A0A077ZHE7_TRITR Loading...

Glycoside hydrolase family 103 protein

AlphaFold DB , UniProt , Accession A0A077ZHE7, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 377 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	37.5	Very low	34.5	Very low	251 Å²	251	159.9 Å²	159.9	100%	1.236	81%	0.806	S	S	*	*				0	131.7	0	-96.1	171.2	172.2	0	0	108
2	L	33.2	Very low	34.1	Very low	142 Å²	142	158.8 Å²	158.8	74%	0.743	80%	0.803	S	S	*	*			trans	-64.8	172.2	-176.2	-81.2	137.9	0	0	0	114
3	Y	35.6	Very low	34.3	Very low	187 Å²	187	159.3 Å²	159.3	73%	0.733	81%	0.809	S	S	*	*			trans	94.2	103.4	156.4	-52.3	-73.1	0	0	0	116.8
4	H	35	Very low	34	Very low	178 Å²	178	152.8 Å²	152.8	82%	0.824	80%	0.801	S	S	*	*				-174.9	141.1	79.2	-103.2	-65.7	0	0	0	112
5	T	29.9	Very low	34.2	Very low	125 Å²	125	150.4 Å²	150.4	77%	0.767	80%	0.799	S	S	*	*			trans	-105.2	146.6	-177	46	0	0	0	0	111.2
6	C	30.6	Very low	34	Very low	120 Å²	120	151.1 Å²	151.1	81%	0.811	80%	0.801	S	S	*	*			trans	77.1	169.6	139.5	-122	0	0	0	0	119.4
7	P	51.6	Low	34.2	Very low	95 Å²	95	152.5 Å²	152.5	62%	0.617	81%	0.805	S	S	*	*				-136.6	170.5	-80.7	42.4	-26.8	0	0	0	113.9
8	W	36.9	Very low	33.9	Very low	237 Å²	237	154.9 Å²	154.9	90%	0.898	81%	0.808	S	S	*	*			trans	-137	109.3	161.3	-82.9	70.2	0	0	0	110.4
9	L	31.9	Very low	33.7	Very low	132 Å²	132	156.4 Å²	156.4	69%	0.691	81%	0.808	S	S	*	*				57.1	108.1	116.6	-83.7	92.5	0	0	0	115.7
10	N	25.5	Very low	33.5	Very low	156 Å²	156	157.4 Å²	157.4	83%	0.834	80%	0.8	S	S	*	*				61.3	141.7	65.1	-96.9	-8.5	0	0	0	117.6
11	L	32.2	Very low	33.6	Very low	136 Å²	136	158.7 Å²	158.7	71%	0.712	80%	0.796	S	S	*	*			trans	100	103.9	166.3	-63.5	136.4	0	0	0	115.1
12	L	29.7	Very low	33.5	Very low	147 Å²	147	156.3 Å²	156.3	77%	0.77	77%	0.774	S	S	*	*				95.4	130.4	67.5	-94.9	160	0	0	0	112.9
13	N	36.5	Very low	33.5	Very low	165 Å²	165	155.2 Å²	155.2	88%	0.882	77%	0.773	S	S	*	*			trans	125.9	123.7	162.9	-68.2	-21.5	0	0	0	110.3
14	G	30.2	Very low	33.5	Very low	68 Å²	68	152.3 Å²	152.3	70%	0.701	78%	0.775	S	S	*	*			cis	167.5	157.2	7.9	0	0	0	0	0	107.1
15	P	37	Very low	33.7	Very low	117 Å²	117	152 Å²	152	76%	0.76	78%	0.778	S	S	*	*			trans	-100.5	176.6	-165.7	39.1	-32.8	0	0	0	112.9
16	L	30.8	Very low	34.4	Very low	161 Å²	161	152.8 Å²	152.8	84%	0.843	78%	0.777	S	S	*	*			trans	135.9	113.5	148.2	-80.4	142.7	0	0	0	112.9
17	M	36.9	Very low	35	Very low	176 Å²	176	152.5 Å²	152.5	87%	0.867	77%	0.774	S	S	*	*				167.5	109.6	104.9	-87.2	-169.2	64	0	0	111.4
18	F	28.5	Very low	34.2	Very low	196 Å²	196	154.3 Å²	154.3	86%	0.86	78%	0.778	S	S	*	*			trans	-66.5	149.2	154.9	-94	-97.9	0	0	0	111
19	K	30.5	Very low	34.4	Very low	183 Å²	183	153.2 Å²	153.2	80%	0.796	78%	0.78	S	S	*	*			trans	144.1	148.8	135.6	-81.9	172.1	-177	177.1	0	110.3
20	R	30.5	Very low	34.6	Very low	176 Å²	176	151.8 Å²	151.8	66%	0.664	78%	0.776	S	S	*	*			cis	163.6	151.2	-8.8	-158.6	-176.9	-178.8	173.6	3.5	104.7
21	R	36.3	Very low	35.3	Very low	185 Å²	185	151 Å²	151	70%	0.698	77%	0.771	S	S	*	*			trans	82.4	149.5	153.8	-48.8	-165.5	165.7	172.1	-7.8	117.4
22	Y	34.3	Very low	35.4	Very low	201 Å²	201	152 Å²	152	79%	0.788	78%	0.776	S	S	*	*			cis	171.1	156.4	-22.6	-108	-66.2	0	0	0	105.9
23	V	34	Very low	35.6	Very low	119 Å²	119	149.4 Å²	149.4	72%	0.721	78%	0.776	S	S	*	*			trans	88.3	104.4	144	170.6	0	0	0	0	120.1
24	T	34.2	Very low	35.5	Very low	125 Å²	125	145.9 Å²	145.9	77%	0.767	77%	0.77	S	S	*	*				7	133.8	127	31.2	0	0	0	0	120.6
25	L	40.6	Very low	35.5	Very low	172 Å²	172	148.8 Å²	148.8	90%	0.901	78%	0.778	S	S	*	*			trans	-146.6	119.2	152.9	-99.3	156.1	0	0	0	110.4
26	L	44.5	Very low	36.3	Very low	142 Å²	142	148.6 Å²	148.6	74%	0.743	78%	0.779	S	S	*	*			trans	-95.4	147.7	153.9	-143.4	100.4	0	0	0	106.3	L28	L26-L28 HydrophobicContact CD2-CD1 4.4Å
27	P	42.5	Very low	37.2	Very low	113 Å²	113	145.5 Å²	145.5	73%	0.734	77%	0.771	S	S	*	*				-149.5	140.2	96.6	33.4	-13.9	0	0	0	113.7
28	L	34.7	Very low	37.5	Very low	134 Å²	134	146.6 Å²	146.6	70%	0.702	77%	0.771	S	S	*	*				53.3	106.2	91.4	-130.8	93.4	0	0	0	116	L26	L26-L28 HydrophobicContact CD2-CD1 4.4Å
29	F	41.6	Very low	37.9	Very low	214 Å²	214	143.6 Å²	143.6	94%	0.939	77%	0.771	S	S	*	*			trans	-143.7	131.3	146	-108.7	-80.1	0	0	0	110.9
30	V	35.4	Very low	38.2	Very low	102 Å²	102	144.1 Å²	144.1	62%	0.618	77%	0.774	S	S	*	*			trans	-99	154	178.4	171.1	0	0	0	0	108.7
31	L	40.7	Very low	38.4	Very low	140 Å²	140	141.2 Å²	141.2	73%	0.733	78%	0.778	S	S	*	*			trans	144.1	106.2	143.3	-76.7	160.2	0	0	0	110.2
32	L	34.5	Very low	38.2	Very low	156 Å²	156	138.5 Å²	138.5	82%	0.817	78%	0.782	S	S	*	*				73.5	115.4	86.8	-91	168.7	0	0	0	115
33	A	33.5	Very low	38.2	Very low	92 Å²	92	137.3 Å²	137.3	76%	0.76	78%	0.783	S	S	*	*				127.2	125.2	125.3	0	0	0	0	0	117.5
34	A	33.2	Very low	38.1	Very low	91 Å²	91	136.9 Å²	136.9	75%	0.752	78%	0.781	S	S	*	*			trans	88.6	96.5	136.1	0	0	0	0	0	120.6
35	C	32	Very low	38	Very low	129 Å²	129	137.4 Å²	137.4	87%	0.872	78%	0.779	S	S	*	*				55.1	126.1	117.1	-63	0	0	0	0	121.9
36	S	53.8	Low	37.6	Very low	113 Å²	113	134.7 Å²	134.7	79%	0.79	77%	0.77	S	S	*	*			trans	104.7	106.5	135.4	-158.8	0	0	0	0	116.4
37	S	48.7	Very low	37.1	Very low	97 Å²	97	133.5 Å²	133.5	68%	0.678	77%	0.769	S	S	*	*				168.8	122	94.5	49.4	0	0	0	0	113.1
38	K	42.7	Very low	36.9	Very low	198 Å²	198	133.6 Å²	133.6	86%	0.861	77%	0.767	S	S	*	*			trans	67.3	133.9	145.8	-59.1	-179.3	-176.2	-179.9	0	119.8	K40	K38-K40 PolarHBondContact O-N 3.44Å
39	P	38	Very low	37.1	Very low	133 Å²	133	130.1 Å²	130.1	86%	0.864	76%	0.764	S	S	*	*	P	Polyproline II helix	trans	-74.1	125.5	-177.1	31.4	-31.1	0	0	0	109.8
40	K	37.2	Very low	37.3	Very low	194 Å²	194	123.9 Å²	123.9	84%	0.843	74%	0.743	S	S	*	*	P	Polyproline II helix	trans	-82.6	143.3	161	-146.2	171.4	-178.9	-171.6	0	107	K38 T42	K38-K40 PolarHBondContact O-N 3.44Å; K40-T42 PolarHBondContact O-N 3.5Å
41	P	34.8	Very low	37.9	Very low	115 Å²	115	121.9 Å²	121.9	75%	0.747	73%	0.733	S	S	*	*	P	Polyproline II helix	trans	-58.1	139.4	-169.4	-18.7	31.2	0	0	0	109.9	E43	P41-E43 PolarHBondContact O-N 3.22Å
42	T	31.4	Very low	38.7	Very low	128 Å²	128	121.3 Å²	121.3	79%	0.785	74%	0.74	S	S	*	*			trans	-50.5	92.3	164.8	-49.2	0	0	0	0	108	K40 T44	K40-T42 PolarHBondContact O-N 3.5Å; T42-T44 PolarHBondContact O-N 3.34Å
43	E	34	Very low	40.3	Very low	176 Å²	176	115.1 Å²	115.1	82%	0.822	71%	0.714	S	S	*	*			trans	-54.6	107.6	148.7	-89	171.4	177.2	0	0	103.4	P41 D45	P41-E43 PolarHBondContact O-N 3.22Å; E43-D45 PolarHBondContact O-N 3.08Å
44	T	32	Very low	42.3	Very low	110 Å²	110	110.9 Å²	110.9	68%	0.675	68%	0.68	S	S	*	*			trans	-54.1	103.5	163.3	-53	0	0	0	0	103.7	T42 T46	T42-T44 PolarHBondContact O-N 3.34Å; T44-T46 PolarHBondContact O-N 3.44Å
45	D	32.9	Very low	44.7	Very low	137 Å²	137	106.7 Å²	106.7	73%	0.733	64%	0.644	S	S	*	*			trans	-54.1	87.2	157.5	-88.8	-33.8	0	0	0	105	E43 T47	E43-D45 PolarHBondContact O-N 3.08Å; D45-T47 HydrophobicContact CB-CG2 4.37Å; D45-T47 PolarHBondContact O-N 2.93Å; D45-T47 PolarHBondContact O-OG1 2.84Å
46	T	30.6	Very low	47.1	Very low	115 Å²	115	104.5 Å²	104.5	71%	0.706	62%	0.624	S	S	*	*			trans	-63.2	72.8	146.9	40.8	0	0	0	0	105.1	T44 T48	T44-T46 PolarHBondContact O-N 3.44Å; T46-T48 PolarHBondContact O-N 3.28Å
47	T	34.1	Very low	48.5	Very low	116 Å²	116	100.3 Å²	100.3	71%	0.712	59%	0.592	S	S	*	*			trans	-56.7	94.5	145.7	38.9	0	0	0	0	103.2	D45 G49	D45-T47 HydrophobicContact CB-CG2 4.37Å; D45-T47 PolarHBondContact O-N 2.93Å; D45-T47 PolarHBondContact O-OG1 2.84Å; T47-G49 PolarHBondContact O-N 2.65Å
48	T	38.4	Very low	50.1	Low	115 Å²	115	99.2 Å²	99.2	71%	0.706	58%	0.576	S	S	*	*			trans	-57.5	85.1	162	45.6	0	0	0	0	105.1	T46 T50	T46-T48 PolarHBondContact O-N 3.28Å; T48-T50 PolarHBondContact O-N 3.25Å; T48-T50 VanDerWaalsContact O-N 3.08Å
49	G	39.6	Very low	52	Low	61 Å²	61	95.1 Å²	95.1	63%	0.629	57%	0.57	S	S	*	*			trans	-54.7	119.7	171.2	0	0	0	0	0	106	T47 P51	T47-G49 PolarHBondContact O-N 2.65Å; G49-P51 VanDerWaalsContact O-CD 3.24Å; G49-P51 WeakPolarHBondContact O-CD 3.33Å
50	T	45.4	Very low	54.2	Low	83 Å²	83	93.9 Å²	93.9	51%	0.509	55%	0.553	S	S	.	*			trans	-43	113.5	176.5	-52.2	0	0	0	0	108.1	T48 S52	T48-T50 PolarHBondContact O-N 3.25Å; T48-T50 VanDerWaalsContact O-N 3.08Å; T50-S52 PolarHBondContact O-N 2.82Å
51	P	47.8	Very low	56.5	Low	60 Å²	60	85.8 Å²	85.8	39%	0.39	52%	0.518	S	S	.	.			trans	-57.7	121.3	177.3	-24.2	34.9	0	0	0	107.2	G49 G53 G54	G49-P51 VanDerWaalsContact O-CD 3.24Å; G49-P51 WeakPolarHBondContact O-CD 3.33Å; P51-G53 PolarHBondContact O-N 3.11Å; P51-G54 PolarHBondContact O-N 3.13Å
52	S	58.5	Low	58.7	Low	128 Å²	128	84.8 Å²	84.8	90%	0.895	51%	0.506	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.1	108.6	176.2	56.6	0	0	0	0	108.3	T50	T50-S52 PolarHBondContact O-N 2.82Å
53	G	66.9	Low	60.8	Low	26 Å²	26	82 Å²	82	27%	0.268	49%	0.489	S	S	.	.	T	Hydrogen-bonded Turn	trans	107.5	4.5	-179.3	0	0	0	0	0	116.3	P51 F89 D90	P51-G53 PolarHBondContact O-N 3.11Å; G53-F89 WeakPolarHBondContact O-CA 3.3Å; G53-D90 PolarHBondContact O-N 3.3Å
54	G	76.9	Confident	62.4	Low	4 Å²	4	79.1 Å²	79.1	4%	0.041	48%	0.477	C	S	.	.			trans	-115.8	176.8	-172.2	0	0	0	0	0	117.6	P51 Q93	P51-G54 PolarHBondContact O-N 3.13Å; G54-Q93 VanDerWaalsContact C-OE1 3.25Å
55	F	83.8	Confident	64	Low	2 Å²	2	78.6 Å²	78.6	1%	0.009	47%	0.467	C	S	.	.			trans	-80.8	156.9	169.1	-47.6	-79.2	0	0	0	111.2	L57 F89 Q93 L94 I97 L216 A219 R220 P226	F55-L57 HydrophobicContact CB-CD2 3.87Å; F55-L57 HydrophobicContact CB-CG 4.16Å; F55-L57 HydrophobicContact CD2-CD2 4.48Å; F55-L57 HydrophobicContact CG-CD2 4.49Å; F55-L57 PolarHBondContact O-N 3.05Å; F55-F89 HydrophobicContact CD1-CE1 4.41Å; F55-F89 HydrophobicContact CE1-CD1 4.43Å; F55-F89 AromaticContact CE1-CE1 3.59Å; F55-F89 HydrophobicContact CE1-CE1 3.59Å; F55-F89 HydrophobicContact CE1-CZ 4.39Å; F55-F89 HydrophobicContact CE2-CD1 4.13Å; F55-F89 HydrophobicContact CE2-CE1 4.09Å; F55-F89 AromaticContact CZ-CD1 3.82Å; F55-F89 HydrophobicContact CZ-CD1 3.82Å; F55-F89 AromaticContact CZ-CE1 3.39Å; F55-F89 HydrophobicContact CZ-CE1 3.39Å; F55-F89 HydrophobicContact CZ-CZ 4.39Å; F55-Q93 HydrophobicContact CD2-CB 4.37Å; F55-Q93 PolarHBondContact O-NE2 2.87Å; F55-L94 HydrophobicContact CE2-CD2 4.06Å; F55-L94 HydrophobicContact CZ-CD2 4.06Å; F55-I97 HydrophobicContact CD2-CD1 4.22Å; F55-I97 HydrophobicContact CD2-CG2 4.32Å; F55-I97 HydrophobicContact CE2-CD1 3.44Å; F55-I97 VanDerWaalsContact CE2-CD1 3.44Å; F55-I97 HydrophobicContact CE2-CG1 4.27Å; F55-I97 HydrophobicContact CZ-CD1 3.63Å; F55-L216 HydrophobicContact CE1-CB 4.01Å; F55-L216 HydrophobicContact CE1-CD2 3.92Å; F55-L216 HydrophobicContact CE1-CG 4.49Å; F55-L216 WeakPolarHBondContact CE1-O 3.31Å; F55-L216 HydrophobicContact CZ-CB 4.01Å; F55-L216 HydrophobicContact CZ-CD1 4.33Å; F55-L216 HydrophobicContact CZ-CD2 3.79Å; F55-L216 HydrophobicContact CZ-CG 4.25Å; F55-A219 HydrophobicContact CD1-CB 4.11Å; F55-A219 HydrophobicContact CE1-CB 4.27Å; F55-R220 HydrophobicContact CD1-CB 4.36Å; F55-R220 HydrophobicContact CE1-CB 4.47Å; F55-P226 HydrophobicContact CD1-CG 3.92Å; F55-P226 HydrophobicContact CD2-CG 4.39Å; F55-P226 HydrophobicContact CE1-CG 4.16Å; F55-P226 HydrophobicContact CG-CG 4.04Å
56	L	82.5	Confident	65.5	Low	84 Å²	84	81.4 Å²	81.4	44%	0.44	48%	0.478	S	S	.	.			trans	-80.2	97	160.3	-169.6	144.3	0	0	0	107.7	Q223 D225	L56-Q223 HydrophobicContact CB-CB 4.41Å; L56-Q223 WeakPolarHBondContact CB-O 3.32Å; L56-Q223 HydrophobicContact CD1-CB 4.5Å; L56-D225 WeakPolarHBondContact O-CA 3.3Å; L56-D225 WeakPolarHBondContact O-CB 3.45Å; L56-D225 PolarHBondContact O-N 3.27Å
57	L	82.2	Confident	67.9	Low	25 Å²	25	77.5 Å²	77.5	13%	0.131	46%	0.461	C	S	.	.			trans	-89.3	133.7	176.9	-62.2	179.7	0	0	0	109.9	F55 Q93 I97	F55-L57 HydrophobicContact CB-CD2 3.87Å; F55-L57 HydrophobicContact CB-CG 4.16Å; F55-L57 HydrophobicContact CD2-CD2 4.48Å; F55-L57 HydrophobicContact CG-CD2 4.49Å; F55-L57 PolarHBondContact O-N 3.05Å; L57-Q93 HydrophobicContact CD1-CG 4.37Å; L57-I97 HydrophobicContact CD1-CG2 4.29Å; L57-I97 HydrophobicContact CD2-CG2 3.65Å
58	E	83.2	Confident	70.5	Confident	73 Å²	73	73.6 Å²	73.6	34%	0.341	44%	0.443	S	S	.	.			trans	-63.9	151.1	169.8	-69	-176.1	170.7	0	0	110.4	Q60 H61 N62 D225 N228	E58-Q60 PolarHBondContact O-N 3.35Å; E58-Q60 PolarHBondContact OE2-NE2 2.95Å; E58-H61 WeakPolarHBondContact O-CA 3.14Å; E58-H61 WeakPolarHBondContact O-CB 3.23Å; E58-H61 PolarHBondContact O-N 3.45Å; E58-N62 PolarHBondContact O-N 3.06Å; E58-D225 PolarHBondContact N-OD2 2.92Å; E58-N228 PolarHBondContact OE1-ND2 3.32Å; E58-N228 PolarHBondContact OE2-ND2 3.27Å
59	P	82.4	Confident	73.2	Confident	113 Å²	113	72 Å²	72	73%	0.734	43%	0.431	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.3	-35.5	-172.9	-29.5	36	0	0	0	114.8	H61 N62	P59-H61 VanDerWaalsContact C-N 3.27Å; P59-H61 PolarHBondContact O-N 2.97Å; P59-N62 PolarHBondContact O-N 3.17Å
60	Q	83.8	Confident	75.7	Confident	107 Å²	107	69.3 Å²	69.3	50%	0.5	40%	0.402	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.7	-18.4	178.2	70.5	-82.4	7.1	0	0	114.2	E58	E58-Q60 PolarHBondContact O-N 3.35Å; E58-Q60 PolarHBondContact OE2-NE2 2.95Å
61	H	85.8	Confident	77.6	Confident	24 Å²	24	66.7 Å²	66.7	11%	0.111	39%	0.389	C	S	.	.	T	Hydrogen-bonded Turn	trans	-96.2	-12	177.7	-61.1	143.5	0	0	0	112.6	E58 P59 V63 Q100 D225 L227 N228	E58-H61 WeakPolarHBondContact O-CA 3.14Å; E58-H61 WeakPolarHBondContact O-CB 3.23Å; E58-H61 PolarHBondContact O-N 3.45Å; P59-H61 VanDerWaalsContact C-N 3.27Å; P59-H61 PolarHBondContact O-N 2.97Å; H61-V63 PolarHBondContact O-N 3.36Å; H61-Q100 PolarHBondContact O-NE2 2.86Å; H61-D225 IonicContact CE1-OD2 3.08Å; H61-D225 IonicContact CG-OD2 3.09Å; H61-D225 IonicContact ND1-OD1 2.69Å; H61-D225 IonicContact ND1-OD2 3.18Å; H61-D225 PolarHBondContact ND1-OD2 2.99Å; H61-L227 HydrophobicContact CB-CD1 3.57Å; H61-N228 PolarHBondContact CE1-OD1 2.93Å
62	N	80.2	Confident	79.4	Confident	93 Å²	93	71.5 Å²	71.5	50%	0.497	41%	0.411	S	S	.	.			trans	-79.7	54.1	173.2	-166.9	22.6	0	0	0	111.4	E58 P59	E58-N62 PolarHBondContact O-N 3.06Å; P59-N62 PolarHBondContact O-N 3.17Å
63	V	76.1	Confident	81.1	Confident	71 Å²	71	66.4 Å²	66.4	43%	0.43	37%	0.374	S	S	.	.			trans	-133	123.9	-179.8	-176.8	0	0	0	0	109.4	H61 Q65	H61-V63 PolarHBondContact O-N 3.36Å; V63-Q65 PolarHBondContact O-N 3.45Å; V63-Q65 VanDerWaalsContact O-N 3.13Å
64	M	67.4	Low	82.4	Confident	115 Å²	115	69.3 Å²	69.3	57%	0.567	39%	0.388	S	S	*	.			trans	-72.9	104.1	168.4	-165.2	178.3	-169.6	0	0	109.7	E96	M64-E96 HydrophobicContact CB-CG 4.32Å
65	Q	65.9	Low	83.3	Confident	99 Å²	99	72.8 Å²	72.8	46%	0.463	41%	0.405	S	S	.	.			trans	-86.4	121.6	167	-66.4	-162.3	-6.3	0	0	109.4	V63 G67 S99	V63-Q65 PolarHBondContact O-N 3.45Å; V63-Q65 VanDerWaalsContact O-N 3.13Å; Q65-G67 PolarHBondContact O-N 3.3Å; Q65-G67 VanDerWaalsContact O-N 3.08Å; Q65-S99 WeakPolarHBondContact O-CB 3.31Å
66	M	64	Low	83.9	Confident	195 Å²	195	72.8 Å²	72.8	96%	0.961	41%	0.406	S	S	*	.	S	Bend	trans	-67.6	106.8	164.6	-73.7	-157.8	-71	0	0	108.5
67	G	82.1	Confident	84.5	Confident	33 Å²	33	71.9 Å²	71.9	34%	0.34	40%	0.399	S	S	.	.			trans	118.4	-149.6	176.3	0	0	0	0	0	113.6	Q65 A71 S99	Q65-G67 PolarHBondContact O-N 3.3Å; Q65-G67 VanDerWaalsContact O-N 3.08Å; G67-A71 WeakPolarHBondContact O-CB 3.39Å; G67-S99 WeakPolarHBondContact O-CA 3.34Å; G67-S99 WeakPolarHBondContact O-CB 3.37Å
68	G	88	Confident	85.2	Confident	34 Å²	34	76.6 Å²	76.6	35%	0.351	42%	0.421	S	S	.	.			trans	103.8	163.5	-168.7	0	0	0	0	0	112.5	F70 A71 S99	G68-F70 PolarHBondContact O-N 3.28Å; G68-A71 PolarHBondContact O-N 3.09Å; G68-S99 VanDerWaalsContact CA-O 3.27Å; G68-S99 WeakPolarHBondContact CA-O 3.37Å
69	D	94.1	Very high	85.9	Confident	83 Å²	83	73.6 Å²	73.6	44%	0.444	41%	0.407	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.4	-16.8	-170.1	-61.3	-16.9	0	0	0	112.7	K102 R103	D69-K102 WeakPolarHBondContact OD2-CA 3.45Å; D69-R103 HydrophobicContact CB-CB 3.7Å; D69-R103 PolarHBondContact OD2-N 3.22Å
70	F	93.8	Very high	86.6	Confident	3 Å²	3	68.4 Å²	68.4	1%	0.013	37%	0.373	C	S	.	.	T	Hydrogen-bonded Turn	trans	-114.2	-0.8	-177.7	-54.9	-71.7	0	0	0	114.8	G68 N72 N73 A76 A101 R103 A195 F199 N200	G68-F70 PolarHBondContact O-N 3.28Å; F70-N72 VanDerWaalsContact C-N 3.29Å; F70-N72 PolarHBondContact O-N 3.48Å; F70-N73 HydrophobicContact CB-CB 4.48Å; F70-N73 WeakPolarHBondContact O-CB 3.41Å; F70-N73 PolarHBondContact O-N 3.41Å; F70-A76 HydrophobicContact CB-CB 4.14Å; F70-A101 HydrophobicContact CD2-CB 3.83Å; F70-A101 HydrophobicContact CE2-CB 3.76Å; F70-R103 HydrophobicContact CE1-CB 4.38Å; F70-R103 HydrophobicContact CZ-CB 4.02Å; F70-A195 HydrophobicContact CD2-CB 4.35Å; F70-A195 HydrophobicContact CE1-CB 4.38Å; F70-A195 HydrophobicContact CE2-CB 3.75Å; F70-A195 HydrophobicContact CZ-CB 3.76Å; F70-F199 HydrophobicContact CD1-CB 4.05Å; F70-F199 AromaticContact CD1-CD2 3.6Å; F70-F199 HydrophobicContact CD1-CD2 3.6Å; F70-F199 HydrophobicContact CD1-CG 4.3Å; F70-F199 HydrophobicContact CE1-CB 4.08Å; F70-F199 AromaticContact CE1-CD2 3.87Å; F70-F199 HydrophobicContact CE1-CD2 3.87Å; F70-F199 HydrophobicContact CE1-CG 4.49Å; F70-F199 HydrophobicContact CG-CD2 4.13Å; F70-N200 VanDerWaalsContact CE1-OD1 3.28Å; F70-N200 WeakPolarHBondContact CE1-OD1 3.39Å
71	A	84.8	Confident	87.3	Confident	29 Å²	29	66.2 Å²	66.2	24%	0.24	37%	0.365	C	S	.	.	T	Hydrogen-bonded Turn	trans	-55.3	-40.6	-172.2	0	0	0	0	0	114.2	G67 G68 Q77	G67-A71 WeakPolarHBondContact O-CB 3.39Å; G68-A71 PolarHBondContact O-N 3.09Å; A71-Q77 PolarHBondContact O-NE2 3.43Å
72	N	86.3	Confident	87.9	Confident	160 Å²	160	68.9 Å²	68.9	86%	0.856	38%	0.376	S	S	*	.	T	Hydrogen-bonded Turn	trans	-103.3	13.8	-179.7	-63	-37.1	0	0	0	112.9	F70 P74	F70-N72 VanDerWaalsContact C-N 3.29Å; F70-N72 PolarHBondContact O-N 3.48Å; N72-P74 VanDerWaalsContact O-CD 3.32Å; N72-P74 WeakPolarHBondContact O-CD 3.44Å
73	N	92.7	Very high	88.7	Confident	22 Å²	22	64.4 Å²	64.4	12%	0.118	35%	0.352	C	S	.	.			trans	-81.4	117.7	-178.4	-171.9	-50.2	0	0	0	110.1	F70 N75 A76 Q77 F199	F70-N73 HydrophobicContact CB-CB 4.48Å; F70-N73 WeakPolarHBondContact O-CB 3.41Å; F70-N73 PolarHBondContact O-N 3.41Å; N73-N75 PolarHBondContact O-N 3.16Å; N73-N75 WeakPolarHBondContact OD1-CA 3.33Å; N73-N75 VanDerWaalsContact OD1-CB 3.28Å; N73-N75 WeakPolarHBondContact OD1-CB 3.31Å; N73-N75 PolarHBondContact OD1-N 2.99Å; N73-A76 HydrophobicContact CB-CB 3.92Å; N73-A76 WeakPolarHBondContact O-CB 3.31Å; N73-A76 PolarHBondContact O-N 2.9Å; N73-A76 PolarHBondContact OD1-N 3.36Å; N73-Q77 PolarHBondContact O-N 3.28Å; N73-Q77 VanDerWaalsContact O-N 3.1Å; N73-F199 PolarHBondContact ND2-O 3.02Å
74	P	94.2	Very high	89.7	Confident	87 Å²	87	62.6 Å²	62.6	57%	0.565	34%	0.341	S	S	*	.	H	α-helix	trans	-59.5	-33.9	-179.1	-25.1	35.3	0	0	0	113.6	N72 A76 Q77 Q78	N72-P74 VanDerWaalsContact O-CD 3.32Å; N72-P74 WeakPolarHBondContact O-CD 3.44Å; P74-A76 VanDerWaalsContact C-N 3.34Å; P74-Q77 PolarHBondContact O-N 3.37Å; P74-Q78 WeakPolarHBondContact O-CG 3.49Å; P74-Q78 PolarHBondContact O-N 3.11Å
75	N	95.6	Very high	91.2	Very high	76 Å²	76	63.5 Å²	63.5	41%	0.406	35%	0.348	S	S	.	.	H	α-helix	trans	-69	-35.2	177.7	-59.1	-30.6	0	0	0	111.2	N73 F79 F199	N73-N75 PolarHBondContact O-N 3.16Å; N73-N75 WeakPolarHBondContact OD1-CA 3.33Å; N73-N75 VanDerWaalsContact OD1-CB 3.28Å; N73-N75 WeakPolarHBondContact OD1-CB 3.31Å; N73-N75 PolarHBondContact OD1-N 2.99Å; N75-F79 VanDerWaalsContact O-CB 3.28Å; N75-F79 WeakPolarHBondContact O-CB 3.37Å; N75-F79 PolarHBondContact O-N 3.3Å; N75-F199 HydrophobicContact CB-CB 4.41Å; N75-F199 HydrophobicContact CB-CD1 3.75Å; N75-F199 HydrophobicContact CB-CG 4.44Å
76	A	96.7	Very high	92.7	Very high	2 Å²	2	64.8 Å²	64.8	2%	0.017	35%	0.352	C	S	.	.	H	α-helix	trans	-67	-41.6	174.5	0	0	0	0	0	111.2	F70 N73 P74 F79 I80 F199	F70-A76 HydrophobicContact CB-CB 4.14Å; N73-A76 HydrophobicContact CB-CB 3.92Å; N73-A76 WeakPolarHBondContact O-CB 3.31Å; N73-A76 PolarHBondContact O-N 2.9Å; N73-A76 PolarHBondContact OD1-N 3.36Å; P74-A76 VanDerWaalsContact C-N 3.34Å; A76-F79 WeakPolarHBondContact O-CB 3.39Å; A76-F79 PolarHBondContact O-N 3.36Å; A76-I80 VanDerWaalsContact O-CG1 3.32Å; A76-I80 WeakPolarHBondContact O-CG1 3.39Å; A76-I80 PolarHBondContact O-N 3.06Å; A76-F199 HydrophobicContact CB-CD1 4.5Å; A76-F199 HydrophobicContact CB-CD2 3.97Å; A76-F199 HydrophobicContact CB-CE1 4.43Å; A76-F199 HydrophobicContact CB-CE2 3.87Å; A76-F199 HydrophobicContact CB-CG 4.29Å; A76-F199 HydrophobicContact CB-CZ 4.11Å
77	Q	95.7	Very high	94.3	Very high	65 Å²	65	57.6 Å²	57.6	30%	0.304	32%	0.316	S	S	.	.	H	α-helix	trans	-63.9	-45.6	176	-63.4	-60.2	-23.9	0	0	112	A71 N73 P74 F79 I80 D81	A71-Q77 PolarHBondContact O-NE2 3.43Å; N73-Q77 PolarHBondContact O-N 3.28Å; N73-Q77 VanDerWaalsContact O-N 3.1Å; P74-Q77 PolarHBondContact O-N 3.37Å; Q77-F79 VanDerWaalsContact C-N 3.27Å; Q77-F79 PolarHBondContact O-N 3.1Å; Q77-I80 PolarHBondContact O-N 2.9Å; Q77-D81 PolarHBondContact O-N 3.44Å
78	Q	96.9	Very high	94.9	Very high	125 Å²	125	58.4 Å²	58.4	58%	0.584	32%	0.324	S	S	*	.	H	α-helix	trans	-60.3	-37.9	174.1	-72.4	174.9	4.7	0	0	112.3	P74 D81 K82	P74-Q78 WeakPolarHBondContact O-CG 3.49Å; P74-Q78 PolarHBondContact O-N 3.11Å; Q78-D81 PolarHBondContact O-N 2.83Å; Q78-K82 WeakPolarHBondContact O-CB 3.28Å; Q78-K82 PolarHBondContact O-N 2.79Å
79	F	97.9	Very high	95.3	Very high	9 Å²	9	57 Å²	57	4%	0.039	31%	0.309	C	S	.	.	H	α-helix	trans	-65	-45	175.1	179.6	-90.9	0	0	0	111.6	N75 A76 Q77 D81 K82 M83 L98 F199 L212 E213 L216	N75-F79 VanDerWaalsContact O-CB 3.28Å; N75-F79 WeakPolarHBondContact O-CB 3.37Å; N75-F79 PolarHBondContact O-N 3.3Å; A76-F79 WeakPolarHBondContact O-CB 3.39Å; A76-F79 PolarHBondContact O-N 3.36Å; Q77-F79 VanDerWaalsContact C-N 3.27Å; Q77-F79 PolarHBondContact O-N 3.1Å; F79-D81 PolarHBondContact O-N 2.96Å; F79-K82 WeakPolarHBondContact O-CB 3.47Å; F79-K82 PolarHBondContact O-N 3.34Å; F79-M83 HydrophobicContact CD1-CG 4.02Å; F79-M83 HydrophobicContact CE1-CG 3.55Å; F79-M83 HydrophobicContact CE1-SD 4.31Å; F79-M83 HydrophobicContact CE2-CG 4.24Å; F79-M83 HydrophobicContact CE2-SD 4.19Å; F79-M83 HydrophobicContact CZ-CG 3.66Å; F79-M83 HydrophobicContact CZ-SD 3.8Å; F79-M83 VanDerWaalsContact O-CG 3.31Å; F79-M83 WeakPolarHBondContact O-CG 3.46Å; F79-M83 PolarHBondContact O-N 3.32Å; F79-L98 HydrophobicContact CD1-CD1 4.49Å; F79-F199 HydrophobicContact CB-CE1 3.7Å; F79-F199 HydrophobicContact CB-CZ 3.84Å; F79-F199 HydrophobicContact CD1-CZ 4.01Å; F79-F199 HydrophobicContact CD2-CE1 4.43Å; F79-F199 HydrophobicContact CD2-CZ 4.48Å; F79-F199 HydrophobicContact CG-CE1 4.02Å; F79-F199 AromaticContact CG-CZ 3.85Å; F79-F199 HydrophobicContact CG-CZ 3.85Å; F79-L212 HydrophobicContact CD1-CD2 4.27Å; F79-L212 HydrophobicContact CD2-CD2 4.41Å; F79-L212 HydrophobicContact CE1-CD2 3.87Å; F79-L212 HydrophobicContact CE1-CG 4.02Å; F79-L212 HydrophobicContact CE2-CB 4.17Å; F79-L212 HydrophobicContact CE2-CD2 4.01Å; F79-L212 HydrophobicContact CE2-CG 4.02Å; F79-L212 HydrophobicContact CZ-CB 4.11Å; F79-L212 HydrophobicContact CZ-CD2 3.74Å; F79-L212 HydrophobicContact CZ-CG 3.54Å; F79-E213 HydrophobicContact CE2-CB 4.02Å; F79-E213 HydrophobicContact CZ-CB 4.33Å; F79-L216 HydrophobicContact CE1-CD1 3.69Å; F79-L216 HydrophobicContact CZ-CD1 3.97Å
80	I	97	Very high	95.3	Very high	4 Å²	4	56.1 Å²	56.1	2%	0.021	30%	0.303	C	S	.	.	H	α-helix	trans	-57.8	-50	174.5	-67.5	164.6	0	0	0	110.2	A76 Q77 K82 M83 V84 R91 L94 Q95 L98	A76-I80 VanDerWaalsContact O-CG1 3.32Å; A76-I80 WeakPolarHBondContact O-CG1 3.39Å; A76-I80 PolarHBondContact O-N 3.06Å; Q77-I80 PolarHBondContact O-N 2.9Å; I80-K82 VanDerWaalsContact C-N 3.28Å; I80-K82 PolarHBondContact O-N 3.13Å; I80-M83 PolarHBondContact O-N 3.02Å; I80-M83 VanDerWaalsContact O-N 3.09Å; I80-V84 HydrophobicContact CG2-CG2 4.19Å; I80-V84 VanDerWaalsContact O-CG2 3.31Å; I80-V84 WeakPolarHBondContact O-CG2 3.36Å; I80-V84 PolarHBondContact O-N 2.84Å; I80-R91 HydrophobicContact CG2-CG 4.03Å; I80-L94 HydrophobicContact CG1-CB 4.24Å; I80-L94 HydrophobicContact CG2-CB 4.29Å; I80-L94 HydrophobicContact CG2-CD1 4.14Å; I80-Q95 HydrophobicContact CD1-CG 3.92Å; I80-L98 HydrophobicContact CD1-CD1 3.84Å; I80-L98 HydrophobicContact CG1-CD1 3.64Å
81	D	97.8	Very high	95.3	Very high	62 Å²	62	60.2 Å²	60.2	33%	0.332	32%	0.319	S	S	.	.	H	α-helix	trans	-57.4	-42.7	179	-69.5	-23.1	0	0	0	111.9	Q77 Q78 F79 N85 R91	Q77-D81 PolarHBondContact O-N 3.44Å; Q78-D81 PolarHBondContact O-N 2.83Å; F79-D81 PolarHBondContact O-N 2.96Å; D81-N85 VanDerWaalsContact O-CB 3.26Å; D81-N85 WeakPolarHBondContact O-CB 3.32Å; D81-N85 PolarHBondContact O-N 3.26Å; D81-N85 PolarHBondContact O-ND2 2.79Å; D81-N85 VanDerWaalsContact O-ND2 3.12Å; D81-R91 IonicContact OD1-CZ 2.72Å; D81-R91 IonicContact OD1-NH1 2.72Å; D81-R91 PolarHBondContact OD1-NH1 2.8Å; D81-R91 IonicContact OD1-NH2 3.58Å; D81-R91 PolarHBondContact OD1-NH2 2.88Å
82	K	98.4	Very high	95.6	Very high	79 Å²	79	63.7 Å²	63.7	34%	0.343	33%	0.33	S	S	.	.	H	α-helix	trans	-60.2	-47.8	174.7	176.4	-175.1	171.4	-170.3	0	111.5	Q78 F79 I80 N85 K86 E213	Q78-K82 WeakPolarHBondContact O-CB 3.28Å; Q78-K82 PolarHBondContact O-N 2.79Å; F79-K82 WeakPolarHBondContact O-CB 3.47Å; F79-K82 PolarHBondContact O-N 3.34Å; I80-K82 VanDerWaalsContact C-N 3.28Å; I80-K82 PolarHBondContact O-N 3.13Å; K82-N85 PolarHBondContact O-N 2.89Å; K82-K86 WeakPolarHBondContact O-CB 3.4Å; K82-K86 PolarHBondContact O-N 3.4Å; K82-E213 WeakPolarHBondContact CE-OE2 3.42Å; K82-E213 IonicContact NZ-OE2 2.7Å; K82-E213 PolarHBondContact NZ-OE2 3.17Å
83	M	98	Very high	95.8	Very high	0 Å²	0	56.7 Å²	56.7	0%	0	29%	0.292	C	S	.	.	H	α-helix	trans	-66.6	-39.6	-177.6	-66.4	-56.8	-69.9	0	0	112.1	F79 I80 H87 G88 F89 L94 E213 L216 L217	F79-M83 HydrophobicContact CD1-CG 4.02Å; F79-M83 HydrophobicContact CE1-CG 3.55Å; F79-M83 HydrophobicContact CE1-SD 4.31Å; F79-M83 HydrophobicContact CE2-CG 4.24Å; F79-M83 HydrophobicContact CE2-SD 4.19Å; F79-M83 HydrophobicContact CZ-CG 3.66Å; F79-M83 HydrophobicContact CZ-SD 3.8Å; F79-M83 VanDerWaalsContact O-CG 3.31Å; F79-M83 WeakPolarHBondContact O-CG 3.46Å; F79-M83 PolarHBondContact O-N 3.32Å; I80-M83 PolarHBondContact O-N 3.02Å; I80-M83 VanDerWaalsContact O-N 3.09Å; M83-H87 WeakPolarHBondContact O-CA 3.32Å; M83-H87 WeakPolarHBondContact O-CB 3.42Å; M83-H87 PolarHBondContact O-N 3.21Å; M83-G88 PolarHBondContact O-N 3.12Å; M83-F89 HydrophobicContact CB-CB 4.4Å; M83-F89 HydrophobicContact CB-CD2 4.21Å; M83-F89 HydrophobicContact CB-CG 4.49Å; M83-F89 HydrophobicContact CE-CD2 3.7Å; M83-F89 HydrophobicContact CE-CE2 3.37Å; M83-F89 HydrophobicContact CE-CZ 4.01Å; M83-F89 PolarHBondContact O-N 3.48Å; M83-L94 HydrophobicContact CB-CD1 3.6Å; M83-E213 HydrophobicContact CE-CG 4.28Å; M83-E213 HydrophobicContact SD-CB 3.92Å; M83-E213 HydrophobicContact SD-CG 3.72Å; M83-L216 HydrophobicContact CE-CB 4.14Å; M83-L217 HydrophobicContact CE-CG 4.43Å
84	V	97.2	Very high	95.9	Very high	33 Å²	33	55.6 Å²	55.6	20%	0.2	29%	0.287	C	S	.	.	H	α-helix	trans	-62.5	-54.6	174	174.4	0	0	0	0	110.2	I80 G88 R91 L94	I80-V84 HydrophobicContact CG2-CG2 4.19Å; I80-V84 VanDerWaalsContact O-CG2 3.31Å; I80-V84 WeakPolarHBondContact O-CG2 3.36Å; I80-V84 PolarHBondContact O-N 2.84Å; V84-G88 VanDerWaalsContact O-CA 3.3Å; V84-G88 WeakPolarHBondContact O-CA 3.36Å; V84-G88 PolarHBondContact O-N 3.06Å; V84-R91 HydrophobicContact CG2-CB 3.87Å; V84-R91 HydrophobicContact CG2-CG 4.46Å; V84-L94 HydrophobicContact CG2-CD1 4.05Å
85	N	97.9	Very high	95.8	Very high	133 Å²	133	54.5 Å²	54.5	71%	0.711	27%	0.274	S	S	*	.	H	α-helix	trans	-70.5	-37.3	-172.7	-68.2	-26.1	0	0	0	113.3	D81 K82	D81-N85 VanDerWaalsContact O-CB 3.26Å; D81-N85 WeakPolarHBondContact O-CB 3.32Å; D81-N85 PolarHBondContact O-N 3.26Å; D81-N85 PolarHBondContact O-ND2 2.79Å; D81-N85 VanDerWaalsContact O-ND2 3.12Å; K82-N85 PolarHBondContact O-N 2.89Å
86	K	98.1	Very high	95.6	Very high	127 Å²	127	51.1 Å²	51.1	55%	0.552	26%	0.256	S	S	*	.	H	α-helix	trans	-88	-37.6	-174.1	-172.8	179.6	170.8	-168.2	0	112.9	K82 E213	K82-K86 WeakPolarHBondContact O-CB 3.4Å; K82-K86 PolarHBondContact O-N 3.4Å; K86-E213 IonicContact NZ-OE1 3.2Å; K86-E213 PolarHBondContact NZ-OE1 3.12Å
87	H	96.8	Very high	95.5	Very high	44 Å²	44	51 Å²	51	20%	0.204	26%	0.255	C	S	.	.	H	α-helix	trans	-121.3	-1	-168.4	-60.9	-61.8	0	0	0	113.7	M83 F89 E213 L217 R220	M83-H87 WeakPolarHBondContact O-CA 3.32Å; M83-H87 WeakPolarHBondContact O-CB 3.42Å; M83-H87 PolarHBondContact O-N 3.21Å; H87-F89 VanDerWaalsContact C-N 3.32Å; H87-F89 HydrophobicContact CB-CD2 3.65Å; H87-F89 HydrophobicContact CB-CE2 3.79Å; H87-F89 PolarHBondContact O-N 3.26Å; H87-E213 IonicContact CD2-OE1 2.75Å; H87-E213 IonicContact CE1-OE1 3.58Å; H87-E213 IonicContact NE2-OE1 3.79Å; H87-E213 PolarHBondContact NE2-OE1 3.02Å; H87-L217 HydrophobicContact CB-CD2 4.12Å; H87-R220 PolarHBondContact O-NH1 3.35Å
88	G	95.2	Very high	95.5	Very high	49 Å²	49	48.2 Å²	48.2	51%	0.505	24%	0.242	S	C	.	.			trans	67.7	29.7	177.4	0	0	0	0	0	113.6	M83 V84	M83-G88 PolarHBondContact O-N 3.12Å; V84-G88 VanDerWaalsContact O-CA 3.3Å; V84-G88 WeakPolarHBondContact O-CA 3.36Å; V84-G88 PolarHBondContact O-N 3.06Å
89	F	96.3	Very high	95.3	Very high	6 Å²	6	42.7 Å²	42.7	3%	0.026	22%	0.217	C	C	.	.			trans	-67.8	146.4	173.8	-86.2	-93	0	0	0	111.6	G53 F55 M83 H87 R91 L94 L216 L217 R220	G53-F89 WeakPolarHBondContact O-CA 3.3Å; F55-F89 HydrophobicContact CD1-CE1 4.41Å; F55-F89 HydrophobicContact CE1-CD1 4.43Å; F55-F89 AromaticContact CE1-CE1 3.59Å; F55-F89 HydrophobicContact CE1-CE1 3.59Å; F55-F89 HydrophobicContact CE1-CZ 4.39Å; F55-F89 HydrophobicContact CE2-CD1 4.13Å; F55-F89 HydrophobicContact CE2-CE1 4.09Å; F55-F89 AromaticContact CZ-CD1 3.82Å; F55-F89 HydrophobicContact CZ-CD1 3.82Å; F55-F89 AromaticContact CZ-CE1 3.39Å; F55-F89 HydrophobicContact CZ-CE1 3.39Å; F55-F89 HydrophobicContact CZ-CZ 4.39Å; M83-F89 HydrophobicContact CB-CB 4.4Å; M83-F89 HydrophobicContact CB-CD2 4.21Å; M83-F89 HydrophobicContact CB-CG 4.49Å; M83-F89 HydrophobicContact CE-CD2 3.7Å; M83-F89 HydrophobicContact CE-CE2 3.37Å; M83-F89 HydrophobicContact CE-CZ 4.01Å; M83-F89 PolarHBondContact O-N 3.48Å; H87-F89 VanDerWaalsContact C-N 3.32Å; H87-F89 HydrophobicContact CB-CD2 3.65Å; H87-F89 HydrophobicContact CB-CE2 3.79Å; H87-F89 PolarHBondContact O-N 3.26Å; F89-R91 PolarHBondContact O-N 3Å; F89-L94 HydrophobicContact CB-CD1 3.53Å; F89-L94 HydrophobicContact CB-CD2 4.38Å; F89-L94 HydrophobicContact CB-CG 3.97Å; F89-L94 HydrophobicContact CD1-CD2 4.07Å; F89-L94 HydrophobicContact CD1-CG 4.38Å; F89-L94 HydrophobicContact CG-CD1 4.25Å; F89-L94 HydrophobicContact CG-CD2 4.3Å; F89-L94 HydrophobicContact CG-CG 4.41Å; F89-L216 HydrophobicContact CZ-CB 4.36Å; F89-L217 HydrophobicContact CE2-CD2 3.75Å; F89-L217 HydrophobicContact CE2-CG 4.34Å; F89-L217 HydrophobicContact CZ-CD2 4.21Å; F89-R220 HydrophobicContact CE1-CB 3.96Å; F89-R220 HydrophobicContact CE1-CG 4.35Å; F89-R220 HydrophobicContact CZ-CB 3.94Å; F89-R220 HydrophobicContact CZ-CG 4.45Å
90	D	93.8	Very high	95.2	Very high	63 Å²	63	43.2 Å²	43.2	34%	0.337	22%	0.22	S	C	.	.			trans	-65.8	124.5	167.4	-178.8	-96.7	0	0	0	110.7	G53 Q92 Q93 L94	G53-D90 PolarHBondContact O-N 3.3Å; D90-Q92 VanDerWaalsContact C-N 3.32Å; D90-Q92 PolarHBondContact O-N 3.1Å; D90-Q92 WeakPolarHBondContact OD1-CA 3.41Å; D90-Q92 VanDerWaalsContact OD1-CB 3.29Å; D90-Q92 WeakPolarHBondContact OD1-CB 3.4Å; D90-Q92 PolarHBondContact OD1-N 3.1Å; D90-Q93 HydrophobicContact CB-CB 4.28Å; D90-Q93 HydrophobicContact CB-CG 4.3Å; D90-Q93 PolarHBondContact OD1-N 2.86Å; D90-L94 WeakPolarHBondContact O-CG 3.34Å; D90-L94 PolarHBondContact O-N 3.38Å
91	R	93	Very high	95.1	Very high	89 Å²	89	43 Å²	43	34%	0.336	22%	0.219	S	C	.	.	H	α-helix	trans	-64.1	-40.3	-177.5	177.7	176.8	-67.5	-86.5	0.2	111.4	I80 D81 V84 F89 L94 Q95	I80-R91 HydrophobicContact CG2-CG 4.03Å; D81-R91 IonicContact OD1-CZ 2.72Å; D81-R91 IonicContact OD1-NH1 2.72Å; D81-R91 PolarHBondContact OD1-NH1 2.8Å; D81-R91 IonicContact OD1-NH2 3.58Å; D81-R91 PolarHBondContact OD1-NH2 2.88Å; V84-R91 HydrophobicContact CG2-CB 3.87Å; V84-R91 HydrophobicContact CG2-CG 4.46Å; F89-R91 PolarHBondContact O-N 3Å; R91-L94 PolarHBondContact O-N 3.48Å; R91-Q95 HydrophobicContact CG-CG 4.4Å; R91-Q95 VanDerWaalsContact O-CG 3.29Å; R91-Q95 WeakPolarHBondContact O-CG 3.48Å; R91-Q95 PolarHBondContact O-N 2.87Å
92	Q	91.3	Very high	95.1	Very high	102 Å²	102	44.1 Å²	44.1	48%	0.477	22%	0.221	S	C	.	.	H	α-helix	trans	-66.3	-47	-175.5	-178.9	-175.3	-28.6	0	0	109.8	D90 L94 Q95 E96	D90-Q92 VanDerWaalsContact C-N 3.32Å; D90-Q92 PolarHBondContact O-N 3.1Å; D90-Q92 WeakPolarHBondContact OD1-CA 3.41Å; D90-Q92 VanDerWaalsContact OD1-CB 3.29Å; D90-Q92 WeakPolarHBondContact OD1-CB 3.4Å; D90-Q92 PolarHBondContact OD1-N 3.1Å; Q92-L94 VanDerWaalsContact C-N 3.34Å; Q92-L94 PolarHBondContact O-N 3.4Å; Q92-Q95 CarbonylContact O-C 3.58Å; Q92-Q95 WeakPolarHBondContact O-CB 3.42Å; Q92-Q95 PolarHBondContact O-N 3.46Å; Q92-Q95 VanDerWaalsContact O-N 3.11Å; Q92-E96 HydrophobicContact CG-CG 4.44Å; Q92-E96 WeakPolarHBondContact CG-OE1 3.32Å; Q92-E96 PolarHBondContact NE2-OE1 2.8Å; Q92-E96 VanDerWaalsContact O-CG 3.31Å; Q92-E96 WeakPolarHBondContact O-CG 3.21Å; Q92-E96 PolarHBondContact O-N 2.83Å
93	Q	91.6	Very high	95	Very high	13 Å²	13	44.6 Å²	44.6	6%	0.061	22%	0.22	C	C	.	.	H	α-helix	trans	-60.9	-41	175.8	-73.4	-162.3	-18.5	0	0	112.9	G54 F55 L57 D90 Q95 E96 I97	G54-Q93 VanDerWaalsContact C-OE1 3.25Å; F55-Q93 HydrophobicContact CD2-CB 4.37Å; F55-Q93 PolarHBondContact O-NE2 2.87Å; L57-Q93 HydrophobicContact CD1-CG 4.37Å; D90-Q93 HydrophobicContact CB-CB 4.28Å; D90-Q93 HydrophobicContact CB-CG 4.3Å; D90-Q93 PolarHBondContact OD1-N 2.86Å; Q93-Q95 VanDerWaalsContact C-N 3.3Å; Q93-Q95 PolarHBondContact O-N 2.78Å; Q93-E96 WeakPolarHBondContact O-CB 3.45Å; Q93-E96 PolarHBondContact O-N 3.44Å; Q93-I97 WeakPolarHBondContact O-CG1 3.42Å; Q93-I97 PolarHBondContact O-N 2.7Å
94	L	94.2	Very high	95	Very high	0 Å²	0	46.4 Å²	46.4	0%	0	23%	0.229	C	C	.	.	H	α-helix	trans	-60.7	-41.9	174.5	-73.9	174	0	0	0	111.8	F55 I80 M83 V84 F89 D90 R91 Q92 I97 L98 L216	F55-L94 HydrophobicContact CE2-CD2 4.06Å; F55-L94 HydrophobicContact CZ-CD2 4.06Å; I80-L94 HydrophobicContact CG1-CB 4.24Å; I80-L94 HydrophobicContact CG2-CB 4.29Å; I80-L94 HydrophobicContact CG2-CD1 4.14Å; M83-L94 HydrophobicContact CB-CD1 3.6Å; V84-L94 HydrophobicContact CG2-CD1 4.05Å; F89-L94 HydrophobicContact CB-CD1 3.53Å; F89-L94 HydrophobicContact CB-CD2 4.38Å; F89-L94 HydrophobicContact CB-CG 3.97Å; F89-L94 HydrophobicContact CD1-CD2 4.07Å; F89-L94 HydrophobicContact CD1-CG 4.38Å; F89-L94 HydrophobicContact CG-CD1 4.25Å; F89-L94 HydrophobicContact CG-CD2 4.3Å; F89-L94 HydrophobicContact CG-CG 4.41Å; D90-L94 WeakPolarHBondContact O-CG 3.34Å; D90-L94 PolarHBondContact O-N 3.38Å; R91-L94 PolarHBondContact O-N 3.48Å; Q92-L94 VanDerWaalsContact C-N 3.34Å; Q92-L94 PolarHBondContact O-N 3.4Å; L94-I97 HydrophobicContact CD2-CD1 4.45Å; L94-I97 WeakPolarHBondContact O-CG1 3.36Å; L94-L98 VanDerWaalsContact O-CB 3.29Å; L94-L98 WeakPolarHBondContact O-CB 3.3Å; L94-L98 VanDerWaalsContact O-CG 3.31Å; L94-L98 WeakPolarHBondContact O-CG 3.4Å; L94-L98 PolarHBondContact O-N 2.85Å; L94-L98 VanDerWaalsContact O-N 3.1Å; L94-L216 HydrophobicContact CD2-CD1 3.91Å
95	Q	92.8	Very high	95	Very high	63 Å²	63	48.5 Å²	48.5	29%	0.294	24%	0.24	S	C	.	.	H	α-helix	trans	-64.8	-41.1	175.1	-72.6	172.2	-21.7	0	0	111.4	I80 R91 Q92 Q93 L98 S99	I80-Q95 HydrophobicContact CD1-CG 3.92Å; R91-Q95 HydrophobicContact CG-CG 4.4Å; R91-Q95 VanDerWaalsContact O-CG 3.29Å; R91-Q95 WeakPolarHBondContact O-CG 3.48Å; R91-Q95 PolarHBondContact O-N 2.87Å; Q92-Q95 CarbonylContact O-C 3.58Å; Q92-Q95 WeakPolarHBondContact O-CB 3.42Å; Q92-Q95 PolarHBondContact O-N 3.46Å; Q92-Q95 VanDerWaalsContact O-N 3.11Å; Q93-Q95 VanDerWaalsContact C-N 3.3Å; Q93-Q95 PolarHBondContact O-N 2.78Å; Q95-L98 PolarHBondContact O-N 3.04Å; Q95-S99 VanDerWaalsContact O-CB 3.24Å; Q95-S99 WeakPolarHBondContact O-CB 3.46Å; Q95-S99 PolarHBondContact O-N 2.77Å; Q95-S99 PolarHBondContact O-OG 3.06Å
96	E	91.5	Very high	95	Very high	5 Å²	5	44.7 Å²	44.7	2%	0.023	22%	0.224	C	C	.	.	H	α-helix	trans	-61.3	-51.9	177.7	-74.5	167.5	-179.5	0	0	111.7	M64 Q92 Q93 L98 S99 Q100	M64-E96 HydrophobicContact CB-CG 4.32Å; Q92-E96 HydrophobicContact CG-CG 4.44Å; Q92-E96 WeakPolarHBondContact CG-OE1 3.32Å; Q92-E96 PolarHBondContact NE2-OE1 2.8Å; Q92-E96 VanDerWaalsContact O-CG 3.31Å; Q92-E96 WeakPolarHBondContact O-CG 3.21Å; Q92-E96 PolarHBondContact O-N 2.83Å; Q93-E96 WeakPolarHBondContact O-CB 3.45Å; Q93-E96 PolarHBondContact O-N 3.44Å; E96-L98 PolarHBondContact O-N 3.02Å; E96-S99 PolarHBondContact O-N 2.97Å; E96-S99 PolarHBondContact O-OG 2.98Å; E96-Q100 WeakPolarHBondContact O-CG 3.41Å; E96-Q100 PolarHBondContact O-N 3.13Å; E96-Q100 PolarHBondContact O-NE2 3.32Å
97	I	94	Very high	95	Very high	0 Å²	0	38.7 Å²	38.7	0%	0	20%	0.198	C	C	.	.	H	α-helix	trans	-66.7	-37.6	-179.5	65.5	165.3	0	0	0	111.8	F55 L57 Q93 L94 Q100 A101 L191 L216 P226 L227	F55-I97 HydrophobicContact CD2-CD1 4.22Å; F55-I97 HydrophobicContact CD2-CG2 4.32Å; F55-I97 HydrophobicContact CE2-CD1 3.44Å; F55-I97 VanDerWaalsContact CE2-CD1 3.44Å; F55-I97 HydrophobicContact CE2-CG1 4.27Å; F55-I97 HydrophobicContact CZ-CD1 3.63Å; L57-I97 HydrophobicContact CD1-CG2 4.29Å; L57-I97 HydrophobicContact CD2-CG2 3.65Å; Q93-I97 WeakPolarHBondContact O-CG1 3.42Å; Q93-I97 PolarHBondContact O-N 2.7Å; L94-I97 HydrophobicContact CD2-CD1 4.45Å; L94-I97 WeakPolarHBondContact O-CG1 3.36Å; I97-Q100 PolarHBondContact O-N 3.31Å; I97-A101 PolarHBondContact O-N 2.94Å; I97-L191 HydrophobicContact CB-CD2 4.12Å; I97-L191 HydrophobicContact CD1-CD1 4.32Å; I97-L216 HydrophobicContact CD1-CD1 4.27Å; I97-L216 HydrophobicContact CD1-CD2 3.62Å; I97-P226 HydrophobicContact CD1-CG 3.96Å; I97-P226 HydrophobicContact CG2-CG 4.08Å; I97-L227 HydrophobicContact CB-CD1 4.5Å; I97-L227 HydrophobicContact CG2-CD1 4.17Å
98	L	94.9	Very high	94.9	Very high	6 Å²	6	37.5 Å²	37.5	3%	0.031	19%	0.193	C	C	.	.	H	α-helix	trans	-75.3	-27.6	179.8	-72.5	174.5	0	0	0	112.7	F79 I80 L94 Q95 E96 Q100 A101 L191 A195 F199	F79-L98 HydrophobicContact CD1-CD1 4.49Å; I80-L98 HydrophobicContact CD1-CD1 3.84Å; I80-L98 HydrophobicContact CG1-CD1 3.64Å; L94-L98 VanDerWaalsContact O-CB 3.29Å; L94-L98 WeakPolarHBondContact O-CB 3.3Å; L94-L98 VanDerWaalsContact O-CG 3.31Å; L94-L98 WeakPolarHBondContact O-CG 3.4Å; L94-L98 PolarHBondContact O-N 2.85Å; L94-L98 VanDerWaalsContact O-N 3.1Å; Q95-L98 PolarHBondContact O-N 3.04Å; E96-L98 PolarHBondContact O-N 3.02Å; L98-Q100 PolarHBondContact O-N 2.95Å; L98-A101 PolarHBondContact O-N 3.45Å; L98-L191 HydrophobicContact CD2-CD1 4.41Å; L98-A195 HydrophobicContact CD2-CB 4.41Å; L98-F199 HydrophobicContact CD2-CE2 4.1Å
99	S	93.8	Very high	95	Very high	9 Å²	9	42.6 Å²	42.6	6%	0.063	20%	0.197	C	C	.	.	H	α-helix	trans	-64.5	-31.1	171	74.1	0	0	0	0	111.8	Q65 G67 G68 Q95 E96	Q65-S99 WeakPolarHBondContact O-CB 3.31Å; G67-S99 WeakPolarHBondContact O-CA 3.34Å; G67-S99 WeakPolarHBondContact O-CB 3.37Å; G68-S99 VanDerWaalsContact CA-O 3.27Å; G68-S99 WeakPolarHBondContact CA-O 3.37Å; Q95-S99 VanDerWaalsContact O-CB 3.24Å; Q95-S99 WeakPolarHBondContact O-CB 3.46Å; Q95-S99 PolarHBondContact O-N 2.77Å; Q95-S99 PolarHBondContact O-OG 3.06Å; E96-S99 PolarHBondContact O-N 2.97Å; E96-S99 PolarHBondContact O-OG 2.98Å
100	Q	94.8	Very high	94.9	Very high	20 Å²	20	45.8 Å²	45.8	9%	0.093	21%	0.213	C	C	.	.	H	α-helix	trans	-89.6	-14.8	178.9	-65.9	177.8	74	0	0	113.2	H61 E96 I97 L98 R189 L227	H61-Q100 PolarHBondContact O-NE2 2.86Å; E96-Q100 WeakPolarHBondContact O-CG 3.41Å; E96-Q100 PolarHBondContact O-N 3.13Å; E96-Q100 PolarHBondContact O-NE2 3.32Å; I97-Q100 PolarHBondContact O-N 3.31Å; L98-Q100 PolarHBondContact O-N 2.95Å; Q100-R189 PolarHBondContact O-NH2 3.19Å; Q100-L227 HydrophobicContact CB-CD1 4.4Å; Q100-L227 HydrophobicContact CB-CD2 3.86Å
101	A	96.3	Very high	94.8	Very high	0 Å²	0	43 Å²	43	0%	0	20%	0.198	C	C	.	.			trans	-66.7	139.3	174.8	0	0	0	0	0	110.8	F70 I97 L98 L191 D192 A195	F70-A101 HydrophobicContact CD2-CB 3.83Å; F70-A101 HydrophobicContact CE2-CB 3.76Å; I97-A101 PolarHBondContact O-N 2.94Å; L98-A101 PolarHBondContact O-N 3.45Å; A101-L191 HydrophobicContact CB-CD2 4.1Å; A101-L191 HydrophobicContact CB-CG 4.09Å; A101-D192 VanDerWaalsContact CA-OD1 3.27Å; A101-D192 WeakPolarHBondContact CA-OD1 3.2Å; A101-A195 HydrophobicContact CB-CB 4.39Å
102	K	97	Very high	94.8	Very high	86 Å²	86	42.4 Å²	42.4	37%	0.374	20%	0.202	S	C	.	.			trans	-107.2	135.7	-178.9	-61.6	-59.2	178.6	-168.1	0	111.3	D69 L104 D192 T196	D69-K102 WeakPolarHBondContact OD2-CA 3.45Å; K102-L104 HydrophobicContact CB-CD2 4.22Å; K102-L104 PolarHBondContact O-N 3.08Å; K102-D192 PolarHBondContact N-OD1 2.97Å; K102-T196 PolarHBondContact O-OG1 3.36Å
103	R	97.2	Very high	94.6	Very high	89 Å²	89	43.9 Å²	43.9	34%	0.336	21%	0.213	S	C	.	.			trans	-75.6	119.4	170.5	179.2	-175	166.5	-76.5	-8	109	D69 F70 D105 L108 T196 N200	D69-R103 HydrophobicContact CB-CB 3.7Å; D69-R103 PolarHBondContact OD2-N 3.22Å; F70-R103 HydrophobicContact CE1-CB 4.38Å; F70-R103 HydrophobicContact CZ-CB 4.02Å; R103-D105 IonicContact CZ-OD1 2.78Å; R103-D105 IonicContact NH1-OD1 3.42Å; R103-D105 PolarHBondContact NH1-OD1 2.93Å; R103-D105 IonicContact NH1-OD2 2.76Å; R103-D105 PolarHBondContact NH1-OD2 3.29Å; R103-D105 IonicContact NH2-OD1 3.39Å; R103-D105 PolarHBondContact NH2-OD1 2.91Å; R103-L108 VanDerWaalsContact NH2-CD1 3.33Å; R103-T196 WeakPolarHBondContact CA-OG1 3.32Å; R103-T196 HydrophobicContact CG-CG2 4.42Å; R103-N200 WeakPolarHBondContact CD-OD1 3.49Å
104	L	97.8	Very high	94.3	Very high	37 Å²	37	49.2 Å²	49.2	19%	0.194	24%	0.238	C	C	.	.			trans	-105	99.6	-174.1	-59.3	-179.4	0	0	0	112	K102 S106 V107 L108 T188 D192 T196	K102-L104 HydrophobicContact CB-CD2 4.22Å; K102-L104 PolarHBondContact O-N 3.08Å; L104-S106 PolarHBondContact O-N 3.02Å; L104-V107 HydrophobicContact CB-CB 3.9Å; L104-V107 HydrophobicContact CB-CG2 3.54Å; L104-V107 HydrophobicContact CD1-CG2 3.67Å; L104-V107 HydrophobicContact CG-CG2 4.26Å; L104-V107 WeakPolarHBondContact O-CB 3.27Å; L104-V107 PolarHBondContact O-N 3.12Å; L104-L108 PolarHBondContact O-N 3.13Å; L104-T188 HydrophobicContact CD1-CG2 3.44Å; L104-T188 VanDerWaalsContact CD1-CG2 3.44Å; L104-D192 HydrophobicContact CD1-CB 3.63Å; L104-D192 HydrophobicContact CG-CB 4.07Å; L104-T196 HydrophobicContact CB-CG2 4.49Å; L104-T196 PolarHBondContact N-OG1 2.93Å
105	D	97.4	Very high	93.6	Very high	78 Å²	78	50.3 Å²	50.3	42%	0.417	25%	0.247	S	C	.	.	H	α-helix	trans	-57.4	-31.9	173.5	-79.7	-44.5	0	0	0	113	R103 V107 L108 R109	R103-D105 IonicContact CZ-OD1 2.78Å; R103-D105 IonicContact NH1-OD1 3.42Å; R103-D105 PolarHBondContact NH1-OD1 2.93Å; R103-D105 IonicContact NH1-OD2 2.76Å; R103-D105 PolarHBondContact NH1-OD2 3.29Å; R103-D105 IonicContact NH2-OD1 3.39Å; R103-D105 PolarHBondContact NH2-OD1 2.91Å; D105-V107 VanDerWaalsContact C-N 3.32Å; D105-V107 PolarHBondContact O-N 2.92Å; D105-L108 PolarHBondContact O-N 3.37Å; D105-R109 WeakPolarHBondContact O-CG 3.09Å; D105-R109 PolarHBondContact O-N 3.01Å
106	S	97.3	Very high	92.6	Very high	53 Å²	53	53.4 Å²	53.4	37%	0.371	27%	0.273	S	S	.	.	H	α-helix	trans	-61.9	-38.7	174.8	54.3	0	0	0	0	112.5	L104 L110	L104-S106 PolarHBondContact O-N 3.02Å; S106-L110 WeakPolarHBondContact O-CB 3.36Å; S106-L110 VanDerWaalsContact O-CG 3.25Å; S106-L110 WeakPolarHBondContact O-CG 3.23Å; S106-L110 PolarHBondContact O-N 3.24Å
107	V	97.3	Very high	91.5	Very high	1 Å²	1	57.6 Å²	57.6	1%	0.006	30%	0.298	C	S	.	.	H	α-helix	trans	-65.3	-46	177.4	168.5	0	0	0	0	110.4	L104 D105 R109 L110 M111 T188 T196 L197 F233	L104-V107 HydrophobicContact CB-CB 3.9Å; L104-V107 HydrophobicContact CB-CG2 3.54Å; L104-V107 HydrophobicContact CD1-CG2 3.67Å; L104-V107 HydrophobicContact CG-CG2 4.26Å; L104-V107 WeakPolarHBondContact O-CB 3.27Å; L104-V107 PolarHBondContact O-N 3.12Å; D105-V107 VanDerWaalsContact C-N 3.32Å; D105-V107 PolarHBondContact O-N 2.92Å; V107-R109 PolarHBondContact O-N 2.93Å; V107-L110 PolarHBondContact O-N 3.09Å; V107-M111 WeakPolarHBondContact O-CB 3.36Å; V107-M111 PolarHBondContact O-N 3Å; V107-T188 HydrophobicContact CG2-CG2 4.45Å; V107-T196 HydrophobicContact CB-CG2 4.36Å; V107-T196 HydrophobicContact CG1-CG2 4.35Å; V107-L197 HydrophobicContact CG1-CD1 3.87Å; V107-L197 HydrophobicContact CG1-CD2 3.77Å; V107-L197 HydrophobicContact CG1-CG 3.64Å; V107-F233 HydrophobicContact CG1-CD2 4.43Å; V107-F233 VanDerWaalsContact CG1-O 3.31Å; V107-F233 WeakPolarHBondContact CG1-O 3.37Å; V107-F233 HydrophobicContact CG2-CB 4.15Å
108	L	96.3	Very high	90	Very high	19 Å²	19	64.9 Å²	64.9	10%	0.099	34%	0.343	C	S	.	.	H	α-helix	trans	-59.5	-49.1	177.8	-60.7	177	0	0	0	111	R103 L104 D105 L110 M111 D112 T196 N200 Y201	R103-L108 VanDerWaalsContact NH2-CD1 3.33Å; L104-L108 PolarHBondContact O-N 3.13Å; D105-L108 PolarHBondContact O-N 3.37Å; L108-L110 VanDerWaalsContact C-N 3.35Å; L108-L110 PolarHBondContact O-N 3.5Å; L108-M111 PolarHBondContact O-N 3.03Å; L108-D112 PolarHBondContact O-N 3.31Å; L108-T196 HydrophobicContact CD1-CG2 4.33Å; L108-T196 HydrophobicContact CD2-CG2 3.72Å; L108-T196 HydrophobicContact CG-CG2 3.77Å; L108-N200 HydrophobicContact CD1-CB 4.44Å; L108-Y201 HydrophobicContact CD2-CD2 3.84Å; L108-Y201 HydrophobicContact CD2-CG 4.19Å
109	R	95.7	Very high	88.4	Confident	156 Å²	156	69.5 Å²	69.5	59%	0.589	38%	0.376	S	S	*	.	H	α-helix	trans	-58.4	-43.5	176.6	-71.4	-170.7	-55.1	-109	3.7	112.7	D105 V107 D112 N113	D105-R109 WeakPolarHBondContact O-CG 3.09Å; D105-R109 PolarHBondContact O-N 3.01Å; V107-R109 PolarHBondContact O-N 2.93Å; R109-D112 PolarHBondContact O-N 3.11Å; R109-N113 PolarHBondContact O-N 3.48Å; R109-N113 PolarHBondContact O-ND2 3.35Å
110	L	94.2	Very high	87.1	Confident	73 Å²	73	74.3 Å²	74.3	38%	0.382	41%	0.405	S	S	.	.	H	α-helix	trans	-66.3	-38.3	179.1	-73.6	170.6	0	0	0	112	S106 V107 L108 N113 Q114 F233	S106-L110 WeakPolarHBondContact O-CB 3.36Å; S106-L110 VanDerWaalsContact O-CG 3.25Å; S106-L110 WeakPolarHBondContact O-CG 3.23Å; S106-L110 PolarHBondContact O-N 3.24Å; V107-L110 PolarHBondContact O-N 3.09Å; L108-L110 VanDerWaalsContact C-N 3.35Å; L108-L110 PolarHBondContact O-N 3.5Å; L110-N113 PolarHBondContact O-N 3.25Å; L110-Q114 WeakPolarHBondContact O-CG 3.31Å; L110-Q114 PolarHBondContact O-N 3.43Å; L110-F233 HydrophobicContact CB-CD2 3.63Å; L110-F233 HydrophobicContact CB-CE1 4.47Å; L110-F233 HydrophobicContact CB-CE2 3.49Å; L110-F233 VanDerWaalsContact CB-CE2 3.49Å; L110-F233 HydrophobicContact CB-CG 4.21Å; L110-F233 HydrophobicContact CB-CZ 3.95Å; L110-F233 HydrophobicContact CD1-CB 4Å; L110-F233 HydrophobicContact CD1-CD1 3.99Å; L110-F233 HydrophobicContact CD1-CD2 3.94Å; L110-F233 HydrophobicContact CD1-CE2 4.47Å; L110-F233 HydrophobicContact CD1-CG 3.68Å; L110-F233 HydrophobicContact CG-CD2 4.45Å
111	M	92.8	Very high	86	Confident	4 Å²	4	82 Å²	82	2%	0.02	44%	0.438	C	S	.	.	H	α-helix	trans	-69.7	-33.1	177.9	-166.1	62.3	65.6	0	0	112.4	V107 L108 Q114 A115 L197 Y201 R203 F208 F233 A234	V107-M111 WeakPolarHBondContact O-CB 3.36Å; V107-M111 PolarHBondContact O-N 3Å; L108-M111 PolarHBondContact O-N 3.03Å; M111-Q114 PolarHBondContact O-N 3.03Å; M111-A115 PolarHBondContact O-N 3.21Å; M111-L197 HydrophobicContact CB-CD2 4.12Å; M111-L197 HydrophobicContact CE-CD1 3.76Å; M111-L197 HydrophobicContact CE-CD2 3.87Å; M111-L197 HydrophobicContact CG-CD2 4.03Å; M111-Y201 HydrophobicContact CB-CE1 4.22Å; M111-Y201 HydrophobicContact CB-CE2 4.38Å; M111-Y201 HydrophobicContact CG-CD1 4.11Å; M111-Y201 HydrophobicContact CG-CE1 3.3Å; M111-Y201 HydrophobicContact CG-CE2 4.29Å; M111-Y201 WeakPolarHBondContact CG-OH 3.38Å; M111-Y201 PolarHBondContact O-OH 3.19Å; M111-R203 PolarHBondContact O-NH2 2.78Å; M111-F208 HydrophobicContact CE-CE1 4.24Å; M111-F208 HydrophobicContact CE-CE2 4.03Å; M111-F208 HydrophobicContact CE-CZ 3.44Å; M111-F208 VanDerWaalsContact CE-CZ 3.44Å; M111-F208 HydrophobicContact SD-CE2 4.39Å; M111-F208 HydrophobicContact SD-CZ 4.13Å; M111-F233 HydrophobicContact CE-CE2 4.1Å; M111-A234 HydrophobicContact CE-CB 3.87Å
112	D	92	Very high	84.9	Confident	77 Å²	77	86.7 Å²	86.7	41%	0.412	47%	0.469	S	S	.	.	H	α-helix	trans	-70.9	-39	172.9	-77.5	-33.4	0	0	0	112.3	L108 R109 Q114 A115 Y201 R203	L108-D112 PolarHBondContact O-N 3.31Å; R109-D112 PolarHBondContact O-N 3.11Å; D112-Q114 PolarHBondContact O-N 3.26Å; D112-A115 WeakPolarHBondContact O-CB 3.32Å; D112-A115 PolarHBondContact O-N 3.48Å; D112-Y201 WeakPolarHBondContact OD1-CE2 3.24Å; D112-Y201 PolarHBondContact OD1-OH 2.88Å; D112-Y201 VanDerWaalsContact OD1-OH 3.07Å; D112-R203 IonicContact OD1-CZ 3.49Å; D112-R203 IonicContact OD1-NH1 2.74Å; D112-R203 PolarHBondContact OD1-NH1 3.06Å
113	N	88.9	Confident	84	Confident	132 Å²	132	86.6 Å²	86.6	71%	0.706	48%	0.476	S	S	*	.	H	α-helix	trans	-64	-23.1	175.3	-70.5	-17	0	0	0	113.4	R109 L110	R109-N113 PolarHBondContact O-N 3.48Å; R109-N113 PolarHBondContact O-ND2 3.35Å; L110-N113 PolarHBondContact O-N 3.25Å
114	Q	83.9	Confident	83.3	Confident	126 Å²	126	88.7 Å²	88.7	59%	0.589	51%	0.505	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.4	-5.7	175.4	-69	-174.2	-12.2	0	0	113.3	L110 M111 D112	L110-Q114 WeakPolarHBondContact O-CG 3.31Å; L110-Q114 PolarHBondContact O-N 3.43Å; M111-Q114 PolarHBondContact O-N 3.03Å; D112-Q114 PolarHBondContact O-N 3.26Å
115	A	79.6	Confident	82.8	Confident	22 Å²	22	88 Å²	88	18%	0.182	51%	0.506	C	S	.	.	S	Bend	trans	-60.6	138.8	175.4	0	0	0	0	0	109.9	M111 D112 T117	M111-A115 PolarHBondContact O-N 3.21Å; D112-A115 WeakPolarHBondContact O-CB 3.32Å; D112-A115 PolarHBondContact O-N 3.48Å; A115-T117 PolarHBondContact O-N 3.41Å
116	P	71.5	Confident	82.6	Confident	129 Å²	129	86.6 Å²	86.6	84%	0.838	50%	0.502	S	S	*	.			trans	-55.8	112.8	169.9	-23.3	33.2	0	0	0	110.3
117	T	68.6	Low	82.4	Confident	92 Å²	92	87.4 Å²	87.4	56%	0.564	50%	0.502	S	S	*	.			trans	-87.1	124.1	170.8	55.4	0	0	0	0	108.9	A115 S119	A115-T117 PolarHBondContact O-N 3.41Å; T117-S119 PolarHBondContact O-N 2.72Å
118	T	62.1	Low	82.4	Confident	154 Å²	154	87.7 Å²	87.7	95%	0.945	51%	0.505	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.1	-9	-179.2	50.3	0	0	0	0	114
119	S	61.8	Low	82.4	Confident	103 Å²	103	88.1 Å²	88.1	72%	0.72	51%	0.511	S	S	*	.	T	Hydrogen-bonded Turn	trans	-105.6	-1.6	-162.9	52.1	0	0	0	0	116.1	T117 K121	T117-S119 PolarHBondContact O-N 2.72Å; S119-K121 PolarHBondContact O-N 2.96Å
120	V	67.1	Low	82.5	Confident	110 Å²	110	80.9 Å²	80.9	67%	0.667	48%	0.484	S	S	*	.			trans	-84.1	107.5	178.4	-174.8	0	0	0	0	109.5	P122	V120-P122 WeakPolarHBondContact O-CD 3.29Å
121	K	72.3	Confident	82.6	Confident	180 Å²	180	81.4 Å²	81.4	78%	0.783	49%	0.487	S	S	*	.	P	Polyproline II helix	trans	-55.6	123.6	169.5	-176.5	179.8	177.4	179.1	0	108.6	S119	S119-K121 PolarHBondContact O-N 2.96Å
122	P	72.6	Confident	82.9	Confident	100 Å²	100	87.5 Å²	87.5	65%	0.649	51%	0.51	S	S	*	.	P	Polyproline II helix	trans	-61.4	151.7	176.1	23	-30.6	0	0	0	110.3	V120 S124	V120-P122 WeakPolarHBondContact O-CD 3.29Å; P122-S124 PolarHBondContact O-N 3.07Å
123	P	77.3	Confident	83.1	Confident	83 Å²	83	86.4 Å²	86.4	54%	0.539	50%	0.5	S	S	.	.	P	Polyproline II helix	trans	-52.8	142.6	175.7	-22.8	32.1	0	0	0	111.4	G125 N127	P123-G125 PolarHBondContact O-N 2.81Å; P123-N127 VanDerWaalsContact CG-ND2 3.31Å; P123-N127 WeakPolarHBondContact CG-ND2 3.13Å
124	S	82.1	Confident	83.6	Confident	133 Å²	133	84.1 Å²	84.1	93%	0.93	48%	0.481	S	S	*	.	S	Bend	trans	-73.4	-2.5	178.7	53.8	0	0	0	0	114.2	P122	P122-S124 PolarHBondContact O-N 3.07Å
125	G	88.3	Confident	84.2	Confident	22 Å²	22	85.8 Å²	85.8	23%	0.227	49%	0.487	C	S	.	.	S	Bend	trans	-175.7	-176.3	-177.5	0	0	0	0	0	112.1	P123 N127	P123-G125 PolarHBondContact O-N 2.81Å; G125-N127 PolarHBondContact O-N 3.44Å
126	P	92.4	Very high	85	Confident	50 Å²	50	90.8 Å²	90.8	33%	0.325	50%	0.504	S	S	.	.			trans	-62.4	133.4	176.7	28.7	-35	0	0	0	109.9	D334 Y339	P126-D334 VanDerWaalsContact CA-OD1 3.23Å; P126-D334 WeakPolarHBondContact CA-OD1 3.49Å; P126-D334 WeakPolarHBondContact CB-OD1 3.48Å; P126-Y339 HydrophobicContact CB-CE1 4.18Å; P126-Y339 HydrophobicContact CB-CE2 4.31Å; P126-Y339 HydrophobicContact CG-CE2 4.41Å
127	N	94.2	Very high	86.3	Confident	70 Å²	70	86 Å²	86	37%	0.374	47%	0.47	S	S	.	.			trans	-133.1	8.9	178.4	73.5	18.6	0	0	0	112.7	P123 G125 A129 R132 D334	P123-N127 VanDerWaalsContact CG-ND2 3.31Å; P123-N127 WeakPolarHBondContact CG-ND2 3.13Å; G125-N127 PolarHBondContact O-N 3.44Å; N127-A129 PolarHBondContact OD1-N 3.02Å; N127-R132 PolarHBondContact O-NH1 2.65Å; N127-R132 PolarHBondContact OD1-NH1 3.33Å; N127-R132 PolarHBondContact OD1-NH2 2.99Å; N127-D334 VanDerWaalsContact N-CG 3.31Å; N127-D334 PolarHBondContact N-OD1 3.11Å; N127-D334 PolarHBondContact N-OD2 2.91Å; N127-D334 PolarHBondContact OD1-OD2 3.31Å
128	G	96	Very high	87.6	Confident	6 Å²	6	82.5 Å²	82.5	6%	0.062	45%	0.448	C	S	.	.			trans	84.4	25.9	178.8	0	0	0	0	0	113.6	W130 L131 R132 D334 G336	G128-W130 VanDerWaalsContact C-N 3.27Å; G128-W130 PolarHBondContact O-N 3.39Å; G128-L131 PolarHBondContact O-N 3.04Å; G128-L131 VanDerWaalsContact O-N 3.16Å; G128-R132 PolarHBondContact O-N 3.38Å; G128-D334 CarbonylContact C-O 3.45Å; G128-D334 WeakPolarHBondContact CA-O 3.28Å; G128-D334 PolarHBondContact N-OD1 3.27Å; G128-D334 PolarHBondContact N-OD2 3.41Å; G128-D334 VanDerWaalsContact N-OD2 3.11Å; G128-G336 VanDerWaalsContact N-CA 3.28Å
129	A	96.2	Very high	89.3	Confident	28 Å²	28	77.3 Å²	77.3	23%	0.231	42%	0.416	C	S	.	.	H	α-helix	trans	-56	-40.1	-178.8	0	0	0	0	0	113	N127 Y133 D334	N127-A129 PolarHBondContact OD1-N 3.02Å; A129-Y133 PolarHBondContact O-N 3.37Å; A129-Y133 VanDerWaalsContact O-N 3.11Å; A129-D334 HydrophobicContact CB-CB 4.18Å; A129-D334 PolarHBondContact N-OD2 2.67Å; A129-D334 VanDerWaalsContact N-OD2 3.13Å
130	W	97.7	Very high	90.9	Very high	4 Å²	4	77.7 Å²	77.7	2%	0.015	42%	0.416	C	S	.	.	H	α-helix	trans	-66.9	-45.9	176.2	165.8	-123.6	0	0	0	111.3	G128 R132 Y133 R134 L333 D334 H359 M362 A363	G128-W130 VanDerWaalsContact C-N 3.27Å; G128-W130 PolarHBondContact O-N 3.39Å; W130-R132 VanDerWaalsContact C-N 3.32Å; W130-R132 PolarHBondContact O-N 3.22Å; W130-Y133 HydrophobicContact CE3-CD1 4.31Å; W130-Y133 AromaticContact CZ3-CD1 3.9Å; W130-Y133 HydrophobicContact CZ3-CD1 3.9Å; W130-Y133 PolarHBondContact O-N 2.93Å; W130-Y133 VanDerWaalsContact O-N 3.1Å; W130-R134 HydrophobicContact CD2-CB 4.23Å; W130-R134 HydrophobicContact CE3-CB 4.31Å; W130-R134 HydrophobicContact CH2-CB 4.03Å; W130-R134 HydrophobicContact CH2-CG 4.13Å; W130-R134 HydrophobicContact CZ2-CB 3.92Å; W130-R134 HydrophobicContact CZ2-CG 3.84Å; W130-R134 HydrophobicContact CZ3-CB 4.22Å; W130-R134 VanDerWaalsContact O-CB 3.3Å; W130-R134 WeakPolarHBondContact O-CB 3.33Å; W130-R134 PolarHBondContact O-N 3.46Å; W130-L333 HydrophobicContact CB-CB 3.99Å; W130-L333 HydrophobicContact CD2-CB 4.5Å; W130-L333 HydrophobicContact CD2-CD1 4.16Å; W130-L333 HydrophobicContact CD2-CD2 4.16Å; W130-L333 HydrophobicContact CE3-CD2 4.41Å; W130-L333 HydrophobicContact CG-CB 3.79Å; W130-L333 HydrophobicContact CG-CD1 4.2Å; W130-L333 HydrophobicContact CG-CD2 4.23Å; W130-L333 HydrophobicContact CG-CG 4.3Å; W130-L333 HydrophobicContact CZ2-CD1 4.37Å; W130-D334 VanDerWaalsContact CB-O 3.28Å; W130-D334 WeakPolarHBondContact CB-O 3.41Å; W130-D334 PolarHBondContact N-O 2.86Å; W130-D334 VanDerWaalsContact N-O 3.1Å; W130-H359 WeakPolarHBondContact CA-NE2 3.34Å; W130-H359 HydrophobicContact CE3-CB 4.27Å; W130-H359 AromaticContact CE3-CD2 3.41Å; W130-H359 VanDerWaalsContact CE3-CD2 3.41Å; W130-H359 HydrophobicContact CZ3-CB 4.34Å; W130-H359 WeakPolarHBondContact CZ3-O 3.3Å; W130-M362 HydrophobicContact CH2-CB 3.66Å; W130-M362 HydrophobicContact CH2-CG 3.44Å; W130-M362 VanDerWaalsContact CH2-CG 3.44Å; W130-M362 HydrophobicContact CZ2-CB 4.16Å; W130-M362 HydrophobicContact CZ2-CG 3.42Å; W130-M362 VanDerWaalsContact CZ2-CG 3.42Å; W130-M362 HydrophobicContact CZ3-CB 4.05Å; W130-M362 HydrophobicContact CZ3-CG 4.22Å; W130-A363 HydrophobicContact CH2-CB 4.13Å; W130-A363 HydrophobicContact CZ3-CB 4.2Å
131	L	97.8	Very high	92.3	Very high	85 Å²	85	78.6 Å²	78.6	45%	0.445	42%	0.417	S	S	.	.	H	α-helix	trans	-59.9	-42	179.7	-62.2	-179.3	0	0	0	112.1	G128 K135 V335	G128-L131 PolarHBondContact O-N 3.04Å; G128-L131 VanDerWaalsContact O-N 3.16Å; L131-K135 WeakPolarHBondContact O-CB 3.16Å; L131-K135 PolarHBondContact O-N 3Å; L131-V335 VanDerWaalsContact CD1-O 3.31Å; L131-V335 WeakPolarHBondContact CD1-O 3.26Å; L131-V335 HydrophobicContact CD2-CG1 4.46Å
132	R	97.7	Very high	93.4	Very high	132 Å²	132	70.2 Å²	70.2	50%	0.498	38%	0.381	S	S	.	.	H	α-helix	trans	-62.7	-41.1	174.7	-71.8	-165.6	-59.5	-76.6	-1.3	112.3	N127 G128 W130	N127-R132 PolarHBondContact O-NH1 2.65Å; N127-R132 PolarHBondContact OD1-NH1 3.33Å; N127-R132 PolarHBondContact OD1-NH2 2.99Å; G128-R132 PolarHBondContact O-N 3.38Å; W130-R132 VanDerWaalsContact C-N 3.32Å; W130-R132 PolarHBondContact O-N 3.22Å
133	Y	97.6	Very high	94.6	Very high	53 Å²	53	66.3 Å²	66.3	21%	0.208	36%	0.355	C	S	.	.	H	α-helix	trans	-67.2	-51.2	177.7	-170.3	-88.1	0	0	0	111.1	A129 W130 K135 K136 F137 H359 A363	A129-Y133 PolarHBondContact O-N 3.37Å; A129-Y133 VanDerWaalsContact O-N 3.11Å; W130-Y133 HydrophobicContact CE3-CD1 4.31Å; W130-Y133 AromaticContact CZ3-CD1 3.9Å; W130-Y133 HydrophobicContact CZ3-CD1 3.9Å; W130-Y133 PolarHBondContact O-N 2.93Å; W130-Y133 VanDerWaalsContact O-N 3.1Å; Y133-K135 VanDerWaalsContact C-N 3.3Å; Y133-K135 PolarHBondContact O-N 3.1Å; Y133-K136 WeakPolarHBondContact O-CB 3.43Å; Y133-K136 PolarHBondContact O-N 2.95Å; Y133-K136 VanDerWaalsContact O-N 3.1Å; Y133-F137 HydrophobicContact CD1-CD2 4.32Å; Y133-F137 AromaticContact CD1-CE2 3.93Å; Y133-F137 HydrophobicContact CD1-CE2 3.93Å; Y133-F137 HydrophobicContact CE1-CD2 4.13Å; Y133-F137 AromaticContact CE1-CE2 3.5Å; Y133-F137 HydrophobicContact CE1-CE2 3.5Å; Y133-F137 HydrophobicContact CE1-CZ 4.44Å; Y133-F137 HydrophobicContact CE2-CE2 4.3Å; Y133-F137 AromaticContact CZ-CE2 3.71Å; Y133-F137 WeakPolarHBondContact O-CD2 3.18Å; Y133-H359 HydrophobicContact CD1-CB 3.76Å; Y133-H359 HydrophobicContact CD2-CB 4.26Å; Y133-H359 HydrophobicContact CE1-CB 3.88Å; Y133-H359 WeakPolarHBondContact CE1-O 3.5Å; Y133-H359 HydrophobicContact CE2-CB 4.4Å; Y133-H359 HydrophobicContact CG-CB 3.94Å; Y133-A363 HydrophobicContact CD1-CB 4.08Å; Y133-A363 HydrophobicContact CE1-CB 3.66Å
134	R	98	Very high	95.6	Very high	85 Å²	85	67.2 Å²	67.2	32%	0.321	35%	0.353	S	S	.	.	H	α-helix	trans	-53.6	-44.3	178.6	-171.5	-174.6	-178.2	-83.5	-1.3	112.4	W130 K136 F137 I138	W130-R134 HydrophobicContact CD2-CB 4.23Å; W130-R134 HydrophobicContact CE3-CB 4.31Å; W130-R134 HydrophobicContact CH2-CB 4.03Å; W130-R134 HydrophobicContact CH2-CG 4.13Å; W130-R134 HydrophobicContact CZ2-CB 3.92Å; W130-R134 HydrophobicContact CZ2-CG 3.84Å; W130-R134 HydrophobicContact CZ3-CB 4.22Å; W130-R134 VanDerWaalsContact O-CB 3.3Å; W130-R134 WeakPolarHBondContact O-CB 3.33Å; W130-R134 PolarHBondContact O-N 3.46Å; R134-K136 PolarHBondContact O-N 3.31Å; R134-K136 VanDerWaalsContact O-N 3.13Å; R134-F137 PolarHBondContact O-N 2.9Å; R134-F137 VanDerWaalsContact O-N 3.08Å; R134-I138 HydrophobicContact CG-CB 4.3Å; R134-I138 HydrophobicContact CG-CD1 3.71Å; R134-I138 HydrophobicContact CG-CG1 4.12Å; R134-I138 PolarHBondContact O-N 2.77Å
135	K	97.5	Very high	96.4	Very high	160 Å²	160	63 Å²	63	70%	0.696	32%	0.319	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62	-19.3	-178.4	-170.7	175.6	179.5	-179.2	0	113.7	L131 Y133 F137 T139	L131-K135 WeakPolarHBondContact O-CB 3.16Å; L131-K135 PolarHBondContact O-N 3Å; Y133-K135 VanDerWaalsContact C-N 3.3Å; Y133-K135 PolarHBondContact O-N 3.1Å; K135-F137 VanDerWaalsContact C-N 3.27Å; K135-F137 PolarHBondContact O-N 3.34Å; K135-T139 VanDerWaalsContact O-CG2 3.24Å; K135-T139 WeakPolarHBondContact O-CG2 3.37Å
136	K	96.9	Very high	96.9	Very high	128 Å²	128	61.9 Å²	61.9	56%	0.557	31%	0.308	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.3	-26.3	175.5	-62.5	179.8	179.5	-175.6	0	113.1	Y133 R134 R180	Y133-K136 WeakPolarHBondContact O-CB 3.43Å; Y133-K136 PolarHBondContact O-N 2.95Å; Y133-K136 VanDerWaalsContact O-N 3.1Å; R134-K136 PolarHBondContact O-N 3.31Å; R134-K136 VanDerWaalsContact O-N 3.13Å; K136-R180 PolarHBondContact O-NH2 2.94Å
137	F	97.3	Very high	97.2	Very high	27 Å²	27	59.9 Å²	59.9	12%	0.118	30%	0.295	C	S	.	.	T	Hydrogen-bonded Turn	trans	-116.6	-43.1	-170.6	-54.2	-74.4	0	0	0	112.3	Y133 R134 K135 T139 N142 V177 A363 L367	Y133-F137 HydrophobicContact CD1-CD2 4.32Å; Y133-F137 AromaticContact CD1-CE2 3.93Å; Y133-F137 HydrophobicContact CD1-CE2 3.93Å; Y133-F137 HydrophobicContact CE1-CD2 4.13Å; Y133-F137 AromaticContact CE1-CE2 3.5Å; Y133-F137 HydrophobicContact CE1-CE2 3.5Å; Y133-F137 HydrophobicContact CE1-CZ 4.44Å; Y133-F137 HydrophobicContact CE2-CE2 4.3Å; Y133-F137 AromaticContact CZ-CE2 3.71Å; Y133-F137 WeakPolarHBondContact O-CD2 3.18Å; R134-F137 PolarHBondContact O-N 2.9Å; R134-F137 VanDerWaalsContact O-N 3.08Å; K135-F137 VanDerWaalsContact C-N 3.27Å; K135-F137 PolarHBondContact O-N 3.34Å; F137-T139 PolarHBondContact O-N 3.12Å; F137-N142 WeakPolarHBondContact O-CB 3.47Å; F137-N142 PolarHBondContact O-ND2 2.86Å; F137-V177 HydrophobicContact CD1-CB 4.23Å; F137-V177 HydrophobicContact CD1-CG1 4.22Å; F137-V177 HydrophobicContact CD1-CG2 3.99Å; F137-V177 HydrophobicContact CE1-CB 4.26Å; F137-V177 HydrophobicContact CE1-CG1 3.8Å; F137-V177 HydrophobicContact CE1-CG2 4.4Å; F137-V177 WeakPolarHBondContact CE1-O 3.45Å; F137-V177 HydrophobicContact CG-CG2 4.17Å; F137-V177 HydrophobicContact CZ-CG1 4.06Å; F137-A363 HydrophobicContact CD2-CB 4.03Å; F137-L367 HydrophobicContact CB-CD2 4.49Å
138	I	97.4	Very high	97.4	Very high	19 Å²	19	60.2 Å²	60.2	10%	0.097	30%	0.3	C	S	.	.			trans	-100.1	85.8	-172	-45	-176.9	0	0	0	108.9	R134 V143 Q366 L367 A370	R134-I138 HydrophobicContact CG-CB 4.3Å; R134-I138 HydrophobicContact CG-CD1 3.71Å; R134-I138 HydrophobicContact CG-CG1 4.12Å; R134-I138 PolarHBondContact O-N 2.77Å; I138-V143 HydrophobicContact CG2-CG2 4.29Å; I138-Q366 HydrophobicContact CD1-CB 3.43Å; I138-Q366 VanDerWaalsContact CD1-CB 3.43Å; I138-L367 HydrophobicContact CG1-CB 4.21Å; I138-L367 HydrophobicContact CG1-CD1 4.33Å; I138-A370 HydrophobicContact CG2-CB 4.12Å
139	T	96.7	Very high	97.5	Very high	45 Å²	45	60.4 Å²	60.4	28%	0.276	30%	0.299	S	S	.	.			trans	-128.8	153.5	175.3	61.1	0	0	0	0	108.4	K135 F137 D141 N142 V143	K135-T139 VanDerWaalsContact O-CG2 3.24Å; K135-T139 WeakPolarHBondContact O-CG2 3.37Å; F137-T139 PolarHBondContact O-N 3.12Å; T139-D141 VanDerWaalsContact C-N 3.34Å; T139-D141 PolarHBondContact O-N 3.28Å; T139-N142 PolarHBondContact O-N 2.95Å; T139-N142 VanDerWaalsContact O-N 3.13Å; T139-N142 VanDerWaalsContact OG1-CB 3.23Å; T139-N142 WeakPolarHBondContact OG1-CB 3.41Å; T139-N142 PolarHBondContact OG1-N 3Å; T139-V143 WeakPolarHBondContact O-CG2 3.34Å; T139-V143 PolarHBondContact O-N 3.43Å
140	P	96.4	Very high	97.7	Very high	112 Å²	112	59.7 Å²	59.7	73%	0.727	29%	0.29	S	S	*	.	H	α-helix	trans	-50.7	-50.2	-179.3	-28.9	36.1	0	0	0	113.2	N142 V143 Q144	P140-N142 PolarHBondContact O-N 3.11Å; P140-V143 PolarHBondContact O-N 3.18Å; P140-Q144 PolarHBondContact O-N 3.41Å
141	D	95.8	Very high	97.7	Very high	128 Å²	128	63.3 Å²	63.3	68%	0.684	31%	0.31	S	S	*	.	H	α-helix	trans	-62.4	-41.3	179.8	-60.3	-15.1	0	0	0	112.6	T139 Q144 N145	T139-D141 VanDerWaalsContact C-N 3.34Å; T139-D141 PolarHBondContact O-N 3.28Å; D141-Q144 PolarHBondContact O-N 3.44Å; D141-N145 PolarHBondContact O-N 2.94Å; D141-N145 PolarHBondContact O-ND2 2.89Å
142	N	95.4	Very high	97.7	Very high	5 Å²	5	65.2 Å²	65.2	3%	0.027	32%	0.316	C	S	.	.	H	α-helix	trans	-69.5	-38.2	178.9	-156.3	64.5	0	0	0	110.8	F137 T139 P140 Q144 N145 G146 R180 W181	F137-N142 WeakPolarHBondContact O-CB 3.47Å; F137-N142 PolarHBondContact O-ND2 2.86Å; T139-N142 PolarHBondContact O-N 2.95Å; T139-N142 VanDerWaalsContact O-N 3.13Å; T139-N142 VanDerWaalsContact OG1-CB 3.23Å; T139-N142 WeakPolarHBondContact OG1-CB 3.41Å; T139-N142 PolarHBondContact OG1-N 3Å; P140-N142 PolarHBondContact O-N 3.11Å; N142-Q144 VanDerWaalsContact C-N 3.33Å; N142-Q144 PolarHBondContact O-N 3.04Å; N142-N145 PolarHBondContact O-N 2.99Å; N142-G146 PolarHBondContact O-N 3.19Å; N142-G146 VanDerWaalsContact O-N 3.12Å; N142-R180 PolarHBondContact OD1-NH1 3.34Å; N142-W181 WeakPolarHBondContact O-CH2 3.38Å; N142-W181 WeakPolarHBondContact O-CZ3 3.46Å
143	V	98.4	Very high	97.8	Very high	17 Å²	17	61.1 Å²	61.1	10%	0.103	30%	0.301	C	S	.	.	H	α-helix	trans	-60.6	-43.9	173.7	170.4	0	0	0	0	110.6	I138 T139 P140 N145 G146 V147 L367 A370 V371 A374	I138-V143 HydrophobicContact CG2-CG2 4.29Å; T139-V143 WeakPolarHBondContact O-CG2 3.34Å; T139-V143 PolarHBondContact O-N 3.43Å; P140-V143 PolarHBondContact O-N 3.18Å; V143-N145 VanDerWaalsContact C-N 3.34Å; V143-N145 PolarHBondContact O-N 2.89Å; V143-G146 WeakPolarHBondContact O-CA 3.31Å; V143-G146 PolarHBondContact O-N 3.23Å; V143-V147 PolarHBondContact O-N 3.14Å; V143-L367 HydrophobicContact CG2-CD1 4.35Å; V143-A370 HydrophobicContact CG1-CB 4.48Å; V143-A370 HydrophobicContact CG2-CB 3.84Å; V143-V371 HydrophobicContact CG1-CG2 4.34Å; V143-A374 HydrophobicContact CG1-CB 3.56Å
144	Q	98.1	Very high	97.8	Very high	103 Å²	103	62.1 Å²	62.1	48%	0.481	31%	0.308	S	S	.	.	H	α-helix	trans	-64.5	-37.3	178.2	-167.9	59.4	29.9	0	0	112.7	P140 D141 N142 G146 V147 V148	P140-Q144 PolarHBondContact O-N 3.41Å; D141-Q144 PolarHBondContact O-N 3.44Å; N142-Q144 VanDerWaalsContact C-N 3.33Å; N142-Q144 PolarHBondContact O-N 3.04Å; Q144-G146 VanDerWaalsContact C-N 3.26Å; Q144-G146 PolarHBondContact O-N 3.38Å; Q144-V147 WeakPolarHBondContact O-CB 3.23Å; Q144-V147 PolarHBondContact O-N 3.15Å; Q144-V147 VanDerWaalsContact O-N 3.16Å; Q144-V148 WeakPolarHBondContact O-CG2 3.47Å; Q144-V148 PolarHBondContact O-N 3.44Å
145	N	98.3	Very high	97.9	Very high	43 Å²	43	64.7 Å²	64.7	23%	0.23	33%	0.328	C	S	.	.	H	α-helix	trans	-60.6	-37.8	172.1	-75.1	-52.7	0	0	0	112.2	D141 N142 V143 V148 F149 W181 R183	D141-N145 PolarHBondContact O-N 2.94Å; D141-N145 PolarHBondContact O-ND2 2.89Å; N142-N145 PolarHBondContact O-N 2.99Å; V143-N145 VanDerWaalsContact C-N 3.34Å; V143-N145 PolarHBondContact O-N 2.89Å; N145-V148 PolarHBondContact O-N 3.26Å; N145-F149 PolarHBondContact O-N 2.53Å; N145-W181 HydrophobicContact CB-CE3 3.8Å; N145-W181 HydrophobicContact CB-CZ3 3.81Å; N145-R183 PolarHBondContact OD1-NE 3.27Å; N145-R183 PolarHBondContact OD1-NH2 3.08Å
146	G	98.7	Very high	97.9	Very high	0 Å²	0	57.5 Å²	57.5	0%	0	30%	0.298	C	S	.	.	H	α-helix	trans	-65.9	-37.2	173.6	0	0	0	0	0	113.2	N142 V143 Q144 V148 F149 W150	N142-G146 PolarHBondContact O-N 3.19Å; N142-G146 VanDerWaalsContact O-N 3.12Å; V143-G146 WeakPolarHBondContact O-CA 3.31Å; V143-G146 PolarHBondContact O-N 3.23Å; Q144-G146 VanDerWaalsContact C-N 3.26Å; Q144-G146 PolarHBondContact O-N 3.38Å; G146-V148 VanDerWaalsContact C-N 3.35Å; G146-F149 PolarHBondContact O-N 3.05Å; G146-W150 WeakPolarHBondContact O-CB 3.36Å; G146-W150 PolarHBondContact O-N 3.3Å
147	V	98.7	Very high	98	Very high	8 Å²	8	51.4 Å²	51.4	5%	0.048	27%	0.271	C	S	.	.	H	α-helix	trans	-61.3	-45.6	174	169.3	0	0	0	0	110.4	V143 Q144 W150 N151 V371 A374 R375	V143-V147 PolarHBondContact O-N 3.14Å; Q144-V147 WeakPolarHBondContact O-CB 3.23Å; Q144-V147 PolarHBondContact O-N 3.15Å; Q144-V147 VanDerWaalsContact O-N 3.16Å; V147-W150 PolarHBondContact O-N 3.41Å; V147-N151 WeakPolarHBondContact O-CB 3.33Å; V147-N151 PolarHBondContact O-N 2.94Å; V147-N151 PolarHBondContact O-ND2 3.16Å; V147-V371 HydrophobicContact CG2-CG1 3.98Å; V147-A374 HydrophobicContact CG2-CB 3.77Å; V147-R375 HydrophobicContact CB-CG 4.36Å; V147-R375 HydrophobicContact CG1-CG 4.06Å; V147-R375 HydrophobicContact CG2-CG 3.95Å
148	V	98.6	Very high	98.1	Very high	77 Å²	77	53.3 Å²	53.3	47%	0.467	28%	0.283	S	S	.	.	H	α-helix	trans	-59.7	-50	176.8	173.9	0	0	0	0	110.9	Q144 N145 G146 W150 N151 Q152	Q144-V148 WeakPolarHBondContact O-CG2 3.47Å; Q144-V148 PolarHBondContact O-N 3.44Å; N145-V148 PolarHBondContact O-N 3.26Å; G146-V148 VanDerWaalsContact C-N 3.35Å; V148-W150 PolarHBondContact O-N 3.13Å; V148-N151 PolarHBondContact O-N 3.31Å; V148-Q152 WeakPolarHBondContact O-CB 3.41Å; V148-Q152 PolarHBondContact O-N 3.09Å
149	F	98.8	Very high	98.2	Very high	10 Å²	10	57.2 Å²	57.2	4%	0.044	30%	0.297	C	S	.	.	H	α-helix	trans	-59.9	-46.6	177.7	178.5	-89.8	0	0	0	112.1	N145 G146 N151 Q152 Y153 V172 I175 W181 Y239 P265 I269	N145-F149 PolarHBondContact O-N 2.53Å; G146-F149 PolarHBondContact O-N 3.05Å; F149-N151 PolarHBondContact O-N 3.2Å; F149-Q152 PolarHBondContact O-N 2.9Å; F149-Y153 HydrophobicContact CD1-CD2 4.44Å; F149-Y153 AromaticContact CD2-CD2 3.64Å; F149-Y153 HydrophobicContact CD2-CD2 3.64Å; F149-Y153 AromaticContact CD2-CE2 3.8Å; F149-Y153 HydrophobicContact CD2-CE2 3.8Å; F149-Y153 HydrophobicContact CE1-CD2 4.34Å; F149-Y153 AromaticContact CE2-CD2 3.54Å; F149-Y153 HydrophobicContact CE2-CD2 3.54Å; F149-Y153 AromaticContact CE2-CE2 3.73Å; F149-Y153 HydrophobicContact CE2-CE2 3.73Å; F149-Y153 HydrophobicContact CG-CD2 4.12Å; F149-Y153 AromaticContact CZ-CD2 3.9Å; F149-Y153 HydrophobicContact CZ-CD2 3.9Å; F149-Y153 HydrophobicContact CZ-CE2 4.49Å; F149-Y153 WeakPolarHBondContact O-CD2 3.15Å; F149-Y153 PolarHBondContact O-N 3.17Å; F149-V172 HydrophobicContact CD1-CG2 4.26Å; F149-V172 HydrophobicContact CE1-CG2 4.46Å; F149-I175 HydrophobicContact CE1-CD1 4.04Å; F149-I175 HydrophobicContact CE1-CG2 4.43Å; F149-I175 HydrophobicContact CE2-CG2 4.37Å; F149-I175 HydrophobicContact CZ-CD1 3.76Å; F149-I175 HydrophobicContact CZ-CG2 4.1Å; F149-W181 HydrophobicContact CB-CB 3.82Å; F149-W181 HydrophobicContact CB-CD2 4.44Å; F149-W181 HydrophobicContact CB-CG 3.65Å; F149-W181 AromaticContact CD1-CD1 3.31Å; F149-W181 HydrophobicContact CD1-CG 4.2Å; F149-W181 AromaticContact CD1-NE1 3.98Å; F149-W181 HydrophobicContact CD2-CB 3.63Å; F149-W181 AromaticContact CD2-CD1 3.84Å; F149-W181 HydrophobicContact CD2-CG 4.05Å; F149-W181 AromaticContact CE1-CD1 3.91Å; F149-W181 HydrophobicContact CE2-CB 4.34Å; F149-W181 HydrophobicContact CG-CB 3.78Å; F149-W181 AromaticContact CG-CD1 3.26Å; F149-W181 AromaticContact CG-CG 3.7Å; F149-W181 HydrophobicContact CG-CG 3.7Å; F149-Y239 HydrophobicContact CE2-CD1 4.09Å; F149-Y239 AromaticContact CE2-CE1 3.94Å; F149-Y239 HydrophobicContact CE2-CE1 3.94Å; F149-P265 HydrophobicContact CE2-CB 4.12Å; F149-P265 HydrophobicContact CZ-CB 4.44Å; F149-I269 HydrophobicContact CE1-CD1 4.12Å; F149-I269 HydrophobicContact CE1-CG1 4.37Å; F149-I269 HydrophobicContact CZ-CD1 3.94Å; F149-I269 HydrophobicContact CZ-CG1 4.19Å
150	W	98.8	Very high	98.3	Very high	13 Å²	13	55.1 Å²	55.1	5%	0.049	28%	0.283	C	S	.	.	H	α-helix	trans	-60	-50.1	179.6	-168.8	-37	0	0	0	110.4	G146 V147 V148 Q152 Y153 E154 L157 P168 E169 V172 V371 A372 R375	G146-W150 WeakPolarHBondContact O-CB 3.36Å; G146-W150 PolarHBondContact O-N 3.3Å; V147-W150 PolarHBondContact O-N 3.41Å; V148-W150 PolarHBondContact O-N 3.13Å; W150-Q152 VanDerWaalsContact C-N 3.3Å; W150-Q152 PolarHBondContact O-N 3.08Å; W150-Y153 CarbonylContact O-C 3.53Å; W150-Y153 PolarHBondContact O-N 3.44Å; W150-E154 VanDerWaalsContact O-CA 3.32Å; W150-E154 WeakPolarHBondContact O-CA 3.16Å; W150-E154 PolarHBondContact O-N 3.39Å; W150-L157 HydrophobicContact CB-CD1 4.16Å; W150-L157 HydrophobicContact CD2-CD1 4.27Å; W150-L157 HydrophobicContact CG-CD1 3.7Å; W150-P168 HydrophobicContact CD2-CB 4.29Å; W150-P168 HydrophobicContact CH2-CB 3.75Å; W150-P168 HydrophobicContact CZ2-CB 3.25Å; W150-P168 HydrophobicContact CZ2-CG 4.05Å; W150-P168 HydrophobicContact CZ3-CB 4.44Å; W150-E169 HydrophobicContact CH2-CB 3.88Å; W150-E169 HydrophobicContact CZ3-CB 3.88Å; W150-V172 HydrophobicContact CB-CG2 4.15Å; W150-V172 HydrophobicContact CD2-CG2 3.93Å; W150-V172 HydrophobicContact CE3-CB 4.07Å; W150-V172 HydrophobicContact CE3-CG1 4.09Å; W150-V172 HydrophobicContact CE3-CG2 3.7Å; W150-V172 HydrophobicContact CG-CG2 4.14Å; W150-V172 HydrophobicContact CZ3-CG2 4.47Å; W150-V371 HydrophobicContact CE3-CB 4.44Å; W150-V371 HydrophobicContact CE3-CG1 3.71Å; W150-V371 HydrophobicContact CZ3-CG1 4.34Å; W150-A372 HydrophobicContact CH2-CB 3.69Å; W150-A372 HydrophobicContact CZ3-CB 3.71Å; W150-R375 VanDerWaalsContact CD1-CZ 3.44Å; W150-R375 VanDerWaalsContact CD2-CD 3.47Å; W150-R375 VanDerWaalsContact CE2-NH1 3.31Å
151	N	98.6	Very high	98.4	Very high	80 Å²	80	52.8 Å²	52.8	43%	0.428	26%	0.26	S	S	.	.	H	α-helix	trans	-62.1	-38.1	-179.6	-69	-13	0	0	0	112.2	V147 V148 F149 Y153 R375	V147-N151 WeakPolarHBondContact O-CB 3.33Å; V147-N151 PolarHBondContact O-N 2.94Å; V147-N151 PolarHBondContact O-ND2 3.16Å; V148-N151 PolarHBondContact O-N 3.31Å; F149-N151 PolarHBondContact O-N 3.2Å; N151-Y153 VanDerWaalsContact C-N 3.34Å; N151-Y153 PolarHBondContact O-N 2.91Å; N151-R375 PolarHBondContact OD1-NE 2.76Å; N151-R375 PolarHBondContact OD1-NH2 2.94Å
152	Q	98.7	Very high	98.5	Very high	124 Å²	124	52.9 Å²	52.9	58%	0.579	26%	0.257	S	S	*	.	H	α-helix	trans	-66.9	-34.2	178.2	-177.4	173.7	-12.2	0	0	112.9	V148 F149 W150	V148-Q152 WeakPolarHBondContact O-CB 3.41Å; V148-Q152 PolarHBondContact O-N 3.09Å; F149-Q152 PolarHBondContact O-N 2.9Å; W150-Q152 VanDerWaalsContact C-N 3.3Å; W150-Q152 PolarHBondContact O-N 3.08Å
153	Y	98.8	Very high	98.7	Very high	47 Å²	47	56.8 Å²	56.8	18%	0.184	28%	0.28	C	S	.	.	T	Hydrogen-bonded Turn	trans	-116.1	27.8	-175.6	-61	-71.4	0	0	0	113	F149 W150 N151 D155 A156 L157 P265 V266 I269	F149-Y153 HydrophobicContact CD1-CD2 4.44Å; F149-Y153 AromaticContact CD2-CD2 3.64Å; F149-Y153 HydrophobicContact CD2-CD2 3.64Å; F149-Y153 AromaticContact CD2-CE2 3.8Å; F149-Y153 HydrophobicContact CD2-CE2 3.8Å; F149-Y153 HydrophobicContact CE1-CD2 4.34Å; F149-Y153 AromaticContact CE2-CD2 3.54Å; F149-Y153 HydrophobicContact CE2-CD2 3.54Å; F149-Y153 AromaticContact CE2-CE2 3.73Å; F149-Y153 HydrophobicContact CE2-CE2 3.73Å; F149-Y153 HydrophobicContact CG-CD2 4.12Å; F149-Y153 AromaticContact CZ-CD2 3.9Å; F149-Y153 HydrophobicContact CZ-CD2 3.9Å; F149-Y153 HydrophobicContact CZ-CE2 4.49Å; F149-Y153 WeakPolarHBondContact O-CD2 3.15Å; F149-Y153 PolarHBondContact O-N 3.17Å; W150-Y153 CarbonylContact O-C 3.53Å; W150-Y153 PolarHBondContact O-N 3.44Å; N151-Y153 VanDerWaalsContact C-N 3.34Å; N151-Y153 PolarHBondContact O-N 2.91Å; Y153-D155 VanDerWaalsContact C-N 3.29Å; Y153-D155 PolarHBondContact O-N 3.38Å; Y153-A156 PolarHBondContact O-N 3.18Å; Y153-L157 WeakPolarHBondContact O-CG 3.37Å; Y153-L157 PolarHBondContact O-N 3.03Å; Y153-P265 HydrophobicContact CD1-CB 4.09Å; Y153-P265 HydrophobicContact CD2-CB 4.15Å; Y153-P265 HydrophobicContact CE1-CB 3.65Å; Y153-P265 HydrophobicContact CE1-CG 4.09Å; Y153-P265 HydrophobicContact CE2-CB 3.73Å; Y153-P265 HydrophobicContact CE2-CG 4.04Å; Y153-P265 HydrophobicContact CG-CB 4.33Å; Y153-P265 VanDerWaalsContact CZ-CB 3.47Å; Y153-P265 WeakPolarHBondContact OH-CG 2.93Å; Y153-V266 HydrophobicContact CD1-CG2 4.25Å; Y153-V266 HydrophobicContact CE1-CG2 4.45Å; Y153-I269 HydrophobicContact CG-CD1 4.12Å
154	E	98.7	Very high	98.7	Very high	73 Å²	73	57.6 Å²	57.6	34%	0.341	28%	0.282	S	S	.	.	H	α-helix	trans	-58.3	-41.5	-174.8	177.6	158.9	-132.1	0	0	111.9	W150 A156 L157 N158 R375	W150-E154 VanDerWaalsContact O-CA 3.32Å; W150-E154 WeakPolarHBondContact O-CA 3.16Å; W150-E154 PolarHBondContact O-N 3.39Å; E154-A156 PolarHBondContact O-N 3.4Å; E154-L157 PolarHBondContact O-N 3.47Å; E154-N158 VanDerWaalsContact CG-ND2 3.34Å; E154-N158 WeakPolarHBondContact CG-ND2 3.38Å; E154-N158 VanDerWaalsContact O-CB 3.29Å; E154-N158 WeakPolarHBondContact O-CB 3Å; E154-N158 VanDerWaalsContact O-CG 3.25Å; E154-N158 PolarHBondContact O-N 3.28Å; E154-N158 PolarHBondContact O-ND2 3.01Å; E154-R375 VanDerWaalsContact CD-NH2 3.28Å; E154-R375 IonicContact OE1-CZ 2.89Å; E154-R375 IonicContact OE1-NH1 2.9Å; E154-R375 PolarHBondContact OE1-NH1 2.75Å; E154-R375 IonicContact OE1-NH2 3.82Å; E154-R375 PolarHBondContact OE1-NH2 2.84Å; E154-R375 IonicContact OE2-NH2 3.86Å; E154-R375 PolarHBondContact OE2-NH2 3.41Å
155	D	98.7	Very high	98.7	Very high	140 Å²	140	52.9 Å²	52.9	75%	0.749	26%	0.261	S	S	*	.	H	α-helix	trans	-63	-43.3	178.6	-71.2	-18.8	0	0	0	112.4	Y153 R159	Y153-D155 VanDerWaalsContact C-N 3.29Å; Y153-D155 PolarHBondContact O-N 3.38Å; D155-R159 VanDerWaalsContact O-CB 3.29Å; D155-R159 WeakPolarHBondContact O-CB 3.46Å; D155-R159 PolarHBondContact O-N 3.5Å
156	A	98.9	Very high	98.7	Very high	8 Å²	8	50.9 Å²	50.9	7%	0.066	25%	0.25	C	S	.	.	H	α-helix	trans	-65.3	-45.4	176.4	0	0	0	0	0	111.1	Y153 E154 N158 R159 A160 F254 V266 I269	Y153-A156 PolarHBondContact O-N 3.18Å; E154-A156 PolarHBondContact O-N 3.4Å; A156-N158 PolarHBondContact O-N 2.95Å; A156-R159 PolarHBondContact O-N 2.99Å; A156-A160 WeakPolarHBondContact O-CB 3.38Å; A156-A160 PolarHBondContact O-N 3.21Å; A156-F254 HydrophobicContact CB-CE1 4.38Å; A156-F254 WeakPolarHBondContact O-CE1 3.41Å; A156-V266 HydrophobicContact CB-CG1 3.99Å; A156-V266 HydrophobicContact CB-CG2 4.35Å; A156-I269 HydrophobicContact CB-CD1 3.97Å; A156-I269 HydrophobicContact CB-CG2 4.2Å
157	L	98.9	Very high	98.7	Very high	0 Å²	0	51.5 Å²	51.5	0%	0	25%	0.254	C	S	.	.	H	α-helix	trans	-61.5	-43.8	177.8	-71.8	166.5	0	0	0	112	W150 Y153 E154 A160 W161 P168 I171 V172 I269	W150-L157 HydrophobicContact CB-CD1 4.16Å; W150-L157 HydrophobicContact CD2-CD1 4.27Å; W150-L157 HydrophobicContact CG-CD1 3.7Å; Y153-L157 WeakPolarHBondContact O-CG 3.37Å; Y153-L157 PolarHBondContact O-N 3.03Å; E154-L157 PolarHBondContact O-N 3.47Å; L157-A160 PolarHBondContact O-N 2.63Å; L157-W161 PolarHBondContact O-N 3.23Å; L157-P168 HydrophobicContact CB-CB 3.94Å; L157-P168 HydrophobicContact CB-CG 4.08Å; L157-P168 HydrophobicContact CD1-CB 4.46Å; L157-P168 HydrophobicContact CD2-CB 4.35Å; L157-P168 HydrophobicContact CG-CB 4.48Å; L157-I171 HydrophobicContact CD2-CB 3.83Å; L157-I171 HydrophobicContact CD2-CD1 4.21Å; L157-I171 HydrophobicContact CD2-CG2 3.74Å; L157-V172 HydrophobicContact CD1-CG2 3.72Å; L157-V172 HydrophobicContact CD2-CG2 3.94Å; L157-I269 HydrophobicContact CD2-CD1 4.11Å; L157-I269 HydrophobicContact CD2-CG1 4.01Å; L157-I269 HydrophobicContact CD2-CG2 4.02Å; L157-I269 HydrophobicContact CG-CD1 4.04Å; L157-I269 HydrophobicContact CG-CG1 4.48Å; L157-I269 HydrophobicContact CG-CG2 4.44Å
158	N	98.7	Very high	98.7	Very high	67 Å²	67	51.7 Å²	51.7	36%	0.358	26%	0.256	S	S	.	.	H	α-helix	trans	-65.2	-42.9	177.1	-76	-26.9	0	0	0	111.5	E154 A156 A160 W161 Q162	E154-N158 VanDerWaalsContact CG-ND2 3.34Å; E154-N158 WeakPolarHBondContact CG-ND2 3.38Å; E154-N158 VanDerWaalsContact O-CB 3.29Å; E154-N158 WeakPolarHBondContact O-CB 3Å; E154-N158 VanDerWaalsContact O-CG 3.25Å; E154-N158 PolarHBondContact O-N 3.28Å; E154-N158 PolarHBondContact O-ND2 3.01Å; A156-N158 PolarHBondContact O-N 2.95Å; N158-A160 VanDerWaalsContact C-N 3.33Å; N158-A160 PolarHBondContact O-N 3.48Å; N158-W161 WeakPolarHBondContact O-CB 3.42Å; N158-W161 PolarHBondContact O-N 3.18Å; N158-Q162 WeakPolarHBondContact O-CG 3.14Å; N158-Q162 PolarHBondContact O-N 3.25Å
159	R	98.7	Very high	98.7	Very high	102 Å²	102	50.3 Å²	50.3	39%	0.385	24%	0.244	S	C	.	.	H	α-helix	trans	-61.6	-42	174.8	-175.5	166.8	50.9	111.9	-1.4	111.4	D155 A156 W161 Q162 V163 F254	D155-R159 VanDerWaalsContact O-CB 3.29Å; D155-R159 WeakPolarHBondContact O-CB 3.46Å; D155-R159 PolarHBondContact O-N 3.5Å; A156-R159 PolarHBondContact O-N 2.99Å; R159-W161 VanDerWaalsContact C-N 3.31Å; R159-W161 PolarHBondContact O-N 2.69Å; R159-Q162 PolarHBondContact O-N 3.4Å; R159-Q162 VanDerWaalsContact O-N 3.08Å; R159-V163 HydrophobicContact CG-CG2 4.26Å; R159-V163 WeakPolarHBondContact O-CG2 3.11Å; R159-V163 PolarHBondContact O-N 3Å; R159-F254 HydrophobicContact CB-CE1 4.38Å; R159-F254 HydrophobicContact CB-CZ 4.03Å; R159-F254 HydrophobicContact CG-CE1 4.45Å; R159-F254 HydrophobicContact CG-CE2 4.42Å; R159-F254 HydrophobicContact CG-CZ 3.77Å; R159-F254 PolarHBondContact NH1-O 2.76Å; R159-F254 PolarHBondContact NH2-O 3.48Å
160	A	98.8	Very high	98.7	Very high	0 Å²	0	50 Å²	50	0%	0	24%	0.243	C	C	.	.	H	α-helix	trans	-61.8	-39.2	177.2	0	0	0	0	0	111.9	A156 L157 N158 Q162 Y164 I171 F254 I269 A273	A156-A160 WeakPolarHBondContact O-CB 3.38Å; A156-A160 PolarHBondContact O-N 3.21Å; L157-A160 PolarHBondContact O-N 2.63Å; N158-A160 VanDerWaalsContact C-N 3.33Å; N158-A160 PolarHBondContact O-N 3.48Å; A160-Q162 PolarHBondContact O-N 2.72Å; A160-Y164 HydrophobicContact CB-CD2 4.41Å; A160-Y164 WeakPolarHBondContact O-CA 3.35Å; A160-Y164 WeakPolarHBondContact O-CB 3.42Å; A160-Y164 PolarHBondContact O-N 2.88Å; A160-I171 HydrophobicContact CB-CD1 3.7Å; A160-F254 HydrophobicContact CB-CE1 4.1Å; A160-F254 HydrophobicContact CB-CZ 3.89Å; A160-I269 HydrophobicContact CB-CG2 3.87Å; A160-A273 HydrophobicContact CB-CB 3.8Å
161	W	98.6	Very high	98.7	Very high	64 Å²	64	49.3 Å²	49.3	24%	0.242	24%	0.24	C	C	.	.	H	α-helix	trans	-62.2	-39.9	171.4	167.9	-108.5	0	0	0	113.3	L157 N158 R159 G165 V166 P167 K283	L157-W161 PolarHBondContact O-N 3.23Å; N158-W161 WeakPolarHBondContact O-CB 3.42Å; N158-W161 PolarHBondContact O-N 3.18Å; R159-W161 VanDerWaalsContact C-N 3.31Å; R159-W161 PolarHBondContact O-N 2.69Å; W161-G165 VanDerWaalsContact CE3-C 3.42Å; W161-G165 WeakPolarHBondContact CZ3-O 3.1Å; W161-G165 WeakPolarHBondContact O-CA 3.33Å; W161-G165 PolarHBondContact O-N 2.82Å; W161-V166 WeakPolarHBondContact CA-O 3.42Å; W161-V166 VanDerWaalsContact CE3-C 3.42Å; W161-P167 HydrophobicContact CD2-CB 4.47Å; W161-P167 HydrophobicContact CE3-CB 3.62Å; W161-P167 HydrophobicContact CE3-CG 4.42Å; W161-P167 VanDerWaalsContact CE3-N 3.31Å; W161-P167 HydrophobicContact CH2-CB 4.3Å; W161-P167 HydrophobicContact CZ3-CB 3.5Å; W161-P167 VanDerWaalsContact CZ3-CB 3.5Å; W161-P167 HydrophobicContact CZ3-CG 4.02Å; W161-K283 VanDerWaalsContact CE2-CE 3.48Å; W161-K283 HydrophobicContact CE3-CG 4.45Å; W161-K283 HydrophobicContact CH2-CD 4.44Å; W161-K283 HydrophobicContact CH2-CG 3.63Å; W161-K283 HydrophobicContact CZ2-CD 4.42Å; W161-K283 VanDerWaalsContact CZ2-CE 3.49Å; W161-K283 HydrophobicContact CZ2-CG 4.05Å; W161-K283 HydrophobicContact CZ3-CG 3.83Å; W161-K283 PolarHBondContact O-NZ 2.96Å
162	Q	98.5	Very high	98.7	Very high	130 Å²	130	45.5 Å²	45.5	61%	0.607	22%	0.22	S	C	*	.	H	α-helix	trans	-68.9	-44.9	178.5	-62.3	-51.2	-20.4	0	0	112	N158 R159 A160	N158-Q162 WeakPolarHBondContact O-CG 3.14Å; N158-Q162 PolarHBondContact O-N 3.25Å; R159-Q162 PolarHBondContact O-N 3.4Å; R159-Q162 VanDerWaalsContact O-N 3.08Å; A160-Q162 PolarHBondContact O-N 2.72Å
163	V	98.5	Very high	98.7	Very high	87 Å²	87	39.6 Å²	39.6	53%	0.527	19%	0.193	S	C	.	.	H	α-helix	trans	-75.4	-48.8	-176.1	176.6	0	0	0	0	111.8	R159	R159-V163 HydrophobicContact CG-CG2 4.26Å; R159-V163 WeakPolarHBondContact O-CG2 3.11Å; R159-V163 PolarHBondContact O-N 3Å
164	Y	98.7	Very high	98.7	Very high	33 Å²	33	37.4 Å²	37.4	13%	0.129	18%	0.184	C	C	.	.	H	α-helix	trans	-104.3	-15.9	-170.5	-59	-68.1	0	0	0	113.6	A160 V166 F254 A273 N274 K277	A160-Y164 HydrophobicContact CB-CD2 4.41Å; A160-Y164 WeakPolarHBondContact O-CA 3.35Å; A160-Y164 WeakPolarHBondContact O-CB 3.42Å; A160-Y164 PolarHBondContact O-N 2.88Å; Y164-V166 VanDerWaalsContact C-N 3.26Å; Y164-V166 PolarHBondContact O-N 3.47Å; Y164-F254 HydrophobicContact CE2-CD2 4.24Å; Y164-F254 AromaticContact CE2-CE2 3.72Å; Y164-F254 HydrophobicContact CE2-CE2 3.72Å; Y164-F254 HydrophobicContact CE2-CZ 4.42Å; Y164-A273 HydrophobicContact CD2-CB 3.47Å; Y164-A273 VanDerWaalsContact CD2-CB 3.47Å; Y164-A273 HydrophobicContact CE2-CB 4.28Å; Y164-A273 HydrophobicContact CG-CB 3.92Å; Y164-N274 HydrophobicContact CD1-CB 4.09Å; Y164-N274 HydrophobicContact CE1-CB 3.62Å; Y164-N274 VanDerWaalsContact CE1-OD1 3.31Å; Y164-N274 WeakPolarHBondContact CE1-OD1 3.42Å; Y164-N274 HydrophobicContact CE2-CB 4.4Å; Y164-K277 HydrophobicContact CD1-CB 4.12Å; Y164-K277 HydrophobicContact CD1-CG 4.34Å
165	G	98.5	Very high	98.7	Very high	5 Å²	5	33.9 Å²	33.9	5%	0.052	17%	0.168	C	C	.	.			trans	74.5	14.1	-177.6	0	0	0	0	0	114.5	W161 W281	W161-G165 VanDerWaalsContact CE3-C 3.42Å; W161-G165 WeakPolarHBondContact CZ3-O 3.1Å; W161-G165 WeakPolarHBondContact O-CA 3.33Å; W161-G165 PolarHBondContact O-N 2.82Å; G165-W281 PolarHBondContact O-NE1 2.78Å; G165-W281 VanDerWaalsContact O-NE1 3.08Å
166	V	98.7	Very high	98.7	Very high	0 Å²	0	27.2 Å²	27.2	0%	0	13%	0.132	C	C	.	.			trans	-97.7	120.4	178.8	-175.3	0	0	0	0	108.7	W161 Y164 I170 I171 A273 F276 W281	W161-V166 WeakPolarHBondContact CA-O 3.42Å; W161-V166 VanDerWaalsContact CE3-C 3.42Å; Y164-V166 VanDerWaalsContact C-N 3.26Å; Y164-V166 PolarHBondContact O-N 3.47Å; V166-I170 HydrophobicContact CG1-CB 4.06Å; V166-I170 HydrophobicContact CG1-CG2 3.95Å; V166-I171 HydrophobicContact CG1-CD1 4.4Å; V166-I171 HydrophobicContact CG1-CG1 3.93Å; V166-A273 HydrophobicContact CB-CB 4.21Å; V166-A273 HydrophobicContact CG2-CB 4.42Å; V166-A273 WeakPolarHBondContact CG2-O 3.33Å; V166-F276 HydrophobicContact CB-CB 4.45Å; V166-F276 HydrophobicContact CG1-CB 4.07Å; V166-F276 HydrophobicContact CG1-CG 4.27Å; V166-F276 HydrophobicContact CG2-CB 3.53Å; V166-W281 HydrophobicContact CG2-CB 4.26Å; V166-W281 HydrophobicContact CG2-CG 3.97Å
167	P	98.5	Very high	98.7	Very high	13 Å²	13	27.5 Å²	27.5	8%	0.084	13%	0.133	C	C	.	.			trans	-76.8	151.8	-168.8	32.5	-34.8	0	0	0	110.5	W161 E169 I170 W281	W161-P167 HydrophobicContact CD2-CB 4.47Å; W161-P167 HydrophobicContact CE3-CB 3.62Å; W161-P167 HydrophobicContact CE3-CG 4.42Å; W161-P167 VanDerWaalsContact CE3-N 3.31Å; W161-P167 HydrophobicContact CH2-CB 4.3Å; W161-P167 HydrophobicContact CZ3-CB 3.5Å; W161-P167 VanDerWaalsContact CZ3-CB 3.5Å; W161-P167 HydrophobicContact CZ3-CG 4.02Å; P167-E169 HydrophobicContact CB-CG 4.41Å; P167-E169 WeakPolarHBondContact CB-OE1 3.47Å; P167-E169 WeakPolarHBondContact CB-OE2 3.25Å; P167-E169 HydrophobicContact CG-CG 4.26Å; P167-E169 PolarHBondContact O-N 3.12Å; P167-E169 VanDerWaalsContact O-N 3.14Å; P167-I170 HydrophobicContact CG-CB 4.38Å; P167-I170 HydrophobicContact CG-CG1 3.71Å; P167-I170 PolarHBondContact O-N 3.02Å; P167-W281 VanDerWaalsContact CD-CZ2 3.46Å; P167-W281 HydrophobicContact CG-CZ2 3.94Å
168	P	98.8	Very high	98.7	Very high	12 Å²	12	30 Å²	30	8%	0.078	14%	0.144	C	C	.	.	H	α-helix	trans	-51.6	-39	-175.6	-32.7	39.9	0	0	0	114.4	W150 L157 I170 I171 V172	W150-P168 HydrophobicContact CD2-CB 4.29Å; W150-P168 HydrophobicContact CH2-CB 3.75Å; W150-P168 HydrophobicContact CZ2-CB 3.25Å; W150-P168 HydrophobicContact CZ2-CG 4.05Å; W150-P168 HydrophobicContact CZ3-CB 4.44Å; L157-P168 HydrophobicContact CB-CB 3.94Å; L157-P168 HydrophobicContact CB-CG 4.08Å; L157-P168 HydrophobicContact CD1-CB 4.46Å; L157-P168 HydrophobicContact CD2-CB 4.35Å; L157-P168 HydrophobicContact CG-CB 4.48Å; P168-I170 PolarHBondContact O-N 3.02Å; P168-I171 PolarHBondContact O-N 3.14Å; P168-I171 VanDerWaalsContact O-N 3.17Å; P168-V172 WeakPolarHBondContact O-CB 3.47Å; P168-V172 VanDerWaalsContact O-CG2 3.31Å; P168-V172 WeakPolarHBondContact O-CG2 3.29Å; P168-V172 PolarHBondContact O-N 2.76Å
169	E	98.6	Very high	98.7	Very high	49 Å²	49	26.9 Å²	26.9	23%	0.229	13%	0.128	C	C	.	.	H	α-helix	trans	-58.7	-31.5	179.6	58.4	-91.3	-157.2	0	0	113.2	W150 P167 G173 G368 A372	W150-E169 HydrophobicContact CH2-CB 3.88Å; W150-E169 HydrophobicContact CZ3-CB 3.88Å; P167-E169 HydrophobicContact CB-CG 4.41Å; P167-E169 WeakPolarHBondContact CB-OE1 3.47Å; P167-E169 WeakPolarHBondContact CB-OE2 3.25Å; P167-E169 HydrophobicContact CG-CG 4.26Å; P167-E169 PolarHBondContact O-N 3.12Å; P167-E169 VanDerWaalsContact O-N 3.14Å; E169-G173 WeakPolarHBondContact O-CA 3.48Å; E169-G173 PolarHBondContact O-N 3.39Å; E169-G368 WeakPolarHBondContact O-CA 3.46Å; E169-A372 HydrophobicContact CB-CB 4.4Å
170	I	98.9	Very high	98.6	Very high	2 Å²	2	26.3 Å²	26.3	1%	0.01	13%	0.125	C	C	.	.	H	α-helix	trans	-76.3	-42.8	179.6	-62.8	-67.4	0	0	0	110.1	V166 P167 P168 G173 I174 F276 W281 V287 I351	V166-I170 HydrophobicContact CG1-CB 4.06Å; V166-I170 HydrophobicContact CG1-CG2 3.95Å; P167-I170 HydrophobicContact CG-CB 4.38Å; P167-I170 HydrophobicContact CG-CG1 3.71Å; P167-I170 PolarHBondContact O-N 3.02Å; P168-I170 PolarHBondContact O-N 3.02Å; I170-G173 PolarHBondContact O-N 3.3Å; I170-I174 WeakPolarHBondContact O-CG1 3.49Å; I170-I174 PolarHBondContact O-N 3.16Å; I170-F276 HydrophobicContact CG2-CD1 4.21Å; I170-F276 HydrophobicContact CG2-CE1 3.87Å; I170-F276 HydrophobicContact CG2-CE2 4.31Å; I170-F276 HydrophobicContact CG2-CZ 3.92Å; I170-W281 HydrophobicContact CB-CH2 4.33Å; I170-W281 HydrophobicContact CD1-CH2 3.56Å; I170-W281 HydrophobicContact CD1-CZ2 4.31Å; I170-W281 HydrophobicContact CD1-CZ3 4.32Å; I170-W281 HydrophobicContact CG1-CH2 3.43Å; I170-W281 VanDerWaalsContact CG1-CH2 3.43Å; I170-W281 HydrophobicContact CG1-CZ2 3.74Å; I170-W281 HydrophobicContact CG1-CZ3 4.32Å; I170-W281 HydrophobicContact CG2-CH2 4.14Å; I170-W281 HydrophobicContact CG2-CZ3 4.22Å; I170-V287 HydrophobicContact CD1-CG2 4.13Å; I170-I351 HydrophobicContact CD1-CD1 4.14Å
171	I	98.9	Very high	98.6	Very high	0 Å²	0	27 Å²	27	0%	0	13%	0.128	C	C	.	.	H	α-helix	trans	-64.8	-48.7	177.9	-57.8	165.8	0	0	0	109.8	L157 A160 V166 P168 G173 I174 I175 I269 V272 A273	L157-I171 HydrophobicContact CD2-CB 3.83Å; L157-I171 HydrophobicContact CD2-CD1 4.21Å; L157-I171 HydrophobicContact CD2-CG2 3.74Å; A160-I171 HydrophobicContact CB-CD1 3.7Å; V166-I171 HydrophobicContact CG1-CD1 4.4Å; V166-I171 HydrophobicContact CG1-CG1 3.93Å; P168-I171 PolarHBondContact O-N 3.14Å; P168-I171 VanDerWaalsContact O-N 3.17Å; I171-G173 VanDerWaalsContact C-N 3.29Å; I171-G173 PolarHBondContact O-N 3.41Å; I171-I174 PolarHBondContact O-N 3.46Å; I171-I175 HydrophobicContact CG2-CD1 4Å; I171-I175 WeakPolarHBondContact O-CG1 3.45Å; I171-I175 PolarHBondContact O-N 3.25Å; I171-I269 HydrophobicContact CD1-CG2 4.4Å; I171-I269 HydrophobicContact CG2-CB 4.23Å; I171-I269 HydrophobicContact CG2-CG1 4Å; I171-I269 HydrophobicContact CG2-CG2 4.18Å; I171-V272 HydrophobicContact CB-CG1 4.43Å; I171-V272 HydrophobicContact CG1-CG1 4.35Å; I171-V272 HydrophobicContact CG2-CB 4.26Å; I171-V272 HydrophobicContact CG2-CG1 4.15Å; I171-A273 HydrophobicContact CD1-CB 3.81Å; I171-A273 HydrophobicContact CG1-CB 4.32Å
172	V	98.9	Very high	98.6	Very high	0 Å²	0	24.7 Å²	24.7	0%	0	12%	0.124	C	C	.	.	H	α-helix	trans	-60.6	-39.8	175.3	171.3	0	0	0	0	111.1	F149 W150 L157 P168 G176 W181 V371	F149-V172 HydrophobicContact CD1-CG2 4.26Å; F149-V172 HydrophobicContact CE1-CG2 4.46Å; W150-V172 HydrophobicContact CB-CG2 4.15Å; W150-V172 HydrophobicContact CD2-CG2 3.93Å; W150-V172 HydrophobicContact CE3-CB 4.07Å; W150-V172 HydrophobicContact CE3-CG1 4.09Å; W150-V172 HydrophobicContact CE3-CG2 3.7Å; W150-V172 HydrophobicContact CG-CG2 4.14Å; W150-V172 HydrophobicContact CZ3-CG2 4.47Å; L157-V172 HydrophobicContact CD1-CG2 3.72Å; L157-V172 HydrophobicContact CD2-CG2 3.94Å; P168-V172 WeakPolarHBondContact O-CB 3.47Å; P168-V172 VanDerWaalsContact O-CG2 3.31Å; P168-V172 WeakPolarHBondContact O-CG2 3.29Å; P168-V172 PolarHBondContact O-N 2.76Å; V172-G176 PolarHBondContact O-N 3.4Å; V172-W181 HydrophobicContact CG1-CZ2 4.1Å; V172-W181 PolarHBondContact O-NE1 3.34Å; V172-W181 VanDerWaalsContact O-NE1 3.08Å; V172-V371 HydrophobicContact CG1-CB 4.26Å; V172-V371 HydrophobicContact CG1-CG1 4.02Å; V172-V371 HydrophobicContact CG1-CG2 4.25Å
173	G	98.9	Very high	98.5	Very high	0 Å²	0	26.7 Å²	26.7	0%	0	13%	0.126	C	C	.	.	H	α-helix	trans	-61.6	-44.6	176.1	0	0	0	0	0	112.8	E169 I170 I171 V177 V364	E169-G173 WeakPolarHBondContact O-CA 3.48Å; E169-G173 PolarHBondContact O-N 3.39Å; I170-G173 PolarHBondContact O-N 3.3Å; I171-G173 VanDerWaalsContact C-N 3.29Å; I171-G173 PolarHBondContact O-N 3.41Å; G173-V177 WeakPolarHBondContact O-CB 3.12Å; G173-V177 WeakPolarHBondContact O-CG2 3.34Å; G173-V177 PolarHBondContact O-N 3.39Å; G173-V364 WeakPolarHBondContact CA-O 3.4Å
174	I	98.9	Very high	98.4	Very high	0 Å²	0	26.8 Å²	26.8	0%	0	13%	0.127	C	C	.	.	H	α-helix	trans	-62.7	-57.3	176.8	-71.2	-76.7	0	0	0	110.1	I170 I171 G176 V177 E178 V272 F276 Y354 Y360 V364	I170-I174 WeakPolarHBondContact O-CG1 3.49Å; I170-I174 PolarHBondContact O-N 3.16Å; I171-I174 PolarHBondContact O-N 3.46Å; I174-G176 PolarHBondContact O-N 3.06Å; I174-V177 PolarHBondContact O-N 3.02Å; I174-V177 VanDerWaalsContact O-N 3.11Å; I174-E178 HydrophobicContact CG2-CG 4.21Å; I174-E178 WeakPolarHBondContact O-CB 3.41Å; I174-E178 VanDerWaalsContact O-CG 3.31Å; I174-E178 WeakPolarHBondContact O-CG 3.42Å; I174-E178 PolarHBondContact O-N 2.85Å; I174-V272 HydrophobicContact CB-CG1 4.05Å; I174-V272 HydrophobicContact CG1-CG1 4.26Å; I174-V272 HydrophobicContact CG2-CG1 3.91Å; I174-V272 HydrophobicContact CG2-CG2 4.03Å; I174-F276 HydrophobicContact CD1-CE2 3.79Å; I174-F276 HydrophobicContact CD1-CZ 3.74Å; I174-F276 HydrophobicContact CG1-CE2 3.64Å; I174-F276 HydrophobicContact CG1-CZ 3.86Å; I174-Y354 HydrophobicContact CD1-CD1 4.36Å; I174-Y354 HydrophobicContact CD1-CD2 4.02Å; I174-Y354 HydrophobicContact CD1-CE2 4.4Å; I174-Y354 HydrophobicContact CD1-CG 3.98Å; I174-Y354 HydrophobicContact CG2-CE1 4.05Å; I174-Y354 HydrophobicContact CG2-CE2 4.04Å; I174-Y360 HydrophobicContact CD1-CE1 4.22Å; I174-Y360 WeakPolarHBondContact CD1-OH 3.43Å; I174-V364 HydrophobicContact CD1-CB 4.41Å; I174-V364 HydrophobicContact CD1-CG1 3.72Å; I174-V364 HydrophobicContact CD1-CG2 3.81Å; I174-V364 HydrophobicContact CG1-CG1 3.73Å; I174-V364 HydrophobicContact CG1-CG2 4.49Å
175	I	98.9	Very high	98.3	Very high	0 Å²	0	27.1 Å²	27.1	0%	0	13%	0.13	C	C	.	.	H	α-helix	trans	-58.9	-36.3	-178.2	-67.9	176.7	0	0	0	111.2	F149 I171 T179 R180 W181 Y239 I269 V272	F149-I175 HydrophobicContact CE1-CD1 4.04Å; F149-I175 HydrophobicContact CE1-CG2 4.43Å; F149-I175 HydrophobicContact CE2-CG2 4.37Å; F149-I175 HydrophobicContact CZ-CD1 3.76Å; F149-I175 HydrophobicContact CZ-CG2 4.1Å; I171-I175 HydrophobicContact CG2-CD1 4Å; I171-I175 WeakPolarHBondContact O-CG1 3.45Å; I171-I175 PolarHBondContact O-N 3.25Å; I175-T179 PolarHBondContact O-N 2.99Å; I175-T179 PolarHBondContact O-OG1 3.03Å; I175-R180 PolarHBondContact O-N 3.32Å; I175-W181 HydrophobicContact CG2-CB 4.29Å; I175-W181 HydrophobicContact CG2-CG 4.15Å; I175-W181 PolarHBondContact O-N 3.49Å; I175-Y239 HydrophobicContact CG2-CD1 3.83Å; I175-I269 HydrophobicContact CD1-CG1 3.94Å; I175-V272 HydrophobicContact CG1-CG2 4.41Å
176	G	98.7	Very high	98.2	Very high	0 Å²	0	28.8 Å²	28.8	0%	0	15%	0.147	C	C	.	.	H	α-helix	trans	-67.9	-42.3	177	0	0	0	0	0	113.9	V172 I174 R180 W181	V172-G176 PolarHBondContact O-N 3.4Å; I174-G176 PolarHBondContact O-N 3.06Å; G176-R180 WeakPolarHBondContact O-CA 3.46Å; G176-R180 PolarHBondContact O-N 3.04Å; G176-W181 VanDerWaalsContact CA-CE2 3.41Å
177	V	98.6	Very high	98.1	Very high	14 Å²	14	37.6 Å²	37.6	9%	0.085	19%	0.186	C	C	.	.	H	α-helix	trans	-70.2	-39.5	176.6	167.5	0	0	0	0	111.3	F137 G173 I174 Y360 A363 V364 L367	F137-V177 HydrophobicContact CD1-CB 4.23Å; F137-V177 HydrophobicContact CD1-CG1 4.22Å; F137-V177 HydrophobicContact CD1-CG2 3.99Å; F137-V177 HydrophobicContact CE1-CB 4.26Å; F137-V177 HydrophobicContact CE1-CG1 3.8Å; F137-V177 HydrophobicContact CE1-CG2 4.4Å; F137-V177 WeakPolarHBondContact CE1-O 3.45Å; F137-V177 HydrophobicContact CG-CG2 4.17Å; F137-V177 HydrophobicContact CZ-CG1 4.06Å; G173-V177 WeakPolarHBondContact O-CB 3.12Å; G173-V177 WeakPolarHBondContact O-CG2 3.34Å; G173-V177 PolarHBondContact O-N 3.39Å; I174-V177 PolarHBondContact O-N 3.02Å; I174-V177 VanDerWaalsContact O-N 3.11Å; V177-Y360 HydrophobicContact CG1-CD2 3.9Å; V177-Y360 HydrophobicContact CG1-CE2 3.55Å; V177-A363 HydrophobicContact CG2-CB 4.44Å; V177-V364 HydrophobicContact CB-CG2 4Å; V177-V364 HydrophobicContact CG1-CG2 4.22Å; V177-V364 HydrophobicContact CG2-CB 4.48Å; V177-V364 HydrophobicContact CG2-CG2 3.82Å; V177-L367 HydrophobicContact CG2-CD2 3.97Å
178	E	98.4	Very high	98.1	Very high	52 Å²	52	38.5 Å²	38.5	24%	0.243	19%	0.191	C	C	.	.	H	α-helix	trans	-75	-50.1	-175.8	-69.8	-55	153.3	0	0	112.6	I174 Q241 Y354 Y360	I174-E178 HydrophobicContact CG2-CG 4.21Å; I174-E178 WeakPolarHBondContact O-CB 3.41Å; I174-E178 VanDerWaalsContact O-CG 3.31Å; I174-E178 WeakPolarHBondContact O-CG 3.42Å; I174-E178 PolarHBondContact O-N 2.85Å; E178-Q241 HydrophobicContact CB-CB 4.2Å; E178-Q241 HydrophobicContact CB-CG 3.73Å; E178-Q241 HydrophobicContact CG-CB 4.27Å; E178-Q241 HydrophobicContact CG-CG 4.33Å; E178-Y354 HydrophobicContact CG-CE1 4.49Å; E178-Y360 WeakPolarHBondContact OE1-CE2 3.47Å; E178-Y360 PolarHBondContact OE1-OH 3.44Å
179	T	98.4	Very high	98.1	Very high	1 Å²	1	40.4 Å²	40.4	1%	0.006	20%	0.196	C	C	.	.	H	α-helix	trans	-133.2	4.3	-167.3	61.7	0	0	0	0	114.8	I175 W181 G182 R183 V184 M185 G238 Y239 Q241	I175-T179 PolarHBondContact O-N 2.99Å; I175-T179 PolarHBondContact O-OG1 3.03Å; T179-W181 PolarHBondContact O-N 3.4Å; T179-G182 PolarHBondContact O-N 2.87Å; T179-G182 PolarHBondContact OG1-N 3.15Å; T179-G182 VanDerWaalsContact OG1-N 3.12Å; T179-R183 PolarHBondContact O-N 3.22Å; T179-R183 VanDerWaalsContact O-N 3.15Å; T179-V184 WeakPolarHBondContact CA-O 3.48Å; T179-V184 PolarHBondContact O-N 2.88Å; T179-M185 HydrophobicContact CG2-CB 4.45Å; T179-M185 HydrophobicContact CG2-CG 3.87Å; T179-G238 WeakPolarHBondContact CG2-O 3.34Å; T179-Y239 WeakPolarHBondContact CG2-O 3.37Å; T179-Y239 PolarHBondContact OG1-O 3.15Å; T179-Q241 HydrophobicContact CG2-CG 3.6Å
180	R	97.9	Very high	98.1	Very high	90 Å²	90	38 Å²	38	34%	0.34	19%	0.186	S	C	.	.	T	Hydrogen-bonded Turn	trans	51.8	45.6	-169.9	-56.3	-179.8	175.6	-81.5	-5.4	111	K136 N142 I175 G176 R183	K136-R180 PolarHBondContact O-NH2 2.94Å; N142-R180 PolarHBondContact OD1-NH1 3.34Å; I175-R180 PolarHBondContact O-N 3.32Å; G176-R180 WeakPolarHBondContact O-CA 3.46Å; G176-R180 PolarHBondContact O-N 3.04Å; R180-R183 HydrophobicContact CB-CB 4.23Å; R180-R183 WeakPolarHBondContact O-CG 3.49Å; R180-R183 PolarHBondContact O-N 3.37Å
181	W	98.3	Very high	98.1	Very high	16 Å²	16	38 Å²	38	6%	0.061	19%	0.185	C	C	.	.	T	Hydrogen-bonded Turn	trans	57.7	53	-178	-51.7	-79.7	0	0	0	112.5	N142 N145 F149 V172 I175 G176 T179 R183 Y239 L367 V371	N142-W181 WeakPolarHBondContact O-CH2 3.38Å; N142-W181 WeakPolarHBondContact O-CZ3 3.46Å; N145-W181 HydrophobicContact CB-CE3 3.8Å; N145-W181 HydrophobicContact CB-CZ3 3.81Å; F149-W181 HydrophobicContact CB-CB 3.82Å; F149-W181 HydrophobicContact CB-CD2 4.44Å; F149-W181 HydrophobicContact CB-CG 3.65Å; F149-W181 AromaticContact CD1-CD1 3.31Å; F149-W181 HydrophobicContact CD1-CG 4.2Å; F149-W181 AromaticContact CD1-NE1 3.98Å; F149-W181 HydrophobicContact CD2-CB 3.63Å; F149-W181 AromaticContact CD2-CD1 3.84Å; F149-W181 HydrophobicContact CD2-CG 4.05Å; F149-W181 AromaticContact CE1-CD1 3.91Å; F149-W181 HydrophobicContact CE2-CB 4.34Å; F149-W181 HydrophobicContact CG-CB 3.78Å; F149-W181 AromaticContact CG-CD1 3.26Å; F149-W181 AromaticContact CG-CG 3.7Å; F149-W181 HydrophobicContact CG-CG 3.7Å; V172-W181 HydrophobicContact CG1-CZ2 4.1Å; V172-W181 PolarHBondContact O-NE1 3.34Å; V172-W181 VanDerWaalsContact O-NE1 3.08Å; I175-W181 HydrophobicContact CG2-CB 4.29Å; I175-W181 HydrophobicContact CG2-CG 4.15Å; I175-W181 PolarHBondContact O-N 3.49Å; G176-W181 VanDerWaalsContact CA-CE2 3.41Å; T179-W181 PolarHBondContact O-N 3.4Å; W181-R183 VanDerWaalsContact C-N 3.27Å; W181-R183 PolarHBondContact O-N 2.96Å; W181-Y239 VanDerWaalsContact C-CE1 3.42Å; W181-L367 HydrophobicContact CH2-CD1 4.15Å; W181-L367 HydrophobicContact CH2-CD2 4.06Å; W181-L367 HydrophobicContact CH2-CG 4.37Å; W181-L367 HydrophobicContact CZ2-CD2 4.07Å; W181-L367 HydrophobicContact CZ2-CG 4.34Å; W181-V371 HydrophobicContact CH2-CG2 4.43Å; W181-V371 HydrophobicContact CZ2-CG2 4.12Å
182	G	97.5	Very high	98	Very high	15 Å²	15	38.5 Å²	38.5	16%	0.155	19%	0.188	C	C	.	.	T	Hydrogen-bonded Turn	trans	84.8	-13.7	174.9	0	0	0	0	0	115.4	T179 V184 M185 Y239	T179-G182 PolarHBondContact O-N 2.87Å; T179-G182 PolarHBondContact OG1-N 3.15Å; T179-G182 VanDerWaalsContact OG1-N 3.12Å; G182-V184 PolarHBondContact O-N 3.19Å; G182-M185 WeakPolarHBondContact O-CE 3.37Å; G182-Y239 VanDerWaalsContact N-CE1 3.32Å
183	R	96.8	Very high	98	Very high	171 Å²	171	38.5 Å²	38.5	65%	0.645	19%	0.188	S	C	*	.	T	Hydrogen-bonded Turn	trans	-63.7	-27.5	-179.1	-65.9	178.5	176.8	-91	5.8	113.2	N145 T179 R180 W181	N145-R183 PolarHBondContact OD1-NE 3.27Å; N145-R183 PolarHBondContact OD1-NH2 3.08Å; T179-R183 PolarHBondContact O-N 3.22Å; T179-R183 VanDerWaalsContact O-N 3.15Å; R180-R183 HydrophobicContact CB-CB 4.23Å; R180-R183 WeakPolarHBondContact O-CG 3.49Å; R180-R183 PolarHBondContact O-N 3.37Å; W181-R183 VanDerWaalsContact C-N 3.27Å; W181-R183 PolarHBondContact O-N 2.96Å
184	V	96.3	Very high	98	Very high	90 Å²	90	38.5 Å²	38.5	55%	0.545	19%	0.188	S	C	.	.	T	Hydrogen-bonded Turn	trans	-138.4	77	-179.6	-169.8	0	0	0	0	110	T179 G182	T179-V184 WeakPolarHBondContact CA-O 3.48Å; T179-V184 PolarHBondContact O-N 2.88Å; G182-V184 PolarHBondContact O-N 3.19Å
185	M	96.7	Very high	98	Very high	39 Å²	39	38.5 Å²	38.5	19%	0.192	19%	0.188	C	C	.	.			trans	-88.9	-7.3	175.3	-66.4	-174.5	-81	0	0	114	T179 G182 G231 S232 Y239 Q241	T179-M185 HydrophobicContact CG2-CB 4.45Å; T179-M185 HydrophobicContact CG2-CG 3.87Å; G182-M185 WeakPolarHBondContact O-CE 3.37Å; M185-G231 CarbonylContact O-C 3.53Å; M185-G231 WeakPolarHBondContact O-CA 3.46Å; M185-S232 PolarHBondContact O-N 3.41Å; M185-Y239 HydrophobicContact CE-CE2 4.01Å; M185-Y239 HydrophobicContact SD-CD2 3.62Å; M185-Y239 HydrophobicContact SD-CE2 3.7Å; M185-Y239 HydrophobicContact SD-CG 4.21Å; M185-Q241 PolarHBondContact O-NE2 3.31Å
186	G	96.7	Very high	98	Very high	41 Å²	41	38.5 Å²	38.5	42%	0.423	19%	0.188	S	C	.	.			trans	95	165.4	-169.4	0	0	0	0	0	112.1	G231	G186-G231 CarbonylContact C-O 3.57Å; G186-G231 VanDerWaalsContact CA-O 3.29Å; G186-G231 WeakPolarHBondContact CA-O 3.49Å
187	K	97	Very high	98	Very high	184 Å²	184	38.5 Å²	38.5	80%	0.8	19%	0.188	S	C	*	.			trans	-133.9	3.4	-171.6	63.4	179.2	179	178.8	0	112.9	G231	K187-G231 PolarHBondContact N-O 2.88Å
188	T	98.3	Very high	97.9	Very high	32 Å²	32	37.9 Å²	37.9	20%	0.196	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.4	131.9	-177.3	-53.5	0	0	0	0	107.9	L104 V107 I190 A193 K230 G231	L104-T188 HydrophobicContact CD1-CG2 3.44Å; L104-T188 VanDerWaalsContact CD1-CG2 3.44Å; V107-T188 HydrophobicContact CG2-CG2 4.45Å; T188-I190 PolarHBondContact O-N 3.26Å; T188-A193 HydrophobicContact CG2-CB 3.96Å; T188-K230 CarbonylContact O-C 3.52Å; T188-K230 VanDerWaalsContact O-CA 3.3Å; T188-K230 WeakPolarHBondContact O-CA 3.38Å; T188-G231 PolarHBondContact N-O 3Å; T188-G231 PolarHBondContact O-N 3.33Å
189	R	98.3	Very high	97.9	Very high	52 Å²	52	35.8 Å²	35.8	20%	0.196	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-57.8	127.7	170	-67.1	-169	-65.7	174.8	10.1	108.4	Q100 L191 D192 A193 L227 L229	Q100-R189 PolarHBondContact O-NH2 3.19Å; R189-L191 PolarHBondContact O-N 2.84Å; R189-D192 HydrophobicContact CB-CB 4.15Å; R189-D192 IonicContact CZ-OD1 3.78Å; R189-D192 IonicContact CZ-OD2 2.62Å; R189-D192 VanDerWaalsContact CZ-OD2 3.31Å; R189-D192 IonicContact NE-OD1 3.69Å; R189-D192 PolarHBondContact NE-OD1 2.94Å; R189-D192 IonicContact NE-OD2 3.54Å; R189-D192 PolarHBondContact NE-OD2 3.34Å; R189-D192 VanDerWaalsContact NH2-CG 3.28Å; R189-D192 IonicContact NH2-OD1 2.75Å; R189-D192 PolarHBondContact NH2-OD1 2.84Å; R189-D192 IonicContact NH2-OD2 2.7Å; R189-D192 PolarHBondContact NH2-OD2 3.24Å; R189-D192 PolarHBondContact O-N 3.14Å; R189-D192 VanDerWaalsContact O-N 3.12Å; R189-A193 PolarHBondContact O-N 3.08Å; R189-A193 VanDerWaalsContact O-N 3.08Å; R189-L227 WeakPolarHBondContact CD-O 3.12Å; R189-L227 VanDerWaalsContact NH1-CD2 3.31Å; R189-L229 WeakPolarHBondContact CA-O 3.29Å
190	I	98.6	Very high	97.8	Very high	0 Å²	0	38.2 Å²	38.2	0%	0	19%	0.187	C	C	.	.	H	α-helix	trans	-62.6	-38	-176.9	-69.3	160.7	0	0	0	109.9	T188 D192 A193 L194 F215 L229 M237 W263	T188-I190 PolarHBondContact O-N 3.26Å; I190-D192 PolarHBondContact O-N 2.88Å; I190-A193 PolarHBondContact O-N 3.31Å; I190-L194 HydrophobicContact CG2-CD1 3.5Å; I190-L194 HydrophobicContact CG2-CG 4.01Å; I190-L194 WeakPolarHBondContact O-CB 3.36Å; I190-L194 WeakPolarHBondContact O-CG 3.46Å; I190-L194 PolarHBondContact O-N 3Å; I190-F215 HydrophobicContact CB-CD2 4.22Å; I190-F215 HydrophobicContact CB-CE1 4.35Å; I190-F215 HydrophobicContact CB-CE2 3.69Å; I190-F215 HydrophobicContact CB-CZ 3.77Å; I190-F215 HydrophobicContact CD1-CE2 4.02Å; I190-F215 HydrophobicContact CG1-CE2 4.49Å; I190-F215 HydrophobicContact CG2-CD1 4.08Å; I190-F215 HydrophobicContact CG2-CD2 3.46Å; I190-F215 VanDerWaalsContact CG2-CD2 3.46Å; I190-F215 HydrophobicContact CG2-CE1 4.1Å; I190-F215 HydrophobicContact CG2-CE2 3.47Å; I190-F215 VanDerWaalsContact CG2-CE2 3.47Å; I190-F215 HydrophobicContact CG2-CG 3.78Å; I190-F215 HydrophobicContact CG2-CZ 3.82Å; I190-L229 HydrophobicContact CD1-CB 4.15Å; I190-L229 PolarHBondContact N-O 3.48Å; I190-M237 HydrophobicContact CD1-CB 4.18Å; I190-M237 HydrophobicContact CD1-CG 3.57Å; I190-M237 HydrophobicContact CD1-SD 3.93Å; I190-M237 HydrophobicContact CG1-CG 4.47Å; I190-W263 HydrophobicContact CD1-CH2 3.65Å; I190-W263 HydrophobicContact CD1-CZ2 3.47Å; I190-W263 VanDerWaalsContact CD1-CZ2 3.47Å
191	L	98.5	Very high	97.6	Very high	0 Å²	0	34.4 Å²	34.4	0%	0	17%	0.173	C	C	.	.	H	α-helix	trans	-53.7	-50.5	172.3	-174.9	66.4	0	0	0	112.2	I97 L98 A101 R189 A193 A195 L212 F215 L216 L227	I97-L191 HydrophobicContact CB-CD2 4.12Å; I97-L191 HydrophobicContact CD1-CD1 4.32Å; L98-L191 HydrophobicContact CD2-CD1 4.41Å; A101-L191 HydrophobicContact CB-CD2 4.1Å; A101-L191 HydrophobicContact CB-CG 4.09Å; R189-L191 PolarHBondContact O-N 2.84Å; L191-A193 PolarHBondContact O-N 2.99Å; L191-A195 WeakPolarHBondContact O-CB 3.39Å; L191-A195 PolarHBondContact O-N 3.44Å; L191-L212 HydrophobicContact CD1-CD1 3.99Å; L191-F215 HydrophobicContact CB-CE1 4.12Å; L191-F215 HydrophobicContact CD1-CE1 4.48Å; L191-L216 HydrophobicContact CD1-CD2 4.03Å; L191-L227 HydrophobicContact CD2-CD2 3.53Å; L191-L227 HydrophobicContact CD2-CG 4.1Å
192	D	98.5	Very high	97.3	Very high	11 Å²	11	39.3 Å²	39.3	6%	0.059	21%	0.207	C	C	.	.	H	α-helix	trans	-62.3	-44.9	-179.7	-68.2	-15.8	0	0	0	111.8	A101 K102 L104 R189 I190 T196	A101-D192 VanDerWaalsContact CA-OD1 3.27Å; A101-D192 WeakPolarHBondContact CA-OD1 3.2Å; K102-D192 PolarHBondContact N-OD1 2.97Å; L104-D192 HydrophobicContact CD1-CB 3.63Å; L104-D192 HydrophobicContact CG-CB 4.07Å; R189-D192 HydrophobicContact CB-CB 4.15Å; R189-D192 IonicContact CZ-OD1 3.78Å; R189-D192 IonicContact CZ-OD2 2.62Å; R189-D192 VanDerWaalsContact CZ-OD2 3.31Å; R189-D192 IonicContact NE-OD1 3.69Å; R189-D192 PolarHBondContact NE-OD1 2.94Å; R189-D192 IonicContact NE-OD2 3.54Å; R189-D192 PolarHBondContact NE-OD2 3.34Å; R189-D192 VanDerWaalsContact NH2-CG 3.28Å; R189-D192 IonicContact NH2-OD1 2.75Å; R189-D192 PolarHBondContact NH2-OD1 2.84Å; R189-D192 IonicContact NH2-OD2 2.7Å; R189-D192 PolarHBondContact NH2-OD2 3.24Å; R189-D192 PolarHBondContact O-N 3.14Å; R189-D192 VanDerWaalsContact O-N 3.12Å; I190-D192 PolarHBondContact O-N 2.88Å; D192-T196 WeakPolarHBondContact O-CB 3.43Å; D192-T196 PolarHBondContact O-N 3.04Å; D192-T196 PolarHBondContact O-OG1 3.31Å
193	A	98.6	Very high	97	Very high	0 Å²	0	44.8 Å²	44.8	0%	0	22%	0.223	C	C	.	.	H	α-helix	trans	-61.5	-52.5	179.6	0	0	0	0	0	111.3	T188 R189 I190 L191 T196 L197 F233	T188-A193 HydrophobicContact CG2-CB 3.96Å; R189-A193 PolarHBondContact O-N 3.08Å; R189-A193 VanDerWaalsContact O-N 3.08Å; I190-A193 PolarHBondContact O-N 3.31Å; L191-A193 PolarHBondContact O-N 2.99Å; A193-T196 PolarHBondContact O-N 2.81Å; A193-L197 WeakPolarHBondContact O-CB 3.12Å; A193-L197 WeakPolarHBondContact O-CD1 3.46Å; A193-L197 VanDerWaalsContact O-CG 3.27Å; A193-L197 WeakPolarHBondContact O-CG 3.5Å; A193-L197 PolarHBondContact O-N 2.88Å; A193-F233 WeakPolarHBondContact CB-O 3.4Å
194	L	98.7	Very high	96.8	Very high	0 Å²	0	41.4 Å²	41.4	0%	0	21%	0.21	C	C	.	.	H	α-helix	trans	-71.1	-39.6	-176.5	-67.3	179.7	0	0	0	111.7	I190 L197 S198 F208 E211 L212 F215 P244	I190-L194 HydrophobicContact CG2-CD1 3.5Å; I190-L194 HydrophobicContact CG2-CG 4.01Å; I190-L194 WeakPolarHBondContact O-CB 3.36Å; I190-L194 WeakPolarHBondContact O-CG 3.46Å; I190-L194 PolarHBondContact O-N 3Å; L194-L197 PolarHBondContact O-N 3.37Å; L194-S198 WeakPolarHBondContact O-CB 3.31Å; L194-S198 PolarHBondContact O-N 3.07Å; L194-S198 PolarHBondContact O-OG 2.94Å; L194-F208 HydrophobicContact CD2-CD1 3.99Å; L194-E211 HydrophobicContact CD1-CB 4.39Å; L194-E211 HydrophobicContact CD2-CB 3.93Å; L194-L212 HydrophobicContact CB-CB 4.04Å; L194-L212 HydrophobicContact CB-CD1 3.86Å; L194-L212 HydrophobicContact CB-CG 4.47Å; L194-F215 HydrophobicContact CD1-CB 3.8Å; L194-F215 HydrophobicContact CD1-CD1 4.45Å; L194-F215 HydrophobicContact CD1-CG 4.11Å; L194-P244 HydrophobicContact CD1-CG 3.88Å
195	A	98.5	Very high	96.8	Very high	0 Å²	0	38.1 Å²	38.1	0%	0	19%	0.192	C	C	.	.	H	α-helix	trans	-61.6	-45.7	173.6	0	0	0	0	0	111.7	F70 L98 A101 L191 L197 S198 F199	F70-A195 HydrophobicContact CD2-CB 4.35Å; F70-A195 HydrophobicContact CE1-CB 4.38Å; F70-A195 HydrophobicContact CE2-CB 3.75Å; F70-A195 HydrophobicContact CZ-CB 3.76Å; L98-A195 HydrophobicContact CD2-CB 4.41Å; A101-A195 HydrophobicContact CB-CB 4.39Å; L191-A195 WeakPolarHBondContact O-CB 3.39Å; L191-A195 PolarHBondContact O-N 3.44Å; A195-L197 VanDerWaalsContact C-N 3.34Å; A195-L197 PolarHBondContact O-N 3.32Å; A195-S198 PolarHBondContact O-N 3.47Å; A195-F199 HydrophobicContact CB-CD2 4.06Å; A195-F199 HydrophobicContact CB-CE2 3.94Å; A195-F199 WeakPolarHBondContact O-CB 3.45Å; A195-F199 WeakPolarHBondContact O-CD2 3.39Å; A195-F199 WeakPolarHBondContact O-CG 3.24Å; A195-F199 PolarHBondContact O-N 2.95Å
196	T	98.3	Very high	96.8	Very high	0 Å²	0	44.7 Å²	44.7	0%	0	22%	0.223	C	C	.	.	H	α-helix	trans	-56.7	-48.2	175.2	-63	0	0	0	0	111.4	K102 R103 L104 V107 L108 D192 A193 N200	K102-T196 PolarHBondContact O-OG1 3.36Å; R103-T196 WeakPolarHBondContact CA-OG1 3.32Å; R103-T196 HydrophobicContact CG-CG2 4.42Å; L104-T196 HydrophobicContact CB-CG2 4.49Å; L104-T196 PolarHBondContact N-OG1 2.93Å; V107-T196 HydrophobicContact CB-CG2 4.36Å; V107-T196 HydrophobicContact CG1-CG2 4.35Å; L108-T196 HydrophobicContact CD1-CG2 4.33Å; L108-T196 HydrophobicContact CD2-CG2 3.72Å; L108-T196 HydrophobicContact CG-CG2 3.77Å; D192-T196 WeakPolarHBondContact O-CB 3.43Å; D192-T196 PolarHBondContact O-N 3.04Å; D192-T196 PolarHBondContact O-OG1 3.31Å; A193-T196 PolarHBondContact O-N 2.81Å; T196-N200 WeakPolarHBondContact O-CA 3.31Å; T196-N200 WeakPolarHBondContact O-CB 3.39Å; T196-N200 PolarHBondContact O-N 3.4Å
197	L	98.1	Very high	96.8	Very high	0 Å²	0	47.1 Å²	47.1	0%	0	22%	0.22	C	C	.	.	H	α-helix	trans	-73.7	-28	-178	-68.9	167.4	0	0	0	113.2	V107 M111 A193 L194 A195 Y201 F208	V107-L197 HydrophobicContact CG1-CD1 3.87Å; V107-L197 HydrophobicContact CG1-CD2 3.77Å; V107-L197 HydrophobicContact CG1-CG 3.64Å; M111-L197 HydrophobicContact CB-CD2 4.12Å; M111-L197 HydrophobicContact CE-CD1 3.76Å; M111-L197 HydrophobicContact CE-CD2 3.87Å; M111-L197 HydrophobicContact CG-CD2 4.03Å; A193-L197 WeakPolarHBondContact O-CB 3.12Å; A193-L197 WeakPolarHBondContact O-CD1 3.46Å; A193-L197 VanDerWaalsContact O-CG 3.27Å; A193-L197 WeakPolarHBondContact O-CG 3.5Å; A193-L197 PolarHBondContact O-N 2.88Å; L194-L197 PolarHBondContact O-N 3.37Å; A195-L197 VanDerWaalsContact C-N 3.34Å; A195-L197 PolarHBondContact O-N 3.32Å; L197-Y201 HydrophobicContact CD2-CD1 3.98Å; L197-Y201 HydrophobicContact CD2-CG 4.06Å; L197-Y201 WeakPolarHBondContact O-CB 3.37Å; L197-F208 HydrophobicContact CB-CB 3.74Å; L197-F208 HydrophobicContact CB-CD1 3.97Å; L197-F208 HydrophobicContact CB-CD2 3.62Å; L197-F208 HydrophobicContact CB-CE2 4.19Å; L197-F208 HydrophobicContact CB-CG 3.5Å; L197-F208 VanDerWaalsContact CB-CG 3.5Å; L197-F208 HydrophobicContact CD1-CD1 3.82Å; L197-F208 HydrophobicContact CD1-CD2 4.33Å; L197-F208 HydrophobicContact CD1-CE1 3.65Å; L197-F208 HydrophobicContact CD1-CE2 4.17Å; L197-F208 HydrophobicContact CD1-CG 4.17Å; L197-F208 HydrophobicContact CD1-CZ 3.85Å; L197-F208 HydrophobicContact CD2-CD2 4.41Å; L197-F208 HydrophobicContact CD2-CE2 4.2Å; L197-F208 HydrophobicContact CG-CD2 4.34Å; L197-F208 HydrophobicContact CG-CE2 4.43Å; L197-F208 HydrophobicContact CG-CG 4.38Å
198	S	98.3	Very high	96.9	Very high	1 Å²	1	38.5 Å²	38.5	1%	0.007	18%	0.182	C	C	.	.	H	α-helix	trans	-75	-42.8	177.4	-59	0	0	0	0	111	L194 A195 A205 F208 S209	L194-S198 WeakPolarHBondContact O-CB 3.31Å; L194-S198 PolarHBondContact O-N 3.07Å; L194-S198 PolarHBondContact O-OG 2.94Å; A195-S198 PolarHBondContact O-N 3.47Å; S198-A205 VanDerWaalsContact O-CB 3.32Å; S198-A205 WeakPolarHBondContact O-CB 3.3Å; S198-F208 PolarHBondContact OG-O 3.41Å; S198-F208 VanDerWaalsContact OG-O 3.07Å; S198-S209 WeakPolarHBondContact CB-OG 3.34Å; S198-S209 WeakPolarHBondContact OG-CA 3.18Å; S198-S209 PolarHBondContact OG-N 2.96Å
199	F	97.8	Very high	96.9	Very high	9 Å²	9	38.2 Å²	38.2	4%	0.039	18%	0.182	C	C	.	.	H	α-helix	trans	-105.7	-17.2	-166.6	-50.8	-39.3	0	0	0	114.5	F70 N73 N75 A76 F79 L98 A195 L212	F70-F199 HydrophobicContact CD1-CB 4.05Å; F70-F199 AromaticContact CD1-CD2 3.6Å; F70-F199 HydrophobicContact CD1-CD2 3.6Å; F70-F199 HydrophobicContact CD1-CG 4.3Å; F70-F199 HydrophobicContact CE1-CB 4.08Å; F70-F199 AromaticContact CE1-CD2 3.87Å; F70-F199 HydrophobicContact CE1-CD2 3.87Å; F70-F199 HydrophobicContact CE1-CG 4.49Å; F70-F199 HydrophobicContact CG-CD2 4.13Å; N73-F199 PolarHBondContact ND2-O 3.02Å; N75-F199 HydrophobicContact CB-CB 4.41Å; N75-F199 HydrophobicContact CB-CD1 3.75Å; N75-F199 HydrophobicContact CB-CG 4.44Å; A76-F199 HydrophobicContact CB-CD1 4.5Å; A76-F199 HydrophobicContact CB-CD2 3.97Å; A76-F199 HydrophobicContact CB-CE1 4.43Å; A76-F199 HydrophobicContact CB-CE2 3.87Å; A76-F199 HydrophobicContact CB-CG 4.29Å; A76-F199 HydrophobicContact CB-CZ 4.11Å; F79-F199 HydrophobicContact CB-CE1 3.7Å; F79-F199 HydrophobicContact CB-CZ 3.84Å; F79-F199 HydrophobicContact CD1-CZ 4.01Å; F79-F199 HydrophobicContact CD2-CE1 4.43Å; F79-F199 HydrophobicContact CD2-CZ 4.48Å; F79-F199 HydrophobicContact CG-CE1 4.02Å; F79-F199 AromaticContact CG-CZ 3.85Å; F79-F199 HydrophobicContact CG-CZ 3.85Å; L98-F199 HydrophobicContact CD2-CE2 4.1Å; A195-F199 HydrophobicContact CB-CD2 4.06Å; A195-F199 HydrophobicContact CB-CE2 3.94Å; A195-F199 WeakPolarHBondContact O-CB 3.45Å; A195-F199 WeakPolarHBondContact O-CD2 3.39Å; A195-F199 WeakPolarHBondContact O-CG 3.24Å; A195-F199 PolarHBondContact O-N 2.95Å; F199-L212 HydrophobicContact CE1-CD2 4.38Å; F199-L212 HydrophobicContact CE2-CD2 4Å; F199-L212 HydrophobicContact CZ-CD2 3.6Å
200	N	95.5	Very high	96.9	Very high	51 Å²	51	37 Å²	37	27%	0.273	18%	0.184	S	C	.	.	S	Bend	trans	-128.4	11.4	-178.2	-60.5	120.2	0	0	0	114.3	F70 R103 L108 T196	F70-N200 VanDerWaalsContact CE1-OD1 3.28Å; F70-N200 WeakPolarHBondContact CE1-OD1 3.39Å; R103-N200 WeakPolarHBondContact CD-OD1 3.49Å; L108-N200 HydrophobicContact CD1-CB 4.44Å; T196-N200 WeakPolarHBondContact O-CA 3.31Å; T196-N200 WeakPolarHBondContact O-CB 3.39Å; T196-N200 PolarHBondContact O-N 3.4Å
201	Y	94.6	Very high	96.9	Very high	11 Å²	11	37.2 Å²	37.2	4%	0.043	19%	0.186	C	C	.	.			trans	-127.1	76.4	178.4	-165.1	-116.4	0	0	0	113.4	L108 M111 D112 L197 R203 R204 A205 F208	L108-Y201 HydrophobicContact CD2-CD2 3.84Å; L108-Y201 HydrophobicContact CD2-CG 4.19Å; M111-Y201 HydrophobicContact CB-CE1 4.22Å; M111-Y201 HydrophobicContact CB-CE2 4.38Å; M111-Y201 HydrophobicContact CG-CD1 4.11Å; M111-Y201 HydrophobicContact CG-CE1 3.3Å; M111-Y201 HydrophobicContact CG-CE2 4.29Å; M111-Y201 WeakPolarHBondContact CG-OH 3.38Å; M111-Y201 PolarHBondContact O-OH 3.19Å; D112-Y201 WeakPolarHBondContact OD1-CE2 3.24Å; D112-Y201 PolarHBondContact OD1-OH 2.88Å; D112-Y201 VanDerWaalsContact OD1-OH 3.07Å; L197-Y201 HydrophobicContact CD2-CD1 3.98Å; L197-Y201 HydrophobicContact CD2-CG 4.06Å; L197-Y201 WeakPolarHBondContact O-CB 3.37Å; Y201-R203 HydrophobicContact CE1-CB 4.32Å; Y201-R203 PolarHBondContact O-N 3.34Å; Y201-R203 PolarHBondContact OH-NH1 3.28Å; Y201-R203 PolarHBondContact OH-NH2 2.94Å; Y201-R204 HydrophobicContact CD1-CB 4.06Å; Y201-R204 HydrophobicContact CE1-CB 4.14Å; Y201-R204 HydrophobicContact CE1-CG 4.26Å; Y201-R204 PolarHBondContact O-N 2.82Å; Y201-R204 VanDerWaalsContact O-N 3.14Å; Y201-A205 WeakPolarHBondContact O-CB 3.23Å; Y201-A205 PolarHBondContact O-N 2.7Å; Y201-F208 HydrophobicContact CD1-CE2 4.44Å
202	P	92.5	Very high	96.9	Very high	118 Å²	118	37.2 Å²	37.2	77%	0.766	19%	0.186	S	C	*	.	G	3₁₀ helix	trans	-52.7	-36.4	-168.7	-28.6	35.1	0	0	0	114.7	R204 A205	P202-R204 PolarHBondContact O-N 2.73Å; P202-R204 VanDerWaalsContact O-N 3.12Å; P202-A205 PolarHBondContact O-N 3.47Å
203	R	90.3	Very high	97	Very high	131 Å²	131	37.5 Å²	37.5	49%	0.494	19%	0.187	S	C	.	.	G	3₁₀ helix	trans	-57.5	-30.1	-176.3	-167.6	172.7	80.5	-126.6	8.6	113.9	M111 D112 Y201	M111-R203 PolarHBondContact O-NH2 2.78Å; D112-R203 IonicContact OD1-CZ 3.49Å; D112-R203 IonicContact OD1-NH1 2.74Å; D112-R203 PolarHBondContact OD1-NH1 3.06Å; Y201-R203 HydrophobicContact CE1-CB 4.32Å; Y201-R203 PolarHBondContact O-N 3.34Å; Y201-R203 PolarHBondContact OH-NH1 3.28Å; Y201-R203 PolarHBondContact OH-NH2 2.94Å
204	R	92.9	Very high	97	Very high	100 Å²	100	38.3 Å²	38.3	38%	0.377	19%	0.192	S	C	.	.	G	3₁₀ helix	trans	-136.6	18.3	-178.6	-64.9	-175.7	65.8	-171.5	0.2	112.9	Y201 P202 E206 Y207 F208	Y201-R204 HydrophobicContact CD1-CB 4.06Å; Y201-R204 HydrophobicContact CE1-CB 4.14Å; Y201-R204 HydrophobicContact CE1-CG 4.26Å; Y201-R204 PolarHBondContact O-N 2.82Å; Y201-R204 VanDerWaalsContact O-N 3.14Å; P202-R204 PolarHBondContact O-N 2.73Å; P202-R204 VanDerWaalsContact O-N 3.12Å; R204-E206 VanDerWaalsContact C-N 3.31Å; R204-E206 PolarHBondContact O-N 3.4Å; R204-Y207 VanDerWaalsContact NH2-CD1 3.3Å; R204-Y207 PolarHBondContact O-N 3.21Å; R204-F208 HydrophobicContact CB-CD2 3.66Å; R204-F208 HydrophobicContact CB-CE2 3.57Å; R204-F208 HydrophobicContact CG-CE2 4.42Å; R204-F208 VanDerWaalsContact O-CD2 3.25Å; R204-F208 WeakPolarHBondContact O-CD2 3.41Å; R204-F208 PolarHBondContact O-N 3.41Å; R204-F208 VanDerWaalsContact O-N 3.09Å
205	A	96.1	Very high	97	Very high	21 Å²	21	38.3 Å²	38.3	17%	0.174	19%	0.192	C	C	.	.	H	α-helix	trans	-55.3	-43.3	-173.2	0	0	0	0	0	112.8	S198 Y201 P202 F208 S209	S198-A205 VanDerWaalsContact O-CB 3.32Å; S198-A205 WeakPolarHBondContact O-CB 3.3Å; Y201-A205 WeakPolarHBondContact O-CB 3.23Å; Y201-A205 PolarHBondContact O-N 2.7Å; P202-A205 PolarHBondContact O-N 3.47Å; A205-F208 PolarHBondContact O-N 3.29Å; A205-S209 VanDerWaalsContact O-CB 3.3Å; A205-S209 WeakPolarHBondContact O-CB 3.48Å; A205-S209 PolarHBondContact O-N 3.09Å; A205-S209 PolarHBondContact O-OG 3.48Å
206	E	96.9	Very high	97	Very high	177 Å²	177	38.3 Å²	38.3	83%	0.827	19%	0.192	S	C	*	.	H	α-helix	trans	-62.8	-46.9	179.8	-175.8	-179.7	-173.9	0	0	112.3	R204 F208 S209 G210	R204-E206 VanDerWaalsContact C-N 3.31Å; R204-E206 PolarHBondContact O-N 3.4Å; E206-F208 PolarHBondContact O-N 3.44Å; E206-S209 PolarHBondContact O-N 3.48Å; E206-G210 PolarHBondContact O-N 3.38Å; E206-G210 VanDerWaalsContact O-N 3.08Å
207	Y	97.4	Very high	96.9	Very high	92 Å²	92	39.1 Å²	39.1	36%	0.361	20%	0.196	S	C	.	.	H	α-helix	trans	-57.3	-51.8	176	169.7	-101.8	0	0	0	111	R204 S209 G210 E211	R204-Y207 VanDerWaalsContact NH2-CD1 3.3Å; R204-Y207 PolarHBondContact O-N 3.21Å; Y207-S209 VanDerWaalsContact C-N 3.3Å; Y207-S209 PolarHBondContact O-N 3.39Å; Y207-G210 PolarHBondContact O-N 3.02Å; Y207-G210 VanDerWaalsContact O-N 3.12Å; Y207-E211 HydrophobicContact CD1-CG 4.47Å; Y207-E211 HydrophobicContact CE1-CG 3.93Å; Y207-E211 HydrophobicContact CE2-CG 4.11Å; Y207-E211 VanDerWaalsContact CE2-OE1 3.24Å; Y207-E211 WeakPolarHBondContact CE2-OE1 3.49Å; Y207-E211 PolarHBondContact O-N 2.74Å; Y207-E211 VanDerWaalsContact O-N 3.1Å; Y207-E211 PolarHBondContact OH-OE1 3.28Å
208	F	98.3	Very high	96.9	Very high	3 Å²	3	39.4 Å²	39.4	1%	0.013	20%	0.197	C	C	.	.	H	α-helix	trans	-69.2	-28.3	-178.5	-72.1	-66.7	0	0	0	113	M111 L194 L197 S198 Y201 R204 A205 E206 G210 E211 L212 M243	M111-F208 HydrophobicContact CE-CE1 4.24Å; M111-F208 HydrophobicContact CE-CE2 4.03Å; M111-F208 HydrophobicContact CE-CZ 3.44Å; M111-F208 VanDerWaalsContact CE-CZ 3.44Å; M111-F208 HydrophobicContact SD-CE2 4.39Å; M111-F208 HydrophobicContact SD-CZ 4.13Å; L194-F208 HydrophobicContact CD2-CD1 3.99Å; L197-F208 HydrophobicContact CB-CB 3.74Å; L197-F208 HydrophobicContact CB-CD1 3.97Å; L197-F208 HydrophobicContact CB-CD2 3.62Å; L197-F208 HydrophobicContact CB-CE2 4.19Å; L197-F208 HydrophobicContact CB-CG 3.5Å; L197-F208 VanDerWaalsContact CB-CG 3.5Å; L197-F208 HydrophobicContact CD1-CD1 3.82Å; L197-F208 HydrophobicContact CD1-CD2 4.33Å; L197-F208 HydrophobicContact CD1-CE1 3.65Å; L197-F208 HydrophobicContact CD1-CE2 4.17Å; L197-F208 HydrophobicContact CD1-CG 4.17Å; L197-F208 HydrophobicContact CD1-CZ 3.85Å; L197-F208 HydrophobicContact CD2-CD2 4.41Å; L197-F208 HydrophobicContact CD2-CE2 4.2Å; L197-F208 HydrophobicContact CG-CD2 4.34Å; L197-F208 HydrophobicContact CG-CE2 4.43Å; L197-F208 HydrophobicContact CG-CG 4.38Å; S198-F208 PolarHBondContact OG-O 3.41Å; S198-F208 VanDerWaalsContact OG-O 3.07Å; Y201-F208 HydrophobicContact CD1-CE2 4.44Å; R204-F208 HydrophobicContact CB-CD2 3.66Å; R204-F208 HydrophobicContact CB-CE2 3.57Å; R204-F208 HydrophobicContact CG-CE2 4.42Å; R204-F208 VanDerWaalsContact O-CD2 3.25Å; R204-F208 WeakPolarHBondContact O-CD2 3.41Å; R204-F208 PolarHBondContact O-N 3.41Å; R204-F208 VanDerWaalsContact O-N 3.09Å; A205-F208 PolarHBondContact O-N 3.29Å; E206-F208 PolarHBondContact O-N 3.44Å; F208-G210 VanDerWaalsContact C-N 3.3Å; F208-G210 PolarHBondContact O-N 2.92Å; F208-E211 PolarHBondContact O-N 3.49Å; F208-L212 WeakPolarHBondContact O-CB 3.41Å; F208-L212 PolarHBondContact O-N 3.5Å; F208-M243 HydrophobicContact CE1-CE 4.45Å
209	S	98.4	Very high	96.9	Very high	26 Å²	26	39.4 Å²	39.4	18%	0.182	20%	0.197	C	C	.	.	H	α-helix	trans	-65	-35.9	172	-61.3	0	0	0	0	111.6	S198 A205 E206 Y207 E213	S198-S209 WeakPolarHBondContact CB-OG 3.34Å; S198-S209 WeakPolarHBondContact OG-CA 3.18Å; S198-S209 PolarHBondContact OG-N 2.96Å; A205-S209 VanDerWaalsContact O-CB 3.3Å; A205-S209 WeakPolarHBondContact O-CB 3.48Å; A205-S209 PolarHBondContact O-N 3.09Å; A205-S209 PolarHBondContact O-OG 3.48Å; E206-S209 PolarHBondContact O-N 3.48Å; Y207-S209 VanDerWaalsContact C-N 3.3Å; Y207-S209 PolarHBondContact O-N 3.39Å; S209-E213 WeakPolarHBondContact O-CB 3.28Å; S209-E213 PolarHBondContact O-N 3.3Å
210	G	98.6	Very high	96.8	Very high	25 Å²	25	41.4 Å²	41.4	26%	0.258	20%	0.204	S	C	.	.	H	α-helix	trans	-68.4	-36.9	172.4	0	0	0	0	0	113.2	E206 Y207 F208 T214	E206-G210 PolarHBondContact O-N 3.38Å; E206-G210 VanDerWaalsContact O-N 3.08Å; Y207-G210 PolarHBondContact O-N 3.02Å; Y207-G210 VanDerWaalsContact O-N 3.12Å; F208-G210 VanDerWaalsContact C-N 3.3Å; F208-G210 PolarHBondContact O-N 2.92Å; G210-T214 WeakPolarHBondContact O-CB 3.44Å; G210-T214 PolarHBondContact O-N 3.24Å; G210-T214 PolarHBondContact O-OG1 3.49Å
211	E	98.8	Very high	96.8	Very high	5 Å²	5	43.9 Å²	43.9	2%	0.023	22%	0.218	C	C	.	.	H	α-helix	trans	-67.7	-41.3	173.1	-61.3	-63.5	168.9	0	0	111.4	L194 Y207 F208 T214 F215 M243 P244 S245	L194-E211 HydrophobicContact CD1-CB 4.39Å; L194-E211 HydrophobicContact CD2-CB 3.93Å; Y207-E211 HydrophobicContact CD1-CG 4.47Å; Y207-E211 HydrophobicContact CE1-CG 3.93Å; Y207-E211 HydrophobicContact CE2-CG 4.11Å; Y207-E211 VanDerWaalsContact CE2-OE1 3.24Å; Y207-E211 WeakPolarHBondContact CE2-OE1 3.49Å; Y207-E211 PolarHBondContact O-N 2.74Å; Y207-E211 VanDerWaalsContact O-N 3.1Å; Y207-E211 PolarHBondContact OH-OE1 3.28Å; F208-E211 PolarHBondContact O-N 3.49Å; E211-T214 PolarHBondContact O-N 2.82Å; E211-F215 WeakPolarHBondContact O-CB 3.32Å; E211-F215 PolarHBondContact O-N 2.85Å; E211-M243 HydrophobicContact CB-CE 4.4Å; E211-M243 HydrophobicContact CG-CE 3.9Å; E211-P244 HydrophobicContact CB-CG 4.23Å; E211-P244 WeakPolarHBondContact O-CB 3.43Å; E211-P244 WeakPolarHBondContact O-CG 3.19Å; E211-P244 WeakPolarHBondContact OE2-CB 3.27Å; E211-P244 WeakPolarHBondContact OE2-CD 3.35Å; E211-S245 VanDerWaalsContact CD-OG 3.31Å; E211-S245 WeakPolarHBondContact OE1-CB 3.32Å; E211-S245 PolarHBondContact OE1-OG 3.12Å; E211-S245 WeakPolarHBondContact OE2-CB 3.35Å; E211-S245 PolarHBondContact OE2-N 3.3Å; E211-S245 PolarHBondContact OE2-OG 3.28Å
212	L	98.8	Very high	96.8	Very high	0 Å²	0	44.9 Å²	44.9	0%	0	22%	0.223	C	C	.	.	H	α-helix	trans	-62.7	-45.6	175.4	-178.3	59.9	0	0	0	111.7	F79 L191 L194 F199 F208 T214 F215 L216	F79-L212 HydrophobicContact CD1-CD2 4.27Å; F79-L212 HydrophobicContact CD2-CD2 4.41Å; F79-L212 HydrophobicContact CE1-CD2 3.87Å; F79-L212 HydrophobicContact CE1-CG 4.02Å; F79-L212 HydrophobicContact CE2-CB 4.17Å; F79-L212 HydrophobicContact CE2-CD2 4.01Å; F79-L212 HydrophobicContact CE2-CG 4.02Å; F79-L212 HydrophobicContact CZ-CB 4.11Å; F79-L212 HydrophobicContact CZ-CD2 3.74Å; F79-L212 HydrophobicContact CZ-CG 3.54Å; L191-L212 HydrophobicContact CD1-CD1 3.99Å; L194-L212 HydrophobicContact CB-CB 4.04Å; L194-L212 HydrophobicContact CB-CD1 3.86Å; L194-L212 HydrophobicContact CB-CG 4.47Å; F199-L212 HydrophobicContact CE1-CD2 4.38Å; F199-L212 HydrophobicContact CE2-CD2 4Å; F199-L212 HydrophobicContact CZ-CD2 3.6Å; F208-L212 WeakPolarHBondContact O-CB 3.41Å; F208-L212 PolarHBondContact O-N 3.5Å; L212-T214 VanDerWaalsContact C-N 3.29Å; L212-T214 PolarHBondContact O-N 3.06Å; L212-F215 HydrophobicContact CD1-CD1 4.43Å; L212-F215 PolarHBondContact O-N 2.9Å; L212-L216 HydrophobicContact CD1-CD1 4.5Å; L212-L216 HydrophobicContact CD1-CG 4.33Å; L212-L216 WeakPolarHBondContact O-CG 3.44Å; L212-L216 PolarHBondContact O-N 3.22Å
213	E	98.7	Very high	96.9	Very high	18 Å²	18	43.1 Å²	43.1	8%	0.084	20%	0.204	C	C	.	.	H	α-helix	trans	-54.3	-47.7	173	167.4	178.4	-171.5	0	0	111.1	F79 K82 M83 K86 H87 S209 L216 L217	F79-E213 HydrophobicContact CE2-CB 4.02Å; F79-E213 HydrophobicContact CZ-CB 4.33Å; K82-E213 WeakPolarHBondContact CE-OE2 3.42Å; K82-E213 IonicContact NZ-OE2 2.7Å; K82-E213 PolarHBondContact NZ-OE2 3.17Å; M83-E213 HydrophobicContact CE-CG 4.28Å; M83-E213 HydrophobicContact SD-CB 3.92Å; M83-E213 HydrophobicContact SD-CG 3.72Å; K86-E213 IonicContact NZ-OE1 3.2Å; K86-E213 PolarHBondContact NZ-OE1 3.12Å; H87-E213 IonicContact CD2-OE1 2.75Å; H87-E213 IonicContact CE1-OE1 3.58Å; H87-E213 IonicContact NE2-OE1 3.79Å; H87-E213 PolarHBondContact NE2-OE1 3.02Å; S209-E213 WeakPolarHBondContact O-CB 3.28Å; S209-E213 PolarHBondContact O-N 3.3Å; E213-L216 PolarHBondContact O-N 3.27Å; E213-L217 HydrophobicContact CG-CD1 4.17Å; E213-L217 WeakPolarHBondContact O-CG 3.38Å; E213-L217 PolarHBondContact O-N 3.2Å; E213-L217 VanDerWaalsContact O-N 3.1Å
214	T	98.7	Very high	97	Very high	17 Å²	17	39.3 Å²	39.3	10%	0.104	19%	0.194	C	C	.	.	H	α-helix	trans	-68.8	-38.1	-178.2	-55.2	0	0	0	0	112.1	G210 E211 L212 L217 M218 P244 K248	G210-T214 WeakPolarHBondContact O-CB 3.44Å; G210-T214 PolarHBondContact O-N 3.24Å; G210-T214 PolarHBondContact O-OG1 3.49Å; E211-T214 PolarHBondContact O-N 2.82Å; L212-T214 VanDerWaalsContact C-N 3.29Å; L212-T214 PolarHBondContact O-N 3.06Å; T214-L217 PolarHBondContact O-N 3.49Å; T214-M218 PolarHBondContact O-N 3.03Å; T214-P244 VanDerWaalsContact CG2-C 3.46Å; T214-P244 HydrophobicContact CG2-CB 3.94Å; T214-P244 WeakPolarHBondContact CG2-O 3.41Å; T214-K248 HydrophobicContact CG2-CB 3.65Å; T214-K248 HydrophobicContact CG2-CD 3.89Å; T214-K248 HydrophobicContact CG2-CG 4.37Å
215	F	98.8	Very high	97.2	Very high	0 Å²	0	35 Å²	35	0%	0	18%	0.178	C	C	.	.	H	α-helix	trans	-62.6	-43.3	176.3	171	-107.1	0	0	0	112.2	I190 L191 L194 E211 L212 M218 A219 P226 L229 M237 P244	I190-F215 HydrophobicContact CB-CD2 4.22Å; I190-F215 HydrophobicContact CB-CE1 4.35Å; I190-F215 HydrophobicContact CB-CE2 3.69Å; I190-F215 HydrophobicContact CB-CZ 3.77Å; I190-F215 HydrophobicContact CD1-CE2 4.02Å; I190-F215 HydrophobicContact CG1-CE2 4.49Å; I190-F215 HydrophobicContact CG2-CD1 4.08Å; I190-F215 HydrophobicContact CG2-CD2 3.46Å; I190-F215 VanDerWaalsContact CG2-CD2 3.46Å; I190-F215 HydrophobicContact CG2-CE1 4.1Å; I190-F215 HydrophobicContact CG2-CE2 3.47Å; I190-F215 VanDerWaalsContact CG2-CE2 3.47Å; I190-F215 HydrophobicContact CG2-CG 3.78Å; I190-F215 HydrophobicContact CG2-CZ 3.82Å; L191-F215 HydrophobicContact CB-CE1 4.12Å; L191-F215 HydrophobicContact CD1-CE1 4.48Å; L194-F215 HydrophobicContact CD1-CB 3.8Å; L194-F215 HydrophobicContact CD1-CD1 4.45Å; L194-F215 HydrophobicContact CD1-CG 4.11Å; E211-F215 WeakPolarHBondContact O-CB 3.32Å; E211-F215 PolarHBondContact O-N 2.85Å; L212-F215 HydrophobicContact CD1-CD1 4.43Å; L212-F215 PolarHBondContact O-N 2.9Å; F215-M218 HydrophobicContact CD2-CE 3.42Å; F215-M218 VanDerWaalsContact CD2-CE 3.42Å; F215-M218 HydrophobicContact CE2-CE 3.53Å; F215-M218 WeakPolarHBondContact O-CB 3.35Å; F215-M218 PolarHBondContact O-N 3.05Å; F215-A219 PolarHBondContact O-N 2.91Å; F215-P226 HydrophobicContact CE1-CB 3.8Å; F215-P226 HydrophobicContact CZ-CB 4.1Å; F215-L229 HydrophobicContact CE2-CB 4.03Å; F215-L229 HydrophobicContact CE2-CD1 3.62Å; F215-L229 HydrophobicContact CE2-CG 4.46Å; F215-L229 HydrophobicContact CZ-CB 4.02Å; F215-L229 HydrophobicContact CZ-CD1 3.93Å; F215-L229 HydrophobicContact CZ-CG 4.5Å; F215-M237 HydrophobicContact CD2-SD 3.88Å; F215-M237 HydrophobicContact CE2-SD 4.36Å; F215-P244 HydrophobicContact CB-CB 4.06Å; F215-P244 HydrophobicContact CB-CG 3.84Å
216	L	98.4	Very high	97.2	Very high	0 Å²	0	34 Å²	34	0%	0	17%	0.17	C	C	.	.	H	α-helix	trans	-69.9	-35	177.8	-65.5	-176.4	0	0	0	112.3	F55 F79 M83 F89 L94 I97 L191 L212 E213 A219 R220 P226	F55-L216 HydrophobicContact CE1-CB 4.01Å; F55-L216 HydrophobicContact CE1-CD2 3.92Å; F55-L216 HydrophobicContact CE1-CG 4.49Å; F55-L216 WeakPolarHBondContact CE1-O 3.31Å; F55-L216 HydrophobicContact CZ-CB 4.01Å; F55-L216 HydrophobicContact CZ-CD1 4.33Å; F55-L216 HydrophobicContact CZ-CD2 3.79Å; F55-L216 HydrophobicContact CZ-CG 4.25Å; F79-L216 HydrophobicContact CE1-CD1 3.69Å; F79-L216 HydrophobicContact CZ-CD1 3.97Å; M83-L216 HydrophobicContact CE-CB 4.14Å; F89-L216 HydrophobicContact CZ-CB 4.36Å; L94-L216 HydrophobicContact CD2-CD1 3.91Å; I97-L216 HydrophobicContact CD1-CD1 4.27Å; I97-L216 HydrophobicContact CD1-CD2 3.62Å; L191-L216 HydrophobicContact CD1-CD2 4.03Å; L212-L216 HydrophobicContact CD1-CD1 4.5Å; L212-L216 HydrophobicContact CD1-CG 4.33Å; L212-L216 WeakPolarHBondContact O-CG 3.44Å; L212-L216 PolarHBondContact O-N 3.22Å; E213-L216 PolarHBondContact O-N 3.27Å; L216-A219 PolarHBondContact O-N 2.88Å; L216-R220 WeakPolarHBondContact O-CB 3.25Å; L216-R220 PolarHBondContact O-N 3.38Å; L216-P226 HydrophobicContact CD2-CB 4.03Å; L216-P226 HydrophobicContact CD2-CG 4.45Å
217	L	98	Very high	97.2	Very high	16 Å²	16	25.7 Å²	25.7	8%	0.084	13%	0.131	C	C	.	.	H	α-helix	trans	-61	-48.9	171.3	-74.4	166.1	0	0	0	111	M83 H87 F89 E213 T214 A219 R220 D221	M83-L217 HydrophobicContact CE-CG 4.43Å; H87-L217 HydrophobicContact CB-CD2 4.12Å; F89-L217 HydrophobicContact CE2-CD2 3.75Å; F89-L217 HydrophobicContact CE2-CG 4.34Å; F89-L217 HydrophobicContact CZ-CD2 4.21Å; E213-L217 HydrophobicContact CG-CD1 4.17Å; E213-L217 WeakPolarHBondContact O-CG 3.38Å; E213-L217 PolarHBondContact O-N 3.2Å; E213-L217 VanDerWaalsContact O-N 3.1Å; T214-L217 PolarHBondContact O-N 3.49Å; L217-A219 PolarHBondContact O-N 3.25Å; L217-R220 VanDerWaalsContact CD2-NH2 3.29Å; L217-R220 PolarHBondContact O-N 2.79Å; L217-D221 WeakPolarHBondContact O-CB 3.3Å; L217-D221 PolarHBondContact O-N 3.14Å
218	M	97.8	Very high	97.1	Very high	7 Å²	7	24.3 Å²	24.3	3%	0.034	13%	0.13	C	C	.	.	H	α-helix	trans	-54.1	-52.6	174	169.5	-165.3	85.3	0	0	111.4	T214 F215 R220 D221 E222 L229 M237 Y247	T214-M218 PolarHBondContact O-N 3.03Å; F215-M218 HydrophobicContact CD2-CE 3.42Å; F215-M218 VanDerWaalsContact CD2-CE 3.42Å; F215-M218 HydrophobicContact CE2-CE 3.53Å; F215-M218 WeakPolarHBondContact O-CB 3.35Å; F215-M218 PolarHBondContact O-N 3.05Å; M218-R220 VanDerWaalsContact C-N 3.25Å; M218-R220 PolarHBondContact O-N 3.26Å; M218-D221 PolarHBondContact O-N 3.45Å; M218-D221 VanDerWaalsContact O-N 3.11Å; M218-E222 HydrophobicContact CG-CG 4.3Å; M218-E222 WeakPolarHBondContact O-CB 3.36Å; M218-E222 PolarHBondContact O-N 3.21Å; M218-L229 HydrophobicContact CE-CD1 3.6Å; M218-M237 HydrophobicContact CE-CE 4.37Å; M218-M237 HydrophobicContact CE-SD 3.9Å; M218-M237 HydrophobicContact SD-CE 3.61Å; M218-M237 HydrophobicContact SD-SD 3.95Å; M218-Y247 HydrophobicContact CB-CD1 3.99Å; M218-Y247 HydrophobicContact CB-CE1 3.65Å; M218-Y247 HydrophobicContact CG-CD1 3.87Å; M218-Y247 HydrophobicContact CG-CD2 4.47Å; M218-Y247 HydrophobicContact CG-CE1 3.36Å; M218-Y247 HydrophobicContact CG-CE2 3.99Å; M218-Y247 HydrophobicContact CG-CG 4.43Å; M218-Y247 VanDerWaalsContact CG-CZ 3.42Å; M218-Y247 HydrophobicContact SD-CD1 3.89Å; M218-Y247 HydrophobicContact SD-CD2 3.85Å; M218-Y247 HydrophobicContact SD-CE1 3.93Å; M218-Y247 HydrophobicContact SD-CE2 3.82Å; M218-Y247 HydrophobicContact SD-CG 3.89Å
219	A	97.5	Very high	97.1	Very high	0 Å²	0	25.1 Å²	25.1	0%	0	13%	0.134	C	C	.	.	H	α-helix	trans	-60.7	-36.3	-177.4	0	0	0	0	0	112.3	F55 F215 L216 L217 Q223 D224 P226	F55-A219 HydrophobicContact CD1-CB 4.11Å; F55-A219 HydrophobicContact CE1-CB 4.27Å; F215-A219 PolarHBondContact O-N 2.91Å; L216-A219 PolarHBondContact O-N 2.88Å; L217-A219 PolarHBondContact O-N 3.25Å; A219-Q223 CarbonylContact O-C 3.59Å; A219-Q223 PolarHBondContact O-N 2.89Å; A219-D224 HydrophobicContact CB-CB 4.35Å; A219-D224 PolarHBondContact O-N 3.42Å; A219-P226 HydrophobicContact CB-CB 4.11Å
220	R	96	Very high	97.1	Very high	52 Å²	52	29.1 Å²	29.1	20%	0.196	15%	0.148	C	C	.	.	H	α-helix	trans	-66.2	-47.6	173.2	-179.3	179.7	69.1	177.7	5.3	112	F55 H87 F89 L216 L217 M218 Q223	F55-R220 HydrophobicContact CD1-CB 4.36Å; F55-R220 HydrophobicContact CE1-CB 4.47Å; H87-R220 PolarHBondContact O-NH1 3.35Å; F89-R220 HydrophobicContact CE1-CB 3.96Å; F89-R220 HydrophobicContact CE1-CG 4.35Å; F89-R220 HydrophobicContact CZ-CB 3.94Å; F89-R220 HydrophobicContact CZ-CG 4.45Å; L216-R220 WeakPolarHBondContact O-CB 3.25Å; L216-R220 PolarHBondContact O-N 3.38Å; L217-R220 VanDerWaalsContact CD2-NH2 3.29Å; L217-R220 PolarHBondContact O-N 2.79Å; M218-R220 VanDerWaalsContact C-N 3.25Å; M218-R220 PolarHBondContact O-N 3.26Å; R220-Q223 PolarHBondContact O-N 3.09Å
221	D	95.2	Very high	97.1	Very high	103 Å²	103	27.9 Å²	27.9	55%	0.551	14%	0.136	S	C	*	.	H	α-helix	trans	-68.8	-38	-173.7	-63.6	-11.3	0	0	0	111.1	L217 M218 Q223	L217-D221 WeakPolarHBondContact O-CB 3.3Å; L217-D221 PolarHBondContact O-N 3.14Å; M218-D221 PolarHBondContact O-N 3.45Å; M218-D221 VanDerWaalsContact O-N 3.11Å; D221-Q223 VanDerWaalsContact C-N 3.33Å
222	E	95.4	Very high	97.1	Very high	31 Å²	31	28.6 Å²	28.6	15%	0.145	14%	0.142	C	C	.	.	T	Hydrogen-bonded Turn	trans	-86.7	1.1	176.5	-59.9	-54.6	147	0	0	114	M218 D224 Y247 H259 I260	M218-E222 HydrophobicContact CG-CG 4.3Å; M218-E222 WeakPolarHBondContact O-CB 3.36Å; M218-E222 PolarHBondContact O-N 3.21Å; E222-D224 VanDerWaalsContact C-N 3.27Å; E222-D224 PolarHBondContact O-N 3.06Å; E222-Y247 WeakPolarHBondContact CG-OH 3.45Å; E222-Y247 PolarHBondContact OE1-OH 2.84Å; E222-H259 WeakPolarHBondContact OE2-CA 3.24Å; E222-H259 IonicContact OE2-ND1 3.56Å; E222-I260 PolarHBondContact OE2-N 3.12Å
223	Q	93.2	Very high	97	Very high	81 Å²	81	30.6 Å²	30.6	38%	0.379	15%	0.15	S	C	.	.	T	Hydrogen-bonded Turn	trans	57.7	36.6	-177.4	-53.9	-111.8	-86.2	0	0	113.5	L56 A219 R220 D221	L56-Q223 HydrophobicContact CB-CB 4.41Å; L56-Q223 WeakPolarHBondContact CB-O 3.32Å; L56-Q223 HydrophobicContact CD1-CB 4.5Å; A219-Q223 CarbonylContact O-C 3.59Å; A219-Q223 PolarHBondContact O-N 2.89Å; R220-Q223 PolarHBondContact O-N 3.09Å; D221-Q223 VanDerWaalsContact C-N 3.33Å
224	D	94	Very high	96.9	Very high	51 Å²	51	30.6 Å²	30.6	27%	0.273	15%	0.153	S	C	.	.			trans	-92.9	150.8	177.2	-81.6	-37.1	0	0	0	112.4	A219 E222 P226 L229	A219-D224 HydrophobicContact CB-CB 4.35Å; A219-D224 PolarHBondContact O-N 3.42Å; E222-D224 VanDerWaalsContact C-N 3.27Å; E222-D224 PolarHBondContact O-N 3.06Å; D224-P226 VanDerWaalsContact O-CD 3.3Å; D224-P226 WeakPolarHBondContact O-CD 3.31Å; D224-L229 HydrophobicContact CB-CD1 4Å; D224-L229 HydrophobicContact CB-CD2 4.41Å; D224-L229 HydrophobicContact CB-CG 4.42Å
225	D	95.7	Very high	96.9	Very high	9 Å²	9	29.8 Å²	29.8	5%	0.048	15%	0.148	C	C	.	.			trans	-79.4	112.7	165.5	-169	-31.9	0	0	0	110.2	L56 E58 H61 L227 N228	L56-D225 WeakPolarHBondContact O-CA 3.3Å; L56-D225 WeakPolarHBondContact O-CB 3.45Å; L56-D225 PolarHBondContact O-N 3.27Å; E58-D225 PolarHBondContact N-OD2 2.92Å; H61-D225 IonicContact CE1-OD2 3.08Å; H61-D225 IonicContact CG-OD2 3.09Å; H61-D225 IonicContact ND1-OD1 2.69Å; H61-D225 IonicContact ND1-OD2 3.18Å; H61-D225 PolarHBondContact ND1-OD2 2.99Å; D225-L227 PolarHBondContact O-N 3.28Å; D225-L227 VanDerWaalsContact OD1-CB 3.26Å; D225-L227 WeakPolarHBondContact OD1-CB 3.13Å; D225-L227 PolarHBondContact OD1-N 3.5Å; D225-N228 HydrophobicContact CB-CB 4.3Å; D225-N228 PolarHBondContact O-N 3.43Å
226	P	96.6	Very high	96.9	Very high	0 Å²	0	30.2 Å²	30.2	0%	0	15%	0.152	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.3	-17.1	-179.1	27	-35.3	0	0	0	113.7	F55 I97 F215 L216 A219 D224 N228	F55-P226 HydrophobicContact CD1-CG 3.92Å; F55-P226 HydrophobicContact CD2-CG 4.39Å; F55-P226 HydrophobicContact CE1-CG 4.16Å; F55-P226 HydrophobicContact CG-CG 4.04Å; I97-P226 HydrophobicContact CD1-CG 3.96Å; I97-P226 HydrophobicContact CG2-CG 4.08Å; F215-P226 HydrophobicContact CE1-CB 3.8Å; F215-P226 HydrophobicContact CZ-CB 4.1Å; L216-P226 HydrophobicContact CD2-CB 4.03Å; L216-P226 HydrophobicContact CD2-CG 4.45Å; A219-P226 HydrophobicContact CB-CB 4.11Å; D224-P226 VanDerWaalsContact O-CD 3.3Å; D224-P226 WeakPolarHBondContact O-CD 3.31Å; P226-N228 VanDerWaalsContact C-N 3.32Å
227	L	96.1	Very high	96.9	Very high	3 Å²	3	30.2 Å²	30.2	2%	0.016	15%	0.152	C	C	.	.	T	Hydrogen-bonded Turn	trans	-79.4	-14.5	176	-66.4	157.6	0	0	0	112.7	H61 I97 Q100 R189 L191 D225	H61-L227 HydrophobicContact CB-CD1 3.57Å; I97-L227 HydrophobicContact CB-CD1 4.5Å; I97-L227 HydrophobicContact CG2-CD1 4.17Å; Q100-L227 HydrophobicContact CB-CD1 4.4Å; Q100-L227 HydrophobicContact CB-CD2 3.86Å; R189-L227 WeakPolarHBondContact CD-O 3.12Å; R189-L227 VanDerWaalsContact NH1-CD2 3.31Å; L191-L227 HydrophobicContact CD2-CD2 3.53Å; L191-L227 HydrophobicContact CD2-CG 4.1Å; D225-L227 PolarHBondContact O-N 3.28Å; D225-L227 VanDerWaalsContact OD1-CB 3.26Å; D225-L227 WeakPolarHBondContact OD1-CB 3.13Å; D225-L227 PolarHBondContact OD1-N 3.5Å
228	N	96.8	Very high	96.9	Very high	64 Å²	64	29.4 Å²	29.4	34%	0.342	15%	0.148	S	C	.	.	T	Hydrogen-bonded Turn	trans	-96.6	-25.9	-179.3	-76.7	-24.3	0	0	0	113.9	E58 H61 D225 P226 K230	E58-N228 PolarHBondContact OE1-ND2 3.32Å; E58-N228 PolarHBondContact OE2-ND2 3.27Å; H61-N228 PolarHBondContact CE1-OD1 2.93Å; D225-N228 HydrophobicContact CB-CB 4.3Å; D225-N228 PolarHBondContact O-N 3.43Å; P226-N228 VanDerWaalsContact C-N 3.32Å; N228-K230 PolarHBondContact O-N 2.97Å
229	L	97.8	Very high	97	Very high	19 Å²	19	30.7 Å²	30.7	10%	0.099	15%	0.152	C	C	.	.			trans	-70.8	123.6	-175.5	-59.2	-178.4	0	0	0	112.1	R189 I190 F215 M218 D224 W263	R189-L229 WeakPolarHBondContact CA-O 3.29Å; I190-L229 HydrophobicContact CD1-CB 4.15Å; I190-L229 PolarHBondContact N-O 3.48Å; F215-L229 HydrophobicContact CE2-CB 4.03Å; F215-L229 HydrophobicContact CE2-CD1 3.62Å; F215-L229 HydrophobicContact CE2-CG 4.46Å; F215-L229 HydrophobicContact CZ-CB 4.02Å; F215-L229 HydrophobicContact CZ-CD1 3.93Å; F215-L229 HydrophobicContact CZ-CG 4.5Å; M218-L229 HydrophobicContact CE-CD1 3.6Å; D224-L229 HydrophobicContact CB-CD1 4Å; D224-L229 HydrophobicContact CB-CD2 4.41Å; D224-L229 HydrophobicContact CB-CG 4.42Å; L229-W263 HydrophobicContact CB-CH2 3.87Å; L229-W263 HydrophobicContact CB-CZ2 4.17Å; L229-W263 HydrophobicContact CD1-CH2 4.14Å; L229-W263 HydrophobicContact CD1-CZ3 4.3Å; L229-W263 HydrophobicContact CD2-CE3 4.34Å; L229-W263 HydrophobicContact CD2-CH2 3.94Å; L229-W263 HydrophobicContact CD2-CZ3 3.84Å; L229-W263 HydrophobicContact CG-CH2 4.2Å; L229-W263 HydrophobicContact CG-CZ3 4.48Å
230	K	98.5	Very high	97	Very high	110 Å²	110	30.9 Å²	30.9	48%	0.478	15%	0.154	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	140.2	-175.5	-70.4	172.7	-171.7	166.8	0	112.2	T188 N228 W263	T188-K230 CarbonylContact O-C 3.52Å; T188-K230 VanDerWaalsContact O-CA 3.3Å; T188-K230 WeakPolarHBondContact O-CA 3.38Å; N228-K230 PolarHBondContact O-N 2.97Å; K230-W263 VanDerWaalsContact O-CE2 3.3Å; K230-W263 VanDerWaalsContact O-CZ2 3.23Å; K230-W263 WeakPolarHBondContact O-CZ2 3.47Å; K230-W263 PolarHBondContact O-NE1 3.23Å
231	G	98.4	Very high	97.1	Very high	0 Å²	0	29.8 Å²	29.8	0%	0	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-155.4	-156.5	179.3	0	0	0	0	0	112.6	M185 G186 K187 T188 A236	M185-G231 CarbonylContact O-C 3.53Å; M185-G231 WeakPolarHBondContact O-CA 3.46Å; G186-G231 CarbonylContact C-O 3.57Å; G186-G231 VanDerWaalsContact CA-O 3.29Å; G186-G231 WeakPolarHBondContact CA-O 3.49Å; K187-G231 PolarHBondContact N-O 2.88Å; T188-G231 PolarHBondContact N-O 3Å; T188-G231 PolarHBondContact O-N 3.33Å; G231-A236 VanDerWaalsContact CA-O 3.32Å; G231-A236 WeakPolarHBondContact CA-O 3.18Å
232	S	98	Very high	97.3	Very high	20 Å²	20	25.2 Å²	25.2	14%	0.14	13%	0.126	C	C	.	.			trans	-67.5	162.1	176	74.3	0	0	0	0	111.8	M185 A234 G235 A236	M185-S232 PolarHBondContact O-N 3.41Å; S232-A234 PolarHBondContact O-N 2.99Å; S232-A234 PolarHBondContact OG-N 2.82Å; S232-G235 PolarHBondContact O-N 2.76Å; S232-A236 PolarHBondContact N-O 3.19Å; S232-A236 WeakPolarHBondContact OG-CA 3.39Å; S232-A236 WeakPolarHBondContact OG-CB 3.3Å; S232-A236 PolarHBondContact OG-N 3.08Å
233	F	97.1	Very high	97.5	Very high	42 Å²	42	25.3 Å²	25.3	18%	0.184	13%	0.127	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.5	-16.8	176.6	79.8	-89.1	0	0	0	113.4	V107 L110 M111 A193	V107-F233 HydrophobicContact CG1-CD2 4.43Å; V107-F233 VanDerWaalsContact CG1-O 3.31Å; V107-F233 WeakPolarHBondContact CG1-O 3.37Å; V107-F233 HydrophobicContact CG2-CB 4.15Å; L110-F233 HydrophobicContact CB-CD2 3.63Å; L110-F233 HydrophobicContact CB-CE1 4.47Å; L110-F233 HydrophobicContact CB-CE2 3.49Å; L110-F233 VanDerWaalsContact CB-CE2 3.49Å; L110-F233 HydrophobicContact CB-CG 4.21Å; L110-F233 HydrophobicContact CB-CZ 3.95Å; L110-F233 HydrophobicContact CD1-CB 4Å; L110-F233 HydrophobicContact CD1-CD1 3.99Å; L110-F233 HydrophobicContact CD1-CD2 3.94Å; L110-F233 HydrophobicContact CD1-CE2 4.47Å; L110-F233 HydrophobicContact CD1-CG 3.68Å; L110-F233 HydrophobicContact CG-CD2 4.45Å; M111-F233 HydrophobicContact CE-CE2 4.1Å; A193-F233 WeakPolarHBondContact CB-O 3.4Å
234	A	97	Very high	97.7	Very high	17 Å²	17	21.4 Å²	21.4	14%	0.14	11%	0.109	C	C	.	.	T	Hydrogen-bonded Turn	trans	-98.5	2.1	177.6	0	0	0	0	0	113.1	M111 S232 M243	M111-A234 HydrophobicContact CE-CB 3.87Å; S232-A234 PolarHBondContact O-N 2.99Å; S232-A234 PolarHBondContact OG-N 2.82Å; A234-M243 WeakPolarHBondContact O-CE 3.15Å
235	G	98.2	Very high	97.9	Very high	0 Å²	0	20.8 Å²	20.8	0%	0	11%	0.109	C	C	.	.			trans	89	11.4	-180	0	0	0	0	0	115.2	S232 M237	S232-G235 PolarHBondContact O-N 2.76Å; G235-M237 WeakPolarHBondContact O-CG 3.43Å
236	A	98.6	Very high	98.1	Very high	9 Å²	9	21.6 Å²	21.6	7%	0.074	12%	0.115	C	C	.	.			trans	-73.9	140	173.6	0	0	0	0	0	111.2	G231 S232 Q241 F242 M243	G231-A236 VanDerWaalsContact CA-O 3.32Å; G231-A236 WeakPolarHBondContact CA-O 3.18Å; S232-A236 PolarHBondContact N-O 3.19Å; S232-A236 WeakPolarHBondContact OG-CA 3.39Å; S232-A236 WeakPolarHBondContact OG-CB 3.3Å; S232-A236 PolarHBondContact OG-N 3.08Å; A236-Q241 HydrophobicContact CB-CB 3.97Å; A236-Q241 WeakPolarHBondContact CB-O 3.22Å; A236-F242 CarbonylContact C-O 3.51Å; A236-F242 WeakPolarHBondContact CA-O 3.32Å; A236-M243 HydrophobicContact CB-SD 4.01Å
237	M	98.7	Very high	98.2	Very high	0 Å²	0	22.4 Å²	22.4	0%	0	12%	0.118	C	C	.	.	B	Isolated β-bridge	trans	-119.2	141.2	-160.5	-47.1	-170.7	-63	0	0	112.6	I190 F215 M218 G235 Q241 F242 P244 Y247 L262 W263	I190-M237 HydrophobicContact CD1-CB 4.18Å; I190-M237 HydrophobicContact CD1-CG 3.57Å; I190-M237 HydrophobicContact CD1-SD 3.93Å; I190-M237 HydrophobicContact CG1-CG 4.47Å; F215-M237 HydrophobicContact CD2-SD 3.88Å; F215-M237 HydrophobicContact CE2-SD 4.36Å; M218-M237 HydrophobicContact CE-CE 4.37Å; M218-M237 HydrophobicContact CE-SD 3.9Å; M218-M237 HydrophobicContact SD-CE 3.61Å; M218-M237 HydrophobicContact SD-SD 3.95Å; G235-M237 WeakPolarHBondContact O-CG 3.43Å; M237-Q241 WeakPolarHBondContact O-CA 3.31Å; M237-Q241 PolarHBondContact O-N 2.96Å; M237-F242 WeakPolarHBondContact CG-O 3.41Å; M237-F242 PolarHBondContact N-O 3.47Å; M237-F242 PolarHBondContact O-N 2.84Å; M237-F242 VanDerWaalsContact O-N 3.14Å; M237-P244 HydrophobicContact CE-CB 4.33Å; M237-P244 HydrophobicContact CE-CG 4.22Å; M237-P244 HydrophobicContact SD-CG 4.04Å; M237-Y247 HydrophobicContact CE-CD2 4.24Å; M237-Y247 HydrophobicContact CE-CG 4Å; M237-L262 HydrophobicContact CE-CD1 4.38Å; M237-W263 HydrophobicContact CB-CH2 4.06Å; M237-W263 HydrophobicContact CB-CZ2 4.17Å; M237-W263 HydrophobicContact CG-CH2 4.49Å; M237-W263 HydrophobicContact SD-CH2 4.4Å
238	G	98.5	Very high	98.3	Very high	0 Å²	0	29 Å²	29	0%	0	15%	0.147	C	C	.	.	T	Hydrogen-bonded Turn	trans	65.5	-165	168.3	0	0	0	0	0	116.2	T179 G240 Q241 L262	T179-G238 WeakPolarHBondContact CG2-O 3.34Å; G238-G240 VanDerWaalsContact C-N 3.31Å; G238-G240 PolarHBondContact O-N 3.3Å; G238-Q241 PolarHBondContact O-N 3.12Å; G238-Q241 PolarHBondContact O-NE2 3.43Å; G238-L262 CarbonylContact C-O 3.58Å; G238-L262 WeakPolarHBondContact CA-O 3.02Å
239	Y	98.8	Very high	98.4	Very high	34 Å²	34	32 Å²	32	13%	0.133	16%	0.159	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.2	-34.2	-176.7	-82.4	-105.6	0	0	0	113.4	F149 I175 T179 W181 G182 M185 L262 W263 P265 A268	F149-Y239 HydrophobicContact CE2-CD1 4.09Å; F149-Y239 AromaticContact CE2-CE1 3.94Å; F149-Y239 HydrophobicContact CE2-CE1 3.94Å; I175-Y239 HydrophobicContact CG2-CD1 3.83Å; T179-Y239 WeakPolarHBondContact CG2-O 3.37Å; T179-Y239 PolarHBondContact OG1-O 3.15Å; W181-Y239 VanDerWaalsContact C-CE1 3.42Å; G182-Y239 VanDerWaalsContact N-CE1 3.32Å; M185-Y239 HydrophobicContact CE-CE2 4.01Å; M185-Y239 HydrophobicContact SD-CD2 3.62Å; M185-Y239 HydrophobicContact SD-CE2 3.7Å; M185-Y239 HydrophobicContact SD-CG 4.21Å; Y239-L262 PolarHBondContact N-O 3.35Å; Y239-W263 VanDerWaalsContact CE2-O 3.22Å; Y239-W263 WeakPolarHBondContact CE2-O 3.32Å; Y239-P265 HydrophobicContact CD2-CG 4.41Å; Y239-P265 HydrophobicContact CE1-CB 4.49Å; Y239-P265 HydrophobicContact CE1-CG 4.06Å; Y239-P265 HydrophobicContact CE2-CG 3.75Å; Y239-A268 HydrophobicContact CG-CB 4.25Å
240	G	98.5	Very high	98.4	Very high	4 Å²	4	33.1 Å²	33.1	4%	0.041	16%	0.162	C	C	.	.	T	Hydrogen-bonded Turn	trans	-88.3	-6.9	179.6	0	0	0	0	0	114.6	G238 F242 Y354	G238-G240 VanDerWaalsContact C-N 3.31Å; G238-G240 PolarHBondContact O-N 3.3Å; G240-F242 VanDerWaalsContact C-N 3.3Å; G240-F242 PolarHBondContact O-N 3.14Å; G240-Y354 WeakPolarHBondContact O-CE1 3.08Å; G240-Y354 PolarHBondContact O-OH 2.9Å
241	Q	98.7	Very high	98.4	Very high	29 Å²	29	28.6 Å²	28.6	14%	0.136	15%	0.145	C	C	.	.	T	Hydrogen-bonded Turn	trans	52.8	45.8	-175.8	-61.7	-70.3	-73.9	0	0	112.7	E178 T179 M185 A236 M237 G238	E178-Q241 HydrophobicContact CB-CB 4.2Å; E178-Q241 HydrophobicContact CB-CG 3.73Å; E178-Q241 HydrophobicContact CG-CB 4.27Å; E178-Q241 HydrophobicContact CG-CG 4.33Å; T179-Q241 HydrophobicContact CG2-CG 3.6Å; M185-Q241 PolarHBondContact O-NE2 3.31Å; A236-Q241 HydrophobicContact CB-CB 3.97Å; A236-Q241 WeakPolarHBondContact CB-O 3.22Å; M237-Q241 WeakPolarHBondContact O-CA 3.31Å; M237-Q241 PolarHBondContact O-N 2.96Å; G238-Q241 PolarHBondContact O-N 3.12Å; G238-Q241 PolarHBondContact O-NE2 3.43Å
242	F	98.8	Very high	98.4	Very high	6 Å²	6	29.9 Å²	29.9	3%	0.026	15%	0.153	C	C	.	.	B	Isolated β-bridge	trans	-70.1	137.9	173.2	-86.1	9.4	0	0	0	110.9	A236 M237 G240 L262 Y275 Y354	A236-F242 CarbonylContact C-O 3.51Å; A236-F242 WeakPolarHBondContact CA-O 3.32Å; M237-F242 WeakPolarHBondContact CG-O 3.41Å; M237-F242 PolarHBondContact N-O 3.47Å; M237-F242 PolarHBondContact O-N 2.84Å; M237-F242 VanDerWaalsContact O-N 3.14Å; G240-F242 VanDerWaalsContact C-N 3.3Å; G240-F242 PolarHBondContact O-N 3.14Å; F242-L262 HydrophobicContact CB-CD1 3.7Å; F242-L262 HydrophobicContact CD2-CD1 3.8Å; F242-L262 HydrophobicContact CG-CD1 4.04Å; F242-Y275 HydrophobicContact CE1-CD2 4.01Å; F242-Y275 HydrophobicContact CE1-CG 4.31Å; F242-Y275 HydrophobicContact CZ-CD2 4Å; F242-Y275 HydrophobicContact CZ-CG 4.24Å; F242-Y354 AromaticContact CD1-CZ 3.96Å; F242-Y354 VanDerWaalsContact CD1-OH 3.31Å; F242-Y354 WeakPolarHBondContact CD1-OH 3.44Å; F242-Y354 AromaticContact CE1-CE2 3.9Å; F242-Y354 HydrophobicContact CE1-CE2 3.9Å; F242-Y354 AromaticContact CE1-CZ 3.58Å; F242-Y354 WeakPolarHBondContact CE1-OH 3.38Å
243	M	98.7	Very high	98.5	Very high	33 Å²	33	31.4 Å²	31.4	16%	0.163	16%	0.159	C	C	.	.			trans	-68.9	152	159.2	-63.2	-58.2	-54.3	0	0	109.5	F208 E211 A234 A236 S245 S246 Y247	F208-M243 HydrophobicContact CE1-CE 4.45Å; E211-M243 HydrophobicContact CB-CE 4.4Å; E211-M243 HydrophobicContact CG-CE 3.9Å; A234-M243 WeakPolarHBondContact O-CE 3.15Å; A236-M243 HydrophobicContact CB-SD 4.01Å; M243-S245 PolarHBondContact O-N 3.4Å; M243-S245 VanDerWaalsContact O-N 3.14Å; M243-S246 WeakPolarHBondContact O-CA 3.41Å; M243-S246 WeakPolarHBondContact O-CB 3.34Å; M243-S246 PolarHBondContact O-N 2.77Å; M243-Y247 PolarHBondContact O-N 3.04Å
244	P	98.8	Very high	98.5	Very high	0 Å²	0	29.9 Å²	29.9	0%	0	15%	0.153	C	C	.	.	H	α-helix	trans	-48.8	-39.6	176.5	-29.7	34.5	0	0	0	114.6	L194 E211 T214 F215 M237 S246 Y247 K248	L194-P244 HydrophobicContact CD1-CG 3.88Å; E211-P244 HydrophobicContact CB-CG 4.23Å; E211-P244 WeakPolarHBondContact O-CB 3.43Å; E211-P244 WeakPolarHBondContact O-CG 3.19Å; E211-P244 WeakPolarHBondContact OE2-CB 3.27Å; E211-P244 WeakPolarHBondContact OE2-CD 3.35Å; T214-P244 VanDerWaalsContact CG2-C 3.46Å; T214-P244 HydrophobicContact CG2-CB 3.94Å; T214-P244 WeakPolarHBondContact CG2-O 3.41Å; F215-P244 HydrophobicContact CB-CB 4.06Å; F215-P244 HydrophobicContact CB-CG 3.84Å; M237-P244 HydrophobicContact CE-CB 4.33Å; M237-P244 HydrophobicContact CE-CG 4.22Å; M237-P244 HydrophobicContact SD-CG 4.04Å; P244-S246 VanDerWaalsContact C-N 3.31Å; P244-S246 PolarHBondContact O-N 2.89Å; P244-Y247 VanDerWaalsContact O-CB 3.32Å; P244-Y247 WeakPolarHBondContact O-CB 3.39Å; P244-Y247 PolarHBondContact O-N 3.47Å; P244-K248 PolarHBondContact O-N 2.62Å
245	S	98.5	Very high	98.6	Very high	37 Å²	37	31.4 Å²	31.4	26%	0.259	16%	0.162	S	C	.	.	H	α-helix	trans	-62.4	-36.2	174.8	59.8	0	0	0	0	113.3	E211 M243 Q249	E211-S245 VanDerWaalsContact CD-OG 3.31Å; E211-S245 WeakPolarHBondContact OE1-CB 3.32Å; E211-S245 PolarHBondContact OE1-OG 3.12Å; E211-S245 WeakPolarHBondContact OE2-CB 3.35Å; E211-S245 PolarHBondContact OE2-N 3.3Å; E211-S245 PolarHBondContact OE2-OG 3.28Å; M243-S245 PolarHBondContact O-N 3.4Å; M243-S245 VanDerWaalsContact O-N 3.14Å; S245-Q249 WeakPolarHBondContact O-CG 3.34Å; S245-Q249 PolarHBondContact O-N 2.8Å
246	S	98.5	Very high	98.6	Very high	26 Å²	26	34.3 Å²	34.3	18%	0.182	19%	0.193	C	C	.	.	H	α-helix	trans	-72.8	-36.5	174.3	-59.8	0	0	0	0	111.7	M243 P244 Q249 Y250	M243-S246 WeakPolarHBondContact O-CA 3.41Å; M243-S246 WeakPolarHBondContact O-CB 3.34Å; M243-S246 PolarHBondContact O-N 2.77Å; P244-S246 VanDerWaalsContact C-N 3.31Å; P244-S246 PolarHBondContact O-N 2.89Å; S246-Q249 PolarHBondContact O-N 2.76Å; S246-Y250 WeakPolarHBondContact O-CB 3.34Å; S246-Y250 WeakPolarHBondContact O-CD2 3.43Å; S246-Y250 PolarHBondContact O-N 2.81Å
247	Y	98.7	Very high	98.6	Very high	18 Å²	18	38.8 Å²	38.8	7%	0.071	22%	0.215	C	C	.	.	H	α-helix	trans	-54	-55.9	169.5	167.5	-84.1	0	0	0	110.5	M218 E222 M237 M243 P244 Q249 Y250 A251 I260 L262	M218-Y247 HydrophobicContact CB-CD1 3.99Å; M218-Y247 HydrophobicContact CB-CE1 3.65Å; M218-Y247 HydrophobicContact CG-CD1 3.87Å; M218-Y247 HydrophobicContact CG-CD2 4.47Å; M218-Y247 HydrophobicContact CG-CE1 3.36Å; M218-Y247 HydrophobicContact CG-CE2 3.99Å; M218-Y247 HydrophobicContact CG-CG 4.43Å; M218-Y247 VanDerWaalsContact CG-CZ 3.42Å; M218-Y247 HydrophobicContact SD-CD1 3.89Å; M218-Y247 HydrophobicContact SD-CD2 3.85Å; M218-Y247 HydrophobicContact SD-CE1 3.93Å; M218-Y247 HydrophobicContact SD-CE2 3.82Å; M218-Y247 HydrophobicContact SD-CG 3.89Å; E222-Y247 WeakPolarHBondContact CG-OH 3.45Å; E222-Y247 PolarHBondContact OE1-OH 2.84Å; M237-Y247 HydrophobicContact CE-CD2 4.24Å; M237-Y247 HydrophobicContact CE-CG 4Å; M243-Y247 PolarHBondContact O-N 3.04Å; P244-Y247 VanDerWaalsContact O-CB 3.32Å; P244-Y247 WeakPolarHBondContact O-CB 3.39Å; P244-Y247 PolarHBondContact O-N 3.47Å; Y247-Q249 PolarHBondContact O-N 2.97Å; Y247-Y250 PolarHBondContact O-N 3.4Å; Y247-A251 HydrophobicContact CD2-CB 3.42Å; Y247-A251 VanDerWaalsContact CD2-CB 3.42Å; Y247-A251 HydrophobicContact CE2-CB 3.78Å; Y247-A251 HydrophobicContact CG-CB 3.93Å; Y247-A251 WeakPolarHBondContact O-CB 3.11Å; Y247-A251 PolarHBondContact O-N 3.21Å; Y247-I260 HydrophobicContact CD2-CG2 4.38Å; Y247-I260 HydrophobicContact CE2-CB 4.06Å; Y247-I260 HydrophobicContact CE2-CG2 3.51Å; Y247-I260 WeakPolarHBondContact OH-CB 3.39Å; Y247-L262 HydrophobicContact CD2-CD1 3.73Å; Y247-L262 HydrophobicContact CD2-CG 3.9Å; Y247-L262 HydrophobicContact CE2-CG 4.41Å
248	K	98.5	Very high	98.5	Very high	142 Å²	142	41.7 Å²	41.7	62%	0.617	25%	0.245	S	C	*	.	H	α-helix	trans	-56.5	-31.6	-177.6	178	175.3	-179.6	173.8	0	113.5	T214 P244	T214-K248 HydrophobicContact CG2-CB 3.65Å; T214-K248 HydrophobicContact CG2-CD 3.89Å; T214-K248 HydrophobicContact CG2-CG 4.37Å; P244-K248 PolarHBondContact O-N 2.62Å
249	Q	98.5	Very high	98.5	Very high	126 Å²	126	46.1 Å²	46.1	59%	0.589	27%	0.266	S	S	*	.	H	α-helix	trans	-91.3	-30.8	-176.2	-71.1	-177.5	-4.1	0	0	113.8	S245 S246 Y247	S245-Q249 WeakPolarHBondContact O-CG 3.34Å; S245-Q249 PolarHBondContact O-N 2.8Å; S246-Q249 PolarHBondContact O-N 2.76Å; Y247-Q249 PolarHBondContact O-N 2.97Å
250	Y	98.8	Very high	98.4	Very high	42 Å²	42	46.5 Å²	46.5	17%	0.165	27%	0.269	C	S	.	.	H	α-helix	trans	-135.3	-14.3	-162.9	-51.3	-61.7	0	0	0	114.8	S246 Y247 N274 Y275 A278 H279	S246-Y250 WeakPolarHBondContact O-CB 3.34Å; S246-Y250 WeakPolarHBondContact O-CD2 3.43Å; S246-Y250 PolarHBondContact O-N 2.81Å; Y247-Y250 PolarHBondContact O-N 3.4Å; Y250-N274 PolarHBondContact O-ND2 2.93Å; Y250-Y275 AromaticContact CD2-CD2 3.44Å; Y250-Y275 HydrophobicContact CD2-CD2 3.44Å; Y250-Y275 VanDerWaalsContact CD2-CD2 3.44Å; Y250-Y275 AromaticContact CD2-CE2 3.94Å; Y250-Y275 HydrophobicContact CD2-CE2 3.94Å; Y250-Y275 HydrophobicContact CD2-CG 4.45Å; Y250-Y275 AromaticContact CE2-CD2 3.87Å; Y250-Y275 HydrophobicContact CE2-CD2 3.87Å; Y250-Y275 AromaticContact CE2-CE2 3.93Å; Y250-Y275 HydrophobicContact CE2-CE2 3.93Å; Y250-Y275 AromaticContact CG-CD2 3.92Å; Y250-Y275 HydrophobicContact CG-CD2 3.92Å; Y250-A278 HydrophobicContact CD1-CB 3.78Å; Y250-A278 HydrophobicContact CE1-CB 3.55Å; Y250-H279 AromaticContact CE2-CE1 3.77Å; Y250-H279 AromaticContact CZ-CE1 3.52Å; Y250-H279 PolarHBondContact OH-CE1 3.07Å
251	A	98.8	Very high	98.4	Very high	15 Å²	15	49.5 Å²	49.5	12%	0.124	29%	0.285	C	S	.	.			trans	-68.2	145.2	176.8	0	0	0	0	0	110.8	Y247 I260 L262 S271	Y247-A251 HydrophobicContact CD2-CB 3.42Å; Y247-A251 VanDerWaalsContact CD2-CB 3.42Å; Y247-A251 HydrophobicContact CE2-CB 3.78Å; Y247-A251 HydrophobicContact CG-CB 3.93Å; Y247-A251 WeakPolarHBondContact O-CB 3.11Å; Y247-A251 PolarHBondContact O-N 3.21Å; A251-I260 HydrophobicContact CB-CG2 3.57Å; A251-L262 HydrophobicContact CB-CD2 4.01Å; A251-L262 HydrophobicContact CB-CG 4.5Å; A251-S271 VanDerWaalsContact CA-OG 3.29Å; A251-S271 WeakPolarHBondContact CA-OG 3.33Å
252	V	98.8	Very high	98.4	Very high	27 Å²	27	48.4 Å²	48.4	16%	0.164	28%	0.28	C	S	.	.			trans	-140.3	142	-177	-66.1	0	0	0	0	109.4	F254 G270 S271 N274	V252-F254 VanDerWaalsContact C-N 3.32Å; V252-F254 HydrophobicContact CG2-CB 4.29Å; V252-F254 HydrophobicContact CG2-CD2 4.39Å; V252-F254 PolarHBondContact O-N 2.63Å; V252-G270 VanDerWaalsContact CG2-C 3.47Å; V252-S271 PolarHBondContact N-OG 3.32Å; V252-S271 VanDerWaalsContact N-OG 3.07Å; V252-N274 HydrophobicContact CG1-CB 4.26Å; V252-N274 WeakPolarHBondContact CG1-ND2 3.19Å
253	D	98.7	Very high	98.4	Very high	52 Å²	52	50.7 Å²	50.7	28%	0.278	29%	0.288	S	S	.	.			trans	-69.7	95	164.5	170.9	15.5	0	0	0	106.9	S255 G256 D257 G258 H259 I260	D253-S255 PolarHBondContact OD1-N 2.93Å; D253-S255 PolarHBondContact OD1-OG 3.2Å; D253-G256 VanDerWaalsContact OD1-CA 3.28Å; D253-G256 WeakPolarHBondContact OD1-CA 3.33Å; D253-G256 PolarHBondContact OD1-N 3.29Å; D253-G256 WeakPolarHBondContact OD2-CA 3.44Å; D253-D257 PolarHBondContact OD1-N 3.39Å; D253-D257 PolarHBondContact OD2-N 3.07Å; D253-G258 VanDerWaalsContact OD2-CA 3.29Å; D253-G258 WeakPolarHBondContact OD2-CA 3.42Å; D253-G258 PolarHBondContact OD2-N 3.1Å; D253-H259 WeakPolarHBondContact CB-O 3.19Å; D253-H259 VanDerWaalsContact CG-O 3.22Å; D253-I260 HydrophobicContact CB-CG1 4.04Å
254	F	98.7	Very high	98.4	Very high	10 Å²	10	51.6 Å²	51.6	4%	0.044	29%	0.294	C	S	.	.			trans	-95	-23.7	179.2	-153.7	-119.6	0	0	0	111.1	A156 R159 A160 Y164 V252 G256 V266 D267 I269 G270	A156-F254 HydrophobicContact CB-CE1 4.38Å; A156-F254 WeakPolarHBondContact O-CE1 3.41Å; R159-F254 HydrophobicContact CB-CE1 4.38Å; R159-F254 HydrophobicContact CB-CZ 4.03Å; R159-F254 HydrophobicContact CG-CE1 4.45Å; R159-F254 HydrophobicContact CG-CE2 4.42Å; R159-F254 HydrophobicContact CG-CZ 3.77Å; R159-F254 PolarHBondContact NH1-O 2.76Å; R159-F254 PolarHBondContact NH2-O 3.48Å; A160-F254 HydrophobicContact CB-CE1 4.1Å; A160-F254 HydrophobicContact CB-CZ 3.89Å; Y164-F254 HydrophobicContact CE2-CD2 4.24Å; Y164-F254 AromaticContact CE2-CE2 3.72Å; Y164-F254 HydrophobicContact CE2-CE2 3.72Å; Y164-F254 HydrophobicContact CE2-CZ 4.42Å; V252-F254 VanDerWaalsContact C-N 3.32Å; V252-F254 HydrophobicContact CG2-CB 4.29Å; V252-F254 HydrophobicContact CG2-CD2 4.39Å; V252-F254 PolarHBondContact O-N 2.63Å; F254-G256 PolarHBondContact O-N 3.03Å; F254-V266 HydrophobicContact CB-CG1 4.24Å; F254-V266 WeakPolarHBondContact CB-O 3.29Å; F254-V266 HydrophobicContact CD1-CG1 3.75Å; F254-V266 VanDerWaalsContact CD1-O 3.26Å; F254-V266 WeakPolarHBondContact CD1-O 3.4Å; F254-V266 HydrophobicContact CG-CG1 4.41Å; F254-D267 WeakPolarHBondContact CA-OD1 3.32Å; F254-D267 PolarHBondContact N-OD1 2.76Å; F254-I269 HydrophobicContact CE1-CG2 4.24Å; F254-G270 VanDerWaalsContact CG-CA 3.45Å
255	S	98.2	Very high	98.4	Very high	49 Å²	49	52 Å²	52	34%	0.343	30%	0.297	S	S	.	.	S	Bend	trans	-61.3	-32.2	167.5	24.8	0	0	0	0	112.6	D253 D257 D267	D253-S255 PolarHBondContact OD1-N 2.93Å; D253-S255 PolarHBondContact OD1-OG 3.2Å; S255-D257 PolarHBondContact OG-OD1 3.24Å; S255-D267 PolarHBondContact N-OD1 3.4Å; S255-D267 PolarHBondContact OG-OD1 2.96Å
256	G	97.9	Very high	98.4	Very high	62 Å²	62	51.6 Å²	51.6	64%	0.639	29%	0.292	S	S	*	.	S	Bend	trans	77.1	26.4	-173.3	0	0	0	0	0	113.1	D253 F254	D253-G256 VanDerWaalsContact OD1-CA 3.28Å; D253-G256 WeakPolarHBondContact OD1-CA 3.33Å; D253-G256 PolarHBondContact OD1-N 3.29Å; D253-G256 WeakPolarHBondContact OD2-CA 3.44Å; F254-G256 PolarHBondContact O-N 3.03Å
257	D	97.8	Very high	98.4	Very high	102 Å²	102	50.4 Å²	50.4	55%	0.545	28%	0.284	S	S	.	.	S	Bend	trans	-95.2	-0.4	-178.6	70.5	-6	0	0	0	113.5	D253 S255 H259	D253-D257 PolarHBondContact OD1-N 3.39Å; D253-D257 PolarHBondContact OD2-N 3.07Å; S255-D257 PolarHBondContact OG-OD1 3.24Å; D257-H259 PolarHBondContact OD1-N 3.48Å; D257-H259 VanDerWaalsContact OD1-N 3.08Å
258	G	97.5	Very high	98.4	Very high	61 Å²	61	49.6 Å²	49.6	63%	0.629	28%	0.281	S	S	*	.	S	Bend	trans	93.1	-1.4	179.3	0	0	0	0	0	114.3	D253	D253-G258 VanDerWaalsContact OD2-CA 3.29Å; D253-G258 WeakPolarHBondContact OD2-CA 3.42Å; D253-G258 PolarHBondContact OD2-N 3.1Å
259	H	97.5	Very high	98.4	Very high	93 Å²	93	42.8 Å²	42.8	43%	0.431	25%	0.251	S	S	.	.			trans	-123.9	152.5	-178.2	-67.5	-75.5	0	0	0	111.2	E222 D253 D257	E222-H259 WeakPolarHBondContact OE2-CA 3.24Å; E222-H259 IonicContact OE2-ND1 3.56Å; D253-H259 WeakPolarHBondContact CB-O 3.19Å; D253-H259 VanDerWaalsContact CG-O 3.22Å; D257-H259 PolarHBondContact OD1-N 3.48Å; D257-H259 VanDerWaalsContact OD1-N 3.08Å
260	I	98.3	Very high	98.5	Very high	42 Å²	42	36.8 Å²	36.8	22%	0.215	22%	0.223	C	C	.	.			trans	-109.7	107.8	175.1	-50.4	-176.5	0	0	0	109.3	E222 Y247 A251 D253 D267	E222-I260 PolarHBondContact OE2-N 3.12Å; Y247-I260 HydrophobicContact CD2-CG2 4.38Å; Y247-I260 HydrophobicContact CE2-CB 4.06Å; Y247-I260 HydrophobicContact CE2-CG2 3.51Å; Y247-I260 WeakPolarHBondContact OH-CB 3.39Å; A251-I260 HydrophobicContact CB-CG2 3.57Å; D253-I260 HydrophobicContact CB-CG1 4.04Å; I260-D267 WeakPolarHBondContact CA-OD2 3.18Å
261	N	98	Very high	98.5	Very high	67 Å²	67	34.9 Å²	34.9	36%	0.358	22%	0.216	S	C	.	.			trans	-124.7	102	-177.1	-179.9	-0.1	0	0	0	112.2	W263 D264 D267	N261-W263 PolarHBondContact O-N 3.37Å; N261-W263 VanDerWaalsContact O-N 3.11Å; N261-W263 WeakPolarHBondContact OD1-CA 3.45Å; N261-W263 WeakPolarHBondContact OD1-CB 3.46Å; N261-W263 PolarHBondContact OD1-N 2.91Å; N261-D264 HydrophobicContact CB-CB 4.17Å; N261-D264 WeakPolarHBondContact O-CA 3.28Å; N261-D264 WeakPolarHBondContact O-CB 3.49Å; N261-D264 PolarHBondContact O-N 3.32Å; N261-D264 PolarHBondContact OD1-N 3.08Å; N261-D267 PolarHBondContact N-OD2 2.87Å; N261-D267 VanDerWaalsContact O-CB 3.23Å; N261-D267 WeakPolarHBondContact O-CB 3.42Å
262	L	98.5	Very high	98.5	Very high	6 Å²	6	34.2 Å²	34.2	3%	0.031	21%	0.21	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70.2	-8.3	179.4	-64.1	-174.4	0	0	0	115.2	M237 G238 Y239 F242 Y247 A251 S271	M237-L262 HydrophobicContact CE-CD1 4.38Å; G238-L262 CarbonylContact C-O 3.58Å; G238-L262 WeakPolarHBondContact CA-O 3.02Å; Y239-L262 PolarHBondContact N-O 3.35Å; F242-L262 HydrophobicContact CB-CD1 3.7Å; F242-L262 HydrophobicContact CD2-CD1 3.8Å; F242-L262 HydrophobicContact CG-CD1 4.04Å; Y247-L262 HydrophobicContact CD2-CD1 3.73Å; Y247-L262 HydrophobicContact CD2-CG 3.9Å; Y247-L262 HydrophobicContact CE2-CG 4.41Å; A251-L262 HydrophobicContact CB-CD2 4.01Å; A251-L262 HydrophobicContact CB-CG 4.5Å; L262-S271 WeakPolarHBondContact CD2-OG 3.36Å
263	W	98.3	Very high	98.5	Very high	55 Å²	55	32.9 Å²	32.9	21%	0.208	20%	0.202	C	C	.	.	T	Hydrogen-bonded Turn	trans	-87.5	-10.4	168.3	-63.9	-95.5	0	0	0	112.3	I190 L229 K230 M237 Y239 N261	I190-W263 HydrophobicContact CD1-CH2 3.65Å; I190-W263 HydrophobicContact CD1-CZ2 3.47Å; I190-W263 VanDerWaalsContact CD1-CZ2 3.47Å; L229-W263 HydrophobicContact CB-CH2 3.87Å; L229-W263 HydrophobicContact CB-CZ2 4.17Å; L229-W263 HydrophobicContact CD1-CH2 4.14Å; L229-W263 HydrophobicContact CD1-CZ3 4.3Å; L229-W263 HydrophobicContact CD2-CE3 4.34Å; L229-W263 HydrophobicContact CD2-CH2 3.94Å; L229-W263 HydrophobicContact CD2-CZ3 3.84Å; L229-W263 HydrophobicContact CG-CH2 4.2Å; L229-W263 HydrophobicContact CG-CZ3 4.48Å; K230-W263 VanDerWaalsContact O-CE2 3.3Å; K230-W263 VanDerWaalsContact O-CZ2 3.23Å; K230-W263 WeakPolarHBondContact O-CZ2 3.47Å; K230-W263 PolarHBondContact O-NE1 3.23Å; M237-W263 HydrophobicContact CB-CH2 4.06Å; M237-W263 HydrophobicContact CB-CZ2 4.17Å; M237-W263 HydrophobicContact CG-CH2 4.49Å; M237-W263 HydrophobicContact SD-CH2 4.4Å; Y239-W263 VanDerWaalsContact CE2-O 3.22Å; Y239-W263 WeakPolarHBondContact CE2-O 3.32Å; N261-W263 PolarHBondContact O-N 3.37Å; N261-W263 VanDerWaalsContact O-N 3.11Å; N261-W263 WeakPolarHBondContact OD1-CA 3.45Å; N261-W263 WeakPolarHBondContact OD1-CB 3.46Å; N261-W263 PolarHBondContact OD1-N 2.91Å
264	D	98.4	Very high	98.5	Very high	52 Å²	52	32.1 Å²	32.1	28%	0.278	20%	0.198	S	C	.	.	S	Bend	trans	-80.1	129.8	162.5	-177.5	74.5	0	0	0	110.2	N261 V266 D267 A268	N261-D264 HydrophobicContact CB-CB 4.17Å; N261-D264 WeakPolarHBondContact O-CA 3.28Å; N261-D264 WeakPolarHBondContact O-CB 3.49Å; N261-D264 PolarHBondContact O-N 3.32Å; N261-D264 PolarHBondContact OD1-N 3.08Å; D264-V266 VanDerWaalsContact C-N 3.33Å; D264-V266 PolarHBondContact O-N 3.48Å; D264-V266 WeakPolarHBondContact OD2-CA 3.34Å; D264-V266 WeakPolarHBondContact OD2-CB 3.38Å; D264-V266 PolarHBondContact OD2-N 3.34Å; D264-D267 HydrophobicContact CB-CB 4.39Å; D264-D267 PolarHBondContact OD2-N 3.5Å; D264-A268 WeakPolarHBondContact O-CB 3.41Å; D264-A268 PolarHBondContact O-N 3.37Å
265	P	98.7	Very high	98.5	Very high	9 Å²	9	32.4 Å²	32.4	6%	0.058	20%	0.199	C	C	.	.	H	α-helix	trans	-63.4	-32.2	-179.4	-29	40.1	0	0	0	115.1	F149 Y153 Y239 I269	F149-P265 HydrophobicContact CE2-CB 4.12Å; F149-P265 HydrophobicContact CZ-CB 4.44Å; Y153-P265 HydrophobicContact CD1-CB 4.09Å; Y153-P265 HydrophobicContact CD2-CB 4.15Å; Y153-P265 HydrophobicContact CE1-CB 3.65Å; Y153-P265 HydrophobicContact CE1-CG 4.09Å; Y153-P265 HydrophobicContact CE2-CB 3.73Å; Y153-P265 HydrophobicContact CE2-CG 4.04Å; Y153-P265 HydrophobicContact CG-CB 4.33Å; Y153-P265 VanDerWaalsContact CZ-CB 3.47Å; Y153-P265 WeakPolarHBondContact OH-CG 2.93Å; Y239-P265 HydrophobicContact CD2-CG 4.41Å; Y239-P265 HydrophobicContact CE1-CB 4.49Å; Y239-P265 HydrophobicContact CE1-CG 4.06Å; Y239-P265 HydrophobicContact CE2-CG 3.75Å; P265-I269 WeakPolarHBondContact O-CB 3.41Å; P265-I269 VanDerWaalsContact O-CD1 3.32Å; P265-I269 WeakPolarHBondContact O-CD1 3.44Å; P265-I269 WeakPolarHBondContact O-CG1 3.41Å; P265-I269 PolarHBondContact O-N 3.3Å
266	V	98.9	Very high	98.5	Very high	28 Å²	28	30 Å²	30	17%	0.17	18%	0.183	C	C	.	.	H	α-helix	trans	-69.2	-48	-178.5	-177.8	0	0	0	0	109.2	Y153 A156 F254 D264 A268 I269 G270	Y153-V266 HydrophobicContact CD1-CG2 4.25Å; Y153-V266 HydrophobicContact CE1-CG2 4.45Å; A156-V266 HydrophobicContact CB-CG1 3.99Å; A156-V266 HydrophobicContact CB-CG2 4.35Å; F254-V266 HydrophobicContact CB-CG1 4.24Å; F254-V266 WeakPolarHBondContact CB-O 3.29Å; F254-V266 HydrophobicContact CD1-CG1 3.75Å; F254-V266 VanDerWaalsContact CD1-O 3.26Å; F254-V266 WeakPolarHBondContact CD1-O 3.4Å; F254-V266 HydrophobicContact CG-CG1 4.41Å; D264-V266 VanDerWaalsContact C-N 3.33Å; D264-V266 PolarHBondContact O-N 3.48Å; D264-V266 WeakPolarHBondContact OD2-CA 3.34Å; D264-V266 WeakPolarHBondContact OD2-CB 3.38Å; D264-V266 PolarHBondContact OD2-N 3.34Å; V266-A268 VanDerWaalsContact C-N 3.35Å; V266-A268 PolarHBondContact O-N 3.31Å; V266-I269 WeakPolarHBondContact O-CB 3.39Å; V266-I269 PolarHBondContact O-N 3.27Å; V266-G270 PolarHBondContact O-N 2.84Å
267	D	98.9	Very high	98.6	Very high	0 Å²	0	32.5 Å²	32.5	0%	0	18%	0.176	C	C	.	.	H	α-helix	trans	-62.5	-41	175	-83.4	8.9	0	0	0	112.7	F254 S255 I260 N261 D264 I269 G270 S271	F254-D267 WeakPolarHBondContact CA-OD1 3.32Å; F254-D267 PolarHBondContact N-OD1 2.76Å; S255-D267 PolarHBondContact N-OD1 3.4Å; S255-D267 PolarHBondContact OG-OD1 2.96Å; I260-D267 WeakPolarHBondContact CA-OD2 3.18Å; N261-D267 PolarHBondContact N-OD2 2.87Å; N261-D267 VanDerWaalsContact O-CB 3.23Å; N261-D267 WeakPolarHBondContact O-CB 3.42Å; D264-D267 HydrophobicContact CB-CB 4.39Å; D264-D267 PolarHBondContact OD2-N 3.5Å; D267-I269 VanDerWaalsContact C-N 3.33Å; D267-I269 PolarHBondContact O-N 3.04Å; D267-G270 PolarHBondContact O-N 3.27Å; D267-S271 WeakPolarHBondContact O-CB 3.22Å; D267-S271 PolarHBondContact O-N 3.18Å; D267-S271 PolarHBondContact O-OG 2.96Å
268	A	98.9	Very high	98.6	Very high	1 Å²	1	30.5 Å²	30.5	1%	0.008	17%	0.174	C	C	.	.	H	α-helix	trans	-61.4	-41.4	174.1	0	0	0	0	0	112.4	Y239 D264 V266 S271 V272	Y239-A268 HydrophobicContact CG-CB 4.25Å; D264-A268 WeakPolarHBondContact O-CB 3.41Å; D264-A268 PolarHBondContact O-N 3.37Å; V266-A268 VanDerWaalsContact C-N 3.35Å; V266-A268 PolarHBondContact O-N 3.31Å; A268-S271 PolarHBondContact O-N 3.47Å; A268-V272 WeakPolarHBondContact O-CB 3.39Å; A268-V272 WeakPolarHBondContact O-CG2 3.43Å; A268-V272 PolarHBondContact O-N 3.4Å
269	I	99	Very high	98.6	Very high	0 Å²	0	29.6 Å²	29.6	0%	0	15%	0.153	C	C	.	.	H	α-helix	trans	-60.3	-50.5	175.4	-77.1	161.3	0	0	0	110.7	F149 Y153 A156 L157 A160 I171 I175 F254 P265 V266 D267 S271 A273	F149-I269 HydrophobicContact CE1-CD1 4.12Å; F149-I269 HydrophobicContact CE1-CG1 4.37Å; F149-I269 HydrophobicContact CZ-CD1 3.94Å; F149-I269 HydrophobicContact CZ-CG1 4.19Å; Y153-I269 HydrophobicContact CG-CD1 4.12Å; A156-I269 HydrophobicContact CB-CD1 3.97Å; A156-I269 HydrophobicContact CB-CG2 4.2Å; L157-I269 HydrophobicContact CD2-CD1 4.11Å; L157-I269 HydrophobicContact CD2-CG1 4.01Å; L157-I269 HydrophobicContact CD2-CG2 4.02Å; L157-I269 HydrophobicContact CG-CD1 4.04Å; L157-I269 HydrophobicContact CG-CG1 4.48Å; L157-I269 HydrophobicContact CG-CG2 4.44Å; A160-I269 HydrophobicContact CB-CG2 3.87Å; I171-I269 HydrophobicContact CD1-CG2 4.4Å; I171-I269 HydrophobicContact CG2-CB 4.23Å; I171-I269 HydrophobicContact CG2-CG1 4Å; I171-I269 HydrophobicContact CG2-CG2 4.18Å; I175-I269 HydrophobicContact CD1-CG1 3.94Å; F254-I269 HydrophobicContact CE1-CG2 4.24Å; P265-I269 WeakPolarHBondContact O-CB 3.41Å; P265-I269 VanDerWaalsContact O-CD1 3.32Å; P265-I269 WeakPolarHBondContact O-CD1 3.44Å; P265-I269 WeakPolarHBondContact O-CG1 3.41Å; P265-I269 PolarHBondContact O-N 3.3Å; V266-I269 WeakPolarHBondContact O-CB 3.39Å; V266-I269 PolarHBondContact O-N 3.27Å; D267-I269 VanDerWaalsContact C-N 3.33Å; D267-I269 PolarHBondContact O-N 3.04Å; I269-S271 PolarHBondContact O-N 3.46Å; I269-A273 WeakPolarHBondContact O-CB 3.38Å; I269-A273 PolarHBondContact O-N 3.08Å
270	G	98.9	Very high	98.7	Very high	0 Å²	0	27.4 Å²	27.4	0%	0	16%	0.155	C	C	.	.	H	α-helix	trans	-61.4	-44.5	178.8	0	0	0	0	0	112.4	V252 F254 V266 D267 A273 N274	V252-G270 VanDerWaalsContact CG2-C 3.47Å; F254-G270 VanDerWaalsContact CG-CA 3.45Å; V266-G270 PolarHBondContact O-N 2.84Å; D267-G270 PolarHBondContact O-N 3.27Å; G270-A273 PolarHBondContact O-N 3.05Å; G270-N274 WeakPolarHBondContact O-CB 3.46Å; G270-N274 PolarHBondContact O-N 3.5Å
271	S	98.9	Very high	98.7	Very high	1 Å²	1	26 Å²	26	1%	0.007	15%	0.147	C	C	.	.	H	α-helix	trans	-66.5	-43.2	-178.4	-61.3	0	0	0	0	112.4	A251 V252 L262 D267 A268 I269 N274 Y275	A251-S271 VanDerWaalsContact CA-OG 3.29Å; A251-S271 WeakPolarHBondContact CA-OG 3.33Å; V252-S271 PolarHBondContact N-OG 3.32Å; V252-S271 VanDerWaalsContact N-OG 3.07Å; L262-S271 WeakPolarHBondContact CD2-OG 3.36Å; D267-S271 WeakPolarHBondContact O-CB 3.22Å; D267-S271 PolarHBondContact O-N 3.18Å; D267-S271 PolarHBondContact O-OG 2.96Å; A268-S271 PolarHBondContact O-N 3.47Å; I269-S271 PolarHBondContact O-N 3.46Å; S271-N274 PolarHBondContact O-N 2.83Å; S271-Y275 WeakPolarHBondContact O-CB 3.42Å; S271-Y275 PolarHBondContact O-N 3.11Å
272	V	98.9	Very high	98.7	Very high	1 Å²	1	26 Å²	26	1%	0.006	15%	0.149	C	C	.	.	H	α-helix	trans	-59.6	-48.5	172.1	170.9	0	0	0	0	109.7	I171 I174 I175 A268 N274 Y275 F276 Y354	I171-V272 HydrophobicContact CB-CG1 4.43Å; I171-V272 HydrophobicContact CG1-CG1 4.35Å; I171-V272 HydrophobicContact CG2-CB 4.26Å; I171-V272 HydrophobicContact CG2-CG1 4.15Å; I174-V272 HydrophobicContact CB-CG1 4.05Å; I174-V272 HydrophobicContact CG1-CG1 4.26Å; I174-V272 HydrophobicContact CG2-CG1 3.91Å; I174-V272 HydrophobicContact CG2-CG2 4.03Å; I175-V272 HydrophobicContact CG1-CG2 4.41Å; A268-V272 WeakPolarHBondContact O-CB 3.39Å; A268-V272 WeakPolarHBondContact O-CG2 3.43Å; A268-V272 PolarHBondContact O-N 3.4Å; V272-N274 PolarHBondContact O-N 2.92Å; V272-Y275 WeakPolarHBondContact O-CB 3.14Å; V272-Y275 PolarHBondContact O-N 3.04Å; V272-F276 HydrophobicContact CG1-CD2 4.01Å; V272-F276 HydrophobicContact CG1-CE2 4.1Å; V272-F276 VanDerWaalsContact O-CD2 3.3Å; V272-F276 WeakPolarHBondContact O-CD2 3.41Å; V272-F276 PolarHBondContact O-N 3.47Å; V272-F276 VanDerWaalsContact O-N 3.09Å; V272-Y354 HydrophobicContact CG1-CE2 4.49Å
273	A	98.9	Very high	98.6	Very high	0 Å²	0	30.5 Å²	30.5	0%	0	17%	0.169	C	C	.	.	H	α-helix	trans	-62.1	-42.4	-180	0	0	0	0	0	112.6	A160 Y164 V166 I171 I269 G270 Y275 F276 K277	A160-A273 HydrophobicContact CB-CB 3.8Å; Y164-A273 HydrophobicContact CD2-CB 3.47Å; Y164-A273 VanDerWaalsContact CD2-CB 3.47Å; Y164-A273 HydrophobicContact CE2-CB 4.28Å; Y164-A273 HydrophobicContact CG-CB 3.92Å; V166-A273 HydrophobicContact CB-CB 4.21Å; V166-A273 HydrophobicContact CG2-CB 4.42Å; V166-A273 WeakPolarHBondContact CG2-O 3.33Å; I171-A273 HydrophobicContact CD1-CB 3.81Å; I171-A273 HydrophobicContact CG1-CB 4.32Å; I269-A273 WeakPolarHBondContact O-CB 3.38Å; I269-A273 PolarHBondContact O-N 3.08Å; G270-A273 PolarHBondContact O-N 3.05Å; A273-Y275 PolarHBondContact O-N 3.44Å; A273-F276 PolarHBondContact O-N 2.71Å; A273-K277 PolarHBondContact O-N 3.5Å
274	N	98.9	Very high	98.5	Very high	35 Å²	35	31.2 Å²	31.2	19%	0.187	19%	0.193	C	C	.	.	H	α-helix	trans	-63.3	-41.4	176.5	-171.4	41.2	0	0	0	112	Y164 Y250 V252 G270 S271 V272 F276 K277 A278	Y164-N274 HydrophobicContact CD1-CB 4.09Å; Y164-N274 HydrophobicContact CE1-CB 3.62Å; Y164-N274 VanDerWaalsContact CE1-OD1 3.31Å; Y164-N274 WeakPolarHBondContact CE1-OD1 3.42Å; Y164-N274 HydrophobicContact CE2-CB 4.4Å; Y250-N274 PolarHBondContact O-ND2 2.93Å; V252-N274 HydrophobicContact CG1-CB 4.26Å; V252-N274 WeakPolarHBondContact CG1-ND2 3.19Å; G270-N274 WeakPolarHBondContact O-CB 3.46Å; G270-N274 PolarHBondContact O-N 3.5Å; S271-N274 PolarHBondContact O-N 2.83Å; V272-N274 PolarHBondContact O-N 2.92Å; N274-F276 VanDerWaalsContact C-N 3.34Å; N274-F276 PolarHBondContact O-N 2.82Å; N274-K277 PolarHBondContact O-N 2.84Å; N274-A278 WeakPolarHBondContact O-CB 3.37Å; N274-A278 PolarHBondContact O-N 2.98Å
275	Y	98.9	Very high	98.5	Very high	16 Å²	16	30.6 Å²	30.6	6%	0.063	19%	0.19	C	C	.	.	H	α-helix	trans	-55.8	-49	173.2	178.8	-78.1	0	0	0	111.4	F242 Y250 S271 V272 A273 K277 A278 H279 R353 Y354	F242-Y275 HydrophobicContact CE1-CD2 4.01Å; F242-Y275 HydrophobicContact CE1-CG 4.31Å; F242-Y275 HydrophobicContact CZ-CD2 4Å; F242-Y275 HydrophobicContact CZ-CG 4.24Å; Y250-Y275 AromaticContact CD2-CD2 3.44Å; Y250-Y275 HydrophobicContact CD2-CD2 3.44Å; Y250-Y275 VanDerWaalsContact CD2-CD2 3.44Å; Y250-Y275 AromaticContact CD2-CE2 3.94Å; Y250-Y275 HydrophobicContact CD2-CE2 3.94Å; Y250-Y275 HydrophobicContact CD2-CG 4.45Å; Y250-Y275 AromaticContact CE2-CD2 3.87Å; Y250-Y275 HydrophobicContact CE2-CD2 3.87Å; Y250-Y275 AromaticContact CE2-CE2 3.93Å; Y250-Y275 HydrophobicContact CE2-CE2 3.93Å; Y250-Y275 AromaticContact CG-CD2 3.92Å; Y250-Y275 HydrophobicContact CG-CD2 3.92Å; S271-Y275 WeakPolarHBondContact O-CB 3.42Å; S271-Y275 PolarHBondContact O-N 3.11Å; V272-Y275 WeakPolarHBondContact O-CB 3.14Å; V272-Y275 PolarHBondContact O-N 3.04Å; A273-Y275 PolarHBondContact O-N 3.44Å; Y275-K277 PolarHBondContact O-N 3.21Å; Y275-A278 PolarHBondContact O-N 3.18Å; Y275-H279 AromaticContact CD1-ND1 3.54Å; Y275-H279 AromaticContact CD2-CE1 3.77Å; Y275-H279 AromaticContact CD2-ND1 3.97Å; Y275-H279 AromaticContact CE1-CE1 3.63Å; Y275-H279 AromaticContact CE1-CG 3.93Å; Y275-H279 AromaticContact CE1-ND1 3.38Å; Y275-H279 WeakPolarHBondContact CE1-ND1 3.26Å; Y275-H279 AromaticContact CE2-CE1 3.34Å; Y275-H279 WeakPolarHBondContact CE2-CE1 3.44Å; Y275-H279 AromaticContact CE2-ND1 3.85Å; Y275-H279 AromaticContact CG-ND1 3.8Å; Y275-H279 AromaticContact CZ-CE1 3.24Å; Y275-H279 AromaticContact CZ-ND1 3.53Å; Y275-H279 AromaticContact CZ-NE2 3.8Å; Y275-H279 WeakPolarHBondContact O-CB 3.49Å; Y275-H279 PolarHBondContact O-N 3.48Å; Y275-H279 PolarHBondContact O-ND1 2.92Å; Y275-R353 HydrophobicContact CE1-CB 4.22Å; Y275-R353 PolarHBondContact OH-O 2.95Å; Y275-Y354 AromaticContact CD1-CD2 3.49Å; Y275-Y354 HydrophobicContact CD1-CD2 3.49Å; Y275-Y354 VanDerWaalsContact CD1-CD2 3.49Å; Y275-Y354 AromaticContact CD1-CE2 3.76Å; Y275-Y354 HydrophobicContact CD1-CE2 3.76Å; Y275-Y354 AromaticContact CE1-CD2 3.42Å; Y275-Y354 HydrophobicContact CE1-CD2 3.42Å; Y275-Y354 VanDerWaalsContact CE1-CD2 3.42Å; Y275-Y354 HydrophobicContact CE1-CE2 4.1Å; Y275-Y354 HydrophobicContact CE1-CG 4.12Å; Y275-Y354 HydrophobicContact CG-CD2 4.18Å; Y275-Y354 HydrophobicContact CG-CE2 4.02Å; Y275-Y354 PolarHBondContact OH-N 2.92Å
276	F	98.8	Very high	98.4	Very high	0 Å²	0	33.6 Å²	33.6	0%	0	20%	0.203	C	C	.	.	H	α-helix	trans	-63.5	-41.9	179.5	-90.9	-90.4	0	0	0	112.2	V166 I170 I174 V272 A273 N274 H279 G280 W281 T350 I351 Y354	V166-F276 HydrophobicContact CB-CB 4.45Å; V166-F276 HydrophobicContact CG1-CB 4.07Å; V166-F276 HydrophobicContact CG1-CG 4.27Å; V166-F276 HydrophobicContact CG2-CB 3.53Å; I170-F276 HydrophobicContact CG2-CD1 4.21Å; I170-F276 HydrophobicContact CG2-CE1 3.87Å; I170-F276 HydrophobicContact CG2-CE2 4.31Å; I170-F276 HydrophobicContact CG2-CZ 3.92Å; I174-F276 HydrophobicContact CD1-CE2 3.79Å; I174-F276 HydrophobicContact CD1-CZ 3.74Å; I174-F276 HydrophobicContact CG1-CE2 3.64Å; I174-F276 HydrophobicContact CG1-CZ 3.86Å; V272-F276 HydrophobicContact CG1-CD2 4.01Å; V272-F276 HydrophobicContact CG1-CE2 4.1Å; V272-F276 VanDerWaalsContact O-CD2 3.3Å; V272-F276 WeakPolarHBondContact O-CD2 3.41Å; V272-F276 PolarHBondContact O-N 3.47Å; V272-F276 VanDerWaalsContact O-N 3.09Å; A273-F276 PolarHBondContact O-N 2.71Å; N274-F276 VanDerWaalsContact C-N 3.34Å; N274-F276 PolarHBondContact O-N 2.82Å; F276-H279 CarbonylContact O-C 3.54Å; F276-H279 PolarHBondContact O-N 3.34Å; F276-G280 PolarHBondContact O-N 2.98Å; F276-W281 HydrophobicContact CB-CB 4.2Å; F276-W281 HydrophobicContact CD1-CD2 4.25Å; F276-W281 AromaticContact CD1-CE3 3.53Å; F276-W281 HydrophobicContact CD1-CE3 3.53Å; F276-W281 HydrophobicContact CD1-CZ3 4Å; F276-W281 HydrophobicContact CE1-CE3 4.04Å; F276-W281 HydrophobicContact CE1-CZ3 4.07Å; F276-W281 VanDerWaalsContact O-CB 3.24Å; F276-W281 WeakPolarHBondContact O-CB 2.97Å; F276-W281 PolarHBondContact O-N 2.82Å; F276-T350 HydrophobicContact CD1-CG2 3.68Å; F276-T350 HydrophobicContact CE1-CG2 4.2Å; F276-I351 HydrophobicContact CE1-CB 4.09Å; F276-I351 HydrophobicContact CE1-CG1 3.6Å; F276-I351 HydrophobicContact CZ-CB 4.31Å; F276-I351 HydrophobicContact CZ-CG1 4.08Å; F276-I351 HydrophobicContact CZ-CG2 4.33Å; F276-Y354 HydrophobicContact CD2-CD2 4.39Å; F276-Y354 AromaticContact CE2-CD2 3.64Å; F276-Y354 HydrophobicContact CE2-CD2 3.64Å; F276-Y354 AromaticContact CE2-CE2 3.99Å; F276-Y354 HydrophobicContact CE2-CE2 3.99Å; F276-Y354 HydrophobicContact CZ-CD2 4.25Å
277	K	98.7	Very high	98.4	Very high	113 Å²	113	32.7 Å²	32.7	49%	0.491	20%	0.197	S	C	.	.	H	α-helix	trans	-58.6	-47.9	174.2	177.1	58.5	174.9	-173.8	0	111.7	Y164 A273 N274 Y275 H279 G280	Y164-K277 HydrophobicContact CD1-CB 4.12Å; Y164-K277 HydrophobicContact CD1-CG 4.34Å; A273-K277 PolarHBondContact O-N 3.5Å; N274-K277 PolarHBondContact O-N 2.84Å; Y275-K277 PolarHBondContact O-N 3.21Å; K277-H279 PolarHBondContact O-N 3.38Å; K277-G280 PolarHBondContact O-N 3.42Å; K277-G280 VanDerWaalsContact O-N 3.12Å
278	A	98.6	Very high	98.4	Very high	61 Å²	61	33 Å²	33	50%	0.504	20%	0.2	S	C	.	.	H	α-helix	trans	-63.5	-26.8	178.7	0	0	0	0	0	112.9	Y250 N274 Y275 G280	Y250-A278 HydrophobicContact CD1-CB 3.78Å; Y250-A278 HydrophobicContact CE1-CB 3.55Å; N274-A278 WeakPolarHBondContact O-CB 3.37Å; N274-A278 PolarHBondContact O-N 2.98Å; Y275-A278 PolarHBondContact O-N 3.18Å; A278-G280 VanDerWaalsContact C-N 3.33Å
279	H	98.5	Very high	98.3	Very high	42 Å²	42	33.2 Å²	33.2	19%	0.194	20%	0.201	C	C	.	.	T	Hydrogen-bonded Turn	trans	-92.6	15.8	177.1	-71.7	89.7	0	0	0	114.2	Y250 Y275 F276 K277 T350 R353	Y250-H279 AromaticContact CE2-CE1 3.77Å; Y250-H279 AromaticContact CZ-CE1 3.52Å; Y250-H279 PolarHBondContact OH-CE1 3.07Å; Y275-H279 AromaticContact CD1-ND1 3.54Å; Y275-H279 AromaticContact CD2-CE1 3.77Å; Y275-H279 AromaticContact CD2-ND1 3.97Å; Y275-H279 AromaticContact CE1-CE1 3.63Å; Y275-H279 AromaticContact CE1-CG 3.93Å; Y275-H279 AromaticContact CE1-ND1 3.38Å; Y275-H279 WeakPolarHBondContact CE1-ND1 3.26Å; Y275-H279 AromaticContact CE2-CE1 3.34Å; Y275-H279 WeakPolarHBondContact CE2-CE1 3.44Å; Y275-H279 AromaticContact CE2-ND1 3.85Å; Y275-H279 AromaticContact CG-ND1 3.8Å; Y275-H279 AromaticContact CZ-CE1 3.24Å; Y275-H279 AromaticContact CZ-ND1 3.53Å; Y275-H279 AromaticContact CZ-NE2 3.8Å; Y275-H279 WeakPolarHBondContact O-CB 3.49Å; Y275-H279 PolarHBondContact O-N 3.48Å; Y275-H279 PolarHBondContact O-ND1 2.92Å; F276-H279 CarbonylContact O-C 3.54Å; F276-H279 PolarHBondContact O-N 3.34Å; K277-H279 PolarHBondContact O-N 3.38Å; H279-T350 HydrophobicContact CB-CG2 3.84Å; H279-T350 WeakPolarHBondContact O-CG2 3.47Å; H279-T350 PolarHBondContact O-OG1 2.91Å; H279-R353 HydrophobicContact CB-CB 4.25Å; H279-R353 HydrophobicContact CB-CG 4.09Å
280	G	98	Very high	98.3	Very high	46 Å²	46	35.9 Å²	35.9	47%	0.474	21%	0.214	S	C	.	.	T	Hydrogen-bonded Turn	trans	85	25.1	169.4	0	0	0	0	0	114.9	F276 K277 A278 V282	F276-G280 PolarHBondContact O-N 2.98Å; K277-G280 PolarHBondContact O-N 3.42Å; K277-G280 VanDerWaalsContact O-N 3.12Å; A278-G280 VanDerWaalsContact C-N 3.33Å; G280-V282 PolarHBondContact O-N 3.42Å
281	W	98.6	Very high	98.3	Very high	14 Å²	14	36.2 Å²	36.2	5%	0.053	22%	0.217	C	C	.	.			trans	-55.6	131.3	172.2	-174.3	-92.3	0	0	0	111.7	G165 V166 P167 I170 F276 V287 N347 T350 I351	G165-W281 PolarHBondContact O-NE1 2.78Å; G165-W281 VanDerWaalsContact O-NE1 3.08Å; V166-W281 HydrophobicContact CG2-CB 4.26Å; V166-W281 HydrophobicContact CG2-CG 3.97Å; P167-W281 VanDerWaalsContact CD-CZ2 3.46Å; P167-W281 HydrophobicContact CG-CZ2 3.94Å; I170-W281 HydrophobicContact CB-CH2 4.33Å; I170-W281 HydrophobicContact CD1-CH2 3.56Å; I170-W281 HydrophobicContact CD1-CZ2 4.31Å; I170-W281 HydrophobicContact CD1-CZ3 4.32Å; I170-W281 HydrophobicContact CG1-CH2 3.43Å; I170-W281 VanDerWaalsContact CG1-CH2 3.43Å; I170-W281 HydrophobicContact CG1-CZ2 3.74Å; I170-W281 HydrophobicContact CG1-CZ3 4.32Å; I170-W281 HydrophobicContact CG2-CH2 4.14Å; I170-W281 HydrophobicContact CG2-CZ3 4.22Å; F276-W281 HydrophobicContact CB-CB 4.2Å; F276-W281 HydrophobicContact CD1-CD2 4.25Å; F276-W281 AromaticContact CD1-CE3 3.53Å; F276-W281 HydrophobicContact CD1-CE3 3.53Å; F276-W281 HydrophobicContact CD1-CZ3 4Å; F276-W281 HydrophobicContact CE1-CE3 4.04Å; F276-W281 HydrophobicContact CE1-CZ3 4.07Å; F276-W281 VanDerWaalsContact O-CB 3.24Å; F276-W281 WeakPolarHBondContact O-CB 2.97Å; F276-W281 PolarHBondContact O-N 2.82Å; W281-V287 HydrophobicContact CH2-CG2 3.73Å; W281-V287 HydrophobicContact CZ3-CG2 4.47Å; W281-N347 HydrophobicContact CD2-CB 4.4Å; W281-N347 HydrophobicContact CE3-CB 3.87Å; W281-N347 HydrophobicContact CH2-CB 3.77Å; W281-N347 HydrophobicContact CZ2-CB 4.28Å; W281-N347 HydrophobicContact CZ3-CB 3.56Å; W281-T350 HydrophobicContact CB-CG2 4.22Å; W281-T350 HydrophobicContact CE3-CG2 4.12Å; W281-I351 HydrophobicContact CZ3-CD1 4.36Å; W281-I351 HydrophobicContact CZ3-CG1 4Å
282	V	97.9	Very high	98.3	Very high	66 Å²	66	39.6 Å²	39.6	40%	0.4	24%	0.235	S	C	.	.			trans	-101.4	112.7	178.8	-174.1	0	0	0	0	109.1	G280 G284 D285 N347	G280-V282 PolarHBondContact O-N 3.42Å; V282-G284 PolarHBondContact O-N 3.22Å; V282-D285 HydrophobicContact CB-CB 3.78Å; V282-D285 HydrophobicContact CG1-CB 3.67Å; V282-D285 PolarHBondContact O-N 2.86Å; V282-N347 PolarHBondContact N-OD1 2.94Å; V282-N347 PolarHBondContact O-ND2 3.09Å
283	K	98	Very high	98.2	Very high	101 Å²	101	41.3 Å²	41.3	44%	0.439	25%	0.253	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.8	128	-179.4	-174	174.1	-173.6	159.7	0	110.9	W161 D285	W161-K283 VanDerWaalsContact CE2-CE 3.48Å; W161-K283 HydrophobicContact CE3-CG 4.45Å; W161-K283 HydrophobicContact CH2-CD 4.44Å; W161-K283 HydrophobicContact CH2-CG 3.63Å; W161-K283 HydrophobicContact CZ2-CD 4.42Å; W161-K283 VanDerWaalsContact CZ2-CE 3.49Å; W161-K283 HydrophobicContact CZ2-CG 4.05Å; W161-K283 HydrophobicContact CZ3-CG 3.83Å; W161-K283 PolarHBondContact O-NZ 2.96Å; K283-D285 PolarHBondContact O-N 2.88Å
284	G	96.2	Very high	98.1	Very high	69 Å²	69	46.1 Å²	46.1	71%	0.711	28%	0.275	S	S	*	.	T	Hydrogen-bonded Turn	trans	75.2	1.7	176.7	0	0	0	0	0	115.4	V282	V282-G284 PolarHBondContact O-N 3.22Å
285	D	96.8	Very high	97.9	Very high	40 Å²	40	44.6 Å²	44.6	21%	0.214	27%	0.267	C	S	.	.			trans	-86.6	152.4	176.9	-166	16.4	0	0	0	111.8	V282 K283 H325 N347	V282-D285 HydrophobicContact CB-CB 3.78Å; V282-D285 HydrophobicContact CG1-CB 3.67Å; V282-D285 PolarHBondContact O-N 2.86Å; K283-D285 PolarHBondContact O-N 2.88Å; D285-H325 VanDerWaalsContact CG-NE2 3.27Å; D285-H325 IonicContact OD1-CD2 2.99Å; D285-H325 IonicContact OD1-CE1 3.31Å; D285-H325 IonicContact OD1-NE2 3.5Å; D285-H325 PolarHBondContact OD1-NE2 2.92Å; D285-H325 IonicContact OD2-CE1 2.81Å; D285-H325 PolarHBondContact OD2-CE1 3.47Å; D285-H325 IonicContact OD2-NE2 3.85Å; D285-H325 PolarHBondContact OD2-NE2 2.7Å; D285-N347 PolarHBondContact O-ND2 3.23Å
286	Q	97	Very high	97.6	Very high	72 Å²	72	48.6 Å²	48.6	34%	0.336	30%	0.295	S	S	.	.			trans	-70.1	149.3	-178.1	-68.8	173.1	-63.8	0	0	111.5	P321 L345	Q286-P321 PolarHBondContact NE2-O 3.05Å; Q286-P321 PolarHBondContact OE1-O 2.7Å; Q286-P321 VanDerWaalsContact OE1-O 3.09Å; Q286-L345 HydrophobicContact CB-CD1 3.52Å
287	V	98.6	Very high	97.3	Very high	9 Å²	9	52.1 Å²	52.1	6%	0.055	33%	0.331	C	S	.	.	S	Bend	trans	-84.8	-63.6	176.6	174.9	0	0	0	0	110.1	I170 W281 L345 N347 F348 I351 W365	I170-V287 HydrophobicContact CD1-CG2 4.13Å; W281-V287 HydrophobicContact CH2-CG2 3.73Å; W281-V287 HydrophobicContact CZ3-CG2 4.47Å; V287-L345 WeakPolarHBondContact O-CB 3.23Å; V287-L345 PolarHBondContact O-N 3.32Å; V287-N347 HydrophobicContact CG2-CB 4.12Å; V287-F348 HydrophobicContact CG1-CB 3.85Å; V287-F348 HydrophobicContact CG1-CD2 3.89Å; V287-F348 HydrophobicContact CG1-CG 4.38Å; V287-F348 WeakPolarHBondContact O-CB 3.43Å; V287-I351 HydrophobicContact CG1-CD1 3.66Å; V287-I351 HydrophobicContact CG2-CD1 4.46Å; V287-W365 HydrophobicContact CB-CD2 3.9Å; V287-W365 HydrophobicContact CB-CG 4.05Å; V287-W365 HydrophobicContact CB-CZ2 4.26Å; V287-W365 HydrophobicContact CG1-CB 4.12Å; V287-W365 HydrophobicContact CG1-CD2 3.72Å; V287-W365 HydrophobicContact CG1-CE3 4.14Å; V287-W365 HydrophobicContact CG1-CG 3.7Å; V287-W365 HydrophobicContact CG2-CG 4.27Å
288	A	98.6	Very high	97.2	Very high	6 Å²	6	48.8 Å²	48.8	5%	0.05	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.5	155.4	177.4	0	0	0	0	0	110.8	L331 W342 Y343 F348 M362 W365	A288-L331 HydrophobicContact CB-CD1 4.32Å; A288-W342 HydrophobicContact CB-CE3 4.17Å; A288-Y343 CarbonylContact C-O 3.32Å; A288-Y343 WeakPolarHBondContact CA-O 3.29Å; A288-Y343 WeakPolarHBondContact CB-O 3.37Å; A288-F348 HydrophobicContact CB-CD2 3.95Å; A288-M362 HydrophobicContact CB-CE 4.27Å; A288-W365 HydrophobicContact CB-CE3 4.31Å; A288-W365 HydrophobicContact CB-CH2 4.29Å; A288-W365 HydrophobicContact CB-CZ3 3.82Å; A288-W365 WeakPolarHBondContact O-CH2 3.39Å
289	V	98.6	Very high	97.2	Very high	5 Å²	5	50 Å²	50	3%	0.03	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	132	178.6	174.9	0	0	0	0	109.4	P318 Q320 L322 W342 Y343 L345	V289-P318 HydrophobicContact CG1-CB 4.08Å; V289-Q320 HydrophobicContact CG1-CB 3.92Å; V289-L322 HydrophobicContact CB-CD2 3.57Å; V289-L322 HydrophobicContact CG1-CD2 3.85Å; V289-L322 HydrophobicContact CG2-CD2 3.76Å; V289-W342 VanDerWaalsContact C-CE3 3.42Å; V289-W342 CarbonylContact O-C 3.41Å; V289-W342 VanDerWaalsContact O-CA 3.31Å; V289-W342 WeakPolarHBondContact O-CA 3.21Å; V289-Y343 PolarHBondContact N-O 2.91Å; V289-Y343 PolarHBondContact O-N 3.47Å; V289-L345 HydrophobicContact CG2-CD1 4.23Å
290	M	98.5	Very high	97.1	Very high	57 Å²	57	50.7 Å²	50.7	28%	0.281	33%	0.327	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68	143.7	179.8	-173.3	166.8	175.5	0	0	110.6	Q319 Q340 W342	M290-Q319 HydrophobicContact CB-CB 4.46Å; M290-Q319 HydrophobicContact CB-CG 4.34Å; M290-Q319 HydrophobicContact CG-CG 4.43Å; M290-Q319 WeakPolarHBondContact O-CB 3.18Å; M290-Q319 PolarHBondContact O-N 2.76Å; M290-Q319 PolarHBondContact SD-OE1 3.34Å; M290-Q319 VanDerWaalsContact SD-OE1 3.37Å; M290-Q340 HydrophobicContact CE-CG 3.7Å; M290-Q340 PolarHBondContact SD-NE2 3.38Å; M290-W342 VanDerWaalsContact CA-CE3 3.44Å; M290-W342 HydrophobicContact CB-CD2 4.01Å; M290-W342 HydrophobicContact CB-CE3 3.79Å; M290-W342 HydrophobicContact CB-CH2 3.93Å; M290-W342 HydrophobicContact CB-CZ2 4.2Å; M290-W342 HydrophobicContact CB-CZ3 3.72Å; M290-W342 HydrophobicContact CG-CD2 4.37Å; M290-W342 HydrophobicContact CG-CH2 4.45Å; M290-W342 HydrophobicContact CG-CZ2 4.27Å; M290-W342 HydrophobicContact SD-CH2 4.4Å; M290-W342 HydrophobicContact SD-CZ2 4.18Å
291	A	98.6	Very high	97	Very high	7 Å²	7	49.2 Å²	49.2	6%	0.058	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.1	144.4	175.7	0	0	0	0	0	111.3	L316 T317 Y341 Y343	A291-L316 HydrophobicContact CB-CB 4.47Å; A291-L316 HydrophobicContact CB-CD2 4.22Å; A291-T317 CarbonylContact C-O 2.98Å; A291-T317 WeakPolarHBondContact CA-O 3.31Å; A291-Y341 WeakPolarHBondContact CB-O 3.49Å; A291-Y341 PolarHBondContact N-O 2.95Å; A291-Y343 HydrophobicContact CB-CD2 3.92Å; A291-Y343 HydrophobicContact CB-CE2 3.4Å
292	N	98.4	Very high	97	Very high	72 Å²	72	49.6 Å²	49.6	39%	0.385	31%	0.313	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.8	155.3	156	-58.4	-49.5	0	0	0	109.2	L316 T317 Q319	N292-L316 WeakPolarHBondContact O-CA 3.27Å; N292-L316 WeakPolarHBondContact O-CD2 3.32Å; N292-T317 PolarHBondContact N-O 3.05Å; N292-T317 PolarHBondContact O-N 3.43Å; N292-T317 VanDerWaalsContact O-N 3.17Å; N292-Q319 WeakPolarHBondContact OD1-CG 3.35Å; N292-Q319 PolarHBondContact OD1-NE2 2.88Å
293	G	97.6	Very high	97	Very high	37 Å²	37	54 Å²	54	38%	0.381	33%	0.327	S	S	.	.	S	Bend	trans	88.3	-171.3	179.5	0	0	0	0	0	113.7
294	Q	96.4	Very high	97	Very high	101 Å²	101	50.3 Å²	50.3	47%	0.472	31%	0.313	S	S	.	.			trans	-142.7	140.2	-176.1	-62.8	-69.8	-59.9	0	0	109.7	Y339 Y341	Q294-Y339 PolarHBondContact NE2-O 3.49Å; Q294-Y339 PolarHBondContact OE1-O 3.1Å; Q294-Y341 HydrophobicContact CB-CE2 4.32Å
295	A	95.7	Very high	97.1	Very high	3 Å²	3	54.1 Å²	54.1	3%	0.025	31%	0.31	C	S	.	.			trans	-132.4	68.1	175.5	0	0	0	0	0	110.9	G297 L298 A314 L316 L330 Y341	A295-G297 VanDerWaalsContact C-N 3.27Å; A295-G297 PolarHBondContact O-N 3.02Å; A295-L298 HydrophobicContact CB-CB 4.41Å; A295-L298 HydrophobicContact CB-CD1 4.11Å; A295-L298 HydrophobicContact CB-CG 4.31Å; A295-L298 PolarHBondContact O-N 3.41Å; A295-A314 HydrophobicContact CB-CB 4.13Å; A295-L316 HydrophobicContact CB-CD1 3.79Å; A295-L316 HydrophobicContact CB-CD2 4.26Å; A295-L316 HydrophobicContact CB-CG 3.99Å; A295-L330 HydrophobicContact CB-CD2 4.3Å; A295-Y341 HydrophobicContact CB-CE1 4.24Å; A295-Y341 PolarHBondContact O-OH 3.38Å
296	P	92.4	Very high	97.2	Very high	100 Å²	100	54 Å²	54	65%	0.649	31%	0.307	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.1	-28.1	-174.2	26.4	-34.5	0	0	0	113.5	Y341	P296-Y341 WeakPolarHBondContact CA-OH 3.21Å
297	G	92.7	Very high	97.2	Very high	73 Å²	73	51.8 Å²	51.8	75%	0.753	30%	0.3	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.3	-9.5	-178.3	0	0	0	0	0	115.2	A295	A295-G297 VanDerWaalsContact C-N 3.27Å; A295-G297 PolarHBondContact O-N 3.02Å
298	L	96.2	Very high	97.2	Very high	44 Å²	44	53.1 Å²	53.1	23%	0.23	31%	0.306	C	S	.	.	S	Bend	trans	-89.9	134.4	179.3	-69.2	-174.3	0	0	0	111.5	A295 N300 Y306 L311 A314 L330	A295-L298 HydrophobicContact CB-CB 4.41Å; A295-L298 HydrophobicContact CB-CD1 4.11Å; A295-L298 HydrophobicContact CB-CG 4.31Å; A295-L298 PolarHBondContact O-N 3.41Å; L298-N300 PolarHBondContact O-N 3.31Å; L298-Y306 HydrophobicContact CD2-CE1 4.36Å; L298-L311 HydrophobicContact CD1-CD2 3.93Å; L298-A314 HydrophobicContact CD1-CB 3.58Å; L298-A314 HydrophobicContact CG-CB 4.22Å; L298-L330 HydrophobicContact CB-CD2 3.54Å; L298-L330 HydrophobicContact CD1-CD2 3.97Å; L298-L330 HydrophobicContact CG-CD2 4.41Å
299	P	97.1	Very high	97.2	Very high	86 Å²	86	57 Å²	57	56%	0.558	33%	0.333	S	S	*	.			trans	-50.4	140.6	161.3	-25.6	33.3	0	0	0	110.8	Y306	P299-Y306 WeakPolarHBondContact CD-OH 3.27Å; P299-Y306 WeakPolarHBondContact O-CE2 3.44Å; P299-Y306 PolarHBondContact O-OH 2.84Å
300	N	96.7	Very high	97.2	Very high	57 Å²	57	61.6 Å²	61.6	31%	0.305	35%	0.354	S	S	.	.			trans	-130.7	164.1	-178	63	94.9	0	0	0	109.9	L298 L330 R332	L298-N300 PolarHBondContact O-N 3.31Å; N300-L330 CarbonylContact C-O 3.4Å; N300-L330 WeakPolarHBondContact CA-O 3.42Å; N300-L330 HydrophobicContact CB-CD2 4.44Å; N300-L330 HydrophobicContact CB-CG 4.26Å; N300-L330 WeakPolarHBondContact CB-O 3.5Å; N300-R332 HydrophobicContact CB-CB 3.91Å; N300-R332 PolarHBondContact ND2-NE 3.45Å; N300-R332 PolarHBondContact ND2-NH2 3.46Å
301	G	97.4	Very high	97.2	Very high	15 Å²	15	58.9 Å²	58.9	16%	0.155	34%	0.341	C	S	.	.	S	Bend	trans	128.7	158.6	-178.5	0	0	0	0	0	111.1	K303 T304 L330	G301-K303 PolarHBondContact O-N 3.26Å; G301-T304 WeakPolarHBondContact O-CB 3.14Å; G301-T304 WeakPolarHBondContact O-CG2 3.33Å; G301-T304 PolarHBondContact O-N 3.31Å; G301-T304 PolarHBondContact O-OG1 3.01Å; G301-L330 PolarHBondContact N-O 3.26Å
302	F	97.5	Very high	97.1	Very high	21 Å²	21	61.1 Å²	61.1	9%	0.092	36%	0.359	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61.1	-16.2	-177.1	65.6	-91.7	0	0	0	114.4	S329 L331 F348 Y349 T352 H356	F302-S329 PolarHBondContact O-OG 2.91Å; F302-L331 HydrophobicContact CB-CD2 4.32Å; F302-F348 HydrophobicContact CB-CD1 4.44Å; F302-F348 HydrophobicContact CB-CE1 4.12Å; F302-Y349 HydrophobicContact CD2-CD2 4.1Å; F302-Y349 AromaticContact CD2-CE2 3.94Å; F302-Y349 HydrophobicContact CD2-CE2 3.94Å; F302-Y349 VanDerWaalsContact O-CD2 3.23Å; F302-Y349 WeakPolarHBondContact O-CD2 3.38Å; F302-T352 HydrophobicContact CB-CG2 3.77Å; F302-T352 HydrophobicContact CD1-CG2 4.16Å; F302-T352 HydrophobicContact CD2-CG2 4.01Å; F302-T352 WeakPolarHBondContact CD2-OG1 3.35Å; F302-T352 HydrophobicContact CG-CG2 3.72Å; F302-H356 VanDerWaalsContact CE1-O 3.31Å; F302-H356 WeakPolarHBondContact CE1-O 3.28Å; F302-H356 HydrophobicContact CZ-CB 3.88Å
303	K	97.6	Very high	97.1	Very high	159 Å²	159	62 Å²	62	69%	0.691	38%	0.376	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.5	-11.5	176.2	-63.4	-174.2	178.2	-179.5	0	113.9	G301	G301-K303 PolarHBondContact O-N 3.26Å
304	T	98.4	Very high	97.1	Very high	24 Å²	24	61.9 Å²	61.9	15%	0.147	37%	0.372	C	S	.	.			trans	-71.1	152.8	179.2	60.1	0	0	0	0	110.7	G301 Y306 S329 L330	G301-T304 WeakPolarHBondContact O-CB 3.14Å; G301-T304 WeakPolarHBondContact O-CG2 3.33Å; G301-T304 PolarHBondContact O-N 3.31Å; G301-T304 PolarHBondContact O-OG1 3.01Å; T304-Y306 HydrophobicContact CG2-CE2 3.94Å; T304-S329 VanDerWaalsContact O-CA 3.27Å; T304-S329 WeakPolarHBondContact O-CA 3.47Å; T304-S329 WeakPolarHBondContact O-CB 3.23Å; T304-S329 PolarHBondContact O-OG 3.23Å; T304-S329 WeakPolarHBondContact OG1-CA 3.5Å; T304-L330 PolarHBondContact OG1-N 3.18Å
305	K	97.9	Very high	97.2	Very high	149 Å²	149	59.3 Å²	59.3	65%	0.648	37%	0.372	S	S	*	.			trans	-145.4	85.3	-179.5	-172.3	170.3	177.5	175.4	0	109.2	Q327	K305-Q327 VanDerWaalsContact CE-CD 3.5Å; K305-Q327 HydrophobicContact CG-CB 4.27Å
306	Y	98.6	Very high	97.3	Very high	37 Å²	37	59.2 Å²	59.2	15%	0.145	37%	0.371	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.3	148.2	178.9	-66.1	-74	0	0	0	110.5	L298 P299 T304 Q310 L311 Q327 A328 L330	L298-Y306 HydrophobicContact CD2-CE1 4.36Å; P299-Y306 WeakPolarHBondContact CD-OH 3.27Å; P299-Y306 WeakPolarHBondContact O-CE2 3.44Å; P299-Y306 PolarHBondContact O-OH 2.84Å; T304-Y306 HydrophobicContact CG2-CE2 3.94Å; Y306-Q310 HydrophobicContact CD1-CB 4.47Å; Y306-L311 HydrophobicContact CD2-CD2 3.83Å; Y306-L311 HydrophobicContact CG-CD2 3.81Å; Y306-L311 HydrophobicContact CG-CG 4.33Å; Y306-Q327 CarbonylContact O-C 3.55Å; Y306-Q327 WeakPolarHBondContact O-CA 3.38Å; Y306-Q327 WeakPolarHBondContact O-CB 3.45Å; Y306-A328 PolarHBondContact N-O 3.07Å; Y306-A328 PolarHBondContact O-N 2.98Å; Y306-L330 HydrophobicContact CD2-CB 3.81Å; Y306-L330 HydrophobicContact CE2-CB 3.79Å; Y306-L330 HydrophobicContact CE2-CD2 4.4Å
307	S	98.5	Very high	97.6	Very high	26 Å²	26	58.1 Å²	58.1	18%	0.182	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.7	152.4	162.5	70.7	0	0	0	0	110.2	S309 Q310 L311 Q326	S307-S309 PolarHBondContact O-N 3.06Å; S307-S309 PolarHBondContact OG-OG 3.1Å; S307-Q310 WeakPolarHBondContact O-CB 3.43Å; S307-Q310 PolarHBondContact O-N 3.04Å; S307-Q310 VanDerWaalsContact O-N 3.12Å; S307-Q310 WeakPolarHBondContact OG-CB 3.32Å; S307-Q310 WeakPolarHBondContact OG-CG 3.35Å; S307-Q310 PolarHBondContact OG-N 3.35Å; S307-Q310 PolarHBondContact OG-OE1 2.97Å; S307-L311 PolarHBondContact O-N 3.26Å; S307-Q326 WeakPolarHBondContact CA-O 3.29Å
308	I	98.2	Very high	97.9	Very high	37 Å²	37	56.8 Å²	56.8	19%	0.19	34%	0.341	C	S	.	.	H	α-helix	trans	-60.2	-33.9	175.2	-56.2	-45.4	0	0	0	110.9	L311 A312 L322 H325 Q326 A328 Y343	I308-L311 PolarHBondContact O-N 3.03Å; I308-A312 WeakPolarHBondContact O-CB 3.31Å; I308-A312 PolarHBondContact O-N 2.93Å; I308-L322 HydrophobicContact CD1-CD1 3.48Å; I308-L322 VanDerWaalsContact CD1-CD1 3.48Å; I308-L322 HydrophobicContact CG1-CD1 3.94Å; I308-L322 HydrophobicContact CG2-CD1 4.15Å; I308-H325 WeakPolarHBondContact CG1-O 3.41Å; I308-Q326 PolarHBondContact N-O 2.87Å; I308-A328 HydrophobicContact CD1-CB 3.99Å; I308-Y343 HydrophobicContact CD1-CD1 4.13Å; I308-Y343 HydrophobicContact CD1-CE1 4.33Å
309	S	98	Very high	98	Very high	87 Å²	87	58.5 Å²	58.5	61%	0.608	35%	0.348	S	S	*	.	H	α-helix	trans	-64.1	-38.2	174.8	57.8	0	0	0	0	113.6	S307 A312 A313	S307-S309 PolarHBondContact O-N 3.06Å; S307-S309 PolarHBondContact OG-OG 3.1Å; S309-A312 PolarHBondContact O-N 3.18Å; S309-A313 WeakPolarHBondContact O-CB 3.12Å; S309-A313 PolarHBondContact O-N 2.9Å
310	Q	98.3	Very high	98	Very high	102 Å²	102	60.2 Å²	60.2	48%	0.477	35%	0.348	S	S	.	.	H	α-helix	trans	-64.6	-41.9	175.1	-77.9	168.5	-24.5	0	0	111.2	Y306 S307 A313 A314	Y306-Q310 HydrophobicContact CD1-CB 4.47Å; S307-Q310 WeakPolarHBondContact O-CB 3.43Å; S307-Q310 PolarHBondContact O-N 3.04Å; S307-Q310 VanDerWaalsContact O-N 3.12Å; S307-Q310 WeakPolarHBondContact OG-CB 3.32Å; S307-Q310 WeakPolarHBondContact OG-CG 3.35Å; S307-Q310 PolarHBondContact OG-N 3.35Å; S307-Q310 PolarHBondContact OG-OE1 2.97Å; Q310-A313 PolarHBondContact O-N 2.62Å; Q310-A314 PolarHBondContact O-N 2.7Å; Q310-A314 VanDerWaalsContact O-N 3.09Å
311	L	98.6	Very high	98.1	Very high	0 Å²	0	62.2 Å²	62.2	0%	0	36%	0.364	C	S	.	.	H	α-helix	trans	-67.8	-38.8	176.8	-63.3	178.8	0	0	0	111.7	L298 Y306 S307 I308 A314 G315 L316 A328 L330 Y343	L298-L311 HydrophobicContact CD1-CD2 3.93Å; Y306-L311 HydrophobicContact CD2-CD2 3.83Å; Y306-L311 HydrophobicContact CG-CD2 3.81Å; Y306-L311 HydrophobicContact CG-CG 4.33Å; S307-L311 PolarHBondContact O-N 3.26Å; I308-L311 PolarHBondContact O-N 3.03Å; L311-A314 PolarHBondContact O-N 2.94Å; L311-G315 PolarHBondContact O-N 2.75Å; L311-L316 HydrophobicContact CB-CB 4.43Å; L311-L316 HydrophobicContact CB-CD1 4.43Å; L311-L316 HydrophobicContact CD2-CD1 4.25Å; L311-L316 WeakPolarHBondContact O-CB 3.47Å; L311-L316 PolarHBondContact O-N 3.25Å; L311-A328 HydrophobicContact CD1-CB 4.39Å; L311-L330 HydrophobicContact CD2-CB 4.24Å; L311-L330 HydrophobicContact CD2-CD1 4.15Å; L311-L330 HydrophobicContact CD2-CD2 4.34Å; L311-L330 HydrophobicContact CD2-CG 4.49Å; L311-Y343 HydrophobicContact CB-CE1 3.94Å; L311-Y343 HydrophobicContact CD1-CD1 3.53Å; L311-Y343 HydrophobicContact CD1-CE1 3.39Å; L311-Y343 HydrophobicContact CG-CE1 4.3Å
312	A	98.2	Very high	98.1	Very high	53 Å²	53	62.1 Å²	62.1	44%	0.438	36%	0.36	S	S	.	.	H	α-helix	trans	-62.2	-44.5	173.4	0	0	0	0	0	112.4	I308 S309 A314 G315 L316	I308-A312 WeakPolarHBondContact O-CB 3.31Å; I308-A312 PolarHBondContact O-N 2.93Å; S309-A312 PolarHBondContact O-N 3.18Å; A312-A314 PolarHBondContact O-N 3.36Å; A312-G315 PolarHBondContact O-N 2.96Å; A312-L316 VanDerWaalsContact CA-O 3.31Å; A312-L316 WeakPolarHBondContact CA-O 3.28Å
313	A	98	Very high	97.9	Very high	91 Å²	91	63.9 Å²	63.9	75%	0.752	38%	0.384	S	S	*	.	H	α-helix	trans	-63.6	-27.4	175.5	0	0	0	0	0	112.9	S309 Q310 G315	S309-A313 WeakPolarHBondContact O-CB 3.12Å; S309-A313 PolarHBondContact O-N 2.9Å; Q310-A313 PolarHBondContact O-N 2.62Å; A313-G315 PolarHBondContact O-N 2.92Å
314	A	97.7	Very high	97.8	Very high	35 Å²	35	63.8 Å²	63.8	29%	0.289	39%	0.391	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80	0.2	172.3	0	0	0	0	0	113.8	A295 L298 Q310 L311 A312	A295-A314 HydrophobicContact CB-CB 4.13Å; L298-A314 HydrophobicContact CD1-CB 3.58Å; L298-A314 HydrophobicContact CG-CB 4.22Å; Q310-A314 PolarHBondContact O-N 2.7Å; Q310-A314 VanDerWaalsContact O-N 3.09Å; L311-A314 PolarHBondContact O-N 2.94Å; A312-A314 PolarHBondContact O-N 3.36Å
315	G	97.9	Very high	97.8	Very high	46 Å²	46	64.7 Å²	64.7	47%	0.474	39%	0.394	S	S	.	.	T	Hydrogen-bonded Turn	trans	94.2	15.7	176.8	0	0	0	0	0	115.1	L311 A312 A313	L311-G315 PolarHBondContact O-N 2.75Å; A312-G315 PolarHBondContact O-N 2.96Å; A313-G315 PolarHBondContact O-N 2.92Å
316	L	98.6	Very high	97.7	Very high	2 Å²	2	64.5 Å²	64.5	1%	0.01	40%	0.395	C	S	.	.			trans	-100	137	178.3	-59.2	177.8	0	0	0	112.6	A291 N292 A295 L311 A312 L330 Y341 Y343	A291-L316 HydrophobicContact CB-CB 4.47Å; A291-L316 HydrophobicContact CB-CD2 4.22Å; N292-L316 WeakPolarHBondContact O-CA 3.27Å; N292-L316 WeakPolarHBondContact O-CD2 3.32Å; A295-L316 HydrophobicContact CB-CD1 3.79Å; A295-L316 HydrophobicContact CB-CD2 4.26Å; A295-L316 HydrophobicContact CB-CG 3.99Å; L311-L316 HydrophobicContact CB-CB 4.43Å; L311-L316 HydrophobicContact CB-CD1 4.43Å; L311-L316 HydrophobicContact CD2-CD1 4.25Å; L311-L316 WeakPolarHBondContact O-CB 3.47Å; L311-L316 PolarHBondContact O-N 3.25Å; A312-L316 VanDerWaalsContact CA-O 3.31Å; A312-L316 WeakPolarHBondContact CA-O 3.28Å; L316-L330 HydrophobicContact CD1-CD1 3.49Å; L316-L330 VanDerWaalsContact CD1-CD1 3.49Å; L316-Y341 HydrophobicContact CD2-CG 4.32Å; L316-Y343 VanDerWaalsContact CB-OH 3.3Å; L316-Y343 WeakPolarHBondContact CB-OH 3.32Å; L316-Y343 PolarHBondContact O-OH 3.08Å; L316-Y343 VanDerWaalsContact O-OH 3.13Å
317	T	98.5	Very high	97.7	Very high	76 Å²	76	67.1 Å²	67.1	47%	0.466	41%	0.409	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	140.8	168.3	59.3	0	0	0	0	110.8	A291 N292 Y343	A291-T317 CarbonylContact C-O 2.98Å; A291-T317 WeakPolarHBondContact CA-O 3.31Å; N292-T317 PolarHBondContact N-O 3.05Å; N292-T317 PolarHBondContact O-N 3.43Å; N292-T317 VanDerWaalsContact O-N 3.17Å; T317-Y343 WeakPolarHBondContact CA-OH 3.29Å; T317-Y343 PolarHBondContact N-OH 2.69Å
318	P	98.4	Very high	97.7	Very high	45 Å²	45	66 Å²	66	29%	0.292	40%	0.402	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75	138	-180	34	-36.8	0	0	0	110.5	V289 Q320 L322 Y343	V289-P318 HydrophobicContact CG1-CB 4.08Å; P318-Q320 WeakPolarHBondContact CB-O 3.42Å; P318-Q320 PolarHBondContact O-N 3.38Å; P318-L322 HydrophobicContact CB-CD1 4.04Å; P318-L322 HydrophobicContact CB-CD2 3.82Å; P318-L322 HydrophobicContact CB-CG 3.79Å; P318-L322 HydrophobicContact CG-CD1 4.08Å; P318-L322 HydrophobicContact CG-CG 4.01Å; P318-Y343 HydrophobicContact CB-CD2 3.98Å; P318-Y343 HydrophobicContact CB-CE2 3.66Å
319	Q	98.4	Very high	97.7	Very high	81 Å²	81	64.9 Å²	64.9	38%	0.379	40%	0.397	S	S	.	.	S	Bend	trans	-72.5	-19.3	177.1	-73.1	-172	-8	0	0	113.1	M290 N292	M290-Q319 HydrophobicContact CB-CB 4.46Å; M290-Q319 HydrophobicContact CB-CG 4.34Å; M290-Q319 HydrophobicContact CG-CG 4.43Å; M290-Q319 WeakPolarHBondContact O-CB 3.18Å; M290-Q319 PolarHBondContact O-N 2.76Å; M290-Q319 PolarHBondContact SD-OE1 3.34Å; M290-Q319 VanDerWaalsContact SD-OE1 3.37Å; N292-Q319 WeakPolarHBondContact OD1-CG 3.35Å; N292-Q319 PolarHBondContact OD1-NE2 2.88Å
320	Q	97.7	Very high	97.8	Very high	122 Å²	122	60.8 Å²	60.8	57%	0.57	37%	0.368	S	S	*	.	S	Bend	trans	-135	155.8	176.3	-62.8	-59.3	-32.3	0	0	109.3	V289 P318 L322	V289-Q320 HydrophobicContact CG1-CB 3.92Å; P318-Q320 WeakPolarHBondContact CB-O 3.42Å; P318-Q320 PolarHBondContact O-N 3.38Å; Q320-L322 PolarHBondContact O-N 2.84Å
321	P	97.6	Very high	97.8	Very high	98 Å²	98	56 Å²	56	64%	0.636	35%	0.345	S	S	*	.			trans	-53.8	139	173.4	-25.2	34.8	0	0	0	111.5	Q286 G323	Q286-P321 PolarHBondContact NE2-O 3.05Å; Q286-P321 PolarHBondContact OE1-O 2.7Å; Q286-P321 VanDerWaalsContact OE1-O 3.09Å; P321-G323 VanDerWaalsContact C-N 3.27Å; P321-G323 PolarHBondContact O-N 3Å
322	L	97.5	Very high	97.7	Very high	13 Å²	13	59.5 Å²	59.5	7%	0.068	36%	0.359	C	S	.	.			trans	-90.4	16.2	177.4	-58.7	177.7	0	0	0	112.3	V289 I308 P318 Q320 N324 H325 Y343	V289-L322 HydrophobicContact CB-CD2 3.57Å; V289-L322 HydrophobicContact CG1-CD2 3.85Å; V289-L322 HydrophobicContact CG2-CD2 3.76Å; I308-L322 HydrophobicContact CD1-CD1 3.48Å; I308-L322 VanDerWaalsContact CD1-CD1 3.48Å; I308-L322 HydrophobicContact CG1-CD1 3.94Å; I308-L322 HydrophobicContact CG2-CD1 4.15Å; P318-L322 HydrophobicContact CB-CD1 4.04Å; P318-L322 HydrophobicContact CB-CD2 3.82Å; P318-L322 HydrophobicContact CB-CG 3.79Å; P318-L322 HydrophobicContact CG-CD1 4.08Å; P318-L322 HydrophobicContact CG-CG 4.01Å; Q320-L322 PolarHBondContact O-N 2.84Å; L322-N324 PolarHBondContact O-N 3.43Å; L322-H325 WeakPolarHBondContact O-CB 3.34Å; L322-H325 PolarHBondContact O-CD2 2.74Å; L322-H325 PolarHBondContact O-N 3.02Å; L322-Y343 HydrophobicContact CD1-CD1 3.82Å; L322-Y343 HydrophobicContact CD1-CE1 4.12Å; L322-Y343 HydrophobicContact CD1-CG 4.17Å; L322-Y343 HydrophobicContact CD2-CD2 4.39Å; L322-Y343 HydrophobicContact CD2-CG 4.05Å
323	G	94.5	Very high	97.7	Very high	59 Å²	59	57 Å²	57	61%	0.608	34%	0.338	S	S	*	.	T	Hydrogen-bonded Turn	trans	56	-137.7	-170.1	0	0	0	0	0	112.5	P321 H325	P321-G323 VanDerWaalsContact C-N 3.27Å; P321-G323 PolarHBondContact O-N 3Å; G323-H325 VanDerWaalsContact C-N 3.3Å
324	N	94.6	Very high	97.6	Very high	157 Å²	157	53.3 Å²	53.3	84%	0.84	31%	0.306	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.5	3.5	179.4	-67	-27.3	0	0	0	113.5	L322 Q326	L322-N324 PolarHBondContact O-N 3.43Å; N324-Q326 PolarHBondContact O-N 3.45Å; N324-Q326 PolarHBondContact O-NE2 2.99Å
325	H	97.5	Very high	97.6	Very high	43 Å²	43	53.2 Å²	53.2	20%	0.199	30%	0.302	C	S	.	.			trans	-66.8	119.2	-174.4	-67.6	-66	0	0	0	111.5	D285 I308 L322 G323 L345	D285-H325 VanDerWaalsContact CG-NE2 3.27Å; D285-H325 IonicContact OD1-CD2 2.99Å; D285-H325 IonicContact OD1-CE1 3.31Å; D285-H325 IonicContact OD1-NE2 3.5Å; D285-H325 PolarHBondContact OD1-NE2 2.92Å; D285-H325 IonicContact OD2-CE1 2.81Å; D285-H325 PolarHBondContact OD2-CE1 3.47Å; D285-H325 IonicContact OD2-NE2 3.85Å; D285-H325 PolarHBondContact OD2-NE2 2.7Å; I308-H325 WeakPolarHBondContact CG1-O 3.41Å; L322-H325 WeakPolarHBondContact O-CB 3.34Å; L322-H325 PolarHBondContact O-CD2 2.74Å; L322-H325 PolarHBondContact O-N 3.02Å; G323-H325 VanDerWaalsContact C-N 3.3Å; H325-L345 HydrophobicContact CB-CD2 4.05Å
326	Q	96.9	Very high	97.4	Very high	145 Å²	145	52.4 Å²	52.4	68%	0.678	29%	0.293	S	S	*	.			trans	-90.7	-12	177.5	-59.1	-53.6	-51.1	0	0	113	S307 I308 N324	S307-Q326 WeakPolarHBondContact CA-O 3.29Å; I308-Q326 PolarHBondContact N-O 2.87Å; N324-Q326 PolarHBondContact O-N 3.45Å; N324-Q326 PolarHBondContact O-NE2 2.99Å
327	Q	98.2	Very high	97.2	Very high	91 Å²	91	59.2 Å²	59.2	43%	0.425	34%	0.335	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.6	150.3	-177.9	-62.7	-179.2	-60.9	0	0	111.1	K305 Y306	K305-Q327 VanDerWaalsContact CE-CD 3.5Å; K305-Q327 HydrophobicContact CG-CB 4.27Å; Y306-Q327 CarbonylContact O-C 3.55Å; Y306-Q327 WeakPolarHBondContact O-CA 3.38Å; Y306-Q327 WeakPolarHBondContact O-CB 3.45Å
328	A	98.6	Very high	97.1	Very high	4 Å²	4	56.5 Å²	56.5	3%	0.033	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.6	156.8	175.8	0	0	0	0	0	111	Y306 I308 L311 Y343 G344 L345	Y306-A328 PolarHBondContact N-O 3.07Å; Y306-A328 PolarHBondContact O-N 2.98Å; I308-A328 HydrophobicContact CD1-CB 3.99Å; L311-A328 HydrophobicContact CD1-CB 4.39Å; A328-Y343 HydrophobicContact CB-CD1 3.97Å; A328-Y343 HydrophobicContact CB-CG 4.49Å; A328-G344 WeakPolarHBondContact CA-O 3.24Å; A328-L345 HydrophobicContact CB-CD2 4.28Å
329	S	98.7	Very high	97	Very high	13 Å²	13	57.2 Å²	57.2	9%	0.091	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.6	139.2	162.4	-57.8	0	0	0	0	110.2	F302 T304 L331 G344	F302-S329 PolarHBondContact O-OG 2.91Å; T304-S329 VanDerWaalsContact O-CA 3.27Å; T304-S329 WeakPolarHBondContact O-CA 3.47Å; T304-S329 WeakPolarHBondContact O-CB 3.23Å; T304-S329 PolarHBondContact O-OG 3.23Å; T304-S329 WeakPolarHBondContact OG1-CA 3.5Å; S329-L331 PolarHBondContact O-N 2.85Å; S329-G344 PolarHBondContact N-O 3.11Å; S329-G344 PolarHBondContact O-N 2.82Å
330	L	98.7	Very high	97	Very high	1 Å²	1	55.3 Å²	55.3	1%	0.005	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.5	109.2	169.2	-177.5	60	0	0	0	109.3	A295 L298 N300 G301 T304 Y306 L311 L316 Y341	A295-L330 HydrophobicContact CB-CD2 4.3Å; L298-L330 HydrophobicContact CB-CD2 3.54Å; L298-L330 HydrophobicContact CD1-CD2 3.97Å; L298-L330 HydrophobicContact CG-CD2 4.41Å; N300-L330 CarbonylContact C-O 3.4Å; N300-L330 WeakPolarHBondContact CA-O 3.42Å; N300-L330 HydrophobicContact CB-CD2 4.44Å; N300-L330 HydrophobicContact CB-CG 4.26Å; N300-L330 WeakPolarHBondContact CB-O 3.5Å; G301-L330 PolarHBondContact N-O 3.26Å; T304-L330 PolarHBondContact OG1-N 3.18Å; Y306-L330 HydrophobicContact CD2-CB 3.81Å; Y306-L330 HydrophobicContact CE2-CB 3.79Å; Y306-L330 HydrophobicContact CE2-CD2 4.4Å; L311-L330 HydrophobicContact CD2-CB 4.24Å; L311-L330 HydrophobicContact CD2-CD1 4.15Å; L311-L330 HydrophobicContact CD2-CD2 4.34Å; L311-L330 HydrophobicContact CD2-CG 4.49Å; L316-L330 HydrophobicContact CD1-CD1 3.49Å; L316-L330 VanDerWaalsContact CD1-CD1 3.49Å; L330-Y341 HydrophobicContact CD1-CD1 3.58Å; L330-Y341 HydrophobicContact CD1-CE1 4.28Å; L330-Y341 HydrophobicContact CD1-CG 4.46Å; L330-Y341 HydrophobicContact CD2-CD1 4.36Å; L330-Y341 HydrophobicContact CD2-CE1 4.25Å; L330-Y341 HydrophobicContact CG-CD1 4.08Å; L330-Y341 HydrophobicContact CG-CE1 4.37Å
331	L	98.6	Very high	97	Very high	0 Å²	0	49.6 Å²	49.6	0%	0	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.1	141.9	175.1	-47	173.9	0	0	0	109.2	A288 F302 S329 Y341 W342 F348 T358 M362	A288-L331 HydrophobicContact CB-CD1 4.32Å; F302-L331 HydrophobicContact CB-CD2 4.32Å; S329-L331 PolarHBondContact O-N 2.85Å; L331-Y341 WeakPolarHBondContact O-CA 3.17Å; L331-W342 HydrophobicContact CB-CB 4.05Å; L331-W342 HydrophobicContact CD1-CB 4.11Å; L331-W342 HydrophobicContact CG-CB 4.5Å; L331-W342 PolarHBondContact N-O 3.03Å; L331-W342 PolarHBondContact O-N 3.1Å; L331-F348 HydrophobicContact CD1-CD1 3.74Å; L331-F348 HydrophobicContact CD1-CD2 3.86Å; L331-F348 HydrophobicContact CD1-CE1 3.51Å; L331-F348 HydrophobicContact CD1-CE2 3.64Å; L331-F348 HydrophobicContact CD1-CG 3.93Å; L331-F348 HydrophobicContact CD1-CZ 3.46Å; L331-F348 VanDerWaalsContact CD1-CZ 3.46Å; L331-F348 HydrophobicContact CD2-CD1 3.93Å; L331-F348 HydrophobicContact CD2-CE1 3.44Å; L331-F348 VanDerWaalsContact CD2-CE1 3.44Å; L331-F348 HydrophobicContact CD2-CZ 4.04Å; L331-F348 HydrophobicContact CG-CD1 4.46Å; L331-F348 HydrophobicContact CG-CE1 4.12Å; L331-F348 HydrophobicContact CG-CZ 4.36Å; L331-T358 HydrophobicContact CB-CG2 4.19Å; L331-T358 HydrophobicContact CD2-CG2 4.07Å; L331-M362 HydrophobicContact CD1-CE 4.2Å
332	R	97.6	Very high	97.1	Very high	74 Å²	74	46.1 Å²	46.1	28%	0.279	26%	0.258	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.8	122.9	178.5	-169.7	176.9	66.1	-179.2	0.6	109.7	N300 Y339 Q340 Y341	N300-R332 HydrophobicContact CB-CB 3.91Å; N300-R332 PolarHBondContact ND2-NE 3.45Å; N300-R332 PolarHBondContact ND2-NH2 3.46Å; R332-Y339 HydrophobicContact CG-CD1 3.73Å; R332-Y339 HydrophobicContact CG-CG 3.83Å; R332-Q340 WeakPolarHBondContact CA-O 3.45Å; R332-Y341 HydrophobicContact CB-CD1 4.22Å; R332-Y341 HydrophobicContact CB-CE1 4.04Å; R332-Y341 WeakPolarHBondContact CD-OH 3.38Å; R332-Y341 HydrophobicContact CG-CD1 4.21Å; R332-Y341 HydrophobicContact CG-CE1 3.78Å; R332-Y341 HydrophobicContact CG-CE2 4.41Å
333	L	98	Very high	97.1	Very high	0 Å²	0	45.6 Å²	45.6	0%	0	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	128.6	-179.6	-57.7	-180	0	0	0	110	W130 V335 Y339 Q340 T358 M362	W130-L333 HydrophobicContact CB-CB 3.99Å; W130-L333 HydrophobicContact CD2-CB 4.5Å; W130-L333 HydrophobicContact CD2-CD1 4.16Å; W130-L333 HydrophobicContact CD2-CD2 4.16Å; W130-L333 HydrophobicContact CE3-CD2 4.41Å; W130-L333 HydrophobicContact CG-CB 3.79Å; W130-L333 HydrophobicContact CG-CD1 4.2Å; W130-L333 HydrophobicContact CG-CD2 4.23Å; W130-L333 HydrophobicContact CG-CG 4.3Å; W130-L333 HydrophobicContact CZ2-CD1 4.37Å; L333-V335 PolarHBondContact O-N 3.29Å; L333-Y339 WeakPolarHBondContact O-CA 3.49Å; L333-Q340 HydrophobicContact CB-CB 4.39Å; L333-Q340 PolarHBondContact N-O 2.92Å; L333-Q340 PolarHBondContact O-N 2.95Å; L333-T358 HydrophobicContact CD2-CG2 3.97Å; L333-M362 HydrophobicContact CD1-CE 4.06Å; L333-M362 HydrophobicContact CD1-CG 3.77Å; L333-M362 HydrophobicContact CD1-SD 4.39Å
334	D	96.5	Very high	97.3	Very high	14 Å²	14	42.9 Å²	42.9	8%	0.075	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.8	104.2	-180	175.1	3.1	0	0	0	111.6	P126 N127 G128 A129 W130 G336 Y339	P126-D334 VanDerWaalsContact CA-OD1 3.23Å; P126-D334 WeakPolarHBondContact CA-OD1 3.49Å; P126-D334 WeakPolarHBondContact CB-OD1 3.48Å; N127-D334 VanDerWaalsContact N-CG 3.31Å; N127-D334 PolarHBondContact N-OD1 3.11Å; N127-D334 PolarHBondContact N-OD2 2.91Å; N127-D334 PolarHBondContact OD1-OD2 3.31Å; G128-D334 CarbonylContact C-O 3.45Å; G128-D334 WeakPolarHBondContact CA-O 3.28Å; G128-D334 PolarHBondContact N-OD1 3.27Å; G128-D334 PolarHBondContact N-OD2 3.41Å; G128-D334 VanDerWaalsContact N-OD2 3.11Å; A129-D334 HydrophobicContact CB-CB 4.18Å; A129-D334 PolarHBondContact N-OD2 2.67Å; A129-D334 VanDerWaalsContact N-OD2 3.13Å; W130-D334 VanDerWaalsContact CB-O 3.28Å; W130-D334 WeakPolarHBondContact CB-O 3.41Å; W130-D334 PolarHBondContact N-O 2.86Å; W130-D334 VanDerWaalsContact N-O 3.1Å; D334-G336 PolarHBondContact OD1-N 3.33Å; D334-Y339 HydrophobicContact CB-CD1 4.1Å; D334-Y339 HydrophobicContact CB-CE1 3.88Å
335	V	96.7	Very high	97.5	Very high	34 Å²	34	35.6 Å²	35.6	21%	0.206	19%	0.188	C	C	.	.			trans	-95.9	13	-179.2	-62.9	0	0	0	0	113.3	L131 L333 T337 G338 Q340	L131-V335 VanDerWaalsContact CD1-O 3.31Å; L131-V335 WeakPolarHBondContact CD1-O 3.26Å; L131-V335 HydrophobicContact CD2-CG1 4.46Å; L333-V335 PolarHBondContact O-N 3.29Å; V335-T337 VanDerWaalsContact C-N 3.28Å; V335-T337 PolarHBondContact O-N 2.84Å; V335-T337 VanDerWaalsContact O-N 3.08Å; V335-G338 VanDerWaalsContact CG2-O 3.3Å; V335-G338 WeakPolarHBondContact CG2-O 3.3Å; V335-G338 PolarHBondContact N-O 3.44Å; V335-Q340 HydrophobicContact CG1-CB 4.03Å
336	G	94.7	Very high	97.5	Very high	29 Å²	29	36.1 Å²	36.1	30%	0.299	20%	0.195	S	C	.	.	S	Bend	trans	85.6	-55.1	175.6	0	0	0	0	0	113.6	G128 D334 G338	G128-G336 VanDerWaalsContact N-CA 3.28Å; D334-G336 PolarHBondContact OD1-N 3.33Å; G336-G338 PolarHBondContact O-N 3.37Å
337	T	94.4	Very high	97.6	Very high	144 Å²	144	29.2 Å²	29.2	88%	0.883	16%	0.163	S	C	*	.	S	Bend	trans	-76.6	-13	174.9	53.2	0	0	0	0	113.2	V335	V335-T337 VanDerWaalsContact C-N 3.28Å; V335-T337 PolarHBondContact O-N 2.84Å; V335-T337 VanDerWaalsContact O-N 3.08Å
338	G	95.4	Very high	97.6	Very high	20 Å²	20	24.9 Å²	24.9	21%	0.206	14%	0.143	C	C	.	.	S	Bend	trans	173.1	-160.6	-174	0	0	0	0	0	111.3	V335 G336	V335-G338 VanDerWaalsContact CG2-O 3.3Å; V335-G338 WeakPolarHBondContact CG2-O 3.3Å; V335-G338 PolarHBondContact N-O 3.44Å; G336-G338 PolarHBondContact O-N 3.37Å
339	Y	96.5	Very high	97.6	Very high	60 Å²	60	29.3 Å²	29.3	24%	0.235	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	138.6	175.9	-62.8	-72.4	0	0	0	111.5	P126 Q294 R332 L333 D334	P126-Y339 HydrophobicContact CB-CE1 4.18Å; P126-Y339 HydrophobicContact CB-CE2 4.31Å; P126-Y339 HydrophobicContact CG-CE2 4.41Å; Q294-Y339 PolarHBondContact NE2-O 3.49Å; Q294-Y339 PolarHBondContact OE1-O 3.1Å; R332-Y339 HydrophobicContact CG-CD1 3.73Å; R332-Y339 HydrophobicContact CG-CG 3.83Å; L333-Y339 WeakPolarHBondContact O-CA 3.49Å; D334-Y339 HydrophobicContact CB-CD1 4.1Å; D334-Y339 HydrophobicContact CB-CE1 3.88Å
340	Q	97.6	Very high	97.6	Very high	41 Å²	41	29 Å²	29	19%	0.192	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.1	128.2	169.8	-170.7	-179	-8.2	0	0	109.3	M290 R332 L333 V335 W342	M290-Q340 HydrophobicContact CE-CG 3.7Å; M290-Q340 PolarHBondContact SD-NE2 3.38Å; R332-Q340 WeakPolarHBondContact CA-O 3.45Å; L333-Q340 HydrophobicContact CB-CB 4.39Å; L333-Q340 PolarHBondContact N-O 2.92Å; L333-Q340 PolarHBondContact O-N 2.95Å; V335-Q340 HydrophobicContact CG1-CB 4.03Å; Q340-W342 VanDerWaalsContact CD-NE1 3.26Å
341	Y	98.5	Very high	97.6	Very high	1 Å²	1	28.9 Å²	28.9	0%	0.004	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	145.1	179.8	-72	-88.8	0	0	0	111.3	A291 Q294 A295 P296 L316 L330 L331 R332	A291-Y341 WeakPolarHBondContact CB-O 3.49Å; A291-Y341 PolarHBondContact N-O 2.95Å; Q294-Y341 HydrophobicContact CB-CE2 4.32Å; A295-Y341 HydrophobicContact CB-CE1 4.24Å; A295-Y341 PolarHBondContact O-OH 3.38Å; P296-Y341 WeakPolarHBondContact CA-OH 3.21Å; L316-Y341 HydrophobicContact CD2-CG 4.32Å; L330-Y341 HydrophobicContact CD1-CD1 3.58Å; L330-Y341 HydrophobicContact CD1-CE1 4.28Å; L330-Y341 HydrophobicContact CD1-CG 4.46Å; L330-Y341 HydrophobicContact CD2-CD1 4.36Å; L330-Y341 HydrophobicContact CD2-CE1 4.25Å; L330-Y341 HydrophobicContact CG-CD1 4.08Å; L330-Y341 HydrophobicContact CG-CE1 4.37Å; L331-Y341 WeakPolarHBondContact O-CA 3.17Å; R332-Y341 HydrophobicContact CB-CD1 4.22Å; R332-Y341 HydrophobicContact CB-CE1 4.04Å; R332-Y341 WeakPolarHBondContact CD-OH 3.38Å; R332-Y341 HydrophobicContact CG-CD1 4.21Å; R332-Y341 HydrophobicContact CG-CE1 3.78Å; R332-Y341 HydrophobicContact CG-CE2 4.41Å
342	W	98.8	Very high	97.6	Very high	26 Å²	26	28.9 Å²	28.9	10%	0.098	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.9	149.6	176.3	-58.6	69.4	0	0	0	110.8	A288 V289 M290 L331 Q340 M362 W365	A288-W342 HydrophobicContact CB-CE3 4.17Å; V289-W342 VanDerWaalsContact C-CE3 3.42Å; V289-W342 CarbonylContact O-C 3.41Å; V289-W342 VanDerWaalsContact O-CA 3.31Å; V289-W342 WeakPolarHBondContact O-CA 3.21Å; M290-W342 VanDerWaalsContact CA-CE3 3.44Å; M290-W342 HydrophobicContact CB-CD2 4.01Å; M290-W342 HydrophobicContact CB-CE3 3.79Å; M290-W342 HydrophobicContact CB-CH2 3.93Å; M290-W342 HydrophobicContact CB-CZ2 4.2Å; M290-W342 HydrophobicContact CB-CZ3 3.72Å; M290-W342 HydrophobicContact CG-CD2 4.37Å; M290-W342 HydrophobicContact CG-CH2 4.45Å; M290-W342 HydrophobicContact CG-CZ2 4.27Å; M290-W342 HydrophobicContact SD-CH2 4.4Å; M290-W342 HydrophobicContact SD-CZ2 4.18Å; L331-W342 HydrophobicContact CB-CB 4.05Å; L331-W342 HydrophobicContact CD1-CB 4.11Å; L331-W342 HydrophobicContact CG-CB 4.5Å; L331-W342 PolarHBondContact N-O 3.03Å; L331-W342 PolarHBondContact O-N 3.1Å; Q340-W342 VanDerWaalsContact CD-NE1 3.26Å; W342-M362 HydrophobicContact CD2-CE 3.89Å; W342-M362 HydrophobicContact CE3-CE 4.18Å; W342-M362 HydrophobicContact CG-CE 4.04Å; W342-W365 HydrophobicContact CE3-CZ3 4.23Å; W342-W365 HydrophobicContact CH2-CZ3 4.35Å; W342-W365 AromaticContact CZ3-CH2 3.98Å; W342-W365 HydrophobicContact CZ3-CH2 3.98Å; W342-W365 AromaticContact CZ3-CZ3 3.74Å; W342-W365 HydrophobicContact CZ3-CZ3 3.74Å
343	Y	98.8	Very high	97.6	Very high	2 Å²	2	29.3 Å²	29.3	1%	0.008	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.3	108.4	165.5	-59.9	-97.8	0	0	0	107.8	A288 V289 A291 I308 L311 L316 T317 P318 L322 A328	A288-Y343 CarbonylContact C-O 3.32Å; A288-Y343 WeakPolarHBondContact CA-O 3.29Å; A288-Y343 WeakPolarHBondContact CB-O 3.37Å; V289-Y343 PolarHBondContact N-O 2.91Å; V289-Y343 PolarHBondContact O-N 3.47Å; A291-Y343 HydrophobicContact CB-CD2 3.92Å; A291-Y343 HydrophobicContact CB-CE2 3.4Å; I308-Y343 HydrophobicContact CD1-CD1 4.13Å; I308-Y343 HydrophobicContact CD1-CE1 4.33Å; L311-Y343 HydrophobicContact CB-CE1 3.94Å; L311-Y343 HydrophobicContact CD1-CD1 3.53Å; L311-Y343 HydrophobicContact CD1-CE1 3.39Å; L311-Y343 HydrophobicContact CG-CE1 4.3Å; L316-Y343 VanDerWaalsContact CB-OH 3.3Å; L316-Y343 WeakPolarHBondContact CB-OH 3.32Å; L316-Y343 PolarHBondContact O-OH 3.08Å; L316-Y343 VanDerWaalsContact O-OH 3.13Å; T317-Y343 WeakPolarHBondContact CA-OH 3.29Å; T317-Y343 PolarHBondContact N-OH 2.69Å; P318-Y343 HydrophobicContact CB-CD2 3.98Å; P318-Y343 HydrophobicContact CB-CE2 3.66Å; L322-Y343 HydrophobicContact CD1-CD1 3.82Å; L322-Y343 HydrophobicContact CD1-CE1 4.12Å; L322-Y343 HydrophobicContact CD1-CG 4.17Å; L322-Y343 HydrophobicContact CD2-CD2 4.39Å; L322-Y343 HydrophobicContact CD2-CG 4.05Å; A328-Y343 HydrophobicContact CB-CD1 3.97Å; A328-Y343 HydrophobicContact CB-CG 4.49Å
344	G	98.7	Very high	97.6	Very high	2 Å²	2	31 Å²	31	2%	0.021	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82	121.4	169.8	0	0	0	0	0	110.1	A328 S329	A328-G344 WeakPolarHBondContact CA-O 3.24Å; S329-G344 PolarHBondContact N-O 3.11Å; S329-G344 PolarHBondContact O-N 2.82Å
345	L	98.5	Very high	97.7	Very high	3 Å²	3	33.8 Å²	33.8	2%	0.016	18%	0.18	C	C	.	.			trans	-97.8	175.4	-179.6	-58.5	177.1	0	0	0	110.2	Q286 V287 V289 H325 A328 N347 F348 Y349	Q286-L345 HydrophobicContact CB-CD1 3.52Å; V287-L345 WeakPolarHBondContact O-CB 3.23Å; V287-L345 PolarHBondContact O-N 3.32Å; V289-L345 HydrophobicContact CG2-CD1 4.23Å; H325-L345 HydrophobicContact CB-CD2 4.05Å; A328-L345 HydrophobicContact CB-CD2 4.28Å; L345-N347 VanDerWaalsContact C-N 3.26Å; L345-N347 PolarHBondContact O-N 3.49Å; L345-N347 VanDerWaalsContact O-N 3.16Å; L345-F348 WeakPolarHBondContact O-CB 3.41Å; L345-F348 PolarHBondContact O-N 3.49Å; L345-Y349 PolarHBondContact O-N 3.27Å
346	P	97.9	Very high	97.6	Very high	54 Å²	54	37.4 Å²	37.4	35%	0.351	19%	0.194	S	C	.	.	H	α-helix	trans	-51.3	-41.7	-175.5	-31.1	38.7	0	0	0	114	F348 Y349 T350	P346-F348 VanDerWaalsContact C-N 3.35Å; P346-F348 PolarHBondContact O-N 2.88Å; P346-Y349 WeakPolarHBondContact O-CA 3.38Å; P346-Y349 WeakPolarHBondContact O-CB 3.46Å; P346-Y349 PolarHBondContact O-N 2.97Å; P346-Y349 VanDerWaalsContact O-N 3.09Å; P346-T350 PolarHBondContact O-N 2.99Å; P346-T350 PolarHBondContact O-OG1 2.75Å
347	N	98.6	Very high	97.8	Very high	0 Å²	0	37.6 Å²	37.6	0%	0	19%	0.191	C	C	.	.	H	α-helix	trans	-65	-33.3	177.5	-80.6	-9.1	0	0	0	113.4	W281 V282 D285 V287 L345 Y349 T350 I351	W281-N347 HydrophobicContact CD2-CB 4.4Å; W281-N347 HydrophobicContact CE3-CB 3.87Å; W281-N347 HydrophobicContact CH2-CB 3.77Å; W281-N347 HydrophobicContact CZ2-CB 4.28Å; W281-N347 HydrophobicContact CZ3-CB 3.56Å; V282-N347 PolarHBondContact N-OD1 2.94Å; V282-N347 PolarHBondContact O-ND2 3.09Å; D285-N347 PolarHBondContact O-ND2 3.23Å; V287-N347 HydrophobicContact CG2-CB 4.12Å; L345-N347 VanDerWaalsContact C-N 3.26Å; L345-N347 PolarHBondContact O-N 3.49Å; L345-N347 VanDerWaalsContact O-N 3.16Å; N347-Y349 VanDerWaalsContact C-N 3.34Å; N347-T350 PolarHBondContact O-N 3.49Å; N347-I351 WeakPolarHBondContact O-CG1 3.41Å; N347-I351 PolarHBondContact O-N 2.72Å; N347-I351 VanDerWaalsContact O-N 3.13Å
348	F	98.8	Very high	97.9	Very high	0 Å²	0	31.8 Å²	31.8	0%	0	16%	0.156	C	C	.	.	H	α-helix	trans	-63.7	-43.1	171	-174.3	-84.1	0	0	0	111.2	V287 A288 F302 L331 L345 P346 T350 I351 T352 T358 A361 M362	V287-F348 HydrophobicContact CG1-CB 3.85Å; V287-F348 HydrophobicContact CG1-CD2 3.89Å; V287-F348 HydrophobicContact CG1-CG 4.38Å; V287-F348 WeakPolarHBondContact O-CB 3.43Å; A288-F348 HydrophobicContact CB-CD2 3.95Å; F302-F348 HydrophobicContact CB-CD1 4.44Å; F302-F348 HydrophobicContact CB-CE1 4.12Å; L331-F348 HydrophobicContact CD1-CD1 3.74Å; L331-F348 HydrophobicContact CD1-CD2 3.86Å; L331-F348 HydrophobicContact CD1-CE1 3.51Å; L331-F348 HydrophobicContact CD1-CE2 3.64Å; L331-F348 HydrophobicContact CD1-CG 3.93Å; L331-F348 HydrophobicContact CD1-CZ 3.46Å; L331-F348 VanDerWaalsContact CD1-CZ 3.46Å; L331-F348 HydrophobicContact CD2-CD1 3.93Å; L331-F348 HydrophobicContact CD2-CE1 3.44Å; L331-F348 VanDerWaalsContact CD2-CE1 3.44Å; L331-F348 HydrophobicContact CD2-CZ 4.04Å; L331-F348 HydrophobicContact CG-CD1 4.46Å; L331-F348 HydrophobicContact CG-CE1 4.12Å; L331-F348 HydrophobicContact CG-CZ 4.36Å; L345-F348 WeakPolarHBondContact O-CB 3.41Å; L345-F348 PolarHBondContact O-N 3.49Å; P346-F348 VanDerWaalsContact C-N 3.35Å; P346-F348 PolarHBondContact O-N 2.88Å; F348-T350 VanDerWaalsContact C-N 3.3Å; F348-T350 PolarHBondContact O-N 3.32Å; F348-I351 PolarHBondContact O-N 3.12Å; F348-T352 HydrophobicContact CD1-CG2 4.28Å; F348-T352 HydrophobicContact CE1-CG2 4.03Å; F348-T352 PolarHBondContact O-N 3.19Å; F348-T358 HydrophobicContact CE1-CG2 4.41Å; F348-T358 HydrophobicContact CZ-CG2 4Å; F348-A361 HydrophobicContact CD2-CB 4.4Å; F348-A361 HydrophobicContact CE1-CB 3.98Å; F348-A361 HydrophobicContact CE2-CB 3.88Å; F348-A361 HydrophobicContact CZ-CB 3.64Å; F348-M362 HydrophobicContact CD2-CE 4.45Å; F348-M362 HydrophobicContact CE2-CB 4.14Å; F348-M362 HydrophobicContact CE2-CE 3.73Å; F348-M362 HydrophobicContact CE2-SD 4.49Å; F348-M362 HydrophobicContact CZ-CB 4.48Å; F348-M362 HydrophobicContact CZ-CE 4.46Å
349	Y	98.2	Very high	98.1	Very high	97 Å²	97	33.2 Å²	33.2	38%	0.38	16%	0.157	S	C	.	.	H	α-helix	trans	-60	-41.6	175	-173.2	-96.6	0	0	0	111.5	F302 L345 P346 N347 I351 T352 R353	F302-Y349 HydrophobicContact CD2-CD2 4.1Å; F302-Y349 AromaticContact CD2-CE2 3.94Å; F302-Y349 HydrophobicContact CD2-CE2 3.94Å; F302-Y349 VanDerWaalsContact O-CD2 3.23Å; F302-Y349 WeakPolarHBondContact O-CD2 3.38Å; L345-Y349 PolarHBondContact O-N 3.27Å; P346-Y349 WeakPolarHBondContact O-CA 3.38Å; P346-Y349 WeakPolarHBondContact O-CB 3.46Å; P346-Y349 PolarHBondContact O-N 2.97Å; P346-Y349 VanDerWaalsContact O-N 3.09Å; N347-Y349 VanDerWaalsContact C-N 3.34Å; Y349-I351 PolarHBondContact O-N 2.94Å; Y349-T352 WeakPolarHBondContact O-CB 3.43Å; Y349-T352 PolarHBondContact O-N 3.31Å; Y349-T352 PolarHBondContact O-OG1 3.05Å; Y349-R353 PolarHBondContact O-N 3.21Å
350	T	98.5	Very high	98.2	Very high	6 Å²	6	30.5 Å²	30.5	4%	0.037	15%	0.146	C	C	.	.	H	α-helix	trans	-58.7	-42.3	175.8	-58	0	0	0	0	112.4	F276 H279 W281 P346 N347 F348 T352 R353	F276-T350 HydrophobicContact CD1-CG2 3.68Å; F276-T350 HydrophobicContact CE1-CG2 4.2Å; H279-T350 HydrophobicContact CB-CG2 3.84Å; H279-T350 WeakPolarHBondContact O-CG2 3.47Å; H279-T350 PolarHBondContact O-OG1 2.91Å; W281-T350 HydrophobicContact CB-CG2 4.22Å; W281-T350 HydrophobicContact CE3-CG2 4.12Å; P346-T350 PolarHBondContact O-N 2.99Å; P346-T350 PolarHBondContact O-OG1 2.75Å; N347-T350 PolarHBondContact O-N 3.49Å; F348-T350 VanDerWaalsContact C-N 3.3Å; F348-T350 PolarHBondContact O-N 3.32Å; T350-T352 PolarHBondContact O-N 2.69Å; T350-R353 VanDerWaalsContact O-CB 3.23Å; T350-R353 WeakPolarHBondContact O-CB 3.31Å; T350-R353 WeakPolarHBondContact O-CG 3.37Å; T350-R353 PolarHBondContact O-N 2.84Å
351	I	98.8	Very high	98.2	Very high	0 Å²	0	28.6 Å²	28.6	0%	0	14%	0.137	C	C	.	.	H	α-helix	trans	-59.5	-36.4	175.3	-57.9	163.9	0	0	0	111.1	I170 F276 W281 V287 N347 F348 Y349 R353 Y354 Y360 A361 V364 W365	I170-I351 HydrophobicContact CD1-CD1 4.14Å; F276-I351 HydrophobicContact CE1-CB 4.09Å; F276-I351 HydrophobicContact CE1-CG1 3.6Å; F276-I351 HydrophobicContact CZ-CB 4.31Å; F276-I351 HydrophobicContact CZ-CG1 4.08Å; F276-I351 HydrophobicContact CZ-CG2 4.33Å; W281-I351 HydrophobicContact CZ3-CD1 4.36Å; W281-I351 HydrophobicContact CZ3-CG1 4Å; V287-I351 HydrophobicContact CG1-CD1 3.66Å; V287-I351 HydrophobicContact CG2-CD1 4.46Å; N347-I351 WeakPolarHBondContact O-CG1 3.41Å; N347-I351 PolarHBondContact O-N 2.72Å; N347-I351 VanDerWaalsContact O-N 3.13Å; F348-I351 PolarHBondContact O-N 3.12Å; Y349-I351 PolarHBondContact O-N 2.94Å; I351-R353 PolarHBondContact O-N 3.08Å; I351-R353 VanDerWaalsContact O-N 3.15Å; I351-Y354 WeakPolarHBondContact O-CB 3.29Å; I351-Y354 PolarHBondContact O-N 3.37Å; I351-Y354 VanDerWaalsContact O-N 3.14Å; I351-Y360 HydrophobicContact CG2-CE1 4.32Å; I351-A361 HydrophobicContact CB-CB 3.91Å; I351-A361 HydrophobicContact CG2-CB 3.66Å; I351-V364 HydrophobicContact CG2-CB 4.04Å; I351-V364 HydrophobicContact CG2-CG1 3.92Å; I351-V364 HydrophobicContact CG2-CG2 4.39Å; I351-W365 HydrophobicContact CD1-CB 4.16Å
352	T	98.4	Very high	98.2	Very high	0 Å²	0	28.5 Å²	28.5	0%	0	14%	0.137	C	C	.	.	H	α-helix	trans	-68.3	-12.1	178.5	71.9	0	0	0	0	113.7	F302 F348 Y349 T350 Y354 N355 H356 A361	F302-T352 HydrophobicContact CB-CG2 3.77Å; F302-T352 HydrophobicContact CD1-CG2 4.16Å; F302-T352 HydrophobicContact CD2-CG2 4.01Å; F302-T352 WeakPolarHBondContact CD2-OG1 3.35Å; F302-T352 HydrophobicContact CG-CG2 3.72Å; F348-T352 HydrophobicContact CD1-CG2 4.28Å; F348-T352 HydrophobicContact CE1-CG2 4.03Å; F348-T352 PolarHBondContact O-N 3.19Å; Y349-T352 WeakPolarHBondContact O-CB 3.43Å; Y349-T352 PolarHBondContact O-N 3.31Å; Y349-T352 PolarHBondContact O-OG1 3.05Å; T350-T352 PolarHBondContact O-N 2.69Å; T352-Y354 PolarHBondContact O-N 3.25Å; T352-N355 CarbonylContact C-O 3.55Å; T352-N355 VanDerWaalsContact CA-O 3.29Å; T352-N355 WeakPolarHBondContact CA-O 3.31Å; T352-N355 CarbonylContact O-C 3.38Å; T352-N355 PolarHBondContact O-N 3.47Å; T352-H356 WeakPolarHBondContact O-CA 3.26Å; T352-H356 PolarHBondContact O-CD2 2.63Å; T352-H356 VanDerWaalsContact O-CD2 3.23Å; T352-H356 PolarHBondContact O-N 3.36Å; T352-A361 HydrophobicContact CG2-CB 3.6Å
353	R	97.8	Very high	98.2	Very high	82 Å²	82	27.3 Å²	27.3	31%	0.309	13%	0.132	S	C	.	.	H	α-helix	trans	-65.4	-34.2	172.8	-59.7	-54	-49.8	135.8	12.6	111.6	Y275 H279 Y349 T350 I351 H356	Y275-R353 HydrophobicContact CE1-CB 4.22Å; Y275-R353 PolarHBondContact OH-O 2.95Å; H279-R353 HydrophobicContact CB-CB 4.25Å; H279-R353 HydrophobicContact CB-CG 4.09Å; Y349-R353 PolarHBondContact O-N 3.21Å; T350-R353 VanDerWaalsContact O-CB 3.23Å; T350-R353 WeakPolarHBondContact O-CB 3.31Å; T350-R353 WeakPolarHBondContact O-CG 3.37Å; T350-R353 PolarHBondContact O-N 2.84Å; I351-R353 PolarHBondContact O-N 3.08Å; I351-R353 VanDerWaalsContact O-N 3.15Å; R353-H356 PolarHBondContact NH1-CD2 2.88Å; R353-H356 PolarHBondContact NH1-NE2 2.97Å
354	Y	98	Very high	98.2	Very high	35 Å²	35	27.2 Å²	27.2	14%	0.137	13%	0.132	C	C	.	.	H	α-helix	trans	-65.6	-44.6	175.5	-134.4	-77.4	0	0	0	111.6	I174 E178 G240 F242 V272 Y275 F276 I351 T352 Y360	I174-Y354 HydrophobicContact CD1-CD1 4.36Å; I174-Y354 HydrophobicContact CD1-CD2 4.02Å; I174-Y354 HydrophobicContact CD1-CE2 4.4Å; I174-Y354 HydrophobicContact CD1-CG 3.98Å; I174-Y354 HydrophobicContact CG2-CE1 4.05Å; I174-Y354 HydrophobicContact CG2-CE2 4.04Å; E178-Y354 HydrophobicContact CG-CE1 4.49Å; G240-Y354 WeakPolarHBondContact O-CE1 3.08Å; G240-Y354 PolarHBondContact O-OH 2.9Å; F242-Y354 AromaticContact CD1-CZ 3.96Å; F242-Y354 VanDerWaalsContact CD1-OH 3.31Å; F242-Y354 WeakPolarHBondContact CD1-OH 3.44Å; F242-Y354 AromaticContact CE1-CE2 3.9Å; F242-Y354 HydrophobicContact CE1-CE2 3.9Å; F242-Y354 AromaticContact CE1-CZ 3.58Å; F242-Y354 WeakPolarHBondContact CE1-OH 3.38Å; V272-Y354 HydrophobicContact CG1-CE2 4.49Å; Y275-Y354 AromaticContact CD1-CD2 3.49Å; Y275-Y354 HydrophobicContact CD1-CD2 3.49Å; Y275-Y354 VanDerWaalsContact CD1-CD2 3.49Å; Y275-Y354 AromaticContact CD1-CE2 3.76Å; Y275-Y354 HydrophobicContact CD1-CE2 3.76Å; Y275-Y354 AromaticContact CE1-CD2 3.42Å; Y275-Y354 HydrophobicContact CE1-CD2 3.42Å; Y275-Y354 VanDerWaalsContact CE1-CD2 3.42Å; Y275-Y354 HydrophobicContact CE1-CE2 4.1Å; Y275-Y354 HydrophobicContact CE1-CG 4.12Å; Y275-Y354 HydrophobicContact CG-CD2 4.18Å; Y275-Y354 HydrophobicContact CG-CE2 4.02Å; Y275-Y354 PolarHBondContact OH-N 2.92Å; F276-Y354 HydrophobicContact CD2-CD2 4.39Å; F276-Y354 AromaticContact CE2-CD2 3.64Å; F276-Y354 HydrophobicContact CE2-CD2 3.64Å; F276-Y354 AromaticContact CE2-CE2 3.99Å; F276-Y354 HydrophobicContact CE2-CE2 3.99Å; F276-Y354 HydrophobicContact CZ-CD2 4.25Å; I351-Y354 WeakPolarHBondContact O-CB 3.29Å; I351-Y354 PolarHBondContact O-N 3.37Å; I351-Y354 VanDerWaalsContact O-N 3.14Å; T352-Y354 PolarHBondContact O-N 3.25Å; Y354-Y360 WeakPolarHBondContact CD1-OH 3.44Å
355	N	97.2	Very high	98.2	Very high	73 Å²	73	28.9 Å²	28.9	39%	0.39	14%	0.137	S	C	.	.	S	Bend	trans	-149.1	125.3	172	-176.4	-45.9	0	0	0	109.8	T352 S357 Y360	T352-N355 CarbonylContact C-O 3.55Å; T352-N355 VanDerWaalsContact CA-O 3.29Å; T352-N355 WeakPolarHBondContact CA-O 3.31Å; T352-N355 CarbonylContact O-C 3.38Å; T352-N355 PolarHBondContact O-N 3.47Å; N355-S357 PolarHBondContact O-N 3.27Å; N355-S357 WeakPolarHBondContact OD1-CB 3.41Å; N355-Y360 HydrophobicContact CB-CD1 3.56Å; N355-Y360 HydrophobicContact CB-CD2 3.8Å; N355-Y360 HydrophobicContact CB-CE1 3.73Å; N355-Y360 HydrophobicContact CB-CE2 3.93Å; N355-Y360 HydrophobicContact CB-CG 3.59Å
356	H	96.6	Very high	98.2	Very high	110 Å²	110	30.1 Å²	30.1	51%	0.509	14%	0.143	S	C	.	.	S	Bend	trans	-69.8	54.9	-174.6	-64	158.8	0	0	0	113.7	F302 T352 R353	F302-H356 VanDerWaalsContact CE1-O 3.31Å; F302-H356 WeakPolarHBondContact CE1-O 3.28Å; F302-H356 HydrophobicContact CZ-CB 3.88Å; T352-H356 WeakPolarHBondContact O-CA 3.26Å; T352-H356 PolarHBondContact O-CD2 2.63Å; T352-H356 VanDerWaalsContact O-CD2 3.23Å; T352-H356 PolarHBondContact O-N 3.36Å; R353-H356 PolarHBondContact NH1-CD2 2.88Å; R353-H356 PolarHBondContact NH1-NE2 2.97Å
357	S	97.1	Very high	98.3	Very high	34 Å²	34	27.5 Å²	27.5	24%	0.238	13%	0.126	C	C	.	.			trans	-142.5	127.3	-174.7	169.5	0	0	0	0	111.5	N355 H359 Y360 A361	N355-S357 PolarHBondContact O-N 3.27Å; N355-S357 WeakPolarHBondContact OD1-CB 3.41Å; S357-H359 VanDerWaalsContact C-N 3.33Å; S357-H359 PolarHBondContact O-N 2.83Å; S357-H359 PolarHBondContact OG-N 3.31Å; S357-Y360 PolarHBondContact O-N 3.17Å; S357-Y360 PolarHBondContact OG-N 3.13Å; S357-A361 PolarHBondContact O-N 2.9Å
358	T	98.2	Very high	98.3	Very high	22 Å²	22	27.5 Å²	27.5	14%	0.135	13%	0.126	C	C	.	.	H	α-helix	trans	-61.5	-40	172.7	-65.3	0	0	0	0	111.9	L331 L333 F348 M362	L331-T358 HydrophobicContact CB-CG2 4.19Å; L331-T358 HydrophobicContact CD2-CG2 4.07Å; L333-T358 HydrophobicContact CD2-CG2 3.97Å; F348-T358 HydrophobicContact CE1-CG2 4.41Å; F348-T358 HydrophobicContact CZ-CG2 4Å; T358-M362 VanDerWaalsContact O-CB 3.3Å; T358-M362 WeakPolarHBondContact O-CB 3.36Å; T358-M362 PolarHBondContact O-N 3.39Å
359	H	98.2	Very high	98.3	Very high	49 Å²	49	31.3 Å²	31.3	23%	0.227	14%	0.144	C	C	.	.	H	α-helix	trans	-63.6	-42.7	176.5	-77.8	162.9	0	0	0	111.6	W130 Y133 S357 A363	W130-H359 WeakPolarHBondContact CA-NE2 3.34Å; W130-H359 HydrophobicContact CE3-CB 4.27Å; W130-H359 AromaticContact CE3-CD2 3.41Å; W130-H359 VanDerWaalsContact CE3-CD2 3.41Å; W130-H359 HydrophobicContact CZ3-CB 4.34Å; W130-H359 WeakPolarHBondContact CZ3-O 3.3Å; Y133-H359 HydrophobicContact CD1-CB 3.76Å; Y133-H359 HydrophobicContact CD2-CB 4.26Å; Y133-H359 HydrophobicContact CE1-CB 3.88Å; Y133-H359 WeakPolarHBondContact CE1-O 3.5Å; Y133-H359 HydrophobicContact CE2-CB 4.4Å; Y133-H359 HydrophobicContact CG-CB 3.94Å; S357-H359 VanDerWaalsContact C-N 3.33Å; S357-H359 PolarHBondContact O-N 2.83Å; S357-H359 PolarHBondContact OG-N 3.31Å; H359-A363 VanDerWaalsContact O-CB 3.28Å; H359-A363 WeakPolarHBondContact O-CB 3.2Å; H359-A363 PolarHBondContact O-N 3.4Å
360	Y	98.5	Very high	98.3	Very high	4 Å²	4	27.8 Å²	27.8	2%	0.016	14%	0.135	C	C	.	.	H	α-helix	trans	-60.3	-54.7	177.2	175.4	-87.1	0	0	0	111	I174 V177 E178 I351 Y354 N355 S357 M362 A363 V364	I174-Y360 HydrophobicContact CD1-CE1 4.22Å; I174-Y360 WeakPolarHBondContact CD1-OH 3.43Å; V177-Y360 HydrophobicContact CG1-CD2 3.9Å; V177-Y360 HydrophobicContact CG1-CE2 3.55Å; E178-Y360 WeakPolarHBondContact OE1-CE2 3.47Å; E178-Y360 PolarHBondContact OE1-OH 3.44Å; I351-Y360 HydrophobicContact CG2-CE1 4.32Å; Y354-Y360 WeakPolarHBondContact CD1-OH 3.44Å; N355-Y360 HydrophobicContact CB-CD1 3.56Å; N355-Y360 HydrophobicContact CB-CD2 3.8Å; N355-Y360 HydrophobicContact CB-CE1 3.73Å; N355-Y360 HydrophobicContact CB-CE2 3.93Å; N355-Y360 HydrophobicContact CB-CG 3.59Å; S357-Y360 PolarHBondContact O-N 3.17Å; S357-Y360 PolarHBondContact OG-N 3.13Å; Y360-M362 VanDerWaalsContact C-N 3.29Å; Y360-M362 PolarHBondContact O-N 2.82Å; Y360-A363 PolarHBondContact O-N 3.17Å; Y360-V364 HydrophobicContact CD1-CG2 4.04Å; Y360-V364 HydrophobicContact CE1-CG2 3.58Å; Y360-V364 HydrophobicContact CE2-CG2 4.26Å; Y360-V364 PolarHBondContact O-N 3.23Å
361	A	98.7	Very high	98.3	Very high	0 Å²	0	27.5 Å²	27.5	0%	0	13%	0.134	C	C	.	.	H	α-helix	trans	-61.6	-38.7	-176.1	0	0	0	0	0	112.5	F348 I351 T352 S357 W365	F348-A361 HydrophobicContact CD2-CB 4.4Å; F348-A361 HydrophobicContact CE1-CB 3.98Å; F348-A361 HydrophobicContact CE2-CB 3.88Å; F348-A361 HydrophobicContact CZ-CB 3.64Å; I351-A361 HydrophobicContact CB-CB 3.91Å; I351-A361 HydrophobicContact CG2-CB 3.66Å; T352-A361 HydrophobicContact CG2-CB 3.6Å; S357-A361 PolarHBondContact O-N 2.9Å; A361-W365 PolarHBondContact O-N 3.25Å; A361-W365 VanDerWaalsContact O-N 3.12Å
362	M	98.8	Very high	98.3	Very high	0 Å²	0	28.8 Å²	28.8	0%	0	14%	0.144	C	C	.	.	H	α-helix	trans	-67.4	-37.3	174.4	-170.7	61.2	69.2	0	0	112.3	W130 A288 L331 L333 W342 F348 T358 Y360 W365 Q366	W130-M362 HydrophobicContact CH2-CB 3.66Å; W130-M362 HydrophobicContact CH2-CG 3.44Å; W130-M362 VanDerWaalsContact CH2-CG 3.44Å; W130-M362 HydrophobicContact CZ2-CB 4.16Å; W130-M362 HydrophobicContact CZ2-CG 3.42Å; W130-M362 VanDerWaalsContact CZ2-CG 3.42Å; W130-M362 HydrophobicContact CZ3-CB 4.05Å; W130-M362 HydrophobicContact CZ3-CG 4.22Å; A288-M362 HydrophobicContact CB-CE 4.27Å; L331-M362 HydrophobicContact CD1-CE 4.2Å; L333-M362 HydrophobicContact CD1-CE 4.06Å; L333-M362 HydrophobicContact CD1-CG 3.77Å; L333-M362 HydrophobicContact CD1-SD 4.39Å; W342-M362 HydrophobicContact CD2-CE 3.89Å; W342-M362 HydrophobicContact CE3-CE 4.18Å; W342-M362 HydrophobicContact CG-CE 4.04Å; F348-M362 HydrophobicContact CD2-CE 4.45Å; F348-M362 HydrophobicContact CE2-CB 4.14Å; F348-M362 HydrophobicContact CE2-CE 3.73Å; F348-M362 HydrophobicContact CE2-SD 4.49Å; F348-M362 HydrophobicContact CZ-CB 4.48Å; F348-M362 HydrophobicContact CZ-CE 4.46Å; T358-M362 VanDerWaalsContact O-CB 3.3Å; T358-M362 WeakPolarHBondContact O-CB 3.36Å; T358-M362 PolarHBondContact O-N 3.39Å; Y360-M362 VanDerWaalsContact C-N 3.29Å; Y360-M362 PolarHBondContact O-N 2.82Å; M362-W365 HydrophobicContact CE-CE3 4.43Å; M362-W365 HydrophobicContact CE-CZ3 4.39Å; M362-W365 HydrophobicContact SD-CE3 3.62Å; M362-W365 HydrophobicContact SD-CZ3 3.88Å; M362-Q366 HydrophobicContact CG-CG 4.25Å; M362-Q366 VanDerWaalsContact O-CB 3.29Å; M362-Q366 WeakPolarHBondContact O-CB 3.35Å; M362-Q366 WeakPolarHBondContact O-CG 3.5Å; M362-Q366 PolarHBondContact O-N 3.46Å; M362-Q366 HydrophobicContact SD-CG 3.94Å; M362-Q366 PolarHBondContact SD-NE2 3.4Å; M362-Q366 VanDerWaalsContact SD-NE2 3.4Å
363	A	98.7	Very high	98.3	Very high	0 Å²	0	33.5 Å²	33.5	0%	0	17%	0.169	C	C	.	.	H	α-helix	trans	-68.7	-43.5	178.2	0	0	0	0	0	112.1	W130 Y133 F137 V177 H359 Y360 L367	W130-A363 HydrophobicContact CH2-CB 4.13Å; W130-A363 HydrophobicContact CZ3-CB 4.2Å; Y133-A363 HydrophobicContact CD1-CB 4.08Å; Y133-A363 HydrophobicContact CE1-CB 3.66Å; F137-A363 HydrophobicContact CD2-CB 4.03Å; V177-A363 HydrophobicContact CG2-CB 4.44Å; H359-A363 VanDerWaalsContact O-CB 3.28Å; H359-A363 WeakPolarHBondContact O-CB 3.2Å; H359-A363 PolarHBondContact O-N 3.4Å; Y360-A363 PolarHBondContact O-N 3.17Å; A363-L367 WeakPolarHBondContact O-CB 3.4Å; A363-L367 PolarHBondContact O-N 2.78Å
364	V	98.8	Very high	98.3	Very high	0 Å²	0	30.6 Å²	30.6	0%	0	16%	0.162	C	C	.	.	H	α-helix	trans	-54.1	-55.4	173.3	163.7	0	0	0	0	110	G173 I174 V177 I351 Y360 L367 G368	G173-V364 WeakPolarHBondContact CA-O 3.4Å; I174-V364 HydrophobicContact CD1-CB 4.41Å; I174-V364 HydrophobicContact CD1-CG1 3.72Å; I174-V364 HydrophobicContact CD1-CG2 3.81Å; I174-V364 HydrophobicContact CG1-CG1 3.73Å; I174-V364 HydrophobicContact CG1-CG2 4.49Å; V177-V364 HydrophobicContact CB-CG2 4Å; V177-V364 HydrophobicContact CG1-CG2 4.22Å; V177-V364 HydrophobicContact CG2-CB 4.48Å; V177-V364 HydrophobicContact CG2-CG2 3.82Å; I351-V364 HydrophobicContact CG2-CB 4.04Å; I351-V364 HydrophobicContact CG2-CG1 3.92Å; I351-V364 HydrophobicContact CG2-CG2 4.39Å; Y360-V364 HydrophobicContact CD1-CG2 4.04Å; Y360-V364 HydrophobicContact CE1-CG2 3.58Å; Y360-V364 HydrophobicContact CE2-CG2 4.26Å; Y360-V364 PolarHBondContact O-N 3.23Å; V364-L367 PolarHBondContact O-N 3.45Å; V364-G368 PolarHBondContact O-N 2.79Å
365	W	98.7	Very high	98.3	Very high	37 Å²	37	32.3 Å²	32.3	14%	0.14	17%	0.168	C	C	.	.	H	α-helix	trans	-63.6	-50.2	-176.8	178.1	48	0	0	0	111.8	V287 A288 W342 I351 A361 M362 L367 G368 Q369	V287-W365 HydrophobicContact CB-CD2 3.9Å; V287-W365 HydrophobicContact CB-CG 4.05Å; V287-W365 HydrophobicContact CB-CZ2 4.26Å; V287-W365 HydrophobicContact CG1-CB 4.12Å; V287-W365 HydrophobicContact CG1-CD2 3.72Å; V287-W365 HydrophobicContact CG1-CE3 4.14Å; V287-W365 HydrophobicContact CG1-CG 3.7Å; V287-W365 HydrophobicContact CG2-CG 4.27Å; A288-W365 HydrophobicContact CB-CE3 4.31Å; A288-W365 HydrophobicContact CB-CH2 4.29Å; A288-W365 HydrophobicContact CB-CZ3 3.82Å; A288-W365 WeakPolarHBondContact O-CH2 3.39Å; W342-W365 HydrophobicContact CE3-CZ3 4.23Å; W342-W365 HydrophobicContact CH2-CZ3 4.35Å; W342-W365 AromaticContact CZ3-CH2 3.98Å; W342-W365 HydrophobicContact CZ3-CH2 3.98Å; W342-W365 AromaticContact CZ3-CZ3 3.74Å; W342-W365 HydrophobicContact CZ3-CZ3 3.74Å; I351-W365 HydrophobicContact CD1-CB 4.16Å; A361-W365 PolarHBondContact O-N 3.25Å; A361-W365 VanDerWaalsContact O-N 3.12Å; M362-W365 HydrophobicContact CE-CE3 4.43Å; M362-W365 HydrophobicContact CE-CZ3 4.39Å; M362-W365 HydrophobicContact SD-CE3 3.62Å; M362-W365 HydrophobicContact SD-CZ3 3.88Å; W365-L367 VanDerWaalsContact C-N 3.33Å; W365-L367 PolarHBondContact O-N 3.44Å; W365-G368 PolarHBondContact O-N 3.38Å; W365-Q369 WeakPolarHBondContact O-CG 3.29Å; W365-Q369 PolarHBondContact O-N 3.02Å
366	Q	98.7	Very high	98.2	Very high	29 Å²	29	34.6 Å²	34.6	14%	0.136	19%	0.185	C	C	.	.	H	α-helix	trans	-67	-31.4	-178.8	-71.3	-169.6	5.4	0	0	113.4	I138 M362 A370	I138-Q366 HydrophobicContact CD1-CB 3.43Å; I138-Q366 VanDerWaalsContact CD1-CB 3.43Å; M362-Q366 HydrophobicContact CG-CG 4.25Å; M362-Q366 VanDerWaalsContact O-CB 3.29Å; M362-Q366 WeakPolarHBondContact O-CB 3.35Å; M362-Q366 WeakPolarHBondContact O-CG 3.5Å; M362-Q366 PolarHBondContact O-N 3.46Å; M362-Q366 HydrophobicContact SD-CG 3.94Å; M362-Q366 PolarHBondContact SD-NE2 3.4Å; M362-Q366 VanDerWaalsContact SD-NE2 3.4Å; Q366-A370 VanDerWaalsContact O-CB 3.31Å; Q366-A370 WeakPolarHBondContact O-CB 3.31Å; Q366-A370 PolarHBondContact O-N 2.98Å
367	L	98.8	Very high	97.6	Very high	0 Å²	0	38.6 Å²	38.6	0%	0	20%	0.204	C	C	.	.	H	α-helix	trans	-64.7	-48.1	172.8	178.9	62	0	0	0	110.2	F137 I138 V143 V177 W181 A363 V364 W365 Q369 A370 V371	F137-L367 HydrophobicContact CB-CD2 4.49Å; I138-L367 HydrophobicContact CG1-CB 4.21Å; I138-L367 HydrophobicContact CG1-CD1 4.33Å; V143-L367 HydrophobicContact CG2-CD1 4.35Å; V177-L367 HydrophobicContact CG2-CD2 3.97Å; W181-L367 HydrophobicContact CH2-CD1 4.15Å; W181-L367 HydrophobicContact CH2-CD2 4.06Å; W181-L367 HydrophobicContact CH2-CG 4.37Å; W181-L367 HydrophobicContact CZ2-CD2 4.07Å; W181-L367 HydrophobicContact CZ2-CG 4.34Å; A363-L367 WeakPolarHBondContact O-CB 3.4Å; A363-L367 PolarHBondContact O-N 2.78Å; V364-L367 PolarHBondContact O-N 3.45Å; W365-L367 VanDerWaalsContact C-N 3.33Å; W365-L367 PolarHBondContact O-N 3.44Å; L367-Q369 PolarHBondContact O-N 3.35Å; L367-A370 PolarHBondContact O-N 2.8Å; L367-V371 HydrophobicContact CD1-CG2 4.43Å; L367-V371 WeakPolarHBondContact O-CG2 3.39Å; L367-V371 PolarHBondContact O-N 3.42Å
368	G	98.8	Very high	97.6	Very high	0 Å²	0	38.9 Å²	38.9	0%	0	20%	0.202	C	C	.	.	H	α-helix	trans	-54	-49.6	174.7	0	0	0	0	0	112.8	E169 V364 W365 A370 V371 A372	E169-G368 WeakPolarHBondContact O-CA 3.46Å; V364-G368 PolarHBondContact O-N 2.79Å; W365-G368 PolarHBondContact O-N 3.38Å; G368-A370 VanDerWaalsContact C-N 3.34Å; G368-A370 PolarHBondContact O-N 3.41Å; G368-V371 PolarHBondContact O-N 3.4Å; G368-A372 WeakPolarHBondContact O-CB 3.42Å; G368-A372 PolarHBondContact O-N 2.93Å
369	Q	98.6	Very high	97.6	Very high	79 Å²	79	39.7 Å²	39.7	37%	0.369	21%	0.206	S	C	.	.	H	α-helix	trans	-61	-41.5	176.9	-65	-57	80.4	0	0	112.3	W365 L367 A372 L373	W365-Q369 WeakPolarHBondContact O-CG 3.29Å; W365-Q369 PolarHBondContact O-N 3.02Å; L367-Q369 PolarHBondContact O-N 3.35Å; Q369-A372 PolarHBondContact O-N 3.06Å; Q369-L373 WeakPolarHBondContact O-CB 3.3Å; Q369-L373 PolarHBondContact O-N 3.01Å
370	A	98.7	Very high	97.6	Very high	24 Å²	24	39.2 Å²	39.2	20%	0.198	20%	0.204	C	C	.	.	H	α-helix	trans	-65.2	-39.8	178.9	0	0	0	0	0	111.8	I138 V143 Q366 L367 G368 A374	I138-A370 HydrophobicContact CG2-CB 4.12Å; V143-A370 HydrophobicContact CG1-CB 4.48Å; V143-A370 HydrophobicContact CG2-CB 3.84Å; Q366-A370 VanDerWaalsContact O-CB 3.31Å; Q366-A370 WeakPolarHBondContact O-CB 3.31Å; Q366-A370 PolarHBondContact O-N 2.98Å; L367-A370 PolarHBondContact O-N 2.8Å; G368-A370 VanDerWaalsContact C-N 3.34Å; G368-A370 PolarHBondContact O-N 3.41Å; A370-A374 WeakPolarHBondContact O-CB 3.49Å; A370-A374 PolarHBondContact O-N 3.08Å
371	V	98.8	Very high	97.5	Very high	0 Å²	0	41.3 Å²	41.3	0%	0	22%	0.216	C	C	.	.	H	α-helix	trans	-64.9	-49.6	173.7	176.7	0	0	0	0	110.6	V143 V147 W150 V172 W181 L367 G368 L373 A374 R375	V143-V371 HydrophobicContact CG1-CG2 4.34Å; V147-V371 HydrophobicContact CG2-CG1 3.98Å; W150-V371 HydrophobicContact CE3-CB 4.44Å; W150-V371 HydrophobicContact CE3-CG1 3.71Å; W150-V371 HydrophobicContact CZ3-CG1 4.34Å; V172-V371 HydrophobicContact CG1-CB 4.26Å; V172-V371 HydrophobicContact CG1-CG1 4.02Å; V172-V371 HydrophobicContact CG1-CG2 4.25Å; W181-V371 HydrophobicContact CH2-CG2 4.43Å; W181-V371 HydrophobicContact CZ2-CG2 4.12Å; L367-V371 HydrophobicContact CD1-CG2 4.43Å; L367-V371 WeakPolarHBondContact O-CG2 3.39Å; L367-V371 PolarHBondContact O-N 3.42Å; G368-V371 PolarHBondContact O-N 3.4Å; V371-L373 VanDerWaalsContact C-N 3.28Å; V371-L373 PolarHBondContact O-N 2.9Å; V371-A374 PolarHBondContact O-N 3.04Å; V371-A374 VanDerWaalsContact O-N 3.1Å; V371-R375 WeakPolarHBondContact O-CG 3.29Å; V371-R375 PolarHBondContact O-N 2.69Å
372	A	98.5	Very high	97.4	Very high	26 Å²	26	43.9 Å²	43.9	22%	0.215	23%	0.229	C	C	.	.	H	α-helix	trans	-55.8	-43.8	179	0	0	0	0	0	112	W150 E169 G368 Q369 R375	W150-A372 HydrophobicContact CH2-CB 3.69Å; W150-A372 HydrophobicContact CZ3-CB 3.71Å; E169-A372 HydrophobicContact CB-CB 4.4Å; G368-A372 WeakPolarHBondContact O-CB 3.42Å; G368-A372 PolarHBondContact O-N 2.93Å; Q369-A372 PolarHBondContact O-N 3.06Å; A372-R375 PolarHBondContact O-N 3.42Å
373	L	98.2	Very high	97.3	Very high	100 Å²	100	46.8 Å²	46.8	52%	0.524	24%	0.244	S	C	.	.	H	α-helix	trans	-66	-41.6	176.4	179.9	62.4	0	0	0	112.3	Q369 V371 R375 V376	Q369-L373 WeakPolarHBondContact O-CB 3.3Å; Q369-L373 PolarHBondContact O-N 3.01Å; V371-L373 VanDerWaalsContact C-N 3.28Å; V371-L373 PolarHBondContact O-N 2.9Å; L373-R375 PolarHBondContact O-N 2.72Å; L373-V376 HydrophobicContact CD1-CG2 4.32Å; L373-V376 WeakPolarHBondContact O-CG2 3.24Å; L373-V376 PolarHBondContact O-N 3.41Å
374	A	98.3	Very high	97.2	Very high	21 Å²	21	50.1 Å²	50.1	17%	0.174	26%	0.262	C	S	.	.	H	α-helix	trans	-68.3	-20.7	179	0	0	0	0	0	113.3	V143 V147 A370 V371 V376	V143-A374 HydrophobicContact CG1-CB 3.56Å; V147-A374 HydrophobicContact CG2-CB 3.77Å; A370-A374 WeakPolarHBondContact O-CB 3.49Å; A370-A374 PolarHBondContact O-N 3.08Å; V371-A374 PolarHBondContact O-N 3.04Å; V371-A374 VanDerWaalsContact O-N 3.1Å; A374-V376 VanDerWaalsContact C-N 3.27Å; A374-V376 PolarHBondContact O-N 2.87Å
375	R	97.3	Very high	97.1	Very high	70 Å²	70	54 Å²	54	26%	0.264	28%	0.282	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.7	-22	174.2	-69.6	-177.3	72.9	-133.3	-0.5	113.7	V147 W150 N151 E154 V371 A372 L373	V147-R375 HydrophobicContact CB-CG 4.36Å; V147-R375 HydrophobicContact CG1-CG 4.06Å; V147-R375 HydrophobicContact CG2-CG 3.95Å; W150-R375 VanDerWaalsContact CD1-CZ 3.44Å; W150-R375 VanDerWaalsContact CD2-CD 3.47Å; W150-R375 VanDerWaalsContact CE2-NH1 3.31Å; N151-R375 PolarHBondContact OD1-NE 2.76Å; N151-R375 PolarHBondContact OD1-NH2 2.94Å; E154-R375 VanDerWaalsContact CD-NH2 3.28Å; E154-R375 IonicContact OE1-CZ 2.89Å; E154-R375 IonicContact OE1-NH1 2.9Å; E154-R375 PolarHBondContact OE1-NH1 2.75Å; E154-R375 IonicContact OE1-NH2 3.82Å; E154-R375 PolarHBondContact OE1-NH2 2.84Å; E154-R375 IonicContact OE2-NH2 3.86Å; E154-R375 PolarHBondContact OE2-NH2 3.41Å; V371-R375 WeakPolarHBondContact O-CG 3.29Å; V371-R375 PolarHBondContact O-N 2.69Å; A372-R375 PolarHBondContact O-N 3.42Å; L373-R375 PolarHBondContact O-N 2.72Å
376	V	94.3	Very high	97	Very high	121 Å²	121	55.4 Å²	55.4	73%	0.733	29%	0.294	S	S	*	.			trans	-108.1	0.1	-173.8	-59.1	0	0	0	0	113.9	L373 A374	L373-V376 HydrophobicContact CD1-CG2 4.32Å; L373-V376 WeakPolarHBondContact O-CG2 3.24Å; L373-V376 PolarHBondContact O-N 3.41Å; A374-V376 VanDerWaalsContact C-N 3.27Å; A374-V376 PolarHBondContact O-N 2.87Å
377	Q	84.9	Confident	96.8	Very high	195 Å²	195	57.8 Å²	57.8	91%	0.911	31%	0.308	S	S	*	.			trans	-93.8	0	172.6	-67.6	178.7	5.9	0	0	109.5

Retrieved 377 of 377 residues in 288.1 ms (Link to these results)

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