.47Å; M245-N248 WeakPolarHBondContact O-CB 3.39Å; M245-N248 PolarHBondContact O-N 3.12Å; M245-N248 VanDerWaalsContact O-N 3.08Å; M245-F249 WeakPolarHBondContact O-CB 3.41Å; M245-F249 PolarHBondContact O-N 3.29Å; M245-W266 HydrophobicContact CB-CE3 4.48Å; M245-W266 HydrophobicContact CB-CZ3 4.48Å; M245-W266 HydrophobicContact SD-CZ3 4.36Å; M245-P267 HydrophobicContact CB-CG 3.79Å; M245-P267 HydrophobicContact CG-CG 4.05Å; M245-F270 HydrophobicContact CB-CE2 3.83Å; M245-F270 HydrophobicContact CB-CZ 4.09Å
246	F	98.4	Very high	94.6	Very high	0 Å²	0	48.9 Å²	48.9	0%	0	26%	0.262	C	S	.	.	H	α-helix	trans	-61.7	-33.5	177.7	-175.2	-103.3	0	0	0	112.3	W209 F213 V220 L221 W224 T242 W243 N244 N248 F249 T250 F270	W209-F246 AromaticContact CD1-CD1 3.92Å; W209-F246 AromaticContact CE2-CD1 3.85Å; W209-F246 HydrophobicContact CZ2-CB 4.1Å; W209-F246 HydrophobicContact CZ2-CD1 4.27Å; W209-F246 HydrophobicContact CZ2-CG 4.17Å; W209-F246 AromaticContact NE1-CD1 3.39Å; F213-F246 HydrophobicContact CE2-CD1 4.21Å; F213-F246 AromaticContact CE2-CE1 3.91Å; F213-F246 HydrophobicContact CE2-CE1 3.91Å; F213-F246 HydrophobicContact CZ-CE1 4.5Å; V220-F246 HydrophobicContact CG1-CZ 4.42Å; L221-F246 HydrophobicContact CD1-CE1 3.95Å; L221-F246 HydrophobicContact CD1-CZ 4.16Å; W224-F246 HydrophobicContact CB-CE2 3.89Å; W224-F246 HydrophobicContact CB-CZ 3.82Å; W224-F246 AromaticContact CD1-CE1 3.85Å; W224-F246 AromaticContact CD1-CE2 3.5Å; W224-F246 VanDerWaalsContact CD1-CE2 3.5Å; W224-F246 AromaticContact CD1-CZ 3.23Å; W224-F246 AromaticContact CD2-CD2 3.99Å; W224-F246 HydrophobicContact CD2-CD2 3.99Å; W224-F246 AromaticContact CD2-CE2 3.42Å; W224-F246 HydrophobicContact CD2-CE2 3.42Å; W224-F246 VanDerWaalsContact CD2-CE2 3.42Å; W224-F246 HydrophobicContact CD2-CZ 4Å; W224-F246 AromaticContact CE2-CD2 3.79Å; W224-F246 AromaticContact CE2-CE2 3.63Å; W224-F246 HydrophobicContact CE3-CD2 4.49Å; W224-F246 HydrophobicContact CE3-CE2 4.05Å; W224-F246 HydrophobicContact CG-CD2 4.27Å; W224-F246 HydrophobicContact CG-CE1 4.41Å; W224-F246 AromaticContact CG-CE2 3.32Å; W224-F246 HydrophobicContact CG-CE2 3.32Å; W224-F246 AromaticContact CG-CZ 3.4Å; W224-F246 HydrophobicContact CG-CZ 3.4Å; W224-F246 VanDerWaalsContact CG-CZ 3.4Å; W224-F246 HydrophobicContact CZ2-CD2 4.15Å; W224-F246 HydrophobicContact CZ2-CE2 4.4Å; W224-F246 AromaticContact NE1-CD2 3.97Å; W224-F246 AromaticContact NE1-CE2 3.65Å; W224-F246 AromaticContact NE1-CZ 3.69Å; T242-F246 WeakPolarHBondContact O-CB 3.2Å; T242-F246 PolarHBondContact O-N 3.35Å; W243-F246 PolarHBondContact O-N 3.14Å; N244-F246 VanDerWaalsContact C-N 3.3Å; N244-F246 PolarHBondContact O-N 3.48Å; F246-N248 PolarHBondContact O-N 3.35Å; F246-F249 HydrophobicContact CD2-CD1 4.19Å; F246-F249 HydrophobicContact CE2-CD1 4.13Å; F246-F249 WeakPolarHBondContact O-CB 3.37Å; F246-F249 PolarHBondContact O-N 3Å; F246-T250 HydrophobicContact CD1-CG2 3.86Å; F246-T250 HydrophobicContact CE1-CG2 3.5Å; F246-T250 HydrophobicContact CE2-CG2 4.3Å; F246-T250 HydrophobicContact CG-CG2 4.41Å; F246-T250 HydrophobicContact CZ-CG2 3.74Å; F246-T250 WeakPolarHBondContact O-CG2 3.4Å; F246-T250 PolarHBondContact O-N 2.99Å; F246-F270 HydrophobicContact CB-CE1 4.33Å; F246-F270 HydrophobicContact CB-CZ 3.86Å; F246-F270 HydrophobicContact CD2-CE1 4.17Å; F246-F270 HydrophobicContact CD2-CZ 4.29Å
247	L	97.8	Very high	94.5	Very high	8 Å²	8	40.3 Å²	40.3	4%	0.042	23%	0.225	C	C	.	.	H	α-helix	trans	-62	-43.9	174.5	-179.7	58.9	0	0	0	111.6	F179 K180 Y183 F213 N244 M245 T250 Q251	F179-L247 HydrophobicContact CD1-CD1 4.39Å; F179-L247 HydrophobicContact CE1-CD1 3.75Å; K180-L247 HydrophobicContact CG-CD2 3.96Å; Y183-L247 HydrophobicContact CD1-CB 4.01Å; Y183-L247 HydrophobicContact CD1-CD2 3.87Å; Y183-L247 HydrophobicContact CD1-CG 4.49Å; Y183-L247 HydrophobicContact CE1-CB 3.64Å; Y183-L247 HydrophobicContact CE1-CD2 4.38Å; Y183-L247 HydrophobicContact CE2-CB 4.37Å; Y183-L247 HydrophobicContact CG-CD2 4.02Å; F213-L247 HydrophobicContact CE1-CD1 4.17Å; F213-L247 HydrophobicContact CZ-CD1 4.11Å; N244-L247 PolarHBondContact O-N 3.48Å; M245-L247 PolarHBondContact O-N 2.86Å; L247-T250 PolarHBondContact O-N 3.31Å; L247-T250 PolarHBondContact O-OG1 3.45Å; L247-Q251 WeakPolarHBondContact O-CG 3.39Å
248	N	96.4	Very high	94.2	Very high	60 Å²	60	43 Å²	43	32%	0.321	24%	0.24	S	C	.	.	H	α-helix	trans	-65.3	-43.3	176.1	-62.2	-14.1	0	0	0	110.7	M245 F246 T250 Q251 V252 W266	M245-N248 WeakPolarHBondContact CE-ND2 3.47Å; M245-N248 WeakPolarHBondContact O-CB 3.39Å; M245-N248 PolarHBondContact O-N 3.12Å; M245-N248 VanDerWaalsContact O-N 3.08Å; F246-N248 PolarHBondContact O-N 3.35Å; N248-T250 VanDerWaalsContact C-N 3.28Å; N248-T250 PolarHBondContact O-N 3.06Å; N248-Q251 WeakPolarHBondContact O-CB 3.06Å; N248-Q251 PolarHBondContact O-N 3.07Å; N248-V252 WeakPolarHBondContact O-CG2 3.39Å; N248-V252 PolarHBondContact O-N 3.41Å; N248-V252 VanDerWaalsContact O-N 3.1Å; N248-W266 HydrophobicContact CB-CH2 4.1Å; N248-W266 HydrophobicContact CB-CZ3 4.12Å
249	F	97.2	Very high	94	Very high	0 Å²	0	47.3 Å²	47.3	0%	0	26%	0.263	C	S	.	.	H	α-helix	trans	-55	-44.1	177	-173.4	-100.3	0	0	0	111.6	V220 M245 F246 Q251 V252 I253 L257 Y260 W266 F270 F273 V274	V220-F249 HydrophobicContact CG2-CE1 4.06Å; M245-F249 WeakPolarHBondContact O-CB 3.41Å; M245-F249 PolarHBondContact O-N 3.29Å; F246-F249 HydrophobicContact CD2-CD1 4.19Å; F246-F249 HydrophobicContact CE2-CD1 4.13Å; F246-F249 WeakPolarHBondContact O-CB 3.37Å; F246-F249 PolarHBondContact O-N 3Å; F249-Q251 PolarHBondContact O-N 2.63Å; F249-Q251 VanDerWaalsContact O-N 3.12Å; F249-V252 PolarHBondContact O-N 2.88Å; F249-I253 HydrophobicContact CD1-CB 4.4Å; F249-I253 HydrophobicContact CD1-CG2 4.23Å; F249-I253 HydrophobicContact CD2-CB 4.46Å; F249-I253 HydrophobicContact CD2-CD1 3.89Å; F249-I253 HydrophobicContact CD2-CG1 4.34Å; F249-I253 HydrophobicContact CE1-CB 4.2Å; F249-I253 HydrophobicContact CE1-CG1 4.04Å; F249-I253 HydrophobicContact CE1-CG2 3.99Å; F249-I253 HydrophobicContact CE2-CB 4.27Å; F249-I253 HydrophobicContact CE2-CD1 3.29Å; F249-I253 HydrophobicContact CE2-CG1 3.7Å; F249-I253 HydrophobicContact CZ-CB 4.14Å; F249-I253 HydrophobicContact CZ-CD1 3.67Å; F249-I253 HydrophobicContact CZ-CG1 3.53Å; F249-I253 HydrophobicContact CZ-CG2 4.36Å; F249-I253 WeakPolarHBondContact O-CB 3.49Å; F249-I253 WeakPolarHBondContact O-CG2 3.47Å; F249-I253 PolarHBondContact O-N 3.5Å; F249-L257 HydrophobicContact CZ-CD2 4.45Å; F249-Y260 HydrophobicContact CE2-CD2 4.07Å; F249-Y260 HydrophobicContact CE2-CE2 4.47Å; F249-W266 HydrophobicContact CB-CZ3 4.4Å; F249-W266 HydrophobicContact CD2-CD2 4.31Å; F249-F270 HydrophobicContact CB-CD2 4.24Å; F249-F270 HydrophobicContact CB-CE2 3.94Å; F249-F270 HydrophobicContact CD2-CB 4.45Å; F249-F270 AromaticContact CD2-CD2 3.67Å; F249-F270 HydrophobicContact CD2-CD2 3.67Å; F249-F270 HydrophobicContact CD2-CE2 4.24Å; F249-F270 HydrophobicContact CD2-CG 4.26Å; F249-F270 HydrophobicContact CE2-CB 4.08Å; F249-F270 HydrophobicContact CE2-CD2 4.16Å; F249-F270 HydrophobicContact CE2-CG 4.34Å; F249-F270 HydrophobicContact CG-CD2 4.01Å; F249-F270 HydrophobicContact CG-CE2 4.19Å; F249-F270 HydrophobicContact CZ-CB 4.47Å; F249-F273 HydrophobicContact CE1-CD1 4.05Å; F249-F273 AromaticContact CE1-CE1 3.84Å; F249-F273 HydrophobicContact CE1-CE1 3.84Å; F249-F273 HydrophobicContact CZ-CD1 4.05Å; F249-F273 HydrophobicContact CZ-CE1 4.1Å; F249-V274 HydrophobicContact CZ-CG2 4.18Å
250	T	96	Very high	93.9	Very high	19 Å²	19	47.6 Å²	47.6	12%	0.117	26%	0.259	C	S	.	.	H	α-helix	trans	-62.1	-22	178	70.5	0	0	0	0	114.2	F213 P218 V220 F246 L247 N248	F213-T250 HydrophobicContact CZ-CG2 4.19Å; P218-T250 HydrophobicContact CB-CG2 4.18Å; P218-T250 HydrophobicContact CG-CG2 3.74Å; V220-T250 HydrophobicContact CG1-CG2 4.01Å; F246-T250 HydrophobicContact CD1-CG2 3.86Å; F246-T250 HydrophobicContact CE1-CG2 3.5Å; F246-T250 HydrophobicContact CE2-CG2 4.3Å; F246-T250 HydrophobicContact CG-CG2 4.41Å; F246-T250 HydrophobicContact CZ-CG2 3.74Å; F246-T250 WeakPolarHBondContact O-CG2 3.4Å; F246-T250 PolarHBondContact O-N 2.99Å; L247-T250 PolarHBondContact O-N 3.31Å; L247-T250 PolarHBondContact O-OG1 3.45Å; N248-T250 VanDerWaalsContact C-N 3.28Å; N248-T250 PolarHBondContact O-N 3.06Å
251	Q	93.3	Very high	93.7	Very high	115 Å²	115	44.4 Å²	44.4	54%	0.537	25%	0.253	S	S	.	.	H	α-helix	trans	-90.8	-30.8	179.2	-63	174.1	-5.8	0	0	112.3	L247 N248 F249	L247-Q251 WeakPolarHBondContact O-CG 3.39Å; N248-Q251 WeakPolarHBondContact O-CB 3.06Å; N248-Q251 PolarHBondContact O-N 3.07Å; F249-Q251 PolarHBondContact O-N 2.63Å; F249-Q251 VanDerWaalsContact O-N 3.12Å
252	V	94.3	Very high	93.4	Very high	58 Å²	58	47.1 Å²	47.1	35%	0.352	26%	0.263	S	S	.	.	H	α-helix	trans	-88.3	-43.3	-174.7	174.7	0	0	0	0	112.1	N248 F249 G254 N259 W266	N248-V252 WeakPolarHBondContact O-CG2 3.39Å; N248-V252 PolarHBondContact O-N 3.41Å; N248-V252 VanDerWaalsContact O-N 3.1Å; F249-V252 PolarHBondContact O-N 2.88Å; V252-G254 PolarHBondContact O-N 3.28Å; V252-N259 VanDerWaalsContact O-CB 3.24Å; V252-N259 WeakPolarHBondContact O-CB 3.32Å; V252-N259 PolarHBondContact O-ND2 3.35Å; V252-W266 HydrophobicContact CB-CZ2 4.47Å; V252-W266 HydrophobicContact CG1-CZ2 4.41Å; V252-W266 HydrophobicContact CG2-CH2 4.46Å; V252-W266 HydrophobicContact CG2-CZ2 4.47Å
253	I	91.4	Very high	93.1	Very high	1 Å²	1	53.4 Å²	53.4	1%	0.005	30%	0.296	C	S	.	.	S	Bend	trans	-74.8	-20.3	-156.2	-146.7	71.7	0	0	0	115.6	V220 F249 L257 Y260	V220-I253 HydrophobicContact CB-CG2 4.1Å; V220-I253 HydrophobicContact CG1-CG2 4.19Å; V220-I253 HydrophobicContact CG2-CG2 4.14Å; F249-I253 HydrophobicContact CD1-CB 4.4Å; F249-I253 HydrophobicContact CD1-CG2 4.23Å; F249-I253 HydrophobicContact CD2-CB 4.46Å; F249-I253 HydrophobicContact CD2-CD1 3.89Å; F249-I253 HydrophobicContact CD2-CG1 4.34Å; F249-I253 HydrophobicContact CE1-CB 4.2Å; F249-I253 HydrophobicContact CE1-CG1 4.04Å; F249-I253 HydrophobicContact CE1-CG2 3.99Å; F249-I253 HydrophobicContact CE2-CB 4.27Å; F249-I253 HydrophobicContact CE2-CD1 3.29Å; F249-I253 HydrophobicContact CE2-CG1 3.7Å; F249-I253 HydrophobicContact CZ-CB 4.14Å; F249-I253 HydrophobicContact CZ-CD1 3.67Å; F249-I253 HydrophobicContact CZ-CG1 3.53Å; F249-I253 HydrophobicContact CZ-CG2 4.36Å; F249-I253 WeakPolarHBondContact O-CB 3.49Å; F249-I253 WeakPolarHBondContact O-CG2 3.47Å; F249-I253 PolarHBondContact O-N 3.5Å; I253-L257 HydrophobicContact CB-CD2 4.39Å; I253-L257 HydrophobicContact CG1-CB 4.43Å; I253-L257 HydrophobicContact CG1-CD2 3.56Å; I253-L257 HydrophobicContact CG2-CD2 3.94Å; I253-L257 WeakPolarHBondContact O-CA 3.44Å; I253-Y260 VanDerWaalsContact CD1-CA 3.45Å; I253-Y260 VanDerWaalsContact CD1-CB 3.4Å; I253-Y260 HydrophobicContact CD1-CD2 3.7Å; I253-Y260 HydrophobicContact CD1-CG 3.99Å
254	G	82.5	Confident	92.9	Very high	22 Å²	22	57.5 Å²	57.5	23%	0.227	31%	0.314	C	S	.	.			trans	68.9	177.2	-174.8	0	0	0	0	0	113.7	V252	V252-G254 PolarHBondContact O-N 3.28Å
255	P	84.7	Confident	92.8	Very high	92 Å²	92	60.3 Å²	60.3	60%	0.597	35%	0.345	S	S	*	.	S	Bend	trans	-74	-25.4	-176.2	29.7	-35.2	0	0	0	114.1	P219 R281	P219-P255 HydrophobicContact CB-CB 3.85Å; P219-P255 HydrophobicContact CG-CB 4.42Å; P255-R281 PolarHBondContact O-NH2 3.07Å
256	D	85	Confident	92.7	Very high	79 Å²	79	59.7 Å²	59.7	42%	0.422	34%	0.339	S	S	.	.	S	Bend	trans	-105.4	1.1	-173.5	61.3	-5.8	0	0	0	113.4	S258 R281	D256-S258 PolarHBondContact O-N 2.87Å; D256-S258 WeakPolarHBondContact OD1-CB 3.44Å; D256-S258 PolarHBondContact OD1-N 3.42Å; D256-S258 PolarHBondContact OD1-OG 2.93Å; D256-S258 VanDerWaalsContact OD1-OG 3.1Å; D256-R281 PolarHBondContact O-NH1 2.8Å
257	L	89.7	Confident	92.6	Very high	12 Å²	12	60.4 Å²	60.4	6%	0.063	34%	0.344	C	S	.	.	S	Bend	trans	65.1	13.2	-173.6	-50.9	173.4	0	0	0	114.2	V220 F249 I253 N259 Y260 F273 V274 E277	V220-L257 HydrophobicContact CG2-CD2 3.87Å; F249-L257 HydrophobicContact CZ-CD2 4.45Å; I253-L257 HydrophobicContact CB-CD2 4.39Å; I253-L257 HydrophobicContact CG1-CB 4.43Å; I253-L257 HydrophobicContact CG1-CD2 3.56Å; I253-L257 HydrophobicContact CG2-CD2 3.94Å; I253-L257 WeakPolarHBondContact O-CA 3.44Å; L257-N259 PolarHBondContact O-N 3.29Å; L257-Y260 VanDerWaalsContact O-CB 3.25Å; L257-Y260 WeakPolarHBondContact O-CB 3.43Å; L257-Y260 PolarHBondContact O-N 3.46Å; L257-Y260 VanDerWaalsContact O-N 3.08Å; L257-F273 HydrophobicContact CD1-CE1 4.42Å; L257-F273 HydrophobicContact CD2-CE1 4.04Å; L257-V274 HydrophobicContact CD1-CG1 4.29Å; L257-V274 HydrophobicContact CD1-CG2 4.26Å; L257-E277 HydrophobicContact CD1-CB 3.9Å; L257-E277 HydrophobicContact CD1-CG 3.54Å
258	S	90	Very high	92.6	Very high	82 Å²	82	64.2 Å²	64.2	57%	0.573	37%	0.372	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.2	-21.8	-176.2	72.5	0	0	0	0	113.7	D256 Y260	D256-S258 PolarHBondContact O-N 2.87Å; D256-S258 WeakPolarHBondContact OD1-CB 3.44Å; D256-S258 PolarHBondContact OD1-N 3.42Å; D256-S258 PolarHBondContact OD1-OG 2.93Å; D256-S258 VanDerWaalsContact OD1-OG 3.1Å; S258-Y260 VanDerWaalsContact C-N 3.28Å
259	N	93.1	Very high	92.6	Very high	92 Å²	92	62.3 Å²	62.3	49%	0.492	36%	0.361	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.3	1.2	178.8	-65.3	-17.4	0	0	0	112.7	V252 L257	V252-N259 VanDerWaalsContact O-CB 3.24Å; V252-N259 WeakPolarHBondContact O-CB 3.32Å; V252-N259 PolarHBondContact O-ND2 3.35Å; L257-N259 PolarHBondContact O-N 3.29Å
260	Y	94.5	Very high	92.7	Very high	43 Å²	43	62.3 Å²	62.3	17%	0.169	36%	0.361	C	S	.	.			trans	-72	136.4	175.9	-178.7	-109.9	0	0	0	110.9	F249 I253 L257 S258 E262 W266 D271 V274	F249-Y260 HydrophobicContact CE2-CD2 4.07Å; F249-Y260 HydrophobicContact CE2-CE2 4.47Å; I253-Y260 VanDerWaalsContact CD1-CA 3.45Å; I253-Y260 VanDerWaalsContact CD1-CB 3.4Å; I253-Y260 HydrophobicContact CD1-CD2 3.7Å; I253-Y260 HydrophobicContact CD1-CG 3.99Å; L257-Y260 VanDerWaalsContact O-CB 3.25Å; L257-Y260 WeakPolarHBondContact O-CB 3.43Å; L257-Y260 PolarHBondContact O-N 3.46Å; L257-Y260 VanDerWaalsContact O-N 3.08Å; S258-Y260 VanDerWaalsContact C-N 3.28Å; Y260-E262 HydrophobicContact CE1-CB 4.24Å; Y260-W266 AromaticContact CE2-CD1 3.91Å; Y260-D271 VanDerWaalsContact OH-CA 3.23Å; Y260-D271 WeakPolarHBondContact OH-CA 3.47Å; Y260-D271 VanDerWaalsContact OH-CB 3.27Å; Y260-D271 WeakPolarHBondContact OH-CB 3.2Å; Y260-D271 PolarHBondContact OH-OD1 2.94Å; Y260-V274 HydrophobicContact CD1-CB 4.09Å; Y260-V274 HydrophobicContact CD1-CG1 3.62Å; Y260-V274 HydrophobicContact CD1-CG2 3.95Å; Y260-V274 HydrophobicContact CD2-CG2 3.87Å; Y260-V274 HydrophobicContact CE1-CB 4.09Å; Y260-V274 HydrophobicContact CE1-CG1 3.96Å; Y260-V274 HydrophobicContact CE1-CG2 4.14Å; Y260-V274 HydrophobicContact CE2-CG2 4.05Å; Y260-V274 HydrophobicContact CG-CB 4.43Å; Y260-V274 HydrophobicContact CG-CG1 4.15Å; Y260-V274 HydrophobicContact CG-CG2 3.78Å
261	S	92.9	Very high	92.7	Very high	40 Å²	40	63.5 Å²	63.5	28%	0.28	37%	0.367	S	S	.	.			trans	-130.7	129.1	167.5	-179.6	0	0	0	0	109.4	D263 E264	S261-D263 PolarHBondContact O-N 3.41Å; S261-D263 PolarHBondContact OG-N 3.45Å; S261-E264 PolarHBondContact O-N 3.28Å
262	E	91.3	Very high	92.8	Very high	151 Å²	151	60.3 Å²	60.3	71%	0.706	36%	0.355	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.3	-16	173.3	64	-177.7	-158.8	0	0	112.9	Y260 E264	Y260-E262 HydrophobicContact CE1-CB 4.24Å; E262-E264 VanDerWaalsContact C-N 3.3Å
263	D	92.8	Very high	93	Very high	148 Å²	148	57.5 Å²	57.5	79%	0.791	34%	0.338	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.1	-13.4	175.8	-65.3	-44	0	0	0	112.8	S261	S261-D263 PolarHBondContact O-N 3.41Å; S261-D263 PolarHBondContact OG-N 3.45Å
264	E	94.2	Very high	93.2	Very high	85 Å²	85	58.1 Å²	58.1	40%	0.397	34%	0.342	S	S	.	.	S	Bend	trans	-78.6	148.9	175.7	-72.1	-179	177	0	0	111.1	S261 E262 W266	S261-E264 PolarHBondContact O-N 3.28Å; E262-E264 VanDerWaalsContact C-N 3.3Å; E264-W266 HydrophobicContact CB-CG 4.45Å; E264-W266 PolarHBondContact O-N 3.07Å; E264-W266 WeakPolarHBondContact OE2-CZ2 3.23Å; E264-W266 PolarHBondContact OE2-NE1 3.5Å
265	A	95.6	Very high	93.9	Very high	108 Å²	108	63.5 Å²	63.5	89%	0.893	36%	0.361	S	S	*	.			trans	-78.4	51.3	-175.5	0	0	0	0	0	113.1
266	W	96.5	Very high	94.5	Very high	38 Å²	38	60.3 Å²	60.3	14%	0.144	34%	0.337	C	S	.	.			trans	-74.8	152.9	174.7	-66.7	117.6	0	0	0	111.5	M245 N248 F249 V252 Y260 E264 S268 F270	M245-W266 HydrophobicContact CB-CE3 4.48Å; M245-W266 HydrophobicContact CB-CZ3 4.48Å; M245-W266 HydrophobicContact SD-CZ3 4.36Å; N248-W266 HydrophobicContact CB-CH2 4.1Å; N248-W266 HydrophobicContact CB-CZ3 4.12Å; F249-W266 HydrophobicContact CB-CZ3 4.4Å; F249-W266 HydrophobicContact CD2-CD2 4.31Å; V252-W266 HydrophobicContact CB-CZ2 4.47Å; V252-W266 HydrophobicContact CG1-CZ2 4.41Å; V252-W266 HydrophobicContact CG2-CH2 4.46Å; V252-W266 HydrophobicContact CG2-CZ2 4.47Å; Y260-W266 AromaticContact CE2-CD1 3.91Å; E264-W266 HydrophobicContact CB-CG 4.45Å; E264-W266 PolarHBondContact O-N 3.07Å; E264-W266 WeakPolarHBondContact OE2-CZ2 3.23Å; E264-W266 PolarHBondContact OE2-NE1 3.5Å; W266-S268 PolarHBondContact O-N 3Å; W266-F270 HydrophobicContact CB-CB 4.3Å; W266-F270 HydrophobicContact CB-CD2 3.93Å; W266-F270 HydrophobicContact CD2-CD2 4.22Å; W266-F270 AromaticContact CE3-CD2 3.95Å; W266-F270 HydrophobicContact CE3-CD2 3.95Å; W266-F270 AromaticContact CE3-CE2 3.97Å; W266-F270 HydrophobicContact CE3-CE2 3.97Å; W266-F270 HydrophobicContact CG-CD2 4.23Å
267	P	96.8	Very high	95	Very high	16 Å²	16	56.6 Å²	56.6	10%	0.104	32%	0.317	C	S	.	.			trans	-55.6	131.1	164.5	-22.8	31.5	0	0	0	110.4	T242 M245 L269 F270	T242-P267 HydrophobicContact CG2-CB 4.46Å; M245-P267 HydrophobicContact CB-CG 3.79Å; M245-P267 HydrophobicContact CG-CG 4.05Å; P267-L269 PolarHBondContact O-N 3.06Å; P267-F270 HydrophobicContact CB-CZ 4.47Å; P267-F270 HydrophobicContact CG-CD2 4.26Å; P267-F270 HydrophobicContact CG-CE2 3.86Å; P267-F270 HydrophobicContact CG-CZ 3.99Å; P267-F270 WeakPolarHBondContact O-CB 3.34Å; P267-F270 PolarHBondContact O-N 3.46Å
268	S	96.3	Very high	95.1	Very high	88 Å²	88	61 Å²	61	62%	0.615	34%	0.339	S	S	*	.	H	α-helix	trans	-57.6	-17.2	-175.2	56.2	0	0	0	0	115.9	W266 F270 D271 T272	W266-S268 PolarHBondContact O-N 3Å; S268-F270 PolarHBondContact O-N 3.22Å; S268-D271 WeakPolarHBondContact CA-OD2 3.37Å; S268-D271 PolarHBondContact O-N 3.38Å; S268-T272 PolarHBondContact O-N 3.4Å; S268-T272 VanDerWaalsContact O-N 3.17Å; S268-T272 PolarHBondContact O-OG1 3.42Å; S268-T272 VanDerWaalsContact O-OG1 3.06Å
269	L	97.6	Very high	95.4	Very high	19 Å²	19	61.3 Å²	61.3	10%	0.099	33%	0.332	C	S	.	.	H	α-helix	trans	-63.9	-28.7	171.3	-173.5	61.7	0	0	0	112.1	W224 F227 L228 I235 I238 T242 P267 F273	W224-L269 HydrophobicContact CH2-CD2 3.7Å; W224-L269 HydrophobicContact CH2-CG 3.9Å; W224-L269 HydrophobicContact CZ2-CD2 4.42Å; W224-L269 HydrophobicContact CZ3-CG 4.36Å; F227-L269 HydrophobicContact CE1-CD1 3.75Å; F227-L269 HydrophobicContact CE1-CG 4.11Å; F227-L269 HydrophobicContact CZ-CD1 3.76Å; L228-L269 HydrophobicContact CD2-CD2 4.33Å; I235-L269 HydrophobicContact CD1-CD1 4.17Å; I235-L269 HydrophobicContact CD1-CD2 3.75Å; I235-L269 HydrophobicContact CG2-CD1 4.04Å; I238-L269 HydrophobicContact CD1-CD2 3.81Å; T242-L269 HydrophobicContact CG2-CD2 3.98Å; P267-L269 PolarHBondContact O-N 3.06Å; L269-F273 WeakPolarHBondContact O-CB 3.5Å; L269-F273 PolarHBondContact O-N 3.35Å
270	F	97.6	Very high	95.4	Very high	0 Å²	0	59.1 Å²	59.1	0%	0	32%	0.316	C	S	.	.	H	α-helix	trans	-71.7	-40.3	177.4	-61.6	-6.7	0	0	0	110.4	W224 T242 M245 F246 F249 W266 P267 S268 T272 F273 V274	W224-F270 AromaticContact CH2-CD1 3.86Å; W224-F270 HydrophobicContact CH2-CD1 3.86Å; W224-F270 AromaticContact CH2-CE1 3.8Å; W224-F270 HydrophobicContact CH2-CE1 3.8Å; W224-F270 HydrophobicContact CZ2-CE1 4.34Å; W224-F270 AromaticContact CZ3-CD1 3.96Å; W224-F270 HydrophobicContact CZ3-CD1 3.96Å; W224-F270 HydrophobicContact CZ3-CE1 4.29Å; T242-F270 HydrophobicContact CG2-CE1 3.78Å; T242-F270 HydrophobicContact CG2-CZ 4.27Å; T242-F270 WeakPolarHBondContact O-CZ 3.16Å; M245-F270 HydrophobicContact CB-CE2 3.83Å; M245-F270 HydrophobicContact CB-CZ 4.09Å; F246-F270 HydrophobicContact CB-CE1 4.33Å; F246-F270 HydrophobicContact CB-CZ 3.86Å; F246-F270 HydrophobicContact CD2-CE1 4.17Å; F246-F270 HydrophobicContact CD2-CZ 4.29Å; F249-F270 HydrophobicContact CB-CD2 4.24Å; F249-F270 HydrophobicContact CB-CE2 3.94Å; F249-F270 HydrophobicContact CD2-CB 4.45Å; F249-F270 AromaticContact CD2-CD2 3.67Å; F249-F270 HydrophobicContact CD2-CD2 3.67Å; F249-F270 HydrophobicContact CD2-CE2 4.24Å; F249-F270 HydrophobicContact CD2-CG 4.26Å; F249-F270 HydrophobicContact CE2-CB 4.08Å; F249-F270 HydrophobicContact CE2-CD2 4.16Å; F249-F270 HydrophobicContact CE2-CG 4.34Å; F249-F270 HydrophobicContact CG-CD2 4.01Å; F249-F270 HydrophobicContact CG-CE2 4.19Å; F249-F270 HydrophobicContact CZ-CB 4.47Å; W266-F270 HydrophobicContact CB-CB 4.3Å; W266-F270 HydrophobicContact CB-CD2 3.93Å; W266-F270 HydrophobicContact CD2-CD2 4.22Å; W266-F270 AromaticContact CE3-CD2 3.95Å; W266-F270 HydrophobicContact CE3-CD2 3.95Å; W266-F270 AromaticContact CE3-CE2 3.97Å; W266-F270 HydrophobicContact CE3-CE2 3.97Å; W266-F270 HydrophobicContact CG-CD2 4.23Å; P267-F270 HydrophobicContact CB-CZ 4.47Å; P267-F270 HydrophobicContact CG-CD2 4.26Å; P267-F270 HydrophobicContact CG-CE2 3.86Å; P267-F270 HydrophobicContact CG-CZ 3.99Å; P267-F270 WeakPolarHBondContact O-CB 3.34Å; P267-F270 PolarHBondContact O-N 3.46Å; S268-F270 PolarHBondContact O-N 3.22Å; F270-T272 VanDerWaalsContact C-N 3.32Å; F270-T272 PolarHBondContact O-N 3.41Å; F270-F273 WeakPolarHBondContact O-CB 3.48Å; F270-F273 PolarHBondContact O-N 3.21Å; F270-F273 VanDerWaalsContact O-N 3.1Å; F270-V274 WeakPolarHBondContact O-CG2 3.18Å; F270-V274 PolarHBondContact O-N 3.04Å
271	D	96.4	Very high	95.4	Very high	45 Å²	45	60.8 Å²	60.8	24%	0.241	32%	0.322	C	S	.	.	H	α-helix	trans	-58	-48.8	173.5	-37.6	-9.5	0	0	0	110	Y260 S268 F273 V274 E275	Y260-D271 VanDerWaalsContact OH-CA 3.23Å; Y260-D271 WeakPolarHBondContact OH-CA 3.47Å; Y260-D271 VanDerWaalsContact OH-CB 3.27Å; Y260-D271 WeakPolarHBondContact OH-CB 3.2Å; Y260-D271 PolarHBondContact OH-OD1 2.94Å; S268-D271 WeakPolarHBondContact CA-OD2 3.37Å; S268-D271 PolarHBondContact O-N 3.38Å; D271-F273 VanDerWaalsContact C-N 3.27Å; D271-F273 PolarHBondContact O-N 3.31Å; D271-V274 PolarHBondContact O-N 2.98Å; D271-E275 WeakPolarHBondContact O-CG 3.46Å; D271-E275 PolarHBondContact O-N 2.76Å
272	T	96.8	Very high	95.4	Very high	47 Å²	47	64.5 Å²	64.5	29%	0.288	33%	0.333	S	S	.	.	H	α-helix	trans	-59.6	-38.4	176.4	-50.4	0	0	0	0	111.9	F227 S268 F270 W276	F227-T272 HydrophobicContact CE2-CG2 4Å; F227-T272 HydrophobicContact CZ-CG2 3.95Å; S268-T272 PolarHBondContact O-N 3.4Å; S268-T272 VanDerWaalsContact O-N 3.17Å; S268-T272 PolarHBondContact O-OG1 3.42Å; S268-T272 VanDerWaalsContact O-OG1 3.06Å; F270-T272 VanDerWaalsContact C-N 3.32Å; F270-T272 PolarHBondContact O-N 3.41Å; T272-W276 WeakPolarHBondContact O-CB 3.33Å; T272-W276 PolarHBondContact O-N 3.4Å
273	F	97.5	Very high	95.4	Very high	0 Å²	0	63 Å²	63	0%	0	32%	0.321	C	S	.	.	H	α-helix	trans	-66.3	-45.4	176.6	160.4	-111.2	0	0	0	111.9	V220 Q223 W224 F227 F249 L257 L269 F270 D271 W276 E277	V220-F273 HydrophobicContact CG2-CE1 3.56Å; V220-F273 HydrophobicContact CG2-CZ 3.58Å; Q223-F273 HydrophobicContact CB-CE2 4.01Å; Q223-F273 HydrophobicContact CB-CZ 4.06Å; W224-F273 HydrophobicContact CB-CE2 4.3Å; W224-F273 HydrophobicContact CB-CZ 4.32Å; W224-F273 HydrophobicContact CE3-CB 3.96Å; W224-F273 HydrophobicContact CE3-CD1 4.02Å; W224-F273 AromaticContact CE3-CD2 3.91Å; W224-F273 HydrophobicContact CE3-CD2 3.91Å; W224-F273 HydrophobicContact CE3-CE2 4.46Å; W224-F273 AromaticContact CE3-CG 3.66Å; W224-F273 HydrophobicContact CE3-CG 3.66Å; W224-F273 HydrophobicContact CZ3-CB 3.77Å; W224-F273 HydrophobicContact CZ3-CD1 4.45Å; W224-F273 AromaticContact CZ3-CG 4Å; W224-F273 HydrophobicContact CZ3-CG 4Å; F227-F273 HydrophobicContact CB-CD2 3.63Å; F227-F273 HydrophobicContact CB-CE2 4.16Å; F227-F273 HydrophobicContact CD1-CB 3.84Å; F227-F273 AromaticContact CD1-CD2 3.9Å; F227-F273 HydrophobicContact CD1-CD2 3.9Å; F227-F273 HydrophobicContact CD1-CG 4.27Å; F227-F273 HydrophobicContact CD2-CB 4.41Å; F227-F273 HydrophobicContact CD2-CD2 4.34Å; F227-F273 HydrophobicContact CE1-CB 3.78Å; F227-F273 HydrophobicContact CE2-CB 4.33Å; F227-F273 HydrophobicContact CG-CB 4.16Å; F227-F273 AromaticContact CG-CD2 3.71Å; F227-F273 HydrophobicContact CG-CD2 3.71Å; F227-F273 HydrophobicContact CG-CG 4.42Å; F227-F273 HydrophobicContact CZ-CB 4.03Å; F249-F273 HydrophobicContact CE1-CD1 4.05Å; F249-F273 AromaticContact CE1-CE1 3.84Å; F249-F273 HydrophobicContact CE1-CE1 3.84Å; F249-F273 HydrophobicContact CZ-CD1 4.05Å; F249-F273 HydrophobicContact CZ-CE1 4.1Å; L257-F273 HydrophobicContact CD1-CE1 4.42Å; L257-F273 HydrophobicContact CD2-CE1 4.04Å; L269-F273 WeakPolarHBondContact O-CB 3.5Å; L269-F273 PolarHBondContact O-N 3.35Å; F270-F273 WeakPolarHBondContact O-CB 3.48Å; F270-F273 PolarHBondContact O-N 3.21Å; F270-F273 VanDerWaalsContact O-N 3.1Å; D271-F273 VanDerWaalsContact C-N 3.27Å; D271-F273 PolarHBondContact O-N 3.31Å; F273-W276 HydrophobicContact CD2-CE3 4.29Å; F273-W276 HydrophobicContact CE2-CE3 4.4Å; F273-W276 HydrophobicContact CE2-CZ3 4.4Å; F273-W276 PolarHBondContact O-N 2.7Å; F273-E277 HydrophobicContact CE2-CB 4.17Å; F273-E277 HydrophobicContact CZ-CB 4.42Å; F273-E277 WeakPolarHBondContact O-CB 3.43Å; F273-E277 PolarHBondContact O-N 3.19Å
274	V	96.4	Very high	95.3	Very high	14 Å²	14	61.4 Å²	61.4	9%	0.085	31%	0.309	C	S	.	.	H	α-helix	trans	-63.4	-46.4	179.7	173.3	0	0	0	0	110.1	F249 L257 Y260 F270 D271 W276 E277 M278	F249-V274 HydrophobicContact CZ-CG2 4.18Å; L257-V274 HydrophobicContact CD1-CG1 4.29Å; L257-V274 HydrophobicContact CD1-CG2 4.26Å; Y260-V274 HydrophobicContact CD1-CB 4.09Å; Y260-V274 HydrophobicContact CD1-CG1 3.62Å; Y260-V274 HydrophobicContact CD1-CG2 3.95Å; Y260-V274 HydrophobicContact CD2-CG2 3.87Å; Y260-V274 HydrophobicContact CE1-CB 4.09Å; Y260-V274 HydrophobicContact CE1-CG1 3.96Å; Y260-V274 HydrophobicContact CE1-CG2 4.14Å; Y260-V274 HydrophobicContact CE2-CG2 4.05Å; Y260-V274 HydrophobicContact CG-CB 4.43Å; Y260-V274 HydrophobicContact CG-CG1 4.15Å; Y260-V274 HydrophobicContact CG-CG2 3.78Å; F270-V274 WeakPolarHBondContact O-CG2 3.18Å; F270-V274 PolarHBondContact O-N 3.04Å; D271-V274 PolarHBondContact O-N 2.98Å; V274-W276 VanDerWaalsContact C-N 3.34Å; V274-W276 PolarHBondContact O-N 3.3Å; V274-E277 PolarHBondContact O-N 3.17Å; V274-M278 HydrophobicContact CG1-CG 4.28Å; V274-M278 WeakPolarHBondContact O-CB 3.46Å; V274-M278 WeakPolarHBondContact O-CG 3.41Å; V274-M278 PolarHBondContact O-N 2.89Å
275	E	95.8	Very high	94.9	Very high	134 Å²	134	59.6 Å²	59.6	63%	0.626	31%	0.313	S	S	*	.	H	α-helix	trans	-55.6	-48	174.2	-71.9	177.9	-173.2	0	0	111.8	D271 E277 M278 E279	D271-E275 WeakPolarHBondContact O-CG 3.46Å; D271-E275 PolarHBondContact O-N 2.76Å; E275-E277 PolarHBondContact O-N 3.06Å; E275-M278 PolarHBondContact O-N 3.37Å; E275-E279 PolarHBondContact O-N 3.41Å; E275-E279 VanDerWaalsContact O-N 3.07Å
276	W	97	Very high	93.5	Very high	25 Å²	25	59.8 Å²	59.8	10%	0.095	30%	0.296	C	S	.	.	H	α-helix	trans	-62.2	-43.1	178.5	172.7	93	0	0	0	112.6	N226 F227 E230 P232 T272 F273 V274 E279 R280	N226-W276 HydrophobicContact CB-CH2 3.95Å; F227-W276 HydrophobicContact CB-CD2 4.01Å; F227-W276 HydrophobicContact CB-CE3 3.63Å; F227-W276 HydrophobicContact CB-CH2 4.08Å; F227-W276 HydrophobicContact CB-CZ2 4.41Å; F227-W276 HydrophobicContact CB-CZ3 3.69Å; F227-W276 HydrophobicContact CD2-CB 3.81Å; F227-W276 AromaticContact CD2-CD2 3.74Å; F227-W276 HydrophobicContact CD2-CD2 3.74Å; F227-W276 HydrophobicContact CD2-CE3 4.03Å; F227-W276 AromaticContact CD2-CG 3.65Å; F227-W276 HydrophobicContact CD2-CG 3.65Å; F227-W276 HydrophobicContact CE2-CB 4.05Å; F227-W276 HydrophobicContact CE2-CG 4.28Å; F227-W276 HydrophobicContact CG-CD2 4.36Å; F227-W276 HydrophobicContact CG-CE3 4.26Å; E230-W276 VanDerWaalsContact OE2-CZ2 3.24Å; E230-W276 WeakPolarHBondContact OE2-CZ2 3.23Å; E230-W276 PolarHBondContact OE2-NE1 3.4Å; P232-W276 HydrophobicContact CG-CG 4.36Å; T272-W276 WeakPolarHBondContact O-CB 3.33Å; T272-W276 PolarHBondContact O-N 3.4Å; F273-W276 HydrophobicContact CD2-CE3 4.29Å; F273-W276 HydrophobicContact CE2-CE3 4.4Å; F273-W276 HydrophobicContact CE2-CZ3 4.4Å; F273-W276 PolarHBondContact O-N 2.7Å; V274-W276 VanDerWaalsContact C-N 3.34Å; V274-W276 PolarHBondContact O-N 3.3Å; W276-E279 PolarHBondContact O-N 3.07Å; W276-R280 WeakPolarHBondContact O-CB 3.36Å; W276-R280 PolarHBondContact O-N 3.41Å
277	E	95.7	Very high	91.7	Very high	1 Å²	1	59.9 Å²	59.9	1%	0.005	31%	0.308	C	S	.	.	H	α-helix	trans	-69	-38	-178.5	173.5	57.7	-164.6	0	0	111.2	L257 F273 V274 E275 R280 R281	L257-E277 HydrophobicContact CD1-CB 3.9Å; L257-E277 HydrophobicContact CD1-CG 3.54Å; F273-E277 HydrophobicContact CE2-CB 4.17Å; F273-E277 HydrophobicContact CZ-CB 4.42Å; F273-E277 WeakPolarHBondContact O-CB 3.43Å; F273-E277 PolarHBondContact O-N 3.19Å; V274-E277 PolarHBondContact O-N 3.17Å; E275-E277 PolarHBondContact O-N 3.06Å; E277-R280 VanDerWaalsContact CD-NH2 3.33Å; E277-R280 PolarHBondContact O-N 3.3Å; E277-R280 IonicContact OE1-CZ 2.66Å; E277-R280 IonicContact OE1-NE 3.87Å; E277-R280 IonicContact OE1-NH2 2.81Å; E277-R280 PolarHBondContact OE1-NH2 3.3Å; E277-R280 IonicContact OE2-CZ 3.15Å; E277-R280 IonicContact OE2-NE 2.91Å; E277-R280 PolarHBondContact OE2-NE 3.05Å; E277-R280 IonicContact OE2-NH2 3.12Å; E277-R280 PolarHBondContact OE2-NH2 3.1Å; E277-R281 VanDerWaalsContact O-CG 3.32Å; E277-R281 WeakPolarHBondContact O-CG 3.24Å; E277-R281 PolarHBondContact O-N 3.44Å; E277-R281 IonicContact OE1-CZ 2.97Å; E277-R281 IonicContact OE1-NE 3.19Å; E277-R281 PolarHBondContact OE1-NE 2.87Å; E277-R281 IonicContact OE1-NH2 2.73Å; E277-R281 PolarHBondContact OE1-NH2 3.45Å
278	M	93.5	Very high	89.7	Confident	106 Å²	106	69.4 Å²	69.4	52%	0.522	34%	0.342	S	S	.	.	H	α-helix	trans	-65	-42.9	175.5	-67.4	-61.6	-81.9	0	0	111.6	V274 E275 R281 K282	V274-M278 HydrophobicContact CG1-CG 4.28Å; V274-M278 WeakPolarHBondContact O-CB 3.46Å; V274-M278 WeakPolarHBondContact O-CG 3.41Å; V274-M278 PolarHBondContact O-N 2.89Å; E275-M278 PolarHBondContact O-N 3.37Å; M278-R281 PolarHBondContact O-N 2.96Å; M278-K282 PolarHBondContact O-N 2.96Å
279	E	95	Very high	87.5	Confident	88 Å²	88	67.6 Å²	67.6	41%	0.411	34%	0.337	S	S	.	.	H	α-helix	trans	-67.4	-36.8	174.8	-176.4	56.6	-150.9	0	0	112	E275 W276 K282 R283	E275-E279 PolarHBondContact O-N 3.41Å; E275-E279 VanDerWaalsContact O-N 3.07Å; W276-E279 PolarHBondContact O-N 3.07Å; E279-K282 PolarHBondContact O-N 3.17Å; E279-R283 WeakPolarHBondContact O-CG 3.49Å; E279-R283 PolarHBondContact O-N 3.37Å; E279-R283 VanDerWaalsContact O-N 3.07Å; E279-R283 PolarHBondContact O-NE 3.1Å
280	R	94.3	Very high	85.4	Confident	46 Å²	46	70.2 Å²	70.2	17%	0.174	36%	0.361	C	S	.	.	H	α-helix	trans	-61	-47.3	173.4	-170.2	-167.4	68.1	74.9	10.1	111.5	W276 E277 K282 R283 E284	W276-R280 WeakPolarHBondContact O-CB 3.36Å; W276-R280 PolarHBondContact O-N 3.41Å; E277-R280 VanDerWaalsContact CD-NH2 3.33Å; E277-R280 PolarHBondContact O-N 3.3Å; E277-R280 IonicContact OE1-CZ 2.66Å; E277-R280 IonicContact OE1-NE 3.87Å; E277-R280 IonicContact OE1-NH2 2.81Å; E277-R280 PolarHBondContact OE1-NH2 3.3Å; E277-R280 IonicContact OE2-CZ 3.15Å; E277-R280 IonicContact OE2-NE 2.91Å; E277-R280 PolarHBondContact OE2-NE 3.05Å; E277-R280 IonicContact OE2-NH2 3.12Å; E277-R280 PolarHBondContact OE2-NH2 3.1Å; R280-K282 VanDerWaalsContact C-N 3.34Å; R280-K282 PolarHBondContact O-N 2.89Å; R280-R283 PolarHBondContact O-N 3.18Å; R280-E284 IonicContact CZ-OE1 2.76Å; R280-E284 IonicContact CZ-OE2 3.42Å; R280-E284 IonicContact NH1-OE1 3.49Å; R280-E284 PolarHBondContact NH1-OE1 2.66Å; R280-E284 IonicContact NH1-OE2 2.66Å; R280-E284 PolarHBondContact NH1-OE2 2.8Å; R280-E284 PolarHBondContact O-N 3.12Å
281	R	93	Very high	83.2	Confident	78 Å²	78	77.8 Å²	77.8	29%	0.294	40%	0.401	S	S	.	.	H	α-helix	trans	-61.5	-40.4	177.5	-73	176.1	-177.4	-173.5	1.8	112.2	P255 D256 E277 M278 E284 G285	P255-R281 PolarHBondContact O-NH2 3.07Å; D256-R281 PolarHBondContact O-NH1 2.8Å; E277-R281 VanDerWaalsContact O-CG 3.32Å; E277-R281 WeakPolarHBondContact O-CG 3.24Å; E277-R281 PolarHBondContact O-N 3.44Å; E277-R281 IonicContact OE1-CZ 2.97Å; E277-R281 IonicContact OE1-NE 3.19Å; E277-R281 PolarHBondContact OE1-NE 2.87Å; E277-R281 IonicContact OE1-NH2 2.73Å; E277-R281 PolarHBondContact OE1-NH2 3.45Å; M278-R281 PolarHBondContact O-N 2.96Å; R281-E284 PolarHBondContact O-N 2.98Å; R281-G285 PolarHBondContact O-N 3.18Å
282	K	93.1	Very high	81.1	Confident	117 Å²	117	80.8 Å²	80.8	51%	0.509	43%	0.426	S	S	.	.	H	α-helix	trans	-60.5	-49.5	176.1	-175	-176.7	171.8	-166.9	0	111.6	M278 E279 R280 E284 G285 E286	M278-K282 PolarHBondContact O-N 2.96Å; E279-K282 PolarHBondContact O-N 3.17Å; R280-K282 VanDerWaalsContact C-N 3.34Å; R280-K282 PolarHBondContact O-N 2.89Å; K282-E284 VanDerWaalsContact C-N 3.33Å; K282-E284 PolarHBondContact O-N 3.08Å; K282-G285 PolarHBondContact O-N 3.02Å; K282-E286 WeakPolarHBondContact CE-OE1 3.27Å; K282-E286 WeakPolarHBondContact O-CG 3.25Å; K282-E286 PolarHBondContact O-N 3.38Å
283	R	92.6	Very high	78.7	Confident	121 Å²	121	83.1 Å²	83.1	46%	0.457	44%	0.444	S	S	.	.	H	α-helix	trans	-59.9	-39.5	177.3	-71	-178.6	-64.8	140.1	-5.6	112.9	E279 R280 G287	E279-R283 WeakPolarHBondContact O-CG 3.49Å; E279-R283 PolarHBondContact O-N 3.37Å; E279-R283 VanDerWaalsContact O-N 3.07Å; E279-R283 PolarHBondContact O-NE 3.1Å; R280-R283 PolarHBondContact O-N 3.18Å; R283-G287 PolarHBondContact O-N 3.05Å; R283-G287 VanDerWaalsContact O-N 3.07Å
284	E	89.8	Confident	76.1	Confident	113 Å²	113	86 Å²	86	53%	0.528	47%	0.473	S	S	.	.	H	α-helix	trans	-70.2	-35.4	177.3	-73.7	-178.8	177.1	0	0	113.1	R280 R281 K282 R288	R280-E284 IonicContact CZ-OE1 2.76Å; R280-E284 IonicContact CZ-OE2 3.42Å; R280-E284 IonicContact NH1-OE1 3.49Å; R280-E284 PolarHBondContact NH1-OE1 2.66Å; R280-E284 IonicContact NH1-OE2 2.66Å; R280-E284 PolarHBondContact NH1-OE2 2.8Å; R280-E284 PolarHBondContact O-N 3.12Å; R281-E284 PolarHBondContact O-N 2.98Å; K282-E284 VanDerWaalsContact C-N 3.33Å; K282-E284 PolarHBondContact O-N 3.08Å; E284-R288 PolarHBondContact O-N 2.93Å
285	G	84.8	Confident	73.7	Confident	47 Å²	47	91.6 Å²	91.6	49%	0.485	51%	0.51	S	S	.	.	H	α-helix	trans	-65.5	-44.1	173.4	0	0	0	0	0	112.6	R281 K282 G287 R288 G289	R281-G285 PolarHBondContact O-N 3.18Å; K282-G285 PolarHBondContact O-N 3.02Å; G285-G287 PolarHBondContact O-N 3.25Å; G285-R288 PolarHBondContact O-N 2.8Å; G285-G289 PolarHBondContact O-N 3.34Å; G285-G289 VanDerWaalsContact O-N 3.17Å
286	E	67.6	Low	71.6	Confident	113 Å²	113	94.8 Å²	94.8	53%	0.528	53%	0.525	S	S	.	.	H	α-helix	trans	-64.3	-39	177.1	-70.6	171.2	178.3	0	0	111.9	K282 R288 G289 A290	K282-E286 WeakPolarHBondContact CE-OE1 3.27Å; K282-E286 WeakPolarHBondContact O-CG 3.25Å; K282-E286 PolarHBondContact O-N 3.38Å; E286-R288 VanDerWaalsContact C-N 3.28Å; E286-R288 PolarHBondContact O-N 2.8Å; E286-G289 PolarHBondContact O-N 3.1Å; E286-A290 PolarHBondContact O-N 2.71Å; E286-A290 VanDerWaalsContact O-N 3.07Å
287	G	58.2	Low	69.2	Low	39 Å²	39	96.6 Å²	96.6	40%	0.402	55%	0.551	S	S	.	*	H	α-helix	trans	-64	-29.3	175.1	0	0	0	0	0	114	R283 G285	R283-G287 PolarHBondContact O-N 3.05Å; R283-G287 VanDerWaalsContact O-N 3.07Å; G285-G287 PolarHBondContact O-N 3.25Å
288	R	54.7	Low	67	Low	216 Å²	216	104.3 Å²	104.3	82%	0.815	59%	0.592	S	S	*	*	H	α-helix	trans	-78	-31.2	174.1	-118.9	176.4	-178	-138.6	0.5	112.8	E284 G285 E286	E284-R288 PolarHBondContact O-N 2.93Å; G285-R288 PolarHBondContact O-N 2.8Å; E286-R288 VanDerWaalsContact C-N 3.28Å; E286-R288 PolarHBondContact O-N 2.8Å
289	G	50.4	Low	64.9	Low	50 Å²	50	105.3 Å²	105.3	52%	0.515	61%	0.608	S	S	.	*	H	α-helix	trans	-70.3	-36.8	174.5	0	0	0	0	0	113.3	G285 E286 L291 S292	G285-G289 PolarHBondContact O-N 3.34Å; G285-G289 VanDerWaalsContact O-N 3.17Å; E286-G289 PolarHBondContact O-N 3.1Å; G289-L291 VanDerWaalsContact C-N 3.31Å; G289-L291 PolarHBondContact O-N 3.08Å; G289-S292 PolarHBondContact O-N 3.25Å
290	A	52.3	Low	62.9	Low	74 Å²	74	106.9 Å²	106.9	61%	0.612	63%	0.626	S	S	*	*	H	α-helix	trans	-71.8	-18.8	-178.2	0	0	0	0	0	114.6	E286	E286-A290 PolarHBondContact O-N 2.71Å; E286-A290 VanDerWaalsContact O-N 3.07Å
291	L	52.8	Low	61.1	Low	159 Å²	159	113.4 Å²	113.4	83%	0.832	66%	0.658	S	S	*	*	T	Hydrogen-bonded Turn	trans	-89.2	-4.3	178.4	-73.7	167.9	0	0	0	113.9	G289	G289-L291 VanDerWaalsContact C-N 3.31Å; G289-L291 PolarHBondContact O-N 3.08Å
292	S	52.6	Low	59.1	Low	108 Å²	108	118.4 Å²	118.4	76%	0.755	69%	0.685	S	S	*	*	S	Bend	trans	-103.4	7.5	-176.3	-161.6	0	0	0	0	114.9	G289	G289-S292 PolarHBondContact O-N 3.25Å
293	S	45.9	Very low	57.4	Low	97 Å²	97	121.2 Å²	121.2	68%	0.678	70%	0.7	S	S	*	*			trans	-110.7	67.7	176.2	50.1	0	0	0	0	111.9
294	G	43.5	Very low	55.6	Low	59 Å²	59	126 Å²	126	61%	0.608	74%	0.742	S	S	*	*			trans	-74.1	145	160.9	0	0	0	0	0	110.3	E296	G294-E296 PolarHBondContact O-N 3.19Å; G294-E296 VanDerWaalsContact O-N 3.14Å
295	P	46	Very low	53.9	Low	132 Å²	132	126.6 Å²	126.6	86%	0.857	75%	0.753	S	S	*	*			trans	-78.9	101.8	-176.3	32.1	-29.9	0	0	0	109.2	G297	P295-G297 PolarHBondContact O-N 3.3Å; P295-G297 VanDerWaalsContact O-N 3.12Å
296	E	51.2	Low	52.2	Low	201 Å²	201	130.8 Å²	130.8	94%	0.939	77%	0.767	S	S	*	*			trans	-73.9	100.7	159	-72.9	-151.7	134.2	0	0	108.1	G294	G294-E296 PolarHBondContact O-N 3.19Å; G294-E296 VanDerWaalsContact O-N 3.14Å
297	G	47.1	Very low	51.4	Low	63 Å²	63	131.8 Å²	131.8	65%	0.649	78%	0.78	S	S	*	*			trans	-68.1	139.4	174.5	0	0	0	0	0	112.2	P295	P295-G297 PolarHBondContact O-N 3.3Å; P295-G297 VanDerWaalsContact O-N 3.12Å
298	L	47.8	Very low	51	Low	163 Å²	163	137.2 Å²	137.2	85%	0.853	80%	0.803	S	S	*	*			trans	13.5	124.6	146.7	-80.6	80.4	0	0	0	118
299	C	49.6	Very low	50.8	Low	128 Å²	128	132.3 Å²	132.3	87%	0.865	80%	0.802	S	S	*	*				-160.6	122.4	114.9	-98.8	0	0	0	0	109.6
300	P	53.1	Low	50.8	Low	120 Å²	120	137.8 Å²	137.8	78%	0.779	82%	0.821	S	S	*	*			trans	-95.2	125.5	161.1	32.8	-22.1	0	0	0	109.3
301	E	57.1	Low	50.7	Low	184 Å²	184	142.4 Å²	142.4	86%	0.86	84%	0.836	S	S	*	*			trans	-111.2	108.7	159.4	-84.5	-167.3	105	0	0	108.7
302	E	51.4	Low	50.5	Low	182 Å²	182	141.1 Å²	141.1	85%	0.85	84%	0.836	S	S	*	*			trans	-68	129.7	155.1	-86	177.8	90	0	0	109
303	Q	56.6	Low	50.3	Low	177 Å²	177	143.8 Å²	143.8	83%	0.827	84%	0.843	S	S	*	*			trans	-166.1	127.4	141.9	-109.7	158.7	80.5	0	0	111.3
304	T	54.6	Low	50.7	Low	220 Å²	220	148.1 Å²	148.1	100%	1.35	86%	0.858	S	S	*	*			trans	88.9	0	171.1	0.3	0	0	0	0	118.7

Retrieved 304 of 304 residues in 681.1 ms (Link to these results)

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