A0A087Y2C1_POEFO Loading...

Progestin and adipoQ receptor family member IIIa

AlphaFold DB , UniProt , Accession A0A087Y2C1, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 347 aa.

Structure Viewer

Loading PAE data...

(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	33.2	Very low	28.3	Very low	244 Å²	244	167.5 Å²	167.5	100%	1.202	85%	0.851	S	S	*	*				0	124	0	-82.1	175.1	177.5	0	0	109
2	R	28.2	Very low	28.2	Very low	244 Å²	244	162.2 Å²	162.2	92%	0.921	84%	0.841	S	S	*	*			trans	29.1	112.2	157	-66.2	177	175.7	177.1	-2.3	118.7
3	S	25	Very low	28	Very low	93 Å²	93	162.3 Å²	162.3	65%	0.65	84%	0.844	S	S	*	*				63.1	119.7	75.9	-164.9	0	0	0	0	112.6
4	S	28.8	Very low	27.9	Very low	102 Å²	102	165.4 Å²	165.4	71%	0.713	84%	0.841	S	S	*	*				-174.8	131.1	90	-69.1	0	0	0	0	115.4
5	Y	26.4	Very low	27.8	Very low	193 Å²	193	167.1 Å²	167.1	76%	0.757	84%	0.84	S	S	*	*			trans	47.9	125.3	134.4	-66.6	-82.7	0	0	0	124.5
6	F	26.3	Very low	27.7	Very low	214 Å²	214	170.9 Å²	170.9	94%	0.939	84%	0.844	S	S	*	*				-154.1	139.9	117.2	-124.1	-90.8	0	0	0	112.4
7	K	31.2	Very low	27.7	Very low	182 Å²	182	168.1 Å²	168.1	79%	0.791	84%	0.838	S	S	*	*			trans	-80	161.7	-171.4	-89.5	175.4	173.5	175.8	0	114.4
8	P	30	Very low	27.6	Very low	125 Å²	125	170.1 Å²	170.1	81%	0.812	84%	0.841	S	S	*	*			trans	-88.5	151.1	172.7	35.5	-31.4	0	0	0	113.1
9	Q	29.2	Very low	27.5	Very low	201 Å²	201	170.4 Å²	170.4	94%	0.939	85%	0.845	S	S	*	*			trans	-104	146.7	171.6	-84.5	-163.7	-7.5	0	0	113
10	N	27.7	Very low	27.4	Very low	176 Å²	176	172.1 Å²	172.1	94%	0.941	85%	0.847	S	S	*	*			trans	-56.2	156.9	-176	-87.9	-29	0	0	0	116.9
11	G	25.3	Very low	27.4	Very low	68 Å²	68	168.9 Å²	168.9	70%	0.701	85%	0.849	S	S	*	*				135.4	94.6	123.4	0	0	0	0	0	116.9
12	S	27.6	Very low	26.9	Very low	104 Å²	104	162.7 Å²	162.7	73%	0.727	83%	0.829	S	S	*	*				168.1	101.5	122.1	43.7	0	0	0	0	110.9
13	N	25.5	Very low	26.8	Very low	164 Å²	164	155.5 Å²	155.5	88%	0.877	82%	0.817	S	S	*	*			trans	-76	115.6	168.1	-87	-43.9	0	0	0	109.4
14	Y	26.3	Very low	26.8	Very low	206 Å²	206	160.1 Å²	160.1	81%	0.808	83%	0.828	S	S	*	*			trans	-95	104.1	160.2	-76.9	-82.7	0	0	0	109.3
15	K	26	Very low	26.6	Very low	190 Å²	190	164.3 Å²	164.3	83%	0.826	83%	0.834	S	S	*	*			trans	-77.3	122.4	166.7	-80.1	-179.8	175.7	177.8	0	108.8	T17	K15-T17 PolarHBondContact O-N 3.3Å
16	Y	26.9	Very low	26.6	Very low	229 Å²	229	165.3 Å²	165.3	90%	0.898	84%	0.842	S	S	*	*			trans	-83.4	108.8	163	-85.6	-88.2	0	0	0	109.4
17	T	26.8	Very low	26.6	Very low	122 Å²	122	161.3 Å²	161.3	75%	0.748	84%	0.835	S	S	*	*			trans	-82.3	119.2	173.7	-49.7	0	0	0	0	109.5	K15 L19	K15-T17 PolarHBondContact O-N 3.3Å; T17-L19 PolarHBondContact O-N 3.5Å
18	K	26.1	Very low	26.3	Very low	204 Å²	204	156.4 Å²	156.4	89%	0.887	84%	0.836	S	S	*	*			trans	-63.9	113	167.6	-110.1	178.7	176.5	176.7	0	109.2	K20	K18-K20 PolarHBondContact O-N 3.39Å
19	L	26.1	Very low	26.2	Very low	176 Å²	176	156.1 Å²	156.1	92%	0.921	84%	0.837	S	S	*	*			trans	-79.9	108.1	165.3	-84.3	157	0	0	0	109	T17	T17-L19 PolarHBondContact O-N 3.5Å
20	K	25	Very low	26.6	Very low	204 Å²	204	152.8 Å²	152.8	89%	0.887	83%	0.833	S	S	*	*			trans	-76.7	131.6	160	-87	179.9	173.2	179.5	0	107.9	K18	K18-K20 PolarHBondContact O-N 3.39Å
21	A	27.8	Very low	26.5	Very low	106 Å²	106	147.7 Å²	147.7	88%	0.876	82%	0.822	S	S	*	*			trans	-114.4	113.9	158.8	0	0	0	0	0	108.5
22	S	23.6	Very low	26.6	Very low	113 Å²	113	150.6 Å²	150.6	79%	0.79	83%	0.832	S	S	*	*			trans	-104.7	156.5	147.8	82.7	0	0	0	0	105.1
23	S	25.2	Very low	26.6	Very low	94 Å²	94	150.3 Å²	150.3	66%	0.657	84%	0.835	S	S	*	*			cis	-169.9	156.4	19.4	46.6	0	0	0	0	106.5
24	Q	25.7	Very low	26.7	Very low	190 Å²	190	151.5 Å²	151.5	89%	0.888	84%	0.838	S	S	*	*				175.2	138.5	118.7	-94.5	-178.9	1.8	0	0	112.6
25	F	23.9	Very low	26.7	Very low	190 Å²	190	147 Å²	147	83%	0.833	84%	0.837	S	S	*	*			trans	-65.8	148.9	-179.5	-96.2	-114.7	0	0	0	114	T27	F25-T27 HydrophobicContact CD1-CG2 4.36Å
26	K	27.1	Very low	26.6	Very low	213 Å²	213	147.2 Å²	147.2	93%	0.926	84%	0.841	S	S	*	*			trans	-149	141	131.5	-95.8	-174.6	-174	179.2	0	110
27	T	25.5	Very low	26.7	Very low	131 Å²	131	145.4 Å²	145.4	80%	0.804	84%	0.838	S	S	*	*			trans	-90	149.1	-166.3	45.6	0	0	0	0	114.1	F25	F25-T27 HydrophobicContact CD1-CG2 4.36Å
28	G	25.6	Very low	26.8	Very low	79 Å²	79	145.8 Å²	145.8	81%	0.814	84%	0.842	S	S	*	*			trans	168.4	110.4	162.3	0	0	0	0	0	113.2
29	S	28.2	Very low	26.9	Very low	119 Å²	119	145.2 Å²	145.2	83%	0.832	84%	0.842	S	S	*	*			trans	-92	-174.6	-178.9	-51.7	0	0	0	0	112.6
30	P	37.2	Very low	27	Very low	130 Å²	130	146.4 Å²	146.4	84%	0.844	84%	0.84	S	S	*	*				-125.9	160.6	-71.4	36.7	-21.1	0	0	0	112.5
31	G	25.3	Very low	27.1	Very low	69 Å²	69	144.6 Å²	144.6	71%	0.711	84%	0.84	S	S	*	*			trans	174.6	116.6	167.6	0	0	0	0	0	117.4
32	S	28.1	Very low	27.2	Very low	130 Å²	130	143.9 Å²	143.9	91%	0.909	84%	0.835	S	S	*	*			trans	78.7	121.8	158.9	79.6	0	0	0	0	119.3
33	A	26.9	Very low	27.5	Very low	97 Å²	97	147.7 Å²	147.7	80%	0.802	84%	0.84	S	S	*	*			trans	-84.9	140.5	178	0	0	0	0	0	111.5
34	M	27.5	Very low	27.7	Very low	189 Å²	189	149.5 Å²	149.5	93%	0.931	85%	0.847	S	S	*	*			trans	-160.8	116.2	151.7	-127.9	168.7	162.5	0	0	113.3
35	S	26.2	Very low	27.9	Very low	113 Å²	113	143.4 Å²	143.4	79%	0.79	83%	0.829	S	S	*	*			trans	47.9	109.6	145.6	-151.8	0	0	0	0	120.9
36	Q	24.3	Very low	28	Very low	193 Å²	193	143 Å²	143	90%	0.902	83%	0.83	S	S	*	*			trans	-74.4	132.7	161.9	-71.9	177.2	-13.2	0	0	111.6
37	K	28.5	Very low	28.2	Very low	192 Å²	192	142.7 Å²	142.7	84%	0.835	82%	0.824	S	S	*	*			trans	-122.1	133.2	153.4	-86.8	-176.8	178	176.7	0	108.6	Q39	K37-Q39 PolarHBondContact O-N 3.5Å
38	P	29.2	Very low	28.5	Very low	130 Å²	130	143 Å²	143	84%	0.844	82%	0.82	S	S	*	*			trans	-77.2	122.5	-178.5	28.3	-30.7	0	0	0	111.4	K40	P38-K40 PolarHBondContact O-N 3.22Å
39	Q	27.2	Very low	28.9	Very low	191 Å²	191	148.4 Å²	148.4	89%	0.893	82%	0.823	S	S	*	*			trans	-78.7	112.1	175.7	-157.5	166.7	-1.5	0	0	108.7	K37 N41	K37-Q39 PolarHBondContact O-N 3.5Å; Q39-N41 PolarHBondContact O-N 3.39Å
40	K	29.3	Very low	29.5	Very low	201 Å²	201	147 Å²	147	87%	0.874	81%	0.806	S	S	*	*			trans	-65.4	122.3	173.9	-86.8	-179.8	174.4	177.8	0	109.5	P38 A42	P38-K40 PolarHBondContact O-N 3.22Å; K40-A42 PolarHBondContact O-N 3.15Å
41	N	26.2	Very low	29.3	Very low	167 Å²	167	143.6 Å²	143.6	89%	0.893	80%	0.795	S	S	*	*			trans	-59	102.5	166.6	-83.3	-19.5	0	0	0	110.1	Q39	Q39-N41 PolarHBondContact O-N 3.39Å
42	A	29.4	Very low	29.7	Very low	91 Å²	91	144.4 Å²	144.4	75%	0.752	80%	0.802	S	S	*	*			trans	-81	113.9	165.6	0	0	0	0	0	108.2	K40 T44	K40-A42 PolarHBondContact O-N 3.15Å; A42-T44 PolarHBondContact O-N 3.12Å
43	Q	30.8	Very low	30.3	Very low	192 Å²	192	146.7 Å²	146.7	90%	0.897	79%	0.792	S	S	*	*			trans	-56.3	117	169.4	-74.2	170.8	-20.5	0	0	109	A45	Q43-A45 PolarHBondContact O-N 3.14Å
44	T	28.5	Very low	31	Very low	133 Å²	133	150 Å²	150	82%	0.816	79%	0.792	S	S	*	*			trans	-65.2	101.3	174.9	-10	0	0	0	0	108.5	A42 H46	A42-T44 PolarHBondContact O-N 3.12Å; T44-H46 PolarHBondContact O-N 3.06Å
45	A	30.4	Very low	31.5	Very low	62 Å²	62	151.4 Å²	151.4	51%	0.512	79%	0.788	S	S	.	*			trans	-64.4	113.3	166.4	0	0	0	0	0	107.9	Q43 Y47	Q43-A45 PolarHBondContact O-N 3.14Å; A45-Y47 HydrophobicContact CB-CD2 4.16Å; A45-Y47 HydrophobicContact CB-CE2 3.63Å; A45-Y47 VanDerWaalsContact O-CD2 3.27Å; A45-Y47 WeakPolarHBondContact O-CD2 3.49Å; A45-Y47 PolarHBondContact O-N 2.92Å
46	H	27.2	Very low	31.7	Very low	182 Å²	182	157 Å²	157	84%	0.843	79%	0.792	S	S	*	*			trans	-64.9	96.4	169	-94.8	-85.1	0	0	0	108.7	T44 I48	T44-H46 PolarHBondContact O-N 3.06Å; H46-I48 PolarHBondContact O-N 3.31Å
47	Y	30	Very low	32.4	Very low	205 Å²	205	153.6 Å²	153.6	80%	0.804	79%	0.787	S	S	*	*			trans	-81.1	112.3	164	-67.8	-82.7	0	0	0	107.6	A45 E49	A45-Y47 HydrophobicContact CB-CD2 4.16Å; A45-Y47 HydrophobicContact CB-CE2 3.63Å; A45-Y47 VanDerWaalsContact O-CD2 3.27Å; A45-Y47 WeakPolarHBondContact O-CD2 3.49Å; A45-Y47 PolarHBondContact O-N 2.92Å; Y47-E49 PolarHBondContact O-N 3.22Å
48	I	32.8	Very low	33.4	Very low	139 Å²	139	148.5 Å²	148.5	71%	0.713	77%	0.771	S	S	*	*			trans	-75.4	107.6	168.5	-61.2	173.3	0	0	0	106.2	H46 L50	H46-I48 PolarHBondContact O-N 3.31Å; I48-L50 HydrophobicContact CG2-CD2 4.23Å; I48-L50 HydrophobicContact CG2-CG 4.18Å; I48-L50 PolarHBondContact O-N 3.09Å
49	E	33.3	Very low	34.1	Very low	191 Å²	191	150.5 Å²	150.5	89%	0.893	77%	0.774	S	S	*	*			trans	-63.6	105.2	167	-74.6	-168.1	161.2	0	0	108.6	Y47	Y47-E49 PolarHBondContact O-N 3.22Å
50	L	40.8	Very low	35.1	Very low	91 Å²	91	145.5 Å²	145.5	48%	0.476	76%	0.756	S	S	.	*			trans	-87.7	114.6	172.6	-73	163.9	0	0	0	107.6	I48	I48-L50 HydrophobicContact CG2-CD2 4.23Å; I48-L50 HydrophobicContact CG2-CG 4.18Å; I48-L50 PolarHBondContact O-N 3.09Å
51	G	32.8	Very low	35.9	Very low	58 Å²	58	139.8 Å²	139.8	60%	0.598	74%	0.74	S	S	*	*			trans	-44.5	145.6	-171.9	0	0	0	0	0	115.8	Y53	G51-Y53 PolarHBondContact O-N 3.24Å
52	G	34.1	Very low	37.3	Very low	85 Å²	85	144.2 Å²	144.2	88%	0.876	74%	0.744	S	S	*	*			trans	-64.9	127.8	175.9	0	0	0	0	0	111.4
53	Y	41.8	Very low	39.3	Very low	178 Å²	178	143 Å²	143	70%	0.698	74%	0.74	S	S	*	*			trans	-93	111.3	169.4	-83	-93	0	0	0	108.9	G51	G51-Y53 PolarHBondContact O-N 3.24Å
54	Q	41.4	Very low	41.9	Very low	168 Å²	168	134.5 Å²	134.5	79%	0.785	70%	0.701	S	S	*	*			trans	-91	150.5	161	-150.4	137.1	-11.5	0	0	107.3
55	Y	37	Very low	44.9	Very low	217 Å²	217	133.4 Å²	133.4	85%	0.851	68%	0.682	S	S	*	*	S	Bend	trans	104.1	115.3	179.8	-58.1	-78.5	0	0	0	116.7
56	W	30.8	Very low	48	Very low	230 Å²	230	132.7 Å²	132.7	87%	0.871	67%	0.669	S	S	*	*			trans	85.3	111.3	-179.4	-65.1	111.5	0	0	0	118.9	V58	W56-V58 VanDerWaalsContact C-N 3.29Å; W56-V58 PolarHBondContact O-N 2.82Å
57	P	38.4	Very low	51.2	Low	123 Å²	123	126.1 Å²	126.1	80%	0.799	64%	0.637	S	S	*	*			trans	-83.5	75.2	171.7	35.7	-30.3	0	0	0	109.1
58	V	49	Very low	54.4	Low	84 Å²	84	117.6 Å²	117.6	51%	0.509	61%	0.606	S	S	.	*			trans	-81.6	119.7	157.9	-177.4	0	0	0	0	105.5	W56 V60 L102	W56-V58 VanDerWaalsContact C-N 3.29Å; W56-V58 PolarHBondContact O-N 2.82Å; V58-V60 VanDerWaalsContact C-N 3.26Å; V58-V60 WeakPolarHBondContact O-CG2 3.19Å; V58-V60 PolarHBondContact O-N 2.94Å; V58-L102 HydrophobicContact CG1-CD2 4.49Å
59	L	43.9	Very low	57.4	Low	173 Å²	173	112.7 Å²	112.7	91%	0.906	58%	0.579	S	S	*	*			trans	-54.2	88	174.3	-79.7	150.1	0	0	0	109.7	P61	L59-P61 VanDerWaalsContact O-CD 3.25Å; L59-P61 WeakPolarHBondContact O-CD 3.4Å
60	V	49.4	Very low	60.4	Low	85 Å²	85	109.8 Å²	109.8	52%	0.515	57%	0.565	S	S	.	*			trans	-77	114.9	171.5	-172.4	0	0	0	0	106.1	V58 R62	V58-V60 VanDerWaalsContact C-N 3.26Å; V58-V60 WeakPolarHBondContact O-CG2 3.19Å; V58-V60 PolarHBondContact O-N 2.94Å; V60-R62 PolarHBondContact O-N 3.12Å
61	P	45.4	Very low	63	Low	81 Å²	81	107.9 Å²	107.9	53%	0.526	55%	0.554	S	S	.	*			trans	-51.5	119.2	163	-16.6	27.6	0	0	0	107.2	L59 G63 I101	L59-P61 VanDerWaalsContact O-CD 3.25Å; L59-P61 WeakPolarHBondContact O-CD 3.4Å; P61-G63 PolarHBondContact O-N 3.28Å; P61-I101 HydrophobicContact CB-CD1 4.38Å; P61-I101 HydrophobicContact CG-CD1 3.67Å
62	R	55.3	Low	66	Low	261 Å²	261	105.2 Å²	105.2	99%	0.985	53%	0.526	S	S	*	.	T	Hydrogen-bonded Turn	trans	-38.3	110	179.2	-74.2	178.9	173.4	167.9	-2.3	110.2	V60	V60-R62 PolarHBondContact O-N 3.12Å
63	G	71.3	Confident	68.8	Low	64 Å²	64	102.2 Å²	102.2	66%	0.66	49%	0.491	S	S	*	.	T	Hydrogen-bonded Turn	trans	142.9	-8.1	161.8	0	0	0	0	0	120.2	P61	P61-G63 PolarHBondContact O-N 3.28Å
64	I	86.1	Confident	71.2	Confident	15 Å²	15	98.7 Å²	98.7	8%	0.077	49%	0.488	C	S	.	.			trans	-121.2	110.9	176.7	-59.7	-176.7	0	0	0	110.3	L90 L94 K97 I101	I64-L90 HydrophobicContact CD1-CD1 4.34Å; I64-L90 HydrophobicContact CG2-CD1 4Å; I64-L90 HydrophobicContact CG2-CD2 4.21Å; I64-L94 HydrophobicContact CD1-CB 4.27Å; I64-L94 WeakPolarHBondContact CD1-O 3.47Å; I64-K97 HydrophobicContact CD1-CB 4.4Å; I64-I101 HydrophobicContact CB-CG1 4.44Å; I64-I101 HydrophobicContact CD1-CG1 4.15Å
65	R	91.3	Very high	73.6	Confident	110 Å²	110	92.8 Å²	92.8	42%	0.415	46%	0.46	S	S	.	.			trans	-77.8	136.5	174.7	176.2	176.1	177.3	174.4	3.2	110.2	Y67	R65-Y67 HydrophobicContact CB-CE2 4.42Å; R65-Y67 HydrophobicContact CG-CE1 4.43Å; R65-Y67 HydrophobicContact CG-CE2 4.29Å; R65-Y67 WeakPolarHBondContact O-CE2 3.42Å
66	L	95.1	Very high	76.2	Confident	46 Å²	46	83.5 Å²	83.5	24%	0.241	42%	0.424	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.1	153	167.7	-58.1	178.2	0	0	0	110.4	Y86 R87 I101 L102 Y305	L66-Y86 CarbonylContact C-O 3.58Å; L66-Y86 VanDerWaalsContact CA-O 3.27Å; L66-Y86 WeakPolarHBondContact CA-O 2.98Å; L66-R87 HydrophobicContact CD2-CG 3.81Å; L66-I101 HydrophobicContact CD2-CG2 4.33Å; L66-L102 VanDerWaalsContact CD1-O 3.31Å; L66-L102 WeakPolarHBondContact CD1-O 3.13Å; L66-Y305 HydrophobicContact CD1-CE1 4.44Å
67	Y	96	Very high	79.2	Confident	44 Å²	44	75.3 Å²	75.3	17%	0.173	39%	0.394	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	149.1	-173.8	-64	-90.2	0	0	0	110.6	R65 Q71 Y86 A88 Y89	R65-Y67 HydrophobicContact CB-CE2 4.42Å; R65-Y67 HydrophobicContact CG-CE1 4.43Å; R65-Y67 HydrophobicContact CG-CE2 4.29Å; R65-Y67 WeakPolarHBondContact O-CE2 3.42Å; Y67-Q71 HydrophobicContact CD1-CB 3.93Å; Y67-Y86 PolarHBondContact N-O 3.15Å; Y67-Y86 WeakPolarHBondContact O-CB 3.39Å; Y67-Y86 PolarHBondContact O-N 2.74Å; Y67-A88 HydrophobicContact CD2-CB 3.81Å; Y67-A88 HydrophobicContact CE2-CB 4.04Å; Y67-A88 HydrophobicContact CG-CB 4.42Å; Y67-Y89 HydrophobicContact CE1-CD2 4.34Å; Y67-Y89 HydrophobicContact CE1-CE2 4.38Å; Y67-Y89 HydrophobicContact CE2-CD2 4.21Å; Y67-Y89 AromaticContact CZ-CD2 3.9Å
68	T	96.7	Very high	81.6	Confident	26 Å²	26	73.9 Å²	73.9	16%	0.16	38%	0.376	C	S	.	.			trans	-77.2	162.5	168.3	57.3	0	0	0	0	111.1	E70 Q71 I72 T83	T68-E70 PolarHBondContact O-N 3.04Å; T68-E70 VanDerWaalsContact O-N 3.14Å; T68-Q71 PolarHBondContact O-N 3.44Å; T68-Q71 VanDerWaalsContact OG1-CG 3.29Å; T68-Q71 WeakPolarHBondContact OG1-CG 3.29Å; T68-Q71 PolarHBondContact OG1-OE1 3.18Å; T68-Q71 VanDerWaalsContact OG1-OE1 3.12Å; T68-I72 PolarHBondContact O-N 2.88Å; T68-T83 CarbonylContact C-O 3.21Å; T68-T83 WeakPolarHBondContact CA-O 3.34Å
69	Y	95.8	Very high	83.7	Confident	37 Å²	37	70.7 Å²	70.7	15%	0.145	36%	0.356	C	S	.	.	T	Hydrogen-bonded Turn	trans	-53.3	-34.5	179	-174.1	-93.4	0	0	0	113.3	Q71 I72 R77 N79 P80 I82 T83 Y86	Y69-Q71 VanDerWaalsContact C-N 3.34Å; Y69-I72 HydrophobicContact CD2-CD1 4.4Å; Y69-I72 WeakPolarHBondContact O-CG1 3.27Å; Y69-R77 HydrophobicContact CE1-CB 4.25Å; Y69-R77 HydrophobicContact CE1-CG 4.14Å; Y69-R77 HydrophobicContact CE2-CB 3.99Å; Y69-R77 HydrophobicContact CE2-CG 4.21Å; Y69-R77 PolarHBondContact O-NE 3.43Å; Y69-N79 VanDerWaalsContact CE2-O 3.26Å; Y69-N79 WeakPolarHBondContact CE2-O 3.46Å; Y69-P80 HydrophobicContact CE1-CB 4.46Å; Y69-I82 WeakPolarHBondContact CD2-O 3.47Å; Y69-T83 PolarHBondContact N-O 2.96Å; Y69-Y86 HydrophobicContact CD2-CE2 4.1Å
70	E	95.4	Very high	86.2	Confident	130 Å²	130	65.9 Å²	65.9	61%	0.607	34%	0.335	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.3	-13.9	179.5	-62.8	-55.1	159	0	0	114.3	T68 R77	T68-E70 PolarHBondContact O-N 3.04Å; T68-E70 VanDerWaalsContact O-N 3.14Å; E70-R77 VanDerWaalsContact C-NH2 3.32Å; E70-R77 PolarHBondContact O-NH2 3.33Å; E70-R77 IonicContact OE2-CZ 3.62Å; E70-R77 IonicContact OE2-NH1 2.69Å; E70-R77 PolarHBondContact OE2-NH1 3.06Å; E70-R77 IonicContact OE2-NH2 2.79Å
71	Q	95.4	Very high	88.5	Confident	50 Å²	50	65.1 Å²	65.1	23%	0.234	32%	0.324	C	S	.	.	T	Hydrogen-bonded Turn	trans	-95.5	-12.3	-179.9	-68.6	170.3	-21.3	0	0	113	Y67 T68 Y69	Y67-Q71 HydrophobicContact CD1-CB 3.93Å; T68-Q71 PolarHBondContact O-N 3.44Å; T68-Q71 VanDerWaalsContact OG1-CG 3.29Å; T68-Q71 WeakPolarHBondContact OG1-CG 3.29Å; T68-Q71 PolarHBondContact OG1-OE1 3.18Å; T68-Q71 VanDerWaalsContact OG1-OE1 3.12Å; Y69-Q71 VanDerWaalsContact C-N 3.34Å
72	I	95.9	Very high	91	Very high	2 Å²	2	61.7 Å²	61.7	1%	0.01	30%	0.301	C	S	.	.	S	Bend	trans	-86.4	154.8	-179.6	55.4	164.3	0	0	0	112.9	T68 Y69 L76 R77 Y86 A88	T68-I72 PolarHBondContact O-N 2.88Å; Y69-I72 HydrophobicContact CD2-CD1 4.4Å; Y69-I72 WeakPolarHBondContact O-CG1 3.27Å; I72-L76 HydrophobicContact CB-CB 4.45Å; I72-L76 HydrophobicContact CD1-CB 3.83Å; I72-R77 HydrophobicContact CD1-CG 3.8Å; I72-R77 HydrophobicContact CG1-CG 3.79Å; I72-R77 PolarHBondContact O-NE 3.23Å; I72-R77 PolarHBondContact O-NH2 2.88Å; I72-Y86 HydrophobicContact CD1-CD1 3.71Å; I72-Y86 HydrophobicContact CD1-CD2 4.22Å; I72-Y86 HydrophobicContact CD1-CE1 3.74Å; I72-Y86 HydrophobicContact CD1-CE2 4.25Å; I72-Y86 HydrophobicContact CD1-CG 3.95Å; I72-Y86 HydrophobicContact CG2-CD1 4.46Å; I72-Y86 HydrophobicContact CG2-CG 3.96Å; I72-A88 HydrophobicContact CG2-CB 4.07Å
73	P	94.5	Very high	93	Very high	22 Å²	22	52 Å²	52	14%	0.143	27%	0.271	C	S	.	.			trans	-55.6	147.9	171.3	-25	33.1	0	0	0	113.5	F75 L76 R77 Y89	P73-F75 HydrophobicContact CB-CD1 3.48Å; P73-F75 VanDerWaalsContact CB-CD1 3.48Å; P73-F75 HydrophobicContact CB-CE1 3.24Å; P73-F75 HydrophobicContact CB-CG 4.38Å; P73-F75 HydrophobicContact CB-CZ 3.99Å; P73-F75 HydrophobicContact CG-CD1 4.46Å; P73-F75 HydrophobicContact CG-CE1 3.75Å; P73-F75 HydrophobicContact CG-CZ 4.15Å; P73-F75 PolarHBondContact O-N 3.38Å; P73-F75 VanDerWaalsContact O-N 3.13Å; P73-L76 PolarHBondContact O-N 3.35Å; P73-R77 PolarHBondContact O-N 2.75Å; P73-Y89 WeakPolarHBondContact CD-OH 3.47Å; P73-Y89 HydrophobicContact CG-CE1 3.65Å; P73-Y89 HydrophobicContact CG-CE2 4.39Å; P73-Y89 WeakPolarHBondContact CG-OH 3.38Å
74	V	92.4	Very high	94.1	Very high	105 Å²	105	51.3 Å²	51.3	64%	0.636	25%	0.252	S	S	*	.	G	3₁₀ helix	trans	-57.5	-32	-177.9	-179.4	0	0	0	0	113.2	L76 R77	V74-L76 PolarHBondContact O-N 3.37Å; V74-R77 PolarHBondContact O-N 2.9Å
75	F	90.3	Very high	94.6	Very high	44 Å²	44	50.6 Å²	50.6	19%	0.193	25%	0.248	C	C	.	.	G	3₁₀ helix	trans	-69	-19	178.3	72.5	-96.7	0	0	0	113.6	P73 E170	P73-F75 HydrophobicContact CB-CD1 3.48Å; P73-F75 VanDerWaalsContact CB-CD1 3.48Å; P73-F75 HydrophobicContact CB-CE1 3.24Å; P73-F75 HydrophobicContact CB-CG 4.38Å; P73-F75 HydrophobicContact CB-CZ 3.99Å; P73-F75 HydrophobicContact CG-CD1 4.46Å; P73-F75 HydrophobicContact CG-CE1 3.75Å; P73-F75 HydrophobicContact CG-CZ 4.15Å; P73-F75 PolarHBondContact O-N 3.38Å; P73-F75 VanDerWaalsContact O-N 3.13Å; F75-E170 HydrophobicContact CB-CG 4.29Å; F75-E170 HydrophobicContact CD1-CB 4.11Å; F75-E170 HydrophobicContact CD1-CG 3.79Å; F75-E170 HydrophobicContact CD2-CG 4.23Å; F75-E170 HydrophobicContact CE1-CB 3.95Å; F75-E170 HydrophobicContact CE1-CG 4.14Å; F75-E170 HydrophobicContact CG-CG 3.85Å; F75-E170 HydrophobicContact CZ-CB 4.27Å
76	L	93	Very high	94.9	Very high	21 Å²	21	46 Å²	46	11%	0.11	23%	0.231	C	C	.	.	G	3₁₀ helix	trans	-92.9	-14.3	174.1	-66.9	-178.8	0	0	0	113.2	I72 P73 V74 E78 A88 C165	I72-L76 HydrophobicContact CB-CB 4.45Å; I72-L76 HydrophobicContact CD1-CB 3.83Å; P73-L76 PolarHBondContact O-N 3.35Å; V74-L76 PolarHBondContact O-N 3.37Å; L76-E78 VanDerWaalsContact C-N 3.31Å; L76-E78 PolarHBondContact O-N 3.18Å; L76-A88 HydrophobicContact CD1-CB 4.36Å; L76-C165 HydrophobicContact CD2-CB 4.44Å; L76-C165 WeakPolarHBondContact CD2-O 3.24Å
77	R	92.9	Very high	94.9	Very high	59 Å²	59	44 Å²	44	22%	0.223	22%	0.221	C	C	.	.			trans	-77	78.1	-179.4	-67.3	-173.8	-161.7	-155.7	-2.6	111	Y69 E70 I72 P73 V74 K233	Y69-R77 HydrophobicContact CE1-CB 4.25Å; Y69-R77 HydrophobicContact CE1-CG 4.14Å; Y69-R77 HydrophobicContact CE2-CB 3.99Å; Y69-R77 HydrophobicContact CE2-CG 4.21Å; Y69-R77 PolarHBondContact O-NE 3.43Å; E70-R77 VanDerWaalsContact C-NH2 3.32Å; E70-R77 PolarHBondContact O-NH2 3.33Å; E70-R77 IonicContact OE2-CZ 3.62Å; E70-R77 IonicContact OE2-NH1 2.69Å; E70-R77 PolarHBondContact OE2-NH1 3.06Å; E70-R77 IonicContact OE2-NH2 2.79Å; I72-R77 HydrophobicContact CD1-CG 3.8Å; I72-R77 HydrophobicContact CG1-CG 3.79Å; I72-R77 PolarHBondContact O-NE 3.23Å; I72-R77 PolarHBondContact O-NH2 2.88Å; P73-R77 PolarHBondContact O-N 2.75Å; V74-R77 PolarHBondContact O-N 2.9Å; R77-K233 PolarHBondContact O-NZ 3.32Å
78	E	88.4	Confident	94.9	Very high	93 Å²	93	42 Å²	42	44%	0.435	21%	0.212	S	C	.	.			trans	-98.4	-47.8	178.5	-65.7	-157	162.9	0	0	113.5	L76	L76-E78 VanDerWaalsContact C-N 3.31Å; L76-E78 PolarHBondContact O-N 3.18Å
79	N	94.3	Very high	94.8	Very high	17 Å²	17	46.3 Å²	46.3	9%	0.091	23%	0.227	C	C	.	.			trans	-114.2	103.4	-174.4	-170.1	-4.9	0	0	0	110.4	Y69 Y81 I82 Y86 E296	Y69-N79 VanDerWaalsContact CE2-O 3.26Å; Y69-N79 WeakPolarHBondContact CE2-O 3.46Å; N79-Y81 PolarHBondContact O-N 3.4Å; N79-Y81 WeakPolarHBondContact OD1-CD2 3.34Å; N79-Y81 PolarHBondContact OD1-N 2.94Å; N79-I82 HydrophobicContact CB-CG1 4.28Å; N79-I82 PolarHBondContact O-N 3.14Å; N79-Y86 PolarHBondContact O-OH 2.65Å; N79-E296 PolarHBondContact ND2-OE1 2.87Å
80	P	95.8	Very high	94.7	Very high	72 Å²	72	45.2 Å²	45.2	47%	0.468	22%	0.223	S	C	.	.	T	Hydrogen-bonded Turn	trans	-68.7	-13.5	-176.7	29.8	-35.9	0	0	0	113.8	Y69 I82	Y69-P80 HydrophobicContact CE1-CB 4.46Å; P80-I82 VanDerWaalsContact C-N 3.34Å
81	Y	97.4	Very high	94.7	Very high	69 Å²	69	41.4 Å²	41.4	27%	0.271	21%	0.21	S	C	.	.	T	Hydrogen-bonded Turn	trans	-81.4	-16.2	179.7	-51.8	-60	0	0	0	113.3	N79 K293 E296 R297 P300 G301	N79-Y81 PolarHBondContact O-N 3.4Å; N79-Y81 WeakPolarHBondContact OD1-CD2 3.34Å; N79-Y81 PolarHBondContact OD1-N 2.94Å; Y81-K293 HydrophobicContact CD2-CB 4.07Å; Y81-K293 HydrophobicContact CE2-CB 4.11Å; Y81-E296 WeakPolarHBondContact CB-O 3.5Å; Y81-E296 HydrophobicContact CD2-CG 4.34Å; Y81-E296 HydrophobicContact CG-CG 4.49Å; Y81-R297 HydrophobicContact CD2-CB 3.96Å; Y81-R297 HydrophobicContact CD2-CG 4.49Å; Y81-R297 HydrophobicContact CE1-CB 4.43Å; Y81-R297 HydrophobicContact CE1-CG 4.12Å; Y81-R297 HydrophobicContact CE2-CB 3.76Å; Y81-R297 HydrophobicContact CE2-CG 3.86Å; Y81-R297 HydrophobicContact CG-CB 4.4Å; Y81-P300 HydrophobicContact CD1-CB 4.48Å; Y81-P300 HydrophobicContact CD1-CG 4.09Å; Y81-P300 WeakPolarHBondContact O-CA 3.45Å; Y81-G301 PolarHBondContact O-N 3.39Å
82	I	97.6	Very high	94.6	Very high	8 Å²	8	41.8 Å²	41.8	4%	0.041	22%	0.218	C	C	.	.			trans	-92	109.8	171.1	-55.9	-61.1	0	0	0	106.9	Y69 N79 P80 Y86 N104 E296 L303 N304	Y69-I82 WeakPolarHBondContact CD2-O 3.47Å; N79-I82 HydrophobicContact CB-CG1 4.28Å; N79-I82 PolarHBondContact O-N 3.14Å; P80-I82 VanDerWaalsContact C-N 3.34Å; I82-Y86 HydrophobicContact CB-CE2 4.46Å; I82-Y86 WeakPolarHBondContact CB-OH 3.35Å; I82-Y86 HydrophobicContact CG2-CE2 3.87Å; I82-Y86 WeakPolarHBondContact O-CE2 3.3Å; I82-Y86 PolarHBondContact O-OH 3.5Å; I82-N104 HydrophobicContact CG2-CB 3.97Å; I82-E296 HydrophobicContact CD1-CB 4.05Å; I82-E296 HydrophobicContact CD1-CG 4.15Å; I82-L303 WeakPolarHBondContact CD1-O 3.43Å; I82-N304 WeakPolarHBondContact CA-OD1 3.41Å
83	T	96.8	Very high	94.6	Very high	59 Å²	59	50.4 Å²	50.4	36%	0.362	25%	0.25	S	S	.	.			trans	-100.1	-19.4	-166.7	59.9	0	0	0	0	113.7	T68 Y69 G301 N304	T68-T83 CarbonylContact C-O 3.21Å; T68-T83 WeakPolarHBondContact CA-O 3.34Å; Y69-T83 PolarHBondContact N-O 2.96Å; T83-G301 WeakPolarHBondContact OG1-CA 3.16Å; T83-N304 PolarHBondContact N-OD1 3.03Å; T83-N304 PolarHBondContact OG1-ND2 3.44Å; T83-N304 VanDerWaalsContact OG1-ND2 3.14Å
84	D	95.6	Very high	94.5	Very high	49 Å²	49	51.9 Å²	51.9	26%	0.262	26%	0.257	S	S	.	.	S	Bend	trans	-150.9	175.1	-175.7	-163.7	16.9	0	0	0	112.4	N304	D84-N304 WeakPolarHBondContact CB-ND2 3.48Å; D84-N304 PolarHBondContact N-ND2 3.36Å; D84-N304 VanDerWaalsContact N-ND2 3.18Å
85	G	95.3	Very high	94.7	Very high	0 Å²	0	46.9 Å²	46.9	0%	0	23%	0.226	C	C	.	.			trans	89	12.2	176.3	0	0	0	0	0	114	S103 N104 Y305	G85-S103 WeakPolarHBondContact O-CA 3.16Å; G85-S103 VanDerWaalsContact O-CB 3.31Å; G85-S103 WeakPolarHBondContact O-CB 3.26Å; G85-N104 PolarHBondContact O-N 3.15Å; G85-N104 PolarHBondContact O-OD1 3.26Å; G85-N104 VanDerWaalsContact O-OD1 3.09Å; G85-Y305 WeakPolarHBondContact CA-OH 3.35Å
86	Y	97.4	Very high	95	Very high	13 Å²	13	49.2 Å²	49.2	5%	0.051	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.9	139.6	-177	-71.2	-89.9	0	0	0	112.9	L66 Y67 Y69 I72 N79 I82 N104	L66-Y86 CarbonylContact C-O 3.58Å; L66-Y86 VanDerWaalsContact CA-O 3.27Å; L66-Y86 WeakPolarHBondContact CA-O 2.98Å; Y67-Y86 PolarHBondContact N-O 3.15Å; Y67-Y86 WeakPolarHBondContact O-CB 3.39Å; Y67-Y86 PolarHBondContact O-N 2.74Å; Y69-Y86 HydrophobicContact CD2-CE2 4.1Å; I72-Y86 HydrophobicContact CD1-CD1 3.71Å; I72-Y86 HydrophobicContact CD1-CD2 4.22Å; I72-Y86 HydrophobicContact CD1-CE1 3.74Å; I72-Y86 HydrophobicContact CD1-CE2 4.25Å; I72-Y86 HydrophobicContact CD1-CG 3.95Å; I72-Y86 HydrophobicContact CG2-CD1 4.46Å; I72-Y86 HydrophobicContact CG2-CG 3.96Å; N79-Y86 PolarHBondContact O-OH 2.65Å; I82-Y86 HydrophobicContact CB-CE2 4.46Å; I82-Y86 WeakPolarHBondContact CB-OH 3.35Å; I82-Y86 HydrophobicContact CG2-CE2 3.87Å; I82-Y86 WeakPolarHBondContact O-CE2 3.3Å; I82-Y86 PolarHBondContact O-OH 3.5Å; Y86-N104 WeakPolarHBondContact CA-OD1 3.39Å; Y86-N104 WeakPolarHBondContact CE1-ND2 3.25Å
87	R	96.3	Very high	95	Very high	5 Å²	5	53.5 Å²	53.5	2%	0.019	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.3	136.4	164.7	-62.6	169.1	-64.5	153.5	15.1	108.6	L66 L90 S98 S103 E105 H162 C166	L66-R87 HydrophobicContact CD2-CG 3.81Å; R87-L90 HydrophobicContact CB-CD1 4.2Å; R87-S98 WeakPolarHBondContact CD-OG 3.13Å; R87-S98 PolarHBondContact NH1-OG 3.29Å; R87-S103 PolarHBondContact NE-OG 3.43Å; R87-E105 VanDerWaalsContact NH2-CG 3.25Å; R87-H162 PolarHBondContact NH2-O 3.22Å; R87-C166 VanDerWaalsContact C-CB 3.44Å; R87-C166 HydrophobicContact CB-CB 3.56Å; R87-C166 WeakPolarHBondContact O-CB 3.23Å
88	A	95.2	Very high	95	Very high	0 Å²	0	50.8 Å²	50.8	0%	0	25%	0.247	C	C	.	.			trans	-150.8	160.7	176.5	0	0	0	0	0	112	Y67 I72 L76 L90 C166	Y67-A88 HydrophobicContact CD2-CB 3.81Å; Y67-A88 HydrophobicContact CE2-CB 4.04Å; Y67-A88 HydrophobicContact CG-CB 4.42Å; I72-A88 HydrophobicContact CG2-CB 4.07Å; L76-A88 HydrophobicContact CD1-CB 4.36Å; A88-L90 PolarHBondContact O-N 3.05Å; A88-C166 CarbonylContact C-O 3.52Å
89	Y	95.1	Very high	95.3	Very high	118 Å²	118	47.8 Å²	47.8	46%	0.463	23%	0.234	S	C	.	.	S	Bend	trans	60.7	23.3	174.2	-48.4	-74.4	0	0	0	115.2	Y67 P73 C166	Y67-Y89 HydrophobicContact CE1-CD2 4.34Å; Y67-Y89 HydrophobicContact CE1-CE2 4.38Å; Y67-Y89 HydrophobicContact CE2-CD2 4.21Å; Y67-Y89 AromaticContact CZ-CD2 3.9Å; P73-Y89 WeakPolarHBondContact CD-OH 3.47Å; P73-Y89 HydrophobicContact CG-CE1 3.65Å; P73-Y89 HydrophobicContact CG-CE2 4.39Å; P73-Y89 WeakPolarHBondContact CG-OH 3.38Å; Y89-C166 PolarHBondContact N-O 3.09Å; Y89-C166 VanDerWaalsContact N-O 3.17Å
90	L	93.8	Very high	95.2	Very high	13 Å²	13	54.2 Å²	54.2	7%	0.068	26%	0.262	C	S	.	.	B	Isolated β-bridge	trans	-85.4	137.9	-176.7	-59.9	-172.2	0	0	0	111.8	I64 R87 A88 L94 C166 H167 R168	I64-L90 HydrophobicContact CD1-CD1 4.34Å; I64-L90 HydrophobicContact CG2-CD1 4Å; I64-L90 HydrophobicContact CG2-CD2 4.21Å; R87-L90 HydrophobicContact CB-CD1 4.2Å; A88-L90 PolarHBondContact O-N 3.05Å; L90-L94 HydrophobicContact CB-CB 4.09Å; L90-L94 HydrophobicContact CD1-CB 4.35Å; L90-L94 HydrophobicContact CD2-CB 4.15Å; L90-L94 HydrophobicContact CD2-CD1 4.26Å; L90-L94 HydrophobicContact CG-CB 4.43Å; L90-C166 PolarHBondContact N-O 3.44Å; L90-H167 CarbonylContact O-C 3.35Å; L90-H167 VanDerWaalsContact O-CA 3.29Å; L90-H167 WeakPolarHBondContact O-CA 3.44Å; L90-H167 PolarHBondContact O-CD2 2.72Å; L90-R168 PolarHBondContact O-N 2.95Å
91	P	95.1	Very high	95.1	Very high	51 Å²	51	51.4 Å²	51.4	33%	0.331	24%	0.243	S	C	.	.			trans	-72	158.7	161.1	31.9	-35.2	0	0	0	110.7	R93 L94 C95	P91-R93 VanDerWaalsContact C-N 3.25Å; P91-R93 PolarHBondContact O-N 3.34Å; P91-L94 HydrophobicContact CG-CB 4.18Å; P91-L94 HydrophobicContact CG-CD1 4.07Å; P91-L94 HydrophobicContact CG-CG 3.92Å; P91-L94 WeakPolarHBondContact O-CA 3.31Å; P91-L94 PolarHBondContact O-N 3.19Å; P91-C95 PolarHBondContact O-N 3.04Å
92	S	94.3	Very high	95	Very high	57 Å²	57	52 Å²	52	40%	0.399	25%	0.25	S	S	.	.	H	α-helix	trans	-48.1	-41	-175	-51.5	0	0	0	0	114.9	L94 C95 I96 H167	S92-L94 VanDerWaalsContact C-N 3.32Å; S92-L94 PolarHBondContact O-N 3.01Å; S92-C95 WeakPolarHBondContact O-CB 3.43Å; S92-C95 PolarHBondContact O-N 3.36Å; S92-I96 PolarHBondContact O-N 3.43Å; S92-I96 VanDerWaalsContact O-N 3.1Å; S92-H167 PolarHBondContact N-CD2 2.97Å; S92-H167 PolarHBondContact OG-NE2 2.89Å
93	R	94.1	Very high	94.9	Very high	184 Å²	184	51.6 Å²	51.6	69%	0.694	25%	0.248	S	C	*	.	H	α-helix	trans	-61.7	-39.2	178.1	-173.3	-178.8	179.4	-168	0.5	112.2	P91 K97	P91-R93 VanDerWaalsContact C-N 3.25Å; P91-R93 PolarHBondContact O-N 3.34Å; R93-K97 WeakPolarHBondContact O-CG 3.43Å; R93-K97 PolarHBondContact O-N 2.72Å; R93-K97 VanDerWaalsContact O-N 3.11Å
94	L	94.4	Very high	94.9	Very high	52 Å²	52	49.3 Å²	49.3	27%	0.272	23%	0.233	S	C	.	.	H	α-helix	trans	-77.5	-30.8	177.4	-65.4	-170.7	0	0	0	111.8	I64 L90 P91 S92 I96 K97 S98	I64-L94 HydrophobicContact CD1-CB 4.27Å; I64-L94 WeakPolarHBondContact CD1-O 3.47Å; L90-L94 HydrophobicContact CB-CB 4.09Å; L90-L94 HydrophobicContact CD1-CB 4.35Å; L90-L94 HydrophobicContact CD2-CB 4.15Å; L90-L94 HydrophobicContact CD2-CD1 4.26Å; L90-L94 HydrophobicContact CG-CB 4.43Å; P91-L94 HydrophobicContact CG-CB 4.18Å; P91-L94 HydrophobicContact CG-CD1 4.07Å; P91-L94 HydrophobicContact CG-CG 3.92Å; P91-L94 WeakPolarHBondContact O-CA 3.31Å; P91-L94 PolarHBondContact O-N 3.19Å; S92-L94 VanDerWaalsContact C-N 3.32Å; S92-L94 PolarHBondContact O-N 3.01Å; L94-I96 VanDerWaalsContact C-N 3.31Å; L94-I96 PolarHBondContact O-N 3.19Å; L94-K97 HydrophobicContact CD2-CD 4.08Å; L94-K97 PolarHBondContact O-N 3.03Å; L94-S98 WeakPolarHBondContact O-CB 3.4Å; L94-S98 PolarHBondContact O-N 2.85Å
95	C	95.9	Very high	95	Very high	0 Å²	0	48.3 Å²	48.3	0%	0	23%	0.227	C	C	.	.	H	α-helix	trans	-55.2	-48.9	168.6	-61.1	0	0	0	0	110.4	P91 S92 S98 L163 F164 C166	P91-C95 PolarHBondContact O-N 3.04Å; S92-C95 WeakPolarHBondContact O-CB 3.43Å; S92-C95 PolarHBondContact O-N 3.36Å; C95-S98 WeakPolarHBondContact O-CB 3.36Å; C95-S98 PolarHBondContact O-N 3.09Å; C95-S98 VanDerWaalsContact O-N 3.17Å; C95-S98 PolarHBondContact O-OG 3.18Å; C95-L163 WeakPolarHBondContact CB-O 3.18Å; C95-L163 WeakPolarHBondContact O-CD1 3.38Å; C95-F164 HydrophobicContact CB-CD1 3.61Å; C95-F164 HydrophobicContact CB-CE1 3.78Å; C95-F164 HydrophobicContact CB-CG 4.46Å; C95-C166 VanDerWaalsContact SG-SG 3.66Å
96	I	95.6	Very high	95.1	Very high	93 Å²	93	49.4 Å²	49.4	48%	0.477	23%	0.234	S	C	.	.	H	α-helix	trans	-63.5	-46.9	178	-62.3	167.6	0	0	0	111.5	S92 L94 S98 L99 L163 F164	S92-I96 PolarHBondContact O-N 3.43Å; S92-I96 VanDerWaalsContact O-N 3.1Å; L94-I96 VanDerWaalsContact C-N 3.31Å; L94-I96 PolarHBondContact O-N 3.19Å; I96-S98 PolarHBondContact O-N 3.07Å; I96-L99 WeakPolarHBondContact O-CB 3.4Å; I96-L99 PolarHBondContact O-N 2.81Å; I96-L99 VanDerWaalsContact O-N 3.09Å; I96-L163 HydrophobicContact CG1-CD2 4.34Å; I96-F164 HydrophobicContact CD1-CZ 4.21Å; I96-F164 HydrophobicContact CG1-CE1 4.25Å; I96-F164 HydrophobicContact CG1-CZ 3.82Å
97	K	93.3	Very high	95.2	Very high	112 Å²	112	50.3 Å²	50.3	49%	0.487	24%	0.241	S	C	.	.	H	α-helix	trans	-60.2	-28.2	176.8	-73.7	-172.2	178.6	-171.2	0	112.9	I64 R93 L94 L99 F100	I64-K97 HydrophobicContact CD1-CB 4.4Å; R93-K97 WeakPolarHBondContact O-CG 3.43Å; R93-K97 PolarHBondContact O-N 2.72Å; R93-K97 VanDerWaalsContact O-N 3.11Å; L94-K97 HydrophobicContact CD2-CD 4.08Å; L94-K97 PolarHBondContact O-N 3.03Å; K97-L99 PolarHBondContact O-N 3.26Å; K97-F100 PolarHBondContact O-N 3.39Å
98	S	93.6	Very high	95.3	Very high	1 Å²	1	50.4 Å²	50.4	1%	0.007	24%	0.242	C	C	.	.	G	3₁₀ helix	trans	-70.3	-6.1	179	79.3	0	0	0	0	114.3	R87 L94 C95 I96 F100 I101	R87-S98 WeakPolarHBondContact CD-OG 3.13Å; R87-S98 PolarHBondContact NH1-OG 3.29Å; L94-S98 WeakPolarHBondContact O-CB 3.4Å; L94-S98 PolarHBondContact O-N 2.85Å; C95-S98 WeakPolarHBondContact O-CB 3.36Å; C95-S98 PolarHBondContact O-N 3.09Å; C95-S98 VanDerWaalsContact O-N 3.17Å; C95-S98 PolarHBondContact O-OG 3.18Å; I96-S98 PolarHBondContact O-N 3.07Å; S98-F100 PolarHBondContact O-N 3.49Å; S98-I101 PolarHBondContact O-N 3.08Å
99	L	94.4	Very high	95.4	Very high	31 Å²	31	50.5 Å²	50.5	16%	0.162	24%	0.242	C	C	.	.	G	3₁₀ helix	trans	-53.7	-34.9	170.7	-178.7	65	0	0	0	112.5	I96 K97 I109 W110 L113 L163	I96-L99 WeakPolarHBondContact O-CB 3.4Å; I96-L99 PolarHBondContact O-N 2.81Å; I96-L99 VanDerWaalsContact O-N 3.09Å; K97-L99 PolarHBondContact O-N 3.26Å; L99-I109 HydrophobicContact CD1-CG2 3.39Å; L99-W110 HydrophobicContact CD1-CZ2 4.31Å; L99-W110 HydrophobicContact CG-CZ2 4.11Å; L99-W110 PolarHBondContact O-NE1 2.88Å; L99-W110 VanDerWaalsContact O-NE1 3.12Å; L99-L113 HydrophobicContact CD1-CD2 4.45Å; L99-L163 HydrophobicContact CB-CD1 4.24Å
100	F	92.9	Very high	95.6	Very high	152 Å²	152	48.8 Å²	48.8	67%	0.667	24%	0.235	S	C	*	.	G	3₁₀ helix	trans	-98.7	13.7	179.8	-56.4	-71.9	0	0	0	113.2	K97 S98 W110	K97-F100 PolarHBondContact O-N 3.39Å; S98-F100 PolarHBondContact O-N 3.49Å; F100-W110 HydrophobicContact CD1-CZ2 4.21Å; F100-W110 HydrophobicContact CE1-CH2 4.28Å; F100-W110 AromaticContact CE1-CZ2 3.98Å; F100-W110 HydrophobicContact CE1-CZ2 3.98Å
101	I	92.7	Very high	95.8	Very high	13 Å²	13	48.8 Å²	48.8	7%	0.067	24%	0.236	C	C	.	.	S	Bend	trans	-104.3	129.7	174.9	-57.4	-63.5	0	0	0	108.3	P61 I64 L66 S98 S103 T106	P61-I101 HydrophobicContact CB-CD1 4.38Å; P61-I101 HydrophobicContact CG-CD1 3.67Å; I64-I101 HydrophobicContact CB-CG1 4.44Å; I64-I101 HydrophobicContact CD1-CG1 4.15Å; L66-I101 HydrophobicContact CD2-CG2 4.33Å; S98-I101 PolarHBondContact O-N 3.08Å; I101-S103 PolarHBondContact O-N 2.99Å; I101-T106 PolarHBondContact O-OG1 3.29Å
102	L	95.4	Very high	96	Very high	81 Å²	81	46.5 Å²	46.5	42%	0.424	22%	0.221	S	C	.	.			trans	-68.3	118.1	173.5	-173.7	63.1	0	0	0	109.4	V58 L66 T106 Y305	V58-L102 HydrophobicContact CG1-CD2 4.49Å; L66-L102 VanDerWaalsContact CD1-O 3.31Å; L66-L102 WeakPolarHBondContact CD1-O 3.13Å; L102-T106 WeakPolarHBondContact CA-OG1 3.27Å; L102-T106 HydrophobicContact CD1-CG2 4.23Å; L102-Y305 HydrophobicContact CD1-CD1 4.25Å; L102-Y305 HydrophobicContact CD2-CD1 4.37Å; L102-Y305 HydrophobicContact CG-CD1 3.77Å; L102-Y305 HydrophobicContact CG-CE1 4.19Å; L102-Y305 HydrophobicContact CG-CG 4.46Å
103	S	95.9	Very high	96.2	Very high	0 Å²	0	45.6 Å²	45.6	0%	0	21%	0.211	C	C	.	.			trans	-145.3	170.8	-176.6	67.2	0	0	0	0	109.7	G85 R87 I101 E105 T106	G85-S103 WeakPolarHBondContact O-CA 3.16Å; G85-S103 VanDerWaalsContact O-CB 3.31Å; G85-S103 WeakPolarHBondContact O-CB 3.26Å; R87-S103 PolarHBondContact NE-OG 3.43Å; I101-S103 PolarHBondContact O-N 2.99Å; S103-E105 PolarHBondContact O-N 3.09Å; S103-E105 PolarHBondContact OG-N 2.75Å; S103-T106 PolarHBondContact N-OG1 3.19Å; S103-T106 WeakPolarHBondContact O-CB 3.06Å; S103-T106 PolarHBondContact O-N 2.94Å; S103-T106 VanDerWaalsContact O-N 3.09Å; S103-T106 PolarHBondContact O-OG1 2.83Å; S103-T106 PolarHBondContact OG-N 3.49Å; S103-T106 PolarHBondContact OG-OG1 3.35Å
104	N	96.8	Very high	96.4	Very high	10 Å²	10	41.5 Å²	41.5	5%	0.053	20%	0.203	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.5	-17.4	175.5	75.4	-55.7	0	0	0	113.6	I82 G85 Y86 N304	I82-N104 HydrophobicContact CG2-CB 3.97Å; G85-N104 PolarHBondContact O-N 3.15Å; G85-N104 PolarHBondContact O-OD1 3.26Å; G85-N104 VanDerWaalsContact O-OD1 3.09Å; Y86-N104 WeakPolarHBondContact CA-OD1 3.39Å; Y86-N104 WeakPolarHBondContact CE1-ND2 3.25Å; N104-N304 WeakPolarHBondContact CA-O 3.36Å; N104-N304 VanDerWaalsContact CB-O 3.28Å; N104-N304 WeakPolarHBondContact CB-O 3.23Å
105	E	97.6	Very high	96.6	Very high	28 Å²	28	39.1 Å²	39.1	13%	0.131	19%	0.19	C	C	.	.	T	Hydrogen-bonded Turn	trans	-99.2	-5.9	-179.9	-62.3	-57.1	154.5	0	0	113.8	R87 S103 V107 N108 I109 H162	R87-E105 VanDerWaalsContact NH2-CG 3.25Å; S103-E105 PolarHBondContact O-N 3.09Å; S103-E105 PolarHBondContact OG-N 2.75Å; E105-V107 PolarHBondContact O-N 2.8Å; E105-N108 WeakPolarHBondContact O-CB 3.49Å; E105-N108 PolarHBondContact O-N 2.95Å; E105-N108 VanDerWaalsContact O-N 3.11Å; E105-N108 PolarHBondContact OE2-ND2 3.13Å; E105-I109 HydrophobicContact CB-CD1 4.22Å; E105-I109 WeakPolarHBondContact O-CG1 3.48Å; E105-I109 PolarHBondContact O-N 2.89Å; E105-H162 IonicContact OE2-CE1 3.6Å; E105-H162 IonicContact OE2-CG 3.17Å; E105-H162 IonicContact OE2-ND1 3.96Å; E105-H162 PolarHBondContact OE2-ND1 2.59Å
106	T	97.8	Very high	96.7	Very high	23 Å²	23	41.2 Å²	41.2	14%	0.141	20%	0.2	C	C	.	.	H	α-helix	trans	-57.9	-48.6	-172	-64.1	0	0	0	0	111.5	I101 L102 S103 N108 I109 W110	I101-T106 PolarHBondContact O-OG1 3.29Å; L102-T106 WeakPolarHBondContact CA-OG1 3.27Å; L102-T106 HydrophobicContact CD1-CG2 4.23Å; S103-T106 PolarHBondContact N-OG1 3.19Å; S103-T106 WeakPolarHBondContact O-CB 3.06Å; S103-T106 PolarHBondContact O-N 2.94Å; S103-T106 VanDerWaalsContact O-N 3.09Å; S103-T106 PolarHBondContact O-OG1 2.83Å; S103-T106 PolarHBondContact OG-N 3.49Å; S103-T106 PolarHBondContact OG-OG1 3.35Å; T106-N108 PolarHBondContact O-N 2.91Å; T106-I109 PolarHBondContact O-N 2.93Å; T106-W110 WeakPolarHBondContact O-CB 3.45Å; T106-W110 VanDerWaalsContact O-CD1 3.25Å; T106-W110 PolarHBondContact O-N 2.9Å
107	V	98.3	Very high	96.9	Very high	33 Å²	33	40.6 Å²	40.6	20%	0.2	20%	0.197	C	C	.	.	H	α-helix	trans	-68.3	-35.4	178.7	178.8	0	0	0	0	111.4	E105 I109 W110 S111 Y305 L306 Q311	E105-V107 PolarHBondContact O-N 2.8Å; V107-I109 VanDerWaalsContact C-N 3.33Å; V107-I109 PolarHBondContact O-N 2.92Å; V107-W110 PolarHBondContact O-N 3.22Å; V107-S111 WeakPolarHBondContact O-CB 3.34Å; V107-S111 PolarHBondContact O-N 3.47Å; V107-S111 PolarHBondContact O-OG 3.33Å; V107-Y305 WeakPolarHBondContact CG2-O 3.31Å; V107-L306 HydrophobicContact CG2-CD1 3.8Å; V107-Q311 HydrophobicContact CB-CB 4.29Å; V107-Q311 VanDerWaalsContact CB-CD 3.44Å; V107-Q311 HydrophobicContact CB-CG 3.69Å; V107-Q311 HydrophobicContact CG1-CB 3.73Å; V107-Q311 HydrophobicContact CG1-CG 3.73Å
108	N	98.3	Very high	97.1	Very high	6 Å²	6	38.4 Å²	38.4	3%	0.032	19%	0.19	C	C	.	.	H	α-helix	trans	-61.1	-42.9	176.2	-58.5	-26.6	0	0	0	111.3	E105 T106 S111 H162 Q311 H314	E105-N108 WeakPolarHBondContact O-CB 3.49Å; E105-N108 PolarHBondContact O-N 2.95Å; E105-N108 VanDerWaalsContact O-N 3.11Å; E105-N108 PolarHBondContact OE2-ND2 3.13Å; T106-N108 PolarHBondContact O-N 2.91Å; N108-S111 PolarHBondContact O-OG 3.5Å; N108-H162 HydrophobicContact CB-CB 4.26Å; N108-Q311 WeakPolarHBondContact OD1-CG 3.34Å; N108-H314 PolarHBondContact O-ND1 3.19Å
109	I	98.6	Very high	97.4	Very high	2 Å²	2	38.4 Å²	38.4	1%	0.01	19%	0.19	C	C	.	.	H	α-helix	trans	-68.2	-54.5	176.9	-62.7	165.2	0	0	0	110.7	L99 E105 T106 V107 H112 L113 V159 H162 L163	L99-I109 HydrophobicContact CD1-CG2 3.39Å; E105-I109 HydrophobicContact CB-CD1 4.22Å; E105-I109 WeakPolarHBondContact O-CG1 3.48Å; E105-I109 PolarHBondContact O-N 2.89Å; T106-I109 PolarHBondContact O-N 2.93Å; V107-I109 VanDerWaalsContact C-N 3.33Å; V107-I109 PolarHBondContact O-N 2.92Å; I109-H112 PolarHBondContact O-N 3.45Å; I109-L113 VanDerWaalsContact O-CB 3.3Å; I109-L113 WeakPolarHBondContact O-CB 3.3Å; I109-L113 PolarHBondContact O-N 2.73Å; I109-V159 HydrophobicContact CG2-CG1 4.28Å; I109-H162 HydrophobicContact CG1-CB 3.58Å; I109-L163 HydrophobicContact CD1-CD1 4.14Å
110	W	98.6	Very high	97.6	Very high	83 Å²	83	41.9 Å²	41.9	31%	0.314	20%	0.204	S	C	.	.	H	α-helix	trans	-70.5	-34.6	-172	-80.4	96.8	0	0	0	113.1	L99 F100 T106 V107 H112 L113 L114	L99-W110 HydrophobicContact CD1-CZ2 4.31Å; L99-W110 HydrophobicContact CG-CZ2 4.11Å; L99-W110 PolarHBondContact O-NE1 2.88Å; L99-W110 VanDerWaalsContact O-NE1 3.12Å; F100-W110 HydrophobicContact CD1-CZ2 4.21Å; F100-W110 HydrophobicContact CE1-CH2 4.28Å; F100-W110 AromaticContact CE1-CZ2 3.98Å; F100-W110 HydrophobicContact CE1-CZ2 3.98Å; T106-W110 WeakPolarHBondContact O-CB 3.45Å; T106-W110 VanDerWaalsContact O-CD1 3.25Å; T106-W110 PolarHBondContact O-N 2.9Å; V107-W110 PolarHBondContact O-N 3.22Å; W110-H112 PolarHBondContact O-N 3.44Å; W110-L113 HydrophobicContact CE3-CD2 4.11Å; W110-L113 HydrophobicContact CZ3-CD2 4.08Å; W110-L113 PolarHBondContact O-N 3.27Å; W110-L114 HydrophobicContact CE3-CG 4.48Å; W110-L114 VanDerWaalsContact O-CB 3.27Å; W110-L114 WeakPolarHBondContact O-CB 3.2Å; W110-L114 WeakPolarHBondContact O-CG 3.28Å; W110-L114 PolarHBondContact O-N 2.91Å
111	S	98.6	Very high	97.8	Very high	12 Å²	12	38.4 Å²	38.4	8%	0.084	20%	0.198	C	C	.	.	H	α-helix	trans	-59.2	-46.7	176	55.5	0	0	0	0	112.3	V107 N108 G115 H314	V107-S111 WeakPolarHBondContact O-CB 3.34Å; V107-S111 PolarHBondContact O-N 3.47Å; V107-S111 PolarHBondContact O-OG 3.33Å; N108-S111 PolarHBondContact O-OG 3.5Å; S111-G115 PolarHBondContact O-N 2.66Å; S111-H314 VanDerWaalsContact OG-CB 3.31Å; S111-H314 WeakPolarHBondContact OG-CB 3.35Å
112	H	98.7	Very high	98.1	Very high	3 Å²	3	38.8 Å²	38.8	1%	0.014	20%	0.201	C	C	.	.	H	α-helix	trans	-79.4	-28.8	177.8	-77.6	-171.6	0	0	0	113.2	I109 W110 G115 F116 M155 S158 V159 H314	I109-H112 PolarHBondContact O-N 3.45Å; W110-H112 PolarHBondContact O-N 3.44Å; H112-G115 PolarHBondContact O-N 3.24Å; H112-F116 PolarHBondContact O-N 3.46Å; H112-M155 HydrophobicContact CB-CB 4.44Å; H112-M155 HydrophobicContact CB-SD 3.8Å; H112-M155 PolarHBondContact CD2-SD 3.44Å; H112-S158 PolarHBondContact CE1-OG 3.21Å; H112-S158 WeakPolarHBondContact ND1-CB 3.12Å; H112-S158 PolarHBondContact ND1-OG 3.35Å; H112-V159 HydrophobicContact CB-CG2 3.76Å; H112-H314 AromaticContact CD2-CG 3.84Å; H112-H314 AromaticContact CD2-ND1 3.31Å; H112-H314 PolarHBondContact CD2-ND1 3.41Å; H112-H314 VanDerWaalsContact CD2-ND1 3.31Å; H112-H314 AromaticContact CE1-CE1 3.38Å; H112-H314 PolarHBondContact CE1-CE1 3.33Å; H112-H314 AromaticContact CE1-CG 3.61Å; H112-H314 AromaticContact CE1-ND1 3.04Å; H112-H314 PolarHBondContact CE1-ND1 2.79Å; H112-H314 AromaticContact CG-CE1 3.95Å; H112-H314 AromaticContact CG-ND1 3.26Å; H112-H314 VanDerWaalsContact CG-ND1 3.26Å; H112-H314 AromaticContact ND1-CE1 3.34Å; H112-H314 PolarHBondContact ND1-CE1 2.92Å; H112-H314 VanDerWaalsContact ND1-CE1 3.34Å; H112-H314 AromaticContact ND1-ND1 3.07Å; H112-H314 PolarHBondContact ND1-ND1 2.91Å; H112-H314 WeakPolarHBondContact NE2-CA 3.45Å; H112-H314 WeakPolarHBondContact NE2-CB 3.23Å; H112-H314 AromaticContact NE2-CE1 3.97Å; H112-H314 AromaticContact NE2-CG 3.44Å; H112-H314 AromaticContact NE2-ND1 3.18Å; H112-H314 PolarHBondContact NE2-ND1 3.36Å; H112-H314 VanDerWaalsContact NE2-ND1 3.18Å; H112-H314 PolarHBondContact NE2-O 3.35Å
113	L	98.6	Very high	98.2	Very high	38 Å²	38	35.5 Å²	35.5	20%	0.199	19%	0.186	C	C	.	.	H	α-helix	trans	-65.4	-44.4	172	-177.3	61.3	0	0	0	111.2	L99 I109 W110 G115 F116 L117 V159	L99-L113 HydrophobicContact CD1-CD2 4.45Å; I109-L113 VanDerWaalsContact O-CB 3.3Å; I109-L113 WeakPolarHBondContact O-CB 3.3Å; I109-L113 PolarHBondContact O-N 2.73Å; W110-L113 HydrophobicContact CE3-CD2 4.11Å; W110-L113 HydrophobicContact CZ3-CD2 4.08Å; W110-L113 PolarHBondContact O-N 3.27Å; L113-G115 VanDerWaalsContact C-N 3.33Å; L113-F116 WeakPolarHBondContact O-CB 3.35Å; L113-F116 PolarHBondContact O-N 3.38Å; L113-L117 WeakPolarHBondContact O-CG 3.31Å; L113-L117 PolarHBondContact O-N 3.49Å; L113-L117 VanDerWaalsContact O-N 3.09Å; L113-V159 HydrophobicContact CB-CG2 4.01Å
114	L	98.6	Very high	98.2	Very high	99 Å²	99	39.3 Å²	39.3	52%	0.518	21%	0.209	S	C	.	.	H	α-helix	trans	-66.4	-36.9	172.5	-67.7	173.5	0	0	0	111.3	W110 L117 L118	W110-L114 HydrophobicContact CE3-CG 4.48Å; W110-L114 VanDerWaalsContact O-CB 3.27Å; W110-L114 WeakPolarHBondContact O-CB 3.2Å; W110-L114 WeakPolarHBondContact O-CG 3.28Å; W110-L114 PolarHBondContact O-N 2.91Å; L114-L117 HydrophobicContact CD2-CD1 4.42Å; L114-L117 PolarHBondContact O-N 2.97Å; L114-L118 WeakPolarHBondContact O-CB 3.27Å; L114-L118 PolarHBondContact O-N 3.3Å
115	G	98.6	Very high	98.2	Very high	1 Å²	1	45.6 Å²	45.6	1%	0.01	23%	0.233	C	C	.	.	H	α-helix	trans	-58.4	-45.3	171.4	0	0	0	0	0	112.7	S111 H112 L113 L118 F119	S111-G115 PolarHBondContact O-N 2.66Å; H112-G115 PolarHBondContact O-N 3.24Å; L113-G115 VanDerWaalsContact C-N 3.33Å; G115-L118 WeakPolarHBondContact O-CB 3.45Å; G115-L118 PolarHBondContact O-N 3.11Å; G115-F119 WeakPolarHBondContact O-CD2 3.48Å; G115-F119 PolarHBondContact O-N 3.02Å
116	F	98.8	Very high	98.1	Very high	44 Å²	44	44.8 Å²	44.8	19%	0.193	23%	0.23	C	C	.	.	H	α-helix	trans	-57.7	-49.3	173.2	165.2	-98.8	0	0	0	111.5	H112 L113 L118 F119 F120 Q152 M155 L156	H112-F116 PolarHBondContact O-N 3.46Å; L113-F116 WeakPolarHBondContact O-CB 3.35Å; L113-F116 PolarHBondContact O-N 3.38Å; F116-L118 VanDerWaalsContact C-N 3.31Å; F116-L118 PolarHBondContact O-N 3.48Å; F116-F119 PolarHBondContact O-N 3.44Å; F116-F120 WeakPolarHBondContact O-CB 3.24Å; F116-F120 PolarHBondContact O-N 3.5Å; F116-Q152 HydrophobicContact CD2-CB 3.78Å; F116-Q152 HydrophobicContact CD2-CG 3.9Å; F116-Q152 HydrophobicContact CE2-CB 3.97Å; F116-Q152 HydrophobicContact CE2-CG 4.08Å; F116-M155 HydrophobicContact CB-CB 4.04Å; F116-L156 HydrophobicContact CB-CD2 4.4Å; F116-L156 HydrophobicContact CD1-CD2 4.16Å; F116-L156 HydrophobicContact CD2-CD1 3.8Å; F116-L156 HydrophobicContact CD2-CD2 3.84Å; F116-L156 HydrophobicContact CD2-CG 3.57Å; F116-L156 HydrophobicContact CE1-CD2 4.46Å; F116-L156 HydrophobicContact CE2-CD1 3.6Å; F116-L156 HydrophobicContact CE2-CD2 4.16Å; F116-L156 HydrophobicContact CE2-CG 3.92Å; F116-L156 HydrophobicContact CG-CD2 3.84Å; F116-L156 HydrophobicContact CG-CG 4.06Å; F116-L156 HydrophobicContact CZ-CD1 4.27Å; F116-L156 HydrophobicContact CZ-CD2 4.46Å
117	L	98.7	Very high	98	Very high	81 Å²	81	46.2 Å²	46.2	42%	0.424	24%	0.235	S	C	.	.	H	α-helix	trans	-61.6	-40	178.3	-67.5	174.4	0	0	0	111.9	L113 L114 F120 C121	L113-L117 WeakPolarHBondContact O-CG 3.31Å; L113-L117 PolarHBondContact O-N 3.49Å; L113-L117 VanDerWaalsContact O-N 3.09Å; L114-L117 HydrophobicContact CD2-CD1 4.42Å; L114-L117 PolarHBondContact O-N 2.97Å; L117-F120 PolarHBondContact O-N 2.93Å; L117-C121 WeakPolarHBondContact O-CB 3.5Å; L117-C121 PolarHBondContact O-N 2.78Å; L117-C121 PolarHBondContact O-SG 3.41Å; L117-C121 VanDerWaalsContact O-SG 3.32Å
118	L	98.6	Very high	97.9	Very high	66 Å²	66	47.8 Å²	47.8	35%	0.346	25%	0.252	S	S	.	.	H	α-helix	trans	-57.8	-53.6	174.3	173.2	65.8	0	0	0	111.1	L114 G115 F116 F120 C121 V122 V318 Y322	L114-L118 WeakPolarHBondContact O-CB 3.27Å; L114-L118 PolarHBondContact O-N 3.3Å; G115-L118 WeakPolarHBondContact O-CB 3.45Å; G115-L118 PolarHBondContact O-N 3.11Å; F116-L118 VanDerWaalsContact C-N 3.31Å; F116-L118 PolarHBondContact O-N 3.48Å; L118-F120 VanDerWaalsContact C-N 3.3Å; L118-F120 PolarHBondContact O-N 3.11Å; L118-C121 PolarHBondContact O-N 3.48Å; L118-V122 HydrophobicContact CD1-CG2 4.02Å; L118-V122 HydrophobicContact CG-CG2 4.43Å; L118-V122 WeakPolarHBondContact O-CB 3.49Å; L118-V122 VanDerWaalsContact O-CG2 3.24Å; L118-V122 WeakPolarHBondContact O-CG2 3.09Å; L118-V122 PolarHBondContact O-N 3.17Å; L118-V318 HydrophobicContact CD2-CG1 4.12Å; L118-Y322 HydrophobicContact CD2-CD2 4.29Å
119	F	98.6	Very high	97.7	Very high	0 Å²	0	50.1 Å²	50.1	0%	0	27%	0.269	C	S	.	.	H	α-helix	trans	-67.9	-30.1	-179	-66.8	-59.9	0	0	0	112.9	G115 F116 G123 L148 F151 Q152 M155 V318 F321	G115-F119 WeakPolarHBondContact O-CD2 3.48Å; G115-F119 PolarHBondContact O-N 3.02Å; F116-F119 PolarHBondContact O-N 3.44Å; F119-G123 PolarHBondContact O-N 3.28Å; F119-L148 HydrophobicContact CB-CD2 4.38Å; F119-L148 HydrophobicContact CD1-CD2 4.07Å; F119-F151 HydrophobicContact CD1-CB 4.41Å; F119-F151 HydrophobicContact CD1-CD2 4.1Å; F119-F151 HydrophobicContact CD2-CB 4.04Å; F119-F151 HydrophobicContact CE1-CD2 4.05Å; F119-F151 HydrophobicContact CE2-CB 4.37Å; F119-F151 HydrophobicContact CG-CB 4.11Å; F119-Q152 HydrophobicContact CB-CG 3.78Å; F119-M155 HydrophobicContact CD2-CG 4.41Å; F119-M155 HydrophobicContact CE2-CE 4.16Å; F119-V318 HydrophobicContact CE2-CG1 4.42Å; F119-F321 HydrophobicContact CE1-CB 3.96Å; F119-F321 HydrophobicContact CE2-CB 4.01Å; F119-F321 HydrophobicContact CE2-CD2 4.27Å; F119-F321 HydrophobicContact CZ-CB 3.34Å; F119-F321 HydrophobicContact CZ-CD2 4.43Å; F119-F321 HydrophobicContact CZ-CG 4.42Å
120	F	98.4	Very high	97.4	Very high	105 Å²	105	51.8 Å²	51.8	46%	0.461	28%	0.279	S	S	.	.	H	α-helix	trans	-64.3	-52	171.2	179.6	-97.4	0	0	0	111.2	F116 L117 L118 V122 G123 V124	F116-F120 WeakPolarHBondContact O-CB 3.24Å; F116-F120 PolarHBondContact O-N 3.5Å; L117-F120 PolarHBondContact O-N 2.93Å; L118-F120 VanDerWaalsContact C-N 3.3Å; L118-F120 PolarHBondContact O-N 3.11Å; F120-V122 PolarHBondContact O-N 2.68Å; F120-G123 PolarHBondContact O-N 3.4Å; F120-G123 VanDerWaalsContact O-N 3.13Å; F120-V124 HydrophobicContact CD1-CG2 4.44Å; F120-V124 HydrophobicContact CE1-CG2 4.02Å; F120-V124 HydrophobicContact CE2-CG2 4.47Å; F120-V124 HydrophobicContact CZ-CG2 4.04Å; F120-V124 WeakPolarHBondContact O-CG2 3.28Å; F120-V124 PolarHBondContact O-N 2.82Å
121	C	98.4	Very high	97.2	Very high	79 Å²	79	47.9 Å²	47.9	53%	0.534	26%	0.264	S	S	.	.	H	α-helix	trans	-62	-43.4	178.1	-71	0	0	0	0	112.1	L117 L118 G123 V124 Y125	L117-C121 WeakPolarHBondContact O-CB 3.5Å; L117-C121 PolarHBondContact O-N 2.78Å; L117-C121 PolarHBondContact O-SG 3.41Å; L117-C121 VanDerWaalsContact O-SG 3.32Å; L118-C121 PolarHBondContact O-N 3.48Å; C121-G123 VanDerWaalsContact C-N 3.3Å; C121-G123 PolarHBondContact O-N 2.94Å; C121-V124 PolarHBondContact O-N 3.4Å; C121-Y125 WeakPolarHBondContact O-CB 3.36Å; C121-Y125 PolarHBondContact O-N 3.39Å
122	V	97.7	Very high	97	Very high	21 Å²	21	49.9 Å²	49.9	13%	0.127	28%	0.277	C	S	.	.	H	α-helix	trans	-60.2	-41.5	173.5	166.4	0	0	0	0	110.6	L118 F120 Y125 N126 L148 H325	L118-V122 HydrophobicContact CD1-CG2 4.02Å; L118-V122 HydrophobicContact CG-CG2 4.43Å; L118-V122 WeakPolarHBondContact O-CB 3.49Å; L118-V122 VanDerWaalsContact O-CG2 3.24Å; L118-V122 WeakPolarHBondContact O-CG2 3.09Å; L118-V122 PolarHBondContact O-N 3.17Å; F120-V122 PolarHBondContact O-N 2.68Å; V122-Y125 PolarHBondContact O-N 2.9Å; V122-N126 WeakPolarHBondContact CG1-ND2 3.49Å; V122-N126 WeakPolarHBondContact O-CB 3.13Å; V122-N126 PolarHBondContact O-N 3.34Å; V122-N126 PolarHBondContact O-ND2 2.91Å; V122-N126 VanDerWaalsContact O-ND2 3.11Å; V122-L148 HydrophobicContact CG1-CD2 4.17Å; V122-H325 WeakPolarHBondContact CG1-NE2 3.43Å
123	G	97.1	Very high	96.7	Very high	11 Å²	11	53.7 Å²	53.7	11%	0.113	30%	0.304	C	S	.	.	H	α-helix	trans	-62.3	-48.6	175.6	0	0	0	0	0	112.9	F119 F120 C121 Y125 N126 M127	F119-G123 PolarHBondContact O-N 3.28Å; F120-G123 PolarHBondContact O-N 3.4Å; F120-G123 VanDerWaalsContact O-N 3.13Å; C121-G123 VanDerWaalsContact C-N 3.3Å; C121-G123 PolarHBondContact O-N 2.94Å; G123-Y125 VanDerWaalsContact C-N 3.35Å; G123-Y125 PolarHBondContact O-N 2.91Å; G123-N126 PolarHBondContact O-N 3.13Å; G123-M127 VanDerWaalsContact O-CG 3.23Å; G123-M127 WeakPolarHBondContact O-CG 3.43Å; G123-M127 PolarHBondContact O-N 3.39Å
124	V	97.6	Very high	96.2	Very high	80 Å²	80	54.3 Å²	54.3	49%	0.485	31%	0.307	S	S	.	.	H	α-helix	trans	-58.4	-47.8	175.5	173.9	0	0	0	0	110.7	F120 C121 N126 M127 A128	F120-V124 HydrophobicContact CD1-CG2 4.44Å; F120-V124 HydrophobicContact CE1-CG2 4.02Å; F120-V124 HydrophobicContact CE2-CG2 4.47Å; F120-V124 HydrophobicContact CZ-CG2 4.04Å; F120-V124 WeakPolarHBondContact O-CG2 3.28Å; F120-V124 PolarHBondContact O-N 2.82Å; C121-V124 PolarHBondContact O-N 3.4Å; V124-N126 PolarHBondContact O-N 3.31Å; V124-M127 PolarHBondContact O-N 3.47Å; V124-A128 WeakPolarHBondContact O-CB 3.26Å; V124-A128 PolarHBondContact O-N 3.1Å
125	Y	96.7	Very high	95.8	Very high	142 Å²	142	57.6 Å²	57.6	56%	0.557	32%	0.319	S	S	*	.	H	α-helix	trans	-60.6	-42.6	178.3	176.9	-108.9	0	0	0	112.5	C121 V122 G123 A128 S129 V130	C121-Y125 WeakPolarHBondContact O-CB 3.36Å; C121-Y125 PolarHBondContact O-N 3.39Å; V122-Y125 PolarHBondContact O-N 2.9Å; G123-Y125 VanDerWaalsContact C-N 3.35Å; G123-Y125 PolarHBondContact O-N 2.91Å; Y125-A128 PolarHBondContact O-N 3.31Å; Y125-S129 WeakPolarHBondContact O-CA 3.46Å; Y125-S129 WeakPolarHBondContact O-CB 3.44Å; Y125-S129 PolarHBondContact O-N 3.04Å; Y125-V130 HydrophobicContact CD1-CG2 3.73Å; Y125-V130 HydrophobicContact CE1-CG2 3.34Å; Y125-V130 PolarHBondContact O-N 3.44Å
126	N	94.9	Very high	95.4	Very high	11 Å²	11	58.2 Å²	58.2	6%	0.059	32%	0.324	C	S	.	.	I	π-helix	trans	-66.4	-43.1	179	-72.6	-27.4	0	0	0	112.4	V122 G123 V124 V130 L131 H325	V122-N126 WeakPolarHBondContact CG1-ND2 3.49Å; V122-N126 WeakPolarHBondContact O-CB 3.13Å; V122-N126 PolarHBondContact O-N 3.34Å; V122-N126 PolarHBondContact O-ND2 2.91Å; V122-N126 VanDerWaalsContact O-ND2 3.11Å; G123-N126 PolarHBondContact O-N 3.13Å; V124-N126 PolarHBondContact O-N 3.31Å; N126-V130 HydrophobicContact CB-CB 4.45Å; N126-V130 PolarHBondContact O-N 3.28Å; N126-V130 WeakPolarHBondContact OD1-CG2 3.13Å; N126-L131 WeakPolarHBondContact O-CB 3.36Å; N126-L131 WeakPolarHBondContact O-CG 3.38Å; N126-L131 PolarHBondContact O-N 3.47Å; N126-H325 PolarHBondContact ND2-CE1 3.27Å; N126-H325 PolarHBondContact ND2-NE2 2.88Å
127	M	94.8	Very high	95.1	Very high	53 Å²	53	57.9 Å²	57.9	26%	0.261	33%	0.328	S	S	.	.	I	π-helix	trans	-68.8	-37.1	179	-64.5	-61	122.9	0	0	112	G123 V124 L131 P132 Y141	G123-M127 VanDerWaalsContact O-CG 3.23Å; G123-M127 WeakPolarHBondContact O-CG 3.43Å; G123-M127 PolarHBondContact O-N 3.39Å; V124-M127 PolarHBondContact O-N 3.47Å; M127-L131 HydrophobicContact CE-CD1 3.32Å; M127-L131 HydrophobicContact CE-CG 4.46Å; M127-L131 HydrophobicContact SD-CD1 3.82Å; M127-P132 WeakPolarHBondContact O-CD 3.46Å; M127-P132 WeakPolarHBondContact O-CG 3.46Å; M127-Y141 HydrophobicContact SD-CD1 3.61Å; M127-Y141 HydrophobicContact SD-CE1 4.22Å
128	A	96.3	Very high	94.9	Very high	67 Å²	67	64.6 Å²	64.6	55%	0.554	35%	0.347	S	S	*	.	I	π-helix	trans	-87.8	-26.5	-174.9	0	0	0	0	0	114	V124 Y125	V124-A128 WeakPolarHBondContact O-CB 3.26Å; V124-A128 PolarHBondContact O-N 3.1Å; Y125-A128 PolarHBondContact O-N 3.31Å
129	S	94.6	Very high	94.6	Very high	55 Å²	55	66.3 Å²	66.3	39%	0.385	35%	0.354	S	S	.	.	I	π-helix	trans	-129.6	-53.8	-170.7	-54.4	0	0	0	0	113.1	Y125 S133	Y125-S129 WeakPolarHBondContact O-CA 3.46Å; Y125-S129 WeakPolarHBondContact O-CB 3.44Å; Y125-S129 PolarHBondContact O-N 3.04Å; S129-S133 VanDerWaalsContact O-CB 3.23Å; S129-S133 WeakPolarHBondContact O-CB 3.33Å; S129-S133 PolarHBondContact O-N 3.12Å; S129-S133 VanDerWaalsContact O-N 3.09Å; S129-S133 PolarHBondContact O-OG 3.25Å
130	V	92.9	Very high	94.4	Very high	37 Å²	37	66.3 Å²	66.3	22%	0.224	35%	0.354	C	S	.	.	I	π-helix	trans	-69	-55.6	-171.9	-177.9	0	0	0	0	112	Y125 N126 S133 I134	Y125-V130 HydrophobicContact CD1-CG2 3.73Å; Y125-V130 HydrophobicContact CE1-CG2 3.34Å; Y125-V130 PolarHBondContact O-N 3.44Å; N126-V130 HydrophobicContact CB-CB 4.45Å; N126-V130 PolarHBondContact O-N 3.28Å; N126-V130 WeakPolarHBondContact OD1-CG2 3.13Å; V130-S133 PolarHBondContact O-N 2.9Å; V130-S133 PolarHBondContact O-OG 3.19Å; V130-I134 PolarHBondContact O-N 3.37Å
131	L	93.7	Very high	94.2	Very high	0 Å²	0	64.8 Å²	64.8	0%	0	35%	0.345	C	S	.	.	H	α-helix	trans	-63.2	-41.4	-177.3	-65.3	-179.2	0	0	0	112.9	N126 M127 I134 H135 A136 D140 Y141 M332	N126-L131 WeakPolarHBondContact O-CB 3.36Å; N126-L131 WeakPolarHBondContact O-CG 3.38Å; N126-L131 PolarHBondContact O-N 3.47Å; M127-L131 HydrophobicContact CE-CD1 3.32Å; M127-L131 HydrophobicContact CE-CG 4.46Å; M127-L131 HydrophobicContact SD-CD1 3.82Å; L131-I134 WeakPolarHBondContact O-CG1 3.46Å; L131-H135 PolarHBondContact O-N 3.17Å; L131-A136 HydrophobicContact CB-CB 3.88Å; L131-A136 HydrophobicContact CD2-CB 3.76Å; L131-A136 HydrophobicContact CG-CB 4.37Å; L131-A136 VanDerWaalsContact O-CB 3.3Å; L131-A136 WeakPolarHBondContact O-CB 3.42Å; L131-A136 PolarHBondContact O-N 3.22Å; L131-D140 HydrophobicContact CD2-CB 4.38Å; L131-Y141 HydrophobicContact CB-CD1 4.4Å; L131-Y141 HydrophobicContact CB-CE1 3.76Å; L131-Y141 HydrophobicContact CB-CE2 4.02Å; L131-Y141 HydrophobicContact CD1-CD1 3.53Å; L131-Y141 HydrophobicContact CD1-CD2 4.23Å; L131-Y141 HydrophobicContact CD1-CE1 3.73Å; L131-Y141 HydrophobicContact CD1-CE2 4.4Å; L131-Y141 HydrophobicContact CD1-CG 3.79Å; L131-Y141 HydrophobicContact CG-CE1 4.43Å; L131-M332 HydrophobicContact CD2-CE 4.07Å; L131-M332 HydrophobicContact CD2-SD 3.68Å
132	P	94.4	Very high	94.1	Very high	54 Å²	54	64.7 Å²	64.7	35%	0.351	34%	0.342	S	S	.	.	H	α-helix	trans	-61.2	-41.2	171.7	-25.8	35.4	0	0	0	113.3	M127 I134 H135 Y141	M127-P132 WeakPolarHBondContact O-CD 3.46Å; M127-P132 WeakPolarHBondContact O-CG 3.46Å; P132-I134 PolarHBondContact O-N 2.65Å; P132-H135 PolarHBondContact O-N 3.18Å; P132-Y141 WeakPolarHBondContact CD-OH 3.46Å
133	S	91.6	Very high	94	Very high	83 Å²	83	64.5 Å²	64.5	58%	0.58	34%	0.34	S	S	*	.	H	α-helix	trans	-62.8	-27.2	-176.2	71.5	0	0	0	0	114.1	S129 V130	S129-S133 VanDerWaalsContact O-CB 3.23Å; S129-S133 WeakPolarHBondContact O-CB 3.33Å; S129-S133 PolarHBondContact O-N 3.12Å; S129-S133 VanDerWaalsContact O-N 3.09Å; S129-S133 PolarHBondContact O-OG 3.25Å; V130-S133 PolarHBondContact O-N 2.9Å; V130-S133 PolarHBondContact O-OG 3.19Å
134	I	89.4	Confident	93.8	Very high	52 Å²	52	64.4 Å²	64.4	27%	0.267	34%	0.336	S	S	.	.	T	Hydrogen-bonded Turn	trans	-101.2	8.3	178.4	67.5	173.5	0	0	0	112.9	V130 L131 P132 A136 M332	V130-I134 PolarHBondContact O-N 3.37Å; L131-I134 WeakPolarHBondContact O-CG1 3.46Å; P132-I134 PolarHBondContact O-N 2.65Å; I134-A136 HydrophobicContact CD1-CB 4.13Å; I134-A136 HydrophobicContact CG1-CB 3.89Å; I134-A136 PolarHBondContact O-N 3.2Å; I134-M332 HydrophobicContact CD1-CE 3.34Å; I134-M332 HydrophobicContact CD1-CG 4.49Å; I134-M332 HydrophobicContact CD1-SD 3.93Å
135	H	89.9	Confident	93.7	Very high	167 Å²	167	63.3 Å²	63.3	77%	0.773	33%	0.332	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.2	43.3	-174.8	-55	80.8	0	0	0	112.4	L131 P132	L131-H135 PolarHBondContact O-N 3.17Å; P132-H135 PolarHBondContact O-N 3.18Å
136	A	91.1	Very high	93.8	Very high	14 Å²	14	59.7 Å²	59.7	12%	0.116	32%	0.322	C	S	.	.			trans	-58.3	147.7	-173.6	0	0	0	0	0	112.4	L131 I134 D140 Y141	L131-A136 HydrophobicContact CB-CB 3.88Å; L131-A136 HydrophobicContact CD2-CB 3.76Å; L131-A136 HydrophobicContact CG-CB 4.37Å; L131-A136 VanDerWaalsContact O-CB 3.3Å; L131-A136 WeakPolarHBondContact O-CB 3.42Å; L131-A136 PolarHBondContact O-N 3.22Å; I134-A136 HydrophobicContact CD1-CB 4.13Å; I134-A136 HydrophobicContact CG1-CB 3.89Å; I134-A136 PolarHBondContact O-N 3.2Å; A136-D140 HydrophobicContact CB-CB 3.91Å; A136-Y141 HydrophobicContact CB-CE2 4.08Å
137	S	92.3	Very high	93.8	Very high	38 Å²	38	59.3 Å²	59.3	27%	0.266	32%	0.321	S	S	.	.			trans	-73	160.8	178.6	72.3	0	0	0	0	111.4	E139 D140 Y141	S137-E139 PolarHBondContact O-N 2.97Å; S137-E139 VanDerWaalsContact O-N 3.17Å; S137-D140 WeakPolarHBondContact CB-OD2 3.33Å; S137-D140 PolarHBondContact N-OD2 2.79Å; S137-D140 WeakPolarHBondContact O-CB 3.47Å; S137-D140 PolarHBondContact O-N 3.09Å; S137-D140 VanDerWaalsContact OG-CG 3.27Å; S137-D140 PolarHBondContact OG-N 2.86Å; S137-D140 PolarHBondContact OG-OD2 2.69Å; S137-Y141 VanDerWaalsContact O-CD2 3.3Å; S137-Y141 WeakPolarHBondContact O-CD2 3.46Å; S137-Y141 PolarHBondContact O-N 2.9Å
138	R	93.4	Very high	94	Very high	221 Å²	221	57 Å²	57	83%	0.834	31%	0.31	S	S	*	.	H	α-helix	trans	-56.1	-34.1	174.9	-164.8	-177.6	-154.9	-171.7	7.1	112.6	D140 Y141 V142	R138-D140 VanDerWaalsContact C-N 3.32Å; R138-Y141 PolarHBondContact O-N 3.46Å; R138-V142 WeakPolarHBondContact O-CG2 3.31Å; R138-V142 PolarHBondContact O-N 3.26Å
139	E	92.8	Very high	94.1	Very high	103 Å²	103	59.8 Å²	59.8	48%	0.481	31%	0.309	S	S	.	.	H	α-helix	trans	-64	-39.2	177.4	-60.6	-173.1	168.1	0	0	111.3	S137 Y141 V142 I143 F197	S137-E139 PolarHBondContact O-N 2.97Å; S137-E139 VanDerWaalsContact O-N 3.17Å; E139-Y141 PolarHBondContact O-N 3.24Å; E139-V142 PolarHBondContact O-N 3.29Å; E139-V142 VanDerWaalsContact O-N 3.16Å; E139-I143 WeakPolarHBondContact O-CB 3.31Å; E139-I143 VanDerWaalsContact O-CG1 3.29Å; E139-I143 WeakPolarHBondContact O-CG1 3.35Å; E139-I143 PolarHBondContact O-N 3.41Å; E139-F197 HydrophobicContact CB-CZ 3.94Å; E139-F197 WeakPolarHBondContact OE2-CZ 3.5Å
140	D	93.7	Very high	94.3	Very high	0 Å²	0	57.5 Å²	57.5	0%	0	29%	0.293	C	S	.	.	H	α-helix	trans	-61.3	-44.3	176.9	-62.7	-53.3	0	0	0	111.7	L131 A136 S137 R138 V142 I143 Y144 Y198 M332 H336	L131-D140 HydrophobicContact CD2-CB 4.38Å; A136-D140 HydrophobicContact CB-CB 3.91Å; S137-D140 WeakPolarHBondContact CB-OD2 3.33Å; S137-D140 PolarHBondContact N-OD2 2.79Å; S137-D140 WeakPolarHBondContact O-CB 3.47Å; S137-D140 PolarHBondContact O-N 3.09Å; S137-D140 VanDerWaalsContact OG-CG 3.27Å; S137-D140 PolarHBondContact OG-N 2.86Å; S137-D140 PolarHBondContact OG-OD2 2.69Å; R138-D140 VanDerWaalsContact C-N 3.32Å; D140-V142 VanDerWaalsContact C-N 3.29Å; D140-V142 PolarHBondContact O-N 3.35Å; D140-I143 PolarHBondContact O-N 2.79Å; D140-Y144 WeakPolarHBondContact O-CB 3.42Å; D140-Y144 WeakPolarHBondContact O-CD2 3.35Å; D140-Y144 PolarHBondContact O-N 3.33Å; D140-Y198 WeakPolarHBondContact OD1-CE1 3.44Å; D140-Y198 PolarHBondContact OD1-OH 2.93Å; D140-M332 HydrophobicContact CB-SD 4.26Å; D140-H336 IonicContact OD1-NE2 2.74Å; D140-H336 IonicContact OD2-CE1 2.65Å; D140-H336 PolarHBondContact OD2-CE1 3.39Å; D140-H336 IonicContact OD2-NE2 3.51Å; D140-H336 PolarHBondContact OD2-NE2 3.36Å
141	Y	95.6	Very high	94.5	Very high	73 Å²	73	56 Å²	56	29%	0.286	28%	0.283	S	S	.	.	H	α-helix	trans	-57.1	-44.1	174.9	-77	-93.4	0	0	0	111.5	M127 L131 P132 A136 S137 R138 E139 S145	M127-Y141 HydrophobicContact SD-CD1 3.61Å; M127-Y141 HydrophobicContact SD-CE1 4.22Å; L131-Y141 HydrophobicContact CB-CD1 4.4Å; L131-Y141 HydrophobicContact CB-CE1 3.76Å; L131-Y141 HydrophobicContact CB-CE2 4.02Å; L131-Y141 HydrophobicContact CD1-CD1 3.53Å; L131-Y141 HydrophobicContact CD1-CD2 4.23Å; L131-Y141 HydrophobicContact CD1-CE1 3.73Å; L131-Y141 HydrophobicContact CD1-CE2 4.4Å; L131-Y141 HydrophobicContact CD1-CG 3.79Å; L131-Y141 HydrophobicContact CG-CE1 4.43Å; P132-Y141 WeakPolarHBondContact CD-OH 3.46Å; A136-Y141 HydrophobicContact CB-CE2 4.08Å; S137-Y141 VanDerWaalsContact O-CD2 3.3Å; S137-Y141 WeakPolarHBondContact O-CD2 3.46Å; S137-Y141 PolarHBondContact O-N 2.9Å; R138-Y141 PolarHBondContact O-N 3.46Å; E139-Y141 PolarHBondContact O-N 3.24Å; Y141-S145 WeakPolarHBondContact O-CB 3.26Å; Y141-S145 PolarHBondContact O-N 2.82Å; Y141-S145 PolarHBondContact O-OG 3.39Å
142	V	96.5	Very high	94.8	Very high	77 Å²	77	57.4 Å²	57.4	47%	0.467	29%	0.29	S	S	.	.	H	α-helix	trans	-66.7	-50.2	-179.5	172.6	0	0	0	0	110.9	R138 E139 D140 Y144 S145 I146	R138-V142 WeakPolarHBondContact O-CG2 3.31Å; R138-V142 PolarHBondContact O-N 3.26Å; E139-V142 PolarHBondContact O-N 3.29Å; E139-V142 VanDerWaalsContact O-N 3.16Å; D140-V142 VanDerWaalsContact C-N 3.29Å; D140-V142 PolarHBondContact O-N 3.35Å; V142-Y144 PolarHBondContact O-N 3.08Å; V142-S145 PolarHBondContact O-N 3.41Å; V142-I146 HydrophobicContact CG1-CD1 3.71Å; V142-I146 HydrophobicContact CG1-CG1 4.45Å; V142-I146 VanDerWaalsContact O-CG1 3.28Å; V142-I146 WeakPolarHBondContact O-CG1 3.49Å; V142-I146 PolarHBondContact O-N 3.45Å
143	I	95.4	Very high	95	Very high	17 Å²	17	57.4 Å²	57.4	9%	0.087	29%	0.287	C	S	.	.	H	α-helix	trans	-63.9	-43.2	-176.7	-67.2	-64.7	0	0	0	111.3	E139 D140 I146 G147 V193 P194 F197 Y198	E139-I143 WeakPolarHBondContact O-CB 3.31Å; E139-I143 VanDerWaalsContact O-CG1 3.29Å; E139-I143 WeakPolarHBondContact O-CG1 3.35Å; E139-I143 PolarHBondContact O-N 3.41Å; D140-I143 PolarHBondContact O-N 2.79Å; I143-I146 PolarHBondContact O-N 3.23Å; I143-G147 PolarHBondContact O-N 2.86Å; I143-V193 HydrophobicContact CD1-CG1 3.78Å; I143-V193 HydrophobicContact CG2-CG1 4.32Å; I143-P194 HydrophobicContact CG2-CB 3.86Å; I143-F197 HydrophobicContact CB-CD1 4.47Å; I143-F197 HydrophobicContact CD1-CB 4.24Å; I143-F197 HydrophobicContact CD1-CD2 3.67Å; I143-F197 HydrophobicContact CD1-CE2 4.14Å; I143-F197 HydrophobicContact CD1-CG 3.89Å; I143-F197 HydrophobicContact CG1-CB 4.48Å; I143-F197 HydrophobicContact CG1-CD1 3.92Å; I143-F197 HydrophobicContact CG1-CD2 3.82Å; I143-F197 HydrophobicContact CG1-CE1 4.06Å; I143-F197 HydrophobicContact CG1-CE2 3.97Å; I143-F197 HydrophobicContact CG1-CG 3.81Å; I143-F197 HydrophobicContact CG1-CZ 4.09Å; I143-F197 HydrophobicContact CG2-CB 4.25Å; I143-F197 HydrophobicContact CG2-CD1 4.17Å; I143-F197 HydrophobicContact CG2-CG 4.26Å; I143-Y198 HydrophobicContact CG2-CE2 3.95Å
144	Y	92.6	Very high	95.3	Very high	8 Å²	8	53.7 Å²	53.7	3%	0.031	26%	0.261	C	S	.	.	H	α-helix	trans	-63.7	-44.1	174.7	-96.2	-105.5	0	0	0	112.7	D140 V142 I146 G147 L148 Y198 H325 S328 G329 M332	D140-Y144 WeakPolarHBondContact O-CB 3.42Å; D140-Y144 WeakPolarHBondContact O-CD2 3.35Å; D140-Y144 PolarHBondContact O-N 3.33Å; V142-Y144 PolarHBondContact O-N 3.08Å; Y144-I146 VanDerWaalsContact C-N 3.32Å; Y144-I146 PolarHBondContact O-N 3.49Å; Y144-G147 PolarHBondContact O-N 3.45Å; Y144-L148 WeakPolarHBondContact O-CB 3.15Å; Y144-L148 WeakPolarHBondContact O-CG 3.2Å; Y144-L148 PolarHBondContact O-N 3.48Å; Y144-Y198 HydrophobicContact CD2-CE2 4.31Å; Y144-Y198 WeakPolarHBondContact CD2-OH 3.03Å; Y144-Y198 AromaticContact CE2-CE2 3.76Å; Y144-Y198 HydrophobicContact CE2-CE2 3.76Å; Y144-Y198 AromaticContact CE2-CZ 3.92Å; Y144-Y198 WeakPolarHBondContact CE2-OH 3.26Å; Y144-H325 AromaticContact CD1-CE1 3.81Å; Y144-H325 AromaticContact CE1-CE1 3.48Å; Y144-H325 VanDerWaalsContact CE1-CE1 3.48Å; Y144-H325 WeakPolarHBondContact CE1-CE1 3.19Å; Y144-S328 PolarHBondContact OH-O 3.1Å; Y144-S328 VanDerWaalsContact OH-O 3.11Å; Y144-G329 WeakPolarHBondContact OH-CA 3.43Å; Y144-G329 PolarHBondContact OH-N 3.44Å; Y144-M332 HydrophobicContact CD2-SD 4Å; Y144-M332 HydrophobicContact CE2-CB 4.25Å; Y144-M332 HydrophobicContact CE2-CE 4.1Å; Y144-M332 HydrophobicContact CE2-CG 4.26Å; Y144-M332 HydrophobicContact CE2-SD 3.31Å; Y144-M332 WeakPolarHBondContact CE2-SD 3.5Å
145	S	96	Very high	95.7	Very high	57 Å²	57	51.2 Å²	51.2	40%	0.399	25%	0.248	S	C	.	.	H	α-helix	trans	-61.7	-42.8	179.3	-63.2	0	0	0	0	111	Y141 V142 F149	Y141-S145 WeakPolarHBondContact O-CB 3.26Å; Y141-S145 PolarHBondContact O-N 2.82Å; Y141-S145 PolarHBondContact O-OG 3.39Å; V142-S145 PolarHBondContact O-N 3.41Å; S145-F149 WeakPolarHBondContact O-CB 3.43Å; S145-F149 PolarHBondContact O-N 3.35Å
146	I	97	Very high	96.1	Very high	67 Å²	67	46.7 Å²	46.7	34%	0.344	23%	0.229	S	C	.	.	H	α-helix	trans	-62	-50.9	176.3	-68.7	166.8	0	0	0	110.6	V142 I143 Y144 L148 F149 C150 V193	V142-I146 HydrophobicContact CG1-CD1 3.71Å; V142-I146 HydrophobicContact CG1-CG1 4.45Å; V142-I146 VanDerWaalsContact O-CG1 3.28Å; V142-I146 WeakPolarHBondContact O-CG1 3.49Å; V142-I146 PolarHBondContact O-N 3.45Å; I143-I146 PolarHBondContact O-N 3.23Å; Y144-I146 VanDerWaalsContact C-N 3.32Å; Y144-I146 PolarHBondContact O-N 3.49Å; I146-L148 PolarHBondContact O-N 3.12Å; I146-F149 PolarHBondContact O-N 3.49Å; I146-C150 WeakPolarHBondContact O-CB 3.47Å; I146-C150 PolarHBondContact O-N 3.43Å; I146-C150 PolarHBondContact O-SG 2.9Å; I146-C150 VanDerWaalsContact O-SG 3.32Å; I146-V193 HydrophobicContact CB-CG1 4.43Å; I146-V193 HydrophobicContact CG2-CB 4.36Å; I146-V193 HydrophobicContact CG2-CG1 3.99Å; I146-V193 HydrophobicContact CG2-CG2 4.24Å
147	G	96.8	Very high	96.5	Very high	3 Å²	3	46.9 Å²	46.9	3%	0.031	23%	0.229	C	C	.	.	H	α-helix	trans	-58.2	-48.8	-179	0	0	0	0	0	112.6	I143 Y144 C150 F151	I143-G147 PolarHBondContact O-N 2.86Å; Y144-G147 PolarHBondContact O-N 3.45Å; G147-C150 WeakPolarHBondContact O-CB 3.3Å; G147-C150 PolarHBondContact O-N 3.39Å; G147-F151 WeakPolarHBondContact O-CG 3.19Å; G147-F151 PolarHBondContact O-N 3.19Å; G147-F151 VanDerWaalsContact O-N 3.12Å
148	L	97.6	Very high	96.8	Very high	5 Å²	5	45.2 Å²	45.2	3%	0.026	22%	0.218	C	C	.	.	H	α-helix	trans	-68.3	-37.1	178.9	-73.7	165.2	0	0	0	112.8	F119 V122 Y144 I146 C150 F151 Q152	F119-L148 HydrophobicContact CB-CD2 4.38Å; F119-L148 HydrophobicContact CD1-CD2 4.07Å; V122-L148 HydrophobicContact CG1-CD2 4.17Å; Y144-L148 WeakPolarHBondContact O-CB 3.15Å; Y144-L148 WeakPolarHBondContact O-CG 3.2Å; Y144-L148 PolarHBondContact O-N 3.48Å; I146-L148 PolarHBondContact O-N 3.12Å; L148-C150 VanDerWaalsContact C-N 3.34Å; L148-F151 PolarHBondContact O-N 2.92Å; L148-Q152 WeakPolarHBondContact O-CB 3.33Å; L148-Q152 VanDerWaalsContact O-CG 3.31Å; L148-Q152 WeakPolarHBondContact O-CG 3.44Å; L148-Q152 PolarHBondContact O-N 3.45Å; L148-Q152 PolarHBondContact O-NE2 3.32Å
149	F	98.3	Very high	97	Very high	125 Å²	125	35.4 Å²	35.4	55%	0.548	18%	0.183	S	C	.	.	H	α-helix	trans	-62.5	-43.4	174.7	176.4	-101.8	0	0	0	111.1	S145 I146 F151 Q152 L153	S145-F149 WeakPolarHBondContact O-CB 3.43Å; S145-F149 PolarHBondContact O-N 3.35Å; I146-F149 PolarHBondContact O-N 3.49Å; F149-F151 PolarHBondContact O-N 2.87Å; F149-Q152 PolarHBondContact O-N 2.82Å; F149-L153 HydrophobicContact CE1-CD2 4.03Å; F149-L153 HydrophobicContact CZ-CD2 4.18Å; F149-L153 WeakPolarHBondContact O-CB 3.46Å; F149-L153 PolarHBondContact O-N 2.82Å
150	C	98.6	Very high	97.3	Very high	7 Å²	7	30.8 Å²	30.8	5%	0.047	16%	0.163	C	C	.	.	H	α-helix	trans	-59	-44.3	175.1	-76.4	0	0	0	0	112.4	I146 G147 L148 L153 C154 I186 G190	I146-C150 WeakPolarHBondContact O-CB 3.47Å; I146-C150 PolarHBondContact O-N 3.43Å; I146-C150 PolarHBondContact O-SG 2.9Å; I146-C150 VanDerWaalsContact O-SG 3.32Å; G147-C150 WeakPolarHBondContact O-CB 3.3Å; G147-C150 PolarHBondContact O-N 3.39Å; L148-C150 VanDerWaalsContact C-N 3.34Å; C150-L153 PolarHBondContact O-N 3.19Å; C150-C154 WeakPolarHBondContact O-CB 3.3Å; C150-C154 PolarHBondContact O-N 3.09Å; C150-I186 HydrophobicContact CB-CG2 3.91Å; C150-I186 WeakPolarHBondContact CB-O 3.27Å; C150-G190 VanDerWaalsContact CB-CA 3.42Å
151	F	98.6	Very high	97.5	Very high	4 Å²	4	32 Å²	32	2%	0.018	17%	0.167	C	C	.	.	H	α-helix	trans	-63.4	-45.9	176.2	-61.3	-18.4	0	0	0	111.9	F119 G147 L148 F149 L153 C154 M155 F321 H325	F119-F151 HydrophobicContact CD1-CB 4.41Å; F119-F151 HydrophobicContact CD1-CD2 4.1Å; F119-F151 HydrophobicContact CD2-CB 4.04Å; F119-F151 HydrophobicContact CE1-CD2 4.05Å; F119-F151 HydrophobicContact CE2-CB 4.37Å; F119-F151 HydrophobicContact CG-CB 4.11Å; G147-F151 WeakPolarHBondContact O-CG 3.19Å; G147-F151 PolarHBondContact O-N 3.19Å; G147-F151 VanDerWaalsContact O-N 3.12Å; L148-F151 PolarHBondContact O-N 2.92Å; F149-F151 PolarHBondContact O-N 2.87Å; F151-L153 PolarHBondContact O-N 3.17Å; F151-C154 WeakPolarHBondContact O-CB 3.3Å; F151-C154 PolarHBondContact O-N 3.33Å; F151-M155 VanDerWaalsContact O-CG 3.25Å; F151-M155 WeakPolarHBondContact O-CG 3.27Å; F151-M155 PolarHBondContact O-N 3.11Å; F151-F321 HydrophobicContact CB-CD2 4.01Å; F151-F321 HydrophobicContact CB-CE2 4.47Å; F151-F321 HydrophobicContact CB-CG 4.49Å; F151-F321 HydrophobicContact CD1-CB 4.33Å; F151-F321 AromaticContact CD1-CD1 3.8Å; F151-F321 HydrophobicContact CD1-CD1 3.8Å; F151-F321 AromaticContact CD1-CD2 3.81Å; F151-F321 HydrophobicContact CD1-CD2 3.81Å; F151-F321 AromaticContact CD1-CE1 4Å; F151-F321 HydrophobicContact CD1-CE1 4Å; F151-F321 HydrophobicContact CD1-CE2 4.01Å; F151-F321 AromaticContact CD1-CG 3.73Å; F151-F321 HydrophobicContact CD1-CG 3.73Å; F151-F321 HydrophobicContact CD1-CZ 4.12Å; F151-F321 HydrophobicContact CD2-CB 4.01Å; F151-F321 HydrophobicContact CD2-CG 4.3Å; F151-F321 HydrophobicContact CE1-CB 4.48Å; F151-F321 AromaticContact CE1-CD1 3.66Å; F151-F321 HydrophobicContact CE1-CD1 3.66Å; F151-F321 HydrophobicContact CE1-CD2 4.48Å; F151-F321 AromaticContact CE1-CE1 3.95Å; F151-F321 HydrophobicContact CE1-CE1 3.95Å; F151-F321 AromaticContact CE1-CG 3.98Å; F151-F321 HydrophobicContact CE1-CG 3.98Å; F151-F321 HydrophobicContact CE1-CZ 4.5Å; F151-F321 HydrophobicContact CE2-CB 4.16Å; F151-F321 HydrophobicContact CG-CB 4.11Å; F151-F321 HydrophobicContact CG-CD1 4.44Å; F151-F321 AromaticContact CG-CD2 3.91Å; F151-F321 HydrophobicContact CG-CD2 3.91Å; F151-F321 HydrophobicContact CG-CE2 4.46Å; F151-F321 AromaticContact CG-CG 3.93Å; F151-F321 HydrophobicContact CG-CG 3.93Å; F151-F321 HydrophobicContact CZ-CB 4.41Å; F151-F321 HydrophobicContact CZ-CD1 4.16Å; F151-F321 HydrophobicContact CZ-CG 4.37Å; F151-H325 HydrophobicContact CE2-CB 4.36Å
152	Q	98.7	Very high	97.7	Very high	31 Å²	31	28.7 Å²	28.7	15%	0.145	15%	0.154	C	C	.	.	H	α-helix	trans	-60.1	-45.1	177.2	-75.1	168.5	88.4	0	0	112.1	F116 F119 L148 F149 M155 L156	F116-Q152 HydrophobicContact CD2-CB 3.78Å; F116-Q152 HydrophobicContact CD2-CG 3.9Å; F116-Q152 HydrophobicContact CE2-CB 3.97Å; F116-Q152 HydrophobicContact CE2-CG 4.08Å; F119-Q152 HydrophobicContact CB-CG 3.78Å; L148-Q152 WeakPolarHBondContact O-CB 3.33Å; L148-Q152 VanDerWaalsContact O-CG 3.31Å; L148-Q152 WeakPolarHBondContact O-CG 3.44Å; L148-Q152 PolarHBondContact O-N 3.45Å; L148-Q152 PolarHBondContact O-NE2 3.32Å; F149-Q152 PolarHBondContact O-N 2.82Å; Q152-M155 PolarHBondContact O-N 3.35Å; Q152-L156 WeakPolarHBondContact O-CG 3.34Å; Q152-L156 PolarHBondContact O-N 3.44Å
153	L	98.6	Very high	97.7	Very high	54 Å²	54	25.9 Å²	25.9	28%	0.283	14%	0.137	S	C	.	.	H	α-helix	trans	-65.7	-41.5	179.9	-175.6	53.7	0	0	0	111.6	F149 C150 F151 M155 L156 C157 I186	F149-L153 HydrophobicContact CE1-CD2 4.03Å; F149-L153 HydrophobicContact CZ-CD2 4.18Å; F149-L153 WeakPolarHBondContact O-CB 3.46Å; F149-L153 PolarHBondContact O-N 2.82Å; C150-L153 PolarHBondContact O-N 3.19Å; F151-L153 PolarHBondContact O-N 3.17Å; L153-M155 VanDerWaalsContact C-N 3.32Å; L153-M155 PolarHBondContact O-N 2.96Å; L153-L156 PolarHBondContact O-N 3.18Å; L153-C157 WeakPolarHBondContact O-CB 3.48Å; L153-C157 PolarHBondContact O-N 3.46Å; L153-C157 PolarHBondContact O-SG 3.41Å; L153-C157 VanDerWaalsContact O-SG 3.34Å; L153-I186 HydrophobicContact CB-CG2 4.39Å; L153-I186 HydrophobicContact CD2-CD1 3.74Å; L153-I186 HydrophobicContact CD2-CG2 4.2Å; L153-I186 HydrophobicContact CG-CD1 4.22Å; L153-I186 HydrophobicContact CG-CG2 4.48Å
154	C	98.6	Very high	97.9	Very high	4 Å²	4	26.3 Å²	26.3	3%	0.027	14%	0.138	C	C	.	.	H	α-helix	trans	-55.1	-48.2	172.2	-179.4	0	0	0	0	111.5	C150 F151 C157 S158 G183 F321	C150-C154 WeakPolarHBondContact O-CB 3.3Å; C150-C154 PolarHBondContact O-N 3.09Å; F151-C154 WeakPolarHBondContact O-CB 3.3Å; F151-C154 PolarHBondContact O-N 3.33Å; C154-C157 PolarHBondContact O-N 3.01Å; C154-S158 PolarHBondContact O-N 3.38Å; C154-S158 VanDerWaalsContact O-N 3.16Å; C154-G183 WeakPolarHBondContact CB-O 3.49Å; C154-G183 PolarHBondContact SG-O 3.12Å; C154-G183 VanDerWaalsContact SG-O 3.35Å; C154-F321 HydrophobicContact CB-CE2 4.23Å
155	M	98.5	Very high	98.1	Very high	0 Å²	0	26.2 Å²	26.2	0%	0	14%	0.139	C	C	.	.	H	α-helix	trans	-63.2	-45.3	179.6	-66.7	-65	159.8	0	0	111.9	H112 F116 F119 F151 Q152 L153 S158 V159 V318 F321	H112-M155 HydrophobicContact CB-CB 4.44Å; H112-M155 HydrophobicContact CB-SD 3.8Å; H112-M155 PolarHBondContact CD2-SD 3.44Å; F116-M155 HydrophobicContact CB-CB 4.04Å; F119-M155 HydrophobicContact CD2-CG 4.41Å; F119-M155 HydrophobicContact CE2-CE 4.16Å; F151-M155 VanDerWaalsContact O-CG 3.25Å; F151-M155 WeakPolarHBondContact O-CG 3.27Å; F151-M155 PolarHBondContact O-N 3.11Å; Q152-M155 PolarHBondContact O-N 3.35Å; L153-M155 VanDerWaalsContact C-N 3.32Å; L153-M155 PolarHBondContact O-N 2.96Å; M155-S158 PolarHBondContact O-N 2.98Å; M155-V159 WeakPolarHBondContact O-CG2 3.27Å; M155-V159 PolarHBondContact O-N 3.29Å; M155-V318 HydrophobicContact CE-CB 4.38Å; M155-V318 HydrophobicContact CE-CG2 3.58Å; M155-V318 HydrophobicContact SD-CG2 3.85Å; M155-F321 HydrophobicContact CE-CD2 3.46Å; M155-F321 VanDerWaalsContact CE-CD2 3.46Å; M155-F321 HydrophobicContact CE-CE2 3.69Å
156	L	98.5	Very high	98.1	Very high	72 Å²	72	23.6 Å²	23.6	38%	0.377	12%	0.12	S	C	.	.	H	α-helix	trans	-65.7	-40.8	179	-73	176.5	0	0	0	113.1	F116 Q152 L153 S158 V159 G160	F116-L156 HydrophobicContact CB-CD2 4.4Å; F116-L156 HydrophobicContact CD1-CD2 4.16Å; F116-L156 HydrophobicContact CD2-CD1 3.8Å; F116-L156 HydrophobicContact CD2-CD2 3.84Å; F116-L156 HydrophobicContact CD2-CG 3.57Å; F116-L156 HydrophobicContact CE1-CD2 4.46Å; F116-L156 HydrophobicContact CE2-CD1 3.6Å; F116-L156 HydrophobicContact CE2-CD2 4.16Å; F116-L156 HydrophobicContact CE2-CG 3.92Å; F116-L156 HydrophobicContact CG-CD2 3.84Å; F116-L156 HydrophobicContact CG-CG 4.06Å; F116-L156 HydrophobicContact CZ-CD1 4.27Å; F116-L156 HydrophobicContact CZ-CD2 4.46Å; Q152-L156 WeakPolarHBondContact O-CG 3.34Å; Q152-L156 PolarHBondContact O-N 3.44Å; L153-L156 PolarHBondContact O-N 3.18Å; L156-S158 VanDerWaalsContact C-N 3.26Å; L156-S158 PolarHBondContact O-N 3.07Å; L156-V159 PolarHBondContact O-N 3.34Å; L156-G160 PolarHBondContact O-N 3.15Å
157	C	98.6	Very high	98.1	Very high	18 Å²	18	21.1 Å²	21.1	12%	0.122	11%	0.107	C	C	.	.	H	α-helix	trans	-57.4	-43.6	174.3	-79	0	0	0	0	111.2	L153 C154 G160 Y161 L179	L153-C157 WeakPolarHBondContact O-CB 3.48Å; L153-C157 PolarHBondContact O-N 3.46Å; L153-C157 PolarHBondContact O-SG 3.41Å; L153-C157 VanDerWaalsContact O-SG 3.34Å; C154-C157 PolarHBondContact O-N 3.01Å; C157-G160 PolarHBondContact O-N 3.44Å; C157-Y161 PolarHBondContact O-N 3.21Å; C157-L179 WeakPolarHBondContact CB-O 3.13Å
158	S	98.5	Very high	98	Very high	3 Å²	3	29.8 Å²	29.8	2%	0.021	14%	0.139	C	C	.	.	H	α-helix	trans	-68.9	-44.4	178.3	-170.8	0	0	0	0	113.2	H112 C154 M155 L156 G160 Y161 H162 D180 H314	H112-S158 PolarHBondContact CE1-OG 3.21Å; H112-S158 WeakPolarHBondContact ND1-CB 3.12Å; H112-S158 PolarHBondContact ND1-OG 3.35Å; C154-S158 PolarHBondContact O-N 3.38Å; C154-S158 VanDerWaalsContact O-N 3.16Å; M155-S158 PolarHBondContact O-N 2.98Å; L156-S158 VanDerWaalsContact C-N 3.26Å; L156-S158 PolarHBondContact O-N 3.07Å; S158-G160 VanDerWaalsContact C-N 3.26Å; S158-G160 PolarHBondContact O-N 3.4Å; S158-Y161 PolarHBondContact O-N 3.31Å; S158-Y161 VanDerWaalsContact O-N 3.17Å; S158-H162 PolarHBondContact O-CD2 2.74Å; S158-H162 VanDerWaalsContact O-CD2 3.28Å; S158-H162 PolarHBondContact O-N 2.87Å; S158-D180 WeakPolarHBondContact CA-OD1 3.5Å; S158-D180 WeakPolarHBondContact CB-OD1 3.4Å; S158-D180 PolarHBondContact OG-OD1 3.04Å; S158-H314 PolarHBondContact OG-CE1 2.69Å; S158-H314 VanDerWaalsContact OG-CE1 3.26Å
159	V	98.7	Very high	97.9	Very high	16 Å²	16	31.6 Å²	31.6	10%	0.097	15%	0.152	C	C	.	.	H	α-helix	trans	-54.8	-45.6	171	167.7	0	0	0	0	110.4	I109 H112 L113 M155 L156 Y161 H162 L163	I109-V159 HydrophobicContact CG2-CG1 4.28Å; H112-V159 HydrophobicContact CB-CG2 3.76Å; L113-V159 HydrophobicContact CB-CG2 4.01Å; M155-V159 WeakPolarHBondContact O-CG2 3.27Å; M155-V159 PolarHBondContact O-N 3.29Å; L156-V159 PolarHBondContact O-N 3.34Å; V159-Y161 PolarHBondContact O-N 2.85Å; V159-H162 PolarHBondContact O-N 3.31Å; V159-L163 WeakPolarHBondContact O-CB 3.47Å; V159-L163 PolarHBondContact O-N 3.25Å
160	G	98.4	Very high	97.7	Very high	6 Å²	6	29.5 Å²	29.5	6%	0.062	14%	0.144	C	C	.	.	H	α-helix	trans	-57.1	-48.6	176.6	0	0	0	0	0	112.2	L156 C157 S158 L163 F164	L156-G160 PolarHBondContact O-N 3.15Å; C157-G160 PolarHBondContact O-N 3.44Å; S158-G160 VanDerWaalsContact C-N 3.26Å; S158-G160 PolarHBondContact O-N 3.4Å; G160-L163 PolarHBondContact O-N 3.05Å; G160-F164 WeakPolarHBondContact O-CB 3.48Å; G160-F164 VanDerWaalsContact O-CD2 3.25Å; G160-F164 WeakPolarHBondContact O-CD2 3.27Å; G160-F164 PolarHBondContact O-N 3.04Å
161	Y	98.3	Very high	97.6	Very high	24 Å²	24	35.5 Å²	35.5	9%	0.094	17%	0.169	C	C	.	.	H	α-helix	trans	-60	-54.2	175.4	171.9	-114.9	0	0	0	113.2	C157 S158 V159 L163 F164 C165 W176 M177 D180	C157-Y161 PolarHBondContact O-N 3.21Å; S158-Y161 PolarHBondContact O-N 3.31Å; S158-Y161 VanDerWaalsContact O-N 3.17Å; V159-Y161 PolarHBondContact O-N 2.85Å; Y161-L163 PolarHBondContact O-N 2.85Å; Y161-F164 CarbonylContact O-C 3.52Å; Y161-F164 PolarHBondContact O-N 2.86Å; Y161-F164 VanDerWaalsContact O-N 3.16Å; Y161-C165 HydrophobicContact CD2-CB 4.12Å; Y161-C165 HydrophobicContact CE2-CB 3.72Å; Y161-C165 WeakPolarHBondContact O-CA 3.31Å; Y161-C165 VanDerWaalsContact O-CB 3.23Å; Y161-C165 WeakPolarHBondContact O-CB 3.43Å; Y161-C165 PolarHBondContact O-N 3.5Å; Y161-W176 HydrophobicContact CD2-CB 4.24Å; Y161-M177 VanDerWaalsContact CD2-CA 3.46Å; Y161-M177 HydrophobicContact CD2-CB 3.78Å; Y161-M177 HydrophobicContact CD2-CG 4.47Å; Y161-M177 HydrophobicContact CE2-CB 3.6Å; Y161-M177 HydrophobicContact CE2-CE 3.9Å; Y161-M177 HydrophobicContact CE2-CG 4.01Å; Y161-M177 VanDerWaalsContact OH-CE 3.26Å; Y161-M177 WeakPolarHBondContact OH-CE 3.12Å; Y161-D180 HydrophobicContact CD1-CB 4.34Å; Y161-D180 HydrophobicContact CG-CB 4.12Å
162	H	98.1	Very high	97.4	Very high	4 Å²	4	36.9 Å²	36.9	2%	0.019	18%	0.178	C	C	.	.	H	α-helix	trans	-65.5	-25.7	-178	-72.7	-73.4	0	0	0	112.7	R87 E105 N108 I109 S158 V159 C165 H310 H314	R87-H162 PolarHBondContact NH2-O 3.22Å; E105-H162 IonicContact OE2-CE1 3.6Å; E105-H162 IonicContact OE2-CG 3.17Å; E105-H162 IonicContact OE2-ND1 3.96Å; E105-H162 PolarHBondContact OE2-ND1 2.59Å; N108-H162 HydrophobicContact CB-CB 4.26Å; I109-H162 HydrophobicContact CG1-CB 3.58Å; S158-H162 PolarHBondContact O-CD2 2.74Å; S158-H162 VanDerWaalsContact O-CD2 3.28Å; S158-H162 PolarHBondContact O-N 2.87Å; V159-H162 PolarHBondContact O-N 3.31Å; H162-C165 PolarHBondContact O-SG 3.42Å; H162-C165 VanDerWaalsContact O-SG 3.42Å; H162-H310 AromaticContact CE1-CD2 3.68Å; H162-H310 AromaticContact CE1-NE2 3.19Å; H162-H310 PolarHBondContact CE1-NE2 3.22Å; H162-H310 AromaticContact NE2-NE2 3.25Å; H162-H310 PolarHBondContact NE2-NE2 2.63Å; H162-H314 AromaticContact CD2-CE1 3.43Å; H162-H314 PolarHBondContact CD2-CE1 2.99Å; H162-H314 VanDerWaalsContact CD2-CE1 3.43Å; H162-H314 AromaticContact CD2-NE2 3.83Å; H162-H314 AromaticContact CE1-NE2 3.95Å; H162-H314 AromaticContact NE2-CE1 3.29Å; H162-H314 PolarHBondContact NE2-CE1 2.91Å; H162-H314 VanDerWaalsContact NE2-CE1 3.29Å; H162-H314 AromaticContact NE2-NE2 3.17Å; H162-H314 PolarHBondContact NE2-NE2 3.45Å; H162-H314 VanDerWaalsContact NE2-NE2 3.17Å
163	L	97.9	Very high	97.3	Very high	19 Å²	19	35.5 Å²	35.5	10%	0.099	17%	0.172	C	C	.	.	H	α-helix	trans	-75.3	-41.3	173.8	-168.6	63.1	0	0	0	112.3	C95 I96 L99 I109 V159 G160 Y161 C166	C95-L163 WeakPolarHBondContact CB-O 3.18Å; C95-L163 WeakPolarHBondContact O-CD1 3.38Å; I96-L163 HydrophobicContact CG1-CD2 4.34Å; L99-L163 HydrophobicContact CB-CD1 4.24Å; I109-L163 HydrophobicContact CD1-CD1 4.14Å; V159-L163 WeakPolarHBondContact O-CB 3.47Å; V159-L163 PolarHBondContact O-N 3.25Å; G160-L163 PolarHBondContact O-N 3.05Å; Y161-L163 PolarHBondContact O-N 2.85Å; L163-C166 PolarHBondContact O-SG 3.4Å
164	F	98.1	Very high	97.1	Very high	26 Å²	26	37.6 Å²	37.6	11%	0.114	18%	0.176	C	C	.	.	H	α-helix	trans	-103.4	0.3	-172.5	-68.9	-75.4	0	0	0	114.9	C95 I96 G160 Y161 C166 H167 W176	C95-F164 HydrophobicContact CB-CD1 3.61Å; C95-F164 HydrophobicContact CB-CE1 3.78Å; C95-F164 HydrophobicContact CB-CG 4.46Å; I96-F164 HydrophobicContact CD1-CZ 4.21Å; I96-F164 HydrophobicContact CG1-CE1 4.25Å; I96-F164 HydrophobicContact CG1-CZ 3.82Å; G160-F164 WeakPolarHBondContact O-CB 3.48Å; G160-F164 VanDerWaalsContact O-CD2 3.25Å; G160-F164 WeakPolarHBondContact O-CD2 3.27Å; G160-F164 PolarHBondContact O-N 3.04Å; Y161-F164 CarbonylContact O-C 3.52Å; Y161-F164 PolarHBondContact O-N 2.86Å; Y161-F164 VanDerWaalsContact O-N 3.16Å; F164-C166 PolarHBondContact O-N 3.29Å; F164-H167 WeakPolarHBondContact O-CB 3.47Å; F164-H167 PolarHBondContact O-N 3.16Å; F164-W176 HydrophobicContact CB-CD2 4.25Å; F164-W176 HydrophobicContact CB-CG 3.83Å; F164-W176 HydrophobicContact CD2-CD2 4.08Å; F164-W176 AromaticContact CD2-CE2 3.45Å; F164-W176 VanDerWaalsContact CD2-CE2 3.45Å; F164-W176 HydrophobicContact CD2-CH2 4.26Å; F164-W176 AromaticContact CD2-CZ2 3.56Å; F164-W176 HydrophobicContact CD2-CZ2 3.56Å; F164-W176 AromaticContact CD2-NE1 3.58Å; F164-W176 HydrophobicContact CE2-CH2 4.33Å; F164-W176 AromaticContact CE2-CZ2 3.72Å; F164-W176 HydrophobicContact CE2-CZ2 3.72Å; F164-W176 AromaticContact CG-CD1 3.91Å; F164-W176 HydrophobicContact CG-CD2 4.48Å; F164-W176 AromaticContact CG-CE2 3.86Å; F164-W176 HydrophobicContact CG-CG 4.5Å; F164-W176 HydrophobicContact CG-CZ2 4.33Å; F164-W176 AromaticContact CG-NE1 3.46Å
165	C	96.8	Very high	97	Very high	6 Å²	6	44.5 Å²	44.5	4%	0.041	20%	0.202	C	C	.	.	T	Hydrogen-bonded Turn	trans	-57.3	-37.9	178.1	63.2	0	0	0	0	111.2	L76 Y161 H162 H167 S173	L76-C165 HydrophobicContact CD2-CB 4.44Å; L76-C165 WeakPolarHBondContact CD2-O 3.24Å; Y161-C165 HydrophobicContact CD2-CB 4.12Å; Y161-C165 HydrophobicContact CE2-CB 3.72Å; Y161-C165 WeakPolarHBondContact O-CA 3.31Å; Y161-C165 VanDerWaalsContact O-CB 3.23Å; Y161-C165 WeakPolarHBondContact O-CB 3.43Å; Y161-C165 PolarHBondContact O-N 3.5Å; H162-C165 PolarHBondContact O-SG 3.42Å; H162-C165 VanDerWaalsContact O-SG 3.42Å; C165-H167 PolarHBondContact O-N 3.09Å; C165-S173 WeakPolarHBondContact CA-OG 3.43Å; C165-S173 WeakPolarHBondContact O-CB 3.41Å; C165-S173 PolarHBondContact O-OG 2.73Å
166	C	96	Very high	96.9	Very high	1 Å²	1	48 Å²	48	1%	0.007	22%	0.215	C	C	.	.	T	Hydrogen-bonded Turn	trans	-72.6	1.7	178.6	64.8	0	0	0	0	115.6	R87 A88 Y89 L90 C95 L163 F164	R87-C166 VanDerWaalsContact C-CB 3.44Å; R87-C166 HydrophobicContact CB-CB 3.56Å; R87-C166 WeakPolarHBondContact O-CB 3.23Å; A88-C166 CarbonylContact C-O 3.52Å; Y89-C166 PolarHBondContact N-O 3.09Å; Y89-C166 VanDerWaalsContact N-O 3.17Å; L90-C166 PolarHBondContact N-O 3.44Å; C95-C166 VanDerWaalsContact SG-SG 3.66Å; L163-C166 PolarHBondContact O-SG 3.4Å; F164-C166 PolarHBondContact O-N 3.29Å
167	H	97.2	Very high	96.8	Very high	15 Å²	15	45.2 Å²	45.2	7%	0.069	20%	0.2	C	C	.	.	B	Isolated β-bridge	trans	-62.7	141.3	-174.7	-172.7	-91.7	0	0	0	111.7	L90 S92 F164 C165 S169 T172	L90-H167 CarbonylContact O-C 3.35Å; L90-H167 VanDerWaalsContact O-CA 3.29Å; L90-H167 WeakPolarHBondContact O-CA 3.44Å; L90-H167 PolarHBondContact O-CD2 2.72Å; S92-H167 PolarHBondContact N-CD2 2.97Å; S92-H167 PolarHBondContact OG-NE2 2.89Å; F164-H167 WeakPolarHBondContact O-CB 3.47Å; F164-H167 PolarHBondContact O-N 3.16Å; C165-H167 PolarHBondContact O-N 3.09Å; H167-S169 WeakPolarHBondContact ND1-CB 3.12Å; H167-S169 PolarHBondContact ND1-N 3.38Å; H167-S169 PolarHBondContact O-N 3.4Å; H167-T172 HydrophobicContact CB-CG2 4.22Å; H167-T172 WeakPolarHBondContact ND1-CB 3.29Å
168	R	94.9	Very high	96.7	Very high	185 Å²	185	45.9 Å²	45.9	70%	0.698	21%	0.207	S	C	*	.	S	Bend	trans	-57.7	-23.5	-178.7	69	176.9	-175.8	164.6	1.9	114.8	L90	L90-R168 PolarHBondContact O-N 2.95Å
169	S	96.2	Very high	96.7	Very high	44 Å²	44	49.5 Å²	49.5	31%	0.308	23%	0.226	S	C	.	.			trans	-98	114.6	175.4	175.6	0	0	0	0	110	H167 K171 T172 S173	H167-S169 WeakPolarHBondContact ND1-CB 3.12Å; H167-S169 PolarHBondContact ND1-N 3.38Å; H167-S169 PolarHBondContact O-N 3.4Å; S169-K171 PolarHBondContact O-N 3.45Å; S169-T172 WeakPolarHBondContact O-CB 3.4Å; S169-T172 PolarHBondContact O-N 3.17Å; S169-S173 PolarHBondContact O-N 3.42Å; S169-S173 VanDerWaalsContact O-N 3.15Å
170	E	94.9	Very high	96.6	Very high	80 Å²	80	49.6 Å²	49.6	37%	0.374	23%	0.226	S	C	.	.	H	α-helix	trans	-56.3	-37.1	174.3	-177.8	177.9	169	0	0	111.7	F75 T172 S173 R174	F75-E170 HydrophobicContact CB-CG 4.29Å; F75-E170 HydrophobicContact CD1-CB 4.11Å; F75-E170 HydrophobicContact CD1-CG 3.79Å; F75-E170 HydrophobicContact CD2-CG 4.23Å; F75-E170 HydrophobicContact CE1-CB 3.95Å; F75-E170 HydrophobicContact CE1-CG 4.14Å; F75-E170 HydrophobicContact CG-CG 3.85Å; F75-E170 HydrophobicContact CZ-CB 4.27Å; E170-T172 VanDerWaalsContact C-N 3.29Å; E170-T172 PolarHBondContact O-N 3.29Å; E170-S173 PolarHBondContact O-N 3.26Å; E170-R174 HydrophobicContact CG-CG 4.27Å; E170-R174 WeakPolarHBondContact O-CB 3.48Å; E170-R174 WeakPolarHBondContact O-CG 3.35Å; E170-R174 PolarHBondContact O-N 3.16Å; E170-R174 IonicContact OE1-CZ 3.2Å; E170-R174 IonicContact OE1-NE 3.83Å; E170-R174 PolarHBondContact OE1-NE 3.26Å; E170-R174 IonicContact OE1-NH2 2.78Å; E170-R174 PolarHBondContact OE1-NH2 3.38Å
171	K	94.8	Very high	96.6	Very high	133 Å²	133	50.5 Å²	50.5	58%	0.578	23%	0.227	S	C	*	.	H	α-helix	trans	-59.5	-39.9	176.5	-172.8	176.8	-175.1	177.6	0	111.9	S169 R175	S169-K171 PolarHBondContact O-N 3.45Å; K171-R175 VanDerWaalsContact O-CG 3.28Å; K171-R175 WeakPolarHBondContact O-CG 3.47Å; K171-R175 PolarHBondContact O-N 3.04Å; K171-R175 VanDerWaalsContact O-N 3.08Å
172	T	95.8	Very high	96.5	Very high	34 Å²	34	50.1 Å²	50.1	21%	0.209	23%	0.229	C	C	.	.	H	α-helix	trans	-67.9	-46.1	176	-59.2	0	0	0	0	110.8	H167 S169 E170 R174 R175 W176	H167-T172 HydrophobicContact CB-CG2 4.22Å; H167-T172 WeakPolarHBondContact ND1-CB 3.29Å; S169-T172 WeakPolarHBondContact O-CB 3.4Å; S169-T172 PolarHBondContact O-N 3.17Å; E170-T172 VanDerWaalsContact C-N 3.29Å; E170-T172 PolarHBondContact O-N 3.29Å; T172-R174 PolarHBondContact O-N 2.96Å; T172-R175 PolarHBondContact O-N 3.43Å; T172-W176 VanDerWaalsContact O-CD1 3.27Å; T172-W176 PolarHBondContact O-N 3.23Å; T172-W176 VanDerWaalsContact O-N 3.07Å
173	S	95.6	Very high	96.5	Very high	2 Å²	2	49.9 Å²	49.9	1%	0.014	23%	0.228	C	C	.	.	H	α-helix	trans	-57.8	-46.5	177.2	-175.6	0	0	0	0	111.8	C165 S169 E170 R175 W176 M177	C165-S173 WeakPolarHBondContact CA-OG 3.43Å; C165-S173 WeakPolarHBondContact O-CB 3.41Å; C165-S173 PolarHBondContact O-OG 2.73Å; S169-S173 PolarHBondContact O-N 3.42Å; S169-S173 VanDerWaalsContact O-N 3.15Å; E170-S173 PolarHBondContact O-N 3.26Å; S173-R175 PolarHBondContact O-N 3.28Å; S173-W176 PolarHBondContact O-N 2.93Å; S173-M177 PolarHBondContact O-N 3.17Å
174	R	94.8	Very high	96.5	Very high	97 Å²	97	50.6 Å²	50.6	37%	0.366	23%	0.233	S	C	.	.	H	α-helix	trans	-64	-37	176.5	-71.9	-179.7	179.6	-90.9	2.5	113.6	E170 T172 M177 A178 L231	E170-R174 HydrophobicContact CG-CG 4.27Å; E170-R174 WeakPolarHBondContact O-CB 3.48Å; E170-R174 WeakPolarHBondContact O-CG 3.35Å; E170-R174 PolarHBondContact O-N 3.16Å; E170-R174 IonicContact OE1-CZ 3.2Å; E170-R174 IonicContact OE1-NE 3.83Å; E170-R174 PolarHBondContact OE1-NE 3.26Å; E170-R174 IonicContact OE1-NH2 2.78Å; E170-R174 PolarHBondContact OE1-NH2 3.38Å; T172-R174 PolarHBondContact O-N 2.96Å; R174-M177 WeakPolarHBondContact O-CB 3.42Å; R174-M177 PolarHBondContact O-N 3.04Å; R174-A178 PolarHBondContact O-N 3.41Å; R174-L231 HydrophobicContact CB-CD1 4.2Å; R174-L231 WeakPolarHBondContact O-CD1 3.36Å
175	R	95.8	Very high	96.4	Very high	150 Å²	150	49.4 Å²	49.4	57%	0.566	23%	0.228	S	C	*	.	H	α-helix	trans	-64.3	-44	175.2	-79.2	170.8	173	-177.4	-7.7	111.6	K171 T172 S173 M177 A178 L179	K171-R175 VanDerWaalsContact O-CG 3.28Å; K171-R175 WeakPolarHBondContact O-CG 3.47Å; K171-R175 PolarHBondContact O-N 3.04Å; K171-R175 VanDerWaalsContact O-N 3.08Å; T172-R175 PolarHBondContact O-N 3.43Å; S173-R175 PolarHBondContact O-N 3.28Å; R175-M177 VanDerWaalsContact C-N 3.34Å; R175-A178 WeakPolarHBondContact O-CB 3.41Å; R175-A178 PolarHBondContact O-N 3.17Å; R175-L179 WeakPolarHBondContact O-CG 3.35Å; R175-L179 PolarHBondContact O-N 3.44Å
176	W	97.6	Very high	96.5	Very high	73 Å²	73	50.7 Å²	50.7	28%	0.277	23%	0.234	S	C	.	.	H	α-helix	trans	-65.8	-38.1	175.4	-78.6	111.4	0	0	0	112.3	Y161 F164 T172 S173 A178 L179 D180	Y161-W176 HydrophobicContact CD2-CB 4.24Å; F164-W176 HydrophobicContact CB-CD2 4.25Å; F164-W176 HydrophobicContact CB-CG 3.83Å; F164-W176 HydrophobicContact CD2-CD2 4.08Å; F164-W176 AromaticContact CD2-CE2 3.45Å; F164-W176 VanDerWaalsContact CD2-CE2 3.45Å; F164-W176 HydrophobicContact CD2-CH2 4.26Å; F164-W176 AromaticContact CD2-CZ2 3.56Å; F164-W176 HydrophobicContact CD2-CZ2 3.56Å; F164-W176 AromaticContact CD2-NE1 3.58Å; F164-W176 HydrophobicContact CE2-CH2 4.33Å; F164-W176 AromaticContact CE2-CZ2 3.72Å; F164-W176 HydrophobicContact CE2-CZ2 3.72Å; F164-W176 AromaticContact CG-CD1 3.91Å; F164-W176 HydrophobicContact CG-CD2 4.48Å; F164-W176 AromaticContact CG-CE2 3.86Å; F164-W176 HydrophobicContact CG-CG 4.5Å; F164-W176 HydrophobicContact CG-CZ2 4.33Å; F164-W176 AromaticContact CG-NE1 3.46Å; T172-W176 VanDerWaalsContact O-CD1 3.27Å; T172-W176 PolarHBondContact O-N 3.23Å; T172-W176 VanDerWaalsContact O-N 3.07Å; S173-W176 PolarHBondContact O-N 2.93Å; W176-A178 VanDerWaalsContact C-N 3.3Å; W176-A178 PolarHBondContact O-N 2.85Å; W176-L179 HydrophobicContact CD2-CD1 4.36Å; W176-L179 HydrophobicContact CE3-CD1 3.82Å; W176-L179 HydrophobicContact CZ3-CD1 4.01Å; W176-L179 PolarHBondContact O-N 2.85Å; W176-L179 VanDerWaalsContact O-N 3.17Å; W176-D180 PolarHBondContact O-N 2.93Å
177	M	96.1	Very high	96.6	Very high	13 Å²	13	50.6 Å²	50.6	6%	0.064	23%	0.234	C	C	.	.	H	α-helix	trans	-60	-39.8	172.1	-172.8	-173.6	-79.5	0	0	111.9	Y161 S173 R174 R175 D180 Y181 L231	Y161-M177 VanDerWaalsContact CD2-CA 3.46Å; Y161-M177 HydrophobicContact CD2-CB 3.78Å; Y161-M177 HydrophobicContact CD2-CG 4.47Å; Y161-M177 HydrophobicContact CE2-CB 3.6Å; Y161-M177 HydrophobicContact CE2-CE 3.9Å; Y161-M177 HydrophobicContact CE2-CG 4.01Å; Y161-M177 VanDerWaalsContact OH-CE 3.26Å; Y161-M177 WeakPolarHBondContact OH-CE 3.12Å; S173-M177 PolarHBondContact O-N 3.17Å; R174-M177 WeakPolarHBondContact O-CB 3.42Å; R174-M177 PolarHBondContact O-N 3.04Å; R175-M177 VanDerWaalsContact C-N 3.34Å; M177-D180 PolarHBondContact O-N 3.31Å; M177-Y181 HydrophobicContact CG-CD2 4.1Å; M177-Y181 HydrophobicContact CG-CE2 3.57Å; M177-Y181 WeakPolarHBondContact O-CD2 3.39Å; M177-Y181 PolarHBondContact O-N 3.2Å; M177-Y181 VanDerWaalsContact O-N 3.13Å; M177-Y181 HydrophobicContact SD-CE2 4.1Å; M177-L231 HydrophobicContact CG-CD2 4.18Å; M177-L231 HydrophobicContact SD-CB 4.48Å; M177-L231 HydrophobicContact SD-CD2 4.18Å
178	A	96.6	Very high	96.6	Very high	32 Å²	32	51.1 Å²	51.1	26%	0.264	24%	0.237	S	C	.	.	H	α-helix	trans	-63.5	-42.7	174.1	0	0	0	0	0	112	R174 R175 W176 D180 Y181 A182 L231	R174-A178 PolarHBondContact O-N 3.41Å; R175-A178 WeakPolarHBondContact O-CB 3.41Å; R175-A178 PolarHBondContact O-N 3.17Å; W176-A178 VanDerWaalsContact C-N 3.3Å; W176-A178 PolarHBondContact O-N 2.85Å; A178-D180 VanDerWaalsContact C-N 3.33Å; A178-D180 PolarHBondContact O-N 3.46Å; A178-Y181 PolarHBondContact O-N 3.05Å; A178-A182 WeakPolarHBondContact O-CB 3.47Å; A178-A182 PolarHBondContact O-N 3.04Å; A178-L231 HydrophobicContact CB-CD1 4.18Å; A178-L231 HydrophobicContact CB-CD2 4.45Å
179	L	97.6	Very high	96.7	Very high	80 Å²	80	44.2 Å²	44.2	42%	0.419	21%	0.213	S	C	.	.	H	α-helix	trans	-63.8	-36.5	176.8	-70.7	173.3	0	0	0	112.4	C157 R175 W176 A182 G183	C157-L179 WeakPolarHBondContact CB-O 3.13Å; R175-L179 WeakPolarHBondContact O-CG 3.35Å; R175-L179 PolarHBondContact O-N 3.44Å; W176-L179 HydrophobicContact CD2-CD1 4.36Å; W176-L179 HydrophobicContact CE3-CD1 3.82Å; W176-L179 HydrophobicContact CZ3-CD1 4.01Å; W176-L179 PolarHBondContact O-N 2.85Å; W176-L179 VanDerWaalsContact O-N 3.17Å; L179-A182 PolarHBondContact O-N 2.77Å; L179-G183 PolarHBondContact O-N 2.79Å
180	D	97.9	Very high	96.8	Very high	18 Å²	18	42.1 Å²	42.1	10%	0.096	20%	0.198	C	C	.	.	H	α-helix	trans	-63.6	-47.6	174.1	-174.4	35.8	0	0	0	111.5	S158 Y161 W176 M177 A178 A182 G183 V184	S158-D180 WeakPolarHBondContact CA-OD1 3.5Å; S158-D180 WeakPolarHBondContact CB-OD1 3.4Å; S158-D180 PolarHBondContact OG-OD1 3.04Å; Y161-D180 HydrophobicContact CD1-CB 4.34Å; Y161-D180 HydrophobicContact CG-CB 4.12Å; W176-D180 PolarHBondContact O-N 2.93Å; M177-D180 PolarHBondContact O-N 3.31Å; A178-D180 VanDerWaalsContact C-N 3.33Å; A178-D180 PolarHBondContact O-N 3.46Å; D180-A182 VanDerWaalsContact C-N 3.31Å; D180-A182 PolarHBondContact O-N 3.49Å; D180-G183 WeakPolarHBondContact O-CA 3.21Å; D180-G183 PolarHBondContact O-N 3.15Å; D180-V184 PolarHBondContact O-N 3.47Å
181	Y	96.8	Very high	96.9	Very high	24 Å²	24	39 Å²	39	9%	0.094	19%	0.185	C	C	.	.	H	α-helix	trans	-62.9	-35.7	173.9	-71.5	-49.1	0	0	0	113.3	M177 A178 G183 V184 S185 Q225 Y230 L231 R239 F243	M177-Y181 HydrophobicContact CG-CD2 4.1Å; M177-Y181 HydrophobicContact CG-CE2 3.57Å; M177-Y181 WeakPolarHBondContact O-CD2 3.39Å; M177-Y181 PolarHBondContact O-N 3.2Å; M177-Y181 VanDerWaalsContact O-N 3.13Å; M177-Y181 HydrophobicContact SD-CE2 4.1Å; A178-Y181 PolarHBondContact O-N 3.05Å; Y181-G183 VanDerWaalsContact C-N 3.32Å; Y181-V184 PolarHBondContact O-N 3.24Å; Y181-S185 PolarHBondContact O-N 3.36Å; Y181-S185 PolarHBondContact O-OG 3.29Å; Y181-Q225 PolarHBondContact O-NE2 3.17Å; Y181-Y230 HydrophobicContact CD2-CE1 4.26Å; Y181-Y230 HydrophobicContact CG-CE1 4.4Å; Y181-L231 HydrophobicContact CD2-CD2 3.65Å; Y181-L231 HydrophobicContact CE2-CD2 3.87Å; Y181-R239 VanDerWaalsContact CE1-NE 3.3Å; Y181-R239 PolarHBondContact OH-NE 3.38Å; Y181-R239 PolarHBondContact OH-NH2 2.94Å; Y181-F243 AromaticContact CD1-CE2 3.77Å; Y181-F243 HydrophobicContact CD1-CE2 3.77Å; Y181-F243 HydrophobicContact CD1-CZ 4.12Å; Y181-F243 HydrophobicContact CE1-CE2 4.47Å; Y181-F243 HydrophobicContact CG-CE2 4.45Å; Y181-F243 HydrophobicContact CG-CZ 4.49Å; Y181-F243 WeakPolarHBondContact O-CZ 3.26Å
182	A	97.3	Very high	97.1	Very high	16 Å²	16	33.5 Å²	33.5	13%	0.132	16%	0.161	C	C	.	.	H	α-helix	trans	-65.1	-38.9	171.3	0	0	0	0	0	111.5	A178 L179 D180 V184 S185 I186 F222	A178-A182 WeakPolarHBondContact O-CB 3.47Å; A178-A182 PolarHBondContact O-N 3.04Å; L179-A182 PolarHBondContact O-N 2.77Å; D180-A182 VanDerWaalsContact C-N 3.31Å; D180-A182 PolarHBondContact O-N 3.49Å; A182-V184 VanDerWaalsContact C-N 3.33Å; A182-V184 PolarHBondContact O-N 2.91Å; A182-S185 WeakPolarHBondContact O-CB 3.45Å; A182-S185 PolarHBondContact O-N 3.38Å; A182-I186 WeakPolarHBondContact O-CG1 3.44Å; A182-I186 PolarHBondContact O-N 3.02Å; A182-F222 HydrophobicContact CB-CE1 3.93Å
183	G	98	Very high	97.1	Very high	0 Å²	0	32.7 Å²	32.7	0%	0	16%	0.156	C	C	.	.	H	α-helix	trans	-56.4	-43.9	173.6	0	0	0	0	0	112.6	C154 L179 D180 Y181 S185 I186 G187	C154-G183 WeakPolarHBondContact CB-O 3.49Å; C154-G183 PolarHBondContact SG-O 3.12Å; C154-G183 VanDerWaalsContact SG-O 3.35Å; L179-G183 PolarHBondContact O-N 2.79Å; D180-G183 WeakPolarHBondContact O-CA 3.21Å; D180-G183 PolarHBondContact O-N 3.15Å; Y181-G183 VanDerWaalsContact C-N 3.32Å; G183-S185 PolarHBondContact O-N 2.85Å; G183-I186 PolarHBondContact O-N 2.83Å; G183-I186 VanDerWaalsContact O-N 3.16Å; G183-G187 PolarHBondContact O-N 3.29Å
184	V	97.4	Very high	97.2	Very high	34 Å²	34	33 Å²	33	21%	0.206	16%	0.158	C	C	.	.	H	α-helix	trans	-58.2	-46.2	174.6	176.1	0	0	0	0	111.4	D180 Y181 A182 I186 G187 I188 F243	D180-V184 PolarHBondContact O-N 3.47Å; Y181-V184 PolarHBondContact O-N 3.24Å; A182-V184 VanDerWaalsContact C-N 3.33Å; A182-V184 PolarHBondContact O-N 2.91Å; V184-I186 VanDerWaalsContact C-N 3.32Å; V184-I186 PolarHBondContact O-N 2.91Å; V184-G187 PolarHBondContact O-N 3.36Å; V184-I188 HydrophobicContact CG1-CD1 4.19Å; V184-I188 WeakPolarHBondContact O-CG1 3.38Å; V184-I188 PolarHBondContact O-N 3.47Å; V184-F243 HydrophobicContact CB-CE1 4.18Å; V184-F243 HydrophobicContact CB-CZ 4.31Å; V184-F243 HydrophobicContact CG1-CD1 3.91Å; V184-F243 HydrophobicContact CG1-CE1 3.94Å; V184-F243 HydrophobicContact CG1-CG 4.29Å; V184-F243 HydrophobicContact CG1-CZ 4.33Å
185	S	97.2	Very high	97.2	Very high	0 Å²	0	28.7 Å²	28.7	0%	0	14%	0.144	C	C	.	.	H	α-helix	trans	-58.6	-43.4	175.3	-56.7	0	0	0	0	112.1	Y181 A182 G183 I188 L189 I218 V221	Y181-S185 PolarHBondContact O-N 3.36Å; Y181-S185 PolarHBondContact O-OG 3.29Å; A182-S185 WeakPolarHBondContact O-CB 3.45Å; A182-S185 PolarHBondContact O-N 3.38Å; G183-S185 PolarHBondContact O-N 2.85Å; S185-I188 PolarHBondContact O-N 3.45Å; S185-L189 PolarHBondContact O-N 3.31Å; S185-I218 WeakPolarHBondContact O-CD1 3.28Å; S185-V221 WeakPolarHBondContact OG-CG1 3.39Å
186	I	97.9	Very high	97.3	Very high	33 Å²	33	21.8 Å²	21.8	17%	0.169	12%	0.118	C	C	.	.	H	α-helix	trans	-65.3	-40.1	178.2	-66.1	169.3	0	0	0	110.9	C150 L153 A182 G183 V184 I188 L189 G190 F222	C150-I186 HydrophobicContact CB-CG2 3.91Å; C150-I186 WeakPolarHBondContact CB-O 3.27Å; L153-I186 HydrophobicContact CB-CG2 4.39Å; L153-I186 HydrophobicContact CD2-CD1 3.74Å; L153-I186 HydrophobicContact CD2-CG2 4.2Å; L153-I186 HydrophobicContact CG-CD1 4.22Å; L153-I186 HydrophobicContact CG-CG2 4.48Å; A182-I186 WeakPolarHBondContact O-CG1 3.44Å; A182-I186 PolarHBondContact O-N 3.02Å; G183-I186 PolarHBondContact O-N 2.83Å; G183-I186 VanDerWaalsContact O-N 3.16Å; V184-I186 VanDerWaalsContact C-N 3.32Å; V184-I186 PolarHBondContact O-N 2.91Å; I186-I188 VanDerWaalsContact C-N 3.35Å; I186-I188 PolarHBondContact O-N 3.1Å; I186-L189 WeakPolarHBondContact O-CB 3.49Å; I186-L189 PolarHBondContact O-N 2.86Å; I186-G190 PolarHBondContact O-N 2.92Å; I186-F222 HydrophobicContact CG1-CZ 4.05Å
187	G	98.1	Very high	97.2	Very high	0 Å²	0	18.9 Å²	18.9	0%	0	11%	0.108	C	C	.	.	H	α-helix	trans	-61.9	-40.5	175	0	0	0	0	0	112.7	G183 V184 G190 C191	G183-G187 PolarHBondContact O-N 3.29Å; V184-G187 PolarHBondContact O-N 3.36Å; G187-G190 PolarHBondContact O-N 3.25Å; G187-C191 PolarHBondContact O-N 2.65Å; G187-C191 VanDerWaalsContact O-N 3.13Å; G187-C191 PolarHBondContact O-SG 3.3Å; G187-C191 VanDerWaalsContact O-SG 3.33Å
188	I	97.8	Very high	97.2	Very high	26 Å²	26	18.2 Å²	18.2	13%	0.133	10%	0.104	C	C	.	.	H	α-helix	trans	-62.3	-45.7	173.9	-66.7	166.9	0	0	0	110.6	V184 S185 I186 G190 C191 Y192 I218 F243 V246	V184-I188 HydrophobicContact CG1-CD1 4.19Å; V184-I188 WeakPolarHBondContact O-CG1 3.38Å; V184-I188 PolarHBondContact O-N 3.47Å; S185-I188 PolarHBondContact O-N 3.45Å; I186-I188 VanDerWaalsContact C-N 3.35Å; I186-I188 PolarHBondContact O-N 3.1Å; I188-G190 VanDerWaalsContact C-N 3.27Å; I188-G190 PolarHBondContact O-N 2.93Å; I188-C191 WeakPolarHBondContact O-CB 3.4Å; I188-C191 PolarHBondContact O-N 3.26Å; I188-Y192 HydrophobicContact CG2-CD2 3.64Å; I188-Y192 HydrophobicContact CG2-CE2 3.43Å; I188-Y192 VanDerWaalsContact CG2-CE2 3.43Å; I188-Y192 VanDerWaalsContact O-CD2 3.29Å; I188-Y192 WeakPolarHBondContact O-CD2 3.23Å; I188-Y192 PolarHBondContact O-N 2.83Å; I188-Y192 VanDerWaalsContact O-N 3.1Å; I188-I218 HydrophobicContact CG2-CD1 4.46Å; I188-F243 HydrophobicContact CD1-CD1 4.18Å; I188-V246 HydrophobicContact CG2-CG1 4.01Å
189	L	97.6	Very high	97.1	Very high	39 Å²	39	17.4 Å²	17.4	20%	0.204	10%	0.096	C	C	.	.	H	α-helix	trans	-56.3	-43.5	173.8	179.5	64.6	0	0	0	111.5	S185 I186 C191 Y192 V193 V214 I218	S185-L189 PolarHBondContact O-N 3.31Å; I186-L189 WeakPolarHBondContact O-CB 3.49Å; I186-L189 PolarHBondContact O-N 2.86Å; L189-C191 PolarHBondContact O-N 3.08Å; L189-Y192 PolarHBondContact O-N 3.42Å; L189-Y192 VanDerWaalsContact O-N 3.1Å; L189-V193 HydrophobicContact CD1-CG2 3.95Å; L189-V193 HydrophobicContact CG-CG2 4.19Å; L189-V193 WeakPolarHBondContact O-CG2 3.47Å; L189-V193 PolarHBondContact O-N 3Å; L189-V214 HydrophobicContact CD1-CG1 3.99Å; L189-I218 HydrophobicContact CB-CG1 4.37Å
190	G	97.4	Very high	97	Very high	0 Å²	0	13.7 Å²	13.7	0%	0	8%	0.077	C	C	.	.	H	α-helix	trans	-60.3	-26.1	175.6	0	0	0	0	0	114.3	C150 I186 G187 I188 P194	C150-G190 VanDerWaalsContact CB-CA 3.42Å; I186-G190 PolarHBondContact O-N 2.92Å; G187-G190 PolarHBondContact O-N 3.25Å; I188-G190 VanDerWaalsContact C-N 3.27Å; I188-G190 PolarHBondContact O-N 2.93Å; G190-P194 WeakPolarHBondContact O-CD 3.43Å; G190-P194 WeakPolarHBondContact O-CG 3.45Å
191	C	97.8	Very high	96.8	Very high	15 Å²	15	15.5 Å²	15.5	10%	0.101	8%	0.082	C	C	.	.	H	α-helix	trans	-77.7	-43.7	172.2	-60.3	0	0	0	0	111.4	G187 I188 L189 G195 W324	G187-C191 PolarHBondContact O-N 2.65Å; G187-C191 VanDerWaalsContact O-N 3.13Å; G187-C191 PolarHBondContact O-SG 3.3Å; G187-C191 VanDerWaalsContact O-SG 3.33Å; I188-C191 WeakPolarHBondContact O-CB 3.4Å; I188-C191 PolarHBondContact O-N 3.26Å; L189-C191 PolarHBondContact O-N 3.08Å; C191-G195 PolarHBondContact O-N 3.28Å; C191-W324 PolarHBondContact O-NE1 3.02Å
192	Y	97.8	Very high	96.5	Very high	18 Å²	18	17.1 Å²	17.1	7%	0.071	10%	0.097	C	C	.	.	H	α-helix	trans	-67	-42.6	-177.4	-83.5	-69.7	0	0	0	113.9	I188 L189 G195 V196 V214 V246 A247 Y249 G250	I188-Y192 HydrophobicContact CG2-CD2 3.64Å; I188-Y192 HydrophobicContact CG2-CE2 3.43Å; I188-Y192 VanDerWaalsContact CG2-CE2 3.43Å; I188-Y192 VanDerWaalsContact O-CD2 3.29Å; I188-Y192 WeakPolarHBondContact O-CD2 3.23Å; I188-Y192 PolarHBondContact O-N 2.83Å; I188-Y192 VanDerWaalsContact O-N 3.1Å; L189-Y192 PolarHBondContact O-N 3.42Å; L189-Y192 VanDerWaalsContact O-N 3.1Å; Y192-G195 PolarHBondContact O-N 3.35Å; Y192-V196 HydrophobicContact CD1-CG2 4.12Å; Y192-V196 VanDerWaalsContact O-CB 3.32Å; Y192-V196 WeakPolarHBondContact O-CB 3.38Å; Y192-V196 WeakPolarHBondContact O-CG2 3.29Å; Y192-V196 PolarHBondContact O-N 2.82Å; Y192-V214 HydrophobicContact CD1-CG2 3.6Å; Y192-V214 HydrophobicContact CD2-CB 4.44Å; Y192-V214 HydrophobicContact CD2-CG1 3.53Å; Y192-V214 HydrophobicContact CD2-CG2 3.98Å; Y192-V214 HydrophobicContact CE1-CG2 3.87Å; Y192-V214 HydrophobicContact CE2-CG1 4.2Å; Y192-V214 HydrophobicContact CE2-CG2 4.23Å; Y192-V214 HydrophobicContact CG-CB 4.31Å; Y192-V214 HydrophobicContact CG-CG1 3.71Å; Y192-V214 HydrophobicContact CG-CG2 3.66Å; Y192-V246 WeakPolarHBondContact CE2-O 3.4Å; Y192-V246 PolarHBondContact OH-O 3.18Å; Y192-A247 PolarHBondContact OH-O 2.87Å; Y192-Y249 HydrophobicContact CE1-CD1 4.11Å; Y192-G250 WeakPolarHBondContact OH-CA 3.47Å; Y192-G250 PolarHBondContact OH-N 3.35Å
193	V	97	Very high	96.3	Very high	17 Å²	17	19 Å²	19	10%	0.103	11%	0.105	C	C	.	.	H	α-helix	trans	-54.8	-60.7	-174.3	170.5	0	0	0	0	112.2	I143 I146 L189 F197 L211	I143-V193 HydrophobicContact CD1-CG1 3.78Å; I143-V193 HydrophobicContact CG2-CG1 4.32Å; I146-V193 HydrophobicContact CB-CG1 4.43Å; I146-V193 HydrophobicContact CG2-CB 4.36Å; I146-V193 HydrophobicContact CG2-CG1 3.99Å; I146-V193 HydrophobicContact CG2-CG2 4.24Å; L189-V193 HydrophobicContact CD1-CG2 3.95Å; L189-V193 HydrophobicContact CG-CG2 4.19Å; L189-V193 WeakPolarHBondContact O-CG2 3.47Å; L189-V193 PolarHBondContact O-N 3Å; V193-F197 WeakPolarHBondContact O-CB 3Å; V193-F197 PolarHBondContact O-N 3.09Å; V193-L211 HydrophobicContact CG2-CD2 4.47Å
194	P	96.2	Very high	96.1	Very high	7 Å²	7	23.7 Å²	23.7	5%	0.045	13%	0.13	C	C	.	.	H	α-helix	trans	-67.2	-38.3	177.2	26.9	-34.1	0	0	0	112.5	I143 G190 F197 Y198	I143-P194 HydrophobicContact CG2-CB 3.86Å; G190-P194 WeakPolarHBondContact O-CD 3.43Å; G190-P194 WeakPolarHBondContact O-CG 3.45Å; P194-F197 PolarHBondContact O-N 3.32Å; P194-Y198 HydrophobicContact CB-CD2 4.28Å; P194-Y198 HydrophobicContact CB-CE2 4.25Å; P194-Y198 WeakPolarHBondContact O-CD2 3.49Å; P194-Y198 PolarHBondContact O-N 2.75Å
195	G	95.9	Very high	96.1	Very high	7 Å²	7	29.6 Å²	29.6	7%	0.072	15%	0.15	C	C	.	.	H	α-helix	trans	-58.9	-52.6	-178.8	0	0	0	0	0	112.9	C191 Y192 T199	C191-G195 PolarHBondContact O-N 3.28Å; Y192-G195 PolarHBondContact O-N 3.35Å; G195-T199 WeakPolarHBondContact O-CB 3.43Å; G195-T199 WeakPolarHBondContact O-CG2 3.26Å; G195-T199 PolarHBondContact O-N 3.37Å; G195-T199 PolarHBondContact O-OG1 3.43Å
196	V	97.2	Very high	96.1	Very high	5 Å²	5	33.9 Å²	33.9	3%	0.03	17%	0.166	C	C	.	.	H	α-helix	trans	-69.8	-39.7	178.6	174.1	0	0	0	0	110.9	Y192 Y198 T199 F200 R207 L211	Y192-V196 HydrophobicContact CD1-CG2 4.12Å; Y192-V196 VanDerWaalsContact O-CB 3.32Å; Y192-V196 WeakPolarHBondContact O-CB 3.38Å; Y192-V196 WeakPolarHBondContact O-CG2 3.29Å; Y192-V196 PolarHBondContact O-N 2.82Å; V196-Y198 PolarHBondContact O-N 2.84Å; V196-T199 WeakPolarHBondContact CA-OG1 3.38Å; V196-T199 PolarHBondContact O-OG1 2.87Å; V196-F200 HydrophobicContact CG1-CD2 4.09Å; V196-F200 WeakPolarHBondContact O-CB 3.25Å; V196-F200 PolarHBondContact O-N 3.35Å; V196-R207 HydrophobicContact CG1-CG 4.35Å; V196-L211 HydrophobicContact CB-CD2 3.96Å; V196-L211 HydrophobicContact CB-CG 4.39Å; V196-L211 HydrophobicContact CG1-CD2 4.04Å; V196-L211 HydrophobicContact CG1-CG 3.91Å
197	F	96.7	Very high	96	Very high	12 Å²	12	33.4 Å²	33.4	5%	0.053	16%	0.162	C	C	.	.	H	α-helix	trans	-59.4	-48.9	-178.7	-178.3	-91	0	0	0	112.3	E139 I143 V193 P194 F200 Y201	E139-F197 HydrophobicContact CB-CZ 3.94Å; E139-F197 WeakPolarHBondContact OE2-CZ 3.5Å; I143-F197 HydrophobicContact CB-CD1 4.47Å; I143-F197 HydrophobicContact CD1-CB 4.24Å; I143-F197 HydrophobicContact CD1-CD2 3.67Å; I143-F197 HydrophobicContact CD1-CE2 4.14Å; I143-F197 HydrophobicContact CD1-CG 3.89Å; I143-F197 HydrophobicContact CG1-CB 4.48Å; I143-F197 HydrophobicContact CG1-CD1 3.92Å; I143-F197 HydrophobicContact CG1-CD2 3.82Å; I143-F197 HydrophobicContact CG1-CE1 4.06Å; I143-F197 HydrophobicContact CG1-CE2 3.97Å; I143-F197 HydrophobicContact CG1-CG 3.81Å; I143-F197 HydrophobicContact CG1-CZ 4.09Å; I143-F197 HydrophobicContact CG2-CB 4.25Å; I143-F197 HydrophobicContact CG2-CD1 4.17Å; I143-F197 HydrophobicContact CG2-CG 4.26Å; V193-F197 WeakPolarHBondContact O-CB 3Å; V193-F197 PolarHBondContact O-N 3.09Å; P194-F197 PolarHBondContact O-N 3.32Å; F197-F200 CarbonylContact O-C 3.53Å; F197-Y201 HydrophobicContact CD1-CD2 4.28Å; F197-Y201 AromaticContact CE1-CD2 3.75Å; F197-Y201 HydrophobicContact CE1-CD2 3.75Å; F197-Y201 AromaticContact CE1-CE2 3.74Å; F197-Y201 HydrophobicContact CE1-CE2 3.74Å; F197-Y201 HydrophobicContact CZ-CD2 4.24Å; F197-Y201 HydrophobicContact CZ-CE2 4.05Å; F197-Y201 VanDerWaalsContact O-CA 3.25Å; F197-Y201 WeakPolarHBondContact O-CA 3.33Å; F197-Y201 PolarHBondContact O-N 2.97Å; F197-Y201 VanDerWaalsContact O-N 3.07Å
198	Y	95.1	Very high	96	Very high	0 Å²	0	38.3 Å²	38.3	0%	0	19%	0.185	C	C	.	.	H	α-helix	trans	-81.3	-30.3	-176.3	-69	-60.2	0	0	0	114.4	D140 I143 Y144 P194 V196 Y201 I331 M332 R335	D140-Y198 WeakPolarHBondContact OD1-CE1 3.44Å; D140-Y198 PolarHBondContact OD1-OH 2.93Å; I143-Y198 HydrophobicContact CG2-CE2 3.95Å; Y144-Y198 HydrophobicContact CD2-CE2 4.31Å; Y144-Y198 WeakPolarHBondContact CD2-OH 3.03Å; Y144-Y198 AromaticContact CE2-CE2 3.76Å; Y144-Y198 HydrophobicContact CE2-CE2 3.76Å; Y144-Y198 AromaticContact CE2-CZ 3.92Å; Y144-Y198 WeakPolarHBondContact CE2-OH 3.26Å; P194-Y198 HydrophobicContact CB-CD2 4.28Å; P194-Y198 HydrophobicContact CB-CE2 4.25Å; P194-Y198 WeakPolarHBondContact O-CD2 3.49Å; P194-Y198 PolarHBondContact O-N 2.75Å; V196-Y198 PolarHBondContact O-N 2.84Å; Y198-Y201 HydrophobicContact CD1-CD2 4.27Å; Y198-Y201 WeakPolarHBondContact O-CB 3.42Å; Y198-I331 VanDerWaalsContact CB-CG2 3.48Å; Y198-I331 HydrophobicContact CD2-CG2 4.12Å; Y198-I331 HydrophobicContact CG-CG2 3.98Å; Y198-M332 HydrophobicContact CD1-CB 4.1Å; Y198-M332 HydrophobicContact CD1-CG 4.49Å; Y198-M332 HydrophobicContact CD2-CB 4.38Å; Y198-M332 HydrophobicContact CE1-CB 3.72Å; Y198-M332 HydrophobicContact CE1-CG 3.7Å; Y198-M332 HydrophobicContact CE2-CB 4.03Å; Y198-M332 HydrophobicContact CE2-CG 4.48Å; Y198-M332 HydrophobicContact CG-CB 4.44Å; Y198-R335 PolarHBondContact O-NE 2.9Å
199	T	94.4	Very high	96	Very high	15 Å²	15	39.2 Å²	39.2	9%	0.092	19%	0.191	C	C	.	.	H	α-helix	trans	-67.3	-47.9	174.3	48.8	0	0	0	0	110.6	G195 V196 Y201 W257 F272 I331 R335	G195-T199 WeakPolarHBondContact O-CB 3.43Å; G195-T199 WeakPolarHBondContact O-CG2 3.26Å; G195-T199 PolarHBondContact O-N 3.37Å; G195-T199 PolarHBondContact O-OG1 3.43Å; V196-T199 WeakPolarHBondContact CA-OG1 3.38Å; V196-T199 PolarHBondContact O-OG1 2.87Å; T199-Y201 VanDerWaalsContact C-N 3.32Å; T199-Y201 PolarHBondContact O-N 3.42Å; T199-W257 HydrophobicContact CG2-CD2 4.04Å; T199-W257 HydrophobicContact CG2-CG 4.24Å; T199-W257 HydrophobicContact CG2-CZ2 4.49Å; T199-W257 PolarHBondContact O-NE1 3.13Å; T199-F272 HydrophobicContact CG2-CD1 4.1Å; T199-F272 HydrophobicContact CG2-CE1 3.53Å; T199-F272 HydrophobicContact CG2-CZ 4.45Å; T199-I331 HydrophobicContact CG2-CD1 3.65Å; T199-R335 PolarHBondContact O-NH2 3.34Å
200	F	95.6	Very high	96	Very high	1 Å²	1	38 Å²	38	0%	0.004	18%	0.184	C	C	.	.	T	Hydrogen-bonded Turn	trans	-94.8	30.1	177.2	-61.9	-88.3	0	0	0	113.1	V196 F197 C202 N203 W206 R207 Y210 P253 H256 W257 I260	V196-F200 HydrophobicContact CG1-CD2 4.09Å; V196-F200 WeakPolarHBondContact O-CB 3.25Å; V196-F200 PolarHBondContact O-N 3.35Å; F197-F200 CarbonylContact O-C 3.53Å; F200-C202 PolarHBondContact O-N 2.87Å; F200-N203 CarbonylContact O-C 3.52Å; F200-N203 PolarHBondContact O-N 2.96Å; F200-W206 HydrophobicContact CD1-CB 3.68Å; F200-W206 HydrophobicContact CE1-CB 3.95Å; F200-W206 HydrophobicContact CG-CB 4.47Å; F200-R207 HydrophobicContact CB-CB 3.76Å; F200-R207 HydrophobicContact CB-CG 4.4Å; F200-Y210 HydrophobicContact CD1-CE2 4.48Å; F200-Y210 HydrophobicContact CD2-CD2 4.08Å; F200-Y210 HydrophobicContact CD2-CE2 4.49Å; F200-Y210 HydrophobicContact CE1-CD2 4.19Å; F200-Y210 AromaticContact CE1-CE2 3.73Å; F200-Y210 HydrophobicContact CE1-CE2 3.73Å; F200-Y210 AromaticContact CE2-CD2 3.66Å; F200-Y210 HydrophobicContact CE2-CD2 3.66Å; F200-Y210 AromaticContact CE2-CE2 3.76Å; F200-Y210 HydrophobicContact CE2-CE2 3.76Å; F200-Y210 AromaticContact CZ-CD2 3.72Å; F200-Y210 HydrophobicContact CZ-CD2 3.72Å; F200-Y210 AromaticContact CZ-CE2 3.31Å; F200-Y210 HydrophobicContact CZ-CE2 3.31Å; F200-P253 HydrophobicContact CE2-CB 3.91Å; F200-P253 HydrophobicContact CZ-CB 4.26Å; F200-P253 WeakPolarHBondContact CZ-O 3.49Å; F200-H256 AromaticContact CE1-ND1 3.87Å; F200-W257 HydrophobicContact CE1-CB 4.32Å; F200-W257 HydrophobicContact CE2-CB 4.07Å; F200-W257 HydrophobicContact CZ-CB 3.72Å; F200-I260 HydrophobicContact CD1-CD1 3.82Å; F200-I260 HydrophobicContact CE1-CD1 3.61Å
201	Y	93.1	Very high	96	Very high	56 Å²	56	39.8 Å²	39.8	22%	0.22	19%	0.193	C	C	.	.	T	Hydrogen-bonded Turn	trans	-54.8	-41.8	-177.8	-168.8	-99	0	0	0	112.2	F197 Y198 T199 R207 R335 C340	F197-Y201 HydrophobicContact CD1-CD2 4.28Å; F197-Y201 AromaticContact CE1-CD2 3.75Å; F197-Y201 HydrophobicContact CE1-CD2 3.75Å; F197-Y201 AromaticContact CE1-CE2 3.74Å; F197-Y201 HydrophobicContact CE1-CE2 3.74Å; F197-Y201 HydrophobicContact CZ-CD2 4.24Å; F197-Y201 HydrophobicContact CZ-CE2 4.05Å; F197-Y201 VanDerWaalsContact O-CA 3.25Å; F197-Y201 WeakPolarHBondContact O-CA 3.33Å; F197-Y201 PolarHBondContact O-N 2.97Å; F197-Y201 VanDerWaalsContact O-N 3.07Å; Y198-Y201 HydrophobicContact CD1-CD2 4.27Å; Y198-Y201 WeakPolarHBondContact O-CB 3.42Å; T199-Y201 VanDerWaalsContact C-N 3.32Å; T199-Y201 PolarHBondContact O-N 3.42Å; Y201-R207 PolarHBondContact O-NH1 3.27Å; Y201-R335 HydrophobicContact CD1-CB 4.39Å; Y201-R335 HydrophobicContact CD1-CG 4.35Å; Y201-R335 HydrophobicContact CG-CG 4.15Å; Y201-C340 VanDerWaalsContact CD1-SG 3.59Å
202	C	91.4	Very high	96	Very high	59 Å²	59	43.2 Å²	43.2	40%	0.399	21%	0.214	S	C	.	.	T	Hydrogen-bonded Turn	trans	-86.3	-5.3	179.7	-52.9	0	0	0	0	114.8	F200 C340	F200-C202 PolarHBondContact O-N 2.87Å; C202-C340 WeakPolarHBondContact CA-SG 3.49Å; C202-C340 HydrophobicContact CB-CB 3.74Å; C202-C340 WeakPolarHBondContact CB-SG 3.34Å; C202-C340 WeakPolarHBondContact SG-CA 3.25Å; C202-C340 WeakPolarHBondContact SG-CB 3.03Å; C202-C340 CovalentContact SG-SG 2.03Å; C202-C340 PolarHBondContact SG-SG 3.31Å
203	N	93.8	Very high	96	Very high	55 Å²	55	44.7 Å²	44.7	29%	0.294	23%	0.225	S	C	.	.			trans	-126.2	88.1	-177.8	-164.6	-51.1	0	0	0	110.7	F200 Y205 W206 R207	F200-N203 CarbonylContact O-C 3.52Å; F200-N203 PolarHBondContact O-N 2.96Å; N203-Y205 VanDerWaalsContact C-N 3.3Å; N203-Y205 PolarHBondContact O-N 3.4Å; N203-Y205 PolarHBondContact OD1-N 2.9Å; N203-W206 VanDerWaalsContact OD1-CD1 3.3Å; N203-W206 PolarHBondContact OD1-N 3.35Å; N203-W206 VanDerWaalsContact OD1-N 3.1Å; N203-R207 WeakPolarHBondContact O-CB 3.49Å; N203-R207 PolarHBondContact O-N 3.29Å
204	N	93.8	Very high	96	Very high	99 Å²	99	44 Å²	44	53%	0.529	22%	0.221	S	C	.	.	H	α-helix	trans	-59.7	-38.8	-176.4	-65.9	-20.8	0	0	0	112.6	R207 Q208	N204-R207 PolarHBondContact OD1-NH1 3.35Å; N204-R207 PolarHBondContact OD1-NH2 2.87Å; N204-Q208 WeakPolarHBondContact O-CG 3.09Å; N204-Q208 PolarHBondContact O-N 3.49Å; N204-Q208 VanDerWaalsContact O-N 3.09Å
205	Y	96.2	Very high	96	Very high	158 Å²	158	47.8 Å²	47.8	62%	0.62	24%	0.24	S	C	*	.	H	α-helix	trans	-61.2	-57	-178.6	175.4	-98.4	0	0	0	111.2	N203 R207 Q208 V209	N203-Y205 VanDerWaalsContact C-N 3.3Å; N203-Y205 PolarHBondContact O-N 3.4Å; N203-Y205 PolarHBondContact OD1-N 2.9Å; Y205-R207 VanDerWaalsContact C-N 3.31Å; Y205-R207 PolarHBondContact O-N 3.39Å; Y205-Q208 PolarHBondContact O-N 2.83Å; Y205-V209 HydrophobicContact CD1-CG2 4.37Å; Y205-V209 HydrophobicContact CE1-CG2 3.97Å; Y205-V209 HydrophobicContact CE2-CG2 4.32Å; Y205-V209 WeakPolarHBondContact O-CG2 3.31Å; Y205-V209 PolarHBondContact O-N 2.94Å
206	W	97.1	Very high	96.1	Very high	89 Å²	89	50 Å²	50	34%	0.337	26%	0.258	S	S	.	.	H	α-helix	trans	-66.8	-34.3	-178.6	-71.6	121.4	0	0	0	112.6	F200 N203 Q208 V209 Y210 H256	F200-W206 HydrophobicContact CD1-CB 3.68Å; F200-W206 HydrophobicContact CE1-CB 3.95Å; F200-W206 HydrophobicContact CG-CB 4.47Å; N203-W206 VanDerWaalsContact OD1-CD1 3.3Å; N203-W206 PolarHBondContact OD1-N 3.35Å; N203-W206 VanDerWaalsContact OD1-N 3.1Å; W206-Q208 VanDerWaalsContact C-N 3.33Å; W206-Q208 PolarHBondContact O-N 3.35Å; W206-V209 HydrophobicContact CE3-CB 4.26Å; W206-V209 HydrophobicContact CE3-CG1 4.23Å; W206-V209 HydrophobicContact CE3-CG2 4.44Å; W206-V209 HydrophobicContact CZ3-CG1 4.33Å; W206-V209 PolarHBondContact O-N 3.48Å; W206-Y210 HydrophobicContact CB-CD2 4.45Å; W206-Y210 HydrophobicContact CB-CE2 4.27Å; W206-Y210 HydrophobicContact CE3-CE2 4.31Å; W206-Y210 WeakPolarHBondContact O-CD2 3.28Å; W206-Y210 PolarHBondContact O-N 3.42Å; W206-H256 AromaticContact CD1-CE1 3.67Å; W206-H256 AromaticContact CD2-CE1 3.36Å; W206-H256 AromaticContact CE2-CE1 3.4Å; W206-H256 VanDerWaalsContact CE2-CE1 3.4Å; W206-H256 AromaticContact CE3-CE1 3.79Å; W206-H256 AromaticContact CG-CE1 3.57Å; W206-H256 AromaticContact CZ2-CE1 3.9Å; W206-H256 AromaticContact NE1-CE1 3.61Å
207	R	97	Very high	96.2	Very high	24 Å²	24	52 Å²	52	9%	0.091	27%	0.267	C	S	.	.	H	α-helix	trans	-54.2	-49.5	171.6	-174.1	172.3	69	-138.7	8.7	111.5	V196 F200 Y201 N203 N204 Y205 Y210 L211	V196-R207 HydrophobicContact CG1-CG 4.35Å; F200-R207 HydrophobicContact CB-CB 3.76Å; F200-R207 HydrophobicContact CB-CG 4.4Å; Y201-R207 PolarHBondContact O-NH1 3.27Å; N203-R207 WeakPolarHBondContact O-CB 3.49Å; N203-R207 PolarHBondContact O-N 3.29Å; N204-R207 PolarHBondContact OD1-NH1 3.35Å; N204-R207 PolarHBondContact OD1-NH2 2.87Å; Y205-R207 VanDerWaalsContact C-N 3.31Å; Y205-R207 PolarHBondContact O-N 3.39Å; R207-Y210 PolarHBondContact O-N 3.1Å; R207-L211 HydrophobicContact CG-CD1 4.01Å; R207-L211 VanDerWaalsContact O-CG 3.31Å; R207-L211 WeakPolarHBondContact O-CG 3.28Å; R207-L211 PolarHBondContact O-N 3.42Å
208	Q	97.3	Very high	96.2	Very high	102 Å²	102	51.7 Å²	51.7	48%	0.477	27%	0.266	S	S	.	.	H	α-helix	trans	-67.6	-42.7	-179.9	-66.4	-57.8	-22.4	0	0	112.5	N204 Y205 W206 Y210 L211 V212	N204-Q208 WeakPolarHBondContact O-CG 3.09Å; N204-Q208 PolarHBondContact O-N 3.49Å; N204-Q208 VanDerWaalsContact O-N 3.09Å; Y205-Q208 PolarHBondContact O-N 2.83Å; W206-Q208 VanDerWaalsContact C-N 3.33Å; W206-Q208 PolarHBondContact O-N 3.35Å; Q208-Y210 VanDerWaalsContact C-N 3.29Å; Q208-Y210 PolarHBondContact O-N 3.32Å; Q208-L211 PolarHBondContact O-N 2.98Å; Q208-V212 WeakPolarHBondContact O-CB 3.42Å; Q208-V212 VanDerWaalsContact O-CG2 3.32Å; Q208-V212 WeakPolarHBondContact O-CG2 3.45Å; Q208-V212 PolarHBondContact O-N 3Å
209	V	97.9	Very high	96.2	Very high	46 Å²	46	56.4 Å²	56.4	28%	0.279	29%	0.291	S	S	.	.	H	α-helix	trans	-53.8	-48.2	176.5	170.4	0	0	0	0	110.8	Y205 W206 T213	Y205-V209 HydrophobicContact CD1-CG2 4.37Å; Y205-V209 HydrophobicContact CE1-CG2 3.97Å; Y205-V209 HydrophobicContact CE2-CG2 4.32Å; Y205-V209 WeakPolarHBondContact O-CG2 3.31Å; Y205-V209 PolarHBondContact O-N 2.94Å; W206-V209 HydrophobicContact CE3-CB 4.26Å; W206-V209 HydrophobicContact CE3-CG1 4.23Å; W206-V209 HydrophobicContact CE3-CG2 4.44Å; W206-V209 HydrophobicContact CZ3-CG1 4.33Å; W206-V209 PolarHBondContact O-N 3.48Å; V209-T213 WeakPolarHBondContact O-CB 3.41Å; V209-T213 PolarHBondContact O-N 3.07Å; V209-T213 PolarHBondContact O-OG1 3.17Å
210	Y	98.2	Very high	96.4	Very high	13 Å²	13	58.5 Å²	58.5	5%	0.051	31%	0.31	C	S	.	.	H	α-helix	trans	-70.3	-42.8	-178.9	-72	-54.9	0	0	0	113.3	F200 W206 R207 Q208 T213 V214 Y249 I252 P253 H256	F200-Y210 HydrophobicContact CD1-CE2 4.48Å; F200-Y210 HydrophobicContact CD2-CD2 4.08Å; F200-Y210 HydrophobicContact CD2-CE2 4.49Å; F200-Y210 HydrophobicContact CE1-CD2 4.19Å; F200-Y210 AromaticContact CE1-CE2 3.73Å; F200-Y210 HydrophobicContact CE1-CE2 3.73Å; F200-Y210 AromaticContact CE2-CD2 3.66Å; F200-Y210 HydrophobicContact CE2-CD2 3.66Å; F200-Y210 AromaticContact CE2-CE2 3.76Å; F200-Y210 HydrophobicContact CE2-CE2 3.76Å; F200-Y210 AromaticContact CZ-CD2 3.72Å; F200-Y210 HydrophobicContact CZ-CD2 3.72Å; F200-Y210 AromaticContact CZ-CE2 3.31Å; F200-Y210 HydrophobicContact CZ-CE2 3.31Å; W206-Y210 HydrophobicContact CB-CD2 4.45Å; W206-Y210 HydrophobicContact CB-CE2 4.27Å; W206-Y210 HydrophobicContact CE3-CE2 4.31Å; W206-Y210 WeakPolarHBondContact O-CD2 3.28Å; W206-Y210 PolarHBondContact O-N 3.42Å; R207-Y210 PolarHBondContact O-N 3.1Å; Q208-Y210 VanDerWaalsContact C-N 3.29Å; Q208-Y210 PolarHBondContact O-N 3.32Å; Y210-T213 PolarHBondContact O-N 3.36Å; Y210-V214 VanDerWaalsContact O-CG2 3.29Å; Y210-V214 WeakPolarHBondContact O-CG2 3.33Å; Y210-V214 PolarHBondContact O-N 2.99Å; Y210-Y249 HydrophobicContact CD1-CE1 4.35Å; Y210-Y249 VanDerWaalsContact CD1-OH 3.31Å; Y210-Y249 WeakPolarHBondContact CD1-OH 3.37Å; Y210-I252 HydrophobicContact CE1-CG2 4.39Å; Y210-P253 HydrophobicContact CD1-CB 3.75Å; Y210-P253 HydrophobicContact CD1-CG 4.21Å; Y210-P253 HydrophobicContact CD2-CB 3.91Å; Y210-P253 HydrophobicContact CE1-CB 3.74Å; Y210-P253 HydrophobicContact CE1-CG 4.35Å; Y210-P253 HydrophobicContact CE2-CB 3.9Å; Y210-P253 HydrophobicContact CG-CB 3.86Å; Y210-H256 AromaticContact CE2-ND1 3.58Å; Y210-H256 AromaticContact CZ-ND1 3.62Å; Y210-H256 VanDerWaalsContact OH-CB 3.29Å; Y210-H256 WeakPolarHBondContact OH-CB 3.06Å; Y210-H256 PolarHBondContact OH-ND1 3.08Å
211	L	96.8	Very high	96.4	Very high	37 Å²	37	58.7 Å²	58.7	19%	0.194	31%	0.311	C	S	.	.	H	α-helix	trans	-64.4	-42.6	178.4	-70.4	176.5	0	0	0	112.2	V193 V196 R207 Q208 V214 L215	V193-L211 HydrophobicContact CG2-CD2 4.47Å; V196-L211 HydrophobicContact CB-CD2 3.96Å; V196-L211 HydrophobicContact CB-CG 4.39Å; V196-L211 HydrophobicContact CG1-CD2 4.04Å; V196-L211 HydrophobicContact CG1-CG 3.91Å; R207-L211 HydrophobicContact CG-CD1 4.01Å; R207-L211 VanDerWaalsContact O-CG 3.31Å; R207-L211 WeakPolarHBondContact O-CG 3.28Å; R207-L211 PolarHBondContact O-N 3.42Å; Q208-L211 PolarHBondContact O-N 2.98Å; L211-V214 PolarHBondContact O-N 2.93Å; L211-L215 WeakPolarHBondContact O-CB 3.49Å; L211-L215 PolarHBondContact O-N 3.17Å
212	V	97.8	Very high	96.5	Very high	88 Å²	88	59.2 Å²	59.2	53%	0.533	32%	0.315	S	S	.	.	H	α-helix	trans	-65.3	-42	175.7	171.4	0	0	0	0	111	Q208 L215 A216	Q208-V212 WeakPolarHBondContact O-CB 3.42Å; Q208-V212 VanDerWaalsContact O-CG2 3.32Å; Q208-V212 WeakPolarHBondContact O-CG2 3.45Å; Q208-V212 PolarHBondContact O-N 3Å; V212-L215 PolarHBondContact O-N 3.49Å; V212-A216 WeakPolarHBondContact O-CB 3.09Å; V212-A216 PolarHBondContact O-N 3Å
213	T	97.9	Very high	96.7	Very high	49 Å²	49	64 Å²	64	30%	0.301	33%	0.329	S	S	.	.	H	α-helix	trans	-62.5	-46.5	177.9	-56.3	0	0	0	0	111.3	V209 Y210 L215 A216 M217 Y249	V209-T213 WeakPolarHBondContact O-CB 3.41Å; V209-T213 PolarHBondContact O-N 3.07Å; V209-T213 PolarHBondContact O-OG1 3.17Å; Y210-T213 PolarHBondContact O-N 3.36Å; T213-L215 VanDerWaalsContact C-N 3.34Å; T213-L215 PolarHBondContact O-N 3.16Å; T213-A216 PolarHBondContact O-N 3.41Å; T213-M217 HydrophobicContact CG2-SD 4.37Å; T213-M217 WeakPolarHBondContact O-CG 3.34Å; T213-M217 PolarHBondContact O-N 3.27Å; T213-Y249 WeakPolarHBondContact CB-OH 3.33Å; T213-Y249 HydrophobicContact CG2-CE1 4.27Å; T213-Y249 HydrophobicContact CG2-CE2 4.03Å; T213-Y249 VanDerWaalsContact CG2-OH 3.23Å; T213-Y249 WeakPolarHBondContact CG2-OH 3.38Å
214	V	97.5	Very high	96.7	Very high	2 Å²	2	62.7 Å²	62.7	1%	0.012	33%	0.326	C	S	.	.	H	α-helix	trans	-60.4	-45.2	176.1	170.9	0	0	0	0	110.7	L189 Y192 Y210 L211 A216 M217 I218 Y249	L189-V214 HydrophobicContact CD1-CG1 3.99Å; Y192-V214 HydrophobicContact CD1-CG2 3.6Å; Y192-V214 HydrophobicContact CD2-CB 4.44Å; Y192-V214 HydrophobicContact CD2-CG1 3.53Å; Y192-V214 HydrophobicContact CD2-CG2 3.98Å; Y192-V214 HydrophobicContact CE1-CG2 3.87Å; Y192-V214 HydrophobicContact CE2-CG1 4.2Å; Y192-V214 HydrophobicContact CE2-CG2 4.23Å; Y192-V214 HydrophobicContact CG-CB 4.31Å; Y192-V214 HydrophobicContact CG-CG1 3.71Å; Y192-V214 HydrophobicContact CG-CG2 3.66Å; Y210-V214 VanDerWaalsContact O-CG2 3.29Å; Y210-V214 WeakPolarHBondContact O-CG2 3.33Å; Y210-V214 PolarHBondContact O-N 2.99Å; L211-V214 PolarHBondContact O-N 2.93Å; V214-A216 VanDerWaalsContact C-N 3.33Å; V214-A216 PolarHBondContact O-N 3.33Å; V214-M217 PolarHBondContact O-N 3.35Å; V214-I218 HydrophobicContact CG1-CG1 4.31Å; V214-I218 WeakPolarHBondContact O-CG1 3.25Å; V214-I218 PolarHBondContact O-N 3.42Å; V214-Y249 HydrophobicContact CG2-CD1 4.04Å; V214-Y249 HydrophobicContact CG2-CE1 3.83Å
215	L	96.6	Very high	96.7	Very high	86 Å²	86	59.7 Å²	59.7	45%	0.45	31%	0.308	S	S	.	.	H	α-helix	trans	-57.8	-46.2	176.6	179.3	62	0	0	0	111.4	L211 V212 T213 M217 I218 L219	L211-L215 WeakPolarHBondContact O-CB 3.49Å; L211-L215 PolarHBondContact O-N 3.17Å; V212-L215 PolarHBondContact O-N 3.49Å; T213-L215 VanDerWaalsContact C-N 3.34Å; T213-L215 PolarHBondContact O-N 3.16Å; L215-M217 VanDerWaalsContact C-N 3.34Å; L215-M217 PolarHBondContact O-N 3.1Å; L215-I218 PolarHBondContact O-N 3.39Å; L215-L219 HydrophobicContact CD1-CD1 4.43Å; L215-L219 HydrophobicContact CD1-CG 4.38Å; L215-L219 HydrophobicContact CG-CD1 4.19Å; L215-L219 VanDerWaalsContact O-CG 3.3Å; L215-L219 WeakPolarHBondContact O-CG 3.42Å; L215-L219 PolarHBondContact O-N 2.7Å
216	A	97.8	Very high	96.5	Very high	54 Å²	54	58.3 Å²	58.3	45%	0.446	31%	0.311	S	S	.	.	H	α-helix	trans	-61	-41.6	176.7	0	0	0	0	0	112.2	V212 T213 V214 L219 A220	V212-A216 WeakPolarHBondContact O-CB 3.09Å; V212-A216 PolarHBondContact O-N 3Å; T213-A216 PolarHBondContact O-N 3.41Å; V214-A216 VanDerWaalsContact C-N 3.33Å; V214-A216 PolarHBondContact O-N 3.33Å; A216-L219 PolarHBondContact O-N 3.45Å; A216-A220 WeakPolarHBondContact O-CB 3.08Å; A216-A220 PolarHBondContact O-N 3.17Å
217	M	97.4	Very high	96.3	Very high	48 Å²	48	57.8 Å²	57.8	24%	0.236	31%	0.312	C	S	.	.	H	α-helix	trans	-62.3	-44	175.1	-69.2	179.5	78.3	0	0	111.8	T213 V214 L215 A220 V221 V246 Y249	T213-M217 HydrophobicContact CG2-SD 4.37Å; T213-M217 WeakPolarHBondContact O-CG 3.34Å; T213-M217 PolarHBondContact O-N 3.27Å; V214-M217 PolarHBondContact O-N 3.35Å; L215-M217 VanDerWaalsContact C-N 3.34Å; L215-M217 PolarHBondContact O-N 3.1Å; M217-A220 WeakPolarHBondContact O-CB 3.38Å; M217-A220 PolarHBondContact O-N 3.37Å; M217-V221 WeakPolarHBondContact O-CG2 3.39Å; M217-V221 PolarHBondContact O-N 3Å; M217-V246 HydrophobicContact CB-CG1 4.47Å; M217-V246 HydrophobicContact CE-CB 4.3Å; M217-V246 HydrophobicContact CE-CG1 4.48Å; M217-V246 HydrophobicContact CE-CG2 4.02Å; M217-Y249 HydrophobicContact CE-CD2 4.44Å; M217-Y249 HydrophobicContact CE-CG 4.18Å; M217-Y249 HydrophobicContact SD-CD1 3.97Å; M217-Y249 HydrophobicContact SD-CD2 3.91Å; M217-Y249 HydrophobicContact SD-CE1 4.43Å; M217-Y249 HydrophobicContact SD-CE2 4.37Å; M217-Y249 HydrophobicContact SD-CG 3.69Å
218	I	97.1	Very high	95.9	Very high	4 Å²	4	62 Å²	62	2%	0.021	34%	0.342	C	S	.	.	H	α-helix	trans	-64.2	-41.9	177.5	-65.3	-61.4	0	0	0	111.4	S185 I188 L189 V214 L215 A220 V221 F222 V246	S185-I218 WeakPolarHBondContact O-CD1 3.28Å; I188-I218 HydrophobicContact CG2-CD1 4.46Å; L189-I218 HydrophobicContact CB-CG1 4.37Å; V214-I218 HydrophobicContact CG1-CG1 4.31Å; V214-I218 WeakPolarHBondContact O-CG1 3.25Å; V214-I218 PolarHBondContact O-N 3.42Å; L215-I218 PolarHBondContact O-N 3.39Å; I218-A220 VanDerWaalsContact C-N 3.32Å; I218-A220 PolarHBondContact O-N 3.23Å; I218-V221 WeakPolarHBondContact O-CB 3.27Å; I218-V221 PolarHBondContact O-N 3.44Å; I218-F222 HydrophobicContact CG2-CD2 4.24Å; I218-F222 HydrophobicContact CG2-CE1 4.48Å; I218-F222 HydrophobicContact CG2-CE2 3.72Å; I218-F222 HydrophobicContact CG2-CZ 3.85Å; I218-F222 PolarHBondContact O-N 3.31Å; I218-V246 HydrophobicContact CD1-CG1 3.93Å
219	L	96.6	Very high	95.6	Very high	99 Å²	99	60.7 Å²	60.7	52%	0.518	34%	0.338	S	S	.	.	H	α-helix	trans	-62.6	-39.3	174.4	-69.1	174	0	0	0	111.8	L215 A216 V221 F222 F223	L215-L219 HydrophobicContact CD1-CD1 4.43Å; L215-L219 HydrophobicContact CD1-CG 4.38Å; L215-L219 HydrophobicContact CG-CD1 4.19Å; L215-L219 VanDerWaalsContact O-CG 3.3Å; L215-L219 WeakPolarHBondContact O-CG 3.42Å; L215-L219 PolarHBondContact O-N 2.7Å; A216-L219 PolarHBondContact O-N 3.45Å; L219-V221 VanDerWaalsContact C-N 3.34Å; L219-V221 PolarHBondContact O-N 3.43Å; L219-F222 HydrophobicContact CD2-CD2 4.43Å; L219-F222 PolarHBondContact O-N 2.89Å; L219-F223 PolarHBondContact O-N 3.38Å
220	A	96.9	Very high	95.3	Very high	60 Å²	60	58.6 Å²	58.6	50%	0.496	33%	0.325	S	S	.	.	H	α-helix	trans	-63.7	-38.4	174.2	0	0	0	0	0	112	A216 M217 I218 F223 A224	A216-A220 WeakPolarHBondContact O-CB 3.08Å; A216-A220 PolarHBondContact O-N 3.17Å; M217-A220 WeakPolarHBondContact O-CB 3.38Å; M217-A220 PolarHBondContact O-N 3.37Å; I218-A220 VanDerWaalsContact C-N 3.32Å; I218-A220 PolarHBondContact O-N 3.23Å; A220-F223 PolarHBondContact O-N 3.41Å; A220-A224 PolarHBondContact O-N 3.01Å
221	V	96.2	Very high	94.9	Very high	5 Å²	5	59.8 Å²	59.8	3%	0.03	33%	0.332	C	S	.	.	H	α-helix	trans	-62.9	-43.8	172.5	176.5	0	0	0	0	111.1	S185 M217 I218 L219 F223 A224 Q225 I242 F243 V246	S185-V221 WeakPolarHBondContact OG-CG1 3.39Å; M217-V221 WeakPolarHBondContact O-CG2 3.39Å; M217-V221 PolarHBondContact O-N 3Å; I218-V221 WeakPolarHBondContact O-CB 3.27Å; I218-V221 PolarHBondContact O-N 3.44Å; L219-V221 VanDerWaalsContact C-N 3.34Å; L219-V221 PolarHBondContact O-N 3.43Å; V221-F223 VanDerWaalsContact C-N 3.32Å; V221-F223 PolarHBondContact O-N 3.34Å; V221-A224 WeakPolarHBondContact O-CB 3.32Å; V221-A224 PolarHBondContact O-N 3.37Å; V221-Q225 WeakPolarHBondContact O-CG 3.42Å; V221-Q225 PolarHBondContact O-N 3.41Å; V221-I242 HydrophobicContact CG1-CG2 4.41Å; V221-I242 HydrophobicContact CG2-CG2 3.66Å; V221-F243 HydrophobicContact CG1-CE1 4.05Å; V221-V246 HydrophobicContact CG2-CG2 3.77Å
222	F	95.4	Very high	94.6	Very high	67 Å²	67	59.1 Å²	59.1	29%	0.294	33%	0.331	S	S	.	.	H	α-helix	trans	-63.1	-38.2	175.9	-67.9	-26.7	0	0	0	112.4	A182 I186 I218 L219 Q225	A182-F222 HydrophobicContact CB-CE1 3.93Å; I186-F222 HydrophobicContact CG1-CZ 4.05Å; I218-F222 HydrophobicContact CG2-CD2 4.24Å; I218-F222 HydrophobicContact CG2-CE1 4.48Å; I218-F222 HydrophobicContact CG2-CE2 3.72Å; I218-F222 HydrophobicContact CG2-CZ 3.85Å; I218-F222 PolarHBondContact O-N 3.31Å; L219-F222 HydrophobicContact CD2-CD2 4.43Å; L219-F222 PolarHBondContact O-N 2.89Å; F222-Q225 WeakPolarHBondContact O-CB 3.46Å; F222-Q225 PolarHBondContact O-N 2.93Å
223	F	95.3	Very high	94.1	Very high	160 Å²	160	61 Å²	61	70%	0.702	33%	0.332	S	S	*	.	H	α-helix	trans	-63.5	-43.5	173.4	-172.3	-99.2	0	0	0	111.6	L219 A220 V221 Q225 I226	L219-F223 PolarHBondContact O-N 3.38Å; A220-F223 PolarHBondContact O-N 3.41Å; V221-F223 VanDerWaalsContact C-N 3.32Å; V221-F223 PolarHBondContact O-N 3.34Å; F223-Q225 PolarHBondContact O-N 3.47Å; F223-I226 HydrophobicContact CD2-CD1 4.16Å; F223-I226 WeakPolarHBondContact O-CB 3.35Å; F223-I226 PolarHBondContact O-N 3.01Å; F223-I226 VanDerWaalsContact O-N 3.1Å
224	A	94.1	Very high	93.7	Very high	27 Å²	27	66.2 Å²	66.2	22%	0.223	35%	0.353	C	S	.	.	H	α-helix	trans	-60.6	-32.1	175.2	0	0	0	0	0	112.7	A220 V221 I226 H227 Y230	A220-A224 PolarHBondContact O-N 3.01Å; V221-A224 WeakPolarHBondContact O-CB 3.32Å; V221-A224 PolarHBondContact O-N 3.37Å; A224-I226 PolarHBondContact O-N 3.13Å; A224-H227 VanDerWaalsContact O-CB 3.25Å; A224-H227 WeakPolarHBondContact O-CB 3.2Å; A224-H227 PolarHBondContact O-N 3.02Å; A224-Y230 HydrophobicContact CB-CD2 4.39Å; A224-Y230 HydrophobicContact CB-CE2 4.29Å; A224-Y230 VanDerWaalsContact O-CD2 3.26Å; A224-Y230 WeakPolarHBondContact O-CD2 3.46Å
225	Q	93.5	Very high	93.4	Very high	35 Å²	35	69.2 Å²	69.2	16%	0.164	36%	0.364	C	S	.	.	H	α-helix	trans	-65.8	-23.3	176.4	-74.9	178.1	9.7	0	0	113.9	Y181 V221 F222 F223 H227 Y230	Y181-Q225 PolarHBondContact O-NE2 3.17Å; V221-Q225 WeakPolarHBondContact O-CG 3.42Å; V221-Q225 PolarHBondContact O-N 3.41Å; F222-Q225 WeakPolarHBondContact O-CB 3.46Å; F222-Q225 PolarHBondContact O-N 2.93Å; F223-Q225 PolarHBondContact O-N 3.47Å; Q225-H227 PolarHBondContact O-N 2.83Å; Q225-Y230 HydrophobicContact CB-CD1 4.36Å; Q225-Y230 HydrophobicContact CB-CE1 4.35Å; Q225-Y230 HydrophobicContact CG-CD1 3.95Å; Q225-Y230 HydrophobicContact CG-CD2 4.45Å; Q225-Y230 HydrophobicContact CG-CE1 3.47Å; Q225-Y230 VanDerWaalsContact CG-CE1 3.47Å; Q225-Y230 HydrophobicContact CG-CE2 3.99Å; Q225-Y230 HydrophobicContact CG-CG 4.42Å; Q225-Y230 VanDerWaalsContact CG-CZ 3.45Å
226	I	92.3	Very high	93.1	Very high	130 Å²	130	68.9 Å²	68.9	67%	0.667	36%	0.359	S	S	*	.	H	α-helix	trans	-68.4	-24.4	176.3	-58.8	170.8	0	0	0	110.6	F223 A224	F223-I226 HydrophobicContact CD2-CD1 4.16Å; F223-I226 WeakPolarHBondContact O-CB 3.35Å; F223-I226 PolarHBondContact O-N 3.01Å; F223-I226 VanDerWaalsContact O-N 3.1Å; A224-I226 PolarHBondContact O-N 3.13Å
227	H	93.1	Very high	92.8	Very high	78 Å²	78	74.3 Å²	74.3	36%	0.361	38%	0.375	S	S	.	.	S	Bend	trans	-62.4	130.3	-177.2	-169.4	-93	0	0	0	111.5	A224 Q225 L229 Y230 W235	A224-H227 VanDerWaalsContact O-CB 3.25Å; A224-H227 WeakPolarHBondContact O-CB 3.2Å; A224-H227 PolarHBondContact O-N 3.02Å; Q225-H227 PolarHBondContact O-N 2.83Å; H227-L229 PolarHBondContact ND1-N 3.38Å; H227-L229 PolarHBondContact O-N 3.42Å; H227-L229 VanDerWaalsContact O-N 3.08Å; H227-Y230 WeakPolarHBondContact O-CB 3.27Å; H227-Y230 PolarHBondContact O-N 3.24Å; H227-W235 HydrophobicContact CB-CH2 4.35Å; H227-W235 HydrophobicContact CB-CZ3 4.29Å; H227-W235 AromaticContact CE1-CH2 3.55Å; H227-W235 AromaticContact CE1-CZ2 3.44Å; H227-W235 VanDerWaalsContact CE1-CZ2 3.44Å; H227-W235 WeakPolarHBondContact CE1-CZ2 3.5Å; H227-W235 AromaticContact CG-CH2 3.7Å; H227-W235 AromaticContact ND1-CH2 3.23Å; H227-W235 WeakPolarHBondContact ND1-CH2 3.05Å; H227-W235 AromaticContact ND1-CZ2 3.49Å; H227-W235 WeakPolarHBondContact ND1-CZ2 3.38Å; H227-W235 AromaticContact ND1-CZ3 3.72Å
228	P	89.3	Confident	92.6	Very high	113 Å²	113	75.8 Å²	75.8	73%	0.734	38%	0.383	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.9	-25.8	-172.6	23.1	-34.7	0	0	0	113.9
229	L	89.9	Confident	92.4	Very high	74 Å²	74	76 Å²	76	39%	0.387	38%	0.384	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.6	-7.4	177.4	-55.8	-177.8	0	0	0	113.7	H227 L231 S232 W235	H227-L229 PolarHBondContact ND1-N 3.38Å; H227-L229 PolarHBondContact O-N 3.42Å; H227-L229 VanDerWaalsContact O-N 3.08Å; L229-L231 VanDerWaalsContact C-N 3.29Å; L229-L231 PolarHBondContact O-N 3.23Å; L229-S232 WeakPolarHBondContact O-CB 3.37Å; L229-S232 PolarHBondContact O-N 3.35Å; L229-S232 PolarHBondContact O-OG 3.07Å; L229-W235 HydrophobicContact CB-CD2 4.07Å; L229-W235 HydrophobicContact CB-CG 4.22Å; L229-W235 HydrophobicContact CB-CZ2 4.17Å; L229-W235 WeakPolarHBondContact O-CB 3.44Å
230	Y	91.3	Very high	92.2	Very high	2 Å²	2	72.5 Å²	72.5	1%	0.008	37%	0.368	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59.6	-38	-173.4	-174.8	-87.9	0	0	0	113.2	Y181 A224 Q225 H227 S232 W235 R239 F243	Y181-Y230 HydrophobicContact CD2-CE1 4.26Å; Y181-Y230 HydrophobicContact CG-CE1 4.4Å; A224-Y230 HydrophobicContact CB-CD2 4.39Å; A224-Y230 HydrophobicContact CB-CE2 4.29Å; A224-Y230 VanDerWaalsContact O-CD2 3.26Å; A224-Y230 WeakPolarHBondContact O-CD2 3.46Å; Q225-Y230 HydrophobicContact CB-CD1 4.36Å; Q225-Y230 HydrophobicContact CB-CE1 4.35Å; Q225-Y230 HydrophobicContact CG-CD1 3.95Å; Q225-Y230 HydrophobicContact CG-CD2 4.45Å; Q225-Y230 HydrophobicContact CG-CE1 3.47Å; Q225-Y230 VanDerWaalsContact CG-CE1 3.47Å; Q225-Y230 HydrophobicContact CG-CE2 3.99Å; Q225-Y230 HydrophobicContact CG-CG 4.42Å; Q225-Y230 VanDerWaalsContact CG-CZ 3.45Å; H227-Y230 WeakPolarHBondContact O-CB 3.27Å; H227-Y230 PolarHBondContact O-N 3.24Å; Y230-S232 VanDerWaalsContact C-N 3.31Å; Y230-W235 HydrophobicContact CD2-CE3 4.27Å; Y230-W235 HydrophobicContact CD2-CZ3 4.5Å; Y230-R239 VanDerWaalsContact CE1-CD 3.41Å; Y230-R239 HydrophobicContact CE1-CG 4.03Å; Y230-R239 HydrophobicContact CE2-CG 4.28Å; Y230-R239 PolarHBondContact O-NH1 3.48Å; Y230-R239 WeakPolarHBondContact OH-CG 3.48Å; Y230-F243 WeakPolarHBondContact OH-CZ 3.38Å
231	L	90.8	Very high	92.1	Very high	37 Å²	37	74.7 Å²	74.7	19%	0.194	37%	0.37	C	S	.	.	T	Hydrogen-bonded Turn	trans	-87.1	3.3	177.1	-59.4	177.8	0	0	0	113.4	R174 M177 A178 Y181 L229	R174-L231 HydrophobicContact CB-CD1 4.2Å; R174-L231 WeakPolarHBondContact O-CD1 3.36Å; M177-L231 HydrophobicContact CG-CD2 4.18Å; M177-L231 HydrophobicContact SD-CB 4.48Å; M177-L231 HydrophobicContact SD-CD2 4.18Å; A178-L231 HydrophobicContact CB-CD1 4.18Å; A178-L231 HydrophobicContact CB-CD2 4.45Å; Y181-L231 HydrophobicContact CD2-CD2 3.65Å; Y181-L231 HydrophobicContact CE2-CD2 3.87Å; L229-L231 VanDerWaalsContact C-N 3.29Å; L229-L231 PolarHBondContact O-N 3.23Å
232	S	89.7	Confident	92.1	Very high	24 Å²	24	76.3 Å²	76.3	17%	0.168	38%	0.378	C	S	.	.	S	Bend	trans	-74.5	158.5	178.1	76.7	0	0	0	0	111.5	L229 Y230 Q234 W235	L229-S232 WeakPolarHBondContact O-CB 3.37Å; L229-S232 PolarHBondContact O-N 3.35Å; L229-S232 PolarHBondContact O-OG 3.07Å; Y230-S232 VanDerWaalsContact C-N 3.31Å; S232-Q234 PolarHBondContact O-N 2.91Å; S232-Q234 PolarHBondContact OG-N 3.06Å; S232-W235 PolarHBondContact O-N 3.05Å; S232-W235 PolarHBondContact OG-N 3.22Å
233	K	87.1	Confident	92	Very high	128 Å²	128	74.4 Å²	74.4	56%	0.557	37%	0.37	S	S	*	.	S	Bend	trans	-63.7	-30.5	172.4	-67.6	-175.6	177.1	-177.5	0	112.2	R77 W235 K236	R77-K233 PolarHBondContact O-NZ 3.32Å; K233-W235 VanDerWaalsContact C-N 3.32Å; K233-W235 PolarHBondContact O-N 2.87Å; K233-K236 VanDerWaalsContact O-CB 3.26Å; K233-K236 WeakPolarHBondContact O-CB 3.43Å; K233-K236 PolarHBondContact O-N 3.34Å
234	Q	89.4	Confident	92.1	Very high	158 Å²	158	69.3 Å²	69.3	74%	0.738	35%	0.354	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.2	-38.6	179.8	-64.5	174.5	-10.5	0	0	111.7	S232 K236	S232-Q234 PolarHBondContact O-N 2.91Å; S232-Q234 PolarHBondContact OG-N 3.06Å; Q234-K236 VanDerWaalsContact C-N 3.3Å; Q234-K236 PolarHBondContact O-N 3.29Å
235	W	92.1	Very high	92.2	Very high	64 Å²	64	71.2 Å²	71.2	24%	0.242	37%	0.365	C	S	.	.	T	Hydrogen-bonded Turn	trans	-87.2	5	-178.6	-78.1	39.7	0	0	0	113.6	H227 L229 Y230 S232 K233 Q237 L238 R239	H227-W235 HydrophobicContact CB-CH2 4.35Å; H227-W235 HydrophobicContact CB-CZ3 4.29Å; H227-W235 AromaticContact CE1-CH2 3.55Å; H227-W235 AromaticContact CE1-CZ2 3.44Å; H227-W235 VanDerWaalsContact CE1-CZ2 3.44Å; H227-W235 WeakPolarHBondContact CE1-CZ2 3.5Å; H227-W235 AromaticContact CG-CH2 3.7Å; H227-W235 AromaticContact ND1-CH2 3.23Å; H227-W235 WeakPolarHBondContact ND1-CH2 3.05Å; H227-W235 AromaticContact ND1-CZ2 3.49Å; H227-W235 WeakPolarHBondContact ND1-CZ2 3.38Å; H227-W235 AromaticContact ND1-CZ3 3.72Å; L229-W235 HydrophobicContact CB-CD2 4.07Å; L229-W235 HydrophobicContact CB-CG 4.22Å; L229-W235 HydrophobicContact CB-CZ2 4.17Å; L229-W235 WeakPolarHBondContact O-CB 3.44Å; Y230-W235 HydrophobicContact CD2-CE3 4.27Å; Y230-W235 HydrophobicContact CD2-CZ3 4.5Å; S232-W235 PolarHBondContact O-N 3.05Å; S232-W235 PolarHBondContact OG-N 3.22Å; K233-W235 VanDerWaalsContact C-N 3.32Å; K233-W235 PolarHBondContact O-N 2.87Å; W235-Q237 VanDerWaalsContact C-N 3.33Å; W235-Q237 PolarHBondContact O-N 2.96Å; W235-L238 HydrophobicContact CD2-CD2 4.04Å; W235-L238 HydrophobicContact CE3-CD2 3.89Å; W235-L238 HydrophobicContact CH2-CD2 4.47Å; W235-L238 HydrophobicContact CZ3-CD2 4.14Å; W235-L238 PolarHBondContact O-N 2.61Å; W235-R239 VanDerWaalsContact O-CB 3.3Å; W235-R239 WeakPolarHBondContact O-CB 3.34Å; W235-R239 PolarHBondContact O-N 3.07Å
236	K	89.9	Confident	92.4	Very high	79 Å²	79	70 Å²	70	34%	0.343	36%	0.36	S	S	.	.	H	α-helix	trans	-54.5	-48.4	-179.2	-180	-178.1	174.5	-177.1	0	112.1	K233 Q234 R239 S240	K233-K236 VanDerWaalsContact O-CB 3.26Å; K233-K236 WeakPolarHBondContact O-CB 3.43Å; K233-K236 PolarHBondContact O-N 3.34Å; Q234-K236 VanDerWaalsContact C-N 3.3Å; Q234-K236 PolarHBondContact O-N 3.29Å; K236-R239 PolarHBondContact O-N 2.78Å; K236-S240 PolarHBondContact O-N 3.36Å; K236-S240 VanDerWaalsContact O-N 3.08Å; K236-S240 PolarHBondContact O-OG 3.03Å
237	Q	90.9	Very high	92.6	Very high	169 Å²	169	65.6 Å²	65.6	79%	0.79	34%	0.343	S	S	*	.	H	α-helix	trans	-66.3	-45.6	179.9	-70.8	-179.6	-14.6	0	0	111.8	W235 R239 S240 L241	W235-Q237 VanDerWaalsContact C-N 3.33Å; W235-Q237 PolarHBondContact O-N 2.96Å; Q237-R239 VanDerWaalsContact C-N 3.32Å; Q237-R239 PolarHBondContact O-N 3.43Å; Q237-S240 PolarHBondContact O-N 3.21Å; Q237-L241 WeakPolarHBondContact O-CB 3.5Å; Q237-L241 PolarHBondContact O-N 3.23Å
238	L	93.6	Very high	92.8	Very high	78 Å²	78	63.3 Å²	63.3	41%	0.408	34%	0.34	S	S	.	.	H	α-helix	trans	-60.3	-42.4	177.6	179.3	59.1	0	0	0	111.6	W235 L241 I242	W235-L238 HydrophobicContact CD2-CD2 4.04Å; W235-L238 HydrophobicContact CE3-CD2 3.89Å; W235-L238 HydrophobicContact CH2-CD2 4.47Å; W235-L238 HydrophobicContact CZ3-CD2 4.14Å; W235-L238 PolarHBondContact O-N 2.61Å; L238-L241 WeakPolarHBondContact O-CB 3.43Å; L238-L241 PolarHBondContact O-N 2.98Å; L238-I242 HydrophobicContact CD1-CD1 4.36Å; L238-I242 HydrophobicContact CD1-CG1 4.41Å; L238-I242 HydrophobicContact CG-CD1 4.06Å; L238-I242 VanDerWaalsContact O-CG1 3.28Å; L238-I242 WeakPolarHBondContact O-CG1 3.28Å; L238-I242 PolarHBondContact O-N 3.17Å
239	R	93.5	Very high	93.1	Very high	10 Å²	10	59.6 Å²	59.6	4%	0.038	31%	0.312	C	S	.	.	H	α-helix	trans	-62	-46.6	176.7	-179.1	173.4	65.9	-124.7	0.4	111.9	Y181 Y230 W235 K236 Q237 L241 I242 F243	Y181-R239 VanDerWaalsContact CE1-NE 3.3Å; Y181-R239 PolarHBondContact OH-NE 3.38Å; Y181-R239 PolarHBondContact OH-NH2 2.94Å; Y230-R239 VanDerWaalsContact CE1-CD 3.41Å; Y230-R239 HydrophobicContact CE1-CG 4.03Å; Y230-R239 HydrophobicContact CE2-CG 4.28Å; Y230-R239 PolarHBondContact O-NH1 3.48Å; Y230-R239 WeakPolarHBondContact OH-CG 3.48Å; W235-R239 VanDerWaalsContact O-CB 3.3Å; W235-R239 WeakPolarHBondContact O-CB 3.34Å; W235-R239 PolarHBondContact O-N 3.07Å; K236-R239 PolarHBondContact O-N 2.78Å; Q237-R239 VanDerWaalsContact C-N 3.32Å; Q237-R239 PolarHBondContact O-N 3.43Å; R239-L241 VanDerWaalsContact C-N 3.31Å; R239-L241 PolarHBondContact O-N 3.28Å; R239-I242 PolarHBondContact O-N 3.37Å; R239-F243 HydrophobicContact CG-CD2 3.94Å; R239-F243 HydrophobicContact CG-CE2 3.53Å; R239-F243 WeakPolarHBondContact O-CD2 3.41Å; R239-F243 PolarHBondContact O-N 3.47Å; R239-F243 VanDerWaalsContact O-N 3.1Å
240	S	91.8	Very high	93.4	Very high	25 Å²	25	56.2 Å²	56.2	18%	0.175	30%	0.296	C	S	.	.	H	α-helix	trans	-59.8	-42.4	174	-68.6	0	0	0	0	111.5	K236 Q237 F243 C244	K236-S240 PolarHBondContact O-N 3.36Å; K236-S240 VanDerWaalsContact O-N 3.08Å; K236-S240 PolarHBondContact O-OG 3.03Å; Q237-S240 PolarHBondContact O-N 3.21Å; S240-F243 PolarHBondContact O-N 3.08Å; S240-C244 WeakPolarHBondContact O-CB 3.25Å; S240-C244 PolarHBondContact O-N 3.31Å; S240-C244 PolarHBondContact O-SG 2.86Å
241	L	94.8	Very high	93.7	Very high	106 Å²	106	60.4 Å²	60.4	56%	0.555	32%	0.317	S	S	*	.	H	α-helix	trans	-61.7	-44.3	176.4	-178.3	63.8	0	0	0	111.8	Q237 L238 R239 F243 C244 S245	Q237-L241 WeakPolarHBondContact O-CB 3.5Å; Q237-L241 PolarHBondContact O-N 3.23Å; L238-L241 WeakPolarHBondContact O-CB 3.43Å; L238-L241 PolarHBondContact O-N 2.98Å; R239-L241 VanDerWaalsContact C-N 3.31Å; R239-L241 PolarHBondContact O-N 3.28Å; L241-F243 PolarHBondContact O-N 3.35Å; L241-C244 PolarHBondContact O-N 3.38Å; L241-S245 WeakPolarHBondContact O-CB 3.2Å; L241-S245 PolarHBondContact O-N 3.29Å; L241-S245 PolarHBondContact O-OG 3.01Å
242	I	95.4	Very high	94	Very high	39 Å²	39	63.1 Å²	63.1	20%	0.2	33%	0.331	C	S	.	.	H	α-helix	trans	-56.3	-50.7	176.1	-71.4	164.7	0	0	0	110.6	V221 L238 R239 C244 S245 V246	V221-I242 HydrophobicContact CG1-CG2 4.41Å; V221-I242 HydrophobicContact CG2-CG2 3.66Å; L238-I242 HydrophobicContact CD1-CD1 4.36Å; L238-I242 HydrophobicContact CD1-CG1 4.41Å; L238-I242 HydrophobicContact CG-CD1 4.06Å; L238-I242 VanDerWaalsContact O-CG1 3.28Å; L238-I242 WeakPolarHBondContact O-CG1 3.28Å; L238-I242 PolarHBondContact O-N 3.17Å; R239-I242 PolarHBondContact O-N 3.37Å; I242-C244 PolarHBondContact O-N 2.91Å; I242-S245 PolarHBondContact O-N 3.3Å; I242-V246 VanDerWaalsContact O-CG2 3.29Å; I242-V246 WeakPolarHBondContact O-CG2 3.43Å; I242-V246 PolarHBondContact O-N 3.48Å
243	F	95.1	Very high	94.4	Very high	27 Å²	27	62.3 Å²	62.3	12%	0.118	33%	0.326	C	S	.	.	H	α-helix	trans	-63.4	-40.9	178.3	-71	-56.1	0	0	0	112.6	Y181 V184 I188 V221 Y230 R239 S240 L241 S245 V246 A247	Y181-F243 AromaticContact CD1-CE2 3.77Å; Y181-F243 HydrophobicContact CD1-CE2 3.77Å; Y181-F243 HydrophobicContact CD1-CZ 4.12Å; Y181-F243 HydrophobicContact CE1-CE2 4.47Å; Y181-F243 HydrophobicContact CG-CE2 4.45Å; Y181-F243 HydrophobicContact CG-CZ 4.49Å; Y181-F243 WeakPolarHBondContact O-CZ 3.26Å; V184-F243 HydrophobicContact CB-CE1 4.18Å; V184-F243 HydrophobicContact CB-CZ 4.31Å; V184-F243 HydrophobicContact CG1-CD1 3.91Å; V184-F243 HydrophobicContact CG1-CE1 3.94Å; V184-F243 HydrophobicContact CG1-CG 4.29Å; V184-F243 HydrophobicContact CG1-CZ 4.33Å; I188-F243 HydrophobicContact CD1-CD1 4.18Å; V221-F243 HydrophobicContact CG1-CE1 4.05Å; Y230-F243 WeakPolarHBondContact OH-CZ 3.38Å; R239-F243 HydrophobicContact CG-CD2 3.94Å; R239-F243 HydrophobicContact CG-CE2 3.53Å; R239-F243 WeakPolarHBondContact O-CD2 3.41Å; R239-F243 PolarHBondContact O-N 3.47Å; R239-F243 VanDerWaalsContact O-N 3.1Å; S240-F243 PolarHBondContact O-N 3.08Å; L241-F243 PolarHBondContact O-N 3.35Å; F243-S245 VanDerWaalsContact C-N 3.33Å; F243-S245 PolarHBondContact O-N 2.85Å; F243-V246 PolarHBondContact O-N 3.32Å; F243-A247 WeakPolarHBondContact O-CB 3.29Å; F243-A247 PolarHBondContact O-N 2.89Å
244	C	96.2	Very high	94.9	Very high	53 Å²	53	57.4 Å²	57.4	36%	0.358	31%	0.306	S	S	.	.	H	α-helix	trans	-63.3	-39.2	176.5	-66.9	0	0	0	0	111.9	S240 L241 I242 A247 G248 L287	S240-C244 WeakPolarHBondContact O-CB 3.25Å; S240-C244 PolarHBondContact O-N 3.31Å; S240-C244 PolarHBondContact O-SG 2.86Å; L241-C244 PolarHBondContact O-N 3.38Å; I242-C244 PolarHBondContact O-N 2.91Å; C244-A247 PolarHBondContact O-N 3.41Å; C244-G248 WeakPolarHBondContact O-CA 3.45Å; C244-G248 PolarHBondContact O-N 2.89Å; C244-L287 VanDerWaalsContact SG-CD2 3.53Å
245	S	96.8	Very high	95.3	Very high	67 Å²	67	55.5 Å²	55.5	47%	0.469	30%	0.301	S	S	.	.	H	α-helix	trans	-66.4	-42.6	176.6	-63.4	0	0	0	0	111.9	L241 I242 F243 G248 Y249	L241-S245 WeakPolarHBondContact O-CB 3.2Å; L241-S245 PolarHBondContact O-N 3.29Å; L241-S245 PolarHBondContact O-OG 3.01Å; I242-S245 PolarHBondContact O-N 3.3Å; F243-S245 VanDerWaalsContact C-N 3.33Å; F243-S245 PolarHBondContact O-N 2.85Å; S245-G248 PolarHBondContact O-N 2.95Å; S245-Y249 PolarHBondContact O-N 2.86Å
246	V	97.2	Very high	95.5	Very high	9 Å²	9	53.9 Å²	53.9	6%	0.055	30%	0.295	C	S	.	.	H	α-helix	trans	-67.6	-38.9	177.4	-179.3	0	0	0	0	111.2	I188 Y192 M217 I218 V221 I242 F243	I188-V246 HydrophobicContact CG2-CG1 4.01Å; Y192-V246 WeakPolarHBondContact CE2-O 3.4Å; Y192-V246 PolarHBondContact OH-O 3.18Å; M217-V246 HydrophobicContact CB-CG1 4.47Å; M217-V246 HydrophobicContact CE-CB 4.3Å; M217-V246 HydrophobicContact CE-CG1 4.48Å; M217-V246 HydrophobicContact CE-CG2 4.02Å; I218-V246 HydrophobicContact CD1-CG1 3.93Å; V221-V246 HydrophobicContact CG2-CG2 3.77Å; I242-V246 VanDerWaalsContact O-CG2 3.29Å; I242-V246 WeakPolarHBondContact O-CG2 3.43Å; I242-V246 PolarHBondContact O-N 3.48Å; F243-V246 PolarHBondContact O-N 3.32Å
247	A	96.6	Very high	95.8	Very high	38 Å²	38	50.1 Å²	50.1	31%	0.314	28%	0.279	S	S	.	.	H	α-helix	trans	-68.9	-43.4	173.8	0	0	0	0	0	111.9	Y192 F243 C244 Y249 G250 Y280	Y192-A247 PolarHBondContact OH-O 2.87Å; F243-A247 WeakPolarHBondContact O-CB 3.29Å; F243-A247 PolarHBondContact O-N 2.89Å; C244-A247 PolarHBondContact O-N 3.41Å; A247-Y249 VanDerWaalsContact C-N 3.28Å; A247-Y249 PolarHBondContact O-N 3.14Å; A247-G250 PolarHBondContact O-N 3.28Å; A247-Y280 PolarHBondContact O-OH 3.33Å
248	G	96.6	Very high	96.1	Very high	29 Å²	29	42.8 Å²	42.8	30%	0.299	25%	0.245	S	C	.	.	H	α-helix	trans	-68.6	-22.7	-179.1	0	0	0	0	0	114.1	C244 S245 G250 L251	C244-G248 WeakPolarHBondContact O-CA 3.45Å; C244-G248 PolarHBondContact O-N 2.89Å; S245-G248 PolarHBondContact O-N 2.95Å; G248-G250 PolarHBondContact O-N 3.17Å; G248-L251 WeakPolarHBondContact O-CB 3.37Å; G248-L251 WeakPolarHBondContact O-CG 3.31Å; G248-L251 PolarHBondContact O-N 2.99Å
249	Y	97.6	Very high	96.2	Very high	35 Å²	35	48.6 Å²	48.6	14%	0.137	26%	0.262	C	S	.	.	T	Hydrogen-bonded Turn	trans	-51.4	-31.7	171.9	173.3	-100.9	0	0	0	112.3	Y192 Y210 T213 V214 M217 S245 A247 L251 I252 P253	Y192-Y249 HydrophobicContact CE1-CD1 4.11Å; Y210-Y249 HydrophobicContact CD1-CE1 4.35Å; Y210-Y249 VanDerWaalsContact CD1-OH 3.31Å; Y210-Y249 WeakPolarHBondContact CD1-OH 3.37Å; T213-Y249 WeakPolarHBondContact CB-OH 3.33Å; T213-Y249 HydrophobicContact CG2-CE1 4.27Å; T213-Y249 HydrophobicContact CG2-CE2 4.03Å; T213-Y249 VanDerWaalsContact CG2-OH 3.23Å; T213-Y249 WeakPolarHBondContact CG2-OH 3.38Å; V214-Y249 HydrophobicContact CG2-CD1 4.04Å; V214-Y249 HydrophobicContact CG2-CE1 3.83Å; M217-Y249 HydrophobicContact CE-CD2 4.44Å; M217-Y249 HydrophobicContact CE-CG 4.18Å; M217-Y249 HydrophobicContact SD-CD1 3.97Å; M217-Y249 HydrophobicContact SD-CD2 3.91Å; M217-Y249 HydrophobicContact SD-CE1 4.43Å; M217-Y249 HydrophobicContact SD-CE2 4.37Å; M217-Y249 HydrophobicContact SD-CG 3.69Å; S245-Y249 PolarHBondContact O-N 2.86Å; A247-Y249 VanDerWaalsContact C-N 3.28Å; A247-Y249 PolarHBondContact O-N 3.14Å; Y249-L251 PolarHBondContact O-N 3.31Å; Y249-I252 HydrophobicContact CD2-CD1 3.87Å; Y249-I252 HydrophobicContact CE2-CD1 4.03Å; Y249-I252 WeakPolarHBondContact O-CB 3.18Å; Y249-I252 PolarHBondContact O-N 3.46Å; Y249-P253 WeakPolarHBondContact O-CD 3.24Å
250	G	96.1	Very high	96.2	Very high	4 Å²	4	51.3 Å²	51.3	4%	0.041	28%	0.276	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63.7	-13.6	-179	0	0	0	0	0	114.4	Y192 A247 G248 I252 P253 T254 Y280	Y192-G250 WeakPolarHBondContact OH-CA 3.47Å; Y192-G250 PolarHBondContact OH-N 3.35Å; A247-G250 PolarHBondContact O-N 3.28Å; G248-G250 PolarHBondContact O-N 3.17Å; G250-I252 VanDerWaalsContact C-N 3.32Å; G250-P253 WeakPolarHBondContact O-CD 3.44Å; G250-P253 WeakPolarHBondContact O-CG 3.41Å; G250-T254 WeakPolarHBondContact O-CB 3.42Å; G250-T254 PolarHBondContact O-N 2.92Å; G250-T254 PolarHBondContact O-OG1 2.94Å; G250-Y280 VanDerWaalsContact C-OH 3.23Å; G250-Y280 VanDerWaalsContact CA-OH 3.32Å; G250-Y280 WeakPolarHBondContact CA-OH 3.48Å
251	L	96.9	Very high	96.2	Very high	89 Å²	89	51.7 Å²	51.7	47%	0.466	28%	0.278	S	S	.	.	H	α-helix	trans	-65.8	-35	168.9	-61.5	178.2	0	0	0	111.7	G248 Y249 T254 L255 Y280	G248-L251 WeakPolarHBondContact O-CB 3.37Å; G248-L251 WeakPolarHBondContact O-CG 3.31Å; G248-L251 PolarHBondContact O-N 2.99Å; Y249-L251 PolarHBondContact O-N 3.31Å; L251-T254 PolarHBondContact O-N 3.37Å; L251-L255 WeakPolarHBondContact O-CB 3.49Å; L251-L255 VanDerWaalsContact O-CG 3.27Å; L251-L255 WeakPolarHBondContact O-CG 3.32Å; L251-L255 PolarHBondContact O-N 3.34Å; L251-Y280 HydrophobicContact CD2-CD2 4.28Å; L251-Y280 HydrophobicContact CD2-CE1 4.35Å; L251-Y280 HydrophobicContact CD2-CE2 3.8Å; L251-Y280 PolarHBondContact N-OH 3.47Å
252	I	97.7	Very high	95.9	Very high	95 Å²	95	49 Å²	49	49%	0.487	28%	0.275	S	S	.	.	H	α-helix	trans	-62.8	-56.9	179.1	-60	176.9	0	0	0	112	Y210 Y249 G250 T254 L255 H256	Y210-I252 HydrophobicContact CE1-CG2 4.39Å; Y249-I252 HydrophobicContact CD2-CD1 3.87Å; Y249-I252 HydrophobicContact CE2-CD1 4.03Å; Y249-I252 WeakPolarHBondContact O-CB 3.18Å; Y249-I252 PolarHBondContact O-N 3.46Å; G250-I252 VanDerWaalsContact C-N 3.32Å; I252-T254 PolarHBondContact O-N 3.05Å; I252-L255 PolarHBondContact O-N 3.27Å; I252-H256 WeakPolarHBondContact O-CB 3.49Å; I252-H256 PolarHBondContact O-N 3.28Å
253	P	97.3	Very high	95.8	Very high	7 Å²	7	48 Å²	48	5%	0.045	28%	0.275	C	S	.	.	H	α-helix	trans	-62.4	-30.5	175.3	22.1	-29.4	0	0	0	112.2	F200 Y210 Y249 G250 W257	F200-P253 HydrophobicContact CE2-CB 3.91Å; F200-P253 HydrophobicContact CZ-CB 4.26Å; F200-P253 WeakPolarHBondContact CZ-O 3.49Å; Y210-P253 HydrophobicContact CD1-CB 3.75Å; Y210-P253 HydrophobicContact CD1-CG 4.21Å; Y210-P253 HydrophobicContact CD2-CB 3.91Å; Y210-P253 HydrophobicContact CE1-CB 3.74Å; Y210-P253 HydrophobicContact CE1-CG 4.35Å; Y210-P253 HydrophobicContact CE2-CB 3.9Å; Y210-P253 HydrophobicContact CG-CB 3.86Å; Y249-P253 WeakPolarHBondContact O-CD 3.24Å; G250-P253 WeakPolarHBondContact O-CD 3.44Å; G250-P253 WeakPolarHBondContact O-CG 3.41Å; P253-W257 WeakPolarHBondContact O-CB 3.32Å; P253-W257 PolarHBondContact O-N 2.8Å
254	T	96.9	Very high	95.7	Very high	25 Å²	25	53.1 Å²	53.1	15%	0.153	30%	0.297	C	S	.	.	H	α-helix	trans	-64.6	-50.7	175.6	-60	0	0	0	0	111.5	G250 L251 I252 H256 W257 I258 I276	G250-T254 WeakPolarHBondContact O-CB 3.42Å; G250-T254 PolarHBondContact O-N 2.92Å; G250-T254 PolarHBondContact O-OG1 2.94Å; L251-T254 PolarHBondContact O-N 3.37Å; I252-T254 PolarHBondContact O-N 3.05Å; T254-H256 VanDerWaalsContact C-N 3.33Å; T254-H256 PolarHBondContact O-N 3.34Å; T254-W257 PolarHBondContact O-N 3.24Å; T254-I258 HydrophobicContact CG2-CD1 4.03Å; T254-I258 VanDerWaalsContact O-CG1 3.27Å; T254-I258 WeakPolarHBondContact O-CG1 3.47Å; T254-I258 PolarHBondContact O-N 3.45Å; T254-I276 HydrophobicContact CG2-CD1 3.76Å; T254-I276 HydrophobicContact CG2-CG2 4.31Å
255	L	97.6	Very high	95.5	Very high	118 Å²	118	55.2 Å²	55.2	62%	0.618	31%	0.313	S	S	*	.	H	α-helix	trans	-61.9	-43	178.6	-71.2	171.4	0	0	0	111.4	L251 I252 I258 W259	L251-L255 WeakPolarHBondContact O-CB 3.49Å; L251-L255 VanDerWaalsContact O-CG 3.27Å; L251-L255 WeakPolarHBondContact O-CG 3.32Å; L251-L255 PolarHBondContact O-N 3.34Å; I252-L255 PolarHBondContact O-N 3.27Å; L255-I258 PolarHBondContact O-N 3.12Å; L255-W259 PolarHBondContact O-N 3.34Å; L255-W259 VanDerWaalsContact O-N 3.09Å
256	H	97.6	Very high	95.3	Very high	29 Å²	29	53.3 Å²	53.3	13%	0.134	30%	0.299	C	S	.	.	H	α-helix	trans	-64.1	-43.2	176.4	-179	-147.6	0	0	0	111.9	F200 W206 Y210 I252 T254 I258 W259 I260	F200-H256 AromaticContact CE1-ND1 3.87Å; W206-H256 AromaticContact CD1-CE1 3.67Å; W206-H256 AromaticContact CD2-CE1 3.36Å; W206-H256 AromaticContact CE2-CE1 3.4Å; W206-H256 VanDerWaalsContact CE2-CE1 3.4Å; W206-H256 AromaticContact CE3-CE1 3.79Å; W206-H256 AromaticContact CG-CE1 3.57Å; W206-H256 AromaticContact CZ2-CE1 3.9Å; W206-H256 AromaticContact NE1-CE1 3.61Å; Y210-H256 AromaticContact CE2-ND1 3.58Å; Y210-H256 AromaticContact CZ-ND1 3.62Å; Y210-H256 VanDerWaalsContact OH-CB 3.29Å; Y210-H256 WeakPolarHBondContact OH-CB 3.06Å; Y210-H256 PolarHBondContact OH-ND1 3.08Å; I252-H256 WeakPolarHBondContact O-CB 3.49Å; I252-H256 PolarHBondContact O-N 3.28Å; T254-H256 VanDerWaalsContact C-N 3.33Å; T254-H256 PolarHBondContact O-N 3.34Å; H256-I258 VanDerWaalsContact C-N 3.35Å; H256-I258 PolarHBondContact O-N 3Å; H256-W259 AromaticContact CD2-CE3 3.82Å; H256-W259 WeakPolarHBondContact O-CB 3.16Å; H256-W259 PolarHBondContact O-N 2.92Å; H256-I260 WeakPolarHBondContact NE2-CG2 3.18Å; H256-I260 PolarHBondContact O-N 3.18Å
257	W	96.8	Very high	95	Very high	1 Å²	1	60.6 Å²	60.6	0%	0.004	33%	0.333	C	S	.	.	H	α-helix	trans	-60.3	-42.9	176	175.4	70.1	0	0	0	112.3	T199 F200 P253 T254 W259 I260 T261 L268 V269 F272 V273	T199-W257 HydrophobicContact CG2-CD2 4.04Å; T199-W257 HydrophobicContact CG2-CG 4.24Å; T199-W257 HydrophobicContact CG2-CZ2 4.49Å; T199-W257 PolarHBondContact O-NE1 3.13Å; F200-W257 HydrophobicContact CE1-CB 4.32Å; F200-W257 HydrophobicContact CE2-CB 4.07Å; F200-W257 HydrophobicContact CZ-CB 3.72Å; P253-W257 WeakPolarHBondContact O-CB 3.32Å; P253-W257 PolarHBondContact O-N 2.8Å; T254-W257 PolarHBondContact O-N 3.24Å; W257-W259 VanDerWaalsContact C-N 3.3Å; W257-W259 PolarHBondContact O-N 2.88Å; W257-I260 WeakPolarHBondContact O-CG1 3.38Å; W257-I260 PolarHBondContact O-N 2.86Å; W257-T261 HydrophobicContact CZ2-CG2 4.37Å; W257-T261 PolarHBondContact NE1-OG1 3.45Å; W257-T261 VanDerWaalsContact O-CB 3.23Å; W257-T261 WeakPolarHBondContact O-CB 3.11Å; W257-T261 PolarHBondContact O-N 3.02Å; W257-T261 PolarHBondContact O-OG1 3.49Å; W257-L268 HydrophobicContact CH2-CG 4.05Å; W257-L268 HydrophobicContact CZ2-CD2 3.74Å; W257-L268 HydrophobicContact CZ2-CG 3.77Å; W257-V269 HydrophobicContact CH2-CG2 4.01Å; W257-V269 HydrophobicContact CZ3-CG2 4.06Å; W257-F272 HydrophobicContact CH2-CB 3.88Å; W257-F272 AromaticContact CH2-CD1 3.8Å; W257-F272 HydrophobicContact CH2-CD1 3.8Å; W257-F272 HydrophobicContact CH2-CG 4.29Å; W257-F272 HydrophobicContact CZ2-CD1 4.43Å; W257-F272 HydrophobicContact CZ3-CB 4.39Å; W257-F272 AromaticContact CZ3-CD1 3.94Å; W257-F272 HydrophobicContact CZ3-CD1 3.94Å; W257-V273 HydrophobicContact CZ3-CG2 4.19Å
258	I	96.6	Very high	94.8	Very high	14 Å²	14	59 Å²	59	7%	0.072	32%	0.319	C	S	.	.	H	α-helix	trans	-57.4	-46.7	174.8	-69.8	165.5	0	0	0	110	T254 L255 H256 T261 G263 F264 V269 V273	T254-I258 HydrophobicContact CG2-CD1 4.03Å; T254-I258 VanDerWaalsContact O-CG1 3.27Å; T254-I258 WeakPolarHBondContact O-CG1 3.47Å; T254-I258 PolarHBondContact O-N 3.45Å; L255-I258 PolarHBondContact O-N 3.12Å; H256-I258 VanDerWaalsContact C-N 3.35Å; H256-I258 PolarHBondContact O-N 3Å; I258-T261 PolarHBondContact O-N 3.47Å; I258-G263 WeakPolarHBondContact O-CA 3.21Å; I258-G263 PolarHBondContact O-N 3.36Å; I258-F264 HydrophobicContact CD1-CE1 4.26Å; I258-F264 HydrophobicContact CD1-CZ 4.03Å; I258-F264 HydrophobicContact CG2-CD2 4.24Å; I258-F264 HydrophobicContact CG2-CE2 4.06Å; I258-F264 HydrophobicContact CG2-CZ 4.23Å; I258-V269 HydrophobicContact CG1-CG1 4.03Å; I258-V269 HydrophobicContact CG2-CG1 4.19Å; I258-V273 HydrophobicContact CD1-CG2 3.8Å; I258-V273 HydrophobicContact CG1-CG2 3.97Å
259	W	95.4	Very high	94.7	Very high	201 Å²	201	57.6 Å²	57.6	76%	0.761	31%	0.305	S	S	*	.	H	α-helix	trans	-61.3	-50	-179	-180	69.5	0	0	0	112.6	L255 H256 W257 T261 G262	L255-W259 PolarHBondContact O-N 3.34Å; L255-W259 VanDerWaalsContact O-N 3.09Å; H256-W259 AromaticContact CD2-CE3 3.82Å; H256-W259 WeakPolarHBondContact O-CB 3.16Å; H256-W259 PolarHBondContact O-N 2.92Å; W257-W259 VanDerWaalsContact C-N 3.3Å; W257-W259 PolarHBondContact O-N 2.88Å; W259-T261 VanDerWaalsContact C-N 3.27Å; W259-T261 PolarHBondContact O-N 2.84Å; W259-G262 PolarHBondContact O-N 3.1Å
260	I	94	Very high	94.5	Very high	66 Å²	66	61.4 Å²	61.4	34%	0.338	32%	0.324	S	S	.	.	H	α-helix	trans	-72.5	-18.1	-178.4	65.6	175.6	0	0	0	113.9	F200 H256 W257 G262	F200-I260 HydrophobicContact CD1-CD1 3.82Å; F200-I260 HydrophobicContact CE1-CD1 3.61Å; H256-I260 WeakPolarHBondContact NE2-CG2 3.18Å; H256-I260 PolarHBondContact O-N 3.18Å; W257-I260 WeakPolarHBondContact O-CG1 3.38Å; W257-I260 PolarHBondContact O-N 2.86Å; I260-G262 VanDerWaalsContact C-N 3.29Å; I260-G262 PolarHBondContact O-N 3.1Å
261	T	91.5	Very high	94.4	Very high	34 Å²	34	63.1 Å²	63.1	21%	0.209	34%	0.338	C	S	.	.	T	Hydrogen-bonded Turn	trans	-91.3	12.2	-177.9	-51.2	0	0	0	0	112.2	W257 I258 W259 S266 L268 V269	W257-T261 HydrophobicContact CZ2-CG2 4.37Å; W257-T261 PolarHBondContact NE1-OG1 3.45Å; W257-T261 VanDerWaalsContact O-CB 3.23Å; W257-T261 WeakPolarHBondContact O-CB 3.11Å; W257-T261 PolarHBondContact O-N 3.02Å; W257-T261 PolarHBondContact O-OG1 3.49Å; I258-T261 PolarHBondContact O-N 3.47Å; W259-T261 VanDerWaalsContact C-N 3.27Å; W259-T261 PolarHBondContact O-N 2.84Å; T261-S266 WeakPolarHBondContact O-CB 3.4Å; T261-S266 PolarHBondContact O-OG 3.48Å; T261-L268 HydrophobicContact CG2-CD2 4.21Å; T261-V269 HydrophobicContact CG2-CG2 3.84Å
262	G	89.3	Confident	94.3	Very high	49 Å²	49	59 Å²	59	51%	0.505	32%	0.316	S	S	.	.	T	Hydrogen-bonded Turn	trans	88.7	17.4	-179.2	0	0	0	0	0	114.2	W259 I260 S265	W259-G262 PolarHBondContact O-N 3.1Å; I260-G262 VanDerWaalsContact C-N 3.29Å; I260-G262 PolarHBondContact O-N 3.1Å; G262-S265 PolarHBondContact O-OG 2.93Å
263	G	93.2	Very high	94.2	Very high	19 Å²	19	55.2 Å²	55.2	20%	0.196	30%	0.297	C	S	.	.	G	3₁₀ helix	trans	70.5	-163	177.8	0	0	0	0	0	114	I258 S265 S266	I258-G263 WeakPolarHBondContact O-CA 3.21Å; I258-G263 PolarHBondContact O-N 3.36Å; G263-S265 PolarHBondContact O-N 3.22Å; G263-S265 VanDerWaalsContact O-N 3.1Å; G263-S266 WeakPolarHBondContact O-CB 3.29Å; G263-S266 PolarHBondContact O-N 3.26Å
264	F	92.6	Very high	94.2	Very high	133 Å²	133	58.4 Å²	58.4	58%	0.583	32%	0.318	S	S	*	.	G	3₁₀ helix	trans	-67.9	-5.3	-179.5	-70.2	-77.2	0	0	0	114.6	I258 S266 V269 Q270 V273	I258-F264 HydrophobicContact CD1-CE1 4.26Å; I258-F264 HydrophobicContact CD1-CZ 4.03Å; I258-F264 HydrophobicContact CG2-CD2 4.24Å; I258-F264 HydrophobicContact CG2-CE2 4.06Å; I258-F264 HydrophobicContact CG2-CZ 4.23Å; F264-S266 VanDerWaalsContact C-N 3.3Å; F264-V269 HydrophobicContact CD1-CG1 4Å; F264-V269 HydrophobicContact CE1-CG1 4.44Å; F264-Q270 VanDerWaalsContact O-CG 3.28Å; F264-Q270 WeakPolarHBondContact O-CG 3.37Å; F264-Q270 PolarHBondContact O-NE2 3.33Å; F264-V273 HydrophobicContact CE1-CG1 4.42Å
265	S	91.4	Very high	94.3	Very high	97 Å²	97	60.6 Å²	60.6	68%	0.678	32%	0.323	S	S	*	.	G	3₁₀ helix	trans	-75.9	-21.2	173.2	72.6	0	0	0	0	112.7	G262 G263	G262-S265 PolarHBondContact O-OG 2.93Å; G263-S265 PolarHBondContact O-N 3.22Å; G263-S265 VanDerWaalsContact O-N 3.1Å
266	S	91.7	Very high	94.2	Very high	27 Å²	27	55.2 Å²	55.2	19%	0.189	30%	0.295	C	S	.	.	S	Bend	trans	-73.3	130.2	-178.6	177.6	0	0	0	0	112	T261 G263 F264 L268 V269 Q270	T261-S266 WeakPolarHBondContact O-CB 3.4Å; T261-S266 PolarHBondContact O-OG 3.48Å; G263-S266 WeakPolarHBondContact O-CB 3.29Å; G263-S266 PolarHBondContact O-N 3.26Å; F264-S266 VanDerWaalsContact C-N 3.3Å; S266-L268 PolarHBondContact O-N 3.33Å; S266-V269 WeakPolarHBondContact O-CB 3.4Å; S266-V269 PolarHBondContact O-N 3.03Å; S266-V269 VanDerWaalsContact O-N 3.08Å; S266-Q270 WeakPolarHBondContact O-CG 3.48Å; S266-Q270 PolarHBondContact O-N 3.16Å
267	Q	91.2	Very high	94.2	Very high	163 Å²	163	59 Å²	59	76%	0.762	32%	0.316	S	S	*	.	H	α-helix	trans	-57.9	-37.7	177.6	-66.3	-177.8	-1.3	0	0	112	Q270 A271	Q267-Q270 PolarHBondContact O-N 3.01Å; Q267-A271 WeakPolarHBondContact O-CB 3.48Å; Q267-A271 PolarHBondContact O-N 3.47Å
268	L	92.3	Very high	94.3	Very high	3 Å²	3	59.8 Å²	59.8	2%	0.016	32%	0.324	C	S	.	.	H	α-helix	trans	-63.3	-43	176.5	177.8	58.8	0	0	0	111.6	W257 T261 S266 A271 F272 Y334	W257-L268 HydrophobicContact CH2-CG 4.05Å; W257-L268 HydrophobicContact CZ2-CD2 3.74Å; W257-L268 HydrophobicContact CZ2-CG 3.77Å; T261-L268 HydrophobicContact CG2-CD2 4.21Å; S266-L268 PolarHBondContact O-N 3.33Å; L268-A271 PolarHBondContact O-N 3.06Å; L268-F272 WeakPolarHBondContact O-CB 3.34Å; L268-F272 PolarHBondContact O-N 3.18Å; L268-Y334 HydrophobicContact CB-CE1 4.2Å; L268-Y334 HydrophobicContact CB-CE2 4.29Å; L268-Y334 HydrophobicContact CD1-CD1 3.59Å; L268-Y334 HydrophobicContact CD1-CD2 3.94Å; L268-Y334 HydrophobicContact CD1-CE1 3.74Å; L268-Y334 HydrophobicContact CD1-CE2 4.03Å; L268-Y334 HydrophobicContact CD1-CG 3.72Å; L268-Y334 HydrophobicContact CD2-CD1 4.02Å; L268-Y334 HydrophobicContact CD2-CE1 3.59Å; L268-Y334 HydrophobicContact CG-CD1 4.34Å; L268-Y334 HydrophobicContact CG-CE1 4.03Å
269	V	94.6	Very high	94.3	Very high	0 Å²	0	60 Å²	60	0%	0	33%	0.325	C	S	.	.	H	α-helix	trans	-64.1	-47	178.2	172.2	0	0	0	0	110.1	W257 I258 T261 F264 S266 A271 F272 V273	W257-V269 HydrophobicContact CH2-CG2 4.01Å; W257-V269 HydrophobicContact CZ3-CG2 4.06Å; I258-V269 HydrophobicContact CG1-CG1 4.03Å; I258-V269 HydrophobicContact CG2-CG1 4.19Å; T261-V269 HydrophobicContact CG2-CG2 3.84Å; F264-V269 HydrophobicContact CD1-CG1 4Å; F264-V269 HydrophobicContact CE1-CG1 4.44Å; S266-V269 WeakPolarHBondContact O-CB 3.4Å; S266-V269 PolarHBondContact O-N 3.03Å; S266-V269 VanDerWaalsContact O-N 3.08Å; V269-A271 VanDerWaalsContact C-N 3.26Å; V269-A271 PolarHBondContact O-N 3.43Å; V269-F272 PolarHBondContact O-N 3.09Å; V269-V273 HydrophobicContact CG1-CG2 3.68Å; V269-V273 VanDerWaalsContact O-CB 3.31Å; V269-V273 WeakPolarHBondContact O-CB 3.39Å; V269-V273 VanDerWaalsContact O-CG2 3.28Å; V269-V273 WeakPolarHBondContact O-CG2 3.36Å; V269-V273 PolarHBondContact O-N 2.84Å
270	Q	94.3	Very high	94.4	Very high	116 Å²	116	53 Å²	53	54%	0.542	30%	0.299	S	S	.	.	H	α-helix	trans	-61.3	-34.1	178	-68	179.6	3.9	0	0	112.7	F264 S266 Q267 P274	F264-Q270 VanDerWaalsContact O-CG 3.28Å; F264-Q270 WeakPolarHBondContact O-CG 3.37Å; F264-Q270 PolarHBondContact O-NE2 3.33Å; S266-Q270 WeakPolarHBondContact O-CG 3.48Å; S266-Q270 PolarHBondContact O-N 3.16Å; Q267-Q270 PolarHBondContact O-N 3.01Å; Q270-P274 WeakPolarHBondContact O-CD 3.33Å; Q270-P274 VanDerWaalsContact O-CG 3.27Å; Q270-P274 WeakPolarHBondContact O-CG 3.29Å
271	A	93.6	Very high	94.6	Very high	40 Å²	40	56.5 Å²	56.5	33%	0.331	31%	0.312	S	S	.	.	H	α-helix	trans	-80.9	-33.6	179	0	0	0	0	0	113.8	Q267 L268 V269 F330	Q267-A271 WeakPolarHBondContact O-CB 3.48Å; Q267-A271 PolarHBondContact O-N 3.47Å; L268-A271 PolarHBondContact O-N 3.06Å; V269-A271 VanDerWaalsContact C-N 3.26Å; V269-A271 PolarHBondContact O-N 3.43Å; A271-F330 HydrophobicContact CB-CE1 3.95Å; A271-F330 HydrophobicContact CB-CZ 3.67Å
272	F	95.5	Very high	95	Very high	1 Å²	1	55.8 Å²	55.8	0%	0.004	31%	0.307	C	S	.	.	H	α-helix	trans	-95.7	-34.7	-173.1	-166.1	-119.4	0	0	0	114	T199 W257 L268 V269 R275 I276 W324 S327 F330 I331	T199-F272 HydrophobicContact CG2-CD1 4.1Å; T199-F272 HydrophobicContact CG2-CE1 3.53Å; T199-F272 HydrophobicContact CG2-CZ 4.45Å; W257-F272 HydrophobicContact CH2-CB 3.88Å; W257-F272 AromaticContact CH2-CD1 3.8Å; W257-F272 HydrophobicContact CH2-CD1 3.8Å; W257-F272 HydrophobicContact CH2-CG 4.29Å; W257-F272 HydrophobicContact CZ2-CD1 4.43Å; W257-F272 HydrophobicContact CZ3-CB 4.39Å; W257-F272 AromaticContact CZ3-CD1 3.94Å; W257-F272 HydrophobicContact CZ3-CD1 3.94Å; L268-F272 WeakPolarHBondContact O-CB 3.34Å; L268-F272 PolarHBondContact O-N 3.18Å; V269-F272 PolarHBondContact O-N 3.09Å; F272-R275 HydrophobicContact CD2-CB 4.47Å; F272-R275 WeakPolarHBondContact O-CA 3.37Å; F272-R275 VanDerWaalsContact O-CB 3.29Å; F272-R275 WeakPolarHBondContact O-CB 3.29Å; F272-R275 PolarHBondContact O-N 3.07Å; F272-I276 HydrophobicContact CD1-CD1 3.72Å; F272-I276 HydrophobicContact CD1-CG1 4.06Å; F272-I276 HydrophobicContact CE1-CD1 3.69Å; F272-I276 HydrophobicContact CE1-CG1 3.85Å; F272-I276 HydrophobicContact CZ-CG1 4.35Å; F272-I276 PolarHBondContact O-N 3.38Å; F272-I276 VanDerWaalsContact O-N 3.17Å; F272-W324 HydrophobicContact CZ-CH2 4.33Å; F272-S327 WeakPolarHBondContact CE2-O 3.25Å; F272-F330 HydrophobicContact CD2-CD1 4.09Å; F272-I331 HydrophobicContact CD1-CD1 3.9Å; F272-I331 HydrophobicContact CD2-CB 4.07Å; F272-I331 HydrophobicContact CD2-CD1 4.39Å; F272-I331 HydrophobicContact CE1-CD1 3.73Å; F272-I331 HydrophobicContact CE2-CB 3.81Å; F272-I331 HydrophobicContact CE2-CD1 4.25Å; F272-I331 HydrophobicContact CE2-CG2 3.95Å; F272-I331 HydrophobicContact CG-CD1 4.24Å; F272-I331 HydrophobicContact CZ-CB 4.19Å; F272-I331 HydrophobicContact CZ-CD1 3.92Å; F272-I331 HydrophobicContact CZ-CG2 4.06Å
273	V	96.1	Very high	95.4	Very high	17 Å²	17	55 Å²	55	10%	0.103	30%	0.295	C	S	.	.	H	α-helix	trans	-57.4	-43.6	179.5	169.8	0	0	0	0	112.9	W257 I258 F264 V269 R275 I276 L277	W257-V273 HydrophobicContact CZ3-CG2 4.19Å; I258-V273 HydrophobicContact CD1-CG2 3.8Å; I258-V273 HydrophobicContact CG1-CG2 3.97Å; F264-V273 HydrophobicContact CE1-CG1 4.42Å; V269-V273 HydrophobicContact CG1-CG2 3.68Å; V269-V273 VanDerWaalsContact O-CB 3.31Å; V269-V273 WeakPolarHBondContact O-CB 3.39Å; V269-V273 VanDerWaalsContact O-CG2 3.28Å; V269-V273 WeakPolarHBondContact O-CG2 3.36Å; V269-V273 PolarHBondContact O-N 2.84Å; V273-R275 PolarHBondContact O-N 3.27Å; V273-R275 VanDerWaalsContact O-N 3.17Å; V273-I276 WeakPolarHBondContact O-CB 3.37Å; V273-I276 PolarHBondContact O-N 3.46Å; V273-I276 VanDerWaalsContact O-N 3.07Å; V273-L277 HydrophobicContact CG1-CD1 4.02Å; V273-L277 HydrophobicContact CG1-CG 4.13Å; V273-L277 WeakPolarHBondContact O-CG 3.43Å; V273-L277 PolarHBondContact O-N 2.83Å
274	P	96.9	Very high	95.6	Very high	73 Å²	73	56.4 Å²	56.4	47%	0.474	31%	0.305	S	S	.	.	H	α-helix	trans	-57.9	-31	175.5	-26.5	36.2	0	0	0	113.4	Q270 L277 G278	Q270-P274 WeakPolarHBondContact O-CD 3.33Å; Q270-P274 VanDerWaalsContact O-CG 3.27Å; Q270-P274 WeakPolarHBondContact O-CG 3.29Å; P274-L277 PolarHBondContact O-N 3.39Å; P274-G278 PolarHBondContact O-N 2.94Å
275	R	97.5	Very high	95.8	Very high	71 Å²	71	52.8 Å²	52.8	27%	0.268	29%	0.292	S	S	.	.	H	α-helix	trans	-71.3	-40.4	176.4	-60.6	177.1	179	-85.1	1.4	111.8	F272 V273 G278 M279 W323 S327	F272-R275 HydrophobicContact CD2-CB 4.47Å; F272-R275 WeakPolarHBondContact O-CA 3.37Å; F272-R275 VanDerWaalsContact O-CB 3.29Å; F272-R275 WeakPolarHBondContact O-CB 3.29Å; F272-R275 PolarHBondContact O-N 3.07Å; V273-R275 PolarHBondContact O-N 3.27Å; V273-R275 VanDerWaalsContact O-N 3.17Å; R275-G278 PolarHBondContact O-N 3.46Å; R275-M279 PolarHBondContact O-N 3.32Å; R275-M279 VanDerWaalsContact O-N 3.09Å; R275-W323 PolarHBondContact O-NE1 2.93Å; R275-S327 WeakPolarHBondContact CB-OG 3.23Å
276	I	96.9	Very high	96.1	Very high	6 Å²	6	48.2 Å²	48.2	3%	0.031	26%	0.26	C	S	.	.	H	α-helix	trans	-61.2	-48.3	172	-59.4	174.4	0	0	0	110.2	T254 F272 V273 G278 M279 Y280 W324	T254-I276 HydrophobicContact CG2-CD1 3.76Å; T254-I276 HydrophobicContact CG2-CG2 4.31Å; F272-I276 HydrophobicContact CD1-CD1 3.72Å; F272-I276 HydrophobicContact CD1-CG1 4.06Å; F272-I276 HydrophobicContact CE1-CD1 3.69Å; F272-I276 HydrophobicContact CE1-CG1 3.85Å; F272-I276 HydrophobicContact CZ-CG1 4.35Å; F272-I276 PolarHBondContact O-N 3.38Å; F272-I276 VanDerWaalsContact O-N 3.17Å; V273-I276 WeakPolarHBondContact O-CB 3.37Å; V273-I276 PolarHBondContact O-N 3.46Å; V273-I276 VanDerWaalsContact O-N 3.07Å; I276-G278 VanDerWaalsContact C-N 3.31Å; I276-G278 PolarHBondContact O-N 2.99Å; I276-M279 WeakPolarHBondContact O-CB 3.42Å; I276-M279 PolarHBondContact O-N 3.2Å; I276-M279 VanDerWaalsContact O-N 3.16Å; I276-Y280 HydrophobicContact CG2-CD2 3.74Å; I276-Y280 HydrophobicContact CG2-CE2 3.57Å; I276-Y280 VanDerWaalsContact O-CD2 3.31Å; I276-Y280 WeakPolarHBondContact O-CD2 3.31Å; I276-Y280 PolarHBondContact O-N 3.49Å; I276-Y280 VanDerWaalsContact O-N 3.09Å; I276-W324 HydrophobicContact CB-CZ3 4.47Å; I276-W324 HydrophobicContact CG1-CH2 4.07Å; I276-W324 HydrophobicContact CG1-CZ3 4Å
277	L	97.6	Very high	96.3	Very high	107 Å²	107	49.4 Å²	49.4	56%	0.56	26%	0.264	S	S	*	.	H	α-helix	trans	-60.8	-40.4	177.5	-66.1	178.4	0	0	0	111.9	V273 P274 M279 Y280 F281	V273-L277 HydrophobicContact CG1-CD1 4.02Å; V273-L277 HydrophobicContact CG1-CG 4.13Å; V273-L277 WeakPolarHBondContact O-CG 3.43Å; V273-L277 PolarHBondContact O-N 2.83Å; P274-L277 PolarHBondContact O-N 3.39Å; L277-M279 VanDerWaalsContact C-N 3.33Å; L277-M279 PolarHBondContact O-N 2.97Å; L277-Y280 PolarHBondContact O-N 2.92Å; L277-F281 VanDerWaalsContact O-CB 3.31Å; L277-F281 WeakPolarHBondContact O-CB 3.47Å; L277-F281 PolarHBondContact O-N 3.25Å
278	G	97.9	Very high	96.6	Very high	18 Å²	18	46.6 Å²	46.6	19%	0.186	25%	0.253	C	S	.	.	H	α-helix	trans	-58.2	-43.1	174.1	0	0	0	0	0	112.7	P274 R275 I276 F281 I282	P274-G278 PolarHBondContact O-N 2.94Å; R275-G278 PolarHBondContact O-N 3.46Å; I276-G278 VanDerWaalsContact C-N 3.31Å; I276-G278 PolarHBondContact O-N 2.99Å; G278-F281 PolarHBondContact O-N 2.91Å; G278-I282 WeakPolarHBondContact O-CD1 3.33Å; G278-I282 VanDerWaalsContact O-CG1 3.27Å; G278-I282 WeakPolarHBondContact O-CG1 3.37Å; G278-I282 PolarHBondContact O-N 2.89Å
279	M	97.4	Very high	96.8	Very high	18 Å²	18	49 Å²	49	9%	0.089	26%	0.263	C	S	.	.	H	α-helix	trans	-61.2	-50.5	175	-177.1	-167.5	66.3	0	0	111.5	R275 I276 L277 F281 I282 A283 M320 W324	R275-M279 PolarHBondContact O-N 3.32Å; R275-M279 VanDerWaalsContact O-N 3.09Å; I276-M279 WeakPolarHBondContact O-CB 3.42Å; I276-M279 PolarHBondContact O-N 3.2Å; I276-M279 VanDerWaalsContact O-N 3.16Å; L277-M279 VanDerWaalsContact C-N 3.33Å; L277-M279 PolarHBondContact O-N 2.97Å; M279-F281 VanDerWaalsContact C-N 3.29Å; M279-F281 PolarHBondContact O-N 2.97Å; M279-I282 PolarHBondContact O-N 3.24Å; M279-A283 WeakPolarHBondContact O-CB 3.33Å; M279-A283 PolarHBondContact O-N 3.1Å; M279-M320 HydrophobicContact CG-CG 3.76Å; M279-M320 HydrophobicContact CG-SD 4.36Å; M279-W324 HydrophobicContact CB-CE3 3.92Å; M279-W324 HydrophobicContact CB-CZ3 4.35Å; M279-W324 HydrophobicContact CE-CD2 4.47Å; M279-W324 HydrophobicContact CE-CE3 4.16Å; M279-W324 HydrophobicContact CE-CH2 4.27Å; M279-W324 HydrophobicContact CE-CZ3 4.07Å; M279-W324 HydrophobicContact CG-CB 4.47Å; M279-W324 HydrophobicContact CG-CD2 4.43Å; M279-W324 HydrophobicContact CG-CE3 4.05Å; M279-W324 HydrophobicContact SD-CB 4.11Å; M279-W324 HydrophobicContact SD-CD2 3.32Å; M279-W324 HydrophobicContact SD-CE3 3.29Å; M279-W324 HydrophobicContact SD-CG 3.72Å; M279-W324 HydrophobicContact SD-CH2 4.3Å; M279-W324 HydrophobicContact SD-CZ2 4.34Å; M279-W324 HydrophobicContact SD-CZ3 3.82Å
280	Y	97.7	Very high	96.8	Very high	54 Å²	54	50.1 Å²	50.1	21%	0.212	27%	0.268	C	S	.	.	H	α-helix	trans	-64.4	-34.2	179.5	-79.3	-72.3	0	0	0	112.7	A247 G250 L251 I276 L277 A283 A284	A247-Y280 PolarHBondContact O-OH 3.33Å; G250-Y280 VanDerWaalsContact C-OH 3.23Å; G250-Y280 VanDerWaalsContact CA-OH 3.32Å; G250-Y280 WeakPolarHBondContact CA-OH 3.48Å; L251-Y280 HydrophobicContact CD2-CD2 4.28Å; L251-Y280 HydrophobicContact CD2-CE1 4.35Å; L251-Y280 HydrophobicContact CD2-CE2 3.8Å; L251-Y280 PolarHBondContact N-OH 3.47Å; I276-Y280 HydrophobicContact CG2-CD2 3.74Å; I276-Y280 HydrophobicContact CG2-CE2 3.57Å; I276-Y280 VanDerWaalsContact O-CD2 3.31Å; I276-Y280 WeakPolarHBondContact O-CD2 3.31Å; I276-Y280 PolarHBondContact O-N 3.49Å; I276-Y280 VanDerWaalsContact O-N 3.09Å; L277-Y280 PolarHBondContact O-N 2.92Å; Y280-A283 PolarHBondContact O-N 3.32Å; Y280-A284 VanDerWaalsContact O-CB 3.26Å; Y280-A284 WeakPolarHBondContact O-CB 3.47Å; Y280-A284 PolarHBondContact O-N 2.85Å
281	F	98.3	Very high	96.8	Very high	141 Å²	141	49 Å²	49	62%	0.618	27%	0.269	S	S	*	.	H	α-helix	trans	-63	-49.2	174.7	175.4	-101.6	0	0	0	111.4	L277 G278 M279 A283 A284 L285	L277-F281 VanDerWaalsContact O-CB 3.31Å; L277-F281 WeakPolarHBondContact O-CB 3.47Å; L277-F281 PolarHBondContact O-N 3.25Å; G278-F281 PolarHBondContact O-N 2.91Å; M279-F281 VanDerWaalsContact C-N 3.29Å; M279-F281 PolarHBondContact O-N 2.97Å; F281-A283 VanDerWaalsContact C-N 3.32Å; F281-A283 PolarHBondContact O-N 3.26Å; F281-A284 PolarHBondContact O-N 3.46Å; F281-L285 WeakPolarHBondContact O-CB 3.36Å; F281-L285 PolarHBondContact O-N 3.44Å
282	I	98.5	Very high	96.9	Very high	18 Å²	18	48.7 Å²	48.7	9%	0.092	26%	0.264	C	S	.	.	H	α-helix	trans	-61.7	-42.9	177.1	-61.4	161.5	0	0	0	110.3	G278 M279 L285 A286 L316 L319 M320 W323	G278-I282 WeakPolarHBondContact O-CD1 3.33Å; G278-I282 VanDerWaalsContact O-CG1 3.27Å; G278-I282 WeakPolarHBondContact O-CG1 3.37Å; G278-I282 PolarHBondContact O-N 2.89Å; M279-I282 PolarHBondContact O-N 3.24Å; I282-L285 PolarHBondContact O-N 3.29Å; I282-A286 WeakPolarHBondContact O-CB 3.48Å; I282-A286 PolarHBondContact O-N 3.22Å; I282-L316 HydrophobicContact CG2-CB 4.23Å; I282-L316 HydrophobicContact CG2-CD2 4.27Å; I282-L316 WeakPolarHBondContact CG2-O 3.45Å; I282-L319 HydrophobicContact CD1-CD2 4.45Å; I282-L319 HydrophobicContact CD1-CG 4.29Å; I282-L319 HydrophobicContact CG2-CD2 4.5Å; I282-M320 HydrophobicContact CB-CB 4.34Å; I282-M320 HydrophobicContact CG2-CB 3.78Å; I282-M320 HydrophobicContact CG2-CG 4.47Å; I282-W323 HydrophobicContact CD1-CB 4.15Å; I282-W323 HydrophobicContact CD1-CG 4.13Å
283	A	97.5	Very high	97	Very high	32 Å²	32	50 Å²	50	26%	0.264	27%	0.269	S	S	.	.	H	α-helix	trans	-61.7	-45.3	177.7	0	0	0	0	0	112.5	M279 Y280 F281 A286 L287 M320	M279-A283 WeakPolarHBondContact O-CB 3.33Å; M279-A283 PolarHBondContact O-N 3.1Å; Y280-A283 PolarHBondContact O-N 3.32Å; F281-A283 VanDerWaalsContact C-N 3.32Å; F281-A283 PolarHBondContact O-N 3.26Å; A283-A286 PolarHBondContact O-N 3.43Å; A283-L287 WeakPolarHBondContact O-CB 3.44Å; A283-L287 PolarHBondContact O-N 3.42Å; A283-M320 HydrophobicContact CB-SD 3.68Å
284	A	97.6	Very high	97	Very high	49 Å²	49	51 Å²	51	41%	0.405	28%	0.276	S	S	.	.	H	α-helix	trans	-64.7	-43.4	177.6	0	0	0	0	0	111.3	Y280 F281 A286 L287 I288	Y280-A284 VanDerWaalsContact O-CB 3.26Å; Y280-A284 WeakPolarHBondContact O-CB 3.47Å; Y280-A284 PolarHBondContact O-N 2.85Å; F281-A284 PolarHBondContact O-N 3.46Å; A284-A286 VanDerWaalsContact C-N 3.34Å; A284-A286 PolarHBondContact O-N 3.36Å; A284-L287 PolarHBondContact O-N 3.48Å; A284-I288 VanDerWaalsContact O-CG1 3.28Å; A284-I288 WeakPolarHBondContact O-CG1 3.48Å; A284-I288 PolarHBondContact O-N 2.96Å
285	L	98.2	Very high	97	Very high	57 Å²	57	49.4 Å²	49.4	30%	0.298	27%	0.265	S	S	.	.	H	α-helix	trans	-59.4	-46.2	175.5	-177	61.7	0	0	0	111.2	F281 I282 L287 I288 F289 L316	F281-L285 WeakPolarHBondContact O-CB 3.36Å; F281-L285 PolarHBondContact O-N 3.44Å; I282-L285 PolarHBondContact O-N 3.29Å; L285-L287 VanDerWaalsContact C-N 3.33Å; L285-L287 PolarHBondContact O-N 2.85Å; L285-I288 WeakPolarHBondContact O-CB 3.46Å; L285-I288 PolarHBondContact O-N 2.89Å; L285-F289 HydrophobicContact CD1-CD2 4.13Å; L285-F289 HydrophobicContact CD1-CE2 3.64Å; L285-F289 HydrophobicContact CD2-CE2 4.5Å; L285-F289 HydrophobicContact CG-CD2 4.13Å; L285-F289 HydrophobicContact CG-CE2 3.86Å; L285-F289 VanDerWaalsContact O-CD2 3.24Å; L285-F289 WeakPolarHBondContact O-CD2 3.33Å; L285-F289 PolarHBondContact O-N 3.45Å; L285-F289 VanDerWaalsContact O-N 3.15Å; L285-L316 HydrophobicContact CB-CD1 4.47Å; L285-L316 HydrophobicContact CD2-CD1 4.23Å; L285-L316 HydrophobicContact CD2-CD2 4.32Å; L285-L316 HydrophobicContact CG-CD1 3.97Å
286	A	97.4	Very high	97	Very high	1 Å²	1	46 Å²	46	1%	0.008	25%	0.253	C	S	.	.	H	α-helix	trans	-56.4	-50.3	175.1	0	0	0	0	0	110.4	I282 A283 A284 I288 F289 Y290 W313 L316	I282-A286 WeakPolarHBondContact O-CB 3.48Å; I282-A286 PolarHBondContact O-N 3.22Å; A283-A286 PolarHBondContact O-N 3.43Å; A284-A286 VanDerWaalsContact C-N 3.34Å; A284-A286 PolarHBondContact O-N 3.36Å; A286-I288 VanDerWaalsContact C-N 3.28Å; A286-I288 PolarHBondContact O-N 2.9Å; A286-F289 PolarHBondContact O-N 3.46Å; A286-F289 VanDerWaalsContact O-N 3.13Å; A286-Y290 PolarHBondContact O-N 2.77Å; A286-W313 HydrophobicContact CB-CD2 4.39Å; A286-W313 HydrophobicContact CB-CE3 3.47Å; A286-W313 VanDerWaalsContact CB-CE3 3.47Å; A286-W313 HydrophobicContact CB-CZ3 3.72Å; A286-W313 VanDerWaalsContact O-CE3 3.27Å; A286-L316 HydrophobicContact CB-CB 3.72Å; A286-L316 HydrophobicContact CB-CD1 3.97Å
287	L	95.9	Very high	97.1	Very high	52 Å²	52	51.9 Å²	51.9	27%	0.272	27%	0.274	S	S	.	.	H	α-helix	trans	-60.2	-38.9	-178.4	-175.8	65.5	0	0	0	112	C244 A283 A284 L285 Y290 V291 W313	C244-L287 VanDerWaalsContact SG-CD2 3.53Å; A283-L287 WeakPolarHBondContact O-CB 3.44Å; A283-L287 PolarHBondContact O-N 3.42Å; A284-L287 PolarHBondContact O-N 3.48Å; L285-L287 VanDerWaalsContact C-N 3.33Å; L285-L287 PolarHBondContact O-N 2.85Å; L287-Y290 HydrophobicContact CD1-CD1 4.46Å; L287-Y290 PolarHBondContact O-N 2.99Å; L287-V291 HydrophobicContact CD1-CG2 3.96Å; L287-V291 HydrophobicContact CG-CG2 4.27Å; L287-V291 WeakPolarHBondContact O-CB 2.94Å; L287-V291 WeakPolarHBondContact O-CG2 3.43Å; L287-V291 PolarHBondContact O-N 3.46Å; L287-W313 HydrophobicContact CB-CZ3 4.17Å; L287-W313 HydrophobicContact CD1-CZ3 4.39Å
288	I	96.8	Very high	97	Very high	105 Å²	105	54.3 Å²	54.3	54%	0.538	28%	0.277	S	S	.	.	H	α-helix	trans	-59.1	-48.7	175.4	-71.5	163.7	0	0	0	110.5	A284 L285 A286 S292	A284-I288 VanDerWaalsContact O-CG1 3.28Å; A284-I288 WeakPolarHBondContact O-CG1 3.48Å; A284-I288 PolarHBondContact O-N 2.96Å; L285-I288 WeakPolarHBondContact O-CB 3.46Å; L285-I288 PolarHBondContact O-N 2.89Å; A286-I288 VanDerWaalsContact C-N 3.28Å; A286-I288 PolarHBondContact O-N 2.9Å; I288-S292 WeakPolarHBondContact O-CB 3.36Å; I288-S292 PolarHBondContact O-N 3.11Å; I288-S292 PolarHBondContact O-OG 2.99Å
289	F	97.2	Very high	97	Very high	54 Å²	54	58.2 Å²	58.2	24%	0.237	29%	0.289	C	S	.	.	H	α-helix	trans	-60.5	-47.7	175	-78.7	-71.9	0	0	0	111.6	L285 A286 V291 K293 V294 S309 V312 L316	L285-F289 HydrophobicContact CD1-CD2 4.13Å; L285-F289 HydrophobicContact CD1-CE2 3.64Å; L285-F289 HydrophobicContact CD2-CE2 4.5Å; L285-F289 HydrophobicContact CG-CD2 4.13Å; L285-F289 HydrophobicContact CG-CE2 3.86Å; L285-F289 VanDerWaalsContact O-CD2 3.24Å; L285-F289 WeakPolarHBondContact O-CD2 3.33Å; L285-F289 PolarHBondContact O-N 3.45Å; L285-F289 VanDerWaalsContact O-N 3.15Å; A286-F289 PolarHBondContact O-N 3.46Å; A286-F289 VanDerWaalsContact O-N 3.13Å; F289-V291 VanDerWaalsContact C-N 3.35Å; F289-V291 PolarHBondContact O-N 3.39Å; F289-K293 PolarHBondContact O-N 3.33Å; F289-K293 VanDerWaalsContact O-N 3.15Å; F289-V294 VanDerWaalsContact CD1-O 3.3Å; F289-V294 WeakPolarHBondContact CD1-O 3.31Å; F289-S309 WeakPolarHBondContact O-CB 3.39Å; F289-S309 PolarHBondContact O-OG 2.96Å; F289-V312 HydrophobicContact CB-CG1 4.36Å; F289-V312 HydrophobicContact CD1-CB 4.49Å; F289-V312 HydrophobicContact CD1-CG1 4.13Å; F289-V312 HydrophobicContact CD2-CG1 3.66Å; F289-V312 HydrophobicContact CE1-CG1 4.37Å; F289-V312 HydrophobicContact CE2-CG1 3.91Å; F289-V312 HydrophobicContact CG-CB 4.35Å; F289-V312 HydrophobicContact CG-CG1 3.8Å; F289-V312 HydrophobicContact CZ-CG1 4.27Å; F289-L316 HydrophobicContact CD2-CD1 3.86Å; F289-L316 HydrophobicContact CE2-CD1 4.27Å
290	Y	94.8	Very high	96.9	Very high	23 Å²	23	60.8 Å²	60.8	9%	0.09	31%	0.307	C	S	.	.	H	α-helix	trans	-59	-42.6	-178.8	175.7	-97.7	0	0	0	113.1	A286 L287 K293 H310 W313	A286-Y290 PolarHBondContact O-N 2.77Å; L287-Y290 HydrophobicContact CD1-CD1 4.46Å; L287-Y290 PolarHBondContact O-N 2.99Å; Y290-K293 WeakPolarHBondContact O-CD 3.23Å; Y290-K293 WeakPolarHBondContact O-CE 3.49Å; Y290-K293 PolarHBondContact O-NZ 3.13Å; Y290-H310 AromaticContact CD2-ND1 3.84Å; Y290-H310 AromaticContact CE2-ND1 3.8Å; Y290-W313 HydrophobicContact CD2-CD2 4.28Å; Y290-W313 HydrophobicContact CD2-CG 4.29Å; Y290-W313 HydrophobicContact CG-CD2 4.31Å; Y290-W313 HydrophobicContact CG-CE3 4.26Å
291	V	94.4	Very high	96.8	Very high	93 Å²	93	59.4 Å²	59.4	56%	0.564	31%	0.309	S	S	*	.	H	α-helix	trans	-80.1	-44.8	-178	174.8	0	0	0	0	111.8	L287 F289 K293	L287-V291 HydrophobicContact CD1-CG2 3.96Å; L287-V291 HydrophobicContact CG-CG2 4.27Å; L287-V291 WeakPolarHBondContact O-CB 2.94Å; L287-V291 WeakPolarHBondContact O-CG2 3.43Å; L287-V291 PolarHBondContact O-N 3.46Å; F289-V291 VanDerWaalsContact C-N 3.35Å; F289-V291 PolarHBondContact O-N 3.39Å; V291-K293 VanDerWaalsContact C-N 3.34Å; V291-K293 PolarHBondContact O-N 3.42Å
292	S	95.5	Very high	96.7	Very high	33 Å²	33	59.8 Å²	59.8	23%	0.231	31%	0.313	C	S	.	.	H	α-helix	trans	-72.4	-24.6	-173.1	66.1	0	0	0	0	114.1	I288 V294	I288-S292 WeakPolarHBondContact O-CB 3.36Å; I288-S292 PolarHBondContact O-N 3.11Å; I288-S292 PolarHBondContact O-OG 2.99Å; S292-V294 PolarHBondContact O-N 3.03Å; S292-V294 PolarHBondContact OG-N 3.11Å
293	K	96.4	Very high	96.6	Very high	27 Å²	27	60.6 Å²	60.6	12%	0.117	32%	0.317	C	S	.	.			trans	59.2	27.8	-173	-54.1	-53	-172.9	-168.7	0	113.4	Y81 F289 Y290 V291 E296 R297 S309	Y81-K293 HydrophobicContact CD2-CB 4.07Å; Y81-K293 HydrophobicContact CE2-CB 4.11Å; F289-K293 PolarHBondContact O-N 3.33Å; F289-K293 VanDerWaalsContact O-N 3.15Å; Y290-K293 WeakPolarHBondContact O-CD 3.23Å; Y290-K293 WeakPolarHBondContact O-CE 3.49Å; Y290-K293 PolarHBondContact O-NZ 3.13Å; V291-K293 VanDerWaalsContact C-N 3.34Å; V291-K293 PolarHBondContact O-N 3.42Å; K293-E296 WeakPolarHBondContact O-CG 3.26Å; K293-E296 PolarHBondContact O-N 3.01Å; K293-R297 HydrophobicContact CB-CB 4.5Å; K293-R297 WeakPolarHBondContact O-CB 3.39Å; K293-R297 PolarHBondContact O-N 3.31Å; K293-S309 WeakPolarHBondContact CA-OG 3.06Å
294	V	96.8	Very high	96.5	Very high	40 Å²	40	59.6 Å²	59.6	24%	0.242	31%	0.307	C	S	.	.	T	Hydrogen-bonded Turn	trans	-87.2	136.6	172.6	175.1	0	0	0	0	108	F289 S292 Y298 S309	F289-V294 VanDerWaalsContact CD1-O 3.3Å; F289-V294 WeakPolarHBondContact CD1-O 3.31Å; S292-V294 PolarHBondContact O-N 3.03Å; S292-V294 PolarHBondContact OG-N 3.11Å; V294-Y298 HydrophobicContact CB-CE2 4.41Å; V294-Y298 HydrophobicContact CG1-CD2 4.07Å; V294-Y298 HydrophobicContact CG1-CE2 4.01Å; V294-Y298 HydrophobicContact CG2-CD2 4.07Å; V294-Y298 HydrophobicContact CG2-CE2 3.54Å; V294-S309 WeakPolarHBondContact O-CB 3.4Å
295	P	97.4	Very high	96.5	Very high	38 Å²	38	60.8 Å²	60.8	25%	0.247	30%	0.302	C	S	.	.	T	Hydrogen-bonded Turn	cis	-93.3	-10.2	11.7	16.4	0.1	0	0	0	115.5	R297 Y298 F299 L303 G307	P295-R297 PolarHBondContact O-N 2.97Å; P295-R297 VanDerWaalsContact O-N 3.09Å; P295-Y298 PolarHBondContact O-N 3.38Å; P295-F299 HydrophobicContact CB-CD2 4.24Å; P295-F299 WeakPolarHBondContact O-CD2 3.09Å; P295-F299 PolarHBondContact O-N 3.44Å; P295-L303 HydrophobicContact CB-CD1 3.66Å; P295-L303 HydrophobicContact CG-CD1 3.6Å; P295-G307 VanDerWaalsContact CD-O 3.24Å; P295-G307 WeakPolarHBondContact CD-O 3.1Å; P295-G307 WeakPolarHBondContact CG-O 3.32Å
296	E	97.8	Very high	96.4	Very high	1 Å²	1	64 Å²	64	1%	0.005	32%	0.319	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60.6	-27.4	-173.6	69	-86.5	-156.2	0	0	113.3	N79 Y81 I82 K293 Y298 F299 P300 L303 S309	N79-E296 PolarHBondContact ND2-OE1 2.87Å; Y81-E296 WeakPolarHBondContact CB-O 3.5Å; Y81-E296 HydrophobicContact CD2-CG 4.34Å; Y81-E296 HydrophobicContact CG-CG 4.49Å; I82-E296 HydrophobicContact CD1-CB 4.05Å; I82-E296 HydrophobicContact CD1-CG 4.15Å; K293-E296 WeakPolarHBondContact O-CG 3.26Å; K293-E296 PolarHBondContact O-N 3.01Å; E296-Y298 VanDerWaalsContact C-N 3.25Å; E296-Y298 PolarHBondContact O-N 3.07Å; E296-F299 CarbonylContact O-C 3.57Å; E296-F299 PolarHBondContact O-N 3.06Å; E296-P300 WeakPolarHBondContact O-CA 3.49Å; E296-P300 VanDerWaalsContact O-N 3.14Å; E296-L303 HydrophobicContact CB-CB 4.18Å; E296-L303 HydrophobicContact CB-CD1 4.35Å; E296-S309 WeakPolarHBondContact OE1-CB 3.49Å; E296-S309 PolarHBondContact OE1-N 3.46Å; E296-S309 PolarHBondContact OE1-OG 3.35Å; E296-S309 VanDerWaalsContact OE2-CB 3.31Å; E296-S309 WeakPolarHBondContact OE2-CB 3.43Å; E296-S309 PolarHBondContact OE2-N 2.94Å
297	R	97.3	Very high	96.3	Very high	128 Å²	128	65.3 Å²	65.3	48%	0.483	33%	0.332	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.2	-35.3	172.1	177.9	169.6	-171.5	-179.2	-1	113.8	Y81 K293 P295	Y81-R297 HydrophobicContact CD2-CB 3.96Å; Y81-R297 HydrophobicContact CD2-CG 4.49Å; Y81-R297 HydrophobicContact CE1-CB 4.43Å; Y81-R297 HydrophobicContact CE1-CG 4.12Å; Y81-R297 HydrophobicContact CE2-CB 3.76Å; Y81-R297 HydrophobicContact CE2-CG 3.86Å; Y81-R297 HydrophobicContact CG-CB 4.4Å; K293-R297 HydrophobicContact CB-CB 4.5Å; K293-R297 WeakPolarHBondContact O-CB 3.39Å; K293-R297 PolarHBondContact O-N 3.31Å; P295-R297 PolarHBondContact O-N 2.97Å; P295-R297 VanDerWaalsContact O-N 3.09Å
298	Y	97.3	Very high	96.4	Very high	159 Å²	159	63 Å²	63	62%	0.624	32%	0.321	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.1	-20.6	179.2	-63.1	-66.1	0	0	0	112.7	V294 P295 E296 P300	V294-Y298 HydrophobicContact CB-CE2 4.41Å; V294-Y298 HydrophobicContact CG1-CD2 4.07Å; V294-Y298 HydrophobicContact CG1-CE2 4.01Å; V294-Y298 HydrophobicContact CG2-CD2 4.07Å; V294-Y298 HydrophobicContact CG2-CE2 3.54Å; P295-Y298 PolarHBondContact O-N 3.38Å; E296-Y298 VanDerWaalsContact C-N 3.25Å; E296-Y298 PolarHBondContact O-N 3.07Å; Y298-P300 VanDerWaalsContact C-CD 3.48Å
299	F	96.4	Very high	96.4	Very high	100 Å²	100	58 Å²	58	44%	0.439	30%	0.295	S	S	.	.	S	Bend	trans	-128.1	64.5	179.2	-52.5	-78.4	0	0	0	111.8	P295 E296 G301 Q302 L303	P295-F299 HydrophobicContact CB-CD2 4.24Å; P295-F299 WeakPolarHBondContact O-CD2 3.09Å; P295-F299 PolarHBondContact O-N 3.44Å; E296-F299 CarbonylContact O-C 3.57Å; E296-F299 PolarHBondContact O-N 3.06Å; F299-G301 PolarHBondContact O-N 3.05Å; F299-Q302 HydrophobicContact CB-CB 4.1Å; F299-Q302 HydrophobicContact CB-CG 4.33Å; F299-Q302 PolarHBondContact O-N 3.46Å; F299-L303 HydrophobicContact CB-CD1 4.41Å
300	P	96.5	Very high	96.5	Very high	72 Å²	72	57.4 Å²	57.4	47%	0.468	29%	0.292	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59	134.9	-177.3	-22.5	34.3	0	0	0	111.5	Y81 E296 Y298 Q302	Y81-P300 HydrophobicContact CD1-CB 4.48Å; Y81-P300 HydrophobicContact CD1-CG 4.09Å; Y81-P300 WeakPolarHBondContact O-CA 3.45Å; E296-P300 WeakPolarHBondContact O-CA 3.49Å; E296-P300 VanDerWaalsContact O-N 3.14Å; Y298-P300 VanDerWaalsContact C-CD 3.48Å; P300-Q302 PolarHBondContact O-N 3.33Å; P300-Q302 VanDerWaalsContact O-N 3.15Å
301	G	94.5	Very high	96.6	Very high	24 Å²	24	56.4 Å²	56.4	25%	0.247	29%	0.289	C	S	.	.	T	Hydrogen-bonded Turn	trans	77.5	-18.1	-179.9	0	0	0	0	0	116.2	Y81 T83 F299 N304	Y81-G301 PolarHBondContact O-N 3.39Å; T83-G301 WeakPolarHBondContact OG1-CA 3.16Å; F299-G301 PolarHBondContact O-N 3.05Å; G301-N304 WeakPolarHBondContact CA-OD1 3.45Å; G301-N304 VanDerWaalsContact O-CG 3.3Å; G301-N304 PolarHBondContact O-ND2 3.32Å; G301-N304 VanDerWaalsContact O-ND2 3.12Å
302	Q	96.1	Very high	96.8	Very high	150 Å²	150	53.7 Å²	53.7	70%	0.701	27%	0.272	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.4	-30.7	178.6	-59.1	-172.8	14.4	0	0	112.1	F299 P300	F299-Q302 HydrophobicContact CB-CB 4.1Å; F299-Q302 HydrophobicContact CB-CG 4.33Å; F299-Q302 PolarHBondContact O-N 3.46Å; P300-Q302 PolarHBondContact O-N 3.33Å; P300-Q302 VanDerWaalsContact O-N 3.15Å
303	L	96.8	Very high	96.9	Very high	35 Å²	35	54.4 Å²	54.4	18%	0.183	27%	0.27	C	S	.	.	T	Hydrogen-bonded Turn	trans	-104.3	32.6	-176.5	-59.7	174.2	0	0	0	112.3	I82 P295 E296 F299 Y305 L306	I82-L303 WeakPolarHBondContact CD1-O 3.43Å; P295-L303 HydrophobicContact CB-CD1 3.66Å; P295-L303 HydrophobicContact CG-CD1 3.6Å; E296-L303 HydrophobicContact CB-CB 4.18Å; E296-L303 HydrophobicContact CB-CD1 4.35Å; F299-L303 HydrophobicContact CB-CD1 4.41Å; L303-Y305 VanDerWaalsContact C-N 3.34Å; L303-Y305 PolarHBondContact O-N 3.32Å; L303-L306 VanDerWaalsContact CD2-O 3.27Å; L303-L306 WeakPolarHBondContact CD2-O 3.36Å
304	N	95.9	Very high	97	Very high	10 Å²	10	53.2 Å²	53.2	5%	0.053	27%	0.265	C	S	.	.	S	Bend	trans	-63	-38.7	-178.2	-77.1	-14.5	0	0	0	112.6	I82 T83 D84 N104 G301	I82-N304 WeakPolarHBondContact CA-OD1 3.41Å; T83-N304 PolarHBondContact N-OD1 3.03Å; T83-N304 PolarHBondContact OG1-ND2 3.44Å; T83-N304 VanDerWaalsContact OG1-ND2 3.14Å; D84-N304 WeakPolarHBondContact CB-ND2 3.48Å; D84-N304 PolarHBondContact N-ND2 3.36Å; D84-N304 VanDerWaalsContact N-ND2 3.18Å; N104-N304 WeakPolarHBondContact CA-O 3.36Å; N104-N304 VanDerWaalsContact CB-O 3.28Å; N104-N304 WeakPolarHBondContact CB-O 3.23Å; G301-N304 WeakPolarHBondContact CA-OD1 3.45Å; G301-N304 VanDerWaalsContact O-CG 3.3Å; G301-N304 PolarHBondContact O-ND2 3.32Å; G301-N304 VanDerWaalsContact O-ND2 3.12Å
305	Y	96.3	Very high	97.1	Very high	75 Å²	75	56 Å²	56	29%	0.294	28%	0.277	S	S	.	.	S	Bend	trans	-108.3	-31.1	-173.2	-61.7	-83.8	0	0	0	114	L66 G85 L102 V107 L303 Q311	L66-Y305 HydrophobicContact CD1-CE1 4.44Å; G85-Y305 WeakPolarHBondContact CA-OH 3.35Å; L102-Y305 HydrophobicContact CD1-CD1 4.25Å; L102-Y305 HydrophobicContact CD2-CD1 4.37Å; L102-Y305 HydrophobicContact CG-CD1 3.77Å; L102-Y305 HydrophobicContact CG-CE1 4.19Å; L102-Y305 HydrophobicContact CG-CG 4.46Å; V107-Y305 WeakPolarHBondContact CG2-O 3.31Å; L303-Y305 VanDerWaalsContact C-N 3.34Å; L303-Y305 PolarHBondContact O-N 3.32Å; Y305-Q311 PolarHBondContact O-NE2 2.92Å
306	L	97.4	Very high	97.2	Very high	125 Å²	125	55.2 Å²	55.2	65%	0.654	27%	0.271	S	S	*	.	S	Bend	trans	-142	140.5	-174.4	-173	67.8	0	0	0	110.7	V107 L303 Q311	V107-L306 HydrophobicContact CG2-CD1 3.8Å; L303-L306 VanDerWaalsContact CD2-O 3.27Å; L303-L306 WeakPolarHBondContact CD2-O 3.36Å; L306-Q311 VanDerWaalsContact C-OE1 3.27Å
307	G	95.3	Very high	97.2	Very high	27 Å²	27	56 Å²	56	28%	0.278	28%	0.276	S	S	.	.	S	Bend	trans	85	10.6	171.9	0	0	0	0	0	115.5	P295	P295-G307 VanDerWaalsContact CD-O 3.24Å; P295-G307 WeakPolarHBondContact CD-O 3.1Å; P295-G307 WeakPolarHBondContact CG-O 3.32Å
308	S	97.5	Very high	97.3	Very high	5 Å²	5	50.9 Å²	50.9	4%	0.035	26%	0.258	C	S	.	.			trans	-71.9	155.7	175	68.1	0	0	0	0	112	H310 Q311 V312	S308-H310 PolarHBondContact O-N 2.68Å; S308-Q311 WeakPolarHBondContact O-CB 3.4Å; S308-Q311 PolarHBondContact O-N 3.19Å; S308-Q311 VanDerWaalsContact OG-CG 3.3Å; S308-Q311 WeakPolarHBondContact OG-CG 3.46Å; S308-V312 PolarHBondContact O-N 2.99Å; S308-V312 VanDerWaalsContact O-N 3.08Å
309	S	98	Very high	97.3	Very high	0 Å²	0	47.4 Å²	47.4	0%	0	25%	0.25	C	C	.	.	H	α-helix	trans	-60.6	-32.3	-175.3	97.4	0	0	0	0	113.3	F289 K293 V294 E296 V312 W313	F289-S309 WeakPolarHBondContact O-CB 3.39Å; F289-S309 PolarHBondContact O-OG 2.96Å; K293-S309 WeakPolarHBondContact CA-OG 3.06Å; V294-S309 WeakPolarHBondContact O-CB 3.4Å; E296-S309 WeakPolarHBondContact OE1-CB 3.49Å; E296-S309 PolarHBondContact OE1-N 3.46Å; E296-S309 PolarHBondContact OE1-OG 3.35Å; E296-S309 VanDerWaalsContact OE2-CB 3.31Å; E296-S309 WeakPolarHBondContact OE2-CB 3.43Å; E296-S309 PolarHBondContact OE2-N 2.94Å; S309-V312 PolarHBondContact O-N 3.49Å; S309-W313 WeakPolarHBondContact O-CB 3.4Å; S309-W313 PolarHBondContact O-N 3.26Å
310	H	97.7	Very high	97.4	Very high	40 Å²	40	43.5 Å²	43.5	19%	0.185	23%	0.233	C	C	.	.	H	α-helix	trans	-68.2	-38.3	176.2	-160.5	79.8	0	0	0	111	H162 Y290 S308 V312 W313 H314	H162-H310 AromaticContact CE1-CD2 3.68Å; H162-H310 AromaticContact CE1-NE2 3.19Å; H162-H310 PolarHBondContact CE1-NE2 3.22Å; H162-H310 AromaticContact NE2-NE2 3.25Å; H162-H310 PolarHBondContact NE2-NE2 2.63Å; Y290-H310 AromaticContact CD2-ND1 3.84Å; Y290-H310 AromaticContact CE2-ND1 3.8Å; S308-H310 PolarHBondContact O-N 2.68Å; H310-V312 VanDerWaalsContact C-N 3.35Å; H310-V312 PolarHBondContact O-N 2.96Å; H310-W313 WeakPolarHBondContact O-CB 3.3Å; H310-W313 PolarHBondContact O-N 3.06Å; H310-H314 AromaticContact CD2-CD2 3.53Å; H310-H314 AromaticContact CD2-NE2 3.37Å; H310-H314 PolarHBondContact CD2-NE2 3.05Å; H310-H314 AromaticContact CE1-NE2 3.88Å; H310-H314 AromaticContact NE2-CD2 3.47Å; H310-H314 PolarHBondContact NE2-CD2 3.31Å; H310-H314 AromaticContact NE2-NE2 2.9Å; H310-H314 PolarHBondContact NE2-NE2 3.42Å; H310-H314 PolarHBondContact O-CD2 3.46Å; H310-H314 PolarHBondContact O-N 2.93Å; H310-H314 VanDerWaalsContact O-N 3.1Å
311	Q	98.4	Very high	97.5	Very high	3 Å²	3	40.4 Å²	40.4	1%	0.014	21%	0.213	C	C	.	.	H	α-helix	trans	-65.2	-41.3	174.5	-64.1	173.3	3	0	0	111.5	V107 N108 Y305 L306 S308 W313 H314 L315	V107-Q311 HydrophobicContact CB-CB 4.29Å; V107-Q311 VanDerWaalsContact CB-CD 3.44Å; V107-Q311 HydrophobicContact CB-CG 3.69Å; V107-Q311 HydrophobicContact CG1-CB 3.73Å; V107-Q311 HydrophobicContact CG1-CG 3.73Å; N108-Q311 WeakPolarHBondContact OD1-CG 3.34Å; Y305-Q311 PolarHBondContact O-NE2 2.92Å; L306-Q311 VanDerWaalsContact C-OE1 3.27Å; S308-Q311 WeakPolarHBondContact O-CB 3.4Å; S308-Q311 PolarHBondContact O-N 3.19Å; S308-Q311 VanDerWaalsContact OG-CG 3.3Å; S308-Q311 WeakPolarHBondContact OG-CG 3.46Å; Q311-W313 VanDerWaalsContact C-N 3.33Å; Q311-W313 PolarHBondContact O-N 3.07Å; Q311-H314 PolarHBondContact O-N 2.83Å; Q311-L315 WeakPolarHBondContact O-CG 3.45Å; Q311-L315 PolarHBondContact O-N 3.24Å; Q311-L315 VanDerWaalsContact O-N 3.11Å
312	V	98.4	Very high	97.7	Very high	35 Å²	35	43.8 Å²	43.8	21%	0.212	22%	0.219	C	C	.	.	H	α-helix	trans	-63	-40.8	175.2	178.6	0	0	0	0	111	F289 S308 S309 H310 H314 L315 L316	F289-V312 HydrophobicContact CB-CG1 4.36Å; F289-V312 HydrophobicContact CD1-CB 4.49Å; F289-V312 HydrophobicContact CD1-CG1 4.13Å; F289-V312 HydrophobicContact CD2-CG1 3.66Å; F289-V312 HydrophobicContact CE1-CG1 4.37Å; F289-V312 HydrophobicContact CE2-CG1 3.91Å; F289-V312 HydrophobicContact CG-CB 4.35Å; F289-V312 HydrophobicContact CG-CG1 3.8Å; F289-V312 HydrophobicContact CZ-CG1 4.27Å; S308-V312 PolarHBondContact O-N 2.99Å; S308-V312 VanDerWaalsContact O-N 3.08Å; S309-V312 PolarHBondContact O-N 3.49Å; H310-V312 VanDerWaalsContact C-N 3.35Å; H310-V312 PolarHBondContact O-N 2.96Å; V312-H314 PolarHBondContact O-N 3.33Å; V312-L315 PolarHBondContact O-N 2.89Å; V312-L316 HydrophobicContact CG1-CD1 3.77Å; V312-L316 HydrophobicContact CG1-CG 4.19Å; V312-L316 WeakPolarHBondContact O-CB 3.42Å; V312-L316 WeakPolarHBondContact O-CG 3.2Å; V312-L316 PolarHBondContact O-N 2.93Å
313	W	97.7	Very high	97.8	Very high	49 Å²	49	41.1 Å²	41.1	19%	0.186	20%	0.202	C	C	.	.	H	α-helix	trans	-54.7	-48.7	172.9	164	-92.7	0	0	0	112	A286 L287 Y290 S309 H310 Q311 L315 L316 L317	A286-W313 HydrophobicContact CB-CD2 4.39Å; A286-W313 HydrophobicContact CB-CE3 3.47Å; A286-W313 VanDerWaalsContact CB-CE3 3.47Å; A286-W313 HydrophobicContact CB-CZ3 3.72Å; A286-W313 VanDerWaalsContact O-CE3 3.27Å; L287-W313 HydrophobicContact CB-CZ3 4.17Å; L287-W313 HydrophobicContact CD1-CZ3 4.39Å; Y290-W313 HydrophobicContact CD2-CD2 4.28Å; Y290-W313 HydrophobicContact CD2-CG 4.29Å; Y290-W313 HydrophobicContact CG-CD2 4.31Å; Y290-W313 HydrophobicContact CG-CE3 4.26Å; S309-W313 WeakPolarHBondContact O-CB 3.4Å; S309-W313 PolarHBondContact O-N 3.26Å; H310-W313 WeakPolarHBondContact O-CB 3.3Å; H310-W313 PolarHBondContact O-N 3.06Å; Q311-W313 VanDerWaalsContact C-N 3.33Å; Q311-W313 PolarHBondContact O-N 3.07Å; W313-L315 PolarHBondContact O-N 3.39Å; W313-L316 PolarHBondContact O-N 3.37Å; W313-L317 HydrophobicContact CD2-CD1 4.3Å; W313-L317 HydrophobicContact CD2-CG 4.38Å; W313-L317 HydrophobicContact CH2-CD2 4.41Å; W313-L317 HydrophobicContact CZ2-CD1 3.69Å; W313-L317 HydrophobicContact CZ2-CD2 4.27Å; W313-L317 HydrophobicContact CZ2-CG 4.19Å; W313-L317 PolarHBondContact O-N 2.68Å
314	H	98.4	Very high	97.9	Very high	2 Å²	2	40.3 Å²	40.3	1%	0.009	20%	0.197	C	C	.	.	H	α-helix	trans	-59.3	-47.7	177.9	-80.7	-118	0	0	0	112.1	N108 S111 H112 S158 H162 H310 Q311 V312 L316 L317 V318	N108-H314 PolarHBondContact O-ND1 3.19Å; S111-H314 VanDerWaalsContact OG-CB 3.31Å; S111-H314 WeakPolarHBondContact OG-CB 3.35Å; H112-H314 AromaticContact CD2-CG 3.84Å; H112-H314 AromaticContact CD2-ND1 3.31Å; H112-H314 PolarHBondContact CD2-ND1 3.41Å; H112-H314 VanDerWaalsContact CD2-ND1 3.31Å; H112-H314 AromaticContact CE1-CE1 3.38Å; H112-H314 PolarHBondContact CE1-CE1 3.33Å; H112-H314 AromaticContact CE1-CG 3.61Å; H112-H314 AromaticContact CE1-ND1 3.04Å; H112-H314 PolarHBondContact CE1-ND1 2.79Å; H112-H314 AromaticContact CG-CE1 3.95Å; H112-H314 AromaticContact CG-ND1 3.26Å; H112-H314 VanDerWaalsContact CG-ND1 3.26Å; H112-H314 AromaticContact ND1-CE1 3.34Å; H112-H314 PolarHBondContact ND1-CE1 2.92Å; H112-H314 VanDerWaalsContact ND1-CE1 3.34Å; H112-H314 AromaticContact ND1-ND1 3.07Å; H112-H314 PolarHBondContact ND1-ND1 2.91Å; H112-H314 WeakPolarHBondContact NE2-CA 3.45Å; H112-H314 WeakPolarHBondContact NE2-CB 3.23Å; H112-H314 AromaticContact NE2-CE1 3.97Å; H112-H314 AromaticContact NE2-CG 3.44Å; H112-H314 AromaticContact NE2-ND1 3.18Å; H112-H314 PolarHBondContact NE2-ND1 3.36Å; H112-H314 VanDerWaalsContact NE2-ND1 3.18Å; H112-H314 PolarHBondContact NE2-O 3.35Å; S158-H314 PolarHBondContact OG-CE1 2.69Å; S158-H314 VanDerWaalsContact OG-CE1 3.26Å; H162-H314 AromaticContact CD2-CE1 3.43Å; H162-H314 PolarHBondContact CD2-CE1 2.99Å; H162-H314 VanDerWaalsContact CD2-CE1 3.43Å; H162-H314 AromaticContact CD2-NE2 3.83Å; H162-H314 AromaticContact CE1-NE2 3.95Å; H162-H314 AromaticContact NE2-CE1 3.29Å; H162-H314 PolarHBondContact NE2-CE1 2.91Å; H162-H314 VanDerWaalsContact NE2-CE1 3.29Å; H162-H314 AromaticContact NE2-NE2 3.17Å; H162-H314 PolarHBondContact NE2-NE2 3.45Å; H162-H314 VanDerWaalsContact NE2-NE2 3.17Å; H310-H314 AromaticContact CD2-CD2 3.53Å; H310-H314 AromaticContact CD2-NE2 3.37Å; H310-H314 PolarHBondContact CD2-NE2 3.05Å; H310-H314 AromaticContact CE1-NE2 3.88Å; H310-H314 AromaticContact NE2-CD2 3.47Å; H310-H314 PolarHBondContact NE2-CD2 3.31Å; H310-H314 AromaticContact NE2-NE2 2.9Å; H310-H314 PolarHBondContact NE2-NE2 3.42Å; H310-H314 PolarHBondContact O-CD2 3.46Å; H310-H314 PolarHBondContact O-N 2.93Å; H310-H314 VanDerWaalsContact O-N 3.1Å; Q311-H314 PolarHBondContact O-N 2.83Å; V312-H314 PolarHBondContact O-N 3.33Å; H314-L316 PolarHBondContact O-N 3.2Å; H314-L317 PolarHBondContact O-N 3.29Å; H314-V318 WeakPolarHBondContact O-CG2 3.44Å; H314-V318 PolarHBondContact O-N 3.09Å; H314-V318 VanDerWaalsContact O-N 3.12Å
315	L	98.6	Very high	97.9	Very high	97 Å²	97	40.4 Å²	40.4	51%	0.508	20%	0.197	S	C	.	.	H	α-helix	trans	-62.8	-42.2	180	-66.9	173.7	0	0	0	112.1	Q311 V312 W313 V318 L319	Q311-L315 WeakPolarHBondContact O-CG 3.45Å; Q311-L315 PolarHBondContact O-N 3.24Å; Q311-L315 VanDerWaalsContact O-N 3.11Å; V312-L315 PolarHBondContact O-N 2.89Å; W313-L315 PolarHBondContact O-N 3.39Å; L315-V318 PolarHBondContact O-N 2.86Å; L315-L319 PolarHBondContact O-N 3.31Å
316	L	98.6	Very high	98	Very high	23 Å²	23	40.7 Å²	40.7	12%	0.12	20%	0.201	C	C	.	.	H	α-helix	trans	-67.9	-34.1	178	-69.8	173.8	0	0	0	112.3	I282 L285 A286 F289 V312 W313 H314 L319 M320	I282-L316 HydrophobicContact CG2-CB 4.23Å; I282-L316 HydrophobicContact CG2-CD2 4.27Å; I282-L316 WeakPolarHBondContact CG2-O 3.45Å; L285-L316 HydrophobicContact CB-CD1 4.47Å; L285-L316 HydrophobicContact CD2-CD1 4.23Å; L285-L316 HydrophobicContact CD2-CD2 4.32Å; L285-L316 HydrophobicContact CG-CD1 3.97Å; A286-L316 HydrophobicContact CB-CB 3.72Å; A286-L316 HydrophobicContact CB-CD1 3.97Å; F289-L316 HydrophobicContact CD2-CD1 3.86Å; F289-L316 HydrophobicContact CE2-CD1 4.27Å; V312-L316 HydrophobicContact CG1-CD1 3.77Å; V312-L316 HydrophobicContact CG1-CG 4.19Å; V312-L316 WeakPolarHBondContact O-CB 3.42Å; V312-L316 WeakPolarHBondContact O-CG 3.2Å; V312-L316 PolarHBondContact O-N 2.93Å; W313-L316 PolarHBondContact O-N 3.37Å; H314-L316 PolarHBondContact O-N 3.2Å; L316-L319 HydrophobicContact CD2-CD2 4.35Å; L316-L319 PolarHBondContact O-N 2.9Å; L316-M320 VanDerWaalsContact O-CB 3.27Å; L316-M320 WeakPolarHBondContact O-CB 3.45Å; L316-M320 PolarHBondContact O-N 3.15Å
317	L	98	Very high	97.9	Very high	18 Å²	18	34.8 Å²	34.8	9%	0.094	17%	0.17	C	C	.	.	H	α-helix	trans	-65.6	-42.1	173.3	-78.6	-174.7	0	0	0	112.5	W313 H314 L319 M320 F321	W313-L317 HydrophobicContact CD2-CD1 4.3Å; W313-L317 HydrophobicContact CD2-CG 4.38Å; W313-L317 HydrophobicContact CH2-CD2 4.41Å; W313-L317 HydrophobicContact CZ2-CD1 3.69Å; W313-L317 HydrophobicContact CZ2-CD2 4.27Å; W313-L317 HydrophobicContact CZ2-CG 4.19Å; W313-L317 PolarHBondContact O-N 2.68Å; H314-L317 PolarHBondContact O-N 3.29Å; L317-L319 VanDerWaalsContact C-N 3.34Å; L317-M320 HydrophobicContact CD2-CE 3.96Å; L317-M320 HydrophobicContact CD2-SD 4.33Å; L317-M320 PolarHBondContact O-N 3.09Å; L317-F321 PolarHBondContact O-N 3.17Å
318	V	98.8	Very high	97.9	Very high	20 Å²	20	33.7 Å²	33.7	12%	0.121	16%	0.158	C	C	.	.	H	α-helix	trans	-60.8	-46.2	174.1	176	0	0	0	0	110.3	L118 F119 M155 H314 L315 M320 F321 Y322	L118-V318 HydrophobicContact CD2-CG1 4.12Å; F119-V318 HydrophobicContact CE2-CG1 4.42Å; M155-V318 HydrophobicContact CE-CB 4.38Å; M155-V318 HydrophobicContact CE-CG2 3.58Å; M155-V318 HydrophobicContact SD-CG2 3.85Å; H314-V318 WeakPolarHBondContact O-CG2 3.44Å; H314-V318 PolarHBondContact O-N 3.09Å; H314-V318 VanDerWaalsContact O-N 3.12Å; L315-V318 PolarHBondContact O-N 2.86Å; V318-M320 VanDerWaalsContact C-N 3.35Å; V318-M320 PolarHBondContact O-N 3.26Å; V318-F321 PolarHBondContact O-N 3.39Å; V318-Y322 WeakPolarHBondContact O-CB 3.35Å; V318-Y322 PolarHBondContact O-N 3.42Å
319	L	98.7	Very high	97.8	Very high	85 Å²	85	34.4 Å²	34.4	45%	0.445	17%	0.166	S	C	.	.	H	α-helix	trans	-60.3	-43.6	176.4	178.3	62.8	0	0	0	111.9	I282 L315 L316 L317 Y322 W323	I282-L319 HydrophobicContact CD1-CD2 4.45Å; I282-L319 HydrophobicContact CD1-CG 4.29Å; I282-L319 HydrophobicContact CG2-CD2 4.5Å; L315-L319 PolarHBondContact O-N 3.31Å; L316-L319 HydrophobicContact CD2-CD2 4.35Å; L316-L319 PolarHBondContact O-N 2.9Å; L317-L319 VanDerWaalsContact C-N 3.34Å; L319-Y322 PolarHBondContact O-N 3.36Å; L319-W323 VanDerWaalsContact O-CB 3.3Å; L319-W323 WeakPolarHBondContact O-CB 3.48Å; L319-W323 PolarHBondContact O-N 2.96Å
320	M	98.5	Very high	97.6	Very high	18 Å²	18	37.5 Å²	37.5	9%	0.089	18%	0.18	C	C	.	.	H	α-helix	trans	-61.4	-47.7	178.3	-175.7	-163.1	75.1	0	0	111.5	M279 I282 A283 L316 L317 V318 Y322 W323 W324	M279-M320 HydrophobicContact CG-CG 3.76Å; M279-M320 HydrophobicContact CG-SD 4.36Å; I282-M320 HydrophobicContact CB-CB 4.34Å; I282-M320 HydrophobicContact CG2-CB 3.78Å; I282-M320 HydrophobicContact CG2-CG 4.47Å; A283-M320 HydrophobicContact CB-SD 3.68Å; L316-M320 VanDerWaalsContact O-CB 3.27Å; L316-M320 WeakPolarHBondContact O-CB 3.45Å; L316-M320 PolarHBondContact O-N 3.15Å; L317-M320 HydrophobicContact CD2-CE 3.96Å; L317-M320 HydrophobicContact CD2-SD 4.33Å; L317-M320 PolarHBondContact O-N 3.09Å; V318-M320 VanDerWaalsContact C-N 3.35Å; V318-M320 PolarHBondContact O-N 3.26Å; M320-Y322 VanDerWaalsContact C-N 3.35Å; M320-W323 PolarHBondContact O-N 3.04Å; M320-W324 WeakPolarHBondContact O-CB 3.47Å; M320-W324 PolarHBondContact O-N 3.48Å
321	F	98.6	Very high	97.4	Very high	8 Å²	8	35.6 Å²	35.6	4%	0.035	17%	0.171	C	C	.	.	H	α-helix	trans	-64.4	-39.5	177.2	-74.1	-15.6	0	0	0	112	F119 F151 C154 M155 L317 V318 W324 H325	F119-F321 HydrophobicContact CE1-CB 3.96Å; F119-F321 HydrophobicContact CE2-CB 4.01Å; F119-F321 HydrophobicContact CE2-CD2 4.27Å; F119-F321 HydrophobicContact CZ-CB 3.34Å; F119-F321 HydrophobicContact CZ-CD2 4.43Å; F119-F321 HydrophobicContact CZ-CG 4.42Å; F151-F321 HydrophobicContact CB-CD2 4.01Å; F151-F321 HydrophobicContact CB-CE2 4.47Å; F151-F321 HydrophobicContact CB-CG 4.49Å; F151-F321 HydrophobicContact CD1-CB 4.33Å; F151-F321 AromaticContact CD1-CD1 3.8Å; F151-F321 HydrophobicContact CD1-CD1 3.8Å; F151-F321 AromaticContact CD1-CD2 3.81Å; F151-F321 HydrophobicContact CD1-CD2 3.81Å; F151-F321 AromaticContact CD1-CE1 4Å; F151-F321 HydrophobicContact CD1-CE1 4Å; F151-F321 HydrophobicContact CD1-CE2 4.01Å; F151-F321 AromaticContact CD1-CG 3.73Å; F151-F321 HydrophobicContact CD1-CG 3.73Å; F151-F321 HydrophobicContact CD1-CZ 4.12Å; F151-F321 HydrophobicContact CD2-CB 4.01Å; F151-F321 HydrophobicContact CD2-CG 4.3Å; F151-F321 HydrophobicContact CE1-CB 4.48Å; F151-F321 AromaticContact CE1-CD1 3.66Å; F151-F321 HydrophobicContact CE1-CD1 3.66Å; F151-F321 HydrophobicContact CE1-CD2 4.48Å; F151-F321 AromaticContact CE1-CE1 3.95Å; F151-F321 HydrophobicContact CE1-CE1 3.95Å; F151-F321 AromaticContact CE1-CG 3.98Å; F151-F321 HydrophobicContact CE1-CG 3.98Å; F151-F321 HydrophobicContact CE1-CZ 4.5Å; F151-F321 HydrophobicContact CE2-CB 4.16Å; F151-F321 HydrophobicContact CG-CB 4.11Å; F151-F321 HydrophobicContact CG-CD1 4.44Å; F151-F321 AromaticContact CG-CD2 3.91Å; F151-F321 HydrophobicContact CG-CD2 3.91Å; F151-F321 HydrophobicContact CG-CE2 4.46Å; F151-F321 AromaticContact CG-CG 3.93Å; F151-F321 HydrophobicContact CG-CG 3.93Å; F151-F321 HydrophobicContact CZ-CB 4.41Å; F151-F321 HydrophobicContact CZ-CD1 4.16Å; F151-F321 HydrophobicContact CZ-CG 4.37Å; C154-F321 HydrophobicContact CB-CE2 4.23Å; M155-F321 HydrophobicContact CE-CD2 3.46Å; M155-F321 VanDerWaalsContact CE-CD2 3.46Å; M155-F321 HydrophobicContact CE-CE2 3.69Å; L317-F321 PolarHBondContact O-N 3.17Å; V318-F321 PolarHBondContact O-N 3.39Å; F321-W324 PolarHBondContact O-N 3.36Å; F321-H325 VanDerWaalsContact O-CB 3.26Å; F321-H325 WeakPolarHBondContact O-CB 3.19Å; F321-H325 PolarHBondContact O-N 2.88Å
322	Y	98.5	Very high	97.1	Very high	95 Å²	95	35.6 Å²	35.6	37%	0.373	17%	0.171	S	C	.	.	H	α-helix	trans	-63.7	-46.4	174.3	-179.2	-100.8	0	0	0	111.7	L118 V318 L319 M320 W324 H325 Q326	L118-Y322 HydrophobicContact CD2-CD2 4.29Å; V318-Y322 WeakPolarHBondContact O-CB 3.35Å; V318-Y322 PolarHBondContact O-N 3.42Å; L319-Y322 PolarHBondContact O-N 3.36Å; M320-Y322 VanDerWaalsContact C-N 3.35Å; Y322-W324 VanDerWaalsContact C-N 3.33Å; Y322-W324 PolarHBondContact O-N 3.39Å; Y322-H325 WeakPolarHBondContact O-CB 3.35Å; Y322-H325 PolarHBondContact O-N 3.3Å; Y322-Q326 HydrophobicContact CD1-CG 4.34Å; Y322-Q326 HydrophobicContact CE1-CG 3.93Å; Y322-Q326 HydrophobicContact CE2-CG 4.4Å; Y322-Q326 WeakPolarHBondContact O-CG 3.29Å; Y322-Q326 PolarHBondContact O-N 3.1Å
323	W	98.5	Very high	96.8	Very high	94 Å²	94	36 Å²	36	36%	0.356	18%	0.177	S	C	.	.	H	α-helix	trans	-58.1	-45	175.4	176.9	-93	0	0	0	112.1	R275 I282 L319 M320 Q326 S327	R275-W323 PolarHBondContact O-NE1 2.93Å; I282-W323 HydrophobicContact CD1-CB 4.15Å; I282-W323 HydrophobicContact CD1-CG 4.13Å; L319-W323 VanDerWaalsContact O-CB 3.3Å; L319-W323 WeakPolarHBondContact O-CB 3.48Å; L319-W323 PolarHBondContact O-N 2.96Å; M320-W323 PolarHBondContact O-N 3.04Å; W323-Q326 PolarHBondContact O-N 2.78Å; W323-S327 WeakPolarHBondContact O-CB 3.48Å; W323-S327 PolarHBondContact O-N 2.7Å; W323-S327 PolarHBondContact O-OG 3.22Å
324	W	97.9	Very high	96.5	Very high	17 Å²	17	36.9 Å²	36.9	6%	0.064	18%	0.181	C	C	.	.	H	α-helix	trans	-68.8	-36.2	179.2	-168.7	-114.6	0	0	0	112.6	C191 F272 I276 M279 M320 F321 Y322 S327 S328	C191-W324 PolarHBondContact O-NE1 3.02Å; F272-W324 HydrophobicContact CZ-CH2 4.33Å; I276-W324 HydrophobicContact CB-CZ3 4.47Å; I276-W324 HydrophobicContact CG1-CH2 4.07Å; I276-W324 HydrophobicContact CG1-CZ3 4Å; M279-W324 HydrophobicContact CB-CE3 3.92Å; M279-W324 HydrophobicContact CB-CZ3 4.35Å; M279-W324 HydrophobicContact CE-CD2 4.47Å; M279-W324 HydrophobicContact CE-CE3 4.16Å; M279-W324 HydrophobicContact CE-CH2 4.27Å; M279-W324 HydrophobicContact CE-CZ3 4.07Å; M279-W324 HydrophobicContact CG-CB 4.47Å; M279-W324 HydrophobicContact CG-CD2 4.43Å; M279-W324 HydrophobicContact CG-CE3 4.05Å; M279-W324 HydrophobicContact SD-CB 4.11Å; M279-W324 HydrophobicContact SD-CD2 3.32Å; M279-W324 HydrophobicContact SD-CE3 3.29Å; M279-W324 HydrophobicContact SD-CG 3.72Å; M279-W324 HydrophobicContact SD-CH2 4.3Å; M279-W324 HydrophobicContact SD-CZ2 4.34Å; M279-W324 HydrophobicContact SD-CZ3 3.82Å; M320-W324 WeakPolarHBondContact O-CB 3.47Å; M320-W324 PolarHBondContact O-N 3.48Å; F321-W324 PolarHBondContact O-N 3.36Å; Y322-W324 VanDerWaalsContact C-N 3.33Å; Y322-W324 PolarHBondContact O-N 3.39Å; W324-S327 WeakPolarHBondContact O-CB 3.28Å; W324-S327 PolarHBondContact O-N 3.46Å; W324-S328 PolarHBondContact O-N 2.94Å; W324-S328 PolarHBondContact O-OG 2.66Å
325	H	97.1	Very high	96.1	Very high	12 Å²	12	38.2 Å²	38.2	6%	0.056	19%	0.186	C	C	.	.	H	α-helix	trans	-60	-49.2	171.7	175.9	65.5	0	0	0	111.7	V122 N126 Y144 F151 F321 Y322 S327 S328 G329	V122-H325 WeakPolarHBondContact CG1-NE2 3.43Å; N126-H325 PolarHBondContact ND2-CE1 3.27Å; N126-H325 PolarHBondContact ND2-NE2 2.88Å; Y144-H325 AromaticContact CD1-CE1 3.81Å; Y144-H325 AromaticContact CE1-CE1 3.48Å; Y144-H325 VanDerWaalsContact CE1-CE1 3.48Å; Y144-H325 WeakPolarHBondContact CE1-CE1 3.19Å; F151-H325 HydrophobicContact CE2-CB 4.36Å; F321-H325 VanDerWaalsContact O-CB 3.26Å; F321-H325 WeakPolarHBondContact O-CB 3.19Å; F321-H325 PolarHBondContact O-N 2.88Å; Y322-H325 WeakPolarHBondContact O-CB 3.35Å; Y322-H325 PolarHBondContact O-N 3.3Å; H325-S327 VanDerWaalsContact C-N 3.27Å; H325-S327 PolarHBondContact O-N 2.92Å; H325-S328 WeakPolarHBondContact O-CB 3.34Å; H325-S328 PolarHBondContact O-N 3.07Å; H325-S328 VanDerWaalsContact O-N 3.17Å; H325-G329 PolarHBondContact O-N 3.34Å
326	Q	96.8	Very high	95.5	Very high	82 Å²	82	36.8 Å²	36.8	38%	0.383	18%	0.177	S	C	.	.	H	α-helix	trans	-60.8	-37.6	175.4	-67	-58.3	-38.4	0	0	112.2	Y322 W323 G329 F330	Y322-Q326 HydrophobicContact CD1-CG 4.34Å; Y322-Q326 HydrophobicContact CE1-CG 3.93Å; Y322-Q326 HydrophobicContact CE2-CG 4.4Å; Y322-Q326 WeakPolarHBondContact O-CG 3.29Å; Y322-Q326 PolarHBondContact O-N 3.1Å; W323-Q326 PolarHBondContact O-N 2.78Å; Q326-G329 WeakPolarHBondContact O-CA 3.32Å; Q326-G329 PolarHBondContact O-N 3.05Å; Q326-F330 PolarHBondContact O-N 3.49Å
327	S	96.9	Very high	94.9	Very high	0 Å²	0	40.2 Å²	40.2	0%	0	20%	0.199	C	C	.	.	H	α-helix	trans	-66	-39.5	176.6	-57.3	0	0	0	0	111.9	F272 R275 W323 W324 H325 G329 F330 I331	F272-S327 WeakPolarHBondContact CE2-O 3.25Å; R275-S327 WeakPolarHBondContact CB-OG 3.23Å; W323-S327 WeakPolarHBondContact O-CB 3.48Å; W323-S327 PolarHBondContact O-N 2.7Å; W323-S327 PolarHBondContact O-OG 3.22Å; W324-S327 WeakPolarHBondContact O-CB 3.28Å; W324-S327 PolarHBondContact O-N 3.46Å; H325-S327 VanDerWaalsContact C-N 3.27Å; H325-S327 PolarHBondContact O-N 2.92Å; S327-G329 VanDerWaalsContact C-N 3.28Å; S327-G329 PolarHBondContact O-N 3.42Å; S327-F330 WeakPolarHBondContact O-CB 3.37Å; S327-F330 PolarHBondContact O-N 3.39Å; S327-I331 PolarHBondContact O-N 3.02Å; S327-I331 VanDerWaalsContact O-N 3.14Å
328	S	94.9	Very high	94.4	Very high	4 Å²	4	44.6 Å²	44.6	3%	0.028	22%	0.219	C	C	.	.	H	α-helix	trans	-63.3	-36.5	172.1	-57.6	0	0	0	0	111.3	Y144 W324 H325 I331 M332	Y144-S328 PolarHBondContact OH-O 3.1Å; Y144-S328 VanDerWaalsContact OH-O 3.11Å; W324-S328 PolarHBondContact O-N 2.94Å; W324-S328 PolarHBondContact O-OG 2.66Å; H325-S328 WeakPolarHBondContact O-CB 3.34Å; H325-S328 PolarHBondContact O-N 3.07Å; H325-S328 VanDerWaalsContact O-N 3.17Å; S328-I331 WeakPolarHBondContact O-CG2 3.31Å; S328-M332 VanDerWaalsContact O-CB 3.26Å; S328-M332 WeakPolarHBondContact O-CB 3.3Å; S328-M332 PolarHBondContact O-N 3.05Å
329	G	93.9	Very high	93.5	Very high	20 Å²	20	48.3 Å²	48.3	21%	0.206	24%	0.244	C	C	.	.	H	α-helix	trans	-53.9	-53.8	170.5	0	0	0	0	0	112.4	Y144 H325 Q326 S327 M332 A333	Y144-G329 WeakPolarHBondContact OH-CA 3.43Å; Y144-G329 PolarHBondContact OH-N 3.44Å; H325-G329 PolarHBondContact O-N 3.34Å; Q326-G329 WeakPolarHBondContact O-CA 3.32Å; Q326-G329 PolarHBondContact O-N 3.05Å; S327-G329 VanDerWaalsContact C-N 3.28Å; S327-G329 PolarHBondContact O-N 3.42Å; G329-M332 PolarHBondContact O-N 3.09Å; G329-A333 WeakPolarHBondContact O-CB 3.43Å; G329-A333 PolarHBondContact O-N 3.18Å
330	F	94.6	Very high	92.9	Very high	65 Å²	65	46.4 Å²	46.4	29%	0.285	24%	0.237	S	C	.	.	H	α-helix	trans	-58.8	-50.9	-179.1	174.7	-93.8	0	0	0	112.6	A271 F272 Q326 S327 A333 Y334	A271-F330 HydrophobicContact CB-CE1 3.95Å; A271-F330 HydrophobicContact CB-CZ 3.67Å; F272-F330 HydrophobicContact CD2-CD1 4.09Å; Q326-F330 PolarHBondContact O-N 3.49Å; S327-F330 WeakPolarHBondContact O-CB 3.37Å; S327-F330 PolarHBondContact O-N 3.39Å; F330-A333 PolarHBondContact O-N 2.91Å; F330-Y334 PolarHBondContact O-N 3.42Å
331	I	93.5	Very high	91.9	Very high	0 Å²	0	51 Å²	51	0%	0	27%	0.268	C	S	.	.	H	α-helix	trans	-70.6	-35.2	-177.1	-167.6	171.4	0	0	0	112.2	Y198 T199 F272 S327 S328 Y334 R335	Y198-I331 VanDerWaalsContact CB-CG2 3.48Å; Y198-I331 HydrophobicContact CD2-CG2 4.12Å; Y198-I331 HydrophobicContact CG-CG2 3.98Å; T199-I331 HydrophobicContact CG2-CD1 3.65Å; F272-I331 HydrophobicContact CD1-CD1 3.9Å; F272-I331 HydrophobicContact CD2-CB 4.07Å; F272-I331 HydrophobicContact CD2-CD1 4.39Å; F272-I331 HydrophobicContact CE1-CD1 3.73Å; F272-I331 HydrophobicContact CE2-CB 3.81Å; F272-I331 HydrophobicContact CE2-CD1 4.25Å; F272-I331 HydrophobicContact CE2-CG2 3.95Å; F272-I331 HydrophobicContact CG-CD1 4.24Å; F272-I331 HydrophobicContact CZ-CB 4.19Å; F272-I331 HydrophobicContact CZ-CD1 3.92Å; F272-I331 HydrophobicContact CZ-CG2 4.06Å; S327-I331 PolarHBondContact O-N 3.02Å; S327-I331 VanDerWaalsContact O-N 3.14Å; S328-I331 WeakPolarHBondContact O-CG2 3.31Å; I331-Y334 WeakPolarHBondContact O-CB 3.45Å; I331-Y334 PolarHBondContact O-N 3.31Å; I331-R335 WeakPolarHBondContact O-CG 3.3Å; I331-R335 PolarHBondContact O-N 3.35Å
332	M	92.6	Very high	90.3	Very high	4 Å²	4	55.1 Å²	55.1	2%	0.02	30%	0.304	C	S	.	.	H	α-helix	trans	-59.7	-52.2	172.7	176.3	-165.5	62.9	0	0	110.3	L131 I134 D140 Y144 Y198 S328 G329 Y334 R335 H336	L131-M332 HydrophobicContact CD2-CE 4.07Å; L131-M332 HydrophobicContact CD2-SD 3.68Å; I134-M332 HydrophobicContact CD1-CE 3.34Å; I134-M332 HydrophobicContact CD1-CG 4.49Å; I134-M332 HydrophobicContact CD1-SD 3.93Å; D140-M332 HydrophobicContact CB-SD 4.26Å; Y144-M332 HydrophobicContact CD2-SD 4Å; Y144-M332 HydrophobicContact CE2-CB 4.25Å; Y144-M332 HydrophobicContact CE2-CE 4.1Å; Y144-M332 HydrophobicContact CE2-CG 4.26Å; Y144-M332 HydrophobicContact CE2-SD 3.31Å; Y144-M332 WeakPolarHBondContact CE2-SD 3.5Å; Y198-M332 HydrophobicContact CD1-CB 4.1Å; Y198-M332 HydrophobicContact CD1-CG 4.49Å; Y198-M332 HydrophobicContact CD2-CB 4.38Å; Y198-M332 HydrophobicContact CE1-CB 3.72Å; Y198-M332 HydrophobicContact CE1-CG 3.7Å; Y198-M332 HydrophobicContact CE2-CB 4.03Å; Y198-M332 HydrophobicContact CE2-CG 4.48Å; Y198-M332 HydrophobicContact CG-CB 4.44Å; S328-M332 VanDerWaalsContact O-CB 3.26Å; S328-M332 WeakPolarHBondContact O-CB 3.3Å; S328-M332 PolarHBondContact O-N 3.05Å; G329-M332 PolarHBondContact O-N 3.09Å; M332-Y334 VanDerWaalsContact C-N 3.28Å; M332-Y334 PolarHBondContact O-N 3Å; M332-R335 PolarHBondContact O-N 2.67Å; M332-H336 PolarHBondContact O-CD2 3.16Å; M332-H336 VanDerWaalsContact O-CD2 3.3Å; M332-H336 PolarHBondContact O-N 3.21Å; M332-H336 VanDerWaalsContact O-N 3.1Å
333	A	91.4	Very high	88.3	Confident	42 Å²	42	54.5 Å²	54.5	35%	0.347	32%	0.318	S	S	.	.	H	α-helix	trans	-58.1	-41.8	178.7	0	0	0	0	0	111.6	G329 F330 R335 H336 T337	G329-A333 WeakPolarHBondContact O-CB 3.43Å; G329-A333 PolarHBondContact O-N 3.18Å; F330-A333 PolarHBondContact O-N 2.91Å; A333-R335 VanDerWaalsContact C-N 3.33Å; A333-R335 PolarHBondContact O-N 3.04Å; A333-H336 PolarHBondContact O-N 3.05Å; A333-T337 WeakPolarHBondContact O-CG2 2.97Å; A333-T337 PolarHBondContact O-N 3.45Å; A333-T337 VanDerWaalsContact O-N 3.09Å; A333-T337 PolarHBondContact O-OG1 3.17Å
334	Y	91.3	Very high	85.9	Confident	69 Å²	69	55 Å²	55	27%	0.271	33%	0.334	S	S	.	.	H	α-helix	trans	-56.3	-45.9	173.7	-179.1	-84.3	0	0	0	111.9	L268 F330 I331 M332 H336 T337 Q338	L268-Y334 HydrophobicContact CB-CE1 4.2Å; L268-Y334 HydrophobicContact CB-CE2 4.29Å; L268-Y334 HydrophobicContact CD1-CD1 3.59Å; L268-Y334 HydrophobicContact CD1-CD2 3.94Å; L268-Y334 HydrophobicContact CD1-CE1 3.74Å; L268-Y334 HydrophobicContact CD1-CE2 4.03Å; L268-Y334 HydrophobicContact CD1-CG 3.72Å; L268-Y334 HydrophobicContact CD2-CD1 4.02Å; L268-Y334 HydrophobicContact CD2-CE1 3.59Å; L268-Y334 HydrophobicContact CG-CD1 4.34Å; L268-Y334 HydrophobicContact CG-CE1 4.03Å; F330-Y334 PolarHBondContact O-N 3.42Å; I331-Y334 WeakPolarHBondContact O-CB 3.45Å; I331-Y334 PolarHBondContact O-N 3.31Å; M332-Y334 VanDerWaalsContact C-N 3.28Å; M332-Y334 PolarHBondContact O-N 3Å; Y334-H336 VanDerWaalsContact C-N 3.33Å; Y334-H336 PolarHBondContact O-N 3.2Å; Y334-T337 PolarHBondContact O-N 3Å; Y334-T337 VanDerWaalsContact O-N 3.15Å; Y334-T337 PolarHBondContact O-OG1 3.38Å; Y334-Q338 HydrophobicContact CD1-CB 4.44Å; Y334-Q338 HydrophobicContact CE1-CB 3.95Å; Y334-Q338 HydrophobicContact CE1-CG 4.4Å; Y334-Q338 HydrophobicContact CE2-CG 4.36Å; Y334-Q338 PolarHBondContact O-N 2.03Å
335	R	89.4	Confident	83.1	Confident	30 Å²	30	62.5 Å²	62.5	11%	0.113	37%	0.369	C	S	.	.	H	α-helix	trans	-65.3	-33.1	-179.9	-69	-60.3	-176.7	-167.5	0.8	113.6	Y198 T199 Y201 I331 M332 A333 Q338	Y198-R335 PolarHBondContact O-NE 2.9Å; T199-R335 PolarHBondContact O-NH2 3.34Å; Y201-R335 HydrophobicContact CD1-CB 4.39Å; Y201-R335 HydrophobicContact CD1-CG 4.35Å; Y201-R335 HydrophobicContact CG-CG 4.15Å; I331-R335 WeakPolarHBondContact O-CG 3.3Å; I331-R335 PolarHBondContact O-N 3.35Å; M332-R335 PolarHBondContact O-N 2.67Å; A333-R335 VanDerWaalsContact C-N 3.33Å; A333-R335 PolarHBondContact O-N 3.04Å; R335-Q338 CarbonylContact O-C 3.46Å
336	H	86.2	Confident	80.6	Confident	66 Å²	66	70.8 Å²	70.8	31%	0.306	41%	0.408	S	S	.	.	H	α-helix	trans	-69.8	-34.5	173	-79.6	-75	0	0	0	112.4	D140 M332 A333 Y334	D140-H336 IonicContact OD1-NE2 2.74Å; D140-H336 IonicContact OD2-CE1 2.65Å; D140-H336 PolarHBondContact OD2-CE1 3.39Å; D140-H336 IonicContact OD2-NE2 3.51Å; D140-H336 PolarHBondContact OD2-NE2 3.36Å; M332-H336 PolarHBondContact O-CD2 3.16Å; M332-H336 VanDerWaalsContact O-CD2 3.3Å; M332-H336 PolarHBondContact O-N 3.21Å; M332-H336 VanDerWaalsContact O-N 3.1Å; A333-H336 PolarHBondContact O-N 3.05Å; Y334-H336 VanDerWaalsContact C-N 3.33Å; Y334-H336 PolarHBondContact O-N 3.2Å
337	T	87.8	Confident	77.8	Confident	95 Å²	95	76.2 Å²	76.2	58%	0.583	45%	0.447	S	S	*	.	H	α-helix	trans	-79	-26.6	176.2	60	0	0	0	0	114.1	A333 Y334	A333-T337 WeakPolarHBondContact O-CG2 2.97Å; A333-T337 PolarHBondContact O-N 3.45Å; A333-T337 VanDerWaalsContact O-N 3.09Å; A333-T337 PolarHBondContact O-OG1 3.17Å; Y334-T337 PolarHBondContact O-N 3Å; Y334-T337 VanDerWaalsContact O-N 3.15Å; Y334-T337 PolarHBondContact O-OG1 3.38Å
338	Q	86.6	Confident	76.8	Confident	110 Å²	110	80.1 Å²	80.1	51%	0.514	47%	0.469	S	S	.	.	S	Bend	trans	-132.6	81	-175.1	-65.1	-65.2	-37.6	0	0	108.8	Y334 R335	Y334-Q338 HydrophobicContact CD1-CB 4.44Å; Y334-Q338 HydrophobicContact CE1-CB 3.95Å; Y334-Q338 HydrophobicContact CE1-CG 4.4Å; Y334-Q338 HydrophobicContact CE2-CG 4.36Å; Y334-Q338 PolarHBondContact O-N 2.03Å; R335-Q338 CarbonylContact O-C 3.46Å
339	P	80.6	Confident	75.9	Confident	99 Å²	99	84.1 Å²	84.1	64%	0.643	49%	0.492	S	S	*	.	P	Polyproline II helix	trans	-64.3	162.3	-179.8	26.3	-33.4	0	0	0	111.3
340	C	84.6	Confident	74.9	Confident	45 Å²	45	87.6 Å²	87.6	30%	0.304	51%	0.508	S	S	.	.	P	Polyproline II helix	trans	-60.2	143.4	-179.9	-60.9	0	0	0	0	111.4	Y201 C202 A342	Y201-C340 VanDerWaalsContact CD1-SG 3.59Å; C202-C340 WeakPolarHBondContact CA-SG 3.49Å; C202-C340 HydrophobicContact CB-CB 3.74Å; C202-C340 WeakPolarHBondContact CB-SG 3.34Å; C202-C340 WeakPolarHBondContact SG-CA 3.25Å; C202-C340 WeakPolarHBondContact SG-CB 3.03Å; C202-C340 CovalentContact SG-SG 2.03Å; C202-C340 PolarHBondContact SG-SG 3.31Å; C340-A342 PolarHBondContact O-N 3Å
341	P	77.8	Confident	73.7	Confident	115 Å²	115	88.9 Å²	88.9	75%	0.747	52%	0.521	S	S	*	.	P	Polyproline II helix	trans	-55.1	137.2	170.3	-16.2	27.3	0	0	0	109.1	A343	P341-A343 PolarHBondContact O-N 2.8Å
342	A	66.5	Low	72.5	Confident	94 Å²	94	94.5 Å²	94.5	78%	0.777	55%	0.554	S	S	*	*	P	Polyproline II helix	trans	-54.9	133.7	170.8	0	0	0	0	0	108.5	C340	C340-A342 PolarHBondContact O-N 3Å
343	A	56.5	Low	71.1	Confident	82 Å²	82	100.5 Å²	100.5	68%	0.678	59%	0.589	S	S	*	*	P	Polyproline II helix	trans	-53.8	136.1	173.4	0	0	0	0	0	108.3	P341 Q345	P341-A343 PolarHBondContact O-N 2.8Å; A343-Q345 PolarHBondContact O-N 3.01Å
344	P	48	Very low	69.7	Low	105 Å²	105	104.7 Å²	104.7	68%	0.682	61%	0.607	S	S	*	*	P	Polyproline II helix	trans	-55.5	120.1	173.4	12.1	-16.4	0	0	0	107.7	H346	P344-H346 PolarHBondContact O-N 2.97Å
345	Q	38	Very low	68	Low	174 Å²	174	107.5 Å²	107.5	81%	0.813	63%	0.632	S	S	*	*			trans	-61.6	107.9	168.9	-71.7	-176.4	-9.5	0	0	105.6	A343 T347	A343-Q345 PolarHBondContact O-N 3.01Å; Q345-T347 PolarHBondContact O-N 2.89Å
346	H	44.2	Very low	66.2	Low	186 Å²	186	113.9 Å²	113.9	86%	0.861	68%	0.676	S	S	*	*			trans	-66.2	91.5	165.6	-75.4	-78.7	0	0	0	106.6	P344	P344-H346 PolarHBondContact O-N 2.97Å
347	T	37.8	Very low	64.4	Low	196 Å²	196	118.3 Å²	118.3	100%	1.202	71%	0.709	S	S	*	*			trans	-77.3	0	163.8	45	0	0	0	0	110.6	Q345	Q345-T347 PolarHBondContact O-N 2.89Å

Retrieved 347 of 347 residues in 477 ms (Link to these results)

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