A0A077Z781_TRITR Loading...

Phosphodiesterase

AlphaFold DB , UniProt , Accession A0A077Z781, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 556 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	25.6	Very low	32.3	Very low	209 Å²	209	123 Å²	123	100%	1.03	58%	0.576	S	S	*	*				0	100.2	0	-163.2	175.2	-134.6	0	0	106.2	F3	M1-F3 HydrophobicContact CG-CD2 4.28Å; M1-F3 HydrophobicContact CG-CE2 3.73Å; M1-F3 HydrophobicContact CG-CZ 4.47Å; M1-F3 HydrophobicContact SD-CE2 3.68Å; M1-F3 HydrophobicContact SD-CZ 4.17Å
2	F	27	Very low	32.7	Very low	174 Å²	174	120.2 Å²	120.2	76%	0.763	57%	0.573	S	S	*	*			trans	-77.5	127.2	179.8	-70.9	-85.7	0	0	0	108.6
3	F	26.9	Very low	32.8	Very low	144 Å²	144	121.8 Å²	121.8	63%	0.632	59%	0.587	S	S	*	*			trans	-112	121.1	169.7	-84.6	-86.8	0	0	0	108.3	M1	M1-F3 HydrophobicContact CG-CD2 4.28Å; M1-F3 HydrophobicContact CG-CE2 3.73Å; M1-F3 HydrophobicContact CG-CZ 4.47Å; M1-F3 HydrophobicContact SD-CE2 3.68Å; M1-F3 HydrophobicContact SD-CZ 4.17Å
4	L	29	Very low	33	Very low	123 Å²	123	123.4 Å²	123.4	64%	0.644	59%	0.593	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-91.9	115.6	166.1	-79.4	159.7	0	0	0	107.1	L41	L4-L41 HydrophobicContact CD2-CD1 4Å; L4-L41 HydrophobicContact CD2-CD2 3.97Å; L4-L41 HydrophobicContact CD2-CG 3.97Å
5	L	29.5	Very low	33	Very low	95 Å²	95	127.5 Å²	127.5	50%	0.497	60%	0.6	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-112.3	120.7	173.7	-97.1	152.6	0	0	0	108.4	V7	L5-V7 HydrophobicContact CB-CG2 4.34Å
6	W	31.2	Very low	33.5	Very low	184 Å²	184	121.9 Å²	121.9	70%	0.697	58%	0.578	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-85.7	117.7	170.1	-147.8	49.9	0	0	0	107.4
7	V	37.9	Very low	33.9	Very low	29 Å²	29	119 Å²	119	18%	0.176	57%	0.573	C	S	.	*	E	Extended strand (participates in β ladder)	trans	-121.8	119.7	-179	-170.8	0	0	0	0	108.7	L5 A9 F18	L5-V7 HydrophobicContact CB-CG2 4.34Å; V7-A9 PolarHBondContact O-N 3.15Å; V7-F18 HydrophobicContact CB-CE1 4.32Å; V7-F18 HydrophobicContact CG1-CD1 3.99Å; V7-F18 HydrophobicContact CG1-CE1 4.18Å
8	D	34.4	Very low	34.3	Very low	106 Å²	106	115.9 Å²	115.9	57%	0.567	56%	0.557	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-75.1	105.9	175	-138.8	-0.2	0	0	0	107.8
9	A	40.2	Very low	34.4	Very low	6 Å²	6	114.3 Å²	114.3	5%	0.05	56%	0.557	C	S	.	*	E	Extended strand (participates in β ladder)	trans	-102.7	135.3	-177.8	0	0	0	0	0	110.7	V7 F18	V7-A9 PolarHBondContact O-N 3.15Å; A9-F18 HydrophobicContact CB-CE1 4.11Å; A9-F18 HydrophobicContact CB-CZ 4.46Å
10	R	35.1	Very low	34.8	Very low	212 Å²	212	118.1 Å²	118.1	80%	0.8	57%	0.573	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-90.6	129.6	168.2	-68.6	-172.5	-163.8	-153.1	4.2	109	C17	R10-C17 PolarHBondContact O-N 3.18Å
11	C	38	Very low	35.2	Very low	71 Å²	71	119.7 Å²	119.7	48%	0.48	59%	0.585	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-82.2	127.3	168.2	-66.7	0	0	0	0	109.5	R15	C11-R15 WeakPolarHBondContact CA-O 3.3Å
12	V	37.1	Very low	35.8	Very low	89 Å²	89	115 Å²	115	54%	0.539	56%	0.559	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-130.4	128.2	166.5	-177.3	0	0	0	0	106.5	E14 R15	V12-E14 PolarHBondContact O-N 3.27Å; V12-R15 PolarHBondContact N-O 3.4Å; V12-R15 VanDerWaalsContact N-O 3.17Å; V12-R15 PolarHBondContact O-N 2.89Å; V12-R15 VanDerWaalsContact O-N 3.17Å
13	D	34.3	Very low	36	Very low	141 Å²	141	112.4 Å²	112.4	75%	0.754	56%	0.562	S	S	*	*	T	Hydrogen-bonded Turn	trans	46.4	58.9	-179	-69	-21.1	0	0	0	114.6	R15	D13-R15 PolarHBondContact O-N 3.21Å
14	E	35.4	Very low	36.2	Very low	144 Å²	144	109.4 Å²	109.4	67%	0.673	57%	0.572	S	S	*	*	T	Hydrogen-bonded Turn	trans	57.9	15	176.6	-56.9	-178.9	165.6	0	0	114.7	V12 P31	V12-E14 PolarHBondContact O-N 3.27Å; E14-P31 HydrophobicContact CB-CB 4.26Å; E14-P31 HydrophobicContact CB-CG 4.41Å; E14-P31 VanDerWaalsContact O-CB 3.26Å; E14-P31 WeakPolarHBondContact O-CB 3.46Å
15	R	34.1	Very low	36.3	Very low	185 Å²	185	106 Å²	106	70%	0.698	56%	0.561	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-122.8	132.5	177.3	-75.3	-176.3	-100.1	-158.6	-5.1	110.9	C11 V12 D13 C17	C11-R15 WeakPolarHBondContact CA-O 3.3Å; V12-R15 PolarHBondContact N-O 3.4Å; V12-R15 VanDerWaalsContact N-O 3.17Å; V12-R15 PolarHBondContact O-N 2.89Å; V12-R15 VanDerWaalsContact O-N 3.17Å; D13-R15 PolarHBondContact O-N 3.21Å; R15-C17 PolarHBondContact O-N 3.23Å
16	C	40.7	Very low	36.2	Very low	38 Å²	38	110.1 Å²	110.1	26%	0.257	58%	0.583	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-71.8	114.3	167.8	-67.5	0	0	0	0	108.6	F18	C16-F18 HydrophobicContact CB-CE2 4.06Å; C16-F18 HydrophobicContact CB-CZ 4.42Å
17	C	39.8	Very low	36.5	Very low	73 Å²	73	107 Å²	107	49%	0.493	57%	0.571	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-90.8	122.8	173.4	-66.7	0	0	0	0	109.8	R10 R15	R10-C17 PolarHBondContact O-N 3.18Å; R15-C17 PolarHBondContact O-N 3.23Å
18	F	40.7	Very low	35.9	Very low	64 Å²	64	114.1 Å²	114.1	28%	0.281	60%	0.6	S	S	.	*	P	Polyproline II helix	trans	-101.3	151.5	172.6	-67.7	-78.3	0	0	0	110.7	V7 A9 C16 I42	V7-F18 HydrophobicContact CB-CE1 4.32Å; V7-F18 HydrophobicContact CG1-CD1 3.99Å; V7-F18 HydrophobicContact CG1-CE1 4.18Å; A9-F18 HydrophobicContact CB-CE1 4.11Å; A9-F18 HydrophobicContact CB-CZ 4.46Å; C16-F18 HydrophobicContact CB-CE2 4.06Å; C16-F18 HydrophobicContact CB-CZ 4.42Å; F18-I42 HydrophobicContact CD1-CD1 4.47Å; F18-I42 HydrophobicContact CE1-CD1 3.61Å; F18-I42 HydrophobicContact CZ-CD1 3.71Å
19	P	37.1	Very low	35.8	Very low	85 Å²	85	113.6 Å²	113.6	55%	0.552	60%	0.601	S	S	*	*	P	Polyproline II helix	trans	-58.8	145.5	174.6	-17.4	29.6	0	0	0	111.7	D21	P19-D21 PolarHBondContact O-N 3.32Å
20	E	42.1	Very low	35.3	Very low	189 Å²	189	119.9 Å²	119.9	88%	0.883	64%	0.638	S	S	*	*	T	Hydrogen-bonded Turn	trans	-59.7	-6.1	-168.5	-69.6	-171.3	149.3	0	0	116.4	F22	E20-F22 VanDerWaalsContact C-N 3.28Å; E20-F22 PolarHBondContact O-N 3.17Å
21	D	42.2	Very low	34.9	Very low	153 Å²	153	113.4 Å²	113.4	82%	0.818	62%	0.624	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.3	4.2	-176	-66.7	-33.8	0	0	0	115.2	P19	P19-D21 PolarHBondContact O-N 3.32Å
22	F	38.8	Very low	34.5	Very low	111 Å²	111	115.6 Å²	115.6	49%	0.487	63%	0.63	S	S	.	*			trans	-108.6	48.4	179.9	-82	-87.8	0	0	0	113.7	E20 G24	E20-F22 VanDerWaalsContact C-N 3.28Å; E20-F22 PolarHBondContact O-N 3.17Å; F22-G24 PolarHBondContact O-N 3.14Å; F22-G24 VanDerWaalsContact O-N 3.12Å
23	S	30.9	Very low	34.1	Very low	118 Å²	118	116.5 Å²	116.5	83%	0.825	64%	0.636	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.3	84.4	173.3	65.2	0	0	0	0	111.4
24	G	31.2	Very low	34	Very low	82 Å²	82	115.1 Å²	115.1	85%	0.845	63%	0.632	S	S	*	*	T	Hydrogen-bonded Turn	trans	-179	-15.3	175.1	0	0	0	0	0	118	F22	F22-G24 PolarHBondContact O-N 3.14Å; F22-G24 VanDerWaalsContact O-N 3.12Å
25	A	31.5	Very low	33.9	Very low	50 Å²	50	113.8 Å²	113.8	41%	0.413	64%	0.636	S	S	.	*			trans	-110.8	135.3	-177.6	0	0	0	0	0	111.5	W27	A25-W27 HydrophobicContact CB-CD2 4.25Å; A25-W27 HydrophobicContact CB-CH2 3.97Å; A25-W27 HydrophobicContact CB-CZ2 3.42Å; A25-W27 VanDerWaalsContact CB-CZ2 3.42Å; A25-W27 PolarHBondContact O-N 3.32Å; A25-W27 PolarHBondContact O-NE1 3.27Å; A25-W27 VanDerWaalsContact O-NE1 3.13Å
26	L	28.4	Very low	33.9	Very low	183 Å²	183	114.5 Å²	114.5	96%	0.958	64%	0.644	S	S	*	*			trans	-73.7	114.7	172.1	-102.5	128.8	0	0	0	108.8
27	W	36.2	Very low	33.7	Very low	117 Å²	117	122.7 Å²	122.7	44%	0.443	67%	0.67	S	S	.	*			trans	-108.1	129.6	177.9	-48.1	103.2	0	0	0	110.5	A25 I42	A25-W27 HydrophobicContact CB-CD2 4.25Å; A25-W27 HydrophobicContact CB-CH2 3.97Å; A25-W27 HydrophobicContact CB-CZ2 3.42Å; A25-W27 VanDerWaalsContact CB-CZ2 3.42Å; A25-W27 PolarHBondContact O-N 3.32Å; A25-W27 PolarHBondContact O-NE1 3.27Å; A25-W27 VanDerWaalsContact O-NE1 3.13Å; W27-I42 HydrophobicContact CH2-CG2 3.84Å; W27-I42 HydrophobicContact CZ3-CG2 3.76Å
28	K	26.2	Very low	33.6	Very low	180 Å²	180	121.5 Å²	121.5	78%	0.783	66%	0.662	S	S	*	*			trans	-120.2	112.4	161.4	-93.1	-175.4	176.6	178.4	0	107.7
29	T	33	Very low	33.2	Very low	95 Å²	95	122 Å²	122	58%	0.583	67%	0.674	S	S	*	*			trans	-112.2	126.2	174	49.4	0	0	0	0	109.2
30	T	27.7	Very low	33	Very low	137 Å²	137	120.1 Å²	120.1	84%	0.84	66%	0.662	S	S	*	*			trans	-87.6	118.9	166.7	-0.5	0	0	0	0	108
31	P	27.6	Very low	32.6	Very low	76 Å²	76	116 Å²	116	49%	0.494	65%	0.645	S	S	.	*			trans	-80.4	133.1	177	31.5	-28.3	0	0	0	109.3	E14	E14-P31 HydrophobicContact CB-CB 4.26Å; E14-P31 HydrophobicContact CB-CG 4.41Å; E14-P31 VanDerWaalsContact O-CB 3.26Å; E14-P31 WeakPolarHBondContact O-CB 3.46Å
32	L	29	Very low	32.3	Very low	117 Å²	117	110.2 Å²	110.2	61%	0.613	61%	0.614	S	S	*	*			trans	-127.4	135.1	161.9	-85.9	161.2	0	0	0	107.7	H138	L32-H138 WeakPolarHBondContact CB-CE1 3.32Å; L32-H138 VanDerWaalsContact CB-NE2 3.32Å; L32-H138 WeakPolarHBondContact CB-NE2 3.26Å; L32-H138 VanDerWaalsContact CD1-CE1 3.49Å; L32-H138 WeakPolarHBondContact CD1-CE1 3.46Å
33	V	28.4	Very low	31.9	Very low	109 Å²	109	107.4 Å²	107.4	66%	0.661	61%	0.606	S	S	*	*			trans	-71.9	129.6	-157.8	177.4	0	0	0	0	112.2
34	T	33.7	Very low	31.8	Very low	111 Å²	111	105.3 Å²	105.3	68%	0.681	59%	0.591	S	S	*	*			trans	-169.3	141.6	136.5	32.6	0	0	0	0	109.3
35	P	32.9	Very low	31.7	Very low	116 Å²	116	107.6 Å²	107.6	75%	0.753	58%	0.578	S	S	*	*	S	Bend	trans	-83.1	139.9	179	32.5	-30.1	0	0	0	111.2
36	K	34.8	Very low	31.4	Very low	200 Å²	200	111 Å²	111	87%	0.87	60%	0.595	S	S	*	*	S	Bend	trans	97.5	100.1	172.7	-56.8	179.8	179.1	176.9	0	115.8
37	R	35.5	Very low	31.4	Very low	210 Å²	210	107.2 Å²	107.2	79%	0.792	59%	0.591	S	S	*	*			trans	55.4	109.5	172.5	-76.5	-173.4	174.1	174.8	-2.1	117.1
38	C	37	Very low	31.1	Very low	48 Å²	48	110.3 Å²	110.3	32%	0.324	61%	0.61	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-103.6	124.4	164.4	-76.1	0	0	0	0	110.2
39	S	32.2	Very low	31.3	Very low	76 Å²	76	109.5 Å²	109.5	53%	0.531	61%	0.614	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-90.7	107.5	165.1	-54.4	0	0	0	0	108.7
40	C	34.6	Very low	31.2	Very low	45 Å²	45	114.7 Å²	114.7	30%	0.304	63%	0.629	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-99.6	126.8	177.8	-65.7	0	0	0	0	110.3
41	L	33.8	Very low	31.3	Very low	102 Å²	102	119.2 Å²	119.2	53%	0.534	63%	0.63	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-84.3	115	169.2	-160.2	78.9	0	0	0	108.7	L4	L4-L41 HydrophobicContact CD2-CD1 4Å; L4-L41 HydrophobicContact CD2-CD2 3.97Å; L4-L41 HydrophobicContact CD2-CG 3.97Å
42	I	34.7	Very low	31.5	Very low	31 Å²	31	120.7 Å²	120.7	16%	0.159	63%	0.634	C	S	.	*	E	Extended strand (participates in β ladder)	trans	-98.5	121.8	176.3	-60.9	175.5	0	0	0	108.8	F18 W27	F18-I42 HydrophobicContact CD1-CD1 4.47Å; F18-I42 HydrophobicContact CE1-CD1 3.61Å; F18-I42 HydrophobicContact CZ-CD1 3.71Å; W27-I42 HydrophobicContact CH2-CG2 3.84Å; W27-I42 HydrophobicContact CZ3-CG2 3.76Å
43	V	31.4	Very low	31.8	Very low	53 Å²	53	122.6 Å²	122.6	32%	0.321	64%	0.644	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-105.1	110.3	170.7	-175.5	0	0	0	0	107.9	F45	V43-F45 HydrophobicContact CB-CE2 4.4Å; V43-F45 HydrophobicContact CG1-CD2 4.4Å; V43-F45 HydrophobicContact CG1-CE2 3.81Å; V43-F45 HydrophobicContact CG1-CZ 4.03Å
44	C	28.6	Very low	32	Very low	74 Å²	74	120.9 Å²	120.9	50%	0.5	63%	0.631	S	S	.	*			trans	-86.9	127.9	176.8	-73	0	0	0	0	111
45	F	28.2	Very low	32.2	Very low	130 Å²	130	119.7 Å²	119.7	57%	0.57	63%	0.626	S	S	*	*			trans	-104.1	150.9	171.8	-70.6	-86.5	0	0	0	111.5	V43	V43-F45 HydrophobicContact CB-CE2 4.4Å; V43-F45 HydrophobicContact CG1-CD2 4.4Å; V43-F45 HydrophobicContact CG1-CE2 3.81Å; V43-F45 HydrophobicContact CG1-CZ 4.03Å
46	P	26.2	Very low	32.3	Very low	120 Å²	120	124.3 Å²	124.3	78%	0.779	63%	0.628	S	S	*	*			trans	-66.8	135.2	172	-6.2	22.1	0	0	0	110.2	E48	P46-E48 PolarHBondContact O-N 3.17Å
47	A	28.6	Very low	32.5	Very low	105 Å²	105	117.4 Å²	117.4	87%	0.868	60%	0.603	S	S	*	*			trans	-80.5	97.7	-176	0	0	0	0	0	112.3
48	E	29.3	Very low	32.5	Very low	181 Å²	181	111.8 Å²	111.8	85%	0.846	59%	0.588	S	S	*	*			trans	-136.6	73.3	165.5	-77.1	-172.3	165.3	0	0	111.6	P46	P46-E48 PolarHBondContact O-N 3.17Å
49	N	29.6	Very low	32.6	Very low	164 Å²	164	113.6 Å²	113.6	88%	0.877	59%	0.594	S	S	*	*			trans	173.6	112.3	135.4	-103.4	-40.5	0	0	0	111.5	R51	N49-R51 PolarHBondContact O-N 3.42Å
50	K	31.1	Very low	32.9	Very low	204 Å²	204	113.1 Å²	113.1	89%	0.887	59%	0.591	S	S	*	*			trans	-84.1	92.9	170.4	-72.4	179	177.5	177.6	0	108.9
51	R	30.2	Very low	32.8	Very low	231 Å²	231	113.2 Å²	113.2	87%	0.872	59%	0.592	S	S	*	*			trans	172.5	106.1	158.2	-98.6	165.4	-144.6	-140.8	8.4	107.5	N49	N49-R51 PolarHBondContact O-N 3.42Å
52	L	32.4	Very low	32.9	Very low	108 Å²	108	109.7 Å²	109.7	57%	0.565	58%	0.577	S	S	*	*			trans	166.9	103.1	149.8	-89.5	150.7	0	0	0	108.8	V57	L52-V57 HydrophobicContact CD2-CB 4.16Å; L52-V57 HydrophobicContact CD2-CG1 3.56Å
53	N	33.8	Very low	33.1	Very low	156 Å²	156	113 Å²	113	83%	0.834	59%	0.594	S	S	*	*			trans	-97.1	8.9	-173.8	-95.9	-14.9	0	0	0	114.3
54	D	34.5	Very low	33.3	Very low	73 Å²	73	117.1 Å²	117.1	39%	0.39	61%	0.614	S	S	.	*			trans	-118	117.1	-175.2	-167.7	-21.6	0	0	0	112.5	R56 V57	D54-R56 PolarHBondContact O-N 3.15Å; D54-R56 WeakPolarHBondContact OD1-CB 3.07Å; D54-R56 PolarHBondContact OD1-N 2.91Å; D54-V57 HydrophobicContact CB-CB 4.39Å; D54-V57 HydrophobicContact CB-CG2 3.9Å; D54-V57 PolarHBondContact O-N 3.19Å
55	P	36.3	Very low	33.4	Very low	86 Å²	86	119.7 Å²	119.7	56%	0.558	62%	0.619	S	S	*	*	H	α-helix	trans	-63.7	-19.6	178.5	24.9	-32	0	0	0	114.2
56	R	35.5	Very low	33.6	Very low	213 Å²	213	117.7 Å²	117.7	80%	0.804	64%	0.635	S	S	*	*	H	α-helix	trans	-76.2	-26.2	176.7	-62.5	178.7	-174.3	177.9	1.6	112.8	D54	D54-R56 PolarHBondContact O-N 3.15Å; D54-R56 WeakPolarHBondContact OD1-CB 3.07Å; D54-R56 PolarHBondContact OD1-N 2.91Å
57	V	39.2	Very low	33.9	Very low	56 Å²	56	119.8 Å²	119.8	34%	0.339	63%	0.634	S	S	.	*	H	α-helix	trans	-84.4	-28.2	-178.7	-177.7	0	0	0	0	111.6	L52 D54 S61	L52-V57 HydrophobicContact CD2-CB 4.16Å; L52-V57 HydrophobicContact CD2-CG1 3.56Å; D54-V57 HydrophobicContact CB-CB 4.39Å; D54-V57 HydrophobicContact CB-CG2 3.9Å; D54-V57 PolarHBondContact O-N 3.19Å; V57-S61 WeakPolarHBondContact O-CB 3.34Å; V57-S61 PolarHBondContact O-N 2.99Å
58	L	36.3	Very low	34.7	Very low	91 Å²	91	122.3 Å²	122.3	48%	0.476	63%	0.633	S	S	.	*	H	α-helix	trans	-66.3	-37.5	179	-81.2	162.9	0	0	0	112.9	A62	L58-A62 VanDerWaalsContact O-CB 3.24Å; L58-A62 WeakPolarHBondContact O-CB 3.43Å; L58-A62 PolarHBondContact O-N 3.44Å; L58-A62 VanDerWaalsContact O-N 3.13Å
59	L	39.1	Very low	35.6	Very low	87 Å²	87	118.8 Å²	118.8	46%	0.455	62%	0.619	S	S	.	*	H	α-helix	trans	-73.7	-38.5	-179.7	-117.2	90.3	0	0	0	113.2	A79	L59-A79 HydrophobicContact CD2-CB 4.11Å
60	S	36.9	Very low	36.7	Very low	66 Å²	66	114.9 Å²	114.9	46%	0.462	60%	0.598	S	S	.	*	H	α-helix	trans	-76.4	-34.5	179.2	74.4	0	0	0	0	112.2	L63	S60-L63 PolarHBondContact O-N 3.28Å
61	S	33.4	Very low	38.2	Very low	47 Å²	47	107.2 Å²	107.2	33%	0.329	57%	0.568	S	S	.	*	H	α-helix	trans	-65.5	-37.6	172.7	-176.7	0	0	0	0	112.3	V57 L63 L64 H65	V57-S61 WeakPolarHBondContact O-CB 3.34Å; V57-S61 PolarHBondContact O-N 2.99Å; S61-L63 VanDerWaalsContact C-N 3.27Å; S61-L63 PolarHBondContact O-N 3.46Å; S61-L64 PolarHBondContact O-N 3.35Å; S61-H65 PolarHBondContact O-N 3.44Å
62	A	35.5	Very low	40.1	Very low	27 Å²	27	98.6 Å²	98.6	22%	0.223	54%	0.541	C	S	.	.	H	α-helix	trans	-68.3	-22.9	179.9	0	0	0	0	0	113.8	L58 L69	L58-A62 VanDerWaalsContact O-CB 3.24Å; L58-A62 WeakPolarHBondContact O-CB 3.43Å; L58-A62 PolarHBondContact O-N 3.44Å; L58-A62 VanDerWaalsContact O-N 3.13Å; A62-L69 HydrophobicContact CB-CD1 3.73Å
63	L	38.2	Very low	42.1	Very low	100 Å²	100	94.5 Å²	94.5	52%	0.524	52%	0.521	S	S	.	.	H	α-helix	trans	-84.4	-18.7	175.9	-75.3	160	0	0	0	112.9	S60 S61	S60-L63 PolarHBondContact O-N 3.28Å; S61-L63 VanDerWaalsContact C-N 3.27Å; S61-L63 PolarHBondContact O-N 3.46Å
64	L	35.6	Very low	44	Very low	141 Å²	141	88 Å²	88	74%	0.738	49%	0.485	S	S	*	.	H	α-helix	trans	-100.3	-19.2	-177	-90.5	153.5	0	0	0	113.6	S61	S61-L64 PolarHBondContact O-N 3.35Å
65	H	32	Very low	46	Very low	128 Å²	128	86 Å²	86	59%	0.593	48%	0.479	S	S	*	.	S	Bend	trans	-122.2	116.3	178.7	-72.2	1.6	0	0	0	108.7	S61 E67	S61-H65 PolarHBondContact O-N 3.44Å; H65-E67 PolarHBondContact O-N 3.25Å
66	G	32.7	Very low	48	Very low	88 Å²	88	86.2 Å²	86.2	91%	0.907	47%	0.472	S	S	*	.			trans	-69.6	43.5	-176.4	0	0	0	0	0	115.1
67	E	32.8	Very low	50.2	Low	163 Å²	163	79.6 Å²	79.6	76%	0.762	46%	0.455	S	S	*	.			trans	-93.5	122.7	165.7	-69.4	-172.6	163.6	0	0	108.4	H65 L69	H65-E67 PolarHBondContact O-N 3.25Å; E67-L69 VanDerWaalsContact C-N 3.26Å; E67-L69 PolarHBondContact O-N 3.06Å
68	D	44	Very low	52.1	Low	158 Å²	158	77.3 Å²	77.3	85%	0.845	44%	0.441	S	S	*	.			trans	-63.2	72.2	-172	-72	-46.3	0	0	0	113.6	I70	D68-I70 PolarHBondContact O-N 3.42Å
69	L	48	Very low	54.2	Low	108 Å²	108	73.5 Å²	73.5	57%	0.565	42%	0.423	S	S	*	.			trans	-67.8	120	163.9	-91.3	143.3	0	0	0	108.4	A62 E67 V71	A62-L69 HydrophobicContact CB-CD1 3.73Å; E67-L69 VanDerWaalsContact C-N 3.26Å; E67-L69 PolarHBondContact O-N 3.06Å; L69-V71 VanDerWaalsContact C-N 3.29Å; L69-V71 HydrophobicContact CB-CG2 4.33Å; L69-V71 PolarHBondContact O-N 2.89Å
70	I	52.3	Low	56.4	Low	82 Å²	82	72.7 Å²	72.7	42%	0.421	42%	0.422	S	S	.	.			trans	-69.9	90.3	176	-59	166.4	0	0	0	108.6	D68 F149	D68-I70 PolarHBondContact O-N 3.42Å; I70-F149 HydrophobicContact CD1-CE1 4.16Å; I70-F149 HydrophobicContact CG2-CE1 3.54Å; I70-F149 HydrophobicContact CG2-CE2 4.27Å; I70-F149 HydrophobicContact CG2-CZ 3.3Å
71	V	64.5	Low	58.7	Low	43 Å²	43	72 Å²	72	26%	0.261	41%	0.412	S	S	.	.			trans	-93	135.1	173.3	-175.5	0	0	0	0	109	L69 A75 Q76 K148	L69-V71 VanDerWaalsContact C-N 3.29Å; L69-V71 HydrophobicContact CB-CG2 4.33Å; L69-V71 PolarHBondContact O-N 2.89Å; V71-A75 HydrophobicContact CG1-CB 3.9Å; V71-Q76 HydrophobicContact CG1-CB 4.34Å; V71-K148 PolarHBondContact O-NZ 3.47Å
72	T	70	Confident	61.1	Low	50 Å²	50	75 Å²	75	31%	0.307	42%	0.416	S	S	.	.			trans	-58.6	138.6	175.1	66.3	0	0	0	0	109.3	F74 A75 Q76 T145	T72-F74 PolarHBondContact O-N 3.31Å; T72-A75 PolarHBondContact O-N 2.91Å; T72-A75 VanDerWaalsContact O-N 3.11Å; T72-A75 WeakPolarHBondContact OG1-CB 3.41Å; T72-A75 PolarHBondContact OG1-N 3.01Å; T72-Q76 PolarHBondContact O-N 3.4Å; T72-T145 WeakPolarHBondContact CB-OG1 3.31Å; T72-T145 HydrophobicContact CG2-CG2 3.88Å; T72-T145 WeakPolarHBondContact CG2-OG1 3.48Å
73	P	74.6	Confident	63.5	Low	22 Å²	22	77.1 Å²	77.1	14%	0.143	42%	0.424	C	S	.	.	H	α-helix	trans	-56.6	-37	-178	15.4	-23.2	0	0	0	111.9	Q76 V77 M144 K148	P73-Q76 WeakPolarHBondContact O-CB 3.48Å; P73-Q76 PolarHBondContact O-N 3.16Å; P73-V77 WeakPolarHBondContact O-CG2 3.37Å; P73-V77 PolarHBondContact O-N 3.01Å; P73-M144 HydrophobicContact CB-CG 4.32Å; P73-M144 HydrophobicContact CB-SD 4.07Å; P73-M144 HydrophobicContact CG-CB 4.26Å; P73-M144 HydrophobicContact CG-CG 3.81Å; P73-M144 WeakPolarHBondContact CG-O 3.24Å; P73-M144 HydrophobicContact CG-SD 4.07Å; P73-K148 HydrophobicContact CB-CD 4.01Å; P73-K148 HydrophobicContact CG-CB 4.03Å; P73-K148 HydrophobicContact CG-CD 3.81Å
74	F	73.4	Confident	65.8	Low	19 Å²	19	75.4 Å²	75.4	8%	0.083	42%	0.417	C	S	.	.	H	α-helix	trans	-62.6	-46.2	176	-171.7	-106.6	0	0	0	113.2	T72 Q76 V77 L78 L132 Q136 V141 M144	T72-F74 PolarHBondContact O-N 3.31Å; F74-Q76 VanDerWaalsContact C-N 3.27Å; F74-Q76 PolarHBondContact O-N 3.09Å; F74-V77 PolarHBondContact O-N 2.86Å; F74-L78 HydrophobicContact CD1-CD1 3.86Å; F74-L78 HydrophobicContact CD1-CG 4.38Å; F74-L78 HydrophobicContact CE1-CD1 3.28Å; F74-L78 HydrophobicContact CE1-CG 3.94Å; F74-L78 HydrophobicContact CZ-CD1 3.77Å; F74-L78 HydrophobicContact CZ-CD2 4.33Å; F74-L78 HydrophobicContact CZ-CG 4.01Å; F74-L78 PolarHBondContact O-N 3.48Å; F74-L132 HydrophobicContact CZ-CB 4.48Å; F74-L132 VanDerWaalsContact CZ-O 3.31Å; F74-L132 WeakPolarHBondContact CZ-O 3.36Å; F74-Q136 HydrophobicContact CE1-CG 3.75Å; F74-Q136 HydrophobicContact CZ-CG 4.33Å; F74-V141 HydrophobicContact CB-CG1 3.98Å; F74-V141 HydrophobicContact CD1-CG1 4.14Å; F74-V141 HydrophobicContact CD1-CG2 3.82Å; F74-V141 HydrophobicContact CE1-CG2 4.15Å; F74-V141 HydrophobicContact CG-CG1 4.27Å; F74-V141 HydrophobicContact CG-CG2 4.02Å; F74-M144 HydrophobicContact CB-CE 4.43Å; F74-M144 HydrophobicContact CB-SD 4.12Å; F74-M144 HydrophobicContact CD2-CE 4.03Å
75	A	75.1	Confident	68.3	Low	31 Å²	31	72.2 Å²	72.2	26%	0.256	40%	0.396	S	S	.	.	H	α-helix	trans	-63.8	-35	176.4	0	0	0	0	0	112	V71 T72 A79	V71-A75 HydrophobicContact CG1-CB 3.9Å; T72-A75 PolarHBondContact O-N 2.91Å; T72-A75 VanDerWaalsContact O-N 3.11Å; T72-A75 WeakPolarHBondContact OG1-CB 3.41Å; T72-A75 PolarHBondContact OG1-N 3.01Å; A75-A79 VanDerWaalsContact O-CB 3.29Å; A75-A79 WeakPolarHBondContact O-CB 3.39Å; A75-A79 PolarHBondContact O-N 2.81Å
76	Q	79.1	Confident	70.8	Confident	90 Å²	90	71.3 Å²	71.3	42%	0.421	39%	0.392	S	S	.	.	H	α-helix	trans	-66	-42.6	175.1	-171.5	176.5	-2.9	0	0	112.1	V71 T72 P73 F74 T80	V71-Q76 HydrophobicContact CG1-CB 4.34Å; T72-Q76 PolarHBondContact O-N 3.4Å; P73-Q76 WeakPolarHBondContact O-CB 3.48Å; P73-Q76 PolarHBondContact O-N 3.16Å; F74-Q76 VanDerWaalsContact C-N 3.27Å; F74-Q76 PolarHBondContact O-N 3.09Å; Q76-T80 WeakPolarHBondContact O-CB 3.45Å; Q76-T80 PolarHBondContact O-N 2.88Å; Q76-T80 PolarHBondContact O-OG1 3.16Å
77	V	81	Confident	73.2	Confident	74 Å²	74	71.9 Å²	71.9	45%	0.448	37%	0.374	S	S	.	.	H	α-helix	trans	-62.9	-49.1	173.7	171.3	0	0	0	0	110.7	P73 F74 A79 T80 L81	P73-V77 WeakPolarHBondContact O-CG2 3.37Å; P73-V77 PolarHBondContact O-N 3.01Å; F74-V77 PolarHBondContact O-N 2.86Å; V77-A79 PolarHBondContact O-N 2.9Å; V77-T80 PolarHBondContact O-N 2.89Å; V77-T80 VanDerWaalsContact O-N 3.15Å; V77-L81 HydrophobicContact CG1-CD1 3.82Å; V77-L81 HydrophobicContact CG1-CG 4.29Å; V77-L81 WeakPolarHBondContact O-CG 3.45Å; V77-L81 PolarHBondContact O-N 3.05Å
78	L	80.4	Confident	75.5	Confident	9 Å²	9	66.2 Å²	66.2	5%	0.047	35%	0.348	C	S	.	.	H	α-helix	trans	-59	-44.5	177.3	-78.1	179.8	0	0	0	112.3	F74 T80 L81 R82 L129 L132 E133	F74-L78 HydrophobicContact CD1-CD1 3.86Å; F74-L78 HydrophobicContact CD1-CG 4.38Å; F74-L78 HydrophobicContact CE1-CD1 3.28Å; F74-L78 HydrophobicContact CE1-CG 3.94Å; F74-L78 HydrophobicContact CZ-CD1 3.77Å; F74-L78 HydrophobicContact CZ-CD2 4.33Å; F74-L78 HydrophobicContact CZ-CG 4.01Å; F74-L78 PolarHBondContact O-N 3.48Å; L78-T80 VanDerWaalsContact C-N 3.3Å; L78-T80 PolarHBondContact O-N 3.27Å; L78-L81 PolarHBondContact O-N 3Å; L78-R82 WeakPolarHBondContact O-CB 3.21Å; L78-R82 VanDerWaalsContact O-CG 3.29Å; L78-R82 WeakPolarHBondContact O-CG 3.22Å; L78-R82 PolarHBondContact O-N 3.49Å; L78-L129 HydrophobicContact CD2-CD2 4.31Å; L78-L132 HydrophobicContact CD2-CB 4.01Å; L78-E133 HydrophobicContact CD1-CG 4.19Å; L78-E133 HydrophobicContact CD2-CG 4.18Å
79	A	80.4	Confident	77.2	Confident	11 Å²	11	62.5 Å²	62.5	9%	0.091	33%	0.327	C	S	.	.	H	α-helix	trans	-62.4	-39.5	176.9	0	0	0	0	0	111.8	L59 A75 V77 N83	L59-A79 HydrophobicContact CD2-CB 4.11Å; A75-A79 VanDerWaalsContact O-CB 3.29Å; A75-A79 WeakPolarHBondContact O-CB 3.39Å; A75-A79 PolarHBondContact O-N 2.81Å; V77-A79 PolarHBondContact O-N 2.9Å; A79-N83 VanDerWaalsContact O-CG 3.23Å; A79-N83 PolarHBondContact O-N 2.93Å; A79-N83 PolarHBondContact O-ND2 3.46Å
80	T	84.6	Confident	78.7	Confident	70 Å²	70	62.4 Å²	62.4	43%	0.429	33%	0.327	S	S	.	.	H	α-helix	trans	-66.7	-45.5	177.4	-55.9	0	0	0	0	111.2	Q76 V77 L78 R82 N83 V84	Q76-T80 WeakPolarHBondContact O-CB 3.45Å; Q76-T80 PolarHBondContact O-N 2.88Å; Q76-T80 PolarHBondContact O-OG1 3.16Å; V77-T80 PolarHBondContact O-N 2.89Å; V77-T80 VanDerWaalsContact O-N 3.15Å; L78-T80 VanDerWaalsContact C-N 3.3Å; L78-T80 PolarHBondContact O-N 3.27Å; T80-R82 PolarHBondContact O-N 2.75Å; T80-N83 WeakPolarHBondContact O-CB 3.32Å; T80-N83 PolarHBondContact O-N 3.07Å; T80-V84 WeakPolarHBondContact O-CG2 3.46Å; T80-V84 PolarHBondContact O-N 2.84Å
81	L	85.7	Confident	79.8	Confident	51 Å²	51	63.2 Å²	63.2	27%	0.267	34%	0.336	S	S	.	.	H	α-helix	trans	-65.5	-38.3	178.2	-69.7	172.5	0	0	0	112.1	V77 L78 V84 R85 L129 L132	V77-L81 HydrophobicContact CG1-CD1 3.82Å; V77-L81 HydrophobicContact CG1-CG 4.29Å; V77-L81 WeakPolarHBondContact O-CG 3.45Å; V77-L81 PolarHBondContact O-N 3.05Å; L78-L81 PolarHBondContact O-N 3Å; L81-V84 WeakPolarHBondContact O-CB 3.44Å; L81-V84 PolarHBondContact O-N 2.93Å; L81-R85 WeakPolarHBondContact O-CB 3.31Å; L81-R85 PolarHBondContact O-N 3.19Å; L81-L129 HydrophobicContact CB-CD2 3.68Å; L81-L129 HydrophobicContact CD1-CD2 4.31Å; L81-L132 HydrophobicContact CD1-CD1 3.71Å
82	R	83.6	Confident	79.8	Confident	110 Å²	110	63.5 Å²	63.5	42%	0.415	34%	0.34	S	S	.	.	H	α-helix	trans	-62.2	-41.8	172.4	-73.6	172.6	178.6	168	-6.9	111.9	L78 T80 V84 R85 E86 L129 E133	L78-R82 WeakPolarHBondContact O-CB 3.21Å; L78-R82 VanDerWaalsContact O-CG 3.29Å; L78-R82 WeakPolarHBondContact O-CG 3.22Å; L78-R82 PolarHBondContact O-N 3.49Å; T80-R82 PolarHBondContact O-N 2.75Å; R82-V84 PolarHBondContact O-N 3.2Å; R82-R85 WeakPolarHBondContact O-CB 3.5Å; R82-R85 PolarHBondContact O-N 2.86Å; R82-E86 PolarHBondContact O-N 2.96Å; R82-L129 HydrophobicContact CG-CD2 4.45Å; R82-E133 IonicContact CZ-OE1 2.85Å; R82-E133 IonicContact NE-OE1 2.79Å; R82-E133 PolarHBondContact NE-OE1 3.1Å; R82-E133 IonicContact NH2-OE1 3.54Å; R82-E133 PolarHBondContact NH2-OE1 2.9Å; R82-E133 IonicContact NH2-OE2 3.58Å; R82-E133 PolarHBondContact NH2-OE2 3.18Å
83	N	85.9	Confident	79.3	Confident	71 Å²	71	66.1 Å²	66.1	38%	0.38	35%	0.351	S	S	.	.	H	α-helix	trans	-63.7	-40	173.9	-71.2	-17.2	0	0	0	111.9	A79 T80 R85 E86 N87	A79-N83 VanDerWaalsContact O-CG 3.23Å; A79-N83 PolarHBondContact O-N 2.93Å; A79-N83 PolarHBondContact O-ND2 3.46Å; T80-N83 WeakPolarHBondContact O-CB 3.32Å; T80-N83 PolarHBondContact O-N 3.07Å; N83-R85 VanDerWaalsContact C-N 3.34Å; N83-E86 PolarHBondContact O-N 3.24Å; N83-N87 WeakPolarHBondContact O-CB 3.49Å; N83-N87 VanDerWaalsContact O-CG 3.25Å; N83-N87 PolarHBondContact O-N 3.07Å; N83-N87 PolarHBondContact O-ND2 3.44Å; N83-N87 VanDerWaalsContact O-ND2 3.08Å
84	V	86.5	Confident	78.1	Confident	64 Å²	64	66.9 Å²	66.9	39%	0.388	36%	0.362	S	S	.	.	H	α-helix	trans	-60.5	-45.5	174.1	170.1	0	0	0	0	110.4	T80 L81 R82 N87 I88	T80-V84 WeakPolarHBondContact O-CG2 3.46Å; T80-V84 PolarHBondContact O-N 2.84Å; L81-V84 WeakPolarHBondContact O-CB 3.44Å; L81-V84 PolarHBondContact O-N 2.93Å; R82-V84 PolarHBondContact O-N 3.2Å; V84-N87 WeakPolarHBondContact O-CB 3.44Å; V84-N87 PolarHBondContact O-N 3.43Å; V84-I88 HydrophobicContact CG1-CD1 3.82Å; V84-I88 HydrophobicContact CG1-CG1 4.42Å; V84-I88 VanDerWaalsContact O-CG1 3.31Å; V84-I88 WeakPolarHBondContact O-CG1 3.15Å; V84-I88 PolarHBondContact O-N 2.7Å
85	R	87.4	Confident	76.8	Confident	74 Å²	74	68.6 Å²	68.6	28%	0.279	38%	0.377	S	S	.	.	H	α-helix	trans	-60	-46.2	176.4	-174.8	-117.2	-174.7	-133.4	-5.1	112.5	L81 R82 N83 N87 I88 M89 L122 L125 D126 L129	L81-R85 WeakPolarHBondContact O-CB 3.31Å; L81-R85 PolarHBondContact O-N 3.19Å; R82-R85 WeakPolarHBondContact O-CB 3.5Å; R82-R85 PolarHBondContact O-N 2.86Å; N83-R85 VanDerWaalsContact C-N 3.34Å; R85-N87 VanDerWaalsContact C-N 3.32Å; R85-N87 PolarHBondContact O-N 2.66Å; R85-I88 PolarHBondContact O-N 2.98Å; R85-M89 WeakPolarHBondContact O-CB 3.42Å; R85-M89 PolarHBondContact O-N 2.8Å; R85-L122 HydrophobicContact CG-CD2 4.15Å; R85-L125 HydrophobicContact CB-CD2 3.69Å; R85-L125 HydrophobicContact CB-CG 4.44Å; R85-L125 HydrophobicContact CG-CD2 4Å; R85-D126 IonicContact CZ-OD1 3.44Å; R85-D126 IonicContact CZ-OD2 3.7Å; R85-D126 IonicContact NE-OD1 2.69Å; R85-D126 PolarHBondContact NE-OD1 3.2Å; R85-D126 IonicContact NE-OD2 3.67Å; R85-D126 IonicContact NH2-OD1 3.31Å; R85-D126 PolarHBondContact NH2-OD1 3.36Å; R85-D126 IonicContact NH2-OD2 2.83Å; R85-D126 PolarHBondContact NH2-OD2 2.73Å; R85-L129 HydrophobicContact CB-CD1 4.23Å; R85-L129 HydrophobicContact CG-CD1 4.28Å
86	E	84.2	Confident	75.4	Confident	110 Å²	110	69.4 Å²	69.4	51%	0.514	39%	0.389	S	S	.	.	H	α-helix	trans	-60.8	-40.6	174.5	-74.4	-173.1	173.1	0	0	112.1	R82 N83 M89 N90	R82-E86 PolarHBondContact O-N 2.96Å; N83-E86 PolarHBondContact O-N 3.24Å; E86-M89 PolarHBondContact O-N 2.99Å; E86-N90 WeakPolarHBondContact O-CB 3.49Å; E86-N90 VanDerWaalsContact O-CG 3.24Å; E86-N90 PolarHBondContact O-N 3.49Å; E86-N90 PolarHBondContact O-ND2 3.29Å; E86-N90 VanDerWaalsContact O-ND2 3.14Å
87	N	84.2	Confident	73.7	Confident	99 Å²	99	76 Å²	76	53%	0.529	41%	0.409	S	S	.	.	H	α-helix	trans	-65	-44.6	176.8	-74.1	-35.6	0	0	0	111.9	N83 V84 R85 M89 N90 T91	N83-N87 WeakPolarHBondContact O-CB 3.49Å; N83-N87 VanDerWaalsContact O-CG 3.25Å; N83-N87 PolarHBondContact O-N 3.07Å; N83-N87 PolarHBondContact O-ND2 3.44Å; N83-N87 VanDerWaalsContact O-ND2 3.08Å; V84-N87 WeakPolarHBondContact O-CB 3.44Å; V84-N87 PolarHBondContact O-N 3.43Å; R85-N87 VanDerWaalsContact C-N 3.32Å; R85-N87 PolarHBondContact O-N 2.66Å; N87-M89 VanDerWaalsContact C-N 3.32Å; N87-M89 PolarHBondContact O-N 3.17Å; N87-N90 PolarHBondContact O-N 3.26Å; N87-T91 WeakPolarHBondContact O-CG2 3.39Å; N87-T91 PolarHBondContact O-N 2.99Å; N87-T91 PolarHBondContact O-OG1 3.44Å
88	I	80.8	Confident	71.9	Confident	44 Å²	44	75.7 Å²	75.7	23%	0.226	42%	0.415	C	S	.	.	H	α-helix	trans	-59.5	-45.1	175.5	-67	166.5	0	0	0	110.2	V84 R85 N90 T91 S92 L122 L125	V84-I88 HydrophobicContact CG1-CD1 3.82Å; V84-I88 HydrophobicContact CG1-CG1 4.42Å; V84-I88 VanDerWaalsContact O-CG1 3.31Å; V84-I88 WeakPolarHBondContact O-CG1 3.15Å; V84-I88 PolarHBondContact O-N 2.7Å; R85-I88 PolarHBondContact O-N 2.98Å; I88-N90 VanDerWaalsContact C-N 3.33Å; I88-N90 PolarHBondContact O-N 3.38Å; I88-T91 WeakPolarHBondContact CA-OG1 3.3Å; I88-T91 PolarHBondContact O-N 2.82Å; I88-T91 PolarHBondContact O-OG1 3.37Å; I88-S92 VanDerWaalsContact O-CB 3.26Å; I88-S92 WeakPolarHBondContact O-CB 3.36Å; I88-S92 PolarHBondContact O-N 2.98Å; I88-S92 PolarHBondContact O-OG 3.38Å; I88-S92 VanDerWaalsContact O-OG 3.08Å; I88-L122 HydrophobicContact CB-CD2 4.12Å; I88-L122 HydrophobicContact CG2-CD1 4.22Å; I88-L122 HydrophobicContact CG2-CD2 3.71Å; I88-L122 HydrophobicContact CG2-CG 3.78Å; I88-L125 HydrophobicContact CD1-CD2 3.92Å
89	M	80.3	Confident	70.1	Confident	80 Å²	80	78 Å²	78	39%	0.394	43%	0.427	S	S	.	.	H	α-helix	trans	-60.1	-43.2	176.9	-165.1	-177.9	179.3	0	0	111.5	R85 E86 N87 I93	R85-M89 WeakPolarHBondContact O-CB 3.42Å; R85-M89 PolarHBondContact O-N 2.8Å; E86-M89 PolarHBondContact O-N 2.99Å; N87-M89 VanDerWaalsContact C-N 3.32Å; N87-M89 PolarHBondContact O-N 3.17Å; M89-I93 HydrophobicContact CE-CD1 4.07Å; M89-I93 HydrophobicContact CG-CD1 3.63Å; M89-I93 HydrophobicContact CG-CG1 4.32Å; M89-I93 VanDerWaalsContact O-CB 3.23Å; M89-I93 WeakPolarHBondContact O-CB 3.43Å; M89-I93 WeakPolarHBondContact O-CG1 3.47Å; M89-I93 PolarHBondContact O-N 3.4Å
90	N	79	Confident	68.3	Low	106 Å²	106	87.3 Å²	87.3	57%	0.567	46%	0.46	S	S	*	.	H	α-helix	trans	-68.8	-36.8	178.6	-73.6	-32.7	0	0	0	113	E86 N87 I88 G94	E86-N90 WeakPolarHBondContact O-CB 3.49Å; E86-N90 VanDerWaalsContact O-CG 3.24Å; E86-N90 PolarHBondContact O-N 3.49Å; E86-N90 PolarHBondContact O-ND2 3.29Å; E86-N90 VanDerWaalsContact O-ND2 3.14Å; N87-N90 PolarHBondContact O-N 3.26Å; I88-N90 VanDerWaalsContact C-N 3.33Å; I88-N90 PolarHBondContact O-N 3.38Å; N90-G94 WeakPolarHBondContact O-CA 3.34Å; N90-G94 PolarHBondContact O-N 2.98Å; N90-G94 VanDerWaalsContact O-N 3.09Å
91	T	74.2	Confident	66.3	Low	99 Å²	99	94.9 Å²	94.9	61%	0.607	48%	0.481	S	S	*	.	H	α-helix	trans	-74.9	-38.5	177.9	48.8	0	0	0	0	112.6	N87 I88	N87-T91 WeakPolarHBondContact O-CG2 3.39Å; N87-T91 PolarHBondContact O-N 2.99Å; N87-T91 PolarHBondContact O-OG1 3.44Å; I88-T91 WeakPolarHBondContact CA-OG1 3.3Å; I88-T91 PolarHBondContact O-N 2.82Å; I88-T91 PolarHBondContact O-OG1 3.37Å
92	S	66.4	Low	64.2	Low	50 Å²	50	101.6 Å²	101.6	35%	0.35	50%	0.502	S	S	.	.	H	α-helix	trans	-87.4	-35.2	-173.9	-58.5	0	0	0	0	112.9	I88	I88-S92 VanDerWaalsContact O-CB 3.26Å; I88-S92 WeakPolarHBondContact O-CB 3.36Å; I88-S92 PolarHBondContact O-N 2.98Å; I88-S92 PolarHBondContact O-OG 3.38Å; I88-S92 VanDerWaalsContact O-OG 3.08Å
93	I	57.8	Low	62.2	Low	105 Å²	105	100.3 Å²	100.3	54%	0.538	51%	0.507	S	S	.	.	H	α-helix	trans	-101.6	-32.3	-177.4	-48.5	-177.3	0	0	0	111.4	M89 G96	M89-I93 HydrophobicContact CE-CD1 4.07Å; M89-I93 HydrophobicContact CG-CD1 3.63Å; M89-I93 HydrophobicContact CG-CG1 4.32Å; M89-I93 VanDerWaalsContact O-CB 3.23Å; M89-I93 WeakPolarHBondContact O-CB 3.43Å; M89-I93 WeakPolarHBondContact O-CG1 3.47Å; M89-I93 PolarHBondContact O-N 3.4Å; I93-G96 PolarHBondContact O-N 3.41Å
94	G	50.1	Low	60.2	Low	37 Å²	37	101.8 Å²	101.8	38%	0.381	53%	0.529	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.3	-23.3	-179	0	0	0	0	0	114.8	N90 G96 R97 A98	N90-G94 WeakPolarHBondContact O-CA 3.34Å; N90-G94 PolarHBondContact O-N 2.98Å; N90-G94 VanDerWaalsContact O-N 3.09Å; G94-G96 PolarHBondContact O-N 3.46Å; G94-R97 PolarHBondContact O-N 2.81Å; G94-A98 PolarHBondContact O-N 3.41Å
95	S	46.4	Very low	58.2	Low	55 Å²	55	102.7 Å²	102.7	39%	0.385	54%	0.543	S	S	.	.	H	α-helix	trans	-63.2	-27.9	173.8	-163.6	0	0	0	0	111.5	R97 A98 L99	S95-R97 PolarHBondContact O-N 2.89Å; S95-R97 VanDerWaalsContact O-N 3.16Å; S95-A98 PolarHBondContact O-N 2.94Å; S95-L99 WeakPolarHBondContact O-CA 3.37Å; S95-L99 WeakPolarHBondContact O-CB 3.21Å; S95-L99 PolarHBondContact O-N 2.96Å
96	G	45	Very low	55.9	Low	49 Å²	49	103.5 Å²	103.5	51%	0.505	58%	0.575	S	S	.	*	H	α-helix	trans	-62.4	-24.2	177	0	0	0	0	0	115.1	I93 G94 R100	I93-G96 PolarHBondContact O-N 3.41Å; G94-G96 PolarHBondContact O-N 3.46Å; G96-R100 WeakPolarHBondContact O-CB 3.48Å
97	R	43.3	Very low	53.7	Low	227 Å²	227	101 Å²	101	86%	0.857	58%	0.578	S	S	*	*	H	α-helix	trans	-96.8	-32	177.6	-86.4	-179.3	170	174.8	-1.8	113.6	G94 S95	G94-R97 PolarHBondContact O-N 2.81Å; S95-R97 PolarHBondContact O-N 2.89Å; S95-R97 VanDerWaalsContact O-N 3.16Å
98	A	43.7	Very low	51.9	Low	69 Å²	69	101.8 Å²	101.8	57%	0.57	59%	0.591	S	S	*	*	H	α-helix	trans	-82.1	-33.4	176	0	0	0	0	0	112.5	G94 S95 R101	G94-A98 PolarHBondContact O-N 3.41Å; S95-A98 PolarHBondContact O-N 2.94Å; A98-R101 PolarHBondContact O-N 3.5Å
99	L	43.2	Very low	50.5	Low	56 Å²	56	107 Å²	107	29%	0.293	62%	0.617	S	S	.	*	G	3₁₀ helix	trans	-75.2	-27.7	177.9	-155.1	72.8	0	0	0	112.1	S95 R101 R102 T103 P110	S95-L99 WeakPolarHBondContact O-CA 3.37Å; S95-L99 WeakPolarHBondContact O-CB 3.21Å; S95-L99 PolarHBondContact O-N 2.96Å; L99-R101 PolarHBondContact O-N 3.3Å; L99-R102 HydrophobicContact CD1-CB 4.42Å; L99-R102 CarbonylContact O-C 3.52Å; L99-R102 WeakPolarHBondContact O-CA 3.29Å; L99-R102 PolarHBondContact O-N 2.85Å; L99-T103 PolarHBondContact O-N 2.94Å; L99-P110 HydrophobicContact CD2-CG 3.83Å
100	R	42.2	Very low	49.2	Very low	207 Å²	207	106.8 Å²	106.8	78%	0.781	62%	0.621	S	S	*	*	G	3₁₀ helix	trans	-64.8	-15	170.8	-120.3	176.4	157.1	-179.8	-6	114.3	G96 T103	G96-R100 WeakPolarHBondContact O-CB 3.48Å; R100-T103 PolarHBondContact O-OG1 3.02Å
101	R	42.9	Very low	48.4	Very low	229 Å²	229	106.4 Å²	106.4	86%	0.864	62%	0.619	S	S	*	*	G	3₁₀ helix	trans	-92.1	-12.1	168.5	-98.5	-179.1	174.4	170.5	-1.3	113.3	A98 L99	A98-R101 PolarHBondContact O-N 3.5Å; L99-R101 PolarHBondContact O-N 3.3Å
102	R	40.9	Very low	48	Very low	192 Å²	192	109.8 Å²	109.8	73%	0.725	63%	0.628	S	S	*	*	T	Hydrogen-bonded Turn	trans	-98.9	-12.8	177.2	-100.4	178.1	151.7	-179	-7.1	113.9	L99 A104 A105	L99-R102 HydrophobicContact CD1-CB 4.42Å; L99-R102 CarbonylContact O-C 3.52Å; L99-R102 WeakPolarHBondContact O-CA 3.29Å; L99-R102 PolarHBondContact O-N 2.85Å; R102-A104 PolarHBondContact O-N 3.4Å; R102-A105 PolarHBondContact O-N 3.26Å; R102-A105 VanDerWaalsContact O-N 3.08Å
103	T	42.8	Very low	48.3	Very low	84 Å²	84	110.7 Å²	110.7	52%	0.515	63%	0.634	S	S	.	*	T	Hydrogen-bonded Turn	trans	-69.4	6	176	47.8	0	0	0	0	114.9	L99 R100 A105	L99-T103 PolarHBondContact O-N 2.94Å; R100-T103 PolarHBondContact O-OG1 3.02Å; T103-A105 VanDerWaalsContact C-N 3.28Å
104	A	43.7	Very low	49	Very low	102 Å²	102	109.7 Å²	109.7	84%	0.843	63%	0.633	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.3	-4	164.5	0	0	0	0	0	113.2	R102	R102-A104 PolarHBondContact O-N 3.4Å
105	A	43.1	Very low	50.1	Low	83 Å²	83	113 Å²	113	69%	0.686	64%	0.639	S	S	*	*	S	Bend	trans	-138	74.8	-179.2	0	0	0	0	0	112	R102 T103 G107	R102-A105 PolarHBondContact O-N 3.26Å; R102-A105 VanDerWaalsContact O-N 3.08Å; T103-A105 VanDerWaalsContact C-N 3.28Å; A105-G107 VanDerWaalsContact C-N 3.31Å; A105-G107 PolarHBondContact O-N 3.27Å
106	G	39.9	Very low	51.5	Low	91 Å²	91	116.9 Å²	116.9	94%	0.938	65%	0.651	S	S	*	*			trans	58.4	12.3	151.6	0	0	0	0	0	121
107	G	37.4	Very low	53.1	Low	56 Å²	56	120 Å²	120	58%	0.577	66%	0.655	S	S	*	*	P	Polyproline II helix	trans	-88.7	133.7	-179.5	0	0	0	0	0	113.5	A105	A105-G107 VanDerWaalsContact C-N 3.31Å; A105-G107 PolarHBondContact O-N 3.27Å
108	S	46.4	Very low	54.8	Low	116 Å²	116	109.9 Å²	109.9	81%	0.811	62%	0.62	S	S	*	*	P	Polyproline II helix	trans	-55.4	140.5	175.8	54.6	0	0	0	0	112.5
109	M	51.1	Low	56.5	Low	155 Å²	155	111.7 Å²	111.7	76%	0.764	62%	0.617	S	S	*	*	P	Polyproline II helix	trans	-54	147	173.7	-70.6	-71.8	-71.2	0	0	111.2	D111	M109-D111 PolarHBondContact O-N 3.08Å
110	P	54.7	Low	58.3	Low	74 Å²	74	111.2 Å²	111.2	48%	0.481	62%	0.618	S	S	.	*	P	Polyproline II helix	trans	-58.5	132.9	168.8	-11.4	25.6	0	0	0	108.9	L99 E112	L99-P110 HydrophobicContact CD2-CG 3.83Å; P110-E112 PolarHBondContact O-N 3.39Å
111	D	62.3	Low	60.3	Low	99 Å²	99	104.2 Å²	104.2	53%	0.529	60%	0.598	S	S	.	*	P	Polyproline II helix	trans	-65.1	126.9	179.8	-176	20.4	0	0	0	110.3	M109 S113 T114 Q115	M109-D111 PolarHBondContact O-N 3.08Å; D111-S113 VanDerWaalsContact CG-OG 3.27Å; D111-S113 PolarHBondContact O-N 3.46Å; D111-S113 WeakPolarHBondContact OD2-CB 2.98Å; D111-S113 PolarHBondContact OD2-OG 2.95Å; D111-T114 WeakPolarHBondContact O-CB 3.16Å; D111-T114 PolarHBondContact O-N 3.11Å; D111-Q115 PolarHBondContact O-N 2.82Å
112	E	65.1	Low	62.4	Low	169 Å²	169	94.1 Å²	94.1	79%	0.79	56%	0.561	S	S	*	*	H	α-helix	trans	-52.4	-31.1	179.4	-85.5	-179.1	152.1	0	0	111.7	P110 T114 Q115 H116	P110-E112 PolarHBondContact O-N 3.39Å; E112-T114 VanDerWaalsContact C-N 3.32Å; E112-T114 PolarHBondContact O-N 3.45Å; E112-Q115 PolarHBondContact O-N 2.86Å; E112-H116 WeakPolarHBondContact O-CB 3.47Å; E112-H116 PolarHBondContact O-N 3.08Å
113	S	72.3	Confident	64.4	Low	69 Å²	69	91.7 Å²	91.7	48%	0.483	56%	0.56	S	S	.	*	H	α-helix	trans	-60.5	-38.6	175.5	86.6	0	0	0	0	112.9	D111 L117	D111-S113 VanDerWaalsContact CG-OG 3.27Å; D111-S113 PolarHBondContact O-N 3.46Å; D111-S113 WeakPolarHBondContact OD2-CB 2.98Å; D111-S113 PolarHBondContact OD2-OG 2.95Å; S113-L117 WeakPolarHBondContact O-CB 3.35Å; S113-L117 PolarHBondContact O-N 3.46Å
114	T	72.5	Confident	66.3	Low	85 Å²	85	93.7 Å²	93.7	52%	0.521	56%	0.564	S	S	.	*	H	α-helix	trans	-74.6	-35.4	-176.7	-56	0	0	0	0	110.8	D111 E112 A118	D111-T114 WeakPolarHBondContact O-CB 3.16Å; D111-T114 PolarHBondContact O-N 3.11Å; E112-T114 VanDerWaalsContact C-N 3.32Å; E112-T114 PolarHBondContact O-N 3.45Å; T114-A118 WeakPolarHBondContact O-CB 3.39Å; T114-A118 PolarHBondContact O-N 3.38Å
115	Q	72.5	Confident	68.5	Low	107 Å²	107	90.3 Å²	90.3	50%	0.5	53%	0.531	S	S	.	.	H	α-helix	trans	-71.1	-43.1	177.3	-165.4	172	-19.2	0	0	111.2	D111 E112 L117 A118 E119	D111-Q115 PolarHBondContact O-N 2.82Å; E112-Q115 PolarHBondContact O-N 2.86Å; Q115-L117 PolarHBondContact O-N 2.78Å; Q115-A118 PolarHBondContact O-N 3.4Å; Q115-E119 WeakPolarHBondContact O-CG 3.28Å; Q115-E119 PolarHBondContact O-N 2.98Å
116	H	76.9	Confident	70.6	Confident	136 Å²	136	88.6 Å²	88.6	63%	0.63	51%	0.511	S	S	*	.	H	α-helix	trans	-62.1	-41.1	173.6	-173	-79.5	0	0	0	112.2	E112 A118 E119 S120	E112-H116 WeakPolarHBondContact O-CB 3.47Å; E112-H116 PolarHBondContact O-N 3.08Å; H116-A118 PolarHBondContact O-N 3.12Å; H116-E119 PolarHBondContact O-N 3.27Å; H116-S120 WeakPolarHBondContact O-CB 3.39Å; H116-S120 PolarHBondContact O-N 2.96Å
117	L	79.2	Confident	72.7	Confident	113 Å²	113	91.5 Å²	91.5	59%	0.592	49%	0.493	S	S	*	.	H	α-helix	trans	-62.5	-42	175	-176.9	63.7	0	0	0	111.9	S113 Q115 S120 T121	S113-L117 WeakPolarHBondContact O-CB 3.35Å; S113-L117 PolarHBondContact O-N 3.46Å; Q115-L117 PolarHBondContact O-N 2.78Å; L117-S120 PolarHBondContact O-N 3.43Å; L117-T121 WeakPolarHBondContact O-CB 3.38Å; L117-T121 PolarHBondContact O-N 3.01Å; L117-T121 PolarHBondContact O-OG1 2.92Å
118	A	78.2	Confident	75	Confident	16 Å²	16	91.4 Å²	91.4	13%	0.132	48%	0.483	C	S	.	.	H	α-helix	trans	-65.1	-41.2	177.8	0	0	0	0	0	112.6	T114 Q115 H116 L122	T114-A118 WeakPolarHBondContact O-CB 3.39Å; T114-A118 PolarHBondContact O-N 3.38Å; Q115-A118 PolarHBondContact O-N 3.4Å; H116-A118 PolarHBondContact O-N 3.12Å; A118-L122 WeakPolarHBondContact O-CB 3.16Å; A118-L122 WeakPolarHBondContact O-CG 3.25Å; A118-L122 PolarHBondContact O-N 2.96Å
119	E	79.1	Confident	76.7	Confident	106 Å²	106	86.4 Å²	86.4	50%	0.495	45%	0.447	S	S	.	.	H	α-helix	trans	-64.6	-46.9	175.3	-74.2	174.1	-171.7	0	0	111.4	Q115 H116 T121 L122 M123	Q115-E119 WeakPolarHBondContact O-CG 3.28Å; Q115-E119 PolarHBondContact O-N 2.98Å; H116-E119 PolarHBondContact O-N 3.27Å; E119-T121 PolarHBondContact O-N 3.48Å; E119-L122 PolarHBondContact O-N 3.05Å; E119-M123 WeakPolarHBondContact O-CG 3.41Å; E119-M123 PolarHBondContact O-N 3.3Å
120	S	81.5	Confident	78	Confident	46 Å²	46	85 Å²	85	32%	0.322	44%	0.439	S	S	.	.	H	α-helix	trans	-59.1	-44.9	175.6	-167.7	0	0	0	0	112.1	H116 L117 L122 M123 E124	H116-S120 WeakPolarHBondContact O-CB 3.39Å; H116-S120 PolarHBondContact O-N 2.96Å; L117-S120 PolarHBondContact O-N 3.43Å; S120-L122 VanDerWaalsContact C-N 3.35Å; S120-L122 PolarHBondContact O-N 3.02Å; S120-M123 PolarHBondContact O-N 3.02Å; S120-E124 PolarHBondContact O-N 2.89Å
121	T	84	Confident	79.1	Confident	60 Å²	60	84.9 Å²	84.9	37%	0.368	43%	0.432	S	S	.	.	H	α-helix	trans	-65.1	-39.1	179.1	-53.8	0	0	0	0	111.5	L117 E119 L125	L117-T121 WeakPolarHBondContact O-CB 3.38Å; L117-T121 PolarHBondContact O-N 3.01Å; L117-T121 PolarHBondContact O-OG1 2.92Å; E119-T121 PolarHBondContact O-N 3.48Å; T121-L125 WeakPolarHBondContact O-CB 3.37Å; T121-L125 PolarHBondContact O-N 2.86Å
122	L	86.3	Confident	79.7	Confident	17 Å²	17	82.9 Å²	82.9	9%	0.089	42%	0.421	C	S	.	.	H	α-helix	trans	-65.8	-39.6	175.8	-83.5	168.9	0	0	0	111.8	R85 I88 A118 E119 S120 L125 D126	R85-L122 HydrophobicContact CG-CD2 4.15Å; I88-L122 HydrophobicContact CB-CD2 4.12Å; I88-L122 HydrophobicContact CG2-CD1 4.22Å; I88-L122 HydrophobicContact CG2-CD2 3.71Å; I88-L122 HydrophobicContact CG2-CG 3.78Å; A118-L122 WeakPolarHBondContact O-CB 3.16Å; A118-L122 WeakPolarHBondContact O-CG 3.25Å; A118-L122 PolarHBondContact O-N 2.96Å; E119-L122 PolarHBondContact O-N 3.05Å; S120-L122 VanDerWaalsContact C-N 3.35Å; S120-L122 PolarHBondContact O-N 3.02Å; L122-L125 PolarHBondContact O-N 3.16Å; L122-D126 WeakPolarHBondContact O-CB 3.19Å; L122-D126 PolarHBondContact O-N 3.49Å
123	M	84	Confident	80.1	Confident	141 Å²	141	78.4 Å²	78.4	70%	0.695	40%	0.4	S	S	*	.	H	α-helix	trans	-63.7	-44.7	175.9	-72.4	179	64.1	0	0	112.1	E119 S120 D126 W127	E119-M123 WeakPolarHBondContact O-CG 3.41Å; E119-M123 PolarHBondContact O-N 3.3Å; S120-M123 PolarHBondContact O-N 3.02Å; M123-D126 PolarHBondContact O-N 3.4Å; M123-W127 WeakPolarHBondContact O-CB 3.47Å; M123-W127 PolarHBondContact O-N 3.34Å
124	E	83.4	Confident	80	Confident	126 Å²	126	78.7 Å²	78.7	59%	0.589	41%	0.407	S	S	*	.	H	α-helix	trans	-63.2	-41.7	175.2	-75	-178.9	-172.7	0	0	112	S120 W127 C128	S120-E124 PolarHBondContact O-N 2.89Å; E124-W127 PolarHBondContact O-N 3.42Å; E124-C128 WeakPolarHBondContact O-CB 3.35Å; E124-C128 PolarHBondContact O-N 3.41Å; E124-C128 PolarHBondContact O-SG 3.03Å
125	L	88.4	Confident	79.7	Confident	32 Å²	32	79.2 Å²	79.2	17%	0.168	41%	0.405	C	S	.	.	H	α-helix	trans	-66.6	-41.3	178	-178.2	60.7	0	0	0	112.1	R85 I88 T121 L122 C128 L129	R85-L125 HydrophobicContact CB-CD2 3.69Å; R85-L125 HydrophobicContact CB-CG 4.44Å; R85-L125 HydrophobicContact CG-CD2 4Å; I88-L125 HydrophobicContact CD1-CD2 3.92Å; T121-L125 WeakPolarHBondContact O-CB 3.37Å; T121-L125 PolarHBondContact O-N 2.86Å; L122-L125 PolarHBondContact O-N 3.16Å; L125-C128 PolarHBondContact O-N 3.49Å; L125-L129 HydrophobicContact CG-CD1 4.35Å; L125-L129 WeakPolarHBondContact O-CB 3.43Å; L125-L129 WeakPolarHBondContact O-CG 3.4Å; L125-L129 PolarHBondContact O-N 3.21Å
126	D	86.9	Confident	78.9	Confident	47 Å²	47	78.5 Å²	78.5	25%	0.251	40%	0.402	S	S	.	.	H	α-helix	trans	-62.8	-45.1	175.9	-80	-15.5	0	0	0	110.6	R85 L122 M123 C128 L129 E130	R85-D126 IonicContact CZ-OD1 3.44Å; R85-D126 IonicContact CZ-OD2 3.7Å; R85-D126 IonicContact NE-OD1 2.69Å; R85-D126 PolarHBondContact NE-OD1 3.2Å; R85-D126 IonicContact NE-OD2 3.67Å; R85-D126 IonicContact NH2-OD1 3.31Å; R85-D126 PolarHBondContact NH2-OD1 3.36Å; R85-D126 IonicContact NH2-OD2 2.83Å; R85-D126 PolarHBondContact NH2-OD2 2.73Å; L122-D126 WeakPolarHBondContact O-CB 3.19Å; L122-D126 PolarHBondContact O-N 3.49Å; M123-D126 PolarHBondContact O-N 3.4Å; D126-C128 PolarHBondContact O-N 3.49Å; D126-L129 PolarHBondContact O-N 3.33Å; D126-E130 WeakPolarHBondContact O-CG 3.3Å; D126-E130 PolarHBondContact O-N 2.88Å
127	W	85.6	Confident	78	Confident	152 Å²	152	76.3 Å²	76.3	58%	0.576	40%	0.398	S	S	*	.	H	α-helix	trans	-60.2	-44.4	173.3	-179.3	83.8	0	0	0	112	M123 E124 L129 E130 Q131	M123-W127 WeakPolarHBondContact O-CB 3.47Å; M123-W127 PolarHBondContact O-N 3.34Å; E124-W127 PolarHBondContact O-N 3.42Å; W127-L129 VanDerWaalsContact C-N 3.34Å; W127-L129 PolarHBondContact O-N 2.67Å; W127-E130 PolarHBondContact O-N 3.16Å; W127-Q131 HydrophobicContact CD2-CG 3.88Å; W127-Q131 HydrophobicContact CE3-CG 4.08Å; W127-Q131 HydrophobicContact CH2-CG 3.8Å; W127-Q131 HydrophobicContact CZ2-CG 3.57Å; W127-Q131 HydrophobicContact CZ3-CG 4.04Å; W127-Q131 WeakPolarHBondContact O-CG 3.49Å; W127-Q131 PolarHBondContact O-N 3.09Å
128	C	83.9	Confident	77.1	Confident	54 Å²	54	76 Å²	76	37%	0.365	39%	0.393	S	S	.	.	H	α-helix	trans	-61.3	-40.8	176.3	-71.4	0	0	0	0	112.4	E124 L125 D126 Q131 L132	E124-C128 WeakPolarHBondContact O-CB 3.35Å; E124-C128 PolarHBondContact O-N 3.41Å; E124-C128 PolarHBondContact O-SG 3.03Å; L125-C128 PolarHBondContact O-N 3.49Å; D126-C128 PolarHBondContact O-N 3.49Å; C128-Q131 PolarHBondContact O-N 3.36Å; C128-L132 WeakPolarHBondContact O-CB 3.39Å; C128-L132 VanDerWaalsContact O-CG 3.27Å; C128-L132 WeakPolarHBondContact O-CG 3.36Å; C128-L132 PolarHBondContact O-N 2.86Å
129	L	82.5	Confident	76.4	Confident	10 Å²	10	84.2 Å²	84.2	5%	0.052	42%	0.421	C	S	.	.	H	α-helix	trans	-63.8	-43.6	176.3	-77.4	172	0	0	0	111.3	L78 L81 R82 R85 L125 D126 W127 L132 E133	L78-L129 HydrophobicContact CD2-CD2 4.31Å; L81-L129 HydrophobicContact CB-CD2 3.68Å; L81-L129 HydrophobicContact CD1-CD2 4.31Å; R82-L129 HydrophobicContact CG-CD2 4.45Å; R85-L129 HydrophobicContact CB-CD1 4.23Å; R85-L129 HydrophobicContact CG-CD1 4.28Å; L125-L129 HydrophobicContact CG-CD1 4.35Å; L125-L129 WeakPolarHBondContact O-CB 3.43Å; L125-L129 WeakPolarHBondContact O-CG 3.4Å; L125-L129 PolarHBondContact O-N 3.21Å; D126-L129 PolarHBondContact O-N 3.33Å; W127-L129 VanDerWaalsContact C-N 3.34Å; W127-L129 PolarHBondContact O-N 2.67Å; L129-L132 PolarHBondContact O-N 3.07Å; L129-E133 WeakPolarHBondContact O-CB 3.47Å; L129-E133 VanDerWaalsContact O-CG 3.31Å; L129-E133 WeakPolarHBondContact O-CG 3.2Å; L129-E133 PolarHBondContact O-N 3.2Å
130	E	80	Confident	75.8	Confident	126 Å²	126	81.2 Å²	81.2	59%	0.589	41%	0.411	S	S	*	.	H	α-helix	trans	-61.4	-44.4	174.3	-73.6	178.3	178.3	0	0	111.8	D126 W127 E133 A134	D126-E130 WeakPolarHBondContact O-CG 3.3Å; D126-E130 PolarHBondContact O-N 2.88Å; W127-E130 PolarHBondContact O-N 3.16Å; E130-E133 PolarHBondContact O-N 2.83Å; E130-A134 WeakPolarHBondContact O-CB 3.19Å; E130-A134 PolarHBondContact O-N 3.03Å
131	Q	76.8	Confident	75.2	Confident	72 Å²	72	80.2 Å²	80.2	34%	0.336	40%	0.404	S	S	.	.	H	α-helix	trans	-62.8	-45.6	175.8	-67	-45.7	-61.4	0	0	111.5	W127 C128 E133 A134 I135	W127-Q131 HydrophobicContact CD2-CG 3.88Å; W127-Q131 HydrophobicContact CE3-CG 4.08Å; W127-Q131 HydrophobicContact CH2-CG 3.8Å; W127-Q131 HydrophobicContact CZ2-CG 3.57Å; W127-Q131 HydrophobicContact CZ3-CG 4.04Å; W127-Q131 WeakPolarHBondContact O-CG 3.49Å; W127-Q131 PolarHBondContact O-N 3.09Å; C128-Q131 PolarHBondContact O-N 3.36Å; Q131-E133 VanDerWaalsContact C-N 3.31Å; Q131-E133 PolarHBondContact O-N 2.89Å; Q131-A134 CarbonylContact O-C 3.56Å; Q131-A134 PolarHBondContact O-N 3.49Å; Q131-I135 HydrophobicContact CB-CD1 4.35Å; Q131-I135 VanDerWaalsContact O-CB 3.28Å; Q131-I135 WeakPolarHBondContact O-CB 3.41Å; Q131-I135 WeakPolarHBondContact O-CD1 3.46Å; Q131-I135 WeakPolarHBondContact O-CG1 3.1Å; Q131-I135 PolarHBondContact O-N 2.9Å
132	L	75	Confident	74.4	Confident	56 Å²	56	80.5 Å²	80.5	29%	0.293	41%	0.408	S	S	.	.	H	α-helix	trans	-59.9	-42.4	176.9	-74.9	170.4	0	0	0	111.4	F74 L78 L81 C128 L129 I135	F74-L132 HydrophobicContact CZ-CB 4.48Å; F74-L132 VanDerWaalsContact CZ-O 3.31Å; F74-L132 WeakPolarHBondContact CZ-O 3.36Å; L78-L132 HydrophobicContact CD2-CB 4.01Å; L81-L132 HydrophobicContact CD1-CD1 3.71Å; C128-L132 WeakPolarHBondContact O-CB 3.39Å; C128-L132 VanDerWaalsContact O-CG 3.27Å; C128-L132 WeakPolarHBondContact O-CG 3.36Å; C128-L132 PolarHBondContact O-N 2.86Å; L129-L132 PolarHBondContact O-N 3.07Å; L132-I135 PolarHBondContact O-N 3.37Å
133	E	72.4	Confident	73.6	Confident	75 Å²	75	85.6 Å²	85.6	35%	0.35	43%	0.431	S	S	.	.	H	α-helix	trans	-66	-37.2	176.3	-72.8	177.6	-158.5	0	0	112.6	L78 R82 L129 E130 Q131 Q136	L78-E133 HydrophobicContact CD1-CG 4.19Å; L78-E133 HydrophobicContact CD2-CG 4.18Å; R82-E133 IonicContact CZ-OE1 2.85Å; R82-E133 IonicContact NE-OE1 2.79Å; R82-E133 PolarHBondContact NE-OE1 3.1Å; R82-E133 IonicContact NH2-OE1 3.54Å; R82-E133 PolarHBondContact NH2-OE1 2.9Å; R82-E133 IonicContact NH2-OE2 3.58Å; R82-E133 PolarHBondContact NH2-OE2 3.18Å; L129-E133 WeakPolarHBondContact O-CB 3.47Å; L129-E133 VanDerWaalsContact O-CG 3.31Å; L129-E133 WeakPolarHBondContact O-CG 3.2Å; L129-E133 PolarHBondContact O-N 3.2Å; E130-E133 PolarHBondContact O-N 2.83Å; Q131-E133 VanDerWaalsContact C-N 3.31Å; Q131-E133 PolarHBondContact O-N 2.89Å; E133-Q136 WeakPolarHBondContact O-CG 3.2Å
134	A	71.5	Confident	72.8	Confident	76 Å²	76	82.8 Å²	82.8	63%	0.628	42%	0.418	S	S	*	.	H	α-helix	trans	-72.7	-29.7	175.3	0	0	0	0	0	113.2	E130 Q131 Q136	E130-A134 WeakPolarHBondContact O-CB 3.19Å; E130-A134 PolarHBondContact O-N 3.03Å; Q131-A134 CarbonylContact O-C 3.56Å; Q131-A134 PolarHBondContact O-N 3.49Å; A134-Q136 PolarHBondContact O-N 3.37Å
135	I	66.1	Low	72.2	Confident	96 Å²	96	77.7 Å²	77.7	49%	0.492	40%	0.395	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71	5.2	178.7	-73.9	164	0	0	0	112.5	Q131 L132 T137	Q131-I135 HydrophobicContact CB-CD1 4.35Å; Q131-I135 VanDerWaalsContact O-CB 3.28Å; Q131-I135 WeakPolarHBondContact O-CB 3.41Å; Q131-I135 WeakPolarHBondContact O-CD1 3.46Å; Q131-I135 WeakPolarHBondContact O-CG1 3.1Å; Q131-I135 PolarHBondContact O-N 2.9Å; L132-I135 PolarHBondContact O-N 3.37Å; I135-T137 PolarHBondContact O-N 2.98Å
136	Q	56.5	Low	71.3	Confident	92 Å²	92	78.2 Å²	78.2	43%	0.43	40%	0.401	S	S	.	.			trans	-66.7	63.9	171.2	-69.4	-172	12.6	0	0	112.9	F74 E133 A134 H138 V141	F74-Q136 HydrophobicContact CE1-CG 3.75Å; F74-Q136 HydrophobicContact CZ-CG 4.33Å; E133-Q136 WeakPolarHBondContact O-CG 3.2Å; A134-Q136 PolarHBondContact O-N 3.37Å; Q136-H138 PolarHBondContact O-N 2.92Å; Q136-V141 HydrophobicContact CG-CG2 4.2Å
137	T	57.8	Low	70.5	Confident	89 Å²	89	77.8 Å²	77.8	55%	0.546	40%	0.402	S	S	.	.			trans	-67.7	123	154.8	56	0	0	0	0	106.6	I135 R139 S140	I135-T137 PolarHBondContact O-N 2.98Å; T137-R139 PolarHBondContact O-N 3.35Å; T137-S140 PolarHBondContact O-N 3.49Å; T137-S140 PolarHBondContact O-OG 2.99Å; T137-S140 VanDerWaalsContact O-OG 3.12Å; T137-S140 PolarHBondContact OG1-OG 3.28Å
138	H	60.1	Low	69.8	Low	106 Å²	106	73.8 Å²	73.8	49%	0.491	39%	0.389	S	S	.	.	H	α-helix	trans	-47.1	-32.6	-175.8	-82.2	-74.7	0	0	0	114.3	L32 Q136 S142	L32-H138 WeakPolarHBondContact CB-CE1 3.32Å; L32-H138 VanDerWaalsContact CB-NE2 3.32Å; L32-H138 WeakPolarHBondContact CB-NE2 3.26Å; L32-H138 VanDerWaalsContact CD1-CE1 3.49Å; L32-H138 WeakPolarHBondContact CD1-CE1 3.46Å; Q136-H138 PolarHBondContact O-N 2.92Å; H138-S142 WeakPolarHBondContact O-CB 3.48Å; H138-S142 PolarHBondContact O-N 3.1Å
139	R	62.2	Low	69.2	Low	190 Å²	190	74.7 Å²	74.7	72%	0.717	39%	0.387	S	S	*	.	H	α-helix	trans	-69	-48.4	179.8	-67.7	-171.9	-167.8	-161.6	3.8	112.8	T137 V141 S142 E143	T137-R139 PolarHBondContact O-N 3.35Å; R139-V141 PolarHBondContact O-N 3.32Å; R139-S142 PolarHBondContact O-N 3.03Å; R139-E143 WeakPolarHBondContact O-CB 3.45Å; R139-E143 VanDerWaalsContact O-CG 3.3Å; R139-E143 WeakPolarHBondContact O-CG 3.39Å; R139-E143 PolarHBondContact O-N 2.72Å
140	S	68	Low	68.7	Low	42 Å²	42	78.2 Å²	78.2	29%	0.294	40%	0.399	S	S	.	.	H	α-helix	trans	-64.2	-43.3	-173.9	66.9	0	0	0	0	112.7	T137 E143 M144	T137-S140 PolarHBondContact O-N 3.49Å; T137-S140 PolarHBondContact O-OG 2.99Å; T137-S140 VanDerWaalsContact O-OG 3.12Å; T137-S140 PolarHBondContact OG1-OG 3.28Å; S140-E143 PolarHBondContact O-N 3.25Å; S140-M144 PolarHBondContact O-N 2.97Å; S140-M144 VanDerWaalsContact O-N 3.08Å
141	V	68.5	Low	68.4	Low	26 Å²	26	78.6 Å²	78.6	16%	0.158	40%	0.399	C	S	.	.	H	α-helix	trans	-69.6	-40	177.2	179.1	0	0	0	0	111.3	F74 Q136 R139 M144 T145	F74-V141 HydrophobicContact CB-CG1 3.98Å; F74-V141 HydrophobicContact CD1-CG1 4.14Å; F74-V141 HydrophobicContact CD1-CG2 3.82Å; F74-V141 HydrophobicContact CE1-CG2 4.15Å; F74-V141 HydrophobicContact CG-CG1 4.27Å; F74-V141 HydrophobicContact CG-CG2 4.02Å; Q136-V141 HydrophobicContact CG-CG2 4.2Å; R139-V141 PolarHBondContact O-N 3.32Å; V141-M144 PolarHBondContact O-N 3.44Å; V141-T145 WeakPolarHBondContact O-CB 3.36Å; V141-T145 PolarHBondContact O-N 3.33Å; V141-T145 VanDerWaalsContact O-N 3.08Å; V141-T145 PolarHBondContact O-OG1 2.72Å
142	S	67.6	Low	68.3	Low	66 Å²	66	79.4 Å²	79.4	46%	0.462	40%	0.404	S	S	.	.	H	α-helix	trans	-64.4	-40.9	175.9	-178.6	0	0	0	0	111.8	H138 R139 T145 S146	H138-S142 WeakPolarHBondContact O-CB 3.48Å; H138-S142 PolarHBondContact O-N 3.1Å; R139-S142 PolarHBondContact O-N 3.03Å; S142-T145 PolarHBondContact O-N 3Å; S142-S146 WeakPolarHBondContact O-CB 3.27Å; S142-S146 PolarHBondContact O-N 3.01Å; S142-S146 PolarHBondContact O-OG 3.46Å
143	E	68.2	Low	68.1	Low	123 Å²	123	79.7 Å²	79.7	58%	0.575	41%	0.405	S	S	*	.	H	α-helix	trans	-64.5	-44.5	176.7	-80.1	173.7	-172.6	0	0	112	R139 S140 T145 S146 S147	R139-E143 WeakPolarHBondContact O-CB 3.45Å; R139-E143 VanDerWaalsContact O-CG 3.3Å; R139-E143 WeakPolarHBondContact O-CG 3.39Å; R139-E143 PolarHBondContact O-N 2.72Å; S140-E143 PolarHBondContact O-N 3.25Å; E143-T145 VanDerWaalsContact C-N 3.28Å; E143-T145 PolarHBondContact O-N 3.16Å; E143-S146 PolarHBondContact O-N 3.45Å; E143-S147 WeakPolarHBondContact O-CB 3.31Å; E143-S147 PolarHBondContact O-N 3.04Å
144	M	67	Low	68.1	Low	83 Å²	83	78.9 Å²	78.9	41%	0.409	41%	0.405	S	S	.	.	H	α-helix	trans	-61.3	-40.6	177.1	-155.3	-168.7	-62.5	0	0	111.2	P73 F74 S140 V141 K148	P73-M144 HydrophobicContact CB-CG 4.32Å; P73-M144 HydrophobicContact CB-SD 4.07Å; P73-M144 HydrophobicContact CG-CB 4.26Å; P73-M144 HydrophobicContact CG-CG 3.81Å; P73-M144 WeakPolarHBondContact CG-O 3.24Å; P73-M144 HydrophobicContact CG-SD 4.07Å; F74-M144 HydrophobicContact CB-CE 4.43Å; F74-M144 HydrophobicContact CB-SD 4.12Å; F74-M144 HydrophobicContact CD2-CE 4.03Å; S140-M144 PolarHBondContact O-N 2.97Å; S140-M144 VanDerWaalsContact O-N 3.08Å; V141-M144 PolarHBondContact O-N 3.44Å; M144-K148 PolarHBondContact O-N 3.49Å
145	T	70.7	Confident	68.3	Low	19 Å²	19	81.5 Å²	81.5	12%	0.117	40%	0.403	C	S	.	.	H	α-helix	trans	-68.2	-51	177.2	-59.2	0	0	0	0	111.2	T72 V141 S142 E143 S147 K148 F149	T72-T145 WeakPolarHBondContact CB-OG1 3.31Å; T72-T145 HydrophobicContact CG2-CG2 3.88Å; T72-T145 WeakPolarHBondContact CG2-OG1 3.48Å; V141-T145 WeakPolarHBondContact O-CB 3.36Å; V141-T145 PolarHBondContact O-N 3.33Å; V141-T145 VanDerWaalsContact O-N 3.08Å; V141-T145 PolarHBondContact O-OG1 2.72Å; S142-T145 PolarHBondContact O-N 3Å; E143-T145 VanDerWaalsContact C-N 3.28Å; E143-T145 PolarHBondContact O-N 3.16Å; T145-S147 VanDerWaalsContact C-N 3.27Å; T145-S147 PolarHBondContact O-N 2.84Å; T145-K148 PolarHBondContact O-N 2.95Å; T145-F149 HydrophobicContact CG2-CD2 3.64Å; T145-F149 HydrophobicContact CG2-CE2 3.42Å; T145-F149 VanDerWaalsContact CG2-CE2 3.42Å; T145-F149 WeakPolarHBondContact O-CD2 3.39Å; T145-F149 PolarHBondContact O-N 2.83Å
146	S	69.5	Low	68.7	Low	43 Å²	43	81.8 Å²	81.8	30%	0.301	40%	0.402	S	S	.	.	H	α-helix	trans	-57.3	-40.3	176.1	-63.2	0	0	0	0	111.6	S142 E143 F149 R150	S142-S146 WeakPolarHBondContact O-CB 3.27Å; S142-S146 PolarHBondContact O-N 3.01Å; S142-S146 PolarHBondContact O-OG 3.46Å; E143-S146 PolarHBondContact O-N 3.45Å; S146-F149 PolarHBondContact O-N 3.18Å; S146-R150 WeakPolarHBondContact O-CB 3.44Å; S146-R150 WeakPolarHBondContact O-CG 3.38Å; S146-R150 PolarHBondContact O-N 3.04Å
147	S	70.1	Confident	69.4	Low	37 Å²	37	77.9 Å²	77.9	26%	0.259	38%	0.384	S	S	.	.	H	α-helix	trans	-64.3	-46.3	175.5	-175.9	0	0	0	0	112.3	E143 T145 F149 R150 K151	E143-S147 WeakPolarHBondContact O-CB 3.31Å; E143-S147 PolarHBondContact O-N 3.04Å; T145-S147 VanDerWaalsContact C-N 3.27Å; T145-S147 PolarHBondContact O-N 2.84Å; S147-F149 VanDerWaalsContact C-N 3.33Å; S147-F149 PolarHBondContact O-N 3.03Å; S147-R150 PolarHBondContact O-N 3.3Å; S147-K151 PolarHBondContact O-N 3.14Å
148	K	71.4	Confident	70.1	Confident	69 Å²	69	76.7 Å²	76.7	30%	0.3	38%	0.379	S	S	.	.	H	α-helix	trans	-59.2	-44.3	173.8	-174.6	-178	-177.3	179.9	0	111.2	V71 P73 M144 T145 K151 M152	V71-K148 PolarHBondContact O-NZ 3.47Å; P73-K148 HydrophobicContact CB-CD 4.01Å; P73-K148 HydrophobicContact CG-CB 4.03Å; P73-K148 HydrophobicContact CG-CD 3.81Å; M144-K148 PolarHBondContact O-N 3.49Å; T145-K148 PolarHBondContact O-N 2.95Å; K148-K151 PolarHBondContact O-N 3.45Å; K148-M152 WeakPolarHBondContact O-CB 3.24Å; K148-M152 PolarHBondContact O-N 3.3Å
149	F	71.9	Confident	70.8	Confident	73 Å²	73	76.9 Å²	76.9	32%	0.32	38%	0.38	S	S	.	.	H	α-helix	trans	-61.8	-45.8	175.9	-83.6	-63.7	0	0	0	112.5	I70 T145 S146 S147 K151 M152 L153	I70-F149 HydrophobicContact CD1-CE1 4.16Å; I70-F149 HydrophobicContact CG2-CE1 3.54Å; I70-F149 HydrophobicContact CG2-CE2 4.27Å; I70-F149 HydrophobicContact CG2-CZ 3.3Å; T145-F149 HydrophobicContact CG2-CD2 3.64Å; T145-F149 HydrophobicContact CG2-CE2 3.42Å; T145-F149 VanDerWaalsContact CG2-CE2 3.42Å; T145-F149 WeakPolarHBondContact O-CD2 3.39Å; T145-F149 PolarHBondContact O-N 2.83Å; S146-F149 PolarHBondContact O-N 3.18Å; S147-F149 VanDerWaalsContact C-N 3.33Å; S147-F149 PolarHBondContact O-N 3.03Å; F149-K151 VanDerWaalsContact C-N 3.34Å; F149-K151 PolarHBondContact O-N 3.27Å; F149-M152 PolarHBondContact O-N 3.44Å; F149-L153 VanDerWaalsContact O-CB 3.28Å; F149-L153 WeakPolarHBondContact O-CB 3.28Å; F149-L153 PolarHBondContact O-N 3.24Å
150	R	70.6	Confident	71.1	Confident	83 Å²	83	73.2 Å²	73.2	31%	0.313	37%	0.37	S	S	.	.	H	α-helix	trans	-58.8	-43.9	176.3	-77.1	-172.6	-65.3	-99.6	4.2	111.9	S146 S147 L153 T154 M178	S146-R150 WeakPolarHBondContact O-CB 3.44Å; S146-R150 WeakPolarHBondContact O-CG 3.38Å; S146-R150 PolarHBondContact O-N 3.04Å; S147-R150 PolarHBondContact O-N 3.3Å; R150-L153 PolarHBondContact O-N 3.02Å; R150-T154 WeakPolarHBondContact O-CB 3.25Å; R150-T154 PolarHBondContact O-N 3.05Å; R150-T154 PolarHBondContact O-OG1 3.35Å; R150-M178 HydrophobicContact CB-CE 3.98Å; R150-M178 HydrophobicContact CG-CE 4.06Å
151	K	74.2	Confident	71.1	Confident	134 Å²	134	73.2 Å²	73.2	58%	0.583	37%	0.37	S	S	*	.	H	α-helix	trans	-64.9	-44	177.2	-73.2	-175.1	179.5	-176.6	0	112.3	S147 K148 F149 T154 K155	S147-K151 PolarHBondContact O-N 3.14Å; K148-K151 PolarHBondContact O-N 3.45Å; F149-K151 VanDerWaalsContact C-N 3.34Å; F149-K151 PolarHBondContact O-N 3.27Å; K151-T154 PolarHBondContact O-N 3.27Å; K151-K155 PolarHBondContact O-N 2.62Å
152	M	74.2	Confident	71.3	Confident	89 Å²	89	79.1 Å²	79.1	44%	0.438	40%	0.4	S	S	.	.	H	α-helix	trans	-61.5	-48.2	176	-175	-177.9	-71.7	0	0	111.1	K148 F149 T154 K155 E156	K148-M152 WeakPolarHBondContact O-CB 3.24Å; K148-M152 PolarHBondContact O-N 3.3Å; F149-M152 PolarHBondContact O-N 3.44Å; M152-T154 VanDerWaalsContact C-N 3.33Å; M152-T154 PolarHBondContact O-N 2.81Å; M152-K155 WeakPolarHBondContact O-CB 3.32Å; M152-K155 PolarHBondContact O-N 2.73Å; M152-E156 WeakPolarHBondContact O-CG 3.4Å; M152-E156 PolarHBondContact O-N 2.89Å
153	L	71.7	Confident	71.6	Confident	63 Å²	63	78.5 Å²	78.5	33%	0.33	40%	0.396	S	S	.	.	H	α-helix	trans	-61	-42.3	177.2	-175.7	62.7	0	0	0	111.5	F149 R150 K155 E156 L157 I173 M178	F149-L153 VanDerWaalsContact O-CB 3.28Å; F149-L153 WeakPolarHBondContact O-CB 3.28Å; F149-L153 PolarHBondContact O-N 3.24Å; R150-L153 PolarHBondContact O-N 3.02Å; L153-K155 VanDerWaalsContact C-N 3.31Å; L153-K155 PolarHBondContact O-N 3.4Å; L153-E156 PolarHBondContact O-N 3.46Å; L153-L157 HydrophobicContact CD1-CD1 4.06Å; L153-L157 HydrophobicContact CD1-CG 4.01Å; L153-L157 HydrophobicContact CD2-CD1 4.4Å; L153-L157 HydrophobicContact CG-CD1 3.8Å; L153-L157 HydrophobicContact CG-CG 4.17Å; L153-L157 VanDerWaalsContact O-CB 3.32Å; L153-L157 WeakPolarHBondContact O-CB 3.31Å; L153-L157 VanDerWaalsContact O-CG 3.24Å; L153-L157 WeakPolarHBondContact O-CG 3.25Å; L153-L157 PolarHBondContact O-N 3.44Å; L153-I173 HydrophobicContact CD2-CG2 4.26Å; L153-M178 HydrophobicContact CD2-CG 4.02Å; L153-M178 HydrophobicContact CD2-SD 3.83Å; L153-M178 HydrophobicContact CG-SD 4.3Å
154	T	72.8	Confident	71.8	Confident	57 Å²	57	81.5 Å²	81.5	35%	0.35	41%	0.407	S	S	.	.	H	α-helix	trans	-59	-43.6	176.4	-59.2	0	0	0	0	111.6	R150 K151 M152 S158 F174	R150-T154 WeakPolarHBondContact O-CB 3.25Å; R150-T154 PolarHBondContact O-N 3.05Å; R150-T154 PolarHBondContact O-OG1 3.35Å; K151-T154 PolarHBondContact O-N 3.27Å; M152-T154 VanDerWaalsContact C-N 3.33Å; M152-T154 PolarHBondContact O-N 2.81Å; T154-S158 WeakPolarHBondContact O-CB 3.24Å; T154-S158 PolarHBondContact O-N 3.04Å; T154-F174 HydrophobicContact CG2-CE1 4.24Å; T154-F174 HydrophobicContact CG2-CZ 3.95Å
155	K	75.9	Confident	72.2	Confident	132 Å²	132	81.6 Å²	81.6	57%	0.574	42%	0.416	S	S	*	.	H	α-helix	trans	-62.2	-48.6	177.3	-173.3	-173	174.7	-169.6	0	111.4	K151 M152 L153 S158 Q159	K151-K155 PolarHBondContact O-N 2.62Å; M152-K155 WeakPolarHBondContact O-CB 3.32Å; M152-K155 PolarHBondContact O-N 2.73Å; L153-K155 VanDerWaalsContact C-N 3.31Å; L153-K155 PolarHBondContact O-N 3.4Å; K155-S158 PolarHBondContact O-N 2.93Å; K155-S158 PolarHBondContact O-OG 2.73Å; K155-Q159 PolarHBondContact O-N 2.66Å
156	E	74.8	Confident	72.4	Confident	101 Å²	101	80.7 Å²	80.7	47%	0.472	41%	0.411	S	S	.	.	H	α-helix	trans	-64.8	-43.9	179.5	-66.6	-55.3	132.8	0	0	112.2	M152 L153 S158 Q159 F160	M152-E156 WeakPolarHBondContact O-CG 3.4Å; M152-E156 PolarHBondContact O-N 2.89Å; L153-E156 PolarHBondContact O-N 3.46Å; E156-S158 VanDerWaalsContact C-N 3.29Å; E156-S158 PolarHBondContact O-N 3.2Å; E156-Q159 PolarHBondContact O-N 3.26Å; E156-F160 PolarHBondContact O-N 3.25Å
157	L	71.2	Confident	72.7	Confident	11 Å²	11	80.6 Å²	80.6	6%	0.058	41%	0.407	C	S	.	.	H	α-helix	trans	-66.2	-30.8	178.3	-70.9	-179.9	0	0	0	112.9	L153 F160 S161 I173 F174	L153-L157 HydrophobicContact CD1-CD1 4.06Å; L153-L157 HydrophobicContact CD1-CG 4.01Å; L153-L157 HydrophobicContact CD2-CD1 4.4Å; L153-L157 HydrophobicContact CG-CD1 3.8Å; L153-L157 HydrophobicContact CG-CG 4.17Å; L153-L157 VanDerWaalsContact O-CB 3.32Å; L153-L157 WeakPolarHBondContact O-CB 3.31Å; L153-L157 VanDerWaalsContact O-CG 3.24Å; L153-L157 WeakPolarHBondContact O-CG 3.25Å; L153-L157 PolarHBondContact O-N 3.44Å; L157-F160 PolarHBondContact O-N 2.97Å; L157-S161 PolarHBondContact O-N 3.39Å; L157-S161 VanDerWaalsContact O-N 3.16Å; L157-I173 HydrophobicContact CD1-CB 4.14Å; L157-I173 HydrophobicContact CD1-CG2 3.73Å; L157-I173 HydrophobicContact CD2-CB 4.42Å; L157-I173 HydrophobicContact CD2-CD1 3.82Å; L157-I173 HydrophobicContact CD2-CG2 4.38Å; L157-F174 HydrophobicContact CB-CD2 4.44Å; L157-F174 HydrophobicContact CB-CE2 3.6Å; L157-F174 HydrophobicContact CB-CZ 4.05Å; L157-F174 HydrophobicContact CD1-CD2 3.68Å; L157-F174 HydrophobicContact CD1-CE1 4.36Å; L157-F174 HydrophobicContact CD1-CE2 3.48Å; L157-F174 VanDerWaalsContact CD1-CE2 3.48Å; L157-F174 HydrophobicContact CD1-CG 4.19Å; L157-F174 HydrophobicContact CD1-CZ 3.85Å; L157-F174 HydrophobicContact CG-CE2 4.2Å
158	S	72.6	Confident	72.9	Confident	64 Å²	64	85.3 Å²	85.3	45%	0.448	42%	0.424	S	S	.	.	H	α-helix	trans	-65.2	-41.1	174.1	74.6	0	0	0	0	111.7	T154 K155 E156 F160 S161	T154-S158 WeakPolarHBondContact O-CB 3.24Å; T154-S158 PolarHBondContact O-N 3.04Å; K155-S158 PolarHBondContact O-N 2.93Å; K155-S158 PolarHBondContact O-OG 2.73Å; E156-S158 VanDerWaalsContact C-N 3.29Å; E156-S158 PolarHBondContact O-N 3.2Å; S158-F160 VanDerWaalsContact C-N 3.32Å; S158-F160 PolarHBondContact O-N 2.68Å; S158-S161 PolarHBondContact O-N 3.39Å; S158-S161 PolarHBondContact O-OG 2.88Å
159	Q	73.3	Confident	73	Confident	109 Å²	109	85.8 Å²	85.8	51%	0.509	43%	0.43	S	S	.	.	H	α-helix	trans	-69.7	-30.6	175.5	-64.2	176.1	25.3	0	0	112	K155 E156 S161	K155-Q159 PolarHBondContact O-N 2.66Å; E156-Q159 PolarHBondContact O-N 3.26Å; Q159-S161 VanDerWaalsContact C-N 3.3Å; Q159-S161 PolarHBondContact O-N 3.25Å
160	F	69	Low	73	Confident	114 Å²	114	82.7 Å²	82.7	50%	0.5	42%	0.418	S	S	.	.	H	α-helix	trans	-75.7	-18.7	178	-156.4	-100.2	0	0	0	113.4	E156 L157 S158 D162 G166 L169	E156-F160 PolarHBondContact O-N 3.25Å; L157-F160 PolarHBondContact O-N 2.97Å; S158-F160 VanDerWaalsContact C-N 3.32Å; S158-F160 PolarHBondContact O-N 2.68Å; F160-D162 VanDerWaalsContact C-N 3.26Å; F160-D162 PolarHBondContact O-N 3.35Å; F160-G166 WeakPolarHBondContact O-CA 3.32Å; F160-L169 HydrophobicContact CE1-CD2 3.83Å; F160-L169 HydrophobicContact CZ-CD2 4.49Å
161	S	69.1	Low	73.2	Confident	41 Å²	41	83 Å²	83	29%	0.287	42%	0.418	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.5	-1.5	-172.4	72.4	0	0	0	0	115.6	L157 S158 Q159 S163	L157-S161 PolarHBondContact O-N 3.39Å; L157-S161 VanDerWaalsContact O-N 3.16Å; S158-S161 PolarHBondContact O-N 3.39Å; S158-S161 PolarHBondContact O-OG 2.88Å; Q159-S161 VanDerWaalsContact C-N 3.3Å; Q159-S161 PolarHBondContact O-N 3.25Å; S161-S163 PolarHBondContact O-N 3.45Å; S161-S163 VanDerWaalsContact O-N 3.17Å
162	D	70.8	Confident	73.3	Confident	150 Å²	150	82 Å²	82	80%	0.802	41%	0.414	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.2	-18.2	-177.7	-73	-13.7	0	0	0	114.2	F160	F160-D162 VanDerWaalsContact C-N 3.26Å; F160-D162 PolarHBondContact O-N 3.35Å
163	S	75.9	Confident	73.5	Confident	54 Å²	54	79.5 Å²	79.5	38%	0.378	40%	0.403	S	S	.	.	S	Bend	trans	-105.6	147.9	174.7	68.7	0	0	0	0	111.5	S161 S165 G166 D167	S161-S163 PolarHBondContact O-N 3.45Å; S161-S163 VanDerWaalsContact O-N 3.17Å; S163-S165 PolarHBondContact O-N 3.44Å; S163-S165 VanDerWaalsContact O-N 3.17Å; S163-S165 PolarHBondContact OG-OG 3.19Å; S163-G166 CarbonylContact O-C 3.58Å; S163-G166 WeakPolarHBondContact O-CA 3.24Å; S163-G166 PolarHBondContact O-N 3.41Å; S163-G166 WeakPolarHBondContact OG-CA 3.39Å; S163-G166 PolarHBondContact OG-N 2.94Å; S163-D167 WeakPolarHBondContact O-CB 3.39Å; S163-D167 PolarHBondContact O-N 2.8Å
164	K	72.3	Confident	73.6	Confident	186 Å²	186	79.8 Å²	79.8	81%	0.809	40%	0.401	S	S	*	.	H	α-helix	trans	-54.6	-36.6	176.7	-74	-173.7	178.4	-179.8	0	113.2	Q168	K164-Q168 WeakPolarHBondContact O-CG 3.3Å; K164-Q168 PolarHBondContact O-N 3.13Å
165	S	74.6	Confident	73.7	Confident	85 Å²	85	81.5 Å²	81.5	59%	0.594	42%	0.415	S	S	*	.	H	α-helix	trans	-71.5	-40.9	174.6	46.6	0	0	0	0	112.2	S163 Q168 L169	S163-S165 PolarHBondContact O-N 3.44Å; S163-S165 VanDerWaalsContact O-N 3.17Å; S163-S165 PolarHBondContact OG-OG 3.19Å; S165-Q168 PolarHBondContact O-N 2.72Å; S165-L169 PolarHBondContact O-N 3.2Å
166	G	74	Confident	73.9	Confident	0 Å²	0	78.7 Å²	78.7	0%	0	41%	0.409	C	S	.	.	H	α-helix	trans	-65.9	-38.3	177.4	0	0	0	0	0	112.7	F160 S163 L169 S170	F160-G166 WeakPolarHBondContact O-CA 3.32Å; S163-G166 CarbonylContact O-C 3.58Å; S163-G166 WeakPolarHBondContact O-CA 3.24Å; S163-G166 PolarHBondContact O-N 3.41Å; S163-G166 WeakPolarHBondContact OG-CA 3.39Å; S163-G166 PolarHBondContact OG-N 2.94Å; G166-L169 PolarHBondContact O-N 3.43Å; G166-S170 WeakPolarHBondContact O-CB 3.44Å; G166-S170 PolarHBondContact O-N 3.5Å
167	D	76	Confident	74	Confident	40 Å²	40	80.7 Å²	80.7	21%	0.214	42%	0.417	C	S	.	.	H	α-helix	trans	-62.7	-44.3	172.7	174.1	53.2	0	0	0	112.2	S163 S170 R171	S163-D167 WeakPolarHBondContact O-CB 3.39Å; S163-D167 PolarHBondContact O-N 2.8Å; D167-S170 PolarHBondContact O-N 3.44Å; D167-R171 VanDerWaalsContact CG-CZ 3.4Å; D167-R171 VanDerWaalsContact CG-NH1 3.35Å; D167-R171 WeakPolarHBondContact O-CG 3.5Å; D167-R171 PolarHBondContact O-N 2.88Å; D167-R171 IonicContact OD1-CZ 3.16Å; D167-R171 IonicContact OD1-NE 3.72Å; D167-R171 IonicContact OD1-NH1 3.55Å; D167-R171 IonicContact OD1-NH2 2.86Å; D167-R171 PolarHBondContact OD1-NH2 3.45Å; D167-R171 IonicContact OD2-CZ 2.98Å; D167-R171 IonicContact OD2-NH1 2.66Å; D167-R171 PolarHBondContact OD2-NH1 3.02Å; D167-R171 IonicContact OD2-NH2 2.7Å; D167-R171 PolarHBondContact OD2-NH2 3.1Å
168	Q	74.5	Confident	73.6	Confident	136 Å²	136	81.5 Å²	81.5	64%	0.636	42%	0.421	S	S	*	.	H	α-helix	trans	-64	-44.9	174.8	-73.7	-179	4.5	0	0	112.7	K164 S165 R171 F172	K164-Q168 WeakPolarHBondContact O-CG 3.3Å; K164-Q168 PolarHBondContact O-N 3.13Å; S165-Q168 PolarHBondContact O-N 2.72Å; Q168-R171 PolarHBondContact O-N 2.95Å; Q168-F172 PolarHBondContact O-N 3.06Å
169	L	73.4	Confident	73	Confident	80 Å²	80	84.2 Å²	84.2	42%	0.419	43%	0.43	S	S	.	.	H	α-helix	trans	-65.2	-42.8	178	-178.2	61.6	0	0	0	111.3	F160 S165 G166 R171 F172 I173	F160-L169 HydrophobicContact CE1-CD2 3.83Å; F160-L169 HydrophobicContact CZ-CD2 4.49Å; S165-L169 PolarHBondContact O-N 3.2Å; G166-L169 PolarHBondContact O-N 3.43Å; L169-R171 PolarHBondContact O-N 3.32Å; L169-F172 HydrophobicContact CD1-CD1 4.39Å; L169-F172 PolarHBondContact O-N 2.87Å; L169-I173 HydrophobicContact CD1-CD1 4.1Å; L169-I173 HydrophobicContact CD1-CG1 4.26Å; L169-I173 HydrophobicContact CD2-CD1 4.44Å; L169-I173 HydrophobicContact CG-CD1 3.84Å; L169-I173 HydrophobicContact CG-CG1 4.41Å; L169-I173 WeakPolarHBondContact O-CG1 3.38Å; L169-I173 PolarHBondContact O-N 3.02Å
170	S	72	Confident	72.1	Confident	8 Å²	8	84.3 Å²	84.3	6%	0.056	44%	0.443	C	S	.	.	H	α-helix	trans	-56	-51	174.6	177.9	0	0	0	0	110.5	G166 D167 F172 I173 F174	G166-S170 WeakPolarHBondContact O-CB 3.44Å; G166-S170 PolarHBondContact O-N 3.5Å; D167-S170 PolarHBondContact O-N 3.44Å; S170-F172 VanDerWaalsContact C-N 3.34Å; S170-F172 PolarHBondContact O-N 2.98Å; S170-I173 PolarHBondContact O-N 3.42Å; S170-F174 WeakPolarHBondContact O-CB 3.4Å; S170-F174 WeakPolarHBondContact O-CD2 3.46Å; S170-F174 PolarHBondContact O-N 3.27Å; S170-F174 WeakPolarHBondContact OG-CE2 3.36Å
171	R	74.8	Confident	71	Confident	88 Å²	88	83.8 Å²	83.8	33%	0.332	44%	0.444	S	S	.	.	H	α-helix	trans	-57.9	-43	175.2	-72.7	-168.4	-164.8	103.8	8.6	113.2	D167 Q168 L169 S175	D167-R171 VanDerWaalsContact CG-CZ 3.4Å; D167-R171 VanDerWaalsContact CG-NH1 3.35Å; D167-R171 WeakPolarHBondContact O-CG 3.5Å; D167-R171 PolarHBondContact O-N 2.88Å; D167-R171 IonicContact OD1-CZ 3.16Å; D167-R171 IonicContact OD1-NE 3.72Å; D167-R171 IonicContact OD1-NH1 3.55Å; D167-R171 IonicContact OD1-NH2 2.86Å; D167-R171 PolarHBondContact OD1-NH2 3.45Å; D167-R171 IonicContact OD2-CZ 2.98Å; D167-R171 IonicContact OD2-NH1 2.66Å; D167-R171 PolarHBondContact OD2-NH1 3.02Å; D167-R171 IonicContact OD2-NH2 2.7Å; D167-R171 PolarHBondContact OD2-NH2 3.1Å; Q168-R171 PolarHBondContact O-N 2.95Å; L169-R171 PolarHBondContact O-N 3.32Å; R171-S175 WeakPolarHBondContact O-CB 3.29Å; R171-S175 PolarHBondContact O-N 3Å; R171-S175 PolarHBondContact O-OG 3.18Å
172	F	77.3	Confident	69.8	Low	114 Å²	114	88.9 Å²	88.9	50%	0.5	46%	0.461	S	S	.	.	H	α-helix	trans	-63	-44	177.3	172.6	-102.7	0	0	0	111.9	Q168 L169 S170 S175 T176 F177	Q168-F172 PolarHBondContact O-N 3.06Å; L169-F172 HydrophobicContact CD1-CD1 4.39Å; L169-F172 PolarHBondContact O-N 2.87Å; S170-F172 VanDerWaalsContact C-N 3.34Å; S170-F172 PolarHBondContact O-N 2.98Å; F172-S175 PolarHBondContact O-N 3.48Å; F172-S175 PolarHBondContact O-OG 3.06Å; F172-S175 VanDerWaalsContact O-OG 3.09Å; F172-T176 WeakPolarHBondContact CE2-OG1 3.33Å; F172-T176 HydrophobicContact CZ-CG2 4.42Å; F172-T176 WeakPolarHBondContact O-CB 3.43Å; F172-T176 PolarHBondContact O-N 3.32Å; F172-T176 VanDerWaalsContact O-N 3.07Å; F172-T176 PolarHBondContact O-OG1 2.74Å; F172-F177 HydrophobicContact CE1-CE2 4.32Å
173	I	77.4	Confident	68.2	Low	37 Å²	37	89.6 Å²	89.6	19%	0.19	46%	0.46	C	S	.	.	H	α-helix	trans	-64.6	-48.3	178.5	-67.5	168.6	0	0	0	110	L153 L157 L169 S170 S175 T176 F177	L153-I173 HydrophobicContact CD2-CG2 4.26Å; L157-I173 HydrophobicContact CD1-CB 4.14Å; L157-I173 HydrophobicContact CD1-CG2 3.73Å; L157-I173 HydrophobicContact CD2-CB 4.42Å; L157-I173 HydrophobicContact CD2-CD1 3.82Å; L157-I173 HydrophobicContact CD2-CG2 4.38Å; L169-I173 HydrophobicContact CD1-CD1 4.1Å; L169-I173 HydrophobicContact CD1-CG1 4.26Å; L169-I173 HydrophobicContact CD2-CD1 4.44Å; L169-I173 HydrophobicContact CG-CD1 3.84Å; L169-I173 HydrophobicContact CG-CG1 4.41Å; L169-I173 WeakPolarHBondContact O-CG1 3.38Å; L169-I173 PolarHBondContact O-N 3.02Å; S170-I173 PolarHBondContact O-N 3.42Å; I173-S175 VanDerWaalsContact C-N 3.34Å; I173-S175 PolarHBondContact O-N 2.92Å; I173-T176 PolarHBondContact O-N 2.96Å; I173-F177 HydrophobicContact CG2-CD2 4.19Å; I173-F177 PolarHBondContact O-N 2.93Å
174	F	73.9	Confident	66.3	Low	69 Å²	69	90.6 Å²	90.6	30%	0.303	47%	0.467	S	S	.	.	H	α-helix	trans	-57.7	-43.9	175.8	-86.7	-71.1	0	0	0	112.3	T154 L157 S170 T176 M178	T154-F174 HydrophobicContact CG2-CE1 4.24Å; T154-F174 HydrophobicContact CG2-CZ 3.95Å; L157-F174 HydrophobicContact CB-CD2 4.44Å; L157-F174 HydrophobicContact CB-CE2 3.6Å; L157-F174 HydrophobicContact CB-CZ 4.05Å; L157-F174 HydrophobicContact CD1-CD2 3.68Å; L157-F174 HydrophobicContact CD1-CE1 4.36Å; L157-F174 HydrophobicContact CD1-CE2 3.48Å; L157-F174 VanDerWaalsContact CD1-CE2 3.48Å; L157-F174 HydrophobicContact CD1-CG 4.19Å; L157-F174 HydrophobicContact CD1-CZ 3.85Å; L157-F174 HydrophobicContact CG-CE2 4.2Å; S170-F174 WeakPolarHBondContact O-CB 3.4Å; S170-F174 WeakPolarHBondContact O-CD2 3.46Å; S170-F174 PolarHBondContact O-N 3.27Å; S170-F174 WeakPolarHBondContact OG-CE2 3.36Å; F174-T176 VanDerWaalsContact C-N 3.31Å; F174-T176 PolarHBondContact O-N 3.44Å; F174-M178 HydrophobicContact CD1-CB 4.45Å; F174-M178 HydrophobicContact CD1-CE 3.84Å; F174-M178 HydrophobicContact CD1-CG 4.26Å; F174-M178 HydrophobicContact CD1-SD 3.16Å; F174-M178 WeakPolarHBondContact CD1-SD 3.33Å; F174-M178 HydrophobicContact CE1-CE 3.66Å; F174-M178 HydrophobicContact CE1-SD 3.27Å; F174-M178 WeakPolarHBondContact CE1-SD 3.29Å; F174-M178 HydrophobicContact CG-SD 4.13Å; F174-M178 HydrophobicContact CZ-SD 4.3Å; F174-M178 WeakPolarHBondContact O-CB 3.46Å; F174-M178 PolarHBondContact O-N 2.74Å; F174-M178 VanDerWaalsContact O-O 3.13Å
175	S	75.8	Confident	64.5	Low	92 Å²	92	87.4 Å²	87.4	64%	0.643	46%	0.459	S	S	*	.	H	α-helix	trans	-73.9	-22.1	-177.4	67.1	0	0	0	0	114.1	R171 F172 I173	R171-S175 WeakPolarHBondContact O-CB 3.29Å; R171-S175 PolarHBondContact O-N 3Å; R171-S175 PolarHBondContact O-OG 3.18Å; F172-S175 PolarHBondContact O-N 3.48Å; F172-S175 PolarHBondContact O-OG 3.06Å; F172-S175 VanDerWaalsContact O-OG 3.09Å; I173-S175 VanDerWaalsContact C-N 3.34Å; I173-S175 PolarHBondContact O-N 2.92Å
176	T	79.1	Confident	62.5	Low	73 Å²	73	91.9 Å²	91.9	45%	0.448	47%	0.47	S	S	.	.	H	α-helix	trans	-105	-42.4	-169.7	-50.6	0	0	0	0	112.6	F172 I173 F174	F172-T176 WeakPolarHBondContact CE2-OG1 3.33Å; F172-T176 HydrophobicContact CZ-CG2 4.42Å; F172-T176 WeakPolarHBondContact O-CB 3.43Å; F172-T176 PolarHBondContact O-N 3.32Å; F172-T176 VanDerWaalsContact O-N 3.07Å; F172-T176 PolarHBondContact O-OG1 2.74Å; I173-T176 PolarHBondContact O-N 2.96Å; F174-T176 VanDerWaalsContact C-N 3.31Å; F174-T176 PolarHBondContact O-N 3.44Å
177	F	77.2	Confident	60.3	Low	144 Å²	144	101.3 Å²	101.3	63%	0.632	51%	0.514	S	S	*	.	H	α-helix	trans	-111.4	-7.4	-171.7	-59.2	-73	0	0	0	113.6	F172 I173	F172-F177 HydrophobicContact CE1-CE2 4.32Å; I173-F177 HydrophobicContact CG2-CD2 4.19Å; I173-F177 PolarHBondContact O-N 2.93Å
178	M	63.2	Low	58	Low	28 Å²	28	107.7 Å²	107.7	14%	0.138	54%	0.54	C	S	.	.	S	Bend	trans	-109.4	121	172.8	-61.7	-173.1	54.9	0	0	108.9	R150 L153 F174 S180	R150-M178 HydrophobicContact CB-CE 3.98Å; R150-M178 HydrophobicContact CG-CE 4.06Å; L153-M178 HydrophobicContact CD2-CG 4.02Å; L153-M178 HydrophobicContact CD2-SD 3.83Å; L153-M178 HydrophobicContact CG-SD 4.3Å; F174-M178 HydrophobicContact CD1-CB 4.45Å; F174-M178 HydrophobicContact CD1-CE 3.84Å; F174-M178 HydrophobicContact CD1-CG 4.26Å; F174-M178 HydrophobicContact CD1-SD 3.16Å; F174-M178 WeakPolarHBondContact CD1-SD 3.33Å; F174-M178 HydrophobicContact CE1-CE 3.66Å; F174-M178 HydrophobicContact CE1-SD 3.27Å; F174-M178 WeakPolarHBondContact CE1-SD 3.29Å; F174-M178 HydrophobicContact CG-SD 4.13Å; F174-M178 HydrophobicContact CZ-SD 4.3Å; F174-M178 WeakPolarHBondContact O-CB 3.46Å; F174-M178 PolarHBondContact O-N 2.74Å; F174-M178 VanDerWaalsContact O-O 3.13Å; M178-S180 PolarHBondContact O-N 3.24Å
179	D	60.4	Low	55.7	Low	120 Å²	120	108 Å²	108	64%	0.642	55%	0.551	S	S	*	*			trans	-54.4	130.1	170.2	-67.1	-37.3	0	0	0	108.7	I181	D179-I181 HydrophobicContact CB-CG1 4.25Å; D179-I181 PolarHBondContact O-N 2.71Å
180	S	52.8	Low	53.8	Low	111 Å²	111	110.8 Å²	110.8	78%	0.776	56%	0.56	S	S	*	*			trans	-70.3	32.8	-177	65.5	0	0	0	0	114.2	M178 K182	M178-S180 PolarHBondContact O-N 3.24Å; S180-K182 PolarHBondContact O-N 2.66Å
181	I	46.3	Very low	51.7	Low	104 Å²	104	114.2 Å²	114.2	53%	0.533	60%	0.597	S	S	.	*			trans	-67.7	79	163.8	-49.5	176.7	0	0	0	106.5	D179 E183	D179-I181 HydrophobicContact CB-CG1 4.25Å; D179-I181 PolarHBondContact O-N 2.71Å; I181-E183 VanDerWaalsContact C-N 3.33Å; I181-E183 PolarHBondContact O-N 3.45Å
182	K	43.7	Very low	49.6	Very low	148 Å²	148	115.1 Å²	115.1	64%	0.643	61%	0.612	S	S	*	*			trans	-57.9	103.4	162	-69.1	-179.3	175.7	179.2	0	106	S180 S184	S180-K182 PolarHBondContact O-N 2.66Å; K182-S184 PolarHBondContact O-N 3.49Å
183	E	38.2	Very low	47.2	Very low	165 Å²	165	115.3 Å²	115.3	77%	0.771	63%	0.627	S	S	*	*			trans	-61.5	78.9	145.3	-73.3	-178.1	168.4	0	0	105.4	I181 D185	I181-E183 VanDerWaalsContact C-N 3.33Å; I181-E183 PolarHBondContact O-N 3.45Å; E183-D185 PolarHBondContact O-N 3.44Å; E183-D185 VanDerWaalsContact O-N 3.1Å
184	S	34.6	Very low	45	Very low	75 Å²	75	117.8 Å²	117.8	52%	0.524	65%	0.648	S	S	.	*	T	Hydrogen-bonded Turn	trans	-83.8	82.3	-175.3	56	0	0	0	0	109.6	K182	K182-S184 PolarHBondContact O-N 3.49Å
185	D	34.6	Very low	42.8	Very low	119 Å²	119	124.2 Å²	124.2	64%	0.636	68%	0.676	S	S	*	*	T	Hydrogen-bonded Turn	trans	-129.8	4.4	158.3	-78	-38.1	0	0	0	113.2	E183	E183-D185 PolarHBondContact O-N 3.44Å; E183-D185 VanDerWaalsContact O-N 3.1Å
186	E	32.3	Very low	40.6	Very low	179 Å²	179	127.5 Å²	127.5	84%	0.836	69%	0.685	S	S	*	*	S	Bend	trans	-106.2	109.1	168.8	-69.1	-166	176.1	0	0	111.7	K188	E186-K188 VanDerWaalsContact C-N 3.32Å; E186-K188 PolarHBondContact O-N 3.37Å
187	E	27.8	Very low	38.3	Very low	198 Å²	198	127.2 Å²	127.2	93%	0.925	70%	0.697	S	S	*	*			trans	-57.9	85.9	167.4	-69.7	-175.1	141	0	0	111.4
188	K	28.3	Very low	35.8	Very low	173 Å²	173	131.9 Å²	131.9	75%	0.752	71%	0.71	S	S	*	*			trans	-133.7	105.3	152.1	-73.2	-171.1	-178.1	169.4	0	110.5	E186 F190	E186-K188 VanDerWaalsContact C-N 3.32Å; E186-K188 PolarHBondContact O-N 3.37Å; K188-F190 PolarHBondContact O-N 3.36Å
189	T	26.2	Very low	34.4	Very low	142 Å²	142	137.3 Å²	137.3	87%	0.871	75%	0.745	S	S	*	*			trans	-56.8	110.8	170.2	45.1	0	0	0	0	111.1
190	F	34.3	Very low	33	Very low	140 Å²	140	139.5 Å²	139.5	61%	0.614	75%	0.749	S	S	*	*			trans	-125.7	95.9	156.4	-79.5	-77.5	0	0	0	108.7	K188	K188-F190 PolarHBondContact O-N 3.36Å
191	G	26.7	Very low	31.9	Very low	80 Å²	80	142.6 Å²	142.6	83%	0.825	75%	0.751	S	S	*	*			trans	-82.3	122.6	169.1	0	0	0	0	0	109.6
192	V	32	Very low	31.2	Very low	107 Å²	107	146.2 Å²	146.2	65%	0.648	77%	0.765	S	S	*	*			trans	-119.2	110.8	163.6	179.7	0	0	0	0	107.1	S194	V192-S194 PolarHBondContact O-N 2.97Å
193	S	26.1	Very low	30.8	Very low	117 Å²	117	146 Å²	146	82%	0.818	78%	0.777	S	S	*	*			trans	-80.1	104.4	167.5	-168	0	0	0	0	107.7
194	S	32.2	Very low	30.9	Very low	90 Å²	90	143.7 Å²	143.7	63%	0.629	77%	0.774	S	S	*	*			trans	-98.2	104.6	167.5	52.3	0	0	0	0	109.2	V192 L196	V192-S194 PolarHBondContact O-N 2.97Å; S194-L196 PolarHBondContact O-N 2.87Å; S194-L196 VanDerWaalsContact O-N 3.14Å
195	K	26.7	Very low	31	Very low	204 Å²	204	145.2 Å²	145.2	89%	0.887	78%	0.784	S	S	*	*			trans	-70.2	95.5	159.2	-75.2	-179.9	176.5	177.3	0	107.2
196	L	30.7	Very low	31.2	Very low	160 Å²	160	142.6 Å²	142.6	84%	0.838	78%	0.779	S	S	*	*	P	Polyproline II helix	trans	-93	122.9	162.6	-115.3	78.1	0	0	0	109.4	S194	S194-L196 PolarHBondContact O-N 2.87Å; S194-L196 VanDerWaalsContact O-N 3.14Å
197	G	29.4	Very low	31.8	Very low	67 Å²	67	139.6 Å²	139.6	69%	0.691	77%	0.767	S	S	*	*	P	Polyproline II helix	trans	-65.4	150.2	-177.1	0	0	0	0	0	113.1	T199	G197-T199 PolarHBondContact O-N 3.31Å
198	R	26.1	Very low	32.1	Very low	243 Å²	243	133.7 Å²	133.7	92%	0.917	75%	0.747	S	S	*	*	P	Polyproline II helix	trans	-61.5	118.7	172.2	-70.9	164.9	91.9	165.9	6.8	109.7
199	T	32.4	Very low	32.5	Very low	142 Å²	142	134 Å²	134	87%	0.871	75%	0.751	S	S	*	*			trans	-119.4	121.5	154.7	-18.6	0	0	0	0	107.9	G197	G197-T199 PolarHBondContact O-N 3.31Å
200	K	30.8	Very low	33.2	Very low	165 Å²	165	131.3 Å²	131.3	72%	0.717	73%	0.73	S	S	*	*			trans	-75.3	162.5	-179	-68.7	174	169.6	178.4	0	110.5
201	Q	31.3	Very low	33.4	Very low	177 Å²	177	130.1 Å²	130.1	83%	0.827	74%	0.739	S	S	*	*			trans	78.1	123.1	164	-60.7	152.8	-27.8	0	0	112.4
202	H	30.9	Very low	33.7	Very low	179 Å²	179	128.1 Å²	128.1	83%	0.829	72%	0.719	S	S	*	*	S	Bend	cis	-175.8	63.5	46.9	-145.5	-71.3	0	0	0	111.3
203	V	36.2	Very low	33.8	Very low	145 Å²	145	128.5 Å²	128.5	88%	0.879	72%	0.721	S	S	*	*			trans	-146.5	70	175.4	-166.9	0	0	0	0	111.3
204	T	38.5	Very low	34.3	Very low	116 Å²	116	131 Å²	131	71%	0.712	72%	0.72	S	S	*	*			trans	-136.8	7.6	-179.4	48.6	0	0	0	0	114.9
205	S	36.9	Very low	34.5	Very low	107 Å²	107	136 Å²	136	75%	0.748	73%	0.73	S	S	*	*	G	3₁₀ helix	trans	-73	-32.7	-174.8	-155.4	0	0	0	0	113.4	M207 S208	S205-M207 PolarHBondContact O-N 3.05Å; S205-S208 PolarHBondContact O-OG 3.4Å
206	A	39.8	Very low	35	Very low	64 Å²	64	131.2 Å²	131.2	53%	0.529	71%	0.714	S	S	.	*	G	3₁₀ helix	trans	-83.5	-2.2	-176.1	0	0	0	0	0	115.1	M356	A206-M356 HydrophobicContact CB-CE 3.92Å
207	M	43.7	Very low	35.2	Very low	116 Å²	116	134.6 Å²	134.6	57%	0.571	72%	0.715	S	S	*	*	G	3₁₀ helix	trans	-119.2	20.9	178.4	-66.3	-171.2	-149.6	0	0	113.1	S205 M356	S205-M207 PolarHBondContact O-N 3.05Å; M207-M356 HydrophobicContact CE-SD 4.23Å
208	S	34.1	Very low	35.5	Very low	74 Å²	74	141.6 Å²	141.6	52%	0.517	73%	0.727	S	S	.	*			trans	-100.6	11.2	-167.9	64.3	0	0	0	0	116.1	S205	S205-S208 PolarHBondContact O-OG 3.4Å
209	H	37.7	Very low	36.2	Very low	180 Å²	180	133.3 Å²	133.3	83%	0.833	71%	0.706	S	S	*	*			trans	-115.6	71.6	174.8	-67.6	-72	0	0	0	111.4
210	I	39.8	Very low	36.7	Very low	85 Å²	85	131.6 Å²	131.6	44%	0.436	70%	0.697	S	S	.	*			trans	-108.7	98.9	166.9	-59.6	172.4	0	0	0	106.1	K373	I210-K373 HydrophobicContact CD1-CG 4.4Å
211	S	39.9	Very low	37.4	Very low	114 Å²	114	130.2 Å²	130.2	80%	0.797	70%	0.703	S	S	*	*			trans	-117.6	119.4	-177.8	57.9	0	0	0	0	110.9
212	G	31.6	Very low	38.6	Very low	39 Å²	39	124.9 Å²	124.9	40%	0.402	68%	0.682	S	S	.	*			trans	122.6	78.5	147.6	0	0	0	0	0	116.4	H214	G212-H214 PolarHBondContact O-N 3.2Å
213	V	34.3	Very low	40.4	Very low	115 Å²	115	120.1 Å²	120.1	70%	0.697	66%	0.663	S	S	*	*			trans	-65.6	89.8	154	-179.4	0	0	0	0	107.9	K215 H283	V213-K215 PolarHBondContact O-N 2.91Å; V213-H283 VanDerWaalsContact CG2-CE1 3.44Å; V213-H283 WeakPolarHBondContact CG2-CE1 3.17Å
214	H	37.9	Very low	42.2	Very low	169 Å²	169	116.6 Å²	116.6	78%	0.782	65%	0.649	S	S	*	*			trans	-76.7	110.4	165.7	-88.9	-65.8	0	0	0	108.8	G212 L216	G212-H214 PolarHBondContact O-N 3.2Å; H214-L216 PolarHBondContact O-N 3.29Å; H214-L216 VanDerWaalsContact O-N 3.09Å
215	K	36.5	Very low	44.2	Very low	194 Å²	194	117.5 Å²	117.5	84%	0.843	65%	0.645	S	S	*	*			trans	-45.6	114	172.3	-143.4	175.6	-169.9	176.4	0	109.6	V213 R217	V213-K215 PolarHBondContact O-N 2.91Å; K215-R217 PolarHBondContact O-N 3.28Å
216	L	37.6	Very low	46.4	Very low	105 Å²	105	116.6 Å²	116.6	55%	0.55	63%	0.629	S	S	.	*			trans	-40.5	101.7	169.5	-85.1	165.4	0	0	0	110.1	H214 K218 H251 L282	H214-L216 PolarHBondContact O-N 3.29Å; H214-L216 VanDerWaalsContact O-N 3.09Å; L216-K218 PolarHBondContact O-N 2.86Å; L216-H251 WeakPolarHBondContact CD2-NE2 3.49Å; L216-L282 HydrophobicContact CD1-CD1 3.38Å; L216-L282 HydrophobicContact CD1-CD2 4.12Å; L216-L282 HydrophobicContact CD1-CG 4.38Å; L216-L282 HydrophobicContact CD2-CD2 3.95Å; L216-L282 HydrophobicContact CG-CD1 4.28Å; L216-L282 HydrophobicContact CG-CD2 4.36Å
217	R	34.7	Very low	48.4	Very low	231 Å²	231	114.6 Å²	114.6	87%	0.872	61%	0.61	S	S	*	*			trans	-74.2	123.3	168	-84.9	177.4	87	174.6	3.5	106	K215 S219	K215-R217 PolarHBondContact O-N 3.28Å; R217-S219 VanDerWaalsContact C-N 3.34Å; R217-S219 PolarHBondContact O-N 3.23Å
218	K	35.7	Very low	50.3	Low	213 Å²	213	113.6 Å²	113.6	93%	0.926	61%	0.611	S	S	*	*			trans	-57.2	100.4	162.3	-78.5	-179.3	174.1	-177.5	0	107.9	L216	L216-K218 PolarHBondContact O-N 2.86Å
219	S	39.4	Very low	52.8	Low	70 Å²	70	114.8 Å²	114.8	49%	0.49	61%	0.611	S	S	.	*			trans	-80.5	149.5	167.2	-154.2	0	0	0	0	109.5	R217 D249	R217-S219 VanDerWaalsContact C-N 3.34Å; R217-S219 PolarHBondContact O-N 3.23Å; S219-D249 WeakPolarHBondContact CB-OD2 3.31Å
220	P	43.7	Very low	55	Low	106 Å²	106	106.9 Å²	106.9	69%	0.688	58%	0.577	S	S	*	*			trans	-82.9	129	-169.9	-0.2	19.7	0	0	0	111.7
221	T	45.7	Very low	57.3	Low	135 Å²	135	105.3 Å²	105.3	83%	0.828	57%	0.569	S	S	*	*			trans	53.4	69.5	150.5	59.1	0	0	0	0	116.8
222	T	55.9	Low	59.7	Low	65 Å²	65	102.4 Å²	102.4	40%	0.399	56%	0.557	S	S	.	*			trans	-68.5	140.5	146	38.4	0	0	0	0	108.8	A224 L247	T222-A224 PolarHBondContact O-N 3.12Å; T222-L247 WeakPolarHBondContact CG2-O 3.26Å
223	N	68.4	Low	62.5	Low	79 Å²	79	104 Å²	104	42%	0.422	55%	0.554	S	S	.	*			trans	-63.9	99	-179.8	-172.8	2.4	0	0	0	108.7	E225 E226 T227	N223-E225 PolarHBondContact O-N 3.47Å; N223-E226 HydrophobicContact CB-CB 4.17Å; N223-E226 HydrophobicContact CB-CG 4.16Å; N223-E226 PolarHBondContact ND2-OE1 3.4Å; N223-E226 PolarHBondContact O-N 3Å; N223-T227 PolarHBondContact O-N 3.49Å; N223-T227 VanDerWaalsContact O-N 3.1Å; N223-T227 PolarHBondContact O-OG1 3.06Å
224	A	75.4	Confident	65.4	Low	71 Å²	71	98.5 Å²	98.5	59%	0.587	52%	0.521	S	S	*	.	H	α-helix	trans	-54.2	-32.1	-171.3	0	0	0	0	0	112.5	T222 V228	T222-A224 PolarHBondContact O-N 3.12Å; A224-V228 WeakPolarHBondContact O-CB 3.44Å; A224-V228 WeakPolarHBondContact O-CG2 3.23Å; A224-V228 PolarHBondContact O-N 3.41Å
225	E	80.1	Confident	68.1	Low	136 Å²	136	95 Å²	95	64%	0.636	51%	0.508	S	S	*	.	H	α-helix	trans	-66.8	-43	176.1	-170.4	174.6	-178.1	0	0	112.3	N223 V228 N229	N223-E225 PolarHBondContact O-N 3.47Å; E225-V228 PolarHBondContact O-N 3.27Å; E225-N229 WeakPolarHBondContact O-CB 3.43Å; E225-N229 PolarHBondContact O-N 2.76Å; E225-N229 PolarHBondContact O-ND2 2.94Å
226	E	83	Confident	70.9	Confident	88 Å²	88	92.7 Å²	92.7	41%	0.411	49%	0.494	S	S	.	.	H	α-helix	trans	-66.3	-39.7	176	-73.5	176.8	-142	0	0	112	N223 N229 A230 L247	N223-E226 HydrophobicContact CB-CB 4.17Å; N223-E226 HydrophobicContact CB-CG 4.16Å; N223-E226 PolarHBondContact ND2-OE1 3.4Å; N223-E226 PolarHBondContact O-N 3Å; E226-N229 PolarHBondContact O-N 3.41Å; E226-A230 WeakPolarHBondContact O-CB 3.37Å; E226-A230 PolarHBondContact O-N 3.14Å; E226-L247 HydrophobicContact CB-CD1 4.27Å; E226-L247 HydrophobicContact CB-CD2 3.87Å
227	T	80.5	Confident	73.5	Confident	21 Å²	21	90.4 Å²	90.4	13%	0.129	48%	0.478	C	S	.	.	H	α-helix	trans	-63.7	-43.1	175.4	-52.2	0	0	0	0	110.9	N223 A230 I231 L247	N223-T227 PolarHBondContact O-N 3.49Å; N223-T227 VanDerWaalsContact O-N 3.1Å; N223-T227 PolarHBondContact O-OG1 3.06Å; T227-A230 PolarHBondContact O-N 3.19Å; T227-I231 HydrophobicContact CG2-CD1 4.19Å; T227-I231 WeakPolarHBondContact O-CB 3.47Å; T227-I231 VanDerWaalsContact O-CG1 3.26Å; T227-I231 WeakPolarHBondContact O-CG1 3.47Å; T227-I231 PolarHBondContact O-N 3.23Å; T227-L247 PolarHBondContact OG1-O 2.73Å
228	V	85.6	Confident	76.3	Confident	96 Å²	96	80.2 Å²	80.2	58%	0.582	45%	0.445	S	S	*	.	H	α-helix	trans	-63.5	-42.2	175.7	169.6	0	0	0	0	111.5	A224 E225 I231 G232	A224-V228 WeakPolarHBondContact O-CB 3.44Å; A224-V228 WeakPolarHBondContact O-CG2 3.23Å; A224-V228 PolarHBondContact O-N 3.41Å; E225-V228 PolarHBondContact O-N 3.27Å; V228-I231 WeakPolarHBondContact O-CB 3.47Å; V228-I231 PolarHBondContact O-N 2.95Å; V228-G232 PolarHBondContact O-N 3.08Å; V228-G232 VanDerWaalsContact O-N 3.1Å
229	N	86.6	Confident	79.2	Confident	98 Å²	98	70.5 Å²	70.5	52%	0.524	40%	0.403	S	S	.	.	H	α-helix	trans	-64.2	-42.5	176.3	-71.2	-22.2	0	0	0	111.6	E225 E226 I231 G232	E225-N229 WeakPolarHBondContact O-CB 3.43Å; E225-N229 PolarHBondContact O-N 2.76Å; E225-N229 PolarHBondContact O-ND2 2.94Å; E226-N229 PolarHBondContact O-N 3.41Å; N229-I231 VanDerWaalsContact C-N 3.32Å; N229-I231 PolarHBondContact O-N 2.96Å; N229-G232 WeakPolarHBondContact O-CA 3.34Å; N229-G232 PolarHBondContact O-N 3.18Å
230	A	83.9	Confident	81.9	Confident	15 Å²	15	70 Å²	70	12%	0.124	40%	0.395	C	S	.	.	H	α-helix	trans	-65	-35.9	176.4	0	0	0	0	0	112.2	E226 T227 G232 E233 F244 L247	E226-A230 WeakPolarHBondContact O-CB 3.37Å; E226-A230 PolarHBondContact O-N 3.14Å; T227-A230 PolarHBondContact O-N 3.19Å; A230-G232 PolarHBondContact O-N 3.32Å; A230-E233 WeakPolarHBondContact O-CB 3.38Å; A230-E233 PolarHBondContact O-N 3.08Å; A230-E233 VanDerWaalsContact O-N 3.12Å; A230-F244 HydrophobicContact CB-CD2 3.97Å; A230-L247 HydrophobicContact CB-CD1 3.68Å
231	I	87.5	Confident	84.4	Confident	52 Å²	52	65 Å²	65	27%	0.267	36%	0.363	S	S	.	.	H	α-helix	trans	-61.1	-34.1	170.8	-74.5	167.3	0	0	0	111.5	T227 V228 N229 E233 I234 F244 T255 T259	T227-I231 HydrophobicContact CG2-CD1 4.19Å; T227-I231 WeakPolarHBondContact O-CB 3.47Å; T227-I231 VanDerWaalsContact O-CG1 3.26Å; T227-I231 WeakPolarHBondContact O-CG1 3.47Å; T227-I231 PolarHBondContact O-N 3.23Å; V228-I231 WeakPolarHBondContact O-CB 3.47Å; V228-I231 PolarHBondContact O-N 2.95Å; N229-I231 VanDerWaalsContact C-N 3.32Å; N229-I231 PolarHBondContact O-N 2.96Å; I231-E233 PolarHBondContact O-N 3.2Å; I231-I234 HydrophobicContact CB-CD1 4.38Å; I231-I234 HydrophobicContact CG1-CD1 4.44Å; I231-I234 HydrophobicContact CG2-CD1 4.14Å; I231-I234 WeakPolarHBondContact O-CB 3.26Å; I231-I234 VanDerWaalsContact O-CG1 3.29Å; I231-I234 WeakPolarHBondContact O-CG1 3.16Å; I231-I234 PolarHBondContact O-N 3.31Å; I231-F244 HydrophobicContact CG1-CE2 3.95Å; I231-F244 HydrophobicContact CG1-CZ 4.5Å; I231-T255 HydrophobicContact CD1-CG2 4.29Å; I231-T255 HydrophobicContact CG1-CG2 4.47Å; I231-T259 HydrophobicContact CG2-CG2 4Å
232	G	89.3	Confident	86.8	Confident	53 Å²	53	58.8 Å²	58.8	55%	0.546	32%	0.324	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.9	-13.9	175.3	0	0	0	0	0	114.7	V228 N229 A230	V228-G232 PolarHBondContact O-N 3.08Å; V228-G232 VanDerWaalsContact O-N 3.1Å; N229-G232 WeakPolarHBondContact O-CA 3.34Å; N229-G232 PolarHBondContact O-N 3.18Å; A230-G232 PolarHBondContact O-N 3.32Å
233	E	91.4	Very high	88.7	Confident	71 Å²	71	60.4 Å²	60.4	33%	0.332	33%	0.325	S	S	.	.	T	Hydrogen-bonded Turn	trans	-95.7	-1.1	179.3	-60.1	-74.2	132.8	0	0	112.8	A230 I231 D235 R236 M239	A230-E233 WeakPolarHBondContact O-CB 3.38Å; A230-E233 PolarHBondContact O-N 3.08Å; A230-E233 VanDerWaalsContact O-N 3.12Å; I231-E233 PolarHBondContact O-N 3.2Å; E233-D235 PolarHBondContact O-N 2.85Å; E233-D235 VanDerWaalsContact O-N 3.08Å; E233-R236 PolarHBondContact O-N 3.42Å; E233-R236 IonicContact OE1-CZ 3.86Å; E233-R236 VanDerWaalsContact OE1-CZ 3.23Å; E233-R236 IonicContact OE1-NE 2.66Å; E233-R236 IonicContact OE1-NH1 3.82Å; E233-R236 PolarHBondContact OE1-NH1 2.94Å; E233-R236 IonicContact OE1-NH2 3.85Å; E233-R236 VanDerWaalsContact OE2-CD 3.28Å; E233-R236 WeakPolarHBondContact OE2-CD 3.27Å; E233-R236 IonicContact OE2-CZ 2.95Å; E233-R236 IonicContact OE2-NE 3.17Å; E233-R236 IonicContact OE2-NH1 2.66Å; E233-R236 PolarHBondContact OE2-NH1 3.46Å; E233-M239 HydrophobicContact CB-CG 4.34Å
234	I	94.8	Very high	89.9	Confident	1 Å²	1	56.7 Å²	56.7	1%	0.005	31%	0.306	C	S	.	.	T	Hydrogen-bonded Turn	trans	-58.2	-23.9	-179	-73.8	175	0	0	0	112.9	I231 R236 M239 F244 V256 T259 V260 Q304	I231-I234 HydrophobicContact CB-CD1 4.38Å; I231-I234 HydrophobicContact CG1-CD1 4.44Å; I231-I234 HydrophobicContact CG2-CD1 4.14Å; I231-I234 WeakPolarHBondContact O-CB 3.26Å; I231-I234 VanDerWaalsContact O-CG1 3.29Å; I231-I234 WeakPolarHBondContact O-CG1 3.16Å; I231-I234 PolarHBondContact O-N 3.31Å; I234-R236 VanDerWaalsContact C-N 3.33Å; I234-M239 HydrophobicContact CB-SD 4.49Å; I234-M239 HydrophobicContact CG1-SD 3.81Å; I234-F244 HydrophobicContact CD1-CE2 4.36Å; I234-F244 HydrophobicContact CD1-CZ 4.31Å; I234-V256 HydrophobicContact CD1-CG2 4.29Å; I234-V256 HydrophobicContact CG1-CG2 4.44Å; I234-V256 HydrophobicContact CG2-CG2 4.44Å; I234-T259 HydrophobicContact CD1-CG2 3.71Å; I234-V260 HydrophobicContact CG2-CG2 3.88Å; I234-Q304 HydrophobicContact CG2-CG 4.34Å; I234-Q304 PolarHBondContact O-NE2 3.46Å
235	D	95	Very high	90.9	Very high	96 Å²	96	54.4 Å²	54.4	51%	0.513	28%	0.283	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.6	0.7	-178.8	-57.4	-25.7	0	0	0	113.1	E233 H307	E233-D235 PolarHBondContact O-N 2.85Å; E233-D235 VanDerWaalsContact O-N 3.08Å; D235-H307 IonicContact OD1-CD2 3.34Å; D235-H307 IonicContact OD1-CE1 2.86Å; D235-H307 IonicContact OD1-NE2 4Å; D235-H307 PolarHBondContact OD1-NE2 3.49Å
236	R	94.9	Very high	91.6	Very high	145 Å²	145	55.2 Å²	55.2	55%	0.547	28%	0.28	S	S	.	.	S	Bend	trans	-104.4	139.9	-174.9	-63.1	-168.8	-177.6	157.9	1.6	113.8	E233 I234 G238 M239 Q304	E233-R236 PolarHBondContact O-N 3.42Å; E233-R236 IonicContact OE1-CZ 3.86Å; E233-R236 VanDerWaalsContact OE1-CZ 3.23Å; E233-R236 IonicContact OE1-NE 2.66Å; E233-R236 IonicContact OE1-NH1 3.82Å; E233-R236 PolarHBondContact OE1-NH1 2.94Å; E233-R236 IonicContact OE1-NH2 3.85Å; E233-R236 VanDerWaalsContact OE2-CD 3.28Å; E233-R236 WeakPolarHBondContact OE2-CD 3.27Å; E233-R236 IonicContact OE2-CZ 2.95Å; E233-R236 IonicContact OE2-NE 3.17Å; E233-R236 IonicContact OE2-NH1 2.66Å; E233-R236 PolarHBondContact OE2-NH1 3.46Å; I234-R236 VanDerWaalsContact C-N 3.33Å; R236-G238 PolarHBondContact O-N 3.37Å; R236-M239 PolarHBondContact O-N 3.49Å; R236-Q304 PolarHBondContact O-NE2 2.78Å
237	W	93.2	Very high	92.1	Very high	57 Å²	57	51.9 Å²	51.9	22%	0.216	27%	0.265	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65.9	118.2	167.5	-163.3	-96.2	0	0	0	109.2	T305 V308 M309 S457 I529	W237-T305 HydrophobicContact CE3-CG2 4.24Å; W237-T305 HydrophobicContact CH2-CG2 3.41Å; W237-T305 VanDerWaalsContact CH2-CG2 3.41Å; W237-T305 HydrophobicContact CZ2-CG2 4.25Å; W237-T305 HydrophobicContact CZ3-CG2 3.41Å; W237-T305 VanDerWaalsContact CZ3-CG2 3.41Å; W237-V308 HydrophobicContact CB-CG1 4.43Å; W237-V308 HydrophobicContact CE3-CB 4.31Å; W237-V308 HydrophobicContact CE3-CG1 3.9Å; W237-M309 HydrophobicContact CH2-CG 4.3Å; W237-M309 HydrophobicContact CH2-SD 4.43Å; W237-M309 HydrophobicContact CZ3-CG 3.7Å; W237-M309 HydrophobicContact CZ3-SD 4.36Å; W237-S457 WeakPolarHBondContact CZ2-OG 3.4Å; W237-S457 PolarHBondContact NE1-O 2.64Å; W237-I529 HydrophobicContact CD2-CD1 3.74Å; W237-I529 HydrophobicContact CD2-CG1 3.79Å; W237-I529 HydrophobicContact CE3-CD1 3.7Å; W237-I529 HydrophobicContact CE3-CG1 4.29Å; W237-I529 HydrophobicContact CG-CD1 4.48Å; W237-I529 HydrophobicContact CG-CG1 4.12Å; W237-I529 HydrophobicContact CH2-CD1 3.72Å; W237-I529 HydrophobicContact CH2-CG1 4.47Å; W237-I529 HydrophobicContact CH2-CG2 4.29Å; W237-I529 HydrophobicContact CZ2-CB 4.37Å; W237-I529 HydrophobicContact CZ2-CD1 3.75Å; W237-I529 HydrophobicContact CZ2-CG1 3.99Å; W237-I529 HydrophobicContact CZ2-CG2 3.48Å; W237-I529 VanDerWaalsContact CZ2-CG2 3.48Å; W237-I529 HydrophobicContact CZ3-CD1 3.69Å
238	G	92.9	Very high	92.6	Very high	17 Å²	17	51.4 Å²	51.4	18%	0.175	26%	0.262	C	S	.	.	T	Hydrogen-bonded Turn	trans	92.6	27.4	-177.6	0	0	0	0	0	115.6	R236 D240	R236-G238 PolarHBondContact O-N 3.37Å; G238-D240 PolarHBondContact O-N 3.31Å
239	M	95.2	Very high	92.8	Very high	8 Å²	8	50.2 Å²	50.2	4%	0.039	25%	0.253	C	S	.	.			trans	-50.8	130.3	163.8	-177.1	-173.3	73.3	0	0	109.6	E233 I234 R236 V241 F244 Q304	E233-M239 HydrophobicContact CB-CG 4.34Å; I234-M239 HydrophobicContact CB-SD 4.49Å; I234-M239 HydrophobicContact CG1-SD 3.81Å; R236-M239 PolarHBondContact O-N 3.49Å; M239-V241 VanDerWaalsContact C-N 3.28Å; M239-V241 HydrophobicContact CE-CB 4.44Å; M239-V241 HydrophobicContact CE-CG2 4.48Å; M239-V241 PolarHBondContact O-N 3.43Å; M239-F244 HydrophobicContact CE-CB 4.32Å; M239-F244 HydrophobicContact CE-CD1 4.2Å; M239-F244 HydrophobicContact CE-CG 4.12Å; M239-F244 HydrophobicContact SD-CD2 4.22Å; M239-F244 HydrophobicContact SD-CG 4.33Å; M239-Q304 HydrophobicContact CE-CB 4.09Å; M239-Q304 HydrophobicContact CE-CG 3.69Å; M239-Q304 HydrophobicContact SD-CG 4.09Å
240	D	96.3	Very high	93	Very high	61 Å²	61	48.9 Å²	48.9	33%	0.326	25%	0.251	S	S	.	.			trans	-70.7	86.6	175.5	-177.5	-12.2	0	0	0	110.1	G238 F242 K243 F244 L462	G238-D240 PolarHBondContact O-N 3.31Å; D240-F242 PolarHBondContact O-N 3.15Å; D240-F242 PolarHBondContact OD1-N 3.05Å; D240-K243 HydrophobicContact CB-CB 4.01Å; D240-K243 PolarHBondContact O-N 3.14Å; D240-K243 WeakPolarHBondContact OD1-CB 3.32Å; D240-K243 PolarHBondContact OD1-N 3.01Å; D240-K243 VanDerWaalsContact OD2-CB 3.28Å; D240-K243 WeakPolarHBondContact OD2-CB 3.24Å; D240-F244 WeakPolarHBondContact O-CB 3.42Å; D240-F244 PolarHBondContact O-N 2.91Å; D240-L462 HydrophobicContact CB-CD2 4.11Å
241	V	96.7	Very high	93.6	Very high	1 Å²	1	51 Å²	51	1%	0.006	26%	0.258	C	S	.	.	H	α-helix	trans	-62.9	-30	-177.5	67.8	0	0	0	0	112.4	M239 F244 H245 I297 T300 D301 W466	M239-V241 VanDerWaalsContact C-N 3.28Å; M239-V241 HydrophobicContact CE-CB 4.44Å; M239-V241 HydrophobicContact CE-CG2 4.48Å; M239-V241 PolarHBondContact O-N 3.43Å; V241-F244 PolarHBondContact O-N 3.07Å; V241-H245 WeakPolarHBondContact O-CB 3.34Å; V241-H245 PolarHBondContact O-N 2.82Å; V241-I297 HydrophobicContact CG1-CG2 4.13Å; V241-I297 HydrophobicContact CG2-CG2 3.95Å; V241-T300 HydrophobicContact CG2-CG2 3.63Å; V241-D301 HydrophobicContact CB-CB 4.44Å; V241-D301 HydrophobicContact CG1-CB 4.24Å; V241-D301 HydrophobicContact CG2-CB 4.15Å; V241-W466 HydrophobicContact CG1-CZ2 3.68Å
242	F	96.6	Very high	94	Very high	3 Å²	3	48.5 Å²	48.5	1%	0.013	25%	0.245	C	C	.	.	H	α-helix	trans	-71	-43.5	176.9	-58.2	-65.9	0	0	0	111.3	D240 H245 R246 I297 L462 Q465 W466	D240-F242 PolarHBondContact O-N 3.15Å; D240-F242 PolarHBondContact OD1-N 3.05Å; F242-H245 PolarHBondContact O-N 3.45Å; F242-R246 WeakPolarHBondContact O-CG 3.47Å; F242-R246 PolarHBondContact O-N 3.21Å; F242-R246 PolarHBondContact O-NH1 2.71Å; F242-I297 HydrophobicContact CD1-CG2 3.9Å; F242-I297 HydrophobicContact CE1-CG2 3.95Å; F242-L462 HydrophobicContact CD2-CD2 3.86Å; F242-L462 HydrophobicContact CE2-CD2 4.25Å; F242-Q465 HydrophobicContact CD2-CB 4.17Å; F242-Q465 HydrophobicContact CE2-CB 3.49Å; F242-Q465 VanDerWaalsContact CE2-CB 3.49Å; F242-Q465 HydrophobicContact CE2-CG 4.32Å; F242-Q465 HydrophobicContact CZ-CB 3.82Å; F242-W466 HydrophobicContact CE1-CD2 4.43Å; F242-W466 HydrophobicContact CE1-CE3 4.36Å; F242-W466 AromaticContact CE1-CH2 3.93Å; F242-W466 HydrophobicContact CE1-CH2 3.93Å; F242-W466 HydrophobicContact CE1-CZ2 4.03Å; F242-W466 HydrophobicContact CE1-CZ3 4.12Å; F242-W466 HydrophobicContact CE2-CD2 4.4Å; F242-W466 AromaticContact CZ-CD2 3.61Å; F242-W466 HydrophobicContact CZ-CD2 3.61Å; F242-W466 AromaticContact CZ-CE2 3.53Å; F242-W466 AromaticContact CZ-CE3 3.91Å; F242-W466 HydrophobicContact CZ-CE3 3.91Å; F242-W466 HydrophobicContact CZ-CG 4.14Å; F242-W466 HydrophobicContact CZ-CH2 4.01Å; F242-W466 AromaticContact CZ-CZ2 3.76Å; F242-W466 HydrophobicContact CZ-CZ2 3.76Å; F242-W466 HydrophobicContact CZ-CZ3 4.1Å
243	K	94.8	Very high	94.5	Very high	99 Å²	99	46 Å²	46	43%	0.43	22%	0.22	S	C	.	.	H	α-helix	trans	-63.6	-44.2	171.6	-178.8	-177.9	177.1	-176.2	0	110.8	D240 H245 R246 L247	D240-K243 HydrophobicContact CB-CB 4.01Å; D240-K243 PolarHBondContact O-N 3.14Å; D240-K243 WeakPolarHBondContact OD1-CB 3.32Å; D240-K243 PolarHBondContact OD1-N 3.01Å; D240-K243 VanDerWaalsContact OD2-CB 3.28Å; D240-K243 WeakPolarHBondContact OD2-CB 3.24Å; K243-H245 VanDerWaalsContact C-N 3.32Å; K243-H245 PolarHBondContact O-N 2.88Å; K243-R246 PolarHBondContact O-N 2.65Å; K243-L247 HydrophobicContact CG-CD1 3.99Å; K243-L247 HydrophobicContact CG-CG 4.41Å; K243-L247 WeakPolarHBondContact O-CG 3.36Å; K243-L247 PolarHBondContact O-N 3.21Å
244	F	95.4	Very high	94.8	Very high	2 Å²	2	43.1 Å²	43.1	1%	0.009	21%	0.206	C	C	.	.	H	α-helix	trans	-57.3	-44.7	177.1	-175.2	-100.6	0	0	0	111.7	A230 I231 I234 M239 D240 V241 R246 L247 C248 T255 V256 T300	A230-F244 HydrophobicContact CB-CD2 3.97Å; I231-F244 HydrophobicContact CG1-CE2 3.95Å; I231-F244 HydrophobicContact CG1-CZ 4.5Å; I234-F244 HydrophobicContact CD1-CE2 4.36Å; I234-F244 HydrophobicContact CD1-CZ 4.31Å; M239-F244 HydrophobicContact CE-CB 4.32Å; M239-F244 HydrophobicContact CE-CD1 4.2Å; M239-F244 HydrophobicContact CE-CG 4.12Å; M239-F244 HydrophobicContact SD-CD2 4.22Å; M239-F244 HydrophobicContact SD-CG 4.33Å; D240-F244 WeakPolarHBondContact O-CB 3.42Å; D240-F244 PolarHBondContact O-N 2.91Å; V241-F244 PolarHBondContact O-N 3.07Å; F244-R246 PolarHBondContact O-N 2.98Å; F244-L247 PolarHBondContact O-N 3.18Å; F244-C248 WeakPolarHBondContact O-CB 3.39Å; F244-C248 PolarHBondContact O-N 3.13Å; F244-C248 PolarHBondContact O-SG 3.02Å; F244-T255 HydrophobicContact CE1-CG2 4.49Å; F244-T255 HydrophobicContact CZ-CG2 3.79Å; F244-V256 HydrophobicContact CE1-CB 4.08Å; F244-V256 HydrophobicContact CZ-CB 4.41Å; F244-T300 HydrophobicContact CD1-CG2 4.16Å; F244-T300 HydrophobicContact CE1-CG2 4.29Å
245	H	95.3	Very high	94.9	Very high	22 Å²	22	44.7 Å²	44.7	10%	0.102	22%	0.216	C	C	.	.	H	α-helix	trans	-59.8	-43.4	175.8	-176.2	84.5	0	0	0	113.7	V241 F242 K243 L247 C248 S250 S252 I297	V241-H245 WeakPolarHBondContact O-CB 3.34Å; V241-H245 PolarHBondContact O-N 2.82Å; F242-H245 PolarHBondContact O-N 3.45Å; K243-H245 VanDerWaalsContact C-N 3.32Å; K243-H245 PolarHBondContact O-N 2.88Å; H245-L247 PolarHBondContact O-N 3.49Å; H245-C248 PolarHBondContact O-N 2.82Å; H245-S250 WeakPolarHBondContact CE1-CA 3.39Å; H245-S250 WeakPolarHBondContact NE2-CB 3.32Å; H245-S250 PolarHBondContact NE2-OG 3.07Å; H245-S250 PolarHBondContact O-N 3.36Å; H245-S250 VanDerWaalsContact O-N 3.16Å; H245-S252 PolarHBondContact ND1-OG 3.23Å; H245-I297 HydrophobicContact CB-CD1 4.46Å; H245-I297 HydrophobicContact CB-CG1 4.27Å
246	R	94.6	Very high	95	Very high	154 Å²	154	40.1 Å²	40.1	58%	0.581	19%	0.192	S	C	*	.	H	α-helix	trans	-63.4	-40.3	174.5	-68	-172.3	-61.4	-89	3.2	112.3	F242 K243 F244 C248 D249	F242-R246 WeakPolarHBondContact O-CG 3.47Å; F242-R246 PolarHBondContact O-N 3.21Å; F242-R246 PolarHBondContact O-NH1 2.71Å; K243-R246 PolarHBondContact O-N 2.65Å; F244-R246 PolarHBondContact O-N 2.98Å; R246-C248 VanDerWaalsContact C-N 3.28Å; R246-C248 PolarHBondContact O-N 3.1Å; R246-D249 PolarHBondContact O-N 3.39Å
247	L	93.5	Very high	95.2	Very high	17 Å²	17	33.3 Å²	33.3	9%	0.089	17%	0.166	C	C	.	.	H	α-helix	trans	-72	-21	179.8	-69.6	174.8	0	0	0	113.6	T222 E226 T227 A230 K243 F244 H245	T222-L247 WeakPolarHBondContact CG2-O 3.26Å; E226-L247 HydrophobicContact CB-CD1 4.27Å; E226-L247 HydrophobicContact CB-CD2 3.87Å; T227-L247 PolarHBondContact OG1-O 2.73Å; A230-L247 HydrophobicContact CB-CD1 3.68Å; K243-L247 HydrophobicContact CG-CD1 3.99Å; K243-L247 HydrophobicContact CG-CG 4.41Å; K243-L247 WeakPolarHBondContact O-CG 3.36Å; K243-L247 PolarHBondContact O-N 3.21Å; F244-L247 PolarHBondContact O-N 3.18Å; H245-L247 PolarHBondContact O-N 3.49Å
248	C	91.8	Very high	95.4	Very high	12 Å²	12	32.5 Å²	32.5	8%	0.081	16%	0.164	C	C	.	.	T	Hydrogen-bonded Turn	trans	-96.6	14.1	178.3	-61	0	0	0	0	113.4	F244 H245 R246 S250 H251	F244-C248 WeakPolarHBondContact O-CB 3.39Å; F244-C248 PolarHBondContact O-N 3.13Å; F244-C248 PolarHBondContact O-SG 3.02Å; H245-C248 PolarHBondContact O-N 2.82Å; R246-C248 VanDerWaalsContact C-N 3.28Å; R246-C248 PolarHBondContact O-N 3.1Å; C248-S250 VanDerWaalsContact C-N 3.26Å; C248-S250 PolarHBondContact O-N 3.39Å; C248-H251 WeakPolarHBondContact O-CB 3.29Å; C248-H251 PolarHBondContact O-N 2.99Å
249	D	90.3	Very high	95.6	Very high	71 Å²	71	32.4 Å²	32.4	38%	0.38	16%	0.161	S	C	.	.	T	Hydrogen-bonded Turn	trans	51.8	45.2	-178.8	-163.6	38.7	0	0	0	112.2	S219 R246 H251	S219-D249 WeakPolarHBondContact CB-OD2 3.31Å; R246-D249 PolarHBondContact O-N 3.39Å; D249-H251 PolarHBondContact O-CD2 2.89Å; D249-H251 VanDerWaalsContact O-CD2 3.27Å; D249-H251 PolarHBondContact O-N 3.31Å
250	S	90.2	Very high	95.8	Very high	69 Å²	69	32 Å²	32	48%	0.483	16%	0.159	S	C	.	.	T	Hydrogen-bonded Turn	trans	64.7	17	-176.7	-66.6	0	0	0	0	116.6	H245 C248	H245-S250 WeakPolarHBondContact CE1-CA 3.39Å; H245-S250 WeakPolarHBondContact NE2-CB 3.32Å; H245-S250 PolarHBondContact NE2-OG 3.07Å; H245-S250 PolarHBondContact O-N 3.36Å; H245-S250 VanDerWaalsContact O-N 3.16Å; C248-S250 VanDerWaalsContact C-N 3.26Å; C248-S250 PolarHBondContact O-N 3.39Å
251	H	95.2	Very high	95.8	Very high	60 Å²	60	29.3 Å²	29.3	28%	0.278	14%	0.144	S	C	.	.			trans	-107	40.5	173.7	-65.5	-66.8	0	0	0	113.6	L216 C248 D249 T255 E285	L216-H251 WeakPolarHBondContact CD2-NE2 3.49Å; C248-H251 WeakPolarHBondContact O-CB 3.29Å; C248-H251 PolarHBondContact O-N 2.99Å; D249-H251 PolarHBondContact O-CD2 2.89Å; D249-H251 VanDerWaalsContact O-CD2 3.27Å; D249-H251 PolarHBondContact O-N 3.31Å; H251-T255 VanDerWaalsContact O-CB 3.31Å; H251-T255 WeakPolarHBondContact O-CB 3.4Å; H251-T255 PolarHBondContact O-N 2.81Å; H251-T255 PolarHBondContact O-OG1 3.33Å; H251-E285 WeakPolarHBondContact CA-OE1 3.44Å; H251-E285 VanDerWaalsContact CA-OE2 3.25Å; H251-E285 WeakPolarHBondContact CA-OE2 3.4Å; H251-E285 IonicContact CG-OE2 3.45Å; H251-E285 IonicContact ND1-OE2 3.9Å; H251-E285 PolarHBondContact ND1-OE2 2.9Å
252	S	97.1	Very high	95.9	Very high	0 Å²	0	35.6 Å²	35.6	0%	0	17%	0.171	C	C	.	.	H	α-helix	trans	-66.2	-39.8	-175.8	52.8	0	0	0	0	113.3	H245 T255 V256 E285 T300	H245-S252 PolarHBondContact ND1-OG 3.23Å; S252-T255 PolarHBondContact O-N 3.34Å; S252-V256 WeakPolarHBondContact O-CB 3.39Å; S252-V256 WeakPolarHBondContact O-CG1 3.46Å; S252-V256 PolarHBondContact O-N 3.4Å; S252-E285 PolarHBondContact N-OE1 2.98Å; S252-T300 WeakPolarHBondContact CB-OG1 3.31Å; S252-T300 PolarHBondContact OG-OG1 3.31Å
253	L	98.4	Very high	95.8	Very high	1 Å²	1	39.9 Å²	39.9	1%	0.005	19%	0.194	C	C	.	.	H	α-helix	trans	-67.6	-44.8	-177.2	179	61.4	0	0	0	109.9	T255 T257 L284 E285 Y288 A299 T300 A332	L253-T255 VanDerWaalsContact C-N 3.35Å; L253-T255 PolarHBondContact O-N 3.25Å; L253-T257 VanDerWaalsContact O-CB 3.24Å; L253-T257 WeakPolarHBondContact O-CB 3.34Å; L253-T257 PolarHBondContact O-N 3.07Å; L253-T257 PolarHBondContact O-OG1 2.91Å; L253-L284 HydrophobicContact CD2-CD2 4.34Å; L253-L284 HydrophobicContact CD2-CG 4.31Å; L253-E285 HydrophobicContact CB-CB 4.45Å; L253-E285 HydrophobicContact CB-CG 4.13Å; L253-E285 VanDerWaalsContact CB-OE1 3.31Å; L253-E285 WeakPolarHBondContact CB-OE1 3.42Å; L253-E285 HydrophobicContact CD2-CB 4.39Å; L253-E285 PolarHBondContact N-OE1 2.94Å; L253-Y288 HydrophobicContact CD2-CD2 3.74Å; L253-Y288 HydrophobicContact CD2-CE2 3.49Å; L253-Y288 VanDerWaalsContact CD2-CE2 3.49Å; L253-A299 HydrophobicContact CD1-CB 3.88Å; L253-A299 HydrophobicContact CD2-CB 4.01Å; L253-T300 VanDerWaalsContact CA-OG1 3.28Å; L253-T300 WeakPolarHBondContact CA-OG1 3.49Å; L253-T300 PolarHBondContact N-OG1 2.76Å; L253-A332 HydrophobicContact CD1-CB 4.03Å
254	T	98.3	Very high	95.9	Very high	9 Å²	9	38 Å²	38	6%	0.055	18%	0.184	C	C	.	.	H	α-helix	trans	-57.9	-49.3	173.3	-62.7	0	0	0	0	110.7	F258 L278 L281 L282 E285	T254-F258 WeakPolarHBondContact O-CB 3.28Å; T254-F258 PolarHBondContact O-N 2.97Å; T254-L278 HydrophobicContact CG2-CD2 4.19Å; T254-L281 HydrophobicContact CG2-CB 3.92Å; T254-L281 HydrophobicContact CG2-CD1 4.49Å; T254-L281 PolarHBondContact OG1-O 3.25Å; T254-L282 HydrophobicContact CG2-CD2 4.22Å; T254-L282 HydrophobicContact CG2-CG 4.31Å; T254-E285 VanDerWaalsContact CB-OE2 3.25Å; T254-E285 WeakPolarHBondContact CB-OE2 3.41Å; T254-E285 PolarHBondContact N-OE2 3.49Å; T254-E285 PolarHBondContact OG1-OE2 3.11Å
255	T	97.3	Very high	96	Very high	34 Å²	34	38.7 Å²	38.7	21%	0.209	19%	0.192	C	C	.	.	H	α-helix	trans	-66.2	-45.9	-175.1	-56.1	0	0	0	0	112.1	I231 F244 H251 S252 L253 T259	I231-T255 HydrophobicContact CD1-CG2 4.29Å; I231-T255 HydrophobicContact CG1-CG2 4.47Å; F244-T255 HydrophobicContact CE1-CG2 4.49Å; F244-T255 HydrophobicContact CZ-CG2 3.79Å; H251-T255 VanDerWaalsContact O-CB 3.31Å; H251-T255 WeakPolarHBondContact O-CB 3.4Å; H251-T255 PolarHBondContact O-N 2.81Å; H251-T255 PolarHBondContact O-OG1 3.33Å; S252-T255 PolarHBondContact O-N 3.34Å; L253-T255 VanDerWaalsContact C-N 3.35Å; L253-T255 PolarHBondContact O-N 3.25Å; T255-T259 VanDerWaalsContact O-CB 3.24Å; T255-T259 WeakPolarHBondContact O-CB 3.46Å; T255-T259 PolarHBondContact O-N 3.08Å; T255-T259 PolarHBondContact O-OG1 2.89Å
256	V	97.8	Very high	96.1	Very high	0 Å²	0	37.7 Å²	37.7	0%	0	19%	0.188	C	C	.	.	H	α-helix	trans	-68.4	-45.8	-178.7	76.1	0	0	0	0	111.1	I234 F244 S252 F258 T259 V260 T300 T303 Q304	I234-V256 HydrophobicContact CD1-CG2 4.29Å; I234-V256 HydrophobicContact CG1-CG2 4.44Å; I234-V256 HydrophobicContact CG2-CG2 4.44Å; F244-V256 HydrophobicContact CE1-CB 4.08Å; F244-V256 HydrophobicContact CZ-CB 4.41Å; S252-V256 WeakPolarHBondContact O-CB 3.39Å; S252-V256 WeakPolarHBondContact O-CG1 3.46Å; S252-V256 PolarHBondContact O-N 3.4Å; V256-F258 PolarHBondContact O-N 3.2Å; V256-T259 PolarHBondContact O-N 2.68Å; V256-V260 HydrophobicContact CG2-CG2 4.19Å; V256-V260 VanDerWaalsContact O-CB 3.31Å; V256-V260 WeakPolarHBondContact O-CB 3.45Å; V256-V260 VanDerWaalsContact O-CG2 3.27Å; V256-V260 WeakPolarHBondContact O-CG2 3.37Å; V256-V260 PolarHBondContact O-N 3.49Å; V256-T300 HydrophobicContact CB-CG2 4.04Å; V256-T300 HydrophobicContact CG1-CG2 3.59Å; V256-T303 HydrophobicContact CG1-CG2 4.3Å; V256-Q304 HydrophobicContact CG2-CB 3.81Å; V256-Q304 HydrophobicContact CG2-CG 4.18Å
257	T	98.5	Very high	96.3	Very high	3 Å²	3	31.3 Å²	31.3	2%	0.018	17%	0.165	C	C	.	.	H	α-helix	trans	-64.7	-46.2	-176.9	-52.2	0	0	0	0	110.4	L253 T259 V260 M261 L281 I328 A332	L253-T257 VanDerWaalsContact O-CB 3.24Å; L253-T257 WeakPolarHBondContact O-CB 3.34Å; L253-T257 PolarHBondContact O-N 3.07Å; L253-T257 PolarHBondContact O-OG1 2.91Å; T257-T259 VanDerWaalsContact C-N 3.35Å; T257-T259 PolarHBondContact O-N 2.95Å; T257-V260 PolarHBondContact O-N 3.26Å; T257-M261 HydrophobicContact CG2-CG 4.49Å; T257-M261 HydrophobicContact CG2-SD 4.04Å; T257-M261 WeakPolarHBondContact O-CB 3.41Å; T257-M261 VanDerWaalsContact O-CG 3.24Å; T257-M261 WeakPolarHBondContact O-CG 3.36Å; T257-M261 PolarHBondContact O-N 2.6Å; T257-L281 HydrophobicContact CG2-CD1 4.25Å; T257-L281 HydrophobicContact CG2-CD2 3.67Å; T257-I328 HydrophobicContact CG2-CG2 4.48Å; T257-A332 HydrophobicContact CG2-CB 4.15Å
258	F	98.1	Very high	96.5	Very high	39 Å²	39	40.5 Å²	40.5	17%	0.171	20%	0.198	C	C	.	.	H	α-helix	trans	-58.9	-46.7	175.8	-175.5	-85.9	0	0	0	111.9	T254 V256 M261 K262 I267 T274 L277 L278 L281	T254-F258 WeakPolarHBondContact O-CB 3.28Å; T254-F258 PolarHBondContact O-N 2.97Å; V256-F258 PolarHBondContact O-N 3.2Å; F258-M261 PolarHBondContact O-N 3.44Å; F258-K262 HydrophobicContact CE1-CD 4.2Å; F258-K262 VanDerWaalsContact O-CB 3.29Å; F258-K262 WeakPolarHBondContact O-CB 3.28Å; F258-K262 PolarHBondContact O-N 3.2Å; F258-I267 HydrophobicContact CE2-CD1 4.33Å; F258-I267 HydrophobicContact CZ-CD1 4.43Å; F258-T274 HydrophobicContact CE2-CG2 3.42Å; F258-T274 VanDerWaalsContact CE2-CG2 3.42Å; F258-T274 HydrophobicContact CZ-CG2 3.45Å; F258-T274 VanDerWaalsContact CZ-CG2 3.45Å; F258-L277 HydrophobicContact CD2-CD2 3.83Å; F258-L277 HydrophobicContact CD2-CG 4.23Å; F258-L277 HydrophobicContact CE2-CD2 4.21Å; F258-L278 HydrophobicContact CD2-CD2 3.59Å; F258-L278 HydrophobicContact CD2-CG 3.98Å; F258-L278 HydrophobicContact CE2-CD1 4.27Å; F258-L278 HydrophobicContact CE2-CD2 3.87Å; F258-L278 HydrophobicContact CE2-CG 3.85Å; F258-L278 HydrophobicContact CG-CD2 4.21Å; F258-L281 HydrophobicContact CB-CD1 4.07Å
259	T	97.3	Very high	96.7	Very high	16 Å²	16	45.1 Å²	45.1	10%	0.098	22%	0.219	C	C	.	.	H	α-helix	trans	-66.2	-45.2	-177.9	-59.6	0	0	0	0	111.5	I231 I234 T255 V256 T257 M261 K262 N263	I231-T259 HydrophobicContact CG2-CG2 4Å; I234-T259 HydrophobicContact CD1-CG2 3.71Å; T255-T259 VanDerWaalsContact O-CB 3.24Å; T255-T259 WeakPolarHBondContact O-CB 3.46Å; T255-T259 PolarHBondContact O-N 3.08Å; T255-T259 PolarHBondContact O-OG1 2.89Å; V256-T259 PolarHBondContact O-N 2.68Å; T257-T259 VanDerWaalsContact C-N 3.35Å; T257-T259 PolarHBondContact O-N 2.95Å; T259-M261 PolarHBondContact O-N 3.25Å; T259-K262 PolarHBondContact O-N 3.4Å; T259-N263 WeakPolarHBondContact O-CB 3.38Å; T259-N263 VanDerWaalsContact O-CG 3.26Å; T259-N263 PolarHBondContact O-N 2.75Å; T259-N263 PolarHBondContact O-OD1 3.35Å
260	V	97.7	Very high	97.1	Very high	0 Å²	0	42.1 Å²	42.1	0%	0	20%	0.203	C	C	.	.	H	α-helix	trans	-59.2	-48.2	176	161.8	0	0	0	0	111	I234 V256 T257 K262 N263 R264 H307 I328	I234-V260 HydrophobicContact CG2-CG2 3.88Å; V256-V260 HydrophobicContact CG2-CG2 4.19Å; V256-V260 VanDerWaalsContact O-CB 3.31Å; V256-V260 WeakPolarHBondContact O-CB 3.45Å; V256-V260 VanDerWaalsContact O-CG2 3.27Å; V256-V260 WeakPolarHBondContact O-CG2 3.37Å; V256-V260 PolarHBondContact O-N 3.49Å; T257-V260 PolarHBondContact O-N 3.26Å; V260-K262 VanDerWaalsContact C-N 3.3Å; V260-K262 PolarHBondContact O-N 2.75Å; V260-N263 PolarHBondContact O-N 2.74Å; V260-R264 WeakPolarHBondContact O-CB 3.27Å; V260-R264 WeakPolarHBondContact O-CG 3.27Å; V260-R264 PolarHBondContact O-N 3.35Å; V260-H307 HydrophobicContact CG1-CB 3.95Å; V260-H307 WeakPolarHBondContact CG1-ND1 3.48Å; V260-H307 HydrophobicContact CG2-CB 3.73Å; V260-I328 HydrophobicContact CG1-CD1 3.7Å; V260-I328 HydrophobicContact CG1-CG1 4.13Å; V260-I328 HydrophobicContact CG1-CG2 3.88Å
261	M	98.1	Very high	97.5	Very high	3 Å²	3	48.6 Å²	48.6	2%	0.015	22%	0.217	C	C	.	.	H	α-helix	trans	-63.8	-36.3	178.6	-71.3	179.9	68.2	0	0	112.3	T257 F258 T259 G265 L266 I267 I272 L277 F325 I328	T257-M261 HydrophobicContact CG2-CG 4.49Å; T257-M261 HydrophobicContact CG2-SD 4.04Å; T257-M261 WeakPolarHBondContact O-CB 3.41Å; T257-M261 VanDerWaalsContact O-CG 3.24Å; T257-M261 WeakPolarHBondContact O-CG 3.36Å; T257-M261 PolarHBondContact O-N 2.6Å; F258-M261 PolarHBondContact O-N 3.44Å; T259-M261 PolarHBondContact O-N 3.25Å; M261-G265 PolarHBondContact O-N 2.81Å; M261-L266 HydrophobicContact CG-CD1 4.48Å; M261-L266 PolarHBondContact O-N 3.42Å; M261-I267 HydrophobicContact CB-CD1 4.27Å; M261-I267 HydrophobicContact CB-CG1 3.91Å; M261-I267 PolarHBondContact O-N 2.87Å; M261-I272 HydrophobicContact CE-CD1 3.35Å; M261-L277 HydrophobicContact CE-CD1 4.04Å; M261-L277 HydrophobicContact CE-CD2 4.07Å; M261-L277 HydrophobicContact SD-CD1 3.89Å; M261-L277 HydrophobicContact SD-CD2 4.09Å; M261-F325 HydrophobicContact CE-CD2 3.78Å; M261-F325 HydrophobicContact CE-CE2 3.34Å; M261-F325 HydrophobicContact CE-CZ 4.11Å; M261-F325 HydrophobicContact SD-CE2 4.25Å; M261-I328 HydrophobicContact CG-CG2 4.26Å
262	K	97.2	Very high	97.6	Very high	133 Å²	133	46.1 Å²	46.1	58%	0.578	21%	0.205	S	C	*	.	H	α-helix	trans	-67.9	-51	175.1	-177.7	-176.8	173.3	-172	0	111.6	F258 T259 V260 R264 G265 I267	F258-K262 HydrophobicContact CE1-CD 4.2Å; F258-K262 VanDerWaalsContact O-CB 3.29Å; F258-K262 WeakPolarHBondContact O-CB 3.28Å; F258-K262 PolarHBondContact O-N 3.2Å; T259-K262 PolarHBondContact O-N 3.4Å; V260-K262 VanDerWaalsContact C-N 3.3Å; V260-K262 PolarHBondContact O-N 2.75Å; K262-R264 VanDerWaalsContact C-N 3.31Å; K262-R264 PolarHBondContact O-N 2.78Å; K262-G265 PolarHBondContact O-N 3.19Å; K262-I267 HydrophobicContact CB-CD1 3.91Å
263	N	95.6	Very high	97.6	Very high	93 Å²	93	49.8 Å²	49.8	50%	0.497	23%	0.225	S	C	.	.	H	α-helix	trans	-63.9	-37	-176.6	-72.6	0.2	0	0	0	111.7	T259 V260 G265	T259-N263 WeakPolarHBondContact O-CB 3.38Å; T259-N263 VanDerWaalsContact O-CG 3.26Å; T259-N263 PolarHBondContact O-N 2.75Å; T259-N263 PolarHBondContact O-OD1 3.35Å; V260-N263 PolarHBondContact O-N 2.74Å; N263-G265 PolarHBondContact O-N 3Å
264	R	95.6	Very high	97.5	Very high	59 Å²	59	52.8 Å²	52.8	22%	0.223	24%	0.243	C	C	.	.	T	Hydrogen-bonded Turn	trans	-77.6	-2.3	173.9	-67.8	-173.7	170.9	-65.4	-10.4	114	V260 K262 L266 H307 S311	V260-R264 WeakPolarHBondContact O-CB 3.27Å; V260-R264 WeakPolarHBondContact O-CG 3.27Å; V260-R264 PolarHBondContact O-N 3.35Å; K262-R264 VanDerWaalsContact C-N 3.31Å; K262-R264 PolarHBondContact O-N 2.78Å; R264-L266 HydrophobicContact CB-CD1 4.11Å; R264-L266 HydrophobicContact CB-CD2 4.47Å; R264-L266 HydrophobicContact CB-CG 3.83Å; R264-L266 PolarHBondContact O-N 3.05Å; R264-H307 PolarHBondContact NE-ND1 3.23Å; R264-H307 PolarHBondContact NH2-ND1 2.89Å; R264-H307 PolarHBondContact NH2-O 2.95Å; R264-S311 PolarHBondContact NH2-OG 2.79Å
265	G	97.5	Very high	97.5	Very high	17 Å²	17	57 Å²	57	18%	0.175	27%	0.269	C	S	.	.	T	Hydrogen-bonded Turn	trans	73.8	6.3	179.2	0	0	0	0	0	115.4	M261 K262 N263 I267 R268 E269	M261-G265 PolarHBondContact O-N 2.81Å; K262-G265 PolarHBondContact O-N 3.19Å; N263-G265 PolarHBondContact O-N 3Å; G265-I267 VanDerWaalsContact C-N 3.32Å; G265-I267 PolarHBondContact O-N 3.38Å; G265-R268 PolarHBondContact O-N 2.82Å; G265-R268 VanDerWaalsContact O-N 3.15Å; G265-E269 PolarHBondContact O-N 2.77Å
266	L	98	Very high	97.5	Very high	1 Å²	1	56.9 Å²	56.9	1%	0.005	27%	0.267	C	S	.	.	H	α-helix	trans	-64.8	-34.3	-173.7	-56.7	176.7	0	0	0	112.5	M261 R264 R268 E269 F270 D321 F325 I328	M261-L266 HydrophobicContact CG-CD1 4.48Å; M261-L266 PolarHBondContact O-N 3.42Å; R264-L266 HydrophobicContact CB-CD1 4.11Å; R264-L266 HydrophobicContact CB-CD2 4.47Å; R264-L266 HydrophobicContact CB-CG 3.83Å; R264-L266 PolarHBondContact O-N 3.05Å; L266-R268 VanDerWaalsContact C-N 3.3Å; L266-R268 PolarHBondContact O-N 3.3Å; L266-E269 PolarHBondContact O-N 2.87Å; L266-F270 HydrophobicContact CB-CD2 4.39Å; L266-F270 HydrophobicContact CD2-CE2 4.09Å; L266-F270 WeakPolarHBondContact O-CD2 3.42Å; L266-F270 PolarHBondContact O-N 3.38Å; L266-D321 HydrophobicContact CD2-CB 3.95Å; L266-F325 HydrophobicContact CD1-CB 4.08Å; L266-F325 HydrophobicContact CD2-CB 4.46Å; L266-I328 HydrophobicContact CD1-CD1 3.8Å
267	I	98.2	Very high	97.5	Very high	21 Å²	21	57 Å²	57	11%	0.108	27%	0.267	C	S	.	.	H	α-helix	trans	-59.2	-44.2	175.9	-60.5	179.2	0	0	0	110.5	F258 M261 K262 G265 R271 I272 L277	F258-I267 HydrophobicContact CE2-CD1 4.33Å; F258-I267 HydrophobicContact CZ-CD1 4.43Å; M261-I267 HydrophobicContact CB-CD1 4.27Å; M261-I267 HydrophobicContact CB-CG1 3.91Å; M261-I267 PolarHBondContact O-N 2.87Å; K262-I267 HydrophobicContact CB-CD1 3.91Å; G265-I267 VanDerWaalsContact C-N 3.32Å; G265-I267 PolarHBondContact O-N 3.38Å; I267-R271 WeakPolarHBondContact O-CA 3.23Å; I267-R271 PolarHBondContact O-N 3.42Å; I267-I272 HydrophobicContact CG2-CB 4.27Å; I267-I272 WeakPolarHBondContact CG2-O 3.37Å; I267-I272 PolarHBondContact O-N 3.49Å; I267-L277 HydrophobicContact CD1-CD2 3.74Å; I267-L277 HydrophobicContact CG1-CD2 3.96Å
268	R	97.7	Very high	97.5	Very high	209 Å²	209	60 Å²	60	79%	0.789	28%	0.283	S	S	*	.	H	α-helix	trans	-73.1	-46	179.9	-178.2	-179.8	63.8	-147.8	-3.8	111.1	G265 L266 F270 R271	G265-R268 PolarHBondContact O-N 2.82Å; G265-R268 VanDerWaalsContact O-N 3.15Å; L266-R268 VanDerWaalsContact C-N 3.3Å; L266-R268 PolarHBondContact O-N 3.3Å; R268-F270 PolarHBondContact O-N 2.96Å; R268-R271 PolarHBondContact O-N 2.66Å
269	E	97.7	Very high	97.4	Very high	109 Å²	109	59.9 Å²	59.9	51%	0.509	29%	0.285	S	S	.	.	H	α-helix	trans	-57.4	-48.7	-178.1	-178.4	55.1	-150.5	0	0	111.7	G265 L266 D321	G265-E269 PolarHBondContact O-N 2.77Å; L266-E269 PolarHBondContact O-N 2.87Å; E269-D321 HydrophobicContact CG-CB 4.29Å
270	F	98	Very high	97.5	Very high	9 Å²	9	59.2 Å²	59.2	4%	0.039	28%	0.281	C	S	.	.	T	Hydrogen-bonded Turn	trans	-95.2	12.7	-178.1	-59	-57.8	0	0	0	114.2	L266 R268 I272 D321 L322 F325 G385 L386	L266-F270 HydrophobicContact CB-CD2 4.39Å; L266-F270 HydrophobicContact CD2-CE2 4.09Å; L266-F270 WeakPolarHBondContact O-CD2 3.42Å; L266-F270 PolarHBondContact O-N 3.38Å; R268-F270 PolarHBondContact O-N 2.96Å; F270-I272 HydrophobicContact CB-CD1 4.16Å; F270-I272 HydrophobicContact CB-CG1 3.88Å; F270-I272 PolarHBondContact O-N 3.27Å; F270-I272 VanDerWaalsContact O-N 3.16Å; F270-D321 HydrophobicContact CE2-CB 4.06Å; F270-D321 WeakPolarHBondContact CE2-O 3.46Å; F270-D321 VanDerWaalsContact CZ-C 3.48Å; F270-D321 HydrophobicContact CZ-CB 3.83Å; F270-L322 HydrophobicContact CE1-CB 4.34Å; F270-L322 HydrophobicContact CE1-CD1 4.03Å; F270-L322 HydrophobicContact CZ-CB 3.96Å; F270-L322 HydrophobicContact CZ-CD1 4.13Å; F270-F325 HydrophobicContact CD2-CB 4.17Å; F270-F325 AromaticContact CD2-CD1 3.67Å; F270-F325 HydrophobicContact CD2-CD1 3.67Å; F270-F325 HydrophobicContact CD2-CE1 4.4Å; F270-F325 HydrophobicContact CD2-CG 4.11Å; F270-F325 HydrophobicContact CE2-CB 3.79Å; F270-F325 AromaticContact CE2-CD1 4Å; F270-F325 HydrophobicContact CE2-CD1 4Å; F270-F325 HydrophobicContact CE2-CG 4.23Å; F270-F325 HydrophobicContact CG-CD1 4.28Å; F270-G385 WeakPolarHBondContact O-CA 3.38Å; F270-L386 HydrophobicContact CB-CD2 3.82Å; F270-L386 HydrophobicContact CD1-CD2 3.22Å; F270-L386 HydrophobicContact CE1-CD2 3.98Å; F270-L386 HydrophobicContact CG-CD2 3.66Å
271	R	97.7	Very high	97.5	Very high	205 Å²	205	59.4 Å²	59.4	77%	0.774	28%	0.282	S	S	*	.	T	Hydrogen-bonded Turn	trans	50.2	40.3	177.7	-54.4	177	-174.8	168.6	1.5	112.7	I267 R268 N273	I267-R271 WeakPolarHBondContact O-CA 3.23Å; I267-R271 PolarHBondContact O-N 3.42Å; R268-R271 PolarHBondContact O-N 2.66Å; R271-N273 PolarHBondContact O-N 2.86Å
272	I	97.8	Very high	97.5	Very high	7 Å²	7	61.2 Å²	61.2	4%	0.036	29%	0.292	C	S	.	.			trans	-72.9	124	-177.1	-55.2	178.4	0	0	0	108.2	M261 I267 F270 T274 L277 F325 I382	M261-I272 HydrophobicContact CE-CD1 3.35Å; I267-I272 HydrophobicContact CG2-CB 4.27Å; I267-I272 WeakPolarHBondContact CG2-O 3.37Å; I267-I272 PolarHBondContact O-N 3.49Å; F270-I272 HydrophobicContact CB-CD1 4.16Å; F270-I272 HydrophobicContact CB-CG1 3.88Å; F270-I272 PolarHBondContact O-N 3.27Å; F270-I272 VanDerWaalsContact O-N 3.16Å; I272-T274 PolarHBondContact O-N 3.45Å; I272-L277 HydrophobicContact CG2-CB 3.94Å; I272-L277 HydrophobicContact CG2-CD2 4.35Å; I272-F325 HydrophobicContact CD1-CE1 4.06Å; I272-F325 HydrophobicContact CD1-CE2 4.12Å; I272-F325 HydrophobicContact CD1-CZ 3.75Å; I272-I382 HydrophobicContact CG2-CB 4.02Å
273	N	97.5	Very high	97.5	Very high	77 Å²	77	56.7 Å²	56.7	41%	0.412	27%	0.272	S	S	.	.			trans	-66.5	119.1	174.5	-177.5	-54.3	0	0	0	109.4	R271 T275 M276 L277	R271-N273 PolarHBondContact O-N 2.86Å; N273-T275 VanDerWaalsContact C-N 3.27Å; N273-T275 PolarHBondContact O-N 3.34Å; N273-T275 WeakPolarHBondContact OD1-CA 3.48Å; N273-T275 VanDerWaalsContact OD1-CB 3.3Å; N273-T275 WeakPolarHBondContact OD1-CB 3.3Å; N273-T275 PolarHBondContact OD1-N 3.34Å; N273-M276 HydrophobicContact CB-CB 4.05Å; N273-M276 HydrophobicContact CB-CG 3.85Å; N273-M276 HydrophobicContact CB-SD 3.76Å; N273-M276 PolarHBondContact O-N 2.85Å; N273-M276 VanDerWaalsContact O-N 3.15Å; N273-M276 PolarHBondContact OD1-N 3.29Å; N273-L277 PolarHBondContact O-N 3.04Å
274	T	97	Very high	97.6	Very high	65 Å²	65	52.3 Å²	52.3	40%	0.399	25%	0.249	S	C	.	.	H	α-helix	trans	-59.3	-35.5	-176.2	-49.1	0	0	0	0	113.1	F258 I272 L278	F258-T274 HydrophobicContact CE2-CG2 3.42Å; F258-T274 VanDerWaalsContact CE2-CG2 3.42Å; F258-T274 HydrophobicContact CZ-CG2 3.45Å; F258-T274 VanDerWaalsContact CZ-CG2 3.45Å; I272-T274 PolarHBondContact O-N 3.45Å; T274-L278 WeakPolarHBondContact O-CG 3.32Å; T274-L278 PolarHBondContact O-N 3.31Å
275	T	97.1	Very high	97.7	Very high	98 Å²	98	50 Å²	50	60%	0.601	24%	0.241	S	C	*	.	H	α-helix	trans	-68.9	-46.5	177.2	-50.1	0	0	0	0	110.2	N273 L277 L278 T279	N273-T275 VanDerWaalsContact C-N 3.27Å; N273-T275 PolarHBondContact O-N 3.34Å; N273-T275 WeakPolarHBondContact OD1-CA 3.48Å; N273-T275 VanDerWaalsContact OD1-CB 3.3Å; N273-T275 WeakPolarHBondContact OD1-CB 3.3Å; N273-T275 PolarHBondContact OD1-N 3.34Å; T275-L277 VanDerWaalsContact C-N 3.3Å; T275-L277 PolarHBondContact O-N 3.36Å; T275-L278 PolarHBondContact O-N 2.89Å; T275-T279 PolarHBondContact O-N 2.81Å; T275-T279 PolarHBondContact O-OG1 3.46Å
276	M	97.2	Very high	97.7	Very high	31 Å²	31	53.7 Å²	53.7	15%	0.153	26%	0.256	C	S	.	.	H	α-helix	trans	-63.4	-37.7	177.4	-63.4	176.8	69.6	0	0	112.1	N273 T279 Y280 D379 D381 T384	N273-M276 HydrophobicContact CB-CB 4.05Å; N273-M276 HydrophobicContact CB-CG 3.85Å; N273-M276 HydrophobicContact CB-SD 3.76Å; N273-M276 PolarHBondContact O-N 2.85Å; N273-M276 VanDerWaalsContact O-N 3.15Å; N273-M276 PolarHBondContact OD1-N 3.29Å; M276-T279 PolarHBondContact O-N 3.33Å; M276-Y280 WeakPolarHBondContact O-CB 3.32Å; M276-Y280 PolarHBondContact O-N 3.03Å; M276-D379 WeakPolarHBondContact CA-O 3.39Å; M276-D379 VanDerWaalsContact CB-O 3.22Å; M276-D379 WeakPolarHBondContact CB-O 3.49Å; M276-D379 WeakPolarHBondContact CG-O 3.36Å; M276-D381 HydrophobicContact CE-CB 4.17Å; M276-D381 WeakPolarHBondContact CE-O 3.48Å; M276-T384 HydrophobicContact CE-CG2 4.34Å
277	L	98.1	Very high	97.7	Very high	1 Å²	1	55.2 Å²	55.2	1%	0.005	26%	0.263	C	S	.	.	H	α-helix	trans	-61.5	-47.3	174.8	179.8	60.3	0	0	0	111.5	F258 M261 I267 I272 N273 T275 Y280 L281 I382	F258-L277 HydrophobicContact CD2-CD2 3.83Å; F258-L277 HydrophobicContact CD2-CG 4.23Å; F258-L277 HydrophobicContact CE2-CD2 4.21Å; M261-L277 HydrophobicContact CE-CD1 4.04Å; M261-L277 HydrophobicContact CE-CD2 4.07Å; M261-L277 HydrophobicContact SD-CD1 3.89Å; M261-L277 HydrophobicContact SD-CD2 4.09Å; I267-L277 HydrophobicContact CD1-CD2 3.74Å; I267-L277 HydrophobicContact CG1-CD2 3.96Å; I272-L277 HydrophobicContact CG2-CB 3.94Å; I272-L277 HydrophobicContact CG2-CD2 4.35Å; N273-L277 PolarHBondContact O-N 3.04Å; T275-L277 VanDerWaalsContact C-N 3.3Å; T275-L277 PolarHBondContact O-N 3.36Å; L277-Y280 PolarHBondContact O-N 3.1Å; L277-L281 HydrophobicContact CD1-CD1 3.86Å; L277-L281 HydrophobicContact CD1-CG 3.99Å; L277-L281 HydrophobicContact CG-CD1 3.91Å; L277-L281 HydrophobicContact CG-CG 4.41Å; L277-L281 WeakPolarHBondContact O-CB 3.39Å; L277-L281 VanDerWaalsContact O-CG 3.25Å; L277-L281 WeakPolarHBondContact O-CG 3.26Å; L277-L281 PolarHBondContact O-N 3.09Å; L277-I382 HydrophobicContact CB-CG2 4.34Å; L277-I382 HydrophobicContact CD1-CD1 4.16Å; L277-I382 HydrophobicContact CD1-CG2 4.08Å
278	L	97.6	Very high	97.7	Very high	68 Å²	68	54.5 Å²	54.5	36%	0.356	26%	0.259	S	S	.	.	H	α-helix	trans	-62.5	-44.8	176.4	-72.3	169.8	0	0	0	111.4	T254 F258 T274 T275 Y280 L281 L282	T254-L278 HydrophobicContact CG2-CD2 4.19Å; F258-L278 HydrophobicContact CD2-CD2 3.59Å; F258-L278 HydrophobicContact CD2-CG 3.98Å; F258-L278 HydrophobicContact CE2-CD1 4.27Å; F258-L278 HydrophobicContact CE2-CD2 3.87Å; F258-L278 HydrophobicContact CE2-CG 3.85Å; F258-L278 HydrophobicContact CG-CD2 4.21Å; T274-L278 WeakPolarHBondContact O-CG 3.32Å; T274-L278 PolarHBondContact O-N 3.31Å; T275-L278 PolarHBondContact O-N 2.89Å; L278-Y280 PolarHBondContact O-N 2.71Å; L278-L281 PolarHBondContact O-N 2.8Å; L278-L282 WeakPolarHBondContact O-CB 3.28Å; L278-L282 WeakPolarHBondContact O-CD1 3.38Å; L278-L282 WeakPolarHBondContact O-CG 3.36Å; L278-L282 PolarHBondContact O-N 2.94Å
279	T	97.5	Very high	97.7	Very high	36 Å²	36	49.5 Å²	49.5	22%	0.221	24%	0.24	C	C	.	.	H	α-helix	trans	-57.5	-50.4	175.8	-54.2	0	0	0	0	110.9	T275 M276 L281 L282 H283	T275-T279 PolarHBondContact O-N 2.81Å; T275-T279 PolarHBondContact O-OG1 3.46Å; M276-T279 PolarHBondContact O-N 3.33Å; T279-L281 PolarHBondContact O-N 2.7Å; T279-L282 PolarHBondContact O-N 3.38Å; T279-H283 PolarHBondContact O-CD2 3.48Å; T279-H283 PolarHBondContact O-N 3.07Å
280	Y	98.5	Very high	97.6	Very high	1 Å²	1	52.2 Å²	52.2	0%	0.004	25%	0.253	C	S	.	.	H	α-helix	trans	-58.5	-48.8	178.5	179	-94.7	0	0	0	112.3	M276 L277 L278 L282 H283 L284 F329 A371 L374 L375 C380 I382	M276-Y280 WeakPolarHBondContact O-CB 3.32Å; M276-Y280 PolarHBondContact O-N 3.03Å; L277-Y280 PolarHBondContact O-N 3.1Å; L278-Y280 PolarHBondContact O-N 2.71Å; Y280-L282 PolarHBondContact O-N 2.91Å; Y280-H283 PolarHBondContact O-N 2.85Å; Y280-L284 HydrophobicContact CE1-CB 4.36Å; Y280-L284 HydrophobicContact CE1-CD2 4.06Å; Y280-L284 WeakPolarHBondContact O-CB 3.37Å; Y280-L284 PolarHBondContact O-N 3.25Å; Y280-F329 HydrophobicContact CD1-CE2 4.42Å; Y280-F329 HydrophobicContact CE1-CD2 4.36Å; Y280-F329 AromaticContact CE1-CE2 3.46Å; Y280-F329 HydrophobicContact CE1-CE2 3.46Å; Y280-F329 VanDerWaalsContact CE1-CE2 3.46Å; Y280-F329 HydrophobicContact CE1-CZ 4.13Å; Y280-F329 AromaticContact CZ-CE2 3.64Å; Y280-F329 AromaticContact CZ-CZ 3.84Å; Y280-F329 WeakPolarHBondContact OH-CE2 3.17Å; Y280-F329 WeakPolarHBondContact OH-CZ 3.36Å; Y280-A371 PolarHBondContact OH-O 3.17Å; Y280-L374 HydrophobicContact CD2-CB 4.29Å; Y280-L374 HydrophobicContact CE2-CB 3.65Å; Y280-L375 HydrophobicContact CD2-CD2 3.64Å; Y280-L375 HydrophobicContact CD2-CG 4.24Å; Y280-L375 HydrophobicContact CE2-CB 4.43Å; Y280-L375 HydrophobicContact CE2-CD2 3.42Å; Y280-L375 VanDerWaalsContact CE2-CD2 3.42Å; Y280-L375 HydrophobicContact CE2-CG 3.6Å; Y280-L375 HydrophobicContact CG-CD2 4.34Å; Y280-C380 HydrophobicContact CD2-CB 4.11Å; Y280-C380 WeakPolarHBondContact CD2-O 3.43Å; Y280-I382 HydrophobicContact CD1-CD1 4.26Å; Y280-I382 HydrophobicContact CD1-CG2 4.46Å; Y280-I382 HydrophobicContact CG-CG2 4.08Å
281	L	98.5	Very high	97.6	Very high	4 Å²	4	53.3 Å²	53.3	2%	0.021	26%	0.259	C	S	.	.	H	α-helix	trans	-65.2	-37.8	-177.6	-70.2	175.2	0	0	0	112.4	T254 T257 F258 L277 L278 T279 L284 E285	T254-L281 HydrophobicContact CG2-CB 3.92Å; T254-L281 HydrophobicContact CG2-CD1 4.49Å; T254-L281 PolarHBondContact OG1-O 3.25Å; T257-L281 HydrophobicContact CG2-CD1 4.25Å; T257-L281 HydrophobicContact CG2-CD2 3.67Å; F258-L281 HydrophobicContact CB-CD1 4.07Å; L277-L281 HydrophobicContact CD1-CD1 3.86Å; L277-L281 HydrophobicContact CD1-CG 3.99Å; L277-L281 HydrophobicContact CG-CD1 3.91Å; L277-L281 HydrophobicContact CG-CG 4.41Å; L277-L281 WeakPolarHBondContact O-CB 3.39Å; L277-L281 VanDerWaalsContact O-CG 3.25Å; L277-L281 WeakPolarHBondContact O-CG 3.26Å; L277-L281 PolarHBondContact O-N 3.09Å; L278-L281 PolarHBondContact O-N 2.8Å; T279-L281 PolarHBondContact O-N 2.7Å; L281-L284 HydrophobicContact CD2-CD2 4.28Å; L281-L284 WeakPolarHBondContact O-CB 3.41Å; L281-L284 PolarHBondContact O-N 3.4Å; L281-E285 WeakPolarHBondContact O-CB 3.4Å; L281-E285 PolarHBondContact O-N 2.87Å
282	L	97.6	Very high	97.6	Very high	42 Å²	42	45.4 Å²	45.4	22%	0.22	24%	0.236	C	C	.	.	H	α-helix	trans	-65.5	-42.1	174.8	-71.5	165	0	0	0	111.8	L216 T254 L278 T279 Y280 D286	L216-L282 HydrophobicContact CD1-CD1 3.38Å; L216-L282 HydrophobicContact CD1-CD2 4.12Å; L216-L282 HydrophobicContact CD1-CG 4.38Å; L216-L282 HydrophobicContact CD2-CD2 3.95Å; L216-L282 HydrophobicContact CG-CD1 4.28Å; L216-L282 HydrophobicContact CG-CD2 4.36Å; T254-L282 HydrophobicContact CG2-CD2 4.22Å; T254-L282 HydrophobicContact CG2-CG 4.31Å; L278-L282 WeakPolarHBondContact O-CB 3.28Å; L278-L282 WeakPolarHBondContact O-CD1 3.38Å; L278-L282 WeakPolarHBondContact O-CG 3.36Å; L278-L282 PolarHBondContact O-N 2.94Å; T279-L282 PolarHBondContact O-N 3.38Å; Y280-L282 PolarHBondContact O-N 2.91Å; L282-D286 WeakPolarHBondContact O-CB 3.23Å; L282-D286 PolarHBondContact O-N 3.05Å; L282-D286 VanDerWaalsContact O-N 3.08Å
283	H	96.8	Very high	97.7	Very high	38 Å²	38	45.7 Å²	45.7	18%	0.176	24%	0.237	C	C	.	.	H	α-helix	trans	-64.7	-42.1	174	-82.5	-115.1	0	0	0	111.3	V213 T279 Y280 D286 H287 L374	V213-H283 VanDerWaalsContact CG2-CE1 3.44Å; V213-H283 WeakPolarHBondContact CG2-CE1 3.17Å; T279-H283 PolarHBondContact O-CD2 3.48Å; T279-H283 PolarHBondContact O-N 3.07Å; Y280-H283 PolarHBondContact O-N 2.85Å; H283-D286 PolarHBondContact O-N 2.82Å; H283-H287 PolarHBondContact O-N 2.83Å; H283-H287 PolarHBondContact O-ND1 3.32Å; H283-L374 HydrophobicContact CB-CD2 4.5Å
284	L	98.4	Very high	97.7	Very high	1 Å²	1	43.6 Å²	43.6	1%	0.005	22%	0.224	C	C	.	.	H	α-helix	trans	-59.7	-50.1	176.8	174.1	64.4	0	0	0	111.5	L253 Y280 L281 D286 H287 Y288 A332 I333 V336 L374	L253-L284 HydrophobicContact CD2-CD2 4.34Å; L253-L284 HydrophobicContact CD2-CG 4.31Å; Y280-L284 HydrophobicContact CE1-CB 4.36Å; Y280-L284 HydrophobicContact CE1-CD2 4.06Å; Y280-L284 WeakPolarHBondContact O-CB 3.37Å; Y280-L284 PolarHBondContact O-N 3.25Å; L281-L284 HydrophobicContact CD2-CD2 4.28Å; L281-L284 WeakPolarHBondContact O-CB 3.41Å; L281-L284 PolarHBondContact O-N 3.4Å; L284-D286 VanDerWaalsContact C-N 3.29Å; L284-D286 PolarHBondContact O-N 3.37Å; L284-H287 PolarHBondContact O-N 2.77Å; L284-Y288 HydrophobicContact CD1-CE2 4.2Å; L284-Y288 HydrophobicContact CG-CE2 4.3Å; L284-Y288 WeakPolarHBondContact O-CD2 3.39Å; L284-Y288 PolarHBondContact O-N 3.13Å; L284-A332 HydrophobicContact CD2-CB 4.26Å; L284-I333 HydrophobicContact CD1-CB 4.38Å; L284-I333 HydrophobicContact CD1-CG2 3.83Å; L284-I333 HydrophobicContact CD2-CG2 3.75Å; L284-I333 HydrophobicContact CG-CG2 4.46Å; L284-V336 HydrophobicContact CD1-CB 3.87Å; L284-V336 HydrophobicContact CD1-CG1 4.41Å; L284-V336 HydrophobicContact CD1-CG2 3.61Å; L284-L374 HydrophobicContact CB-CD1 4.4Å; L284-L374 HydrophobicContact CD1-CD1 4.27Å
285	E	98.1	Very high	97.8	Very high	11 Å²	11	40.8 Å²	40.8	5%	0.051	21%	0.207	C	C	.	.	H	α-helix	trans	-63.3	-34.3	-179.9	-172.5	162.6	-140.5	0	0	112.3	H251 S252 L253 T254 L281 H287 Y288	H251-E285 WeakPolarHBondContact CA-OE1 3.44Å; H251-E285 VanDerWaalsContact CA-OE2 3.25Å; H251-E285 WeakPolarHBondContact CA-OE2 3.4Å; H251-E285 IonicContact CG-OE2 3.45Å; H251-E285 IonicContact ND1-OE2 3.9Å; H251-E285 PolarHBondContact ND1-OE2 2.9Å; S252-E285 PolarHBondContact N-OE1 2.98Å; L253-E285 HydrophobicContact CB-CB 4.45Å; L253-E285 HydrophobicContact CB-CG 4.13Å; L253-E285 VanDerWaalsContact CB-OE1 3.31Å; L253-E285 WeakPolarHBondContact CB-OE1 3.42Å; L253-E285 HydrophobicContact CD2-CB 4.39Å; L253-E285 PolarHBondContact N-OE1 2.94Å; T254-E285 VanDerWaalsContact CB-OE2 3.25Å; T254-E285 WeakPolarHBondContact CB-OE2 3.41Å; T254-E285 PolarHBondContact N-OE2 3.49Å; T254-E285 PolarHBondContact OG1-OE2 3.11Å; L281-E285 WeakPolarHBondContact O-CB 3.4Å; L281-E285 PolarHBondContact O-N 2.87Å; E285-H287 VanDerWaalsContact C-N 3.29Å; E285-H287 PolarHBondContact O-N 3.2Å; E285-Y288 PolarHBondContact O-N 3Å
286	D	97	Very high	97.9	Very high	93 Å²	93	36.3 Å²	36.3	50%	0.497	18%	0.179	S	C	.	.	H	α-helix	trans	-68.3	-25.4	173.8	-169.2	64.8	0	0	0	113.2	L282 H283 L284 Y288	L282-D286 WeakPolarHBondContact O-CB 3.23Å; L282-D286 PolarHBondContact O-N 3.05Å; L282-D286 VanDerWaalsContact O-N 3.08Å; H283-D286 PolarHBondContact O-N 2.82Å; L284-D286 VanDerWaalsContact C-N 3.29Å; L284-D286 PolarHBondContact O-N 3.37Å; D286-Y288 VanDerWaalsContact C-N 3.33Å
287	H	97.7	Very high	97.9	Very high	34 Å²	34	35.4 Å²	35.4	16%	0.157	18%	0.175	C	C	.	.	T	Hydrogen-bonded Turn	trans	-82.4	-8.6	175	-74.4	64.8	0	0	0	113.2	H283 L284 E285 R289 V336 D337	H283-H287 PolarHBondContact O-N 2.83Å; H283-H287 PolarHBondContact O-ND1 3.32Å; L284-H287 PolarHBondContact O-N 2.77Å; E285-H287 VanDerWaalsContact C-N 3.29Å; E285-H287 PolarHBondContact O-N 3.2Å; H287-R289 PolarHBondContact O-N 3.11Å; H287-V336 HydrophobicContact CB-CG2 3.54Å; H287-D337 VanDerWaalsContact O-CA 3.28Å; H287-D337 WeakPolarHBondContact O-CA 3.29Å; H287-D337 PolarHBondContact O-N 3.42Å; H287-D337 VanDerWaalsContact O-N 3.08Å
288	Y	98.5	Very high	97.9	Very high	5 Å²	5	35.4 Å²	35.4	2%	0.02	18%	0.175	C	C	.	.	S	Bend	trans	-75.2	119.3	167.9	-85.8	-86.3	0	0	0	110	L253 L284 E285 D286 N295 A299 A332 D335 V336	L253-Y288 HydrophobicContact CD2-CD2 3.74Å; L253-Y288 HydrophobicContact CD2-CE2 3.49Å; L253-Y288 VanDerWaalsContact CD2-CE2 3.49Å; L284-Y288 HydrophobicContact CD1-CE2 4.2Å; L284-Y288 HydrophobicContact CG-CE2 4.3Å; L284-Y288 WeakPolarHBondContact O-CD2 3.39Å; L284-Y288 PolarHBondContact O-N 3.13Å; E285-Y288 PolarHBondContact O-N 3Å; D286-Y288 VanDerWaalsContact C-N 3.33Å; Y288-N295 VanDerWaalsContact CD1-C 3.44Å; Y288-A299 HydrophobicContact CD1-CB 4.49Å; Y288-A299 HydrophobicContact CE1-CB 3.69Å; Y288-A299 HydrophobicContact CE2-CB 3.97Å; Y288-A299 VanDerWaalsContact OH-CB 3.3Å; Y288-A299 WeakPolarHBondContact OH-CB 3.28Å; Y288-A332 WeakPolarHBondContact CE2-O 3.45Å; Y288-A332 PolarHBondContact OH-O 3.41Å; Y288-D335 HydrophobicContact CE1-CB 3.72Å; Y288-D335 VanDerWaalsContact CE1-O 3.32Å; Y288-D335 WeakPolarHBondContact CE1-O 3.47Å; Y288-D335 PolarHBondContact OH-N 3.21Å; Y288-V336 HydrophobicContact CD2-CB 4.45Å; Y288-V336 HydrophobicContact CD2-CG2 4.33Å; Y288-V336 HydrophobicContact CE2-CB 3.94Å; Y288-V336 HydrophobicContact CE2-CG2 4.24Å; Y288-V336 PolarHBondContact OH-N 2.81Å
289	R	97.7	Very high	98	Very high	104 Å²	104	32.1 Å²	32.1	39%	0.392	16%	0.158	S	C	.	.			trans	-69.1	153.6	178	-57.3	-169.9	-172.7	173.6	4.1	110.4	H287 N291 N295 D337 H338	H287-R289 PolarHBondContact O-N 3.11Å; R289-N291 PolarHBondContact O-N 3.44Å; R289-N295 VanDerWaalsContact O-CB 3.28Å; R289-N295 WeakPolarHBondContact O-CB 3.49Å; R289-D337 IonicContact CZ-OD1 2.65Å; R289-D337 IonicContact NE-OD1 3.95Å; R289-D337 PolarHBondContact NE-OD1 2.87Å; R289-D337 VanDerWaalsContact NH2-CG 3.29Å; R289-D337 IonicContact NH2-OD1 3.61Å; R289-D337 PolarHBondContact NH2-OD1 3.46Å; R289-D337 IonicContact NH2-OD2 3.82Å; R289-D337 PolarHBondContact NH2-OD2 2.97Å; R289-H338 WeakPolarHBondContact CD-O 3.39Å
290	Q	96	Very high	98.1	Very high	167 Å²	167	30.4 Å²	30.4	78%	0.78	15%	0.147	S	C	*	.			trans	-79	53.1	178	-59.7	-61.3	-44.9	0	0	111.4
291	N	97.6	Very high	98.1	Very high	31 Å²	31	30.5 Å²	30.5	17%	0.166	15%	0.148	C	C	.	.			trans	-75.3	165.9	173.6	-54.4	-40.8	0	0	0	110.6	R289 H294 N295 H338 E473	R289-N291 PolarHBondContact O-N 3.44Å; N291-H294 PolarHBondContact ND2-O 3.38Å; N291-N295 PolarHBondContact O-ND2 3.47Å; N291-H338 PolarHBondContact ND2-O 3.14Å; N291-E473 VanDerWaalsContact CB-OE2 3.27Å; N291-E473 WeakPolarHBondContact CB-OE2 3.38Å
292	S	98	Very high	98.1	Very high	40 Å²	40	30.3 Å²	30.3	28%	0.28	15%	0.147	S	C	.	.	S	Bend	trans	-67.6	-42.3	-179.5	-60.6	0	0	0	0	112.5	N295 R469 E472 E473	S292-N295 PolarHBondContact O-ND2 3.42Å; S292-R469 WeakPolarHBondContact CB-O 3.23Å; S292-R469 WeakPolarHBondContact O-CB 3.32Å; S292-R469 WeakPolarHBondContact O-CD 3.45Å; S292-R469 WeakPolarHBondContact O-CG 3.18Å; S292-R469 PolarHBondContact O-NH1 3.4Å; S292-R469 VanDerWaalsContact O-NH1 3.17Å; S292-E472 WeakPolarHBondContact OG-CG 3.28Å; S292-E473 PolarHBondContact N-OE2 2.8Å
293	Y	98.7	Very high	98.1	Very high	13 Å²	13	28.3 Å²	28.3	5%	0.051	14%	0.137	C	C	.	.	S	Bend	trans	-113.2	-63.4	-178.2	-177.4	-85.7	0	0	0	112.5	N295 H298 N455 W466 R469 L470 E473	Y293-N295 VanDerWaalsContact C-N 3.26Å; Y293-N295 PolarHBondContact O-N 3.47Å; Y293-H298 AromaticContact CE1-CD2 3.85Å; Y293-H298 AromaticContact CE1-CE1 3.71Å; Y293-H298 AromaticContact CE1-CG 3.86Å; Y293-H298 AromaticContact CE1-ND1 3.77Å; Y293-H298 AromaticContact CE1-NE2 3.74Å; Y293-H298 AromaticContact CZ-CE1 3.71Å; Y293-H298 AromaticContact CZ-ND1 3.66Å; Y293-H298 VanDerWaalsContact O-CB 3.23Å; Y293-H298 WeakPolarHBondContact O-CB 3.48Å; Y293-H298 PolarHBondContact OH-CE1 2.81Å; Y293-H298 PolarHBondContact OH-ND1 2.83Å; Y293-N455 WeakPolarHBondContact CE2-ND2 3.47Å; Y293-N455 PolarHBondContact OH-ND2 2.67Å; Y293-W466 AromaticContact CD2-CE3 3.74Å; Y293-W466 HydrophobicContact CD2-CE3 3.74Å; Y293-W466 HydrophobicContact CD2-CZ3 4.23Å; Y293-W466 HydrophobicContact CE2-CD2 4.37Å; Y293-W466 AromaticContact CE2-CE3 3.72Å; Y293-W466 HydrophobicContact CE2-CE3 3.72Å; Y293-W466 HydrophobicContact CE2-CZ3 4.35Å; Y293-R469 HydrophobicContact CD2-CB 4.4Å; Y293-L470 HydrophobicContact CD1-CD1 4.08Å; Y293-L470 HydrophobicContact CD2-CB 3.73Å; Y293-L470 HydrophobicContact CD2-CD1 4.03Å; Y293-L470 HydrophobicContact CD2-CG 4.44Å; Y293-L470 HydrophobicContact CE1-CD1 4.4Å; Y293-L470 HydrophobicContact CE2-CB 4.24Å; Y293-L470 HydrophobicContact CE2-CD1 4.34Å; Y293-L470 HydrophobicContact CG-CB 4.26Å; Y293-L470 HydrophobicContact CG-CD1 3.89Å; Y293-E473 WeakPolarHBondContact CA-OE2 3.47Å; Y293-E473 WeakPolarHBondContact CB-OE2 3.44Å; Y293-E473 PolarHBondContact N-OE2 3.12Å
294	H	98.8	Very high	98.2	Very high	32 Å²	32	26.6 Å²	26.6	15%	0.148	13%	0.128	C	C	.	.	T	Hydrogen-bonded Turn	trans	-78	73.9	-173.9	-59.8	96.5	0	0	0	110.9	N291 D335 H338 E473	N291-H294 PolarHBondContact ND2-O 3.38Å; H294-D335 IonicContact CD2-OD1 3.36Å; H294-D335 IonicContact CD2-OD2 2.95Å; H294-D335 PolarHBondContact CD2-OD2 2.98Å; H294-D335 VanDerWaalsContact CD2-OD2 3.32Å; H294-H338 HydrophobicContact CB-CB 3.86Å; H294-H338 WeakPolarHBondContact CB-ND1 3.36Å; H294-H338 AromaticContact CE1-CE1 3.97Å; H294-H338 AromaticContact CG-CE1 3.63Å; H294-H338 AromaticContact CG-CG 3.92Å; H294-H338 AromaticContact CG-ND1 3.63Å; H294-H338 AromaticContact CG-NE2 3.94Å; H294-H338 AromaticContact ND1-CE1 3.42Å; H294-H338 PolarHBondContact ND1-CE1 3.31Å; H294-H338 AromaticContact ND1-ND1 3.75Å; H294-H338 AromaticContact ND1-NE2 3.94Å; H294-E473 IonicContact CE1-OE1 2.79Å; H294-E473 IonicContact CG-OE1 3.92Å; H294-E473 PolarHBondContact N-OE2 3.19Å; H294-E473 IonicContact ND1-OE1 3.85Å; H294-E473 PolarHBondContact ND1-OE1 3.22Å; H294-E473 IonicContact ND1-OE2 2.64Å
295	N	98.5	Very high	98.2	Very high	6 Å²	6	26.6 Å²	26.6	3%	0.032	13%	0.128	C	C	.	.	T	Hydrogen-bonded Turn	trans	-133.2	-175.8	-179.1	64	44.5	0	0	0	110.5	Y288 R289 N291 S292 Y293 I297 H298 A299	Y288-N295 VanDerWaalsContact CD1-C 3.44Å; R289-N295 VanDerWaalsContact O-CB 3.28Å; R289-N295 WeakPolarHBondContact O-CB 3.49Å; N291-N295 PolarHBondContact O-ND2 3.47Å; S292-N295 PolarHBondContact O-ND2 3.42Å; Y293-N295 VanDerWaalsContact C-N 3.26Å; Y293-N295 PolarHBondContact O-N 3.47Å; N295-I297 PolarHBondContact O-N 3.28Å; N295-I297 WeakPolarHBondContact OD1-CA 3.48Å; N295-I297 WeakPolarHBondContact OD1-CB 3.28Å; N295-I297 PolarHBondContact OD1-N 2.87Å; N295-H298 PolarHBondContact O-N 2.87Å; N295-H298 VanDerWaalsContact O-N 3.13Å; N295-H298 PolarHBondContact OD1-N 2.75Å; N295-A299 PolarHBondContact O-N 3.15Å
296	S	98.4	Very high	98.2	Very high	4 Å²	4	26 Å²	26	3%	0.028	13%	0.126	C	C	.	.	H	α-helix	trans	-64.1	-22.7	-177.3	62	0	0	0	0	114.4	T300	S296-T300 WeakPolarHBondContact O-CB 3.28Å; S296-T300 PolarHBondContact O-N 2.87Å; S296-T300 PolarHBondContact O-OG1 3.37Å
297	I	98.5	Very high	98.2	Very high	13 Å²	13	21.9 Å²	21.9	7%	0.067	10%	0.104	C	C	.	.	H	α-helix	trans	-68.5	-43.2	174.8	-52.5	176.5	0	0	0	109.7	V241 F242 H245 N295 T300 D301 W466	V241-I297 HydrophobicContact CG1-CG2 4.13Å; V241-I297 HydrophobicContact CG2-CG2 3.95Å; F242-I297 HydrophobicContact CD1-CG2 3.9Å; F242-I297 HydrophobicContact CE1-CG2 3.95Å; H245-I297 HydrophobicContact CB-CD1 4.46Å; H245-I297 HydrophobicContact CB-CG1 4.27Å; N295-I297 PolarHBondContact O-N 3.28Å; N295-I297 WeakPolarHBondContact OD1-CA 3.48Å; N295-I297 WeakPolarHBondContact OD1-CB 3.28Å; N295-I297 PolarHBondContact OD1-N 2.87Å; I297-T300 VanDerWaalsContact O-CB 3.27Å; I297-T300 WeakPolarHBondContact O-CB 3.25Å; I297-T300 PolarHBondContact O-N 3.42Å; I297-D301 PolarHBondContact O-N 2.99Å; I297-W466 HydrophobicContact CB-CH2 4.2Å; I297-W466 HydrophobicContact CG2-CH2 3.75Å; I297-W466 HydrophobicContact CG2-CZ2 4.2Å
298	H	98.8	Very high	98.2	Very high	0 Å²	0	21.3 Å²	21.3	0%	0	10%	0.102	C	C	.	.	H	α-helix	trans	-64.9	-46.2	177.2	174.1	57.3	0	0	0	110.8	Y293 N295 T300 D301 V302 H334 D335 D452 W466	Y293-H298 AromaticContact CE1-CD2 3.85Å; Y293-H298 AromaticContact CE1-CE1 3.71Å; Y293-H298 AromaticContact CE1-CG 3.86Å; Y293-H298 AromaticContact CE1-ND1 3.77Å; Y293-H298 AromaticContact CE1-NE2 3.74Å; Y293-H298 AromaticContact CZ-CE1 3.71Å; Y293-H298 AromaticContact CZ-ND1 3.66Å; Y293-H298 VanDerWaalsContact O-CB 3.23Å; Y293-H298 WeakPolarHBondContact O-CB 3.48Å; Y293-H298 PolarHBondContact OH-CE1 2.81Å; Y293-H298 PolarHBondContact OH-ND1 2.83Å; N295-H298 PolarHBondContact O-N 2.87Å; N295-H298 VanDerWaalsContact O-N 3.13Å; N295-H298 PolarHBondContact OD1-N 2.75Å; H298-T300 PolarHBondContact O-N 3.35Å; H298-D301 WeakPolarHBondContact O-CB 3.22Å; H298-D301 PolarHBondContact O-N 3.33Å; H298-V302 VanDerWaalsContact CE1-CG2 3.43Å; H298-V302 WeakPolarHBondContact CE1-CG2 3.43Å; H298-V302 WeakPolarHBondContact O-CG2 3.48Å; H298-V302 PolarHBondContact O-N 3.32Å; H298-H334 AromaticContact CD2-NE2 3.95Å; H298-H334 AromaticContact NE2-CE1 3.92Å; H298-H334 AromaticContact NE2-NE2 3.44Å; H298-H334 PolarHBondContact NE2-NE2 3.25Å; H298-D335 IonicContact CD2-OD2 3.37Å; H298-D335 PolarHBondContact CD2-OD2 3.08Å; H298-D335 IonicContact NE2-OD2 3.83Å; H298-D335 PolarHBondContact NE2-OD2 3.25Å; H298-D452 IonicContact CE1-OD1 2.75Å; H298-D452 PolarHBondContact CE1-OD1 3.17Å; H298-D452 VanDerWaalsContact CE1-OD1 3.29Å; H298-D452 IonicContact NE2-OD1 3.2Å; H298-D452 PolarHBondContact NE2-OD1 3.02Å; H298-W466 HydrophobicContact CB-CH2 3.9Å; H298-W466 HydrophobicContact CB-CZ3 4.03Å
299	A	98.8	Very high	98	Very high	0 Å²	0	21.5 Å²	21.5	0%	0	10%	0.104	C	C	.	.	H	α-helix	trans	-58.1	-35.5	172.8	0	0	0	0	0	113.2	L253 Y288 N295 T303	L253-A299 HydrophobicContact CD1-CB 3.88Å; L253-A299 HydrophobicContact CD2-CB 4.01Å; Y288-A299 HydrophobicContact CD1-CB 4.49Å; Y288-A299 HydrophobicContact CE1-CB 3.69Å; Y288-A299 HydrophobicContact CE2-CB 3.97Å; Y288-A299 VanDerWaalsContact OH-CB 3.3Å; Y288-A299 WeakPolarHBondContact OH-CB 3.28Å; N295-A299 PolarHBondContact O-N 3.15Å; A299-T303 VanDerWaalsContact O-CB 3.27Å; A299-T303 WeakPolarHBondContact O-CB 3.29Å; A299-T303 PolarHBondContact O-N 3.07Å; A299-T303 PolarHBondContact O-OG1 2.84Å
300	T	98.7	Very high	97.9	Very high	0 Å²	0	16.8 Å²	16.8	0%	0	9%	0.086	C	C	.	.	H	α-helix	trans	-62	-47.3	173.2	-57.4	0	0	0	0	110.6	V241 F244 S252 L253 V256 S296 I297 H298 T303 Q304	V241-T300 HydrophobicContact CG2-CG2 3.63Å; F244-T300 HydrophobicContact CD1-CG2 4.16Å; F244-T300 HydrophobicContact CE1-CG2 4.29Å; S252-T300 WeakPolarHBondContact CB-OG1 3.31Å; S252-T300 PolarHBondContact OG-OG1 3.31Å; L253-T300 VanDerWaalsContact CA-OG1 3.28Å; L253-T300 WeakPolarHBondContact CA-OG1 3.49Å; L253-T300 PolarHBondContact N-OG1 2.76Å; V256-T300 HydrophobicContact CB-CG2 4.04Å; V256-T300 HydrophobicContact CG1-CG2 3.59Å; S296-T300 WeakPolarHBondContact O-CB 3.28Å; S296-T300 PolarHBondContact O-N 2.87Å; S296-T300 PolarHBondContact O-OG1 3.37Å; I297-T300 VanDerWaalsContact O-CB 3.27Å; I297-T300 WeakPolarHBondContact O-CB 3.25Å; I297-T300 PolarHBondContact O-N 3.42Å; H298-T300 PolarHBondContact O-N 3.35Å; T300-T303 PolarHBondContact O-N 3.48Å; T300-Q304 WeakPolarHBondContact O-CB 3.46Å; T300-Q304 PolarHBondContact O-N 2.84Å
301	D	98.7	Very high	97.7	Very high	3 Å²	3	11.5 Å²	11.5	2%	0.016	7%	0.067	C	C	.	.	H	α-helix	trans	-63.5	-46.8	-179	-168.2	23.3	0	0	0	111.6	V241 I297 H298 T303 Q304 T305 N455 K458 W466	V241-D301 HydrophobicContact CB-CB 4.44Å; V241-D301 HydrophobicContact CG1-CB 4.24Å; V241-D301 HydrophobicContact CG2-CB 4.15Å; I297-D301 PolarHBondContact O-N 2.99Å; H298-D301 WeakPolarHBondContact O-CB 3.22Å; H298-D301 PolarHBondContact O-N 3.33Å; D301-T303 PolarHBondContact O-N 2.92Å; D301-Q304 PolarHBondContact O-N 3.33Å; D301-T305 WeakPolarHBondContact O-CB 3.43Å; D301-T305 PolarHBondContact O-N 3.34Å; D301-T305 PolarHBondContact O-OG1 3.18Å; D301-T305 PolarHBondContact OD1-OG1 2.94Å; D301-N455 PolarHBondContact OD2-OD1 3.05Å; D301-K458 IonicContact OD1-NZ 2.77Å; D301-K458 PolarHBondContact OD1-NZ 3.38Å; D301-K458 IonicContact OD2-NZ 2.76Å; D301-K458 PolarHBondContact OD2-NZ 2.85Å; D301-W466 HydrophobicContact CB-CZ2 3.84Å; D301-W466 PolarHBondContact OD2-NE1 3.42Å; D301-W466 VanDerWaalsContact OD2-NE1 3.08Å
302	V	98.8	Very high	97.4	Very high	0 Å²	0	10.6 Å²	10.6	0%	0	6%	0.064	C	C	.	.	H	α-helix	trans	-63.3	-44.9	177.6	-178.7	0	0	0	0	110.7	H298 Q304 T305 V306 A331 I448 A451 D452	H298-V302 VanDerWaalsContact CE1-CG2 3.43Å; H298-V302 WeakPolarHBondContact CE1-CG2 3.43Å; H298-V302 WeakPolarHBondContact O-CG2 3.48Å; H298-V302 PolarHBondContact O-N 3.32Å; V302-Q304 PolarHBondContact O-N 3.13Å; V302-T305 PolarHBondContact O-N 3.05Å; V302-V306 HydrophobicContact CG1-CG2 4.45Å; V302-V306 WeakPolarHBondContact O-CB 3.31Å; V302-V306 WeakPolarHBondContact O-CG2 3.19Å; V302-V306 PolarHBondContact O-N 3.44Å; V302-A331 HydrophobicContact CG1-CB 4.11Å; V302-I448 HydrophobicContact CG1-CG1 4.49Å; V302-A451 HydrophobicContact CG1-CB 3.95Å; V302-D452 HydrophobicContact CG2-CB 4.49Å
303	T	98.8	Very high	96.9	Very high	0 Å²	0	12.4 Å²	12.4	0%	0	8%	0.075	C	C	.	.	H	α-helix	trans	-60.7	-44	177.7	-57.9	0	0	0	0	112.3	V256 A299 T300 D301 H307 I328 A332	V256-T303 HydrophobicContact CG1-CG2 4.3Å; A299-T303 VanDerWaalsContact O-CB 3.27Å; A299-T303 WeakPolarHBondContact O-CB 3.29Å; A299-T303 PolarHBondContact O-N 3.07Å; A299-T303 PolarHBondContact O-OG1 2.84Å; T300-T303 PolarHBondContact O-N 3.48Å; D301-T303 PolarHBondContact O-N 2.92Å; T303-H307 PolarHBondContact O-N 3.06Å; T303-I328 HydrophobicContact CG2-CG2 4.27Å; T303-A332 HydrophobicContact CG2-CB 4.48Å; T303-A332 VanDerWaalsContact OG1-CA 3.23Å; T303-A332 WeakPolarHBondContact OG1-CA 3.46Å; T303-A332 PolarHBondContact OG1-N 3.42Å
304	Q	98.2	Very high	96.2	Very high	1 Å²	1	13.3 Å²	13.3	1%	0.005	8%	0.083	C	C	.	.	H	α-helix	trans	-69	-39.1	177.3	-173.9	-91.1	-21.3	0	0	111.8	I234 R236 M239 V256 T300 D301 V302 H307 V308	I234-Q304 HydrophobicContact CG2-CG 4.34Å; I234-Q304 PolarHBondContact O-NE2 3.46Å; R236-Q304 PolarHBondContact O-NE2 2.78Å; M239-Q304 HydrophobicContact CE-CB 4.09Å; M239-Q304 HydrophobicContact CE-CG 3.69Å; M239-Q304 HydrophobicContact SD-CG 4.09Å; V256-Q304 HydrophobicContact CG2-CB 3.81Å; V256-Q304 HydrophobicContact CG2-CG 4.18Å; T300-Q304 WeakPolarHBondContact O-CB 3.46Å; T300-Q304 PolarHBondContact O-N 2.84Å; D301-Q304 PolarHBondContact O-N 3.33Å; V302-Q304 PolarHBondContact O-N 3.13Å; Q304-H307 WeakPolarHBondContact O-CA 3.35Å; Q304-H307 VanDerWaalsContact O-CB 3.28Å; Q304-H307 WeakPolarHBondContact O-CB 3.43Å; Q304-H307 PolarHBondContact O-N 3.12Å; Q304-H307 VanDerWaalsContact O-N 3.15Å; Q304-V308 VanDerWaalsContact NE2-CG2 3.26Å; Q304-V308 WeakPolarHBondContact O-CG2 3.44Å; Q304-V308 PolarHBondContact O-N 2.75Å
305	T	98.3	Very high	95.6	Very high	1 Å²	1	11.8 Å²	11.8	1%	0.006	8%	0.076	C	C	.	.	H	α-helix	trans	-64.3	-46.6	177.8	-59.7	0	0	0	0	110.8	W237 D301 V302 H307 V308 M309 A451 K458	W237-T305 HydrophobicContact CE3-CG2 4.24Å; W237-T305 HydrophobicContact CH2-CG2 3.41Å; W237-T305 VanDerWaalsContact CH2-CG2 3.41Å; W237-T305 HydrophobicContact CZ2-CG2 4.25Å; W237-T305 HydrophobicContact CZ3-CG2 3.41Å; W237-T305 VanDerWaalsContact CZ3-CG2 3.41Å; D301-T305 WeakPolarHBondContact O-CB 3.43Å; D301-T305 PolarHBondContact O-N 3.34Å; D301-T305 PolarHBondContact O-OG1 3.18Å; D301-T305 PolarHBondContact OD1-OG1 2.94Å; V302-T305 PolarHBondContact O-N 3.05Å; T305-H307 PolarHBondContact O-N 3.18Å; T305-V308 PolarHBondContact O-N 2.89Å; T305-M309 HydrophobicContact CG2-SD 4.24Å; T305-M309 VanDerWaalsContact O-CG 3.31Å; T305-M309 WeakPolarHBondContact O-CG 3.28Å; T305-M309 PolarHBondContact O-N 3.5Å; T305-A451 HydrophobicContact CG2-CB 3.78Å; T305-K458 PolarHBondContact OG1-NZ 3.29Å
306	V	98.2	Very high	94.8	Very high	0 Å²	0	16 Å²	16	0%	0	10%	0.099	C	C	.	.	H	α-helix	trans	-54.9	-42.3	171.1	162.8	0	0	0	0	111.2	V302 M309 F310 V327 I328 A331 L447 I448 A451	V302-V306 HydrophobicContact CG1-CG2 4.45Å; V302-V306 WeakPolarHBondContact O-CB 3.31Å; V302-V306 WeakPolarHBondContact O-CG2 3.19Å; V302-V306 PolarHBondContact O-N 3.44Å; V306-M309 PolarHBondContact O-N 3.04Å; V306-F310 HydrophobicContact CG1-CD2 3.83Å; V306-F310 HydrophobicContact CG1-CE2 3.62Å; V306-F310 WeakPolarHBondContact O-CD2 3.19Å; V306-F310 PolarHBondContact O-N 3.41Å; V306-F310 VanDerWaalsContact O-N 3.07Å; V306-V327 HydrophobicContact CG1-CG1 3.87Å; V306-I328 HydrophobicContact CG1-CG1 4.27Å; V306-A331 HydrophobicContact CB-CB 4.22Å; V306-A331 HydrophobicContact CG2-CB 3.85Å; V306-L447 HydrophobicContact CB-CD2 4.12Å; V306-L447 HydrophobicContact CG1-CD2 3.8Å; V306-L447 HydrophobicContact CG2-CD2 3.85Å; V306-I448 HydrophobicContact CG2-CG1 4.42Å; V306-A451 HydrophobicContact CG2-CB 3.49Å; V306-A451 VanDerWaalsContact CG2-CB 3.49Å
307	H	97.3	Very high	94.1	Very high	6 Å²	6	21.4 Å²	21.4	3%	0.028	14%	0.136	C	C	.	.	H	α-helix	trans	-59.4	-47.2	174.7	170.2	86.1	0	0	0	111.6	D235 V260 R264 T303 Q304 T305 M309 F310 S311	D235-H307 IonicContact OD1-CD2 3.34Å; D235-H307 IonicContact OD1-CE1 2.86Å; D235-H307 IonicContact OD1-NE2 4Å; D235-H307 PolarHBondContact OD1-NE2 3.49Å; V260-H307 HydrophobicContact CG1-CB 3.95Å; V260-H307 WeakPolarHBondContact CG1-ND1 3.48Å; V260-H307 HydrophobicContact CG2-CB 3.73Å; R264-H307 PolarHBondContact NE-ND1 3.23Å; R264-H307 PolarHBondContact NH2-ND1 2.89Å; R264-H307 PolarHBondContact NH2-O 2.95Å; T303-H307 PolarHBondContact O-N 3.06Å; Q304-H307 WeakPolarHBondContact O-CA 3.35Å; Q304-H307 VanDerWaalsContact O-CB 3.28Å; Q304-H307 WeakPolarHBondContact O-CB 3.43Å; Q304-H307 PolarHBondContact O-N 3.12Å; Q304-H307 VanDerWaalsContact O-N 3.15Å; T305-H307 PolarHBondContact O-N 3.18Å; H307-M309 PolarHBondContact O-N 3.15Å; H307-F310 PolarHBondContact O-N 3.21Å; H307-S311 PolarHBondContact O-OG 2.85Å
308	V	96.7	Very high	93.6	Very high	22 Å²	22	22.2 Å²	22.2	13%	0.133	14%	0.142	C	C	.	.	H	α-helix	trans	-63.5	-42.3	178.5	177.4	0	0	0	0	111.2	W237 Q304 T305 F310 S311	W237-V308 HydrophobicContact CB-CG1 4.43Å; W237-V308 HydrophobicContact CE3-CB 4.31Å; W237-V308 HydrophobicContact CE3-CG1 3.9Å; Q304-V308 VanDerWaalsContact NE2-CG2 3.26Å; Q304-V308 WeakPolarHBondContact O-CG2 3.44Å; Q304-V308 PolarHBondContact O-N 2.75Å; T305-V308 PolarHBondContact O-N 2.89Å; V308-F310 VanDerWaalsContact C-N 3.34Å; V308-F310 PolarHBondContact O-N 3.48Å; V308-S311 VanDerWaalsContact O-CB 3.32Å; V308-S311 WeakPolarHBondContact O-CB 3.45Å; V308-S311 PolarHBondContact O-N 3.45Å
309	M	95.7	Very high	93.4	Very high	9 Å²	9	22.5 Å²	22.5	4%	0.044	14%	0.143	C	C	.	.	H	α-helix	trans	-60.6	-40.7	179.6	-66.6	175.8	77.3	0	0	112.5	W237 T305 V306 H307 S311 A312 L447 I450 A451 W518	W237-M309 HydrophobicContact CH2-CG 4.3Å; W237-M309 HydrophobicContact CH2-SD 4.43Å; W237-M309 HydrophobicContact CZ3-CG 3.7Å; W237-M309 HydrophobicContact CZ3-SD 4.36Å; T305-M309 HydrophobicContact CG2-SD 4.24Å; T305-M309 VanDerWaalsContact O-CG 3.31Å; T305-M309 WeakPolarHBondContact O-CG 3.28Å; T305-M309 PolarHBondContact O-N 3.5Å; V306-M309 PolarHBondContact O-N 3.04Å; H307-M309 PolarHBondContact O-N 3.15Å; M309-S311 PolarHBondContact O-N 3.46Å; M309-S311 VanDerWaalsContact O-N 3.14Å; M309-A312 VanDerWaalsContact O-CB 3.28Å; M309-A312 WeakPolarHBondContact O-CB 3.23Å; M309-A312 PolarHBondContact O-N 3.39Å; M309-A312 VanDerWaalsContact O-N 3.1Å; M309-L447 HydrophobicContact CB-CD1 4.2Å; M309-L447 HydrophobicContact CB-CD2 4.33Å; M309-L447 HydrophobicContact CB-CG 4.1Å; M309-L447 HydrophobicContact CE-CB 4.41Å; M309-L447 HydrophobicContact CE-CG 3.9Å; M309-L447 HydrophobicContact SD-CD2 4.37Å; M309-L447 HydrophobicContact SD-CG 4.18Å; M309-I450 HydrophobicContact CE-CB 3.82Å; M309-I450 HydrophobicContact CE-CD1 4.38Å; M309-I450 HydrophobicContact CE-CG2 3.46Å; M309-I450 VanDerWaalsContact CE-CG2 3.46Å; M309-I450 HydrophobicContact SD-CG2 4.12Å; M309-A451 HydrophobicContact SD-CB 4Å; M309-W518 HydrophobicContact CE-CD2 4.11Å; M309-W518 HydrophobicContact CE-CH2 4.03Å; M309-W518 HydrophobicContact CE-CZ2 3.36Å
310	F	95.1	Very high	93.3	Very high	5 Å²	5	25.9 Å²	25.9	2%	0.022	16%	0.164	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.9	-14	175.1	-83.5	-47.4	0	0	0	114.5	V306 H307 V308 A312 F319 K324 V327 I328 L444 L447	V306-F310 HydrophobicContact CG1-CD2 3.83Å; V306-F310 HydrophobicContact CG1-CE2 3.62Å; V306-F310 WeakPolarHBondContact O-CD2 3.19Å; V306-F310 PolarHBondContact O-N 3.41Å; V306-F310 VanDerWaalsContact O-N 3.07Å; H307-F310 PolarHBondContact O-N 3.21Å; V308-F310 VanDerWaalsContact C-N 3.34Å; V308-F310 PolarHBondContact O-N 3.48Å; F310-A312 VanDerWaalsContact C-N 3.34Å; F310-F319 HydrophobicContact CD1-CD2 4.15Å; F310-F319 AromaticContact CE1-CD2 3.77Å; F310-F319 HydrophobicContact CE1-CD2 3.77Å; F310-F319 HydrophobicContact CE1-CE2 4.31Å; F310-F319 HydrophobicContact CE1-CG 4.31Å; F310-K324 HydrophobicContact CD1-CG 4.24Å; F310-K324 HydrophobicContact CE1-CG 4.19Å; F310-K324 HydrophobicContact CE2-CB 4.49Å; F310-K324 HydrophobicContact CE2-CG 4.47Å; F310-K324 HydrophobicContact CG-CG 4.42Å; F310-K324 HydrophobicContact CZ-CG 4.3Å; F310-V327 HydrophobicContact CE2-CB 3.9Å; F310-V327 HydrophobicContact CE2-CG1 3.97Å; F310-V327 HydrophobicContact CZ-CB 3.75Å; F310-V327 HydrophobicContact CZ-CG1 3.92Å; F310-V327 HydrophobicContact CZ-CG2 4.24Å; F310-I328 HydrophobicContact CD2-CG1 4.41Å; F310-I328 HydrophobicContact CE2-CG1 4.3Å; F310-L444 HydrophobicContact CE1-CD2 3.76Å; F310-L444 HydrophobicContact CZ-CD2 3.87Å; F310-L447 HydrophobicContact CD1-CD1 3.86Å; F310-L447 HydrophobicContact CE1-CD1 3.69Å; F310-L447 HydrophobicContact CE2-CD2 4.4Å; F310-L447 HydrophobicContact CG-CD1 4.45Å; F310-L447 HydrophobicContact CZ-CD1 4.16Å; F310-L447 HydrophobicContact CZ-CD2 4.33Å
311	S	92.4	Very high	93.2	Very high	55 Å²	55	29 Å²	29	39%	0.385	18%	0.18	S	C	.	.	T	Hydrogen-bonded Turn	trans	-88.1	-3.2	176.5	-59.8	0	0	0	0	112.8	R264 H307 V308 M309 P313	R264-S311 PolarHBondContact NH2-OG 2.79Å; H307-S311 PolarHBondContact O-OG 2.85Å; V308-S311 VanDerWaalsContact O-CB 3.32Å; V308-S311 WeakPolarHBondContact O-CB 3.45Å; V308-S311 PolarHBondContact O-N 3.45Å; M309-S311 PolarHBondContact O-N 3.46Å; M309-S311 VanDerWaalsContact O-N 3.14Å; S311-P313 VanDerWaalsContact O-CD 3.29Å; S311-P313 WeakPolarHBondContact O-CD 3.28Å
312	A	89.8	Confident	93.2	Very high	12 Å²	12	29.4 Å²	29.4	10%	0.099	18%	0.183	C	C	.	.			trans	-58.7	122.9	173.8	0	0	0	0	0	110.7	M309 F310 S314 L315 N316 D525	M309-A312 VanDerWaalsContact O-CB 3.28Å; M309-A312 WeakPolarHBondContact O-CB 3.23Å; M309-A312 PolarHBondContact O-N 3.39Å; M309-A312 VanDerWaalsContact O-N 3.1Å; F310-A312 VanDerWaalsContact C-N 3.34Å; A312-S314 PolarHBondContact O-N 2.89Å; A312-S314 VanDerWaalsContact O-N 3.09Å; A312-L315 HydrophobicContact CB-CD1 4.43Å; A312-L315 HydrophobicContact CB-CG 4.32Å; A312-L315 PolarHBondContact O-N 2.9Å; A312-N316 PolarHBondContact O-N 3.49Å; A312-D525 HydrophobicContact CB-CB 4.3Å
313	P	87.4	Confident	93.1	Very high	79 Å²	79	30 Å²	30	51%	0.513	19%	0.185	S	C	.	.	G	3₁₀ helix	trans	-45.5	-38.9	175.7	-32.9	32.3	0	0	0	115.5	S311 L315 N316 D525	S311-P313 VanDerWaalsContact O-CD 3.29Å; S311-P313 WeakPolarHBondContact O-CD 3.28Å; P313-L315 PolarHBondContact O-N 3.27Å; P313-N316 WeakPolarHBondContact CA-ND2 3.27Å; P313-N316 VanDerWaalsContact O-CB 3.31Å; P313-N316 WeakPolarHBondContact O-CB 3.43Å; P313-N316 PolarHBondContact O-N 3.05Å; P313-D525 WeakPolarHBondContact CD-OD1 3.46Å; P313-D525 VanDerWaalsContact CD-OD2 3.25Å; P313-D525 WeakPolarHBondContact CD-OD2 3.48Å
314	S	84.3	Confident	93.1	Very high	31 Å²	31	31.6 Å²	31.6	22%	0.217	19%	0.192	C	C	.	.	G	3₁₀ helix	trans	-65.4	-22.1	178.3	54.8	0	0	0	0	114.4	A312 V522	A312-S314 PolarHBondContact O-N 2.89Å; A312-S314 VanDerWaalsContact O-N 3.09Å; S314-V522 WeakPolarHBondContact OG-CA 3.26Å; S314-V522 VanDerWaalsContact OG-CB 3.29Å; S314-V522 WeakPolarHBondContact OG-CB 3.27Å; S314-V522 PolarHBondContact OG-O 2.93Å
315	L	86.8	Confident	93.1	Very high	1 Å²	1	31.5 Å²	31.5	1%	0.005	19%	0.192	C	C	.	.	G	3₁₀ helix	trans	-100.1	-2.5	177	-57.6	-176.4	0	0	0	112.8	A312 P313 S317 V318 F319 L431 L447 W518 V522	A312-L315 HydrophobicContact CB-CD1 4.43Å; A312-L315 HydrophobicContact CB-CG 4.32Å; A312-L315 PolarHBondContact O-N 2.9Å; P313-L315 PolarHBondContact O-N 3.27Å; L315-S317 PolarHBondContact O-N 3.43Å; L315-V318 WeakPolarHBondContact O-CB 3.41Å; L315-V318 PolarHBondContact O-N 3.24Å; L315-V318 VanDerWaalsContact O-N 3.14Å; L315-F319 HydrophobicContact CB-CE2 4.49Å; L315-F319 HydrophobicContact CD1-CE2 4.48Å; L315-F319 HydrophobicContact CD2-CE2 4.2Å; L315-L431 HydrophobicContact CD2-CD2 3.97Å; L315-L447 HydrophobicContact CD1-CD1 4.09Å; L315-W518 HydrophobicContact CD1-CH2 3.89Å; L315-W518 HydrophobicContact CD1-CZ2 3.9Å; L315-V522 HydrophobicContact CD1-CG1 4.28Å; L315-V522 HydrophobicContact CD2-CG1 4.23Å; L315-V522 HydrophobicContact CG-CG1 4.16Å
316	N	81.6	Confident	93.1	Very high	95 Å²	95	31.5 Å²	31.5	51%	0.508	19%	0.192	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.4	129.9	178	-81.2	-23.4	0	0	0	110.7	A312 P313 V318	A312-N316 PolarHBondContact O-N 3.49Å; P313-N316 WeakPolarHBondContact CA-ND2 3.27Å; P313-N316 VanDerWaalsContact O-CB 3.31Å; P313-N316 WeakPolarHBondContact O-CB 3.43Å; P313-N316 PolarHBondContact O-N 3.05Å; N316-V318 PolarHBondContact O-N 3.44Å; N316-V318 VanDerWaalsContact O-N 3.08Å
317	S	82.7	Confident	93.1	Very high	117 Å²	117	31.5 Å²	31.5	82%	0.818	19%	0.192	S	C	*	.	T	Hydrogen-bonded Turn	trans	62.1	5.2	-178.2	-44.1	0	0	0	0	115.9	L315	L315-S317 PolarHBondContact O-N 3.43Å
318	V	89.1	Confident	93.2	Very high	30 Å²	30	31.2 Å²	31.2	18%	0.182	19%	0.19	C	C	.	.	T	Hydrogen-bonded Turn	trans	-71.5	-47.8	173.7	178	0	0	0	0	109.8	L315 N316 L431 L434 R440	L315-V318 WeakPolarHBondContact O-CB 3.41Å; L315-V318 PolarHBondContact O-N 3.24Å; L315-V318 VanDerWaalsContact O-N 3.14Å; N316-V318 PolarHBondContact O-N 3.44Å; N316-V318 VanDerWaalsContact O-N 3.08Å; V318-L431 HydrophobicContact CG1-CD2 3.91Å; V318-L431 HydrophobicContact CG2-CD2 4.06Å; V318-L434 HydrophobicContact CG1-CD1 3.84Å; V318-R440 PolarHBondContact O-NH1 3.48Å; V318-R440 PolarHBondContact O-NH2 2.97Å
319	F	94.5	Very high	93.3	Very high	6 Å²	6	30.4 Å²	30.4	3%	0.026	19%	0.185	C	C	.	.	S	Bend	trans	-99.5	137.8	-177.2	-55.8	-67.3	0	0	0	113.2	F310 L315 E323 K324 R440 V443 L444	F310-F319 HydrophobicContact CD1-CD2 4.15Å; F310-F319 AromaticContact CE1-CD2 3.77Å; F310-F319 HydrophobicContact CE1-CD2 3.77Å; F310-F319 HydrophobicContact CE1-CE2 4.31Å; F310-F319 HydrophobicContact CE1-CG 4.31Å; L315-F319 HydrophobicContact CB-CE2 4.49Å; L315-F319 HydrophobicContact CD1-CE2 4.48Å; L315-F319 HydrophobicContact CD2-CE2 4.2Å; F319-E323 HydrophobicContact CB-CB 4.27Å; F319-K324 HydrophobicContact CB-CG 4.2Å; F319-K324 VanDerWaalsContact O-CE 3.28Å; F319-K324 WeakPolarHBondContact O-CE 3.27Å; F319-K324 PolarHBondContact O-NZ 2.65Å; F319-K324 VanDerWaalsContact O-NZ 3.14Å; F319-R440 HydrophobicContact CE1-CB 4.45Å; F319-V443 HydrophobicContact CE1-CB 4.45Å; F319-V443 HydrophobicContact CE2-CG1 4.22Å; F319-V443 HydrophobicContact CZ-CB 3.81Å; F319-V443 HydrophobicContact CZ-CG1 3.61Å; F319-L444 HydrophobicContact CD1-CD1 4.11Å; F319-L444 HydrophobicContact CD1-CD2 3.61Å; F319-L444 HydrophobicContact CD1-CG 3.97Å; F319-L444 HydrophobicContact CD2-CD2 4Å; F319-L444 HydrophobicContact CE1-CD1 4.19Å; F319-L444 HydrophobicContact CE1-CD2 3.51Å; F319-L444 HydrophobicContact CE1-CG 3.64Å; F319-L444 HydrophobicContact CE2-CD2 3.89Å; F319-L444 HydrophobicContact CG-CD2 3.86Å; F319-L444 HydrophobicContact CZ-CD2 3.66Å; F319-L444 HydrophobicContact CZ-CG 4.11Å
320	T	95.6	Very high	93.4	Very high	70 Å²	70	30 Å²	30	43%	0.429	18%	0.183	S	C	.	.			trans	-66.1	160.4	171.5	67	0	0	0	0	110.7	L322 E323 K324	T320-L322 PolarHBondContact O-N 3.04Å; T320-E323 VanDerWaalsContact CB-OE2 3.3Å; T320-E323 WeakPolarHBondContact CB-OE2 3.44Å; T320-E323 WeakPolarHBondContact CG2-OE2 3.44Å; T320-E323 PolarHBondContact N-OE2 2.67Å; T320-E323 PolarHBondContact O-N 2.89Å; T320-E323 VanDerWaalsContact OG1-CD 3.3Å; T320-E323 WeakPolarHBondContact OG1-CG 3.28Å; T320-E323 PolarHBondContact OG1-N 2.86Å; T320-E323 PolarHBondContact OG1-OE2 3.04Å; T320-K324 PolarHBondContact O-N 3.48Å
321	D	96.9	Very high	93.6	Very high	65 Å²	65	29.8 Å²	29.8	35%	0.348	18%	0.182	S	C	.	.	H	α-helix	trans	-63.6	-27.8	176.7	-64.5	-30.8	0	0	0	112.1	L266 E269 F270 K324 F325	L266-D321 HydrophobicContact CD2-CB 3.95Å; E269-D321 HydrophobicContact CG-CB 4.29Å; F270-D321 HydrophobicContact CE2-CB 4.06Å; F270-D321 WeakPolarHBondContact CE2-O 3.46Å; F270-D321 VanDerWaalsContact CZ-C 3.48Å; F270-D321 HydrophobicContact CZ-CB 3.83Å; D321-K324 IonicContact OD1-NZ 3.32Å; D321-F325 VanDerWaalsContact O-CB 3.28Å; D321-F325 WeakPolarHBondContact O-CB 3.38Å; D321-F325 PolarHBondContact O-N 3.37Å
322	L	98.1	Very high	93.9	Very high	13 Å²	13	27.2 Å²	27.2	7%	0.068	16%	0.164	C	C	.	.	H	α-helix	trans	-70.7	-40.8	178.2	-173.8	70.8	0	0	0	111	F270 T320 F325 A326 L386 Q390 L393 F394	F270-L322 HydrophobicContact CE1-CB 4.34Å; F270-L322 HydrophobicContact CE1-CD1 4.03Å; F270-L322 HydrophobicContact CZ-CB 3.96Å; F270-L322 HydrophobicContact CZ-CD1 4.13Å; T320-L322 PolarHBondContact O-N 3.04Å; L322-F325 PolarHBondContact O-N 3.23Å; L322-A326 WeakPolarHBondContact O-CB 3.32Å; L322-A326 PolarHBondContact O-N 2.93Å; L322-L386 HydrophobicContact CD1-CD1 4.08Å; L322-L386 HydrophobicContact CD1-CD2 4.03Å; L322-Q390 HydrophobicContact CD1-CB 4.34Å; L322-Q390 HydrophobicContact CD2-CB 4.13Å; L322-Q390 HydrophobicContact CD2-CG 4.14Å; L322-L393 HydrophobicContact CD2-CB 4.16Å; L322-L393 HydrophobicContact CD2-CD2 3.86Å; L322-L393 HydrophobicContact CD2-CG 4.04Å; L322-F394 HydrophobicContact CD1-CB 4.19Å; L322-F394 HydrophobicContact CD1-CD2 4.35Å
323	E	98	Very high	94.4	Very high	12 Å²	12	26.6 Å²	26.6	6%	0.056	16%	0.159	C	C	.	.	H	α-helix	trans	-66.4	-45.1	175.2	-72.8	155.1	144	0	0	111.1	F319 T320 F325 A326 V327 I397 R440 L444	F319-E323 HydrophobicContact CB-CB 4.27Å; T320-E323 VanDerWaalsContact CB-OE2 3.3Å; T320-E323 WeakPolarHBondContact CB-OE2 3.44Å; T320-E323 WeakPolarHBondContact CG2-OE2 3.44Å; T320-E323 PolarHBondContact N-OE2 2.67Å; T320-E323 PolarHBondContact O-N 2.89Å; T320-E323 VanDerWaalsContact OG1-CD 3.3Å; T320-E323 WeakPolarHBondContact OG1-CG 3.28Å; T320-E323 PolarHBondContact OG1-N 2.86Å; T320-E323 PolarHBondContact OG1-OE2 3.04Å; E323-F325 VanDerWaalsContact C-N 3.31Å; E323-F325 PolarHBondContact O-N 3.02Å; E323-A326 PolarHBondContact O-N 3.02Å; E323-V327 WeakPolarHBondContact O-CG2 3.35Å; E323-V327 PolarHBondContact O-N 3.4Å; E323-I397 HydrophobicContact CB-CD1 4.43Å; E323-I397 HydrophobicContact CG-CD1 3.62Å; E323-R440 VanDerWaalsContact CD-NH2 3.27Å; E323-R440 IonicContact OE1-CZ 3.98Å; E323-R440 IonicContact OE1-NE 3.23Å; E323-R440 PolarHBondContact OE1-NE 2.93Å; E323-R440 IonicContact OE1-NH2 3.65Å; E323-R440 PolarHBondContact OE1-NH2 3.48Å; E323-R440 VanDerWaalsContact OE1-NH2 3.13Å; E323-R440 IonicContact OE2-CZ 3.98Å; E323-R440 IonicContact OE2-NE 3.97Å; E323-R440 IonicContact OE2-NH2 3.67Å; E323-R440 PolarHBondContact OE2-NH2 3.17Å; E323-L444 HydrophobicContact CB-CD1 3.95Å; E323-L444 HydrophobicContact CG-CD1 4.12Å
324	K	97.7	Very high	94.9	Very high	33 Å²	33	22.9 Å²	22.9	14%	0.143	14%	0.135	C	C	.	.	H	α-helix	trans	-58.2	-45.3	174.4	-70.3	168	-177.8	156.2	0	111.3	F310 F319 T320 D321 V327 I328	F310-K324 HydrophobicContact CD1-CG 4.24Å; F310-K324 HydrophobicContact CE1-CG 4.19Å; F310-K324 HydrophobicContact CE2-CB 4.49Å; F310-K324 HydrophobicContact CE2-CG 4.47Å; F310-K324 HydrophobicContact CG-CG 4.42Å; F310-K324 HydrophobicContact CZ-CG 4.3Å; F319-K324 HydrophobicContact CB-CG 4.2Å; F319-K324 VanDerWaalsContact O-CE 3.28Å; F319-K324 WeakPolarHBondContact O-CE 3.27Å; F319-K324 PolarHBondContact O-NZ 2.65Å; F319-K324 VanDerWaalsContact O-NZ 3.14Å; T320-K324 PolarHBondContact O-N 3.48Å; D321-K324 IonicContact OD1-NZ 3.32Å; K324-V327 PolarHBondContact O-N 3.08Å; K324-I328 WeakPolarHBondContact O-CB 3.34Å; K324-I328 VanDerWaalsContact O-CD1 3.32Å; K324-I328 WeakPolarHBondContact O-CD1 3.27Å; K324-I328 VanDerWaalsContact O-CG1 3.24Å; K324-I328 WeakPolarHBondContact O-CG1 3.26Å; K324-I328 PolarHBondContact O-N 3.39Å
325	F	98.5	Very high	95.6	Very high	0 Å²	0	21.9 Å²	21.9	0%	0	13%	0.127	C	C	.	.	H	α-helix	trans	-60.6	-46.9	175.8	175.4	-147.4	0	0	0	111.7	M261 L266 F270 I272 D321 L322 E323 V327 I328 F329 I382 L383 L386 F394	M261-F325 HydrophobicContact CE-CD2 3.78Å; M261-F325 HydrophobicContact CE-CE2 3.34Å; M261-F325 HydrophobicContact CE-CZ 4.11Å; M261-F325 HydrophobicContact SD-CE2 4.25Å; L266-F325 HydrophobicContact CD1-CB 4.08Å; L266-F325 HydrophobicContact CD2-CB 4.46Å; F270-F325 HydrophobicContact CD2-CB 4.17Å; F270-F325 AromaticContact CD2-CD1 3.67Å; F270-F325 HydrophobicContact CD2-CD1 3.67Å; F270-F325 HydrophobicContact CD2-CE1 4.4Å; F270-F325 HydrophobicContact CD2-CG 4.11Å; F270-F325 HydrophobicContact CE2-CB 3.79Å; F270-F325 AromaticContact CE2-CD1 4Å; F270-F325 HydrophobicContact CE2-CD1 4Å; F270-F325 HydrophobicContact CE2-CG 4.23Å; F270-F325 HydrophobicContact CG-CD1 4.28Å; I272-F325 HydrophobicContact CD1-CE1 4.06Å; I272-F325 HydrophobicContact CD1-CE2 4.12Å; I272-F325 HydrophobicContact CD1-CZ 3.75Å; D321-F325 VanDerWaalsContact O-CB 3.28Å; D321-F325 WeakPolarHBondContact O-CB 3.38Å; D321-F325 PolarHBondContact O-N 3.37Å; L322-F325 PolarHBondContact O-N 3.23Å; E323-F325 VanDerWaalsContact C-N 3.31Å; E323-F325 PolarHBondContact O-N 3.02Å; F325-V327 PolarHBondContact O-N 3.46Å; F325-I328 PolarHBondContact O-N 3.35Å; F325-F329 HydrophobicContact CE2-CB 4.38Å; F325-F329 VanDerWaalsContact O-CB 3.29Å; F325-F329 WeakPolarHBondContact O-CB 3.36Å; F325-F329 PolarHBondContact O-N 3.38Å; F325-I382 HydrophobicContact CE2-CD1 4.33Å; F325-I382 HydrophobicContact CZ-CD1 4.05Å; F325-I382 HydrophobicContact CZ-CG1 4.44Å; F325-L383 HydrophobicContact CE1-CD2 3.75Å; F325-L383 HydrophobicContact CZ-CD2 3.78Å; F325-L386 HydrophobicContact CE1-CD1 4.34Å; F325-F394 AromaticContact CD1-CD2 3.82Å; F325-F394 HydrophobicContact CD1-CD2 3.82Å; F325-F394 AromaticContact CD1-CE2 3.54Å; F325-F394 HydrophobicContact CD1-CE2 3.54Å; F325-F394 HydrophobicContact CD2-CE2 4.1Å; F325-F394 AromaticContact CE1-CD2 3.95Å; F325-F394 HydrophobicContact CE1-CD2 3.95Å; F325-F394 AromaticContact CE1-CE2 3.49Å; F325-F394 HydrophobicContact CE1-CE2 3.49Å; F325-F394 VanDerWaalsContact CE1-CE2 3.49Å; F325-F394 HydrophobicContact CE1-CZ 4.16Å; F325-F394 HydrophobicContact CE2-CE2 4.02Å; F325-F394 HydrophobicContact CE2-CZ 4.39Å; F325-F394 HydrophobicContact CG-CD2 4.38Å; F325-F394 AromaticContact CG-CE2 3.85Å; F325-F394 HydrophobicContact CG-CE2 3.85Å; F325-F394 AromaticContact CZ-CE2 3.73Å; F325-F394 HydrophobicContact CZ-CE2 3.73Å; F325-F394 HydrophobicContact CZ-CZ 4.04Å
326	A	98.8	Very high	96.2	Very high	0 Å²	0	21.8 Å²	21.8	0%	0	13%	0.127	C	C	.	.	H	α-helix	trans	-59.1	-44.3	178.5	0	0	0	0	0	112.3	L322 E323 F329 A330 F394 I397 V398	L322-A326 WeakPolarHBondContact O-CB 3.32Å; L322-A326 PolarHBondContact O-N 2.93Å; E323-A326 PolarHBondContact O-N 3.02Å; A326-F329 PolarHBondContact O-N 2.93Å; A326-A330 WeakPolarHBondContact O-CB 3.14Å; A326-A330 PolarHBondContact O-N 3.14Å; A326-F394 VanDerWaalsContact CA-CE2 3.5Å; A326-F394 HydrophobicContact CB-CD2 3.76Å; A326-F394 HydrophobicContact CB-CE2 4.02Å; A326-F394 HydrophobicContact CB-CG 4.47Å; A326-I397 HydrophobicContact CB-CB 3.79Å; A326-I397 HydrophobicContact CB-CD1 4.38Å; A326-I397 HydrophobicContact CB-CG2 3.53Å; A326-V398 HydrophobicContact CB-CG2 3.97Å; A326-V398 WeakPolarHBondContact O-CG2 3.28Å
327	V	98.7	Very high	97	Very high	0 Å²	0	18.9 Å²	18.9	0%	0	11%	0.111	C	C	.	.	H	α-helix	trans	-76.4	-35.1	-177.4	-179.2	0	0	0	0	112.8	V306 F310 E323 K324 F325 F329 A330 A331 I397 T401 L444 L447 I448	V306-V327 HydrophobicContact CG1-CG1 3.87Å; F310-V327 HydrophobicContact CE2-CB 3.9Å; F310-V327 HydrophobicContact CE2-CG1 3.97Å; F310-V327 HydrophobicContact CZ-CB 3.75Å; F310-V327 HydrophobicContact CZ-CG1 3.92Å; F310-V327 HydrophobicContact CZ-CG2 4.24Å; E323-V327 WeakPolarHBondContact O-CG2 3.35Å; E323-V327 PolarHBondContact O-N 3.4Å; K324-V327 PolarHBondContact O-N 3.08Å; F325-V327 PolarHBondContact O-N 3.46Å; V327-F329 VanDerWaalsContact C-N 3.3Å; V327-F329 PolarHBondContact O-N 3.48Å; V327-A330 PolarHBondContact O-N 3.23Å; V327-A331 WeakPolarHBondContact O-CB 3.47Å; V327-A331 PolarHBondContact O-N 3.29Å; V327-I397 HydrophobicContact CG2-CG2 4.09Å; V327-T401 HydrophobicContact CG2-CG2 4.12Å; V327-L444 HydrophobicContact CG2-CB 4.02Å; V327-L444 HydrophobicContact CG2-CD1 4.02Å; V327-L444 HydrophobicContact CG2-CD2 3.99Å; V327-L444 HydrophobicContact CG2-CG 4.21Å; V327-L447 HydrophobicContact CG1-CD2 4.12Å; V327-I448 HydrophobicContact CG1-CB 4.46Å
328	I	98.7	Very high	97.7	Very high	0 Å²	0	13.8 Å²	13.8	0%	0	7%	0.074	C	C	.	.	H	α-helix	trans	-62.8	-41.6	170.9	-70.8	160.3	0	0	0	110.3	T257 V260 M261 L266 T303 V306 F310 K324 F325 A332	T257-I328 HydrophobicContact CG2-CG2 4.48Å; V260-I328 HydrophobicContact CG1-CD1 3.7Å; V260-I328 HydrophobicContact CG1-CG1 4.13Å; V260-I328 HydrophobicContact CG1-CG2 3.88Å; M261-I328 HydrophobicContact CG-CG2 4.26Å; L266-I328 HydrophobicContact CD1-CD1 3.8Å; T303-I328 HydrophobicContact CG2-CG2 4.27Å; V306-I328 HydrophobicContact CG1-CG1 4.27Å; F310-I328 HydrophobicContact CD2-CG1 4.41Å; F310-I328 HydrophobicContact CE2-CG1 4.3Å; K324-I328 WeakPolarHBondContact O-CB 3.34Å; K324-I328 VanDerWaalsContact O-CD1 3.32Å; K324-I328 WeakPolarHBondContact O-CD1 3.27Å; K324-I328 VanDerWaalsContact O-CG1 3.24Å; K324-I328 WeakPolarHBondContact O-CG1 3.26Å; K324-I328 PolarHBondContact O-N 3.39Å; F325-I328 PolarHBondContact O-N 3.35Å; I328-A332 PolarHBondContact O-N 3.46Å
329	F	98.8	Very high	98.2	Very high	6 Å²	6	13.1 Å²	13.1	3%	0.026	7%	0.071	C	C	.	.	H	α-helix	trans	-64.4	-45.8	174	178.7	-90.2	0	0	0	111.4	Y280 F325 A326 V327 A331 A332 I333 L375 I382 F394 V398	Y280-F329 HydrophobicContact CD1-CE2 4.42Å; Y280-F329 HydrophobicContact CE1-CD2 4.36Å; Y280-F329 AromaticContact CE1-CE2 3.46Å; Y280-F329 HydrophobicContact CE1-CE2 3.46Å; Y280-F329 VanDerWaalsContact CE1-CE2 3.46Å; Y280-F329 HydrophobicContact CE1-CZ 4.13Å; Y280-F329 AromaticContact CZ-CE2 3.64Å; Y280-F329 AromaticContact CZ-CZ 3.84Å; Y280-F329 WeakPolarHBondContact OH-CE2 3.17Å; Y280-F329 WeakPolarHBondContact OH-CZ 3.36Å; F325-F329 HydrophobicContact CE2-CB 4.38Å; F325-F329 VanDerWaalsContact O-CB 3.29Å; F325-F329 WeakPolarHBondContact O-CB 3.36Å; F325-F329 PolarHBondContact O-N 3.38Å; A326-F329 PolarHBondContact O-N 2.93Å; V327-F329 VanDerWaalsContact C-N 3.3Å; V327-F329 PolarHBondContact O-N 3.48Å; F329-A331 VanDerWaalsContact C-N 3.35Å; F329-A331 PolarHBondContact O-N 2.95Å; F329-A332 PolarHBondContact O-N 2.82Å; F329-A332 VanDerWaalsContact O-N 3.13Å; F329-I333 HydrophobicContact CD1-CD1 4.17Å; F329-I333 HydrophobicContact CD1-CG1 4.31Å; F329-I333 HydrophobicContact CD1-CG2 4.36Å; F329-I333 HydrophobicContact CE1-CD1 3.72Å; F329-I333 HydrophobicContact CE1-CG1 4.21Å; F329-I333 HydrophobicContact CE1-CG2 4.03Å; F329-I333 HydrophobicContact CE2-CG2 4.33Å; F329-I333 HydrophobicContact CZ-CG2 4.01Å; F329-I333 WeakPolarHBondContact O-CG1 3.36Å; F329-I333 WeakPolarHBondContact O-CG2 3.27Å; F329-I333 PolarHBondContact O-N 3.34Å; F329-L375 HydrophobicContact CZ-CD1 4.23Å; F329-I382 HydrophobicContact CD2-CD1 3.91Å; F329-I382 HydrophobicContact CE2-CD1 3.82Å; F329-F394 HydrophobicContact CB-CE2 4.25Å; F329-F394 HydrophobicContact CB-CZ 3.88Å; F329-F394 HydrophobicContact CD1-CE1 4.15Å; F329-F394 AromaticContact CD1-CZ 3.71Å; F329-F394 HydrophobicContact CD1-CZ 3.71Å; F329-F394 HydrophobicContact CD2-CZ 4.15Å; F329-F394 HydrophobicContact CE1-CE1 4.28Å; F329-F394 HydrophobicContact CE1-CZ 4.23Å; F329-F394 HydrophobicContact CG-CE1 4.48Å; F329-F394 HydrophobicContact CG-CE2 4.49Å; F329-F394 AromaticContact CG-CZ 3.65Å; F329-F394 HydrophobicContact CG-CZ 3.65Å; F329-V398 HydrophobicContact CD1-CG1 3.93Å; F329-V398 HydrophobicContact CD1-CG2 3.77Å; F329-V398 HydrophobicContact CE1-CG1 4.06Å; F329-V398 HydrophobicContact CE1-CG2 4.4Å
330	A	98.9	Very high	98.3	Very high	0 Å²	0	13.1 Å²	13.1	0%	0	7%	0.073	C	C	.	.	H	α-helix	trans	-55.8	-48.3	177	0	0	0	0	0	111.4	A326 V327 A332 I333 H334 V398 T401 V402 I448	A326-A330 WeakPolarHBondContact O-CB 3.14Å; A326-A330 PolarHBondContact O-N 3.14Å; V327-A330 PolarHBondContact O-N 3.23Å; A330-A332 VanDerWaalsContact C-N 3.28Å; A330-A332 PolarHBondContact O-N 3Å; A330-I333 VanDerWaalsContact O-CG1 3.32Å; A330-I333 WeakPolarHBondContact O-CG1 3.4Å; A330-I333 PolarHBondContact O-N 2.84Å; A330-H334 WeakPolarHBondContact O-CA 3.2Å; A330-H334 WeakPolarHBondContact O-CB 3.43Å; A330-H334 PolarHBondContact O-N 3.2Å; A330-V398 HydrophobicContact CB-CG1 4.36Å; A330-T401 WeakPolarHBondContact CB-OG1 3.46Å; A330-V402 HydrophobicContact CB-CG2 3.85Å; A330-I448 HydrophobicContact CB-CD1 3.82Å
331	A	98.9	Very high	98.5	Very high	0 Å²	0	10.6 Å²	10.6	0%	0	6%	0.056	C	C	.	.	H	α-helix	trans	-58.1	-38.8	176.5	0	0	0	0	0	112.9	V302 V306 V327 F329 I333 H334 I448	V302-A331 HydrophobicContact CG1-CB 4.11Å; V306-A331 HydrophobicContact CB-CB 4.22Å; V306-A331 HydrophobicContact CG2-CB 3.85Å; V327-A331 WeakPolarHBondContact O-CB 3.47Å; V327-A331 PolarHBondContact O-N 3.29Å; F329-A331 VanDerWaalsContact C-N 3.35Å; F329-A331 PolarHBondContact O-N 2.95Å; A331-I333 VanDerWaalsContact C-N 3.27Å; A331-I333 PolarHBondContact O-N 3.46Å; A331-H334 PolarHBondContact O-ND1 3.47Å; A331-I448 HydrophobicContact CB-CD1 4.24Å
332	A	98.9	Very high	98.5	Very high	1 Å²	1	9.9 Å²	9.9	1%	0.008	6%	0.055	C	C	.	.	H	α-helix	trans	-71.6	-20.7	178.7	0	0	0	0	0	113.8	L253 T257 L284 Y288 T303 I328 F329 A330	L253-A332 HydrophobicContact CD1-CB 4.03Å; T257-A332 HydrophobicContact CG2-CB 4.15Å; L284-A332 HydrophobicContact CD2-CB 4.26Å; Y288-A332 WeakPolarHBondContact CE2-O 3.45Å; Y288-A332 PolarHBondContact OH-O 3.41Å; T303-A332 HydrophobicContact CG2-CB 4.48Å; T303-A332 VanDerWaalsContact OG1-CA 3.23Å; T303-A332 WeakPolarHBondContact OG1-CA 3.46Å; T303-A332 PolarHBondContact OG1-N 3.42Å; I328-A332 PolarHBondContact O-N 3.46Å; F329-A332 PolarHBondContact O-N 2.82Å; F329-A332 VanDerWaalsContact O-N 3.13Å; A330-A332 VanDerWaalsContact C-N 3.28Å; A330-A332 PolarHBondContact O-N 3Å
333	I	98.9	Very high	98.5	Very high	0 Å²	0	10.8 Å²	10.8	0%	0	6%	0.059	C	C	.	.	H	α-helix	trans	-112.3	-9	-175.2	69.2	150.8	0	0	0	114.1	L284 F329 A330 A331 D335 V336 L368 A371 V398 V402	L284-I333 HydrophobicContact CD1-CB 4.38Å; L284-I333 HydrophobicContact CD1-CG2 3.83Å; L284-I333 HydrophobicContact CD2-CG2 3.75Å; L284-I333 HydrophobicContact CG-CG2 4.46Å; F329-I333 HydrophobicContact CD1-CD1 4.17Å; F329-I333 HydrophobicContact CD1-CG1 4.31Å; F329-I333 HydrophobicContact CD1-CG2 4.36Å; F329-I333 HydrophobicContact CE1-CD1 3.72Å; F329-I333 HydrophobicContact CE1-CG1 4.21Å; F329-I333 HydrophobicContact CE1-CG2 4.03Å; F329-I333 HydrophobicContact CE2-CG2 4.33Å; F329-I333 HydrophobicContact CZ-CG2 4.01Å; F329-I333 WeakPolarHBondContact O-CG1 3.36Å; F329-I333 WeakPolarHBondContact O-CG2 3.27Å; F329-I333 PolarHBondContact O-N 3.34Å; A330-I333 VanDerWaalsContact O-CG1 3.32Å; A330-I333 WeakPolarHBondContact O-CG1 3.4Å; A330-I333 PolarHBondContact O-N 2.84Å; A331-I333 VanDerWaalsContact C-N 3.27Å; A331-I333 PolarHBondContact O-N 3.46Å; I333-D335 PolarHBondContact O-N 3.3Å; I333-V336 WeakPolarHBondContact O-CG1 3.39Å; I333-V336 PolarHBondContact O-N 3.25Å; I333-L368 HydrophobicContact CD1-CD2 4.23Å; I333-A371 HydrophobicContact CB-CB 3.69Å; I333-A371 HydrophobicContact CD1-CB 3.37Å; I333-A371 HydrophobicContact CG1-CB 4.12Å; I333-A371 HydrophobicContact CG2-CB 3.77Å; I333-V398 HydrophobicContact CD1-CG1 3.81Å; I333-V402 HydrophobicContact CD1-CG2 4.17Å; I333-V402 HydrophobicContact CG1-CG2 4.19Å
334	H	98.9	Very high	98.4	Very high	0 Å²	0	15.5 Å²	15.5	0%	0	8%	0.081	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.8	-18.9	-161.3	75.7	-72	0	0	0	114.5	H298 A330 A331 H367 V402 T405 D452	H298-H334 AromaticContact CD2-NE2 3.95Å; H298-H334 AromaticContact NE2-CE1 3.92Å; H298-H334 AromaticContact NE2-NE2 3.44Å; H298-H334 PolarHBondContact NE2-NE2 3.25Å; A330-H334 WeakPolarHBondContact O-CA 3.2Å; A330-H334 WeakPolarHBondContact O-CB 3.43Å; A330-H334 PolarHBondContact O-N 3.2Å; A331-H334 PolarHBondContact O-ND1 3.47Å; H334-H367 WeakPolarHBondContact O-CB 3.29Å; H334-H367 PolarHBondContact O-CD2 3.08Å; H334-V402 HydrophobicContact CB-CG1 4.32Å; H334-V402 HydrophobicContact CB-CG2 4.32Å; H334-T405 HydrophobicContact CB-CG2 4.4Å; H334-D452 IonicContact NE2-OD1 3.13Å
335	D	98.8	Very high	98.4	Very high	10 Å²	10	14.4 Å²	14.4	5%	0.053	8%	0.077	C	C	.	.	T	Hydrogen-bonded Turn	trans	-127.9	14.8	-178.2	-86.4	-25.5	0	0	0	114.1	Y288 H294 H298 I333 D337 H338 H367	Y288-D335 HydrophobicContact CE1-CB 3.72Å; Y288-D335 VanDerWaalsContact CE1-O 3.32Å; Y288-D335 WeakPolarHBondContact CE1-O 3.47Å; Y288-D335 PolarHBondContact OH-N 3.21Å; H294-D335 IonicContact CD2-OD1 3.36Å; H294-D335 IonicContact CD2-OD2 2.95Å; H294-D335 PolarHBondContact CD2-OD2 2.98Å; H294-D335 VanDerWaalsContact CD2-OD2 3.32Å; H298-D335 IonicContact CD2-OD2 3.37Å; H298-D335 PolarHBondContact CD2-OD2 3.08Å; H298-D335 IonicContact NE2-OD2 3.83Å; H298-D335 PolarHBondContact NE2-OD2 3.25Å; I333-D335 PolarHBondContact O-N 3.3Å; D335-D337 PolarHBondContact O-N 3.03Å; D335-H338 VanDerWaalsContact O-CB 3.28Å; D335-H338 WeakPolarHBondContact O-CB 3.33Å; D335-H338 PolarHBondContact O-N 3.09Å; D335-H338 VanDerWaalsContact O-N 3.08Å; D335-H338 IonicContact OD1-CD2 3.56Å; D335-H367 IonicContact OD1-CD2 3.75Å; D335-H367 IonicContact OD1-NE2 2.92Å
336	V	98.8	Very high	98.4	Very high	0 Å²	0	14.8 Å²	14.8	0%	0	8%	0.079	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.8	135	-176.5	65.9	0	0	0	0	111	L284 H287 Y288 I333 H338 H367 V370 A371	L284-V336 HydrophobicContact CD1-CB 3.87Å; L284-V336 HydrophobicContact CD1-CG1 4.41Å; L284-V336 HydrophobicContact CD1-CG2 3.61Å; H287-V336 HydrophobicContact CB-CG2 3.54Å; Y288-V336 HydrophobicContact CD2-CB 4.45Å; Y288-V336 HydrophobicContact CD2-CG2 4.33Å; Y288-V336 HydrophobicContact CE2-CB 3.94Å; Y288-V336 HydrophobicContact CE2-CG2 4.24Å; Y288-V336 PolarHBondContact OH-N 2.81Å; I333-V336 WeakPolarHBondContact O-CG1 3.39Å; I333-V336 PolarHBondContact O-N 3.25Å; V336-H338 VanDerWaalsContact C-N 3.25Å; V336-H338 PolarHBondContact O-N 2.65Å; V336-H367 HydrophobicContact CG1-CB 4.24Å; V336-H367 VanDerWaalsContact CG1-O 3.23Å; V336-H367 WeakPolarHBondContact CG1-O 3.12Å; V336-H367 PolarHBondContact O-ND1 3.04Å; V336-V370 HydrophobicContact CG1-CB 4.04Å; V336-V370 HydrophobicContact CG1-CG1 4.01Å; V336-V370 HydrophobicContact CG2-CG1 3.98Å; V336-A371 HydrophobicContact CG1-CB 4.17Å
337	D	98.6	Very high	98.3	Very high	33 Å²	33	16.7 Å²	16.7	18%	0.176	9%	0.09	C	C	.	.	T	Hydrogen-bonded Turn	trans	62.5	22.4	-176.3	-163.1	42	0	0	0	115.3	H287 R289 D335 H366 V370	H287-D337 VanDerWaalsContact O-CA 3.28Å; H287-D337 WeakPolarHBondContact O-CA 3.29Å; H287-D337 PolarHBondContact O-N 3.42Å; H287-D337 VanDerWaalsContact O-N 3.08Å; R289-D337 IonicContact CZ-OD1 2.65Å; R289-D337 IonicContact NE-OD1 3.95Å; R289-D337 PolarHBondContact NE-OD1 2.87Å; R289-D337 VanDerWaalsContact NH2-CG 3.29Å; R289-D337 IonicContact NH2-OD1 3.61Å; R289-D337 PolarHBondContact NH2-OD1 3.46Å; R289-D337 IonicContact NH2-OD2 3.82Å; R289-D337 PolarHBondContact NH2-OD2 2.97Å; D335-D337 PolarHBondContact O-N 3.03Å; D337-H366 IonicContact OD2-CD2 3.61Å; D337-H366 IonicContact OD2-CE1 3.73Å; D337-H366 IonicContact OD2-NE2 3.86Å; D337-H366 PolarHBondContact OD2-NE2 3.19Å; D337-V370 HydrophobicContact CB-CG1 4.41Å; D337-V370 HydrophobicContact CB-CG2 4.23Å
338	H	98.6	Very high	98.2	Very high	10 Å²	10	20.9 Å²	20.9	5%	0.046	11%	0.113	C	C	.	.			trans	-56.1	130.9	173.2	-167	-85.2	0	0	0	111.4	R289 N291 H294 D335 V336 G340 L341 H367 E473	R289-H338 WeakPolarHBondContact CD-O 3.39Å; N291-H338 PolarHBondContact ND2-O 3.14Å; H294-H338 HydrophobicContact CB-CB 3.86Å; H294-H338 WeakPolarHBondContact CB-ND1 3.36Å; H294-H338 AromaticContact CE1-CE1 3.97Å; H294-H338 AromaticContact CG-CE1 3.63Å; H294-H338 AromaticContact CG-CG 3.92Å; H294-H338 AromaticContact CG-ND1 3.63Å; H294-H338 AromaticContact CG-NE2 3.94Å; H294-H338 AromaticContact ND1-CE1 3.42Å; H294-H338 PolarHBondContact ND1-CE1 3.31Å; H294-H338 AromaticContact ND1-ND1 3.75Å; H294-H338 AromaticContact ND1-NE2 3.94Å; D335-H338 VanDerWaalsContact O-CB 3.28Å; D335-H338 WeakPolarHBondContact O-CB 3.33Å; D335-H338 PolarHBondContact O-N 3.09Å; D335-H338 VanDerWaalsContact O-N 3.08Å; D335-H338 IonicContact OD1-CD2 3.56Å; V336-H338 VanDerWaalsContact C-N 3.25Å; V336-H338 PolarHBondContact O-N 2.65Å; H338-G340 VanDerWaalsContact C-N 3.31Å; H338-G340 WeakPolarHBondContact ND1-CA 3.33Å; H338-G340 PolarHBondContact ND1-N 2.6Å; H338-G340 PolarHBondContact O-N 3Å; H338-L341 PolarHBondContact CE1-O 2.71Å; H338-H367 AromaticContact CD2-CE1 3.85Å; H338-H367 AromaticContact CD2-NE2 3.73Å; H338-E473 IonicContact CE1-OE1 3.79Å; H338-E473 IonicContact ND1-OE1 3.55Å
339	P	98.2	Very high	98.1	Very high	16 Å²	16	23 Å²	23	10%	0.104	13%	0.128	C	C	.	.			trans	-84.5	-0.2	-174.6	34.2	-36.7	0	0	0	114.7	L341 L346 L363	P339-L341 HydrophobicContact CB-CD1 4.39Å; P339-L341 HydrophobicContact CG-CB 4.17Å; P339-L346 HydrophobicContact CG-CD1 4.43Å; P339-L346 HydrophobicContact CG-CD2 4.46Å; P339-L363 HydrophobicContact CG-CD2 3.82Å
340	G	98.1	Very high	98	Very high	7 Å²	7	24.8 Å²	24.8	7%	0.072	15%	0.148	C	C	.	.	S	Bend	trans	73.9	33.5	-174	0	0	0	0	0	112.9	H338 E473	H338-G340 VanDerWaalsContact C-N 3.31Å; H338-G340 WeakPolarHBondContact ND1-CA 3.33Å; H338-G340 PolarHBondContact ND1-N 2.6Å; H338-G340 PolarHBondContact O-N 3Å; G340-E473 VanDerWaalsContact CA-OE1 3.28Å; G340-E473 WeakPolarHBondContact CA-OE1 3.48Å
341	L	98	Very high	97.9	Very high	16 Å²	16	26 Å²	26	8%	0.084	16%	0.156	C	C	.	.	S	Bend	trans	-145.6	148.4	-174.3	-62.6	167.6	0	0	0	108.9	H338 P339 F345 L346 L363 Q477 K480	H338-L341 PolarHBondContact CE1-O 2.71Å; P339-L341 HydrophobicContact CB-CD1 4.39Å; P339-L341 HydrophobicContact CG-CB 4.17Å; L341-F345 HydrophobicContact CB-CB 4.42Å; L341-F345 HydrophobicContact CB-CD1 3.98Å; L341-F345 HydrophobicContact CB-CG 4.29Å; L341-F345 HydrophobicContact CD1-CD1 3.66Å; L341-F345 HydrophobicContact CD1-CE1 3.49Å; L341-F345 VanDerWaalsContact CD1-CE1 3.49Å; L341-F345 HydrophobicContact CD1-CZ 4.25Å; L341-F345 HydrophobicContact CD2-CD1 3.93Å; L341-F345 HydrophobicContact CD2-CD2 4.17Å; L341-F345 HydrophobicContact CD2-CE1 3.99Å; L341-F345 HydrophobicContact CD2-CE2 4.2Å; L341-F345 HydrophobicContact CD2-CG 4.04Å; L341-F345 HydrophobicContact CD2-CZ 4.11Å; L341-F345 HydrophobicContact CG-CD1 4.07Å; L341-F345 HydrophobicContact CG-CE1 4.24Å; L341-L346 HydrophobicContact CD1-CD2 4.41Å; L341-L363 WeakPolarHBondContact O-CD1 3.49Å; L341-Q477 HydrophobicContact CD2-CB 3.85Å; L341-Q477 HydrophobicContact CD2-CG 3.74Å; L341-K480 HydrophobicContact CD2-CD 3.77Å
342	T	98.1	Very high	97.8	Very high	51 Å²	51	33 Å²	33	31%	0.313	19%	0.189	S	C	.	.			trans	-76.9	159.7	179.1	66.8	0	0	0	0	113.2	Q344 F345 L346	T342-Q344 PolarHBondContact O-N 2.88Å; T342-F345 WeakPolarHBondContact O-CB 3.34Å; T342-F345 PolarHBondContact O-N 2.85Å; T342-F345 VanDerWaalsContact O-N 3.12Å; T342-F345 PolarHBondContact OG1-N 3.02Å; T342-L346 PolarHBondContact O-N 3.12Å; T342-L346 VanDerWaalsContact O-N 3.12Å
343	N	97.7	Very high	97.7	Very high	31 Å²	31	34.4 Å²	34.4	17%	0.166	20%	0.196	C	C	.	.	H	α-helix	trans	-49.2	-43.8	168.9	-82.6	-29.9	0	0	0	111.7	F345 L346 V347 V362 L363 E364	N343-F345 PolarHBondContact O-N 3.2Å; N343-L346 WeakPolarHBondContact O-CB 3.48Å; N343-L346 PolarHBondContact O-N 3.24Å; N343-V347 WeakPolarHBondContact O-CG2 3.24Å; N343-V347 PolarHBondContact O-N 3.12Å; N343-V362 WeakPolarHBondContact OD1-CB 3.4Å; N343-V362 PolarHBondContact OD1-N 2.71Å; N343-L363 VanDerWaalsContact OD1-CB 3.28Å; N343-L363 WeakPolarHBondContact OD1-CB 3.47Å; N343-L363 WeakPolarHBondContact OD1-CD1 3.16Å; N343-L363 WeakPolarHBondContact OD1-CG 3.37Å; N343-L363 PolarHBondContact OD1-N 3.14Å; N343-E364 PolarHBondContact ND2-OE1 3.2Å; N343-E364 PolarHBondContact ND2-OE2 3.14Å
344	Q	96.7	Very high	97.6	Very high	111 Å²	111	34.4 Å²	34.4	52%	0.519	20%	0.196	S	C	.	.	H	α-helix	trans	-65.1	-38.9	-179.3	-169.6	62.3	58.3	0	0	112.7	T342 L346 V347 N348	T342-Q344 PolarHBondContact O-N 2.88Å; Q344-L346 VanDerWaalsContact C-N 3.34Å; Q344-V347 PolarHBondContact O-N 3.49Å; Q344-N348 PolarHBondContact NE2-OD1 2.77Å; Q344-N348 WeakPolarHBondContact O-CB 3.23Å; Q344-N348 PolarHBondContact O-N 3.44Å; Q344-N348 PolarHBondContact O-ND2 3.46Å; Q344-N348 PolarHBondContact O-OD1 3.01Å
345	F	97.9	Very high	97.6	Very high	10 Å²	10	39.9 Å²	39.9	4%	0.044	22%	0.224	C	C	.	.	H	α-helix	trans	-61.1	-45.1	173.5	178.4	-78	0	0	0	111	L341 T342 N343 V347 N348 S349 Q477 K480 E481 L484	L341-F345 HydrophobicContact CB-CB 4.42Å; L341-F345 HydrophobicContact CB-CD1 3.98Å; L341-F345 HydrophobicContact CB-CG 4.29Å; L341-F345 HydrophobicContact CD1-CD1 3.66Å; L341-F345 HydrophobicContact CD1-CE1 3.49Å; L341-F345 VanDerWaalsContact CD1-CE1 3.49Å; L341-F345 HydrophobicContact CD1-CZ 4.25Å; L341-F345 HydrophobicContact CD2-CD1 3.93Å; L341-F345 HydrophobicContact CD2-CD2 4.17Å; L341-F345 HydrophobicContact CD2-CE1 3.99Å; L341-F345 HydrophobicContact CD2-CE2 4.2Å; L341-F345 HydrophobicContact CD2-CG 4.04Å; L341-F345 HydrophobicContact CD2-CZ 4.11Å; L341-F345 HydrophobicContact CG-CD1 4.07Å; L341-F345 HydrophobicContact CG-CE1 4.24Å; T342-F345 WeakPolarHBondContact O-CB 3.34Å; T342-F345 PolarHBondContact O-N 2.85Å; T342-F345 VanDerWaalsContact O-N 3.12Å; T342-F345 PolarHBondContact OG1-N 3.02Å; N343-F345 PolarHBondContact O-N 3.2Å; F345-V347 VanDerWaalsContact C-N 3.32Å; F345-V347 PolarHBondContact O-N 3.39Å; F345-N348 PolarHBondContact O-N 3.01Å; F345-S349 WeakPolarHBondContact O-CB 3.22Å; F345-S349 PolarHBondContact O-N 3.16Å; F345-S349 PolarHBondContact O-OG 3.42Å; F345-Q477 HydrophobicContact CB-CG 4.5Å; F345-Q477 HydrophobicContact CD2-CG 3.74Å; F345-Q477 HydrophobicContact CE2-CG 4.34Å; F345-Q477 HydrophobicContact CG-CG 4.31Å; F345-K480 HydrophobicContact CE2-CB 4.17Å; F345-K480 HydrophobicContact CZ-CB 4.16Å; F345-E481 HydrophobicContact CD2-CG 3.6Å; F345-E481 HydrophobicContact CE2-CG 3.61Å; F345-L484 HydrophobicContact CE2-CD1 4.34Å; F345-L484 HydrophobicContact CZ-CD1 3.71Å
346	L	97.9	Very high	97.5	Very high	9 Å²	9	42.5 Å²	42.5	5%	0.047	24%	0.237	C	C	.	.	H	α-helix	trans	-62.4	-37.9	-179.9	-68.5	-175.9	0	0	0	112.6	P339 L341 T342 N343 Q344 S349 G350 S351 L353 A354 V362 L363	P339-L346 HydrophobicContact CG-CD1 4.43Å; P339-L346 HydrophobicContact CG-CD2 4.46Å; L341-L346 HydrophobicContact CD1-CD2 4.41Å; T342-L346 PolarHBondContact O-N 3.12Å; T342-L346 VanDerWaalsContact O-N 3.12Å; N343-L346 WeakPolarHBondContact O-CB 3.48Å; N343-L346 PolarHBondContact O-N 3.24Å; Q344-L346 VanDerWaalsContact C-N 3.34Å; L346-S349 WeakPolarHBondContact CA-OG 3.5Å; L346-S349 PolarHBondContact O-OG 3.42Å; L346-G350 PolarHBondContact O-N 3.08Å; L346-S351 WeakPolarHBondContact CB-OG 3.33Å; L346-S351 WeakPolarHBondContact O-CB 3.34Å; L346-S351 PolarHBondContact O-N 3.06Å; L346-S351 PolarHBondContact O-OG 3.35Å; L346-L353 HydrophobicContact CD1-CD1 4.31Å; L346-A354 HydrophobicContact CB-CB 4.43Å; L346-A354 VanDerWaalsContact O-CB 3.29Å; L346-A354 WeakPolarHBondContact O-CB 3.29Å; L346-V362 HydrophobicContact CD1-CG1 3.98Å; L346-L363 HydrophobicContact CD1-CD1 4.43Å; L346-L363 HydrophobicContact CD1-CD2 3.65Å; L346-L363 HydrophobicContact CD1-CG 3.84Å
347	V	97.2	Very high	97.5	Very high	39 Å²	39	43.8 Å²	43.8	24%	0.236	24%	0.242	C	C	.	.	H	α-helix	trans	-68.5	-49.7	174.9	172.9	0	0	0	0	110.7	N343 Q344 F345 S349 G350 A354 D359 V362	N343-V347 WeakPolarHBondContact O-CG2 3.24Å; N343-V347 PolarHBondContact O-N 3.12Å; Q344-V347 PolarHBondContact O-N 3.49Å; F345-V347 VanDerWaalsContact C-N 3.32Å; F345-V347 PolarHBondContact O-N 3.39Å; V347-S349 VanDerWaalsContact C-N 3.28Å; V347-S349 PolarHBondContact O-N 2.86Å; V347-G350 PolarHBondContact O-N 3.39Å; V347-A354 HydrophobicContact CG2-CB 4.07Å; V347-D359 HydrophobicContact CG1-CB 4.25Å; V347-D359 HydrophobicContact CG2-CB 3.77Å; V347-V362 HydrophobicContact CG2-CG2 4.35Å
348	N	95.8	Very high	97.4	Very high	89 Å²	89	48.2 Å²	48.2	48%	0.476	27%	0.266	S	S	.	.	H	α-helix	trans	-62.7	-35.1	-178.4	-71	-8	0	0	0	112.8	Q344 F345 G350	Q344-N348 PolarHBondContact NE2-OD1 2.77Å; Q344-N348 WeakPolarHBondContact O-CB 3.23Å; Q344-N348 PolarHBondContact O-N 3.44Å; Q344-N348 PolarHBondContact O-ND2 3.46Å; Q344-N348 PolarHBondContact O-OD1 3.01Å; F345-N348 PolarHBondContact O-N 3.01Å; N348-G350 VanDerWaalsContact C-N 3.28Å; N348-G350 PolarHBondContact O-N 3.44Å
349	S	96.4	Very high	97.4	Very high	45 Å²	45	51.9 Å²	51.9	32%	0.315	29%	0.286	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.5	-8.4	176.7	56.4	0	0	0	0	114.3	F345 L346 V347 S351	F345-S349 WeakPolarHBondContact O-CB 3.22Å; F345-S349 PolarHBondContact O-N 3.16Å; F345-S349 PolarHBondContact O-OG 3.42Å; L346-S349 WeakPolarHBondContact CA-OG 3.5Å; L346-S349 PolarHBondContact O-OG 3.42Å; V347-S349 VanDerWaalsContact C-N 3.28Å; V347-S349 PolarHBondContact O-N 2.86Å; S349-S351 PolarHBondContact O-N 2.77Å
350	G	95.7	Very high	97.2	Very high	43 Å²	43	56.4 Å²	56.4	44%	0.443	31%	0.305	S	S	.	.	T	Hydrogen-bonded Turn	trans	62.2	34.5	-173.8	0	0	0	0	0	112.5	L346 V347 N348 I355	L346-G350 PolarHBondContact O-N 3.08Å; V347-G350 PolarHBondContact O-N 3.39Å; N348-G350 VanDerWaalsContact C-N 3.28Å; N348-G350 PolarHBondContact O-N 3.44Å; G350-I355 WeakPolarHBondContact O-CD1 3.13Å
351	S	96.9	Very high	97.2	Very high	25 Å²	25	56.8 Å²	56.8	18%	0.175	31%	0.307	C	S	.	.			trans	-59.1	153.4	-177.5	70.1	0	0	0	0	112.2	L346 S349 L353 A354 I355	L346-S351 WeakPolarHBondContact CB-OG 3.33Å; L346-S351 WeakPolarHBondContact O-CB 3.34Å; L346-S351 PolarHBondContact O-N 3.06Å; L346-S351 PolarHBondContact O-OG 3.35Å; S349-S351 PolarHBondContact O-N 2.77Å; S351-L353 PolarHBondContact O-N 2.83Å; S351-A354 PolarHBondContact O-N 2.82Å; S351-A354 VanDerWaalsContact O-N 3.12Å; S351-A354 WeakPolarHBondContact OG-CB 3.24Å; S351-A354 PolarHBondContact OG-N 3.32Å; S351-I355 WeakPolarHBondContact O-CG1 3.43Å; S351-I355 PolarHBondContact O-N 2.79Å
352	E	97.6	Very high	97.2	Very high	146 Å²	146	56 Å²	56	68%	0.682	30%	0.303	S	S	*	.	H	α-helix	trans	-57.8	-34.1	177.2	-65	-170.8	165.9	0	0	112.4	M356	E352-M356 VanDerWaalsContact O-CB 3.23Å; E352-M356 WeakPolarHBondContact O-CB 3.44Å; E352-M356 PolarHBondContact O-N 3.08Å
353	L	97.3	Very high	97.3	Very high	32 Å²	32	53.9 Å²	53.9	17%	0.168	29%	0.289	C	S	.	.	H	α-helix	trans	-65.9	-47.2	176.2	-65.1	-178.8	0	0	0	111.4	L346 S351 I355 M356 Y357 V362 H366	L346-L353 HydrophobicContact CD1-CD1 4.31Å; S351-L353 PolarHBondContact O-N 2.83Å; L353-I355 VanDerWaalsContact C-N 3.31Å; L353-I355 PolarHBondContact O-N 3.13Å; L353-M356 PolarHBondContact O-N 3.03Å; L353-M356 VanDerWaalsContact O-N 3.15Å; L353-Y357 HydrophobicContact CD2-CE2 4.2Å; L353-Y357 VanDerWaalsContact O-CD2 3.27Å; L353-Y357 WeakPolarHBondContact O-CD2 3.32Å; L353-Y357 PolarHBondContact O-N 3.47Å; L353-V362 VanDerWaalsContact C-CG1 3.48Å; L353-V362 HydrophobicContact CB-CG1 3.69Å; L353-H366 WeakPolarHBondContact CD2-ND1 3.22Å
354	A	97.4	Very high	97.3	Very high	0 Å²	0	53.2 Å²	53.2	0%	0	29%	0.285	C	S	.	.	H	α-helix	trans	-60.7	-42.6	178.5	0	0	0	0	0	111.6	L346 V347 S351 Y357 N358 D359 V362	L346-A354 HydrophobicContact CB-CB 4.43Å; L346-A354 VanDerWaalsContact O-CB 3.29Å; L346-A354 WeakPolarHBondContact O-CB 3.29Å; V347-A354 HydrophobicContact CG2-CB 4.07Å; S351-A354 PolarHBondContact O-N 2.82Å; S351-A354 VanDerWaalsContact O-N 3.12Å; S351-A354 WeakPolarHBondContact OG-CB 3.24Å; S351-A354 PolarHBondContact OG-N 3.32Å; A354-Y357 PolarHBondContact O-N 3.21Å; A354-N358 WeakPolarHBondContact O-CA 3.22Å; A354-N358 PolarHBondContact O-N 3.15Å; A354-D359 PolarHBondContact O-N 2.73Å; A354-V362 HydrophobicContact CB-CG1 4.42Å; A354-V362 HydrophobicContact CB-CG2 4.36Å
355	I	97.3	Very high	97.4	Very high	115 Å²	115	51.2 Å²	51.2	59%	0.59	28%	0.276	S	S	*	.	H	α-helix	trans	-62.8	-43.5	174.4	-63.5	169	0	0	0	111.2	G350 S351 L353 Y357	G350-I355 WeakPolarHBondContact O-CD1 3.13Å; S351-I355 WeakPolarHBondContact O-CG1 3.43Å; S351-I355 PolarHBondContact O-N 2.79Å; L353-I355 VanDerWaalsContact C-N 3.31Å; L353-I355 PolarHBondContact O-N 3.13Å; I355-Y357 PolarHBondContact O-N 3.12Å
356	M	97.5	Very high	97.4	Very high	65 Å²	65	51.8 Å²	51.8	32%	0.32	28%	0.279	S	S	.	.	H	α-helix	trans	-62.9	-42.2	-178.8	-175.1	178.4	-53.6	0	0	112.2	A206 M207 E352 L353	A206-M356 HydrophobicContact CB-CE 3.92Å; M207-M356 HydrophobicContact CE-SD 4.23Å; E352-M356 VanDerWaalsContact O-CB 3.23Å; E352-M356 WeakPolarHBondContact O-CB 3.44Å; E352-M356 PolarHBondContact O-N 3.08Å; L353-M356 PolarHBondContact O-N 3.03Å; L353-M356 VanDerWaalsContact O-N 3.15Å
357	Y	97.6	Very high	97.5	Very high	27 Å²	27	51.4 Å²	51.4	11%	0.106	28%	0.277	C	S	.	.	H	α-helix	trans	-97.8	4.3	-176.1	-63	-61.8	0	0	0	113.9	L353 A354 I355 D359 E360 V362 Q365 H366 A369	L353-Y357 HydrophobicContact CD2-CE2 4.2Å; L353-Y357 VanDerWaalsContact O-CD2 3.27Å; L353-Y357 WeakPolarHBondContact O-CD2 3.32Å; L353-Y357 PolarHBondContact O-N 3.47Å; A354-Y357 PolarHBondContact O-N 3.21Å; I355-Y357 PolarHBondContact O-N 3.12Å; Y357-D359 VanDerWaalsContact C-N 3.33Å; Y357-D359 PolarHBondContact O-N 3.25Å; Y357-E360 PolarHBondContact O-N 3.42Å; Y357-V362 HydrophobicContact CD2-CG1 4.14Å; Y357-V362 VanDerWaalsContact CD2-O 3.27Å; Y357-V362 WeakPolarHBondContact CD2-O 3.42Å; Y357-Q365 HydrophobicContact CD1-CB 3.46Å; Y357-Q365 VanDerWaalsContact CD1-CB 3.46Å; Y357-Q365 HydrophobicContact CD1-CG 4.21Å; Y357-Q365 HydrophobicContact CD2-CB 4.37Å; Y357-Q365 HydrophobicContact CE1-CB 3.62Å; Y357-Q365 HydrophobicContact CG-CB 3.88Å; Y357-H366 HydrophobicContact CE2-CB 3.7Å; Y357-A369 VanDerWaalsContact OH-CB 3.26Å; Y357-A369 WeakPolarHBondContact OH-CB 3.48Å
358	N	97.5	Very high	97.5	Very high	126 Å²	126	50.1 Å²	50.1	67%	0.674	27%	0.268	S	S	*	.	T	Hydrogen-bonded Turn	trans	55.6	44.9	177.3	-51.6	-87.3	0	0	0	112.9	A354 E360	A354-N358 WeakPolarHBondContact O-CA 3.22Å; A354-N358 PolarHBondContact O-N 3.15Å; N358-E360 PolarHBondContact O-N 2.89Å
359	D	97.7	Very high	97.7	Very high	87 Å²	87	47.5 Å²	47.5	47%	0.465	26%	0.259	S	S	.	.	T	Hydrogen-bonded Turn	trans	62.8	4.5	177.1	-49.6	-27.2	0	0	0	116.1	V347 A354 Y357	V347-D359 HydrophobicContact CG1-CB 4.25Å; V347-D359 HydrophobicContact CG2-CB 3.77Å; A354-D359 PolarHBondContact O-N 2.73Å; Y357-D359 VanDerWaalsContact C-N 3.33Å; Y357-D359 PolarHBondContact O-N 3.25Å
360	E	95.7	Very high	97.8	Very high	111 Å²	111	46.5 Å²	46.5	52%	0.519	25%	0.251	S	S	.	.	S	Bend	trans	-102.5	119.4	-179.6	-70.6	-72.5	149.7	0	0	111.1	Y357 N358 V362 Q365	Y357-E360 PolarHBondContact O-N 3.42Å; N358-E360 PolarHBondContact O-N 2.89Å; E360-V362 PolarHBondContact O-N 3.14Å; E360-V362 VanDerWaalsContact O-N 3.13Å; E360-Q365 PolarHBondContact O-NE2 3.22Å
361	S	97.2	Very high	97.9	Very high	15 Å²	15	44.4 Å²	44.4	11%	0.105	23%	0.23	C	C	.	.	S	Bend	trans	41.5	51.9	177.4	-51.8	0	0	0	0	112.3	L363 E364 Q365 D406	S361-L363 PolarHBondContact O-N 3.4Å; S361-E364 WeakPolarHBondContact CA-OE2 3.4Å; S361-E364 WeakPolarHBondContact CB-OE2 3.14Å; S361-E364 PolarHBondContact O-N 3.26Å; S361-Q365 WeakPolarHBondContact O-CB 3.42Å; S361-Q365 WeakPolarHBondContact O-CG 3.45Å; S361-Q365 PolarHBondContact O-N 3.41Å; S361-D406 WeakPolarHBondContact CB-OD2 3.47Å; S361-D406 PolarHBondContact OG-OD2 2.96Å
362	V	98.5	Very high	98	Very high	0 Å²	0	44.3 Å²	44.3	0%	0	23%	0.226	C	C	.	.	H	α-helix	trans	-59.5	-47.6	-164.4	174.2	0	0	0	0	111.1	N343 L346 V347 L353 A354 Y357 E360 H366	N343-V362 WeakPolarHBondContact OD1-CB 3.4Å; N343-V362 PolarHBondContact OD1-N 2.71Å; L346-V362 HydrophobicContact CD1-CG1 3.98Å; V347-V362 HydrophobicContact CG2-CG2 4.35Å; L353-V362 VanDerWaalsContact C-CG1 3.48Å; L353-V362 HydrophobicContact CB-CG1 3.69Å; A354-V362 HydrophobicContact CB-CG1 4.42Å; A354-V362 HydrophobicContact CB-CG2 4.36Å; Y357-V362 HydrophobicContact CD2-CG1 4.14Å; Y357-V362 VanDerWaalsContact CD2-O 3.27Å; Y357-V362 WeakPolarHBondContact CD2-O 3.42Å; E360-V362 PolarHBondContact O-N 3.14Å; E360-V362 VanDerWaalsContact O-N 3.13Å; V362-H366 WeakPolarHBondContact O-CB 3.42Å; V362-H366 PolarHBondContact O-N 2.81Å
363	L	98.7	Very high	98	Very high	5 Å²	5	41 Å²	41	3%	0.026	21%	0.21	C	C	.	.	H	α-helix	trans	-70.1	-47.7	179.3	-74.3	167.3	0	0	0	111.3	P339 L341 N343 L346 S361 Q365 H366 H367	P339-L363 HydrophobicContact CG-CD2 3.82Å; L341-L363 WeakPolarHBondContact O-CD1 3.49Å; N343-L363 VanDerWaalsContact OD1-CB 3.28Å; N343-L363 WeakPolarHBondContact OD1-CB 3.47Å; N343-L363 WeakPolarHBondContact OD1-CD1 3.16Å; N343-L363 WeakPolarHBondContact OD1-CG 3.37Å; N343-L363 PolarHBondContact OD1-N 3.14Å; L346-L363 HydrophobicContact CD1-CD1 4.43Å; L346-L363 HydrophobicContact CD1-CD2 3.65Å; L346-L363 HydrophobicContact CD1-CG 3.84Å; S361-L363 PolarHBondContact O-N 3.4Å; L363-Q365 VanDerWaalsContact C-N 3.32Å; L363-Q365 PolarHBondContact O-N 3.13Å; L363-H366 CarbonylContact O-C 3.38Å; L363-H366 WeakPolarHBondContact O-CA 3.29Å; L363-H366 VanDerWaalsContact O-CB 3.26Å; L363-H366 WeakPolarHBondContact O-CB 3.28Å; L363-H366 PolarHBondContact O-N 3.01Å; L363-H367 PolarHBondContact O-CD2 3.35Å; L363-H367 PolarHBondContact O-N 3.26Å; L363-H367 PolarHBondContact O-ND1 3.44Å; L363-H367 PolarHBondContact O-NE2 2.88Å
364	E	98.8	Very high	98	Very high	18 Å²	18	39.6 Å²	39.6	8%	0.084	20%	0.202	C	C	.	.	H	α-helix	trans	-64.3	-38.3	-175.8	-57.9	76.2	-162.2	0	0	111.6	N343 S361 L368 V402 L403 D406	N343-E364 PolarHBondContact ND2-OE1 3.2Å; N343-E364 PolarHBondContact ND2-OE2 3.14Å; S361-E364 WeakPolarHBondContact CA-OE2 3.4Å; S361-E364 WeakPolarHBondContact CB-OE2 3.14Å; S361-E364 PolarHBondContact O-N 3.26Å; E364-L368 WeakPolarHBondContact O-CG 3.34Å; E364-L368 PolarHBondContact O-N 3.04Å; E364-V402 HydrophobicContact CB-CG1 4.47Å; E364-L403 HydrophobicContact CB-CD2 4Å; E364-D406 HydrophobicContact CG-CB 3.85Å
365	Q	98.6	Very high	98	Very high	69 Å²	69	40.3 Å²	40.3	32%	0.322	21%	0.206	S	C	.	.	H	α-helix	trans	-65.6	-38	170.5	-72.3	-164.4	87.5	0	0	112.4	Y357 E360 S361 L363 A369 L403	Y357-Q365 HydrophobicContact CD1-CB 3.46Å; Y357-Q365 VanDerWaalsContact CD1-CB 3.46Å; Y357-Q365 HydrophobicContact CD1-CG 4.21Å; Y357-Q365 HydrophobicContact CD2-CB 4.37Å; Y357-Q365 HydrophobicContact CE1-CB 3.62Å; Y357-Q365 HydrophobicContact CG-CB 3.88Å; E360-Q365 PolarHBondContact O-NE2 3.22Å; S361-Q365 WeakPolarHBondContact O-CB 3.42Å; S361-Q365 WeakPolarHBondContact O-CG 3.45Å; S361-Q365 PolarHBondContact O-N 3.41Å; L363-Q365 VanDerWaalsContact C-N 3.32Å; L363-Q365 PolarHBondContact O-N 3.13Å; Q365-A369 WeakPolarHBondContact O-CB 3.37Å; Q365-A369 PolarHBondContact O-N 3.21Å; Q365-L403 HydrophobicContact CG-CD2 3.78Å
366	H	98.6	Very high	98	Very high	21 Å²	21	41.4 Å²	41.4	10%	0.097	21%	0.209	C	C	.	.	H	α-helix	trans	-64.7	-46.5	176.3	-174.8	58.3	0	0	0	112.5	D337 L353 Y357 V362 L363 L368 A369 V370	D337-H366 IonicContact OD2-CD2 3.61Å; D337-H366 IonicContact OD2-CE1 3.73Å; D337-H366 IonicContact OD2-NE2 3.86Å; D337-H366 PolarHBondContact OD2-NE2 3.19Å; L353-H366 WeakPolarHBondContact CD2-ND1 3.22Å; Y357-H366 HydrophobicContact CE2-CB 3.7Å; V362-H366 WeakPolarHBondContact O-CB 3.42Å; V362-H366 PolarHBondContact O-N 2.81Å; L363-H366 CarbonylContact O-C 3.38Å; L363-H366 WeakPolarHBondContact O-CA 3.29Å; L363-H366 VanDerWaalsContact O-CB 3.26Å; L363-H366 WeakPolarHBondContact O-CB 3.28Å; L363-H366 PolarHBondContact O-N 3.01Å; H366-L368 VanDerWaalsContact C-N 3.3Å; H366-L368 PolarHBondContact O-N 3.27Å; H366-A369 PolarHBondContact O-N 3.05Å; H366-V370 VanDerWaalsContact CE1-CG2 3.47Å; H366-V370 WeakPolarHBondContact CE1-CG2 3.36Å; H366-V370 WeakPolarHBondContact O-CG2 3.49Å; H366-V370 PolarHBondContact O-N 3.1Å
367	H	98.8	Very high	97.9	Very high	1 Å²	1	41.2 Å²	41.2	1%	0.005	21%	0.207	C	C	.	.	H	α-helix	trans	-54.9	-47.2	176.6	-56.7	-35.9	0	0	0	110.9	H334 D335 V336 H338 L363 A371 V402	H334-H367 WeakPolarHBondContact O-CB 3.29Å; H334-H367 PolarHBondContact O-CD2 3.08Å; D335-H367 IonicContact OD1-CD2 3.75Å; D335-H367 IonicContact OD1-NE2 2.92Å; V336-H367 HydrophobicContact CG1-CB 4.24Å; V336-H367 VanDerWaalsContact CG1-O 3.23Å; V336-H367 WeakPolarHBondContact CG1-O 3.12Å; V336-H367 PolarHBondContact O-ND1 3.04Å; H338-H367 AromaticContact CD2-CE1 3.85Å; H338-H367 AromaticContact CD2-NE2 3.73Å; L363-H367 PolarHBondContact O-CD2 3.35Å; L363-H367 PolarHBondContact O-N 3.26Å; L363-H367 PolarHBondContact O-ND1 3.44Å; L363-H367 PolarHBondContact O-NE2 2.88Å; H367-A371 VanDerWaalsContact O-CB 3.29Å; H367-A371 WeakPolarHBondContact O-CB 3.48Å; H367-A371 PolarHBondContact O-N 2.89Å; H367-V402 HydrophobicContact CB-CG1 4.43Å
368	L	98.8	Very high	97.7	Very high	12 Å²	12	44.5 Å²	44.5	6%	0.063	23%	0.232	C	C	.	.	H	α-helix	trans	-60	-48.1	173.5	-74.4	165.6	0	0	0	112.4	I333 E364 H366 V370 A371 F372 V398 I399 V402 L403	I333-L368 HydrophobicContact CD1-CD2 4.23Å; E364-L368 WeakPolarHBondContact O-CG 3.34Å; E364-L368 PolarHBondContact O-N 3.04Å; H366-L368 VanDerWaalsContact C-N 3.3Å; H366-L368 PolarHBondContact O-N 3.27Å; L368-V370 PolarHBondContact O-N 3.48Å; L368-A371 PolarHBondContact O-N 2.81Å; L368-F372 HydrophobicContact CD2-CD2 4.35Å; L368-F372 HydrophobicContact CD2-CE2 3.85Å; L368-F372 WeakPolarHBondContact O-CB 3.3Å; L368-F372 VanDerWaalsContact O-CD2 3.23Å; L368-F372 WeakPolarHBondContact O-CD2 3.36Å; L368-F372 PolarHBondContact O-N 3.49Å; L368-V398 HydrophobicContact CD2-CG1 3.84Å; L368-I399 HydrophobicContact CD1-CB 4.34Å; L368-I399 HydrophobicContact CD1-CG1 4.23Å; L368-I399 HydrophobicContact CD1-CG2 4.2Å; L368-I399 HydrophobicContact CD2-CG1 4.05Å; L368-V402 HydrophobicContact CD1-CB 4.12Å; L368-V402 HydrophobicContact CD1-CG1 4.24Å; L368-V402 HydrophobicContact CD2-CB 3.8Å; L368-V402 HydrophobicContact CD2-CG1 4.24Å; L368-V402 HydrophobicContact CD2-CG2 3.89Å; L368-V402 HydrophobicContact CG-CB 3.86Å; L368-V402 HydrophobicContact CG-CG1 3.82Å; L368-V402 HydrophobicContact CG-CG2 4.39Å; L368-L403 HydrophobicContact CD1-CD2 3.95Å; L368-L403 HydrophobicContact CD1-CG 3.88Å
369	A	98.5	Very high	97.6	Very high	35 Å²	35	44.2 Å²	44.2	29%	0.289	23%	0.23	S	C	.	.	H	α-helix	trans	-60.2	-47.2	-177.9	0	0	0	0	0	111.8	Y357 Q365 H366 K373	Y357-A369 VanDerWaalsContact OH-CB 3.26Å; Y357-A369 WeakPolarHBondContact OH-CB 3.48Å; Q365-A369 WeakPolarHBondContact O-CB 3.37Å; Q365-A369 PolarHBondContact O-N 3.21Å; H366-A369 PolarHBondContact O-N 3.05Å; A369-K373 WeakPolarHBondContact O-CB 3.46Å; A369-K373 PolarHBondContact O-N 2.96Å
370	V	98.4	Very high	97.6	Very high	23 Å²	23	40 Å²	40	14%	0.139	21%	0.208	C	C	.	.	H	α-helix	trans	-61.4	-52.6	176.8	173.2	0	0	0	0	110.5	V336 D337 H366 L368 F372 K373 L374	V336-V370 HydrophobicContact CG1-CB 4.04Å; V336-V370 HydrophobicContact CG1-CG1 4.01Å; V336-V370 HydrophobicContact CG2-CG1 3.98Å; D337-V370 HydrophobicContact CB-CG1 4.41Å; D337-V370 HydrophobicContact CB-CG2 4.23Å; H366-V370 VanDerWaalsContact CE1-CG2 3.47Å; H366-V370 WeakPolarHBondContact CE1-CG2 3.36Å; H366-V370 WeakPolarHBondContact O-CG2 3.49Å; H366-V370 PolarHBondContact O-N 3.1Å; L368-V370 PolarHBondContact O-N 3.48Å; V370-F372 PolarHBondContact O-N 2.67Å; V370-K373 WeakPolarHBondContact O-CA 3.36Å; V370-K373 WeakPolarHBondContact O-CB 3.37Å; V370-K373 PolarHBondContact O-N 3.17Å; V370-L374 HydrophobicContact CG1-CD1 4.36Å; V370-L374 WeakPolarHBondContact O-CG 3.29Å; V370-L374 PolarHBondContact O-N 3.34Å
371	A	98.5	Very high	97.6	Very high	0 Å²	0	36.7 Å²	36.7	0%	0	19%	0.193	C	C	.	.	H	α-helix	trans	-60.1	-42	-176.4	0	0	0	0	0	113.5	Y280 I333 V336 H367 L368 L374	Y280-A371 PolarHBondContact OH-O 3.17Å; I333-A371 HydrophobicContact CB-CB 3.69Å; I333-A371 HydrophobicContact CD1-CB 3.37Å; I333-A371 HydrophobicContact CG1-CB 4.12Å; I333-A371 HydrophobicContact CG2-CB 3.77Å; V336-A371 HydrophobicContact CG1-CB 4.17Å; H367-A371 VanDerWaalsContact O-CB 3.29Å; H367-A371 WeakPolarHBondContact O-CB 3.48Å; H367-A371 PolarHBondContact O-N 2.89Å; L368-A371 PolarHBondContact O-N 2.81Å; A371-L374 PolarHBondContact O-N 3.37Å
372	F	98.4	Very high	97.7	Very high	22 Å²	22	36.1 Å²	36.1	10%	0.096	19%	0.189	C	C	.	.	H	α-helix	trans	-75.8	-24.7	176.5	-79.2	-71.1	0	0	0	113	L368 V370 L375 F394 R395 V398 I399	L368-F372 HydrophobicContact CD2-CD2 4.35Å; L368-F372 HydrophobicContact CD2-CE2 3.85Å; L368-F372 WeakPolarHBondContact O-CB 3.3Å; L368-F372 VanDerWaalsContact O-CD2 3.23Å; L368-F372 WeakPolarHBondContact O-CD2 3.36Å; L368-F372 PolarHBondContact O-N 3.49Å; V370-F372 PolarHBondContact O-N 2.67Å; F372-L375 HydrophobicContact CD1-CD1 3.74Å; F372-L375 HydrophobicContact CE1-CD1 4.19Å; F372-F394 HydrophobicContact CE1-CE1 4.48Å; F372-R395 HydrophobicContact CE1-CB 4.27Å; F372-R395 HydrophobicContact CE1-CG 4.04Å; F372-R395 HydrophobicContact CE2-CG 4.36Å; F372-R395 HydrophobicContact CZ-CB 4.2Å; F372-R395 HydrophobicContact CZ-CG 3.81Å; F372-V398 HydrophobicContact CE2-CB 4.4Å; F372-V398 HydrophobicContact CE2-CG1 3.84Å; F372-V398 HydrophobicContact CZ-CB 3.99Å; F372-V398 HydrophobicContact CZ-CG1 3.79Å; F372-I399 HydrophobicContact CE2-CG1 4.24Å
373	K	98.2	Very high	97.6	Very high	78 Å²	78	36.6 Å²	36.6	34%	0.339	19%	0.192	S	C	.	.	H	α-helix	trans	-68.9	-40.4	170.7	177.2	58.8	-174.7	165.9	0	110.9	I210 A369 V370 L375 Q376	I210-K373 HydrophobicContact CD1-CG 4.4Å; A369-K373 WeakPolarHBondContact O-CB 3.46Å; A369-K373 PolarHBondContact O-N 2.96Å; V370-K373 WeakPolarHBondContact O-CA 3.36Å; V370-K373 WeakPolarHBondContact O-CB 3.37Å; V370-K373 PolarHBondContact O-N 3.17Å; K373-L375 PolarHBondContact O-N 3.33Å; K373-Q376 VanDerWaalsContact O-CB 3.3Å; K373-Q376 WeakPolarHBondContact O-CB 3.01Å; K373-Q376 PolarHBondContact O-N 3.33Å
374	L	97.8	Very high	97.5	Very high	2 Å²	2	40 Å²	40	1%	0.01	21%	0.213	C	C	.	.	H	α-helix	trans	-58.7	-33.1	176.3	-70.5	176.6	0	0	0	113.1	Y280 H283 L284 V370 A371 Q376 E377 C380	Y280-L374 HydrophobicContact CD2-CB 4.29Å; Y280-L374 HydrophobicContact CE2-CB 3.65Å; H283-L374 HydrophobicContact CB-CD2 4.5Å; L284-L374 HydrophobicContact CB-CD1 4.4Å; L284-L374 HydrophobicContact CD1-CD1 4.27Å; V370-L374 HydrophobicContact CG1-CD1 4.36Å; V370-L374 WeakPolarHBondContact O-CG 3.29Å; V370-L374 PolarHBondContact O-N 3.34Å; A371-L374 PolarHBondContact O-N 3.37Å; L374-Q376 PolarHBondContact O-N 2.99Å; L374-Q376 VanDerWaalsContact O-N 3.12Å; L374-E377 WeakPolarHBondContact O-CB 3.41Å; L374-E377 PolarHBondContact O-N 3.13Å; L374-E377 VanDerWaalsContact O-N 3.08Å; L374-C380 WeakPolarHBondContact O-CB 3.19Å
375	L	97.6	Very high	97.4	Very high	14 Å²	14	40.7 Å²	40.7	7%	0.073	22%	0.224	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.6	-15.2	174.4	-69.4	172	0	0	0	113.5	Y280 F329 F372 K373 C380 D381 I382 L383	Y280-L375 HydrophobicContact CD2-CD2 3.64Å; Y280-L375 HydrophobicContact CD2-CG 4.24Å; Y280-L375 HydrophobicContact CE2-CB 4.43Å; Y280-L375 HydrophobicContact CE2-CD2 3.42Å; Y280-L375 VanDerWaalsContact CE2-CD2 3.42Å; Y280-L375 HydrophobicContact CE2-CG 3.6Å; Y280-L375 HydrophobicContact CG-CD2 4.34Å; F329-L375 HydrophobicContact CZ-CD1 4.23Å; F372-L375 HydrophobicContact CD1-CD1 3.74Å; F372-L375 HydrophobicContact CE1-CD1 4.19Å; K373-L375 PolarHBondContact O-N 3.33Å; L375-C380 WeakPolarHBondContact CD2-O 3.14Å; L375-D381 WeakPolarHBondContact O-CA 3.45Å; L375-D381 WeakPolarHBondContact O-CB 3.43Å; L375-D381 PolarHBondContact O-N 2.97Å; L375-I382 HydrophobicContact CD2-CD1 4.45Å; L375-I382 HydrophobicContact CD2-CG1 3.78Å; L375-L383 HydrophobicContact CD1-CD1 3.83Å; L375-L383 HydrophobicContact CD1-CG 4.38Å
376	Q	96.6	Very high	97.4	Very high	138 Å²	138	38 Å²	38	65%	0.645	21%	0.212	S	C	*	.	T	Hydrogen-bonded Turn	trans	-92	-8.3	177.3	-56	176.3	19	0	0	113	K373 L374	K373-Q376 VanDerWaalsContact O-CB 3.3Å; K373-Q376 WeakPolarHBondContact O-CB 3.01Å; K373-Q376 PolarHBondContact O-N 3.33Å; L374-Q376 PolarHBondContact O-N 2.99Å; L374-Q376 VanDerWaalsContact O-N 3.12Å
377	E	94.5	Very high	97.3	Very high	61 Å²	61	39.7 Å²	39.7	29%	0.285	23%	0.227	S	C	.	.	S	Bend	trans	-67.1	154.7	174.3	-67.2	-56.8	136.5	0	0	110.8	L374 D379 C380	L374-E377 WeakPolarHBondContact O-CB 3.41Å; L374-E377 PolarHBondContact O-N 3.13Å; L374-E377 VanDerWaalsContact O-N 3.08Å; E377-D379 PolarHBondContact O-N 3.01Å; E377-C380 HydrophobicContact CB-CB 4.06Å; E377-C380 WeakPolarHBondContact O-CB 3.4Å; E377-C380 PolarHBondContact O-N 3.49Å
378	P	94.5	Very high	97.2	Very high	97 Å²	97	47 Å²	47	63%	0.63	26%	0.261	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53	132.4	177.1	-25.3	34.9	0	0	0	111.7	C380	P378-C380 PolarHBondContact O-N 3.25Å; P378-C380 VanDerWaalsContact O-N 3.17Å
379	D	95.3	Very high	97.1	Very high	119 Å²	119	54.4 Å²	54.4	64%	0.636	29%	0.293	S	S	*	.	T	Hydrogen-bonded Turn	trans	59.8	20.6	178.3	-54.3	-45.2	0	0	0	115.6	M276 E377	M276-D379 WeakPolarHBondContact CA-O 3.39Å; M276-D379 VanDerWaalsContact CB-O 3.22Å; M276-D379 WeakPolarHBondContact CB-O 3.49Å; M276-D379 WeakPolarHBondContact CG-O 3.36Å; E377-D379 PolarHBondContact O-N 3.01Å
380	C	97.1	Very high	97	Very high	0 Å²	0	55.9 Å²	55.9	0%	0	29%	0.294	C	S	.	.			trans	-108	-9.1	-179.2	-76.5	0	0	0	0	115.3	Y280 L374 L375 E377 P378 I382	Y280-C380 HydrophobicContact CD2-CB 4.11Å; Y280-C380 WeakPolarHBondContact CD2-O 3.43Å; L374-C380 WeakPolarHBondContact O-CB 3.19Å; L375-C380 WeakPolarHBondContact CD2-O 3.14Å; E377-C380 HydrophobicContact CB-CB 4.06Å; E377-C380 WeakPolarHBondContact O-CB 3.4Å; E377-C380 PolarHBondContact O-N 3.49Å; P378-C380 PolarHBondContact O-N 3.25Å; P378-C380 VanDerWaalsContact O-N 3.17Å; C380-I382 PolarHBondContact O-N 3.39Å
381	D	97.5	Very high	97	Very high	40 Å²	40	58.8 Å²	58.8	21%	0.214	30%	0.302	C	S	.	.			trans	-73.2	86.5	-179.8	-172.6	-2.1	0	0	0	112	M276 L375 L383 T384 R391	M276-D381 HydrophobicContact CE-CB 4.17Å; M276-D381 WeakPolarHBondContact CE-O 3.48Å; L375-D381 WeakPolarHBondContact O-CA 3.45Å; L375-D381 WeakPolarHBondContact O-CB 3.43Å; L375-D381 PolarHBondContact O-N 2.97Å; D381-L383 PolarHBondContact O-N 3.23Å; D381-L383 VanDerWaalsContact O-N 3.16Å; D381-L383 WeakPolarHBondContact OD1-CB 3.38Å; D381-L383 PolarHBondContact OD1-N 3.37Å; D381-T384 HydrophobicContact CB-CG2 4.05Å; D381-T384 VanDerWaalsContact O-CG2 3.31Å; D381-T384 WeakPolarHBondContact O-CG2 3.4Å; D381-R391 VanDerWaalsContact CG-NH2 3.33Å; D381-R391 IonicContact OD1-CZ 3.68Å; D381-R391 IonicContact OD1-NH1 3.56Å; D381-R391 IonicContact OD1-NH2 3.18Å; D381-R391 PolarHBondContact OD1-NH2 3.49Å; D381-R391 IonicContact OD2-CZ 3.33Å; D381-R391 IonicContact OD2-NH1 2.93Å; D381-R391 PolarHBondContact OD2-NH1 2.95Å; D381-R391 IonicContact OD2-NH2 2.75Å; D381-R391 PolarHBondContact OD2-NH2 3.28Å
382	I	97.8	Very high	97	Very high	3 Å²	3	64.4 Å²	64.4	2%	0.015	33%	0.328	C	S	.	.	T	Hydrogen-bonded Turn	trans	-69.8	-6.7	178.4	70.1	175.3	0	0	0	113.3	I272 L277 Y280 F325 F329 L375 C380	I272-I382 HydrophobicContact CG2-CB 4.02Å; L277-I382 HydrophobicContact CB-CG2 4.34Å; L277-I382 HydrophobicContact CD1-CD1 4.16Å; L277-I382 HydrophobicContact CD1-CG2 4.08Å; Y280-I382 HydrophobicContact CD1-CD1 4.26Å; Y280-I382 HydrophobicContact CD1-CG2 4.46Å; Y280-I382 HydrophobicContact CG-CG2 4.08Å; F325-I382 HydrophobicContact CE2-CD1 4.33Å; F325-I382 HydrophobicContact CZ-CD1 4.05Å; F325-I382 HydrophobicContact CZ-CG1 4.44Å; F329-I382 HydrophobicContact CD2-CD1 3.91Å; F329-I382 HydrophobicContact CE2-CD1 3.82Å; L375-I382 HydrophobicContact CD2-CD1 4.45Å; L375-I382 HydrophobicContact CD2-CG1 3.78Å; C380-I382 PolarHBondContact O-N 3.39Å
383	L	97.7	Very high	96.9	Very high	11 Å²	11	66.4 Å²	66.4	6%	0.058	34%	0.34	C	S	.	.	T	Hydrogen-bonded Turn	trans	-96.4	7.4	-174.3	-51.7	179.8	0	0	0	112.4	F325 L375 D381 G385 L386 R391 F394	F325-L383 HydrophobicContact CE1-CD2 3.75Å; F325-L383 HydrophobicContact CZ-CD2 3.78Å; L375-L383 HydrophobicContact CD1-CD1 3.83Å; L375-L383 HydrophobicContact CD1-CG 4.38Å; D381-L383 PolarHBondContact O-N 3.23Å; D381-L383 VanDerWaalsContact O-N 3.16Å; D381-L383 WeakPolarHBondContact OD1-CB 3.38Å; D381-L383 PolarHBondContact OD1-N 3.37Å; L383-G385 PolarHBondContact O-N 2.9Å; L383-L386 HydrophobicContact CB-CD1 4.23Å; L383-L386 HydrophobicContact CD2-CD1 3.9Å; L383-L386 WeakPolarHBondContact O-CB 3.25Å; L383-L386 PolarHBondContact O-N 3.12Å; L383-R391 HydrophobicContact CB-CG 4.36Å; L383-R391 VanDerWaalsContact O-CZ 3.23Å; L383-R391 PolarHBondContact O-NE 3Å; L383-R391 PolarHBondContact O-NH2 3.29Å; L383-F394 HydrophobicContact CD1-CD1 3.84Å; L383-F394 HydrophobicContact CD1-CE1 3.75Å; L383-F394 HydrophobicContact CD2-CD1 4Å; L383-F394 HydrophobicContact CD2-CE1 3.65Å; L383-F394 HydrophobicContact CD2-CE2 4.19Å; L383-F394 HydrophobicContact CD2-CG 4.44Å; L383-F394 HydrophobicContact CD2-CZ 3.75Å; L383-F394 HydrophobicContact CG-CE1 4.36Å
384	T	96	Very high	96.9	Very high	76 Å²	76	62.7 Å²	62.7	47%	0.466	32%	0.324	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.2	-29.4	-176.4	50	0	0	0	0	114.1	M276 D381	M276-T384 HydrophobicContact CE-CG2 4.34Å; D381-T384 HydrophobicContact CB-CG2 4.05Å; D381-T384 VanDerWaalsContact O-CG2 3.31Å; D381-T384 WeakPolarHBondContact O-CG2 3.4Å
385	G	96.2	Very high	97	Very high	32 Å²	32	68.2 Å²	68.2	33%	0.33	34%	0.344	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.6	-12.2	175.2	0	0	0	0	0	115.7	F270 L383	F270-G385 WeakPolarHBondContact O-CA 3.38Å; L383-G385 PolarHBondContact O-N 2.9Å
386	L	97.8	Very high	97	Very high	12 Å²	12	71.4 Å²	71.4	6%	0.063	36%	0.355	C	S	.	.	S	Bend	trans	-82.2	139	179.8	-60.3	-172.2	0	0	0	112	F270 L322 F325 L383 Q390 R391 F394	F270-L386 HydrophobicContact CB-CD2 3.82Å; F270-L386 HydrophobicContact CD1-CD2 3.22Å; F270-L386 HydrophobicContact CE1-CD2 3.98Å; F270-L386 HydrophobicContact CG-CD2 3.66Å; L322-L386 HydrophobicContact CD1-CD1 4.08Å; L322-L386 HydrophobicContact CD1-CD2 4.03Å; F325-L386 HydrophobicContact CE1-CD1 4.34Å; L383-L386 HydrophobicContact CB-CD1 4.23Å; L383-L386 HydrophobicContact CD2-CD1 3.9Å; L383-L386 WeakPolarHBondContact O-CB 3.25Å; L383-L386 PolarHBondContact O-N 3.12Å; L386-Q390 HydrophobicContact CB-CB 3.98Å; L386-Q390 HydrophobicContact CD2-CB 4.31Å; L386-R391 HydrophobicContact CB-CG 3.67Å; L386-R391 HydrophobicContact CD1-CG 4.33Å; L386-F394 HydrophobicContact CD1-CB 4.19Å; L386-F394 HydrophobicContact CD1-CD2 4.47Å; L386-F394 HydrophobicContact CD1-CG 4.29Å
387	S	97.4	Very high	97.1	Very high	58 Å²	58	64.8 Å²	64.8	41%	0.406	32%	0.324	S	S	.	.			trans	-63.1	161.8	167.1	67.2	0	0	0	0	111.8	K389 Q390 R391	S387-K389 VanDerWaalsContact C-N 3.26Å; S387-K389 PolarHBondContact O-N 3.49Å; S387-Q390 PolarHBondContact O-N 2.95Å; S387-Q390 WeakPolarHBondContact OG-CB 3.4Å; S387-Q390 VanDerWaalsContact OG-CG 3.32Å; S387-Q390 WeakPolarHBondContact OG-CG 3.41Å; S387-Q390 PolarHBondContact OG-N 3.47Å; S387-Q390 PolarHBondContact OG-OE1 2.87Å; S387-R391 PolarHBondContact O-N 2.91Å
388	Q	96.2	Very high	97.3	Very high	154 Å²	154	61.9 Å²	61.9	72%	0.72	31%	0.311	S	S	*	.	H	α-helix	trans	-56.5	-39.7	178.3	-171.2	179.7	20.2	0	0	112.6	R391 Q392	Q388-R391 PolarHBondContact O-N 3.06Å; Q388-Q392 WeakPolarHBondContact O-CG 3.49Å; Q388-Q392 PolarHBondContact O-N 2.76Å
389	K	96.4	Very high	97.5	Very high	168 Å²	168	59.4 Å²	59.4	73%	0.73	29%	0.292	S	S	*	.	H	α-helix	trans	-65.3	-43.1	176.3	-172.5	-178.8	178.3	-173.9	0	111.3	S387 Q392 L393	S387-K389 VanDerWaalsContact C-N 3.26Å; S387-K389 PolarHBondContact O-N 3.49Å; K389-Q392 PolarHBondContact O-N 3.5Å; K389-L393 PolarHBondContact O-N 3.33Å
390	Q	98	Very high	97.7	Very high	66 Å²	66	55.7 Å²	55.7	31%	0.308	27%	0.272	S	S	.	.	H	α-helix	trans	-65.5	-41.8	176.3	-74	166.6	-52.9	0	0	111.8	L322 L386 S387 Q392 L393 F394	L322-Q390 HydrophobicContact CD1-CB 4.34Å; L322-Q390 HydrophobicContact CD2-CB 4.13Å; L322-Q390 HydrophobicContact CD2-CG 4.14Å; L386-Q390 HydrophobicContact CB-CB 3.98Å; L386-Q390 HydrophobicContact CD2-CB 4.31Å; S387-Q390 PolarHBondContact O-N 2.95Å; S387-Q390 WeakPolarHBondContact OG-CB 3.4Å; S387-Q390 VanDerWaalsContact OG-CG 3.32Å; S387-Q390 WeakPolarHBondContact OG-CG 3.41Å; S387-Q390 PolarHBondContact OG-N 3.47Å; S387-Q390 PolarHBondContact OG-OE1 2.87Å; Q390-Q392 VanDerWaalsContact C-N 3.32Å; Q390-Q392 PolarHBondContact O-N 3Å; Q390-L393 PolarHBondContact O-N 3.26Å; Q390-F394 WeakPolarHBondContact O-CB 3.42Å; Q390-F394 PolarHBondContact O-N 3.2Å
391	R	97.9	Very high	97.8	Very high	83 Å²	83	55.7 Å²	55.7	31%	0.313	27%	0.272	S	S	.	.	H	α-helix	trans	-59.9	-41.7	175.2	-74.8	-169.2	171	-141.9	3.1	112.3	D381 L383 L386 S387 Q388 R395	D381-R391 VanDerWaalsContact CG-NH2 3.33Å; D381-R391 IonicContact OD1-CZ 3.68Å; D381-R391 IonicContact OD1-NH1 3.56Å; D381-R391 IonicContact OD1-NH2 3.18Å; D381-R391 PolarHBondContact OD1-NH2 3.49Å; D381-R391 IonicContact OD2-CZ 3.33Å; D381-R391 IonicContact OD2-NH1 2.93Å; D381-R391 PolarHBondContact OD2-NH1 2.95Å; D381-R391 IonicContact OD2-NH2 2.75Å; D381-R391 PolarHBondContact OD2-NH2 3.28Å; L383-R391 HydrophobicContact CB-CG 4.36Å; L383-R391 VanDerWaalsContact O-CZ 3.23Å; L383-R391 PolarHBondContact O-NE 3Å; L383-R391 PolarHBondContact O-NH2 3.29Å; L386-R391 HydrophobicContact CB-CG 3.67Å; L386-R391 HydrophobicContact CD1-CG 4.33Å; S387-R391 PolarHBondContact O-N 2.91Å; Q388-R391 PolarHBondContact O-N 3.06Å; R391-R395 VanDerWaalsContact O-CB 3.3Å; R391-R395 WeakPolarHBondContact O-CB 3.43Å; R391-R395 PolarHBondContact O-N 3.38Å
392	Q	97.4	Very high	97.8	Very high	118 Å²	118	53.8 Å²	53.8	55%	0.551	26%	0.262	S	S	*	.	H	α-helix	trans	-64.2	-46.7	176.3	-74.4	172.5	-13	0	0	111.7	Q388 K389 Q390 R395 R396	Q388-Q392 WeakPolarHBondContact O-CG 3.49Å; Q388-Q392 PolarHBondContact O-N 2.76Å; K389-Q392 PolarHBondContact O-N 3.5Å; Q390-Q392 VanDerWaalsContact C-N 3.32Å; Q390-Q392 PolarHBondContact O-N 3Å; Q392-R395 PolarHBondContact O-N 3.15Å; Q392-R396 WeakPolarHBondContact O-CB 3.49Å; Q392-R396 PolarHBondContact O-N 2.9Å
393	L	97.8	Very high	97.9	Very high	65 Å²	65	56.2 Å²	56.2	34%	0.34	28%	0.275	S	S	.	.	H	α-helix	trans	-66.3	-45.4	178.7	-179.7	56.7	0	0	0	112	L322 K389 Q390 R395 R396 I397 Y437	L322-L393 HydrophobicContact CD2-CB 4.16Å; L322-L393 HydrophobicContact CD2-CD2 3.86Å; L322-L393 HydrophobicContact CD2-CG 4.04Å; K389-L393 PolarHBondContact O-N 3.33Å; Q390-L393 PolarHBondContact O-N 3.26Å; L393-R395 PolarHBondContact O-N 3.44Å; L393-R396 WeakPolarHBondContact O-CB 3.32Å; L393-R396 PolarHBondContact O-N 3.48Å; L393-I397 HydrophobicContact CD1-CD1 3.93Å; L393-I397 HydrophobicContact CD1-CG1 4.18Å; L393-I397 HydrophobicContact CG-CD1 3.86Å; L393-I397 WeakPolarHBondContact O-CG1 3.46Å; L393-I397 PolarHBondContact O-N 3.11Å; L393-Y437 HydrophobicContact CD1-CD2 4.15Å; L393-Y437 HydrophobicContact CD1-CE2 3.75Å
394	F	98.6	Very high	97.9	Very high	0 Å²	0	55.9 Å²	55.9	0%	0	27%	0.273	C	S	.	.	H	α-helix	trans	-53.7	-52.5	173.5	174.7	-89	0	0	0	110.9	L322 F325 A326 F329 F372 L383 L386 Q390 R396 I397 V398	L322-F394 HydrophobicContact CD1-CB 4.19Å; L322-F394 HydrophobicContact CD1-CD2 4.35Å; F325-F394 AromaticContact CD1-CD2 3.82Å; F325-F394 HydrophobicContact CD1-CD2 3.82Å; F325-F394 AromaticContact CD1-CE2 3.54Å; F325-F394 HydrophobicContact CD1-CE2 3.54Å; F325-F394 HydrophobicContact CD2-CE2 4.1Å; F325-F394 AromaticContact CE1-CD2 3.95Å; F325-F394 HydrophobicContact CE1-CD2 3.95Å; F325-F394 AromaticContact CE1-CE2 3.49Å; F325-F394 HydrophobicContact CE1-CE2 3.49Å; F325-F394 VanDerWaalsContact CE1-CE2 3.49Å; F325-F394 HydrophobicContact CE1-CZ 4.16Å; F325-F394 HydrophobicContact CE2-CE2 4.02Å; F325-F394 HydrophobicContact CE2-CZ 4.39Å; F325-F394 HydrophobicContact CG-CD2 4.38Å; F325-F394 AromaticContact CG-CE2 3.85Å; F325-F394 HydrophobicContact CG-CE2 3.85Å; F325-F394 AromaticContact CZ-CE2 3.73Å; F325-F394 HydrophobicContact CZ-CE2 3.73Å; F325-F394 HydrophobicContact CZ-CZ 4.04Å; A326-F394 VanDerWaalsContact CA-CE2 3.5Å; A326-F394 HydrophobicContact CB-CD2 3.76Å; A326-F394 HydrophobicContact CB-CE2 4.02Å; A326-F394 HydrophobicContact CB-CG 4.47Å; F329-F394 HydrophobicContact CB-CE2 4.25Å; F329-F394 HydrophobicContact CB-CZ 3.88Å; F329-F394 HydrophobicContact CD1-CE1 4.15Å; F329-F394 AromaticContact CD1-CZ 3.71Å; F329-F394 HydrophobicContact CD1-CZ 3.71Å; F329-F394 HydrophobicContact CD2-CZ 4.15Å; F329-F394 HydrophobicContact CE1-CE1 4.28Å; F329-F394 HydrophobicContact CE1-CZ 4.23Å; F329-F394 HydrophobicContact CG-CE1 4.48Å; F329-F394 HydrophobicContact CG-CE2 4.49Å; F329-F394 AromaticContact CG-CZ 3.65Å; F329-F394 HydrophobicContact CG-CZ 3.65Å; F372-F394 HydrophobicContact CE1-CE1 4.48Å; L383-F394 HydrophobicContact CD1-CD1 3.84Å; L383-F394 HydrophobicContact CD1-CE1 3.75Å; L383-F394 HydrophobicContact CD2-CD1 4Å; L383-F394 HydrophobicContact CD2-CE1 3.65Å; L383-F394 HydrophobicContact CD2-CE2 4.19Å; L383-F394 HydrophobicContact CD2-CG 4.44Å; L383-F394 HydrophobicContact CD2-CZ 3.75Å; L383-F394 HydrophobicContact CG-CE1 4.36Å; L386-F394 HydrophobicContact CD1-CB 4.19Å; L386-F394 HydrophobicContact CD1-CD2 4.47Å; L386-F394 HydrophobicContact CD1-CG 4.29Å; Q390-F394 WeakPolarHBondContact O-CB 3.42Å; Q390-F394 PolarHBondContact O-N 3.2Å; F394-R396 VanDerWaalsContact C-N 3.28Å; F394-R396 PolarHBondContact O-N 3.04Å; F394-I397 PolarHBondContact O-N 2.94Å; F394-V398 HydrophobicContact CD1-CG2 4.16Å; F394-V398 HydrophobicContact CE1-CG2 3.8Å; F394-V398 HydrophobicContact CE2-CG2 4.28Å; F394-V398 HydrophobicContact CZ-CG2 3.88Å; F394-V398 VanDerWaalsContact O-CG2 3.31Å; F394-V398 WeakPolarHBondContact O-CG2 3.37Å; F394-V398 PolarHBondContact O-N 3.27Å
395	R	98.5	Very high	98	Very high	117 Å²	117	52.5 Å²	52.5	44%	0.442	25%	0.253	S	S	.	.	H	α-helix	trans	-58.7	-41.3	179	178	174.5	178.8	79.6	2.4	111.7	F372 R391 Q392 L393 I399	F372-R395 HydrophobicContact CE1-CB 4.27Å; F372-R395 HydrophobicContact CE1-CG 4.04Å; F372-R395 HydrophobicContact CE2-CG 4.36Å; F372-R395 HydrophobicContact CZ-CB 4.2Å; F372-R395 HydrophobicContact CZ-CG 3.81Å; R391-R395 VanDerWaalsContact O-CB 3.3Å; R391-R395 WeakPolarHBondContact O-CB 3.43Å; R391-R395 PolarHBondContact O-N 3.38Å; Q392-R395 PolarHBondContact O-N 3.15Å; L393-R395 PolarHBondContact O-N 3.44Å; R395-I399 HydrophobicContact CG-CD1 3.74Å; R395-I399 HydrophobicContact CG-CG1 4.43Å; R395-I399 VanDerWaalsContact O-CG1 3.26Å; R395-I399 WeakPolarHBondContact O-CG1 3.36Å; R395-I399 PolarHBondContact O-N 3.03Å
396	R	98.3	Very high	98.1	Very high	81 Å²	81	51.5 Å²	51.5	31%	0.306	24%	0.24	S	C	.	.	H	α-helix	trans	-62.3	-49.9	178.3	-170.5	-173.6	176.8	174.2	-1.1	111.4	Q392 L393 F394 V398 I399 D400 Y437	Q392-R396 WeakPolarHBondContact O-CB 3.49Å; Q392-R396 PolarHBondContact O-N 2.9Å; L393-R396 WeakPolarHBondContact O-CB 3.32Å; L393-R396 PolarHBondContact O-N 3.48Å; F394-R396 VanDerWaalsContact C-N 3.28Å; F394-R396 PolarHBondContact O-N 3.04Å; R396-V398 VanDerWaalsContact C-N 3.34Å; R396-V398 PolarHBondContact O-N 3.2Å; R396-I399 PolarHBondContact O-N 3.39Å; R396-D400 IonicContact NE-OD2 3.29Å; R396-D400 WeakPolarHBondContact O-CB 3.39Å; R396-D400 VanDerWaalsContact O-CG 3.27Å; R396-D400 PolarHBondContact O-N 3.43Å; R396-Y437 WeakPolarHBondContact CG-OH 3.19Å
397	I	98.7	Very high	97.9	Very high	0 Å²	0	54.9 Å²	54.9	0%	0	26%	0.256	C	S	.	.	H	α-helix	trans	-60.4	-44.9	179.5	-64.6	159.3	0	0	0	110.6	E323 A326 V327 L393 F394 I399 D400 T401 Y437 I441 L444	E323-I397 HydrophobicContact CB-CD1 4.43Å; E323-I397 HydrophobicContact CG-CD1 3.62Å; A326-I397 HydrophobicContact CB-CB 3.79Å; A326-I397 HydrophobicContact CB-CD1 4.38Å; A326-I397 HydrophobicContact CB-CG2 3.53Å; V327-I397 HydrophobicContact CG2-CG2 4.09Å; L393-I397 HydrophobicContact CD1-CD1 3.93Å; L393-I397 HydrophobicContact CD1-CG1 4.18Å; L393-I397 HydrophobicContact CG-CD1 3.86Å; L393-I397 WeakPolarHBondContact O-CG1 3.46Å; L393-I397 PolarHBondContact O-N 3.11Å; F394-I397 PolarHBondContact O-N 2.94Å; I397-I399 PolarHBondContact O-N 2.94Å; I397-D400 PolarHBondContact O-N 3.41Å; I397-T401 HydrophobicContact CG2-CG2 4.37Å; I397-T401 WeakPolarHBondContact O-CB 3.37Å; I397-T401 WeakPolarHBondContact O-CG2 3.23Å; I397-T401 PolarHBondContact O-N 3.29Å; I397-T401 PolarHBondContact O-OG1 3.24Å; I397-Y437 HydrophobicContact CG1-CE2 3.95Å; I397-I441 HydrophobicContact CB-CD1 4.37Å; I397-I441 HydrophobicContact CG1-CD1 4.4Å; I397-I441 HydrophobicContact CG2-CD1 3.97Å; I397-L444 HydrophobicContact CG2-CD1 4.27Å
398	V	98.9	Very high	97.7	Very high	0 Å²	0	56.1 Å²	56.1	0%	0	27%	0.265	C	S	.	.	H	α-helix	trans	-60.8	-45.3	178.1	173.8	0	0	0	0	111.3	A326 F329 A330 I333 L368 F372 F394 R396 T401 V402	A326-V398 HydrophobicContact CB-CG2 3.97Å; A326-V398 WeakPolarHBondContact O-CG2 3.28Å; F329-V398 HydrophobicContact CD1-CG1 3.93Å; F329-V398 HydrophobicContact CD1-CG2 3.77Å; F329-V398 HydrophobicContact CE1-CG1 4.06Å; F329-V398 HydrophobicContact CE1-CG2 4.4Å; A330-V398 HydrophobicContact CB-CG1 4.36Å; I333-V398 HydrophobicContact CD1-CG1 3.81Å; L368-V398 HydrophobicContact CD2-CG1 3.84Å; F372-V398 HydrophobicContact CE2-CB 4.4Å; F372-V398 HydrophobicContact CE2-CG1 3.84Å; F372-V398 HydrophobicContact CZ-CB 3.99Å; F372-V398 HydrophobicContact CZ-CG1 3.79Å; F394-V398 HydrophobicContact CD1-CG2 4.16Å; F394-V398 HydrophobicContact CE1-CG2 3.8Å; F394-V398 HydrophobicContact CE2-CG2 4.28Å; F394-V398 HydrophobicContact CZ-CG2 3.88Å; F394-V398 VanDerWaalsContact O-CG2 3.31Å; F394-V398 WeakPolarHBondContact O-CG2 3.37Å; F394-V398 PolarHBondContact O-N 3.27Å; R396-V398 VanDerWaalsContact C-N 3.34Å; R396-V398 PolarHBondContact O-N 3.2Å; V398-T401 PolarHBondContact O-N 3.34Å; V398-T401 PolarHBondContact O-OG1 2.94Å; V398-V402 HydrophobicContact CG1-CG2 4.35Å; V398-V402 WeakPolarHBondContact O-CG2 3.35Å; V398-V402 PolarHBondContact O-N 3.26Å
399	I	98.7	Very high	97.5	Very high	45 Å²	45	51.9 Å²	51.9	23%	0.231	24%	0.244	C	C	.	.	H	α-helix	trans	-62.5	-50.5	177.3	-69.8	167.6	0	0	0	110.7	L368 F372 R395 R396 I397 T401 L403	L368-I399 HydrophobicContact CD1-CB 4.34Å; L368-I399 HydrophobicContact CD1-CG1 4.23Å; L368-I399 HydrophobicContact CD1-CG2 4.2Å; L368-I399 HydrophobicContact CD2-CG1 4.05Å; F372-I399 HydrophobicContact CE2-CG1 4.24Å; R395-I399 HydrophobicContact CG-CD1 3.74Å; R395-I399 HydrophobicContact CG-CG1 4.43Å; R395-I399 VanDerWaalsContact O-CG1 3.26Å; R395-I399 WeakPolarHBondContact O-CG1 3.36Å; R395-I399 PolarHBondContact O-N 3.03Å; R396-I399 PolarHBondContact O-N 3.39Å; I397-I399 PolarHBondContact O-N 2.94Å; I399-T401 PolarHBondContact O-N 3.08Å; I399-L403 HydrophobicContact CG2-CD1 3.71Å; I399-L403 HydrophobicContact CG2-CG 4.29Å; I399-L403 WeakPolarHBondContact O-CB 3.44Å; I399-L403 VanDerWaalsContact O-CG 3.29Å; I399-L403 WeakPolarHBondContact O-CG 3.44Å; I399-L403 PolarHBondContact O-N 3.02Å
400	D	98.3	Very high	97.3	Very high	41 Å²	41	44.1 Å²	44.1	22%	0.219	21%	0.21	C	C	.	.	H	α-helix	trans	-60.2	-34.4	-177.7	-70.1	-13.1	0	0	0	111.4	R396 I397 Y437 I441 Q445	R396-D400 IonicContact NE-OD2 3.29Å; R396-D400 WeakPolarHBondContact O-CB 3.39Å; R396-D400 VanDerWaalsContact O-CG 3.27Å; R396-D400 PolarHBondContact O-N 3.43Å; I397-D400 PolarHBondContact O-N 3.41Å; D400-Y437 PolarHBondContact OD2-OH 3.24Å; D400-I441 HydrophobicContact CB-CD1 3.84Å; D400-I441 HydrophobicContact CB-CG1 3.68Å; D400-Q445 WeakPolarHBondContact O-CG 3.39Å; D400-Q445 PolarHBondContact O-NE2 2.86Å
401	T	98.7	Very high	96.9	Very high	0 Å²	0	46.5 Å²	46.5	0%	0	22%	0.223	C	C	.	.	H	α-helix	trans	-83.6	-40.3	-178.5	49	0	0	0	0	114.2	V327 A330 I397 V398 I399 A404 I441 L444 Q445 I448	V327-T401 HydrophobicContact CG2-CG2 4.12Å; A330-T401 WeakPolarHBondContact CB-OG1 3.46Å; I397-T401 HydrophobicContact CG2-CG2 4.37Å; I397-T401 WeakPolarHBondContact O-CB 3.37Å; I397-T401 WeakPolarHBondContact O-CG2 3.23Å; I397-T401 PolarHBondContact O-N 3.29Å; I397-T401 PolarHBondContact O-OG1 3.24Å; V398-T401 PolarHBondContact O-N 3.34Å; V398-T401 PolarHBondContact O-OG1 2.94Å; I399-T401 PolarHBondContact O-N 3.08Å; T401-A404 WeakPolarHBondContact O-CB 3.4Å; T401-A404 PolarHBondContact O-N 2.86Å; T401-I441 HydrophobicContact CG2-CD1 3.94Å; T401-L444 HydrophobicContact CG2-CB 4.06Å; T401-Q445 HydrophobicContact CG2-CG 4.2Å; T401-I448 WeakPolarHBondContact O-CG2 3.19Å
402	V	98.8	Very high	96.5	Very high	0 Å²	0	45.6 Å²	45.6	0%	0	23%	0.229	C	C	.	.	H	α-helix	trans	-69.5	-38.2	174.9	177	0	0	0	0	111.1	A330 I333 H334 E364 H367 L368 V398 A404 T405	A330-V402 HydrophobicContact CB-CG2 3.85Å; I333-V402 HydrophobicContact CD1-CG2 4.17Å; I333-V402 HydrophobicContact CG1-CG2 4.19Å; H334-V402 HydrophobicContact CB-CG1 4.32Å; H334-V402 HydrophobicContact CB-CG2 4.32Å; E364-V402 HydrophobicContact CB-CG1 4.47Å; H367-V402 HydrophobicContact CB-CG1 4.43Å; L368-V402 HydrophobicContact CD1-CB 4.12Å; L368-V402 HydrophobicContact CD1-CG1 4.24Å; L368-V402 HydrophobicContact CD2-CB 3.8Å; L368-V402 HydrophobicContact CD2-CG1 4.24Å; L368-V402 HydrophobicContact CD2-CG2 3.89Å; L368-V402 HydrophobicContact CG-CB 3.86Å; L368-V402 HydrophobicContact CG-CG1 3.82Å; L368-V402 HydrophobicContact CG-CG2 4.39Å; V398-V402 HydrophobicContact CG1-CG2 4.35Å; V398-V402 WeakPolarHBondContact O-CG2 3.35Å; V398-V402 PolarHBondContact O-N 3.26Å; V402-A404 PolarHBondContact O-N 3.14Å; V402-A404 VanDerWaalsContact O-N 3.17Å; V402-T405 PolarHBondContact O-N 3.43Å; V402-T405 VanDerWaalsContact O-N 3.07Å; V402-T405 PolarHBondContact O-OG1 3.41Å
403	L	98.6	Very high	96.3	Very high	54 Å²	54	40.4 Å²	40.4	28%	0.283	21%	0.205	S	C	.	.	G	3₁₀ helix	trans	-65	-20.4	174.7	-68.3	179	0	0	0	113.2	E364 Q365 L368 I399 T405	E364-L403 HydrophobicContact CB-CD2 4Å; Q365-L403 HydrophobicContact CG-CD2 3.78Å; L368-L403 HydrophobicContact CD1-CD2 3.95Å; L368-L403 HydrophobicContact CD1-CG 3.88Å; I399-L403 HydrophobicContact CG2-CD1 3.71Å; I399-L403 HydrophobicContact CG2-CG 4.29Å; I399-L403 WeakPolarHBondContact O-CB 3.44Å; I399-L403 VanDerWaalsContact O-CG 3.29Å; I399-L403 WeakPolarHBondContact O-CG 3.44Å; I399-L403 PolarHBondContact O-N 3.02Å; L403-T405 VanDerWaalsContact C-N 3.3Å
404	A	98.3	Very high	96	Very high	3 Å²	3	38 Å²	38	3%	0.025	19%	0.193	C	C	.	.	G	3₁₀ helix	trans	-78.5	-11.6	176	0	0	0	0	0	113.3	T401 V402 D406 L413 Q445 H449	T401-A404 WeakPolarHBondContact O-CB 3.4Å; T401-A404 PolarHBondContact O-N 2.86Å; V402-A404 PolarHBondContact O-N 3.14Å; V402-A404 VanDerWaalsContact O-N 3.17Å; A404-D406 VanDerWaalsContact C-N 3.25Å; A404-L413 HydrophobicContact CB-CD1 4.04Å; A404-L413 HydrophobicContact CB-CD2 4.17Å; A404-L413 WeakPolarHBondContact O-CD1 3.5Å; A404-Q445 HydrophobicContact CB-CB 3.67Å; A404-Q445 HydrophobicContact CB-CG 3.67Å; A404-H449 PolarHBondContact O-ND1 3.12Å
405	T	98.5	Very high	95.5	Very high	6 Å²	6	40.4 Å²	40.4	4%	0.037	21%	0.212	C	C	.	.	G	3₁₀ helix	trans	-79.3	-10	174	68.4	0	0	0	0	112.3	H334 V402 L403 M407 I448	H334-T405 HydrophobicContact CB-CG2 4.4Å; V402-T405 PolarHBondContact O-N 3.43Å; V402-T405 VanDerWaalsContact O-N 3.07Å; V402-T405 PolarHBondContact O-OG1 3.41Å; L403-T405 VanDerWaalsContact C-N 3.3Å; T405-M407 PolarHBondContact O-N 2.98Å; T405-I448 HydrophobicContact CG2-CD1 4.3Å; T405-I448 HydrophobicContact CG2-CG1 4.18Å; T405-I448 HydrophobicContact CG2-CG2 4.27Å
406	D	98	Very high	95	Very high	11 Å²	11	37.7 Å²	37.7	6%	0.059	21%	0.207	C	C	.	.			trans	-59.8	112	170	177.6	-11.5	0	0	0	109.6	S361 E364 A404 S408 K409	S361-D406 WeakPolarHBondContact CB-OD2 3.47Å; S361-D406 PolarHBondContact OG-OD2 2.96Å; E364-D406 HydrophobicContact CG-CB 3.85Å; A404-D406 VanDerWaalsContact C-N 3.25Å; D406-S408 PolarHBondContact O-N 2.98Å; D406-S408 VanDerWaalsContact OD1-CB 3.22Å; D406-S408 WeakPolarHBondContact OD1-CB 3.4Å; D406-S408 PolarHBondContact OD1-N 3.21Å; D406-S408 PolarHBondContact OD1-OG 3.5Å; D406-S408 PolarHBondContact OD2-OG 3.26Å; D406-K409 HydrophobicContact CB-CG 4.03Å; D406-K409 WeakPolarHBondContact O-CB 3.4Å; D406-K409 PolarHBondContact O-N 3.36Å; D406-K409 IonicContact OD2-NZ 3.6Å
407	M	93.5	Very high	94.6	Very high	82 Å²	82	33.8 Å²	33.8	40%	0.404	19%	0.192	S	C	.	.	G	3₁₀ helix	trans	-58.6	-21.5	-176.8	-72.3	-58.2	-61	0	0	113.9	T405 K409 H410 H449 L453 I510	T405-M407 PolarHBondContact O-N 2.98Å; M407-K409 PolarHBondContact O-N 3.24Å; M407-H410 HydrophobicContact CE-CB 4.46Å; M407-H410 WeakPolarHBondContact O-CB 3.44Å; M407-H410 PolarHBondContact O-N 3.22Å; M407-H449 VanDerWaalsContact SD-CE1 3.56Å; M407-L453 HydrophobicContact CE-CD1 3.99Å; M407-L453 HydrophobicContact CE-CD2 3.85Å; M407-L453 HydrophobicContact SD-CD1 4.08Å; M407-L453 HydrophobicContact SD-CD2 3.79Å; M407-L453 HydrophobicContact SD-CG 4.27Å; M407-I510 HydrophobicContact CE-CG2 4.19Å
408	S	92.4	Very high	94.1	Very high	85 Å²	85	38.2 Å²	38.2	59%	0.594	21%	0.211	S	C	*	.	G	3₁₀ helix	trans	-64.9	-18.7	172.7	75.7	0	0	0	0	113.3	D406	D406-S408 PolarHBondContact O-N 2.98Å; D406-S408 VanDerWaalsContact OD1-CB 3.22Å; D406-S408 WeakPolarHBondContact OD1-CB 3.4Å; D406-S408 PolarHBondContact OD1-N 3.21Å; D406-S408 PolarHBondContact OD1-OG 3.5Å; D406-S408 PolarHBondContact OD2-OG 3.26Å
409	K	92.1	Very high	93.5	Very high	64 Å²	64	42 Å²	42	28%	0.278	24%	0.235	S	C	.	.	G	3₁₀ helix	trans	-92.7	-3.7	178.6	-47.3	-54.6	-178.9	-153.5	0	113.5	D406 M407 M411 S412 L413	D406-K409 HydrophobicContact CB-CG 4.03Å; D406-K409 WeakPolarHBondContact O-CB 3.4Å; D406-K409 PolarHBondContact O-N 3.36Å; D406-K409 IonicContact OD2-NZ 3.6Å; M407-K409 PolarHBondContact O-N 3.24Å; K409-M411 VanDerWaalsContact C-N 3.33Å; K409-M411 PolarHBondContact O-N 3.25Å; K409-S412 PolarHBondContact O-N 3.06Å; K409-S412 VanDerWaalsContact O-N 3.12Å; K409-S412 PolarHBondContact O-OG 2.93Å; K409-L413 HydrophobicContact CB-CD1 4.35Å; K409-L413 PolarHBondContact O-N 3.12Å
410	H	92.3	Very high	92.8	Very high	5 Å²	5	40.7 Å²	40.7	2%	0.023	23%	0.228	C	C	.	.	H	α-helix	trans	-51.3	-47.7	-174.6	174.3	97.4	0	0	0	112.9	M407 S412 L413 L414 H449 I510	M407-H410 HydrophobicContact CE-CB 4.46Å; M407-H410 WeakPolarHBondContact O-CB 3.44Å; M407-H410 PolarHBondContact O-N 3.22Å; H410-S412 PolarHBondContact O-N 3.42Å; H410-L413 PolarHBondContact O-N 3.22Å; H410-L414 WeakPolarHBondContact O-CB 3.42Å; H410-L414 PolarHBondContact O-N 3.02Å; H410-H449 AromaticContact CG-NE2 3.77Å; H410-H449 AromaticContact ND1-NE2 3.2Å; H410-H449 PolarHBondContact ND1-NE2 3.08Å; H410-I510 VanDerWaalsContact CE1-CG2 3.48Å; H410-I510 WeakPolarHBondContact CE1-CG2 3.47Å; H410-I510 PolarHBondContact CE1-O 3.49Å
411	M	89.9	Confident	92.1	Very high	117 Å²	117	39 Å²	39	58%	0.576	22%	0.219	S	C	*	.	H	α-helix	trans	-67.4	-34.7	-176.5	-65.1	-61.5	160.4	0	0	112.9	K409 A415 I510	K409-M411 VanDerWaalsContact C-N 3.33Å; K409-M411 PolarHBondContact O-N 3.25Å; M411-A415 WeakPolarHBondContact O-CB 3.39Å; M411-A415 PolarHBondContact O-N 3.04Å; M411-I510 HydrophobicContact CE-CD1 3.95Å
412	S	90.3	Very high	91.4	Very high	64 Å²	64	44.8 Å²	44.8	45%	0.448	25%	0.246	S	C	.	.	H	α-helix	trans	-67.5	-42.8	173.2	39.3	0	0	0	0	112	K409 H410 L414 A415 D416	K409-S412 PolarHBondContact O-N 3.06Å; K409-S412 VanDerWaalsContact O-N 3.12Å; K409-S412 PolarHBondContact O-OG 2.93Å; H410-S412 PolarHBondContact O-N 3.42Å; S412-L414 PolarHBondContact O-N 3.33Å; S412-A415 PolarHBondContact O-N 3.47Å; S412-D416 PolarHBondContact O-N 3.21Å
413	L	93	Very high	90.3	Very high	9 Å²	9	48 Å²	48	5%	0.047	27%	0.265	C	S	.	.	H	α-helix	trans	-63.5	-43	178.2	-68.6	169.1	0	0	0	111.7	A404 K409 H410 D416 L417 Q445 N446 H449	A404-L413 HydrophobicContact CB-CD1 4.04Å; A404-L413 HydrophobicContact CB-CD2 4.17Å; A404-L413 WeakPolarHBondContact O-CD1 3.5Å; K409-L413 HydrophobicContact CB-CD1 4.35Å; K409-L413 PolarHBondContact O-N 3.12Å; H410-L413 PolarHBondContact O-N 3.22Å; L413-D416 PolarHBondContact O-N 2.69Å; L413-L417 WeakPolarHBondContact O-CB 3.38Å; L413-L417 PolarHBondContact O-N 2.93Å; L413-Q445 HydrophobicContact CD2-CB 3.87Å; L413-N446 PolarHBondContact O-ND2 3.36Å; L413-N446 PolarHBondContact O-OD1 2.92Å; L413-H449 HydrophobicContact CD1-CB 4.28Å
414	L	91.6	Very high	89.1	Confident	14 Å²	14	46.7 Å²	46.7	7%	0.073	26%	0.258	C	S	.	.	H	α-helix	trans	-63.5	-41.8	176.5	179.9	58.2	0	0	0	112	H410 S412 L417 K418 P513 L514	H410-L414 WeakPolarHBondContact O-CB 3.42Å; H410-L414 PolarHBondContact O-N 3.02Å; S412-L414 PolarHBondContact O-N 3.33Å; L414-L417 PolarHBondContact O-N 3.25Å; L414-K418 HydrophobicContact CD1-CG 4.38Å; L414-K418 WeakPolarHBondContact O-CB 3.48Å; L414-K418 WeakPolarHBondContact O-CG 3.43Å; L414-K418 PolarHBondContact O-N 3.49Å; L414-P513 HydrophobicContact CD2-CB 3.98Å; L414-L514 HydrophobicContact CD1-CD1 4.38Å
415	A	88.4	Confident	87.8	Confident	50 Å²	50	53.3 Å²	53.3	41%	0.413	29%	0.286	S	S	.	.	H	α-helix	trans	-61.9	-47.3	176.5	0	0	0	0	0	111.5	M411 S412 L417 K418 T419	M411-A415 WeakPolarHBondContact O-CB 3.39Å; M411-A415 PolarHBondContact O-N 3.04Å; S412-A415 PolarHBondContact O-N 3.47Å; A415-L417 VanDerWaalsContact C-N 3.32Å; A415-L417 PolarHBondContact O-N 2.97Å; A415-K418 PolarHBondContact O-N 2.87Å; A415-T419 PolarHBondContact O-N 3.38Å; A415-T419 PolarHBondContact O-OG1 2.99Å
416	D	87.6	Confident	86.3	Confident	60 Å²	60	60.2 Å²	60.2	32%	0.321	32%	0.321	S	S	.	.	H	α-helix	trans	-59.6	-43.3	176.5	-75.8	-3.7	0	0	0	111.6	S412 L413 T419 M420 Q442	S412-D416 PolarHBondContact O-N 3.21Å; L413-D416 PolarHBondContact O-N 2.69Å; D416-T419 PolarHBondContact O-N 3.32Å; D416-M420 PolarHBondContact O-N 3.07Å; D416-M420 VanDerWaalsContact O-N 3.08Å; D416-Q442 PolarHBondContact OD2-NE2 3.34Å
417	L	89.7	Confident	84.9	Confident	0 Å²	0	63.5 Å²	63.5	0%	0	35%	0.346	C	S	.	.	H	α-helix	trans	-63.4	-43.5	177.7	-169.9	65.1	0	0	0	111.8	L413 L414 A415 M420 V421 N446 I450 L514 T517 W518 L521	L413-L417 WeakPolarHBondContact O-CB 3.38Å; L413-L417 PolarHBondContact O-N 2.93Å; L414-L417 PolarHBondContact O-N 3.25Å; A415-L417 VanDerWaalsContact C-N 3.32Å; A415-L417 PolarHBondContact O-N 2.97Å; L417-M420 WeakPolarHBondContact O-CB 3.5Å; L417-M420 PolarHBondContact O-N 3.28Å; L417-V421 WeakPolarHBondContact O-CG2 3.33Å; L417-V421 PolarHBondContact O-N 3.26Å; L417-N446 HydrophobicContact CD1-CB 4.06Å; L417-N446 HydrophobicContact CD2-CB 4.36Å; L417-I450 HydrophobicContact CD2-CD1 4.44Å; L417-L514 HydrophobicContact CD2-CD1 4.13Å; L417-T517 HydrophobicContact CB-CG2 4.14Å; L417-T517 HydrophobicContact CD2-CG2 3.83Å; L417-T517 HydrophobicContact CG-CG2 3.67Å; L417-W518 HydrophobicContact CD1-CE3 4.3Å; L417-W518 HydrophobicContact CD2-CB 4.42Å; L417-L521 HydrophobicContact CD1-CD2 3.68Å
418	K	88.9	Confident	83.5	Confident	93 Å²	93	61.2 Å²	61.2	40%	0.404	34%	0.343	S	S	.	.	H	α-helix	trans	-60.9	-46.7	176.6	-77.9	-175.6	176.5	-172.5	0	111.8	L414 A415 M420 V421 E422 T517	L414-K418 HydrophobicContact CD1-CG 4.38Å; L414-K418 WeakPolarHBondContact O-CB 3.48Å; L414-K418 WeakPolarHBondContact O-CG 3.43Å; L414-K418 PolarHBondContact O-N 3.49Å; A415-K418 PolarHBondContact O-N 2.87Å; K418-M420 PolarHBondContact O-N 3.12Å; K418-V421 PolarHBondContact O-N 2.8Å; K418-V421 VanDerWaalsContact O-N 3.15Å; K418-E422 WeakPolarHBondContact O-CG 3.48Å; K418-E422 PolarHBondContact O-N 3.48Å; K418-T517 HydrophobicContact CB-CG2 4.29Å; K418-T517 WeakPolarHBondContact CE-OG1 3.45Å; K418-T517 HydrophobicContact CG-CG2 3.55Å
419	T	85.7	Confident	82.2	Confident	80 Å²	80	64 Å²	64	49%	0.491	36%	0.359	S	S	.	.	H	α-helix	trans	-58.6	-37.5	175.7	-61.5	0	0	0	0	111.9	A415 D416 E422 T423	A415-T419 PolarHBondContact O-N 3.38Å; A415-T419 PolarHBondContact O-OG1 2.99Å; D416-T419 PolarHBondContact O-N 3.32Å; T419-E422 PolarHBondContact O-N 3.19Å; T419-T423 PolarHBondContact O-N 2.93Å; T419-T423 PolarHBondContact O-OG1 3.29Å
420	M	83.7	Confident	80.8	Confident	17 Å²	17	63 Å²	63	8%	0.084	37%	0.367	C	S	.	.	H	α-helix	trans	-67.5	-42	176.5	-167.7	175.8	-61	0	0	112.7	D416 L417 K418 T423 K424 L434 D439 Q442 V443 L521	D416-M420 PolarHBondContact O-N 3.07Å; D416-M420 VanDerWaalsContact O-N 3.08Å; L417-M420 WeakPolarHBondContact O-CB 3.5Å; L417-M420 PolarHBondContact O-N 3.28Å; K418-M420 PolarHBondContact O-N 3.12Å; M420-T423 PolarHBondContact O-N 3.21Å; M420-K424 WeakPolarHBondContact O-CB 3.44Å; M420-K424 PolarHBondContact O-N 3.06Å; M420-L434 HydrophobicContact CE-CD2 4.48Å; M420-L434 HydrophobicContact SD-CD2 4.16Å; M420-D439 WeakPolarHBondContact CE-O 3.5Å; M420-Q442 HydrophobicContact CE-CB 4.03Å; M420-V443 HydrophobicContact CE-CG2 3.56Å; M420-V443 HydrophobicContact SD-CG2 3.19Å; M420-V443 WeakPolarHBondContact SD-CG2 3.34Å; M420-L521 HydrophobicContact CG-CD1 4.22Å; M420-L521 HydrophobicContact SD-CD1 4.33Å
421	V	84.8	Confident	79.7	Confident	5 Å²	5	64.3 Å²	64.3	3%	0.03	37%	0.374	C	S	.	.	H	α-helix	trans	-62	-42.6	174.9	168.2	0	0	0	0	111.5	L417 K418 T423 K424 K425 T517 D520 L521	L417-V421 WeakPolarHBondContact O-CG2 3.33Å; L417-V421 PolarHBondContact O-N 3.26Å; K418-V421 PolarHBondContact O-N 2.8Å; K418-V421 VanDerWaalsContact O-N 3.15Å; V421-T423 PolarHBondContact O-N 3.42Å; V421-K424 WeakPolarHBondContact O-CB 3.38Å; V421-K424 PolarHBondContact O-N 2.91Å; V421-K425 HydrophobicContact CG1-CD 4.33Å; V421-K425 WeakPolarHBondContact O-CG 3.43Å; V421-K425 PolarHBondContact O-N 3.34Å; V421-T517 HydrophobicContact CG2-CG2 3.93Å; V421-T517 WeakPolarHBondContact CG2-O 3.35Å; V421-D520 HydrophobicContact CG1-CB 3.76Å; V421-D520 HydrophobicContact CG2-CB 4.27Å; V421-L521 HydrophobicContact CG2-CB 3.79Å; V421-L521 HydrophobicContact CG2-CD1 4.05Å
422	E	82.4	Confident	78.5	Confident	121 Å²	121	59.8 Å²	59.8	57%	0.565	35%	0.353	S	S	*	.	H	α-helix	trans	-61.7	-44	175.9	-71.2	172.1	176.1	0	0	111.4	K418 T419 K424 K425 L426	K418-E422 WeakPolarHBondContact O-CG 3.48Å; K418-E422 PolarHBondContact O-N 3.48Å; T419-E422 PolarHBondContact O-N 3.19Å; E422-K424 VanDerWaalsContact C-N 3.33Å; E422-K424 PolarHBondContact O-N 3.47Å; E422-K425 PolarHBondContact O-N 2.86Å; E422-L426 WeakPolarHBondContact O-CG 3.38Å; E422-L426 PolarHBondContact O-N 3.48Å
423	T	76.9	Confident	77.6	Confident	68 Å²	68	65 Å²	65	42%	0.417	37%	0.368	S	S	.	.	H	α-helix	trans	-65.1	-36.1	176.6	-54.9	0	0	0	0	112.3	T419 M420 V421 L426 S427	T419-T423 PolarHBondContact O-N 2.93Å; T419-T423 PolarHBondContact O-OG1 3.29Å; M420-T423 PolarHBondContact O-N 3.21Å; V421-T423 PolarHBondContact O-N 3.42Å; T423-L426 PolarHBondContact O-N 2.94Å; T423-S427 PolarHBondContact O-N 3.48Å; T423-S427 PolarHBondContact O-OG 3.19Å
424	K	73.6	Confident	77	Confident	27 Å²	27	65.3 Å²	65.3	12%	0.117	37%	0.37	C	S	.	.	H	α-helix	trans	-59.9	-49	172.1	-179.5	-176.7	168.6	-163.6	0	111.5	M420 V421 E422 L426 S427 G428 G430 P432 D520 L521	M420-K424 WeakPolarHBondContact O-CB 3.44Å; M420-K424 PolarHBondContact O-N 3.06Å; V421-K424 WeakPolarHBondContact O-CB 3.38Å; V421-K424 PolarHBondContact O-N 2.91Å; E422-K424 VanDerWaalsContact C-N 3.33Å; E422-K424 PolarHBondContact O-N 3.47Å; K424-L426 PolarHBondContact O-N 3.04Å; K424-L426 VanDerWaalsContact O-N 3.13Å; K424-S427 PolarHBondContact O-N 3.31Å; K424-G428 PolarHBondContact O-N 2.93Å; K424-G430 WeakPolarHBondContact CE-O 3.38Å; K424-G430 VanDerWaalsContact CG-O 3.24Å; K424-G430 WeakPolarHBondContact CG-O 3.49Å; K424-P432 HydrophobicContact CB-CG 3.87Å; K424-D520 PolarHBondContact NZ-O 3.31Å; K424-L521 HydrophobicContact CD-CD1 4.18Å; K424-L521 PolarHBondContact NZ-O 3.44Å
425	K	70.8	Confident	76.4	Confident	141 Å²	141	71 Å²	71	61%	0.613	40%	0.396	S	S	*	.	H	α-helix	trans	-57.1	-29.6	179.6	-72.3	173.8	-178.2	174.1	0	112	V421 E422 D520	V421-K425 HydrophobicContact CG1-CD 4.33Å; V421-K425 WeakPolarHBondContact O-CG 3.43Å; V421-K425 PolarHBondContact O-N 3.34Å; E422-K425 PolarHBondContact O-N 2.86Å; K425-D520 IonicContact NZ-OD2 2.63Å; K425-D520 PolarHBondContact NZ-OD2 3.45Å
426	L	67.6	Low	76.2	Confident	151 Å²	151	74.9 Å²	74.9	79%	0.791	40%	0.403	S	S	*	.	H	α-helix	trans	-80.9	-26.2	176.1	-61	174.5	0	0	0	114.4	E422 T423 K424	E422-L426 WeakPolarHBondContact O-CG 3.38Å; E422-L426 PolarHBondContact O-N 3.48Å; T423-L426 PolarHBondContact O-N 2.94Å; K424-L426 PolarHBondContact O-N 3.04Å; K424-L426 VanDerWaalsContact O-N 3.13Å
427	S	67.3	Low	76.4	Confident	81 Å²	81	73.9 Å²	73.9	57%	0.566	40%	0.395	S	S	*	.	H	α-helix	trans	-91.4	-5	-171.3	-58	0	0	0	0	114.3	T423 K424	T423-S427 PolarHBondContact O-N 3.48Å; T423-S427 PolarHBondContact O-OG 3.19Å; K424-S427 PolarHBondContact O-N 3.31Å
428	G	64.6	Low	76.3	Confident	34 Å²	34	75.5 Å²	75.5	35%	0.351	41%	0.412	S	S	.	.			trans	95.2	-174.6	-176.7	0	0	0	0	0	113.5	K424 G430	K424-G428 PolarHBondContact O-N 2.93Å; G428-G430 PolarHBondContact O-N 3.29Å
429	P	64.3	Low	76.2	Confident	143 Å²	143	73.9 Å²	73.9	93%	0.929	41%	0.408	S	S	*	.	S	Bend	trans	-68.4	128	-176.9	26.9	-32.8	0	0	0	111.7
430	G	63.6	Low	76.5	Confident	44 Å²	44	71.8 Å²	71.8	45%	0.454	39%	0.391	S	S	.	.	S	Bend	trans	120.8	164.4	-177.2	0	0	0	0	0	111.9	K424 G428	K424-G430 WeakPolarHBondContact CE-O 3.38Å; K424-G430 VanDerWaalsContact CG-O 3.24Å; K424-G430 WeakPolarHBondContact CG-O 3.49Å; G428-G430 PolarHBondContact O-N 3.29Å
431	L	68.7	Low	77	Confident	31 Å²	31	71.6 Å²	71.6	16%	0.162	39%	0.39	C	S	.	.			trans	-66.5	144.2	171.6	-143.6	72.3	0	0	0	109	L315 V318 L434 L521	L315-L431 HydrophobicContact CD2-CD2 3.97Å; V318-L431 HydrophobicContact CG1-CD2 3.91Å; V318-L431 HydrophobicContact CG2-CD2 4.06Å; L431-L434 HydrophobicContact CD2-CD1 3.59Å; L431-L434 HydrophobicContact CD2-CG 4.17Å; L431-L521 HydrophobicContact CD1-CD1 3.48Å; L431-L521 VanDerWaalsContact CD1-CD1 3.48Å; L431-L521 HydrophobicContact CD1-CD2 4.29Å; L431-L521 HydrophobicContact CD1-CG 3.65Å
432	P	65.4	Low	77.4	Confident	22 Å²	22	73.7 Å²	73.7	14%	0.143	40%	0.4	C	S	.	.			trans	-51.4	150.6	168.9	-25.1	34.6	0	0	0	110.4	K424 L434	K424-P432 HydrophobicContact CB-CG 3.87Å; P432-L434 HydrophobicContact CB-CD2 4.46Å; P432-L434 WeakPolarHBondContact O-CG 3.45Å; P432-L434 PolarHBondContact O-N 3.04Å
433	K	71.6	Confident	77.9	Confident	174 Å²	174	68 Å²	68	76%	0.757	37%	0.373	S	S	*	.			trans	-63.5	100.4	171.8	-74.9	-171.8	177.2	-177.1	0	108.9	E435	K433-E435 VanDerWaalsContact C-N 3.26Å; K433-E435 HydrophobicContact CB-CG 4.07Å; K433-E435 PolarHBondContact O-N 3.11Å
434	L	80.2	Confident	78.9	Confident	15 Å²	15	64.8 Å²	64.8	8%	0.079	35%	0.353	C	S	.	.			trans	-79.1	78.3	175.2	-52.8	-177.9	0	0	0	108.9	V318 M420 L431 P432 D439 R440 V443	V318-L434 HydrophobicContact CG1-CD1 3.84Å; M420-L434 HydrophobicContact CE-CD2 4.48Å; M420-L434 HydrophobicContact SD-CD2 4.16Å; L431-L434 HydrophobicContact CD2-CD1 3.59Å; L431-L434 HydrophobicContact CD2-CG 4.17Å; P432-L434 HydrophobicContact CB-CD2 4.46Å; P432-L434 WeakPolarHBondContact O-CG 3.45Å; P432-L434 PolarHBondContact O-N 3.04Å; L434-D439 HydrophobicContact CB-CB 4.44Å; L434-D439 HydrophobicContact CD2-CB 3.84Å; L434-R440 HydrophobicContact CB-CG 3.64Å; L434-R440 WeakPolarHBondContact O-CD 3.37Å; L434-R440 WeakPolarHBondContact O-CG 3.43Å; L434-R440 PolarHBondContact O-NH1 3.13Å; L434-R440 VanDerWaalsContact O-NH1 3.1Å; L434-V443 HydrophobicContact CD1-CB 4.5Å; L434-V443 HydrophobicContact CD1-CG2 3.68Å
435	E	78	Confident	80.1	Confident	135 Å²	135	65.2 Å²	65.2	63%	0.631	36%	0.356	S	S	*	.			trans	-80.6	-41.4	-178.3	-64.2	-176.9	171.8	0	0	111.1	K433	K433-E435 VanDerWaalsContact C-N 3.26Å; K433-E435 HydrophobicContact CB-CG 4.07Å; K433-E435 PolarHBondContact O-N 3.11Å
436	K	86	Confident	81.3	Confident	130 Å²	130	58.6 Å²	58.6	57%	0.565	33%	0.327	S	S	*	.	S	Bend	trans	-84.3	148.4	-175.1	-62.4	178	-175.9	173	0	111.6	G438 D439 R440	K436-G438 PolarHBondContact O-N 3.18Å; K436-D439 PolarHBondContact O-N 3.17Å; K436-R440 VanDerWaalsContact O-CG 3.26Å; K436-R440 WeakPolarHBondContact O-CG 3.46Å; K436-R440 PolarHBondContact O-N 3.33Å
437	Y	90.1	Very high	82.7	Confident	40 Å²	40	51.4 Å²	51.4	16%	0.157	29%	0.289	C	S	.	.	H	α-helix	trans	-52.7	-42.1	172.5	178.3	-93.8	0	0	0	112.8	L393 R396 I397 D400 R440 I441	L393-Y437 HydrophobicContact CD1-CD2 4.15Å; L393-Y437 HydrophobicContact CD1-CE2 3.75Å; R396-Y437 WeakPolarHBondContact CG-OH 3.19Å; I397-Y437 HydrophobicContact CG1-CE2 3.95Å; D400-Y437 PolarHBondContact OD2-OH 3.24Å; Y437-R440 PolarHBondContact O-N 3.41Å; Y437-I441 HydrophobicContact CD1-CB 4.46Å; Y437-I441 HydrophobicContact CD1-CG2 4.17Å; Y437-I441 HydrophobicContact CE1-CB 3.96Å; Y437-I441 HydrophobicContact CE1-CG1 4.26Å; Y437-I441 HydrophobicContact CE1-CG2 3.85Å; Y437-I441 WeakPolarHBondContact O-CG2 3.38Å; Y437-I441 PolarHBondContact O-N 3.2Å
438	G	87.9	Confident	84.2	Confident	34 Å²	34	47.5 Å²	47.5	35%	0.351	26%	0.262	S	S	.	.	H	α-helix	trans	-56.9	-51.1	-178.8	0	0	0	0	0	112.8	K436 R440 I441 Q442	K436-G438 PolarHBondContact O-N 3.18Å; G438-R440 VanDerWaalsContact C-N 3.29Å; G438-R440 PolarHBondContact O-N 3.31Å; G438-I441 VanDerWaalsContact O-CG2 3.27Å; G438-I441 WeakPolarHBondContact O-CG2 3.5Å; G438-I441 PolarHBondContact O-N 3.1Å; G438-Q442 WeakPolarHBondContact O-CG 3.24Å; G438-Q442 PolarHBondContact O-N 3.5Å; G438-Q442 VanDerWaalsContact O-N 3.15Å
439	D	86.3	Confident	85.8	Confident	58 Å²	58	45.9 Å²	45.9	31%	0.31	25%	0.246	S	C	.	.	H	α-helix	trans	-65.4	-36.9	-178.9	-44.6	-24.1	0	0	0	111	M420 L434 K436	M420-D439 WeakPolarHBondContact CE-O 3.5Å; L434-D439 HydrophobicContact CB-CB 4.44Å; L434-D439 HydrophobicContact CD2-CB 3.84Å; K436-D439 PolarHBondContact O-N 3.17Å
440	R	92.4	Very high	87.4	Confident	36 Å²	36	39.1 Å²	39.1	14%	0.136	20%	0.202	C	C	.	.	H	α-helix	trans	-69.1	-46.1	179.3	-62.5	170.2	72.3	73.7	2.7	112	V318 F319 E323 L434 K436 Y437 G438 Q442 V443 L444	V318-R440 PolarHBondContact O-NH1 3.48Å; V318-R440 PolarHBondContact O-NH2 2.97Å; F319-R440 HydrophobicContact CE1-CB 4.45Å; E323-R440 VanDerWaalsContact CD-NH2 3.27Å; E323-R440 IonicContact OE1-CZ 3.98Å; E323-R440 IonicContact OE1-NE 3.23Å; E323-R440 PolarHBondContact OE1-NE 2.93Å; E323-R440 IonicContact OE1-NH2 3.65Å; E323-R440 PolarHBondContact OE1-NH2 3.48Å; E323-R440 VanDerWaalsContact OE1-NH2 3.13Å; E323-R440 IonicContact OE2-CZ 3.98Å; E323-R440 IonicContact OE2-NE 3.97Å; E323-R440 IonicContact OE2-NH2 3.67Å; E323-R440 PolarHBondContact OE2-NH2 3.17Å; L434-R440 HydrophobicContact CB-CG 3.64Å; L434-R440 WeakPolarHBondContact O-CD 3.37Å; L434-R440 WeakPolarHBondContact O-CG 3.43Å; L434-R440 PolarHBondContact O-NH1 3.13Å; L434-R440 VanDerWaalsContact O-NH1 3.1Å; K436-R440 VanDerWaalsContact O-CG 3.26Å; K436-R440 WeakPolarHBondContact O-CG 3.46Å; K436-R440 PolarHBondContact O-N 3.33Å; Y437-R440 PolarHBondContact O-N 3.41Å; G438-R440 VanDerWaalsContact C-N 3.29Å; G438-R440 PolarHBondContact O-N 3.31Å; R440-Q442 VanDerWaalsContact C-N 3.32Å; R440-Q442 PolarHBondContact O-N 3.47Å; R440-V443 PolarHBondContact O-N 3.32Å; R440-L444 WeakPolarHBondContact O-CG 3.4Å; R440-L444 PolarHBondContact O-N 2.94Å
441	I	95.2	Very high	89	Confident	13 Å²	13	37 Å²	37	7%	0.067	18%	0.18	C	C	.	.	H	α-helix	trans	-67	-34.8	-178	-165	61.1	0	0	0	111.3	I397 D400 T401 Y437 G438 V443 L444 Q445	I397-I441 HydrophobicContact CB-CD1 4.37Å; I397-I441 HydrophobicContact CG1-CD1 4.4Å; I397-I441 HydrophobicContact CG2-CD1 3.97Å; D400-I441 HydrophobicContact CB-CD1 3.84Å; D400-I441 HydrophobicContact CB-CG1 3.68Å; T401-I441 HydrophobicContact CG2-CD1 3.94Å; Y437-I441 HydrophobicContact CD1-CB 4.46Å; Y437-I441 HydrophobicContact CD1-CG2 4.17Å; Y437-I441 HydrophobicContact CE1-CB 3.96Å; Y437-I441 HydrophobicContact CE1-CG1 4.26Å; Y437-I441 HydrophobicContact CE1-CG2 3.85Å; Y437-I441 WeakPolarHBondContact O-CG2 3.38Å; Y437-I441 PolarHBondContact O-N 3.2Å; G438-I441 VanDerWaalsContact O-CG2 3.27Å; G438-I441 WeakPolarHBondContact O-CG2 3.5Å; G438-I441 PolarHBondContact O-N 3.1Å; I441-V443 VanDerWaalsContact C-N 3.33Å; I441-V443 PolarHBondContact O-N 2.81Å; I441-L444 HydrophobicContact CD1-CB 4.36Å; I441-L444 HydrophobicContact CD1-CD1 4.42Å; I441-L444 PolarHBondContact O-N 2.66Å; I441-L444 VanDerWaalsContact O-N 3.12Å; I441-Q445 HydrophobicContact CG1-CG 4.22Å; I441-Q445 WeakPolarHBondContact O-CB 3.46Å; I441-Q445 VanDerWaalsContact O-CG 3.27Å; I441-Q445 WeakPolarHBondContact O-CG 3.23Å; I441-Q445 PolarHBondContact O-N 2.77Å
442	Q	92.8	Very high	90.4	Very high	50 Å²	50	36.4 Å²	36.4	23%	0.234	18%	0.177	C	C	.	.	H	α-helix	trans	-58.8	-41.2	174.8	-78.1	177.9	-38.4	0	0	112.7	D416 M420 G438 R440 N446	D416-Q442 PolarHBondContact OD2-NE2 3.34Å; M420-Q442 HydrophobicContact CE-CB 4.03Å; G438-Q442 WeakPolarHBondContact O-CG 3.24Å; G438-Q442 PolarHBondContact O-N 3.5Å; G438-Q442 VanDerWaalsContact O-N 3.15Å; R440-Q442 VanDerWaalsContact C-N 3.32Å; R440-Q442 PolarHBondContact O-N 3.47Å; Q442-N446 PolarHBondContact O-N 2.77Å; Q442-N446 VanDerWaalsContact O-N 3.09Å; Q442-N446 PolarHBondContact O-ND2 2.95Å
443	V	93.6	Very high	92	Very high	0 Å²	0	36 Å²	36	0%	0	17%	0.173	C	C	.	.	H	α-helix	trans	-66.7	-42.8	174.5	-176.4	0	0	0	0	111.1	F319 M420 L434 R440 I441 N446 L447 W518 L521	F319-V443 HydrophobicContact CE1-CB 4.45Å; F319-V443 HydrophobicContact CE2-CG1 4.22Å; F319-V443 HydrophobicContact CZ-CB 3.81Å; F319-V443 HydrophobicContact CZ-CG1 3.61Å; M420-V443 HydrophobicContact CE-CG2 3.56Å; M420-V443 HydrophobicContact SD-CG2 3.19Å; M420-V443 WeakPolarHBondContact SD-CG2 3.34Å; L434-V443 HydrophobicContact CD1-CB 4.5Å; L434-V443 HydrophobicContact CD1-CG2 3.68Å; R440-V443 PolarHBondContact O-N 3.32Å; I441-V443 VanDerWaalsContact C-N 3.33Å; I441-V443 PolarHBondContact O-N 2.81Å; V443-N446 PolarHBondContact O-N 3.02Å; V443-L447 VanDerWaalsContact O-CB 3.28Å; V443-L447 WeakPolarHBondContact O-CB 3.41Å; V443-L447 PolarHBondContact O-N 2.86Å; V443-W518 HydrophobicContact CG1-CH2 4.24Å; V443-W518 HydrophobicContact CG1-CZ3 4.08Å; V443-L521 HydrophobicContact CG1-CD2 4.35Å
444	L	97.1	Very high	93.3	Very high	1 Å²	1	27.7 Å²	27.7	1%	0.005	14%	0.137	C	C	.	.	H	α-helix	trans	-66.4	-36.9	-179.4	-66.2	178.6	0	0	0	112.6	F310 F319 E323 V327 I397 T401 R440 I441 L447 I448	F310-L444 HydrophobicContact CE1-CD2 3.76Å; F310-L444 HydrophobicContact CZ-CD2 3.87Å; F319-L444 HydrophobicContact CD1-CD1 4.11Å; F319-L444 HydrophobicContact CD1-CD2 3.61Å; F319-L444 HydrophobicContact CD1-CG 3.97Å; F319-L444 HydrophobicContact CD2-CD2 4Å; F319-L444 HydrophobicContact CE1-CD1 4.19Å; F319-L444 HydrophobicContact CE1-CD2 3.51Å; F319-L444 HydrophobicContact CE1-CG 3.64Å; F319-L444 HydrophobicContact CE2-CD2 3.89Å; F319-L444 HydrophobicContact CG-CD2 3.86Å; F319-L444 HydrophobicContact CZ-CD2 3.66Å; F319-L444 HydrophobicContact CZ-CG 4.11Å; E323-L444 HydrophobicContact CB-CD1 3.95Å; E323-L444 HydrophobicContact CG-CD1 4.12Å; V327-L444 HydrophobicContact CG2-CB 4.02Å; V327-L444 HydrophobicContact CG2-CD1 4.02Å; V327-L444 HydrophobicContact CG2-CD2 3.99Å; V327-L444 HydrophobicContact CG2-CG 4.21Å; I397-L444 HydrophobicContact CG2-CD1 4.27Å; T401-L444 HydrophobicContact CG2-CB 4.06Å; R440-L444 WeakPolarHBondContact O-CG 3.4Å; R440-L444 PolarHBondContact O-N 2.94Å; I441-L444 HydrophobicContact CD1-CB 4.36Å; I441-L444 HydrophobicContact CD1-CD1 4.42Å; I441-L444 PolarHBondContact O-N 2.66Å; I441-L444 VanDerWaalsContact O-N 3.12Å; L444-L447 PolarHBondContact O-N 2.69Å; L444-I448 PolarHBondContact O-N 3.21Å; L444-I448 VanDerWaalsContact O-N 3.14Å
445	Q	98.1	Very high	94.1	Very high	37 Å²	37	27.6 Å²	27.6	17%	0.173	14%	0.137	C	C	.	.	H	α-helix	trans	-63.5	-47.5	173.2	-75.1	175.2	-46.7	0	0	111.2	D400 T401 A404 L413 I441 L447 I448 H449	D400-Q445 WeakPolarHBondContact O-CG 3.39Å; D400-Q445 PolarHBondContact O-NE2 2.86Å; T401-Q445 HydrophobicContact CG2-CG 4.2Å; A404-Q445 HydrophobicContact CB-CB 3.67Å; A404-Q445 HydrophobicContact CB-CG 3.67Å; L413-Q445 HydrophobicContact CD2-CB 3.87Å; I441-Q445 HydrophobicContact CG1-CG 4.22Å; I441-Q445 WeakPolarHBondContact O-CB 3.46Å; I441-Q445 VanDerWaalsContact O-CG 3.27Å; I441-Q445 WeakPolarHBondContact O-CG 3.23Å; I441-Q445 PolarHBondContact O-N 2.77Å; Q445-L447 VanDerWaalsContact C-N 3.32Å; Q445-L447 PolarHBondContact O-N 2.79Å; Q445-I448 VanDerWaalsContact O-CG2 3.26Å; Q445-I448 WeakPolarHBondContact O-CG2 3.42Å; Q445-H449 VanDerWaalsContact O-CB 3.29Å; Q445-H449 WeakPolarHBondContact O-CB 3.41Å; Q445-H449 PolarHBondContact O-N 3.21Å; Q445-H449 VanDerWaalsContact O-N 3.08Å
446	N	96.3	Very high	95.1	Very high	1 Å²	1	21.3 Å²	21.3	1%	0.005	11%	0.107	C	C	.	.	H	α-helix	trans	-63.5	-39	174.3	-84.2	-81.1	0	0	0	111.8	L413 L417 Q442 V443 I448 H449 I450	L413-N446 PolarHBondContact O-ND2 3.36Å; L413-N446 PolarHBondContact O-OD1 2.92Å; L417-N446 HydrophobicContact CD1-CB 4.06Å; L417-N446 HydrophobicContact CD2-CB 4.36Å; Q442-N446 PolarHBondContact O-N 2.77Å; Q442-N446 VanDerWaalsContact O-N 3.09Å; Q442-N446 PolarHBondContact O-ND2 2.95Å; V443-N446 PolarHBondContact O-N 3.02Å; N446-I448 PolarHBondContact O-N 2.84Å; N446-H449 PolarHBondContact O-N 2.68Å; N446-I450 HydrophobicContact CB-CD1 4.35Å; N446-I450 VanDerWaalsContact O-CB 3.29Å; N446-I450 WeakPolarHBondContact O-CB 3.5Å; N446-I450 VanDerWaalsContact O-CD1 3.24Å; N446-I450 WeakPolarHBondContact O-CD1 3.4Å; N446-I450 WeakPolarHBondContact O-CG1 3.48Å; N446-I450 PolarHBondContact O-N 2.64Å
447	L	96.8	Very high	95.7	Very high	0 Å²	0	15.1 Å²	15.1	0%	0	8%	0.08	C	C	.	.	H	α-helix	trans	-59.1	-48.3	179.9	-174.4	155.7	0	0	0	111.8	V306 M309 F310 L315 V327 V443 L444 Q445 A451 W518	V306-L447 HydrophobicContact CB-CD2 4.12Å; V306-L447 HydrophobicContact CG1-CD2 3.8Å; V306-L447 HydrophobicContact CG2-CD2 3.85Å; M309-L447 HydrophobicContact CB-CD1 4.2Å; M309-L447 HydrophobicContact CB-CD2 4.33Å; M309-L447 HydrophobicContact CB-CG 4.1Å; M309-L447 HydrophobicContact CE-CB 4.41Å; M309-L447 HydrophobicContact CE-CG 3.9Å; M309-L447 HydrophobicContact SD-CD2 4.37Å; M309-L447 HydrophobicContact SD-CG 4.18Å; F310-L447 HydrophobicContact CD1-CD1 3.86Å; F310-L447 HydrophobicContact CE1-CD1 3.69Å; F310-L447 HydrophobicContact CE2-CD2 4.4Å; F310-L447 HydrophobicContact CG-CD1 4.45Å; F310-L447 HydrophobicContact CZ-CD1 4.16Å; F310-L447 HydrophobicContact CZ-CD2 4.33Å; L315-L447 HydrophobicContact CD1-CD1 4.09Å; V327-L447 HydrophobicContact CG1-CD2 4.12Å; V443-L447 VanDerWaalsContact O-CB 3.28Å; V443-L447 WeakPolarHBondContact O-CB 3.41Å; V443-L447 PolarHBondContact O-N 2.86Å; L444-L447 PolarHBondContact O-N 2.69Å; Q445-L447 VanDerWaalsContact C-N 3.32Å; Q445-L447 PolarHBondContact O-N 2.79Å; L447-A451 PolarHBondContact O-N 3.35Å; L447-A451 VanDerWaalsContact O-N 3.11Å; L447-W518 HydrophobicContact CB-CH2 3.98Å; L447-W518 HydrophobicContact CB-CZ3 4.38Å; L447-W518 HydrophobicContact CD1-CH2 4.08Å; L447-W518 HydrophobicContact CD1-CZ2 4.5Å; L447-W518 HydrophobicContact CG-CH2 4.15Å
448	I	98.4	Very high	96.1	Very high	0 Å²	0	13.3 Å²	13.3	0%	0	7%	0.073	C	C	.	.	H	α-helix	trans	-69.5	-39.5	177.7	-168.7	169.2	0	0	0	111.7	V302 V306 V327 A330 A331 T401 T405 L444 Q445 N446 I450 A451 D452	V302-I448 HydrophobicContact CG1-CG1 4.49Å; V306-I448 HydrophobicContact CG2-CG1 4.42Å; V327-I448 HydrophobicContact CG1-CB 4.46Å; A330-I448 HydrophobicContact CB-CD1 3.82Å; A331-I448 HydrophobicContact CB-CD1 4.24Å; T401-I448 WeakPolarHBondContact O-CG2 3.19Å; T405-I448 HydrophobicContact CG2-CD1 4.3Å; T405-I448 HydrophobicContact CG2-CG1 4.18Å; T405-I448 HydrophobicContact CG2-CG2 4.27Å; L444-I448 PolarHBondContact O-N 3.21Å; L444-I448 VanDerWaalsContact O-N 3.14Å; Q445-I448 VanDerWaalsContact O-CG2 3.26Å; Q445-I448 WeakPolarHBondContact O-CG2 3.42Å; N446-I448 PolarHBondContact O-N 2.84Å; I448-I450 VanDerWaalsContact C-N 3.32Å; I448-I450 PolarHBondContact O-N 2.85Å; I448-A451 WeakPolarHBondContact O-CB 3.36Å; I448-A451 PolarHBondContact O-N 3.33Å; I448-A451 VanDerWaalsContact O-N 3.14Å; I448-D452 PolarHBondContact O-N 3.21Å
449	H	98.2	Very high	96.6	Very high	0 Å²	0	13.8 Å²	13.8	0%	0	7%	0.071	C	C	.	.	H	α-helix	trans	-62.4	-39.2	178.2	-168.7	55.7	0	0	0	112.6	A404 M407 H410 L413 Q445 N446 D452 L453	A404-H449 PolarHBondContact O-ND1 3.12Å; M407-H449 VanDerWaalsContact SD-CE1 3.56Å; H410-H449 AromaticContact CG-NE2 3.77Å; H410-H449 AromaticContact ND1-NE2 3.2Å; H410-H449 PolarHBondContact ND1-NE2 3.08Å; L413-H449 HydrophobicContact CD1-CB 4.28Å; Q445-H449 VanDerWaalsContact O-CB 3.29Å; Q445-H449 WeakPolarHBondContact O-CB 3.41Å; Q445-H449 PolarHBondContact O-N 3.21Å; Q445-H449 VanDerWaalsContact O-N 3.08Å; N446-H449 PolarHBondContact O-N 2.68Å; H449-D452 PolarHBondContact O-N 2.9Å; H449-L453 WeakPolarHBondContact O-CB 3.49Å; H449-L453 WeakPolarHBondContact O-CG 3.29Å; H449-L453 PolarHBondContact O-N 3.5Å
450	I	97.9	Very high	97.1	Very high	1 Å²	1	12.6 Å²	12.6	1%	0.005	6%	0.064	C	C	.	.	H	α-helix	trans	-67.3	-40.3	174.2	-72.5	160.8	0	0	0	111.1	M309 L417 N446 I448 D452 L453 S454 L514 M515 W518	M309-I450 HydrophobicContact CE-CB 3.82Å; M309-I450 HydrophobicContact CE-CD1 4.38Å; M309-I450 HydrophobicContact CE-CG2 3.46Å; M309-I450 VanDerWaalsContact CE-CG2 3.46Å; M309-I450 HydrophobicContact SD-CG2 4.12Å; L417-I450 HydrophobicContact CD2-CD1 4.44Å; N446-I450 HydrophobicContact CB-CD1 4.35Å; N446-I450 VanDerWaalsContact O-CB 3.29Å; N446-I450 WeakPolarHBondContact O-CB 3.5Å; N446-I450 VanDerWaalsContact O-CD1 3.24Å; N446-I450 WeakPolarHBondContact O-CD1 3.4Å; N446-I450 WeakPolarHBondContact O-CG1 3.48Å; N446-I450 PolarHBondContact O-N 2.64Å; I448-I450 VanDerWaalsContact C-N 3.32Å; I448-I450 PolarHBondContact O-N 2.85Å; I450-D452 VanDerWaalsContact C-N 3.31Å; I450-L453 CarbonylContact O-C 3.59Å; I450-L453 PolarHBondContact O-N 2.91Å; I450-S454 WeakPolarHBondContact O-CA 3.41Å; I450-S454 WeakPolarHBondContact O-CB 3.18Å; I450-S454 PolarHBondContact O-N 3.08Å; I450-L514 HydrophobicContact CD1-CD1 4.22Å; I450-L514 HydrophobicContact CD1-CG 4.42Å; I450-L514 HydrophobicContact CG1-CD1 3.85Å; I450-L514 HydrophobicContact CG1-CD2 3.78Å; I450-L514 HydrophobicContact CG1-CG 3.68Å; I450-M515 HydrophobicContact CG2-CE 3.7Å; I450-M515 HydrophobicContact CG2-SD 3.67Å; I450-W518 HydrophobicContact CD1-CB 3.54Å; I450-W518 HydrophobicContact CD1-CD2 3.38Å; I450-W518 HydrophobicContact CD1-CE3 3.3Å; I450-W518 HydrophobicContact CD1-CG 3.49Å; I450-W518 VanDerWaalsContact CD1-CG 3.49Å; I450-W518 HydrophobicContact CD1-CZ3 4.13Å
451	A	98.4	Very high	97.4	Very high	0 Å²	0	14.9 Å²	14.9	0%	0	8%	0.083	C	C	.	.	H	α-helix	trans	-63.8	-39	177	0	0	0	0	0	111.7	V302 T305 V306 M309 L447 I448 S454	V302-A451 HydrophobicContact CG1-CB 3.95Å; T305-A451 HydrophobicContact CG2-CB 3.78Å; V306-A451 HydrophobicContact CG2-CB 3.49Å; V306-A451 VanDerWaalsContact CG2-CB 3.49Å; M309-A451 HydrophobicContact SD-CB 4Å; L447-A451 PolarHBondContact O-N 3.35Å; L447-A451 VanDerWaalsContact O-N 3.11Å; I448-A451 WeakPolarHBondContact O-CB 3.36Å; I448-A451 PolarHBondContact O-N 3.33Å; I448-A451 VanDerWaalsContact O-N 3.14Å; A451-S454 VanDerWaalsContact O-CB 3.22Å; A451-S454 WeakPolarHBondContact O-CB 3.46Å; A451-S454 PolarHBondContact O-N 3.05Å; A451-S454 PolarHBondContact O-OG 3.03Å
452	D	98.7	Very high	97.5	Very high	17 Å²	17	14.8 Å²	14.8	9%	0.091	8%	0.083	C	C	.	.	H	α-helix	trans	-64.5	-44.2	174.2	-170	5.3	0	0	0	111.7	H298 V302 H334 I448 H449 I450 S454	H298-D452 IonicContact CE1-OD1 2.75Å; H298-D452 PolarHBondContact CE1-OD1 3.17Å; H298-D452 VanDerWaalsContact CE1-OD1 3.29Å; H298-D452 IonicContact NE2-OD1 3.2Å; H298-D452 PolarHBondContact NE2-OD1 3.02Å; V302-D452 HydrophobicContact CG2-CB 4.49Å; H334-D452 IonicContact NE2-OD1 3.13Å; I448-D452 PolarHBondContact O-N 3.21Å; H449-D452 PolarHBondContact O-N 2.9Å; I450-D452 VanDerWaalsContact C-N 3.31Å; D452-S454 PolarHBondContact O-N 3.47Å
453	L	98.2	Very high	97.8	Very high	14 Å²	14	12.6 Å²	12.6	7%	0.073	7%	0.073	C	C	.	.	T	Hydrogen-bonded Turn	trans	-84.9	17.6	176.5	-62.1	175.5	0	0	0	114.5	M407 H449 I450 N455 P456 F506 I510 L514	M407-L453 HydrophobicContact CE-CD1 3.99Å; M407-L453 HydrophobicContact CE-CD2 3.85Å; M407-L453 HydrophobicContact SD-CD1 4.08Å; M407-L453 HydrophobicContact SD-CD2 3.79Å; M407-L453 HydrophobicContact SD-CG 4.27Å; H449-L453 WeakPolarHBondContact O-CB 3.49Å; H449-L453 WeakPolarHBondContact O-CG 3.29Å; H449-L453 PolarHBondContact O-N 3.5Å; I450-L453 CarbonylContact O-C 3.59Å; I450-L453 PolarHBondContact O-N 2.91Å; L453-N455 PolarHBondContact O-N 2.6Å; L453-P456 WeakPolarHBondContact O-CD 3.32Å; L453-F506 HydrophobicContact CD2-CZ 3.88Å; L453-I510 HydrophobicContact CD1-CG2 4.42Å; L453-L514 HydrophobicContact CB-CD2 4.44Å; L453-L514 HydrophobicContact CD1-CD2 3.66Å
454	S	98.3	Very high	98	Very high	0 Å²	0	14.9 Å²	14.9	0%	0	8%	0.083	C	C	.	.	T	Hydrogen-bonded Turn	trans	-80.6	-16.2	-170.4	67.2	0	0	0	0	114.7	I450 A451 D452 P456 S457 K458	I450-S454 WeakPolarHBondContact O-CA 3.41Å; I450-S454 WeakPolarHBondContact O-CB 3.18Å; I450-S454 PolarHBondContact O-N 3.08Å; A451-S454 VanDerWaalsContact O-CB 3.22Å; A451-S454 WeakPolarHBondContact O-CB 3.46Å; A451-S454 PolarHBondContact O-N 3.05Å; A451-S454 PolarHBondContact O-OG 3.03Å; D452-S454 PolarHBondContact O-N 3.47Å; S454-P456 VanDerWaalsContact C-CD 3.49Å; S454-S457 WeakPolarHBondContact O-CA 3.37Å; S454-S457 PolarHBondContact O-N 3.37Å; S454-S457 PolarHBondContact O-OG 2.91Å; S454-K458 PolarHBondContact O-N 3.25Å; S454-K458 WeakPolarHBondContact OG-CE 3.36Å; S454-K458 PolarHBondContact OG-NZ 3.15Å
455	N	98.5	Very high	98.1	Very high	12 Å²	12	18.1 Å²	18.1	6%	0.064	10%	0.099	C	C	.	.	G	3₁₀ helix	trans	-50.2	-45.6	-172.7	-57.6	-26.5	0	0	0	114.1	Y293 D301 L453 S457 K458 Y463 W466	Y293-N455 WeakPolarHBondContact CE2-ND2 3.47Å; Y293-N455 PolarHBondContact OH-ND2 2.67Å; D301-N455 PolarHBondContact OD2-OD1 3.05Å; L453-N455 PolarHBondContact O-N 2.6Å; N455-S457 PolarHBondContact O-N 3.35Å; N455-S457 VanDerWaalsContact O-N 3.1Å; N455-K458 WeakPolarHBondContact O-CB 3.29Å; N455-K458 PolarHBondContact O-N 2.76Å; N455-Y463 HydrophobicContact CB-CD2 4.12Å; N455-Y463 WeakPolarHBondContact O-CB 3.31Å; N455-Y463 WeakPolarHBondContact O-CD2 3.26Å; N455-W466 HydrophobicContact CB-CB 4.02Å; N455-W466 HydrophobicContact CB-CG 4.14Å; N455-W466 PolarHBondContact OD1-NE1 2.79Å
456	P	98.5	Very high	98.1	Very high	3 Å²	3	16.5 Å²	16.5	2%	0.019	9%	0.091	C	C	.	.	G	3₁₀ helix	trans	-66.4	-12.7	-179.4	-22.9	38.2	0	0	0	114.7	L453 S454 Y463 F506 I507 V511 L533 N536	L453-P456 WeakPolarHBondContact O-CD 3.32Å; S454-P456 VanDerWaalsContact C-CD 3.49Å; P456-Y463 HydrophobicContact CB-CD1 4.44Å; P456-Y463 HydrophobicContact CB-CD2 4.38Å; P456-Y463 HydrophobicContact CB-CE1 3.86Å; P456-Y463 HydrophobicContact CB-CE2 3.84Å; P456-Y463 HydrophobicContact CG-CD2 4.36Å; P456-Y463 HydrophobicContact CG-CE2 3.63Å; P456-F506 HydrophobicContact CG-CD1 4.19Å; P456-F506 HydrophobicContact CG-CE1 3.93Å; P456-I507 HydrophobicContact CB-CD1 4.01Å; P456-I507 HydrophobicContact CB-CG1 3.82Å; P456-I507 HydrophobicContact CG-CG1 4.4Å; P456-V511 HydrophobicContact CB-CG1 4.37Å; P456-V511 HydrophobicContact CG-CG1 4.31Å; P456-V511 HydrophobicContact CG-CG2 4.17Å; P456-L533 HydrophobicContact CB-CD1 3.51Å; P456-N536 WeakPolarHBondContact O-CB 3.35Å; P456-N536 PolarHBondContact O-ND2 3.42Å
457	S	98.1	Very high	98.2	Very high	0 Å²	0	16.6 Å²	16.6	0%	0	9%	0.091	C	C	.	.	G	3₁₀ helix	trans	-102.5	5.2	175.9	73	0	0	0	0	113.7	W237 S454 N455 Q532	W237-S457 WeakPolarHBondContact CZ2-OG 3.4Å; W237-S457 PolarHBondContact NE1-O 2.64Å; S454-S457 WeakPolarHBondContact O-CA 3.37Å; S454-S457 PolarHBondContact O-N 3.37Å; S454-S457 PolarHBondContact O-OG 2.91Å; N455-S457 PolarHBondContact O-N 3.35Å; N455-S457 VanDerWaalsContact O-N 3.1Å; S457-Q532 WeakPolarHBondContact O-CG 3.4Å
458	K	98.2	Very high	98.2	Very high	2 Å²	2	20.5 Å²	20.5	1%	0.009	11%	0.112	C	C	.	.	S	Bend	trans	-83.5	161.1	171.9	-55.7	-65.7	170.7	67.8	0	110	D301 T305 S454 N455 L460 L462 N536	D301-K458 IonicContact OD1-NZ 2.77Å; D301-K458 PolarHBondContact OD1-NZ 3.38Å; D301-K458 IonicContact OD2-NZ 2.76Å; D301-K458 PolarHBondContact OD2-NZ 2.85Å; T305-K458 PolarHBondContact OG1-NZ 3.29Å; S454-K458 PolarHBondContact O-N 3.25Å; S454-K458 WeakPolarHBondContact OG-CE 3.36Å; S454-K458 PolarHBondContact OG-NZ 3.15Å; N455-K458 WeakPolarHBondContact O-CB 3.29Å; N455-K458 PolarHBondContact O-N 2.76Å; K458-L460 PolarHBondContact O-N 3.43Å; K458-L462 HydrophobicContact CB-CB 4.26Å; K458-N536 PolarHBondContact O-ND2 3.41Å
459	P	98	Very high	98.2	Very high	45 Å²	45	24.1 Å²	24.1	29%	0.292	13%	0.126	S	C	.	.			trans	-49.6	138.1	172	-29.2	34.9	0	0	0	112.7	P461 L462 Y463	P459-P461 VanDerWaalsContact C-CD 3.43Å; P459-P461 VanDerWaalsContact O-N 3.1Å; P459-L462 WeakPolarHBondContact O-CB 3.28Å; P459-L462 PolarHBondContact O-N 2.73Å; P459-Y463 PolarHBondContact O-N 2.99Å; P459-Y463 VanDerWaalsContact O-N 3.15Å
460	L	98	Very high	98.2	Very high	33 Å²	33	25.4 Å²	25.4	17%	0.173	13%	0.133	C	C	.	.	H	α-helix	trans	-46.4	-44.3	-170.3	-175.9	65.4	0	0	0	115.2	K458 L462 Y463 E464 N539 F540	K458-L460 PolarHBondContact O-N 3.43Å; L460-L462 VanDerWaalsContact C-N 3.27Å; L460-L462 PolarHBondContact O-N 3.26Å; L460-Y463 PolarHBondContact O-N 3.09Å; L460-E464 HydrophobicContact CD1-CG 4.04Å; L460-E464 HydrophobicContact CG-CG 4.28Å; L460-E464 WeakPolarHBondContact O-CG 3.29Å; L460-E464 PolarHBondContact O-N 3.39Å; L460-N539 HydrophobicContact CD1-CB 4.11Å; L460-N539 HydrophobicContact CD2-CB 4Å; L460-F540 HydrophobicContact CD1-CE2 4.2Å
461	P	97.9	Very high	98.2	Very high	83 Å²	83	25.5 Å²	25.5	54%	0.539	13%	0.133	S	C	.	.	H	α-helix	trans	-64.8	-26.1	179.2	-22.7	35.1	0	0	0	114.8	P459 Q465	P459-P461 VanDerWaalsContact C-CD 3.43Å; P459-P461 VanDerWaalsContact O-N 3.1Å; P461-Q465 WeakPolarHBondContact O-CG 3.49Å; P461-Q465 PolarHBondContact O-NE2 3.13Å
462	L	98.2	Very high	98.1	Very high	12 Å²	12	29.4 Å²	29.4	6%	0.063	15%	0.151	C	C	.	.	H	α-helix	trans	-78.6	-44.9	173.5	-62.9	-179.7	0	0	0	110.2	D240 F242 K458 P459 L460 E464 Q465 W466	D240-L462 HydrophobicContact CB-CD2 4.11Å; F242-L462 HydrophobicContact CD2-CD2 3.86Å; F242-L462 HydrophobicContact CE2-CD2 4.25Å; K458-L462 HydrophobicContact CB-CB 4.26Å; P459-L462 WeakPolarHBondContact O-CB 3.28Å; P459-L462 PolarHBondContact O-N 2.73Å; L460-L462 VanDerWaalsContact C-N 3.27Å; L460-L462 PolarHBondContact O-N 3.26Å; L462-E464 VanDerWaalsContact C-N 3.34Å; L462-E464 PolarHBondContact O-N 2.9Å; L462-Q465 PolarHBondContact O-N 3.46Å; L462-W466 PolarHBondContact O-N 2.88Å
463	Y	98.5	Very high	98.1	Very high	3 Å²	3	29.1 Å²	29.1	1%	0.012	15%	0.15	C	C	.	.	H	α-helix	trans	-59.2	-45.8	178.1	179.1	-151.7	0	0	0	111.3	N455 P456 P459 L460 Q465 W466 V467 Q503 I507 N536 F540	N455-Y463 HydrophobicContact CB-CD2 4.12Å; N455-Y463 WeakPolarHBondContact O-CB 3.31Å; N455-Y463 WeakPolarHBondContact O-CD2 3.26Å; P456-Y463 HydrophobicContact CB-CD1 4.44Å; P456-Y463 HydrophobicContact CB-CD2 4.38Å; P456-Y463 HydrophobicContact CB-CE1 3.86Å; P456-Y463 HydrophobicContact CB-CE2 3.84Å; P456-Y463 HydrophobicContact CG-CD2 4.36Å; P456-Y463 HydrophobicContact CG-CE2 3.63Å; P459-Y463 PolarHBondContact O-N 2.99Å; P459-Y463 VanDerWaalsContact O-N 3.15Å; L460-Y463 PolarHBondContact O-N 3.09Å; Y463-Q465 VanDerWaalsContact C-N 3.33Å; Y463-Q465 PolarHBondContact O-N 3.37Å; Y463-W466 WeakPolarHBondContact O-CB 3.2Å; Y463-W466 PolarHBondContact O-N 3.06Å; Y463-V467 HydrophobicContact CD2-CG2 3.72Å; Y463-V467 HydrophobicContact CE2-CG2 3.3Å; Y463-V467 WeakPolarHBondContact O-CG2 3.38Å; Y463-V467 PolarHBondContact O-N 2.78Å; Y463-Q503 WeakPolarHBondContact OH-CB 3.32Å; Y463-Q503 PolarHBondContact OH-OE1 3.12Å; Y463-I507 HydrophobicContact CE1-CD1 4.19Å; Y463-N536 HydrophobicContact CD1-CB 3.89Å; Y463-N536 HydrophobicContact CE1-CB 4.11Å; Y463-F540 HydrophobicContact CD1-CD2 4.35Å; Y463-F540 AromaticContact CD1-CE2 3.59Å; Y463-F540 HydrophobicContact CD1-CE2 3.59Å; Y463-F540 HydrophobicContact CD1-CZ 4.47Å; Y463-F540 AromaticContact CE1-CD2 3.74Å; Y463-F540 HydrophobicContact CE1-CD2 3.74Å; Y463-F540 AromaticContact CE1-CE2 3.24Å; Y463-F540 HydrophobicContact CE1-CE2 3.24Å; Y463-F540 HydrophobicContact CE1-CZ 4.14Å; Y463-F540 AromaticContact CZ-CE2 3.91Å
464	E	98.1	Very high	98.1	Very high	48 Å²	48	32 Å²	32	22%	0.224	16%	0.16	C	C	.	.	H	α-helix	trans	-59.1	-41.5	177.6	-73.2	-180	143.1	0	0	112.8	L460 L462 W466 V467 D468 F540 R543	L460-E464 HydrophobicContact CD1-CG 4.04Å; L460-E464 HydrophobicContact CG-CG 4.28Å; L460-E464 WeakPolarHBondContact O-CG 3.29Å; L460-E464 PolarHBondContact O-N 3.39Å; L462-E464 VanDerWaalsContact C-N 3.34Å; L462-E464 PolarHBondContact O-N 2.9Å; E464-W466 VanDerWaalsContact C-N 3.32Å; E464-W466 PolarHBondContact O-N 2.93Å; E464-V467 PolarHBondContact O-N 3.49Å; E464-D468 PolarHBondContact O-N 3.12Å; E464-F540 HydrophobicContact CG-CZ 4.29Å; E464-R543 IonicContact OE1-CZ 3.86Å; E464-R543 IonicContact OE1-NH1 2.84Å; E464-R543 PolarHBondContact OE1-NH1 3.24Å; E464-R543 IonicContact OE1-NH2 2.77Å; E464-R543 PolarHBondContact OE1-NH2 3.06Å
465	Q	98.3	Very high	98	Very high	70 Å²	70	34.6 Å²	34.6	33%	0.327	17%	0.17	S	C	.	.	H	α-helix	trans	-64	-37.2	174.8	-78.3	177.4	82.4	0	0	112.3	F242 P461 L462 Y463 R469	F242-Q465 HydrophobicContact CD2-CB 4.17Å; F242-Q465 HydrophobicContact CE2-CB 3.49Å; F242-Q465 VanDerWaalsContact CE2-CB 3.49Å; F242-Q465 HydrophobicContact CE2-CG 4.32Å; F242-Q465 HydrophobicContact CZ-CB 3.82Å; P461-Q465 WeakPolarHBondContact O-CG 3.49Å; P461-Q465 PolarHBondContact O-NE2 3.13Å; L462-Q465 PolarHBondContact O-N 3.46Å; Y463-Q465 VanDerWaalsContact C-N 3.33Å; Y463-Q465 PolarHBondContact O-N 3.37Å; Q465-R469 WeakPolarHBondContact O-CB 3.32Å; Q465-R469 WeakPolarHBondContact O-CD 3.36Å; Q465-R469 VanDerWaalsContact O-CG 3.23Å; Q465-R469 WeakPolarHBondContact O-CG 3.41Å; Q465-R469 PolarHBondContact O-N 3.35Å; Q465-R469 VanDerWaalsContact O-N 3.12Å
466	W	98.6	Very high	98	Very high	3 Å²	3	35.4 Å²	35.4	1%	0.011	18%	0.181	C	C	.	.	H	α-helix	trans	-66.4	-41.1	174.3	-77.3	132.3	0	0	0	112.4	V241 F242 Y293 I297 H298 D301 N455 L462 Y463 E464 R469 L470	V241-W466 HydrophobicContact CG1-CZ2 3.68Å; F242-W466 HydrophobicContact CE1-CD2 4.43Å; F242-W466 HydrophobicContact CE1-CE3 4.36Å; F242-W466 AromaticContact CE1-CH2 3.93Å; F242-W466 HydrophobicContact CE1-CH2 3.93Å; F242-W466 HydrophobicContact CE1-CZ2 4.03Å; F242-W466 HydrophobicContact CE1-CZ3 4.12Å; F242-W466 HydrophobicContact CE2-CD2 4.4Å; F242-W466 AromaticContact CZ-CD2 3.61Å; F242-W466 HydrophobicContact CZ-CD2 3.61Å; F242-W466 AromaticContact CZ-CE2 3.53Å; F242-W466 AromaticContact CZ-CE3 3.91Å; F242-W466 HydrophobicContact CZ-CE3 3.91Å; F242-W466 HydrophobicContact CZ-CG 4.14Å; F242-W466 HydrophobicContact CZ-CH2 4.01Å; F242-W466 AromaticContact CZ-CZ2 3.76Å; F242-W466 HydrophobicContact CZ-CZ2 3.76Å; F242-W466 HydrophobicContact CZ-CZ3 4.1Å; Y293-W466 AromaticContact CD2-CE3 3.74Å; Y293-W466 HydrophobicContact CD2-CE3 3.74Å; Y293-W466 HydrophobicContact CD2-CZ3 4.23Å; Y293-W466 HydrophobicContact CE2-CD2 4.37Å; Y293-W466 AromaticContact CE2-CE3 3.72Å; Y293-W466 HydrophobicContact CE2-CE3 3.72Å; Y293-W466 HydrophobicContact CE2-CZ3 4.35Å; I297-W466 HydrophobicContact CB-CH2 4.2Å; I297-W466 HydrophobicContact CG2-CH2 3.75Å; I297-W466 HydrophobicContact CG2-CZ2 4.2Å; H298-W466 HydrophobicContact CB-CH2 3.9Å; H298-W466 HydrophobicContact CB-CZ3 4.03Å; D301-W466 HydrophobicContact CB-CZ2 3.84Å; D301-W466 PolarHBondContact OD2-NE1 3.42Å; D301-W466 VanDerWaalsContact OD2-NE1 3.08Å; N455-W466 HydrophobicContact CB-CB 4.02Å; N455-W466 HydrophobicContact CB-CG 4.14Å; N455-W466 PolarHBondContact OD1-NE1 2.79Å; L462-W466 PolarHBondContact O-N 2.88Å; Y463-W466 WeakPolarHBondContact O-CB 3.2Å; Y463-W466 PolarHBondContact O-N 3.06Å; E464-W466 VanDerWaalsContact C-N 3.32Å; E464-W466 PolarHBondContact O-N 2.93Å; W466-R469 PolarHBondContact O-N 3.46Å; W466-L470 WeakPolarHBondContact O-CB 3.26Å; W466-L470 PolarHBondContact O-N 3.17Å
467	V	98	Very high	98	Very high	2 Å²	2	35.4 Å²	35.4	1%	0.012	18%	0.181	C	C	.	.	H	α-helix	trans	-59.6	-48.2	175.1	174.1	0	0	0	0	110.8	Y463 E464 R469 L470 L471 R499 Q503 F540	Y463-V467 HydrophobicContact CD2-CG2 3.72Å; Y463-V467 HydrophobicContact CE2-CG2 3.3Å; Y463-V467 WeakPolarHBondContact O-CG2 3.38Å; Y463-V467 PolarHBondContact O-N 2.78Å; E464-V467 PolarHBondContact O-N 3.49Å; V467-R469 VanDerWaalsContact C-N 3.3Å; V467-R469 PolarHBondContact O-N 3.28Å; V467-L470 PolarHBondContact O-N 3.07Å; V467-L471 HydrophobicContact CG1-CD1 3.95Å; V467-L471 HydrophobicContact CG1-CG 4.36Å; V467-L471 WeakPolarHBondContact O-CB 3.4Å; V467-L471 WeakPolarHBondContact O-CG 3.31Å; V467-L471 PolarHBondContact O-N 3.27Å; V467-R499 HydrophobicContact CG1-CG 3.95Å; V467-Q503 HydrophobicContact CG1-CG 3.96Å; V467-Q503 HydrophobicContact CG2-CG 3.91Å; V467-F540 HydrophobicContact CG2-CZ 4.1Å
468	D	97.7	Very high	97.9	Very high	83 Å²	83	35.4 Å²	35.4	44%	0.444	18%	0.181	S	C	.	.	H	α-helix	trans	-63.2	-39.1	-178	-62.8	-11.1	0	0	0	111.3	E464 E472 R499	E464-D468 PolarHBondContact O-N 3.12Å; D468-E472 WeakPolarHBondContact O-CB 3.41Å; D468-E472 PolarHBondContact O-N 3.05Å; D468-R499 IonicContact OD1-CZ 3.33Å; D468-R499 IonicContact OD1-NE 3.58Å; D468-R499 PolarHBondContact OD1-NE 3.42Å; D468-R499 IonicContact OD1-NH2 3.3Å; D468-R499 PolarHBondContact OD1-NH2 2.92Å
469	R	98.4	Very high	97.9	Very high	75 Å²	75	37.9 Å²	37.9	28%	0.283	19%	0.194	S	C	.	.	H	α-helix	trans	-65.8	-43.7	174.9	-76.6	172.6	179.4	-77.8	-0.3	113.3	S292 Y293 Q465 W466 V467 E472 E473	S292-R469 WeakPolarHBondContact CB-O 3.23Å; S292-R469 WeakPolarHBondContact O-CB 3.32Å; S292-R469 WeakPolarHBondContact O-CD 3.45Å; S292-R469 WeakPolarHBondContact O-CG 3.18Å; S292-R469 PolarHBondContact O-NH1 3.4Å; S292-R469 VanDerWaalsContact O-NH1 3.17Å; Y293-R469 HydrophobicContact CD2-CB 4.4Å; Q465-R469 WeakPolarHBondContact O-CB 3.32Å; Q465-R469 WeakPolarHBondContact O-CD 3.36Å; Q465-R469 VanDerWaalsContact O-CG 3.23Å; Q465-R469 WeakPolarHBondContact O-CG 3.41Å; Q465-R469 PolarHBondContact O-N 3.35Å; Q465-R469 VanDerWaalsContact O-N 3.12Å; W466-R469 PolarHBondContact O-N 3.46Å; V467-R469 VanDerWaalsContact C-N 3.3Å; V467-R469 PolarHBondContact O-N 3.28Å; R469-E472 PolarHBondContact O-N 3.37Å; R469-E473 PolarHBondContact O-N 2.96Å; R469-E473 VanDerWaalsContact O-N 3.11Å
470	L	97.7	Very high	97.9	Very high	27 Å²	27	39.7 Å²	39.7	14%	0.141	20%	0.197	C	C	.	.	H	α-helix	trans	-64.8	-46	179.5	-176.6	64.3	0	0	0	110.8	Y293 W466 V467 E473 Y474	Y293-L470 HydrophobicContact CD1-CD1 4.08Å; Y293-L470 HydrophobicContact CD2-CB 3.73Å; Y293-L470 HydrophobicContact CD2-CD1 4.03Å; Y293-L470 HydrophobicContact CD2-CG 4.44Å; Y293-L470 HydrophobicContact CE1-CD1 4.4Å; Y293-L470 HydrophobicContact CE2-CB 4.24Å; Y293-L470 HydrophobicContact CE2-CD1 4.34Å; Y293-L470 HydrophobicContact CG-CB 4.26Å; Y293-L470 HydrophobicContact CG-CD1 3.89Å; W466-L470 WeakPolarHBondContact O-CB 3.26Å; W466-L470 PolarHBondContact O-N 3.17Å; V467-L470 PolarHBondContact O-N 3.07Å; L470-E473 PolarHBondContact O-N 3.38Å; L470-Y474 HydrophobicContact CD1-CD1 4.39Å; L470-Y474 HydrophobicContact CD1-CE1 3.75Å; L470-Y474 HydrophobicContact CD1-CE2 4.28Å; L470-Y474 HydrophobicContact CD2-CE2 4.21Å; L470-Y474 HydrophobicContact CG-CD2 4.42Å; L470-Y474 HydrophobicContact CG-CE1 4.28Å; L470-Y474 HydrophobicContact CG-CE2 3.95Å; L470-Y474 PolarHBondContact O-N 3.39Å
471	L	97.1	Very high	97.8	Very high	3 Å²	3	38.2 Å²	38.2	2%	0.016	19%	0.189	C	C	.	.	H	α-helix	trans	-62.9	-42.2	177.1	-71.4	178.7	0	0	0	111.9	V467 E473 Y474 W475 M491 V497 R499	V467-L471 HydrophobicContact CG1-CD1 3.95Å; V467-L471 HydrophobicContact CG1-CG 4.36Å; V467-L471 WeakPolarHBondContact O-CB 3.4Å; V467-L471 WeakPolarHBondContact O-CG 3.31Å; V467-L471 PolarHBondContact O-N 3.27Å; L471-E473 VanDerWaalsContact C-N 3.26Å; L471-E473 PolarHBondContact O-N 3.49Å; L471-Y474 PolarHBondContact O-N 3.06Å; L471-W475 HydrophobicContact CB-CD2 4.46Å; L471-W475 HydrophobicContact CB-CH2 4.08Å; L471-W475 HydrophobicContact CB-CZ2 3.82Å; L471-W475 HydrophobicContact CB-CZ3 4.49Å; L471-W475 HydrophobicContact CD1-CZ2 4.2Å; L471-W475 HydrophobicContact CG-CZ2 4.46Å; L471-W475 WeakPolarHBondContact O-CB 3.39Å; L471-W475 PolarHBondContact O-N 3.42Å; L471-M491 HydrophobicContact CD2-CE 4.01Å; L471-V497 HydrophobicContact CD2-CG1 4.11Å; L471-R499 HydrophobicContact CD1-CB 4.09Å; L471-R499 HydrophobicContact CD1-CG 3.86Å
472	E	98	Very high	97.8	Very high	82 Å²	82	38.7 Å²	38.7	38%	0.383	18%	0.183	S	C	.	.	H	α-helix	trans	-61.2	-36.8	175.8	-173.2	61.7	-149.6	0	0	111.9	S292 D468 R469 W475 G476	S292-E472 WeakPolarHBondContact OG-CG 3.28Å; D468-E472 WeakPolarHBondContact O-CB 3.41Å; D468-E472 PolarHBondContact O-N 3.05Å; R469-E472 PolarHBondContact O-N 3.37Å; E472-W475 PolarHBondContact O-N 2.9Å; E472-G476 PolarHBondContact O-N 2.92Å
473	E	98.3	Very high	97.7	Very high	12 Å²	12	45.8 Å²	45.8	6%	0.056	22%	0.216	C	C	.	.	H	α-helix	trans	-68.4	-44.5	175.2	-159.9	168.8	121.7	0	0	112.5	N291 S292 Y293 H294 H338 G340 R469 L470 L471 W475 G476 Q477	N291-E473 VanDerWaalsContact CB-OE2 3.27Å; N291-E473 WeakPolarHBondContact CB-OE2 3.38Å; S292-E473 PolarHBondContact N-OE2 2.8Å; Y293-E473 WeakPolarHBondContact CA-OE2 3.47Å; Y293-E473 WeakPolarHBondContact CB-OE2 3.44Å; Y293-E473 PolarHBondContact N-OE2 3.12Å; H294-E473 IonicContact CE1-OE1 2.79Å; H294-E473 IonicContact CG-OE1 3.92Å; H294-E473 PolarHBondContact N-OE2 3.19Å; H294-E473 IonicContact ND1-OE1 3.85Å; H294-E473 PolarHBondContact ND1-OE1 3.22Å; H294-E473 IonicContact ND1-OE2 2.64Å; H338-E473 IonicContact CE1-OE1 3.79Å; H338-E473 IonicContact ND1-OE1 3.55Å; G340-E473 VanDerWaalsContact CA-OE1 3.28Å; G340-E473 WeakPolarHBondContact CA-OE1 3.48Å; R469-E473 PolarHBondContact O-N 2.96Å; R469-E473 VanDerWaalsContact O-N 3.11Å; L470-E473 PolarHBondContact O-N 3.38Å; L471-E473 VanDerWaalsContact C-N 3.26Å; L471-E473 PolarHBondContact O-N 3.49Å; E473-W475 VanDerWaalsContact C-N 3.3Å; E473-W475 PolarHBondContact O-N 3.46Å; E473-G476 PolarHBondContact O-N 3.43Å; E473-G476 VanDerWaalsContact O-N 3.14Å; E473-Q477 PolarHBondContact O-N 2.7Å
474	Y	97.2	Very high	97.6	Very high	73 Å²	73	50.5 Å²	50.5	29%	0.286	24%	0.24	S	C	.	.	H	α-helix	trans	-59.6	-40.7	174	-71.5	-8.2	0	0	0	111.9	L470 L471 G476 Q477 G478 M491 C492	L470-Y474 HydrophobicContact CD1-CD1 4.39Å; L470-Y474 HydrophobicContact CD1-CE1 3.75Å; L470-Y474 HydrophobicContact CD1-CE2 4.28Å; L470-Y474 HydrophobicContact CD2-CE2 4.21Å; L470-Y474 HydrophobicContact CG-CD2 4.42Å; L470-Y474 HydrophobicContact CG-CE1 4.28Å; L470-Y474 HydrophobicContact CG-CE2 3.95Å; L470-Y474 PolarHBondContact O-N 3.39Å; L471-Y474 PolarHBondContact O-N 3.06Å; Y474-G476 VanDerWaalsContact C-N 3.34Å; Y474-Q477 WeakPolarHBondContact O-CB 3.43Å; Y474-Q477 PolarHBondContact O-N 2.97Å; Y474-G478 PolarHBondContact O-N 3.41Å; Y474-M491 HydrophobicContact CD2-CB 4Å; Y474-M491 HydrophobicContact CE2-CB 4.37Å; Y474-C492 WeakPolarHBondContact O-CA 3.47Å; Y474-C492 VanDerWaalsContact O-CB 3.26Å; Y474-C492 WeakPolarHBondContact O-CB 3.17Å; Y474-C492 PolarHBondContact O-SG 3.22Å
475	W	97.7	Very high	97.4	Very high	56 Å²	56	51.3 Å²	51.3	21%	0.212	26%	0.262	C	S	.	.	H	α-helix	trans	-66.8	-36.5	175.7	-59.9	-21.8	0	0	0	112.2	L471 E472 E473 Q477 G478 D479 R494	L471-W475 HydrophobicContact CB-CD2 4.46Å; L471-W475 HydrophobicContact CB-CH2 4.08Å; L471-W475 HydrophobicContact CB-CZ2 3.82Å; L471-W475 HydrophobicContact CB-CZ3 4.49Å; L471-W475 HydrophobicContact CD1-CZ2 4.2Å; L471-W475 HydrophobicContact CG-CZ2 4.46Å; L471-W475 WeakPolarHBondContact O-CB 3.39Å; L471-W475 PolarHBondContact O-N 3.42Å; E472-W475 PolarHBondContact O-N 2.9Å; E473-W475 VanDerWaalsContact C-N 3.3Å; E473-W475 PolarHBondContact O-N 3.46Å; W475-Q477 VanDerWaalsContact C-N 3.31Å; W475-Q477 PolarHBondContact O-N 3.46Å; W475-G478 PolarHBondContact O-N 3.32Å; W475-D479 VanDerWaalsContact O-CG 3.27Å; W475-D479 PolarHBondContact O-N 3.35Å; W475-R494 HydrophobicContact CB-CB 4.19Å; W475-R494 HydrophobicContact CD2-CB 3.73Å; W475-R494 HydrophobicContact CE3-CB 4.36Å; W475-R494 HydrophobicContact CG-CB 3.63Å
476	G	97.4	Very high	97.2	Very high	28 Å²	28	51.5 Å²	51.5	29%	0.289	26%	0.262	S	S	.	.	H	α-helix	trans	-61.6	-36.9	171.1	0	0	0	0	0	113.1	E472 E473 Y474 K480	E472-G476 PolarHBondContact O-N 2.92Å; E473-G476 PolarHBondContact O-N 3.43Å; E473-G476 VanDerWaalsContact O-N 3.14Å; Y474-G476 VanDerWaalsContact C-N 3.34Å; G476-K480 WeakPolarHBondContact O-CG 3.12Å; G476-K480 PolarHBondContact O-N 3.3Å
477	Q	97.9	Very high	97	Very high	4 Å²	4	60 Å²	60	2%	0.019	30%	0.302	C	S	.	.	H	α-helix	trans	-65.3	-47.7	169.8	178.3	174.7	-54.8	0	0	111.4	L341 F345 E473 Y474 W475 D479 K480 E481	L341-Q477 HydrophobicContact CD2-CB 3.85Å; L341-Q477 HydrophobicContact CD2-CG 3.74Å; F345-Q477 HydrophobicContact CB-CG 4.5Å; F345-Q477 HydrophobicContact CD2-CG 3.74Å; F345-Q477 HydrophobicContact CE2-CG 4.34Å; F345-Q477 HydrophobicContact CG-CG 4.31Å; E473-Q477 PolarHBondContact O-N 2.7Å; Y474-Q477 WeakPolarHBondContact O-CB 3.43Å; Y474-Q477 PolarHBondContact O-N 2.97Å; W475-Q477 VanDerWaalsContact C-N 3.31Å; W475-Q477 PolarHBondContact O-N 3.46Å; Q477-D479 VanDerWaalsContact C-N 3.28Å; Q477-D479 PolarHBondContact O-N 3.34Å; Q477-K480 WeakPolarHBondContact O-CB 3.09Å; Q477-K480 PolarHBondContact O-N 3Å; Q477-E481 HydrophobicContact CG-CG 4.26Å; Q477-E481 PolarHBondContact NE2-OE1 3.46Å; Q477-E481 WeakPolarHBondContact O-CG 3.33Å; Q477-E481 PolarHBondContact O-N 3.45Å
478	G	97.6	Very high	96.9	Very high	0 Å²	0	61.8 Å²	61.8	0%	0	31%	0.312	C	S	.	.	H	α-helix	trans	-60.6	-36	-179.1	0	0	0	0	0	113.4	Y474 W475 E481 K482	Y474-G478 PolarHBondContact O-N 3.41Å; W475-G478 PolarHBondContact O-N 3.32Å; G478-E481 PolarHBondContact O-N 2.94Å; G478-K482 WeakPolarHBondContact O-CG 3.42Å; G478-K482 PolarHBondContact O-N 2.84Å
479	D	97.2	Very high	96.6	Very high	54 Å²	54	59.1 Å²	59.1	29%	0.289	30%	0.301	S	S	.	.	H	α-helix	trans	-64.7	-43.2	173.5	-67.5	-19.1	0	0	0	111.3	W475 Q477 E481 K482 E483 R494	W475-D479 VanDerWaalsContact O-CG 3.27Å; W475-D479 PolarHBondContact O-N 3.35Å; Q477-D479 VanDerWaalsContact C-N 3.28Å; Q477-D479 PolarHBondContact O-N 3.34Å; D479-E481 PolarHBondContact O-N 3.03Å; D479-K482 WeakPolarHBondContact O-CB 3.34Å; D479-K482 PolarHBondContact O-N 3.46Å; D479-E483 WeakPolarHBondContact O-CG 3.38Å; D479-E483 PolarHBondContact O-N 2.88Å; D479-R494 IonicContact OD1-NE 2.75Å; D479-R494 IonicContact OD1-NH2 3.17Å; D479-R494 IonicContact OD2-CZ 3.82Å; D479-R494 IonicContact OD2-NE 2.66Å; D479-R494 IonicContact OD2-NH2 2.78Å; D479-R494 PolarHBondContact OD2-NH2 2.91Å
480	K	97.1	Very high	96.2	Very high	82 Å²	82	61.3 Å²	61.3	36%	0.357	32%	0.324	S	S	.	.	H	α-helix	trans	-64.7	-37.1	174.4	-72.5	167.7	175.7	172.9	0	112.6	L341 F345 G476 Q477 E483 L484	L341-K480 HydrophobicContact CD2-CD 3.77Å; F345-K480 HydrophobicContact CE2-CB 4.17Å; F345-K480 HydrophobicContact CZ-CB 4.16Å; G476-K480 WeakPolarHBondContact O-CG 3.12Å; G476-K480 PolarHBondContact O-N 3.3Å; Q477-K480 WeakPolarHBondContact O-CB 3.09Å; Q477-K480 PolarHBondContact O-N 3Å; K480-E483 PolarHBondContact O-N 3.03Å; K480-L484 WeakPolarHBondContact O-CG 3.27Å; K480-L484 PolarHBondContact O-N 2.88Å
481	E	97.8	Very high	95.8	Very high	3 Å²	3	63.1 Å²	63.1	1%	0.014	33%	0.333	C	S	.	.	H	α-helix	trans	-61.4	-44.9	174.3	-71.4	169.5	161.7	0	0	110.8	F345 Q477 G478 D479 E483 L484 G485 F486 V488 S489	F345-E481 HydrophobicContact CD2-CG 3.6Å; F345-E481 HydrophobicContact CE2-CG 3.61Å; Q477-E481 HydrophobicContact CG-CG 4.26Å; Q477-E481 PolarHBondContact NE2-OE1 3.46Å; Q477-E481 WeakPolarHBondContact O-CG 3.33Å; Q477-E481 PolarHBondContact O-N 3.45Å; G478-E481 PolarHBondContact O-N 2.94Å; D479-E481 PolarHBondContact O-N 3.03Å; E481-E483 PolarHBondContact O-N 2.87Å; E481-L484 PolarHBondContact O-N 3.4Å; E481-G485 PolarHBondContact O-N 2.8Å; E481-G485 VanDerWaalsContact O-N 3.09Å; E481-F486 HydrophobicContact CB-CB 4.15Å; E481-F486 HydrophobicContact CG-CB 4.48Å; E481-F486 PolarHBondContact O-N 3.19Å; E481-V488 WeakPolarHBondContact OE2-CA 3.42Å; E481-S489 VanDerWaalsContact OE1-CB 3.29Å; E481-S489 WeakPolarHBondContact OE1-CB 3.48Å; E481-S489 PolarHBondContact OE1-OG 3.34Å; E481-S489 PolarHBondContact OE2-N 2.88Å
482	K	95.9	Very high	95.7	Very high	93 Å²	93	63.2 Å²	63.2	40%	0.404	33%	0.334	S	S	.	.	H	α-helix	trans	-60.3	-43.7	174.1	-69.6	173	-173.3	172.8	0	111.7	G478 D479 L484 G485 V488 D493	G478-K482 WeakPolarHBondContact O-CG 3.42Å; G478-K482 PolarHBondContact O-N 2.84Å; D479-K482 WeakPolarHBondContact O-CB 3.34Å; D479-K482 PolarHBondContact O-N 3.46Å; K482-L484 VanDerWaalsContact C-N 3.34Å; K482-L484 PolarHBondContact O-N 3.37Å; K482-G485 PolarHBondContact O-N 3.49Å; K482-V488 HydrophobicContact CD-CG2 4.17Å; K482-V488 HydrophobicContact CG-CG2 3.51Å; K482-D493 IonicContact NZ-OD1 3.23Å; K482-D493 PolarHBondContact NZ-OD1 3.37Å
483	E	96.5	Very high	95.4	Very high	161 Å²	161	61.2 Å²	61.2	75%	0.752	33%	0.326	S	S	*	.	H	α-helix	trans	-62.4	-38	178.3	-73.9	176.3	-177.9	0	0	113	D479 K480 E481 G485	D479-E483 WeakPolarHBondContact O-CG 3.38Å; D479-E483 PolarHBondContact O-N 2.88Å; K480-E483 PolarHBondContact O-N 3.03Å; E481-E483 PolarHBondContact O-N 2.87Å; E483-G485 VanDerWaalsContact C-N 3.32Å
484	L	96.1	Very high	95.1	Very high	101 Å²	101	65.7 Å²	65.7	53%	0.529	34%	0.342	S	S	.	.	H	α-helix	trans	-84.2	-4.6	179	-66.6	174.7	0	0	0	113.7	F345 K480 E481 K482 F486	F345-L484 HydrophobicContact CE2-CD1 4.34Å; F345-L484 HydrophobicContact CZ-CD1 3.71Å; K480-L484 WeakPolarHBondContact O-CG 3.27Å; K480-L484 PolarHBondContact O-N 2.88Å; E481-L484 PolarHBondContact O-N 3.4Å; K482-L484 VanDerWaalsContact C-N 3.34Å; K482-L484 PolarHBondContact O-N 3.37Å; L484-F486 VanDerWaalsContact C-N 3.35Å; L484-F486 HydrophobicContact CB-CD2 4.16Å; L484-F486 HydrophobicContact CB-CE2 4.12Å; L484-F486 HydrophobicContact CB-CG 4.37Å; L484-F486 HydrophobicContact CB-CZ 4.31Å; L484-F486 HydrophobicContact CD1-CD2 4.39Å; L484-F486 HydrophobicContact CD1-CE2 3.9Å; L484-F486 HydrophobicContact CD1-CZ 4.45Å
485	G	95.5	Very high	94.7	Very high	66 Å²	66	70.2 Å²	70.2	68%	0.68	37%	0.366	S	S	*	.	T	Hydrogen-bonded Turn	trans	73.6	24.5	-177.4	0	0	0	0	0	113.9	E481 K482 E483	E481-G485 PolarHBondContact O-N 2.8Å; E481-G485 VanDerWaalsContact O-N 3.09Å; K482-G485 PolarHBondContact O-N 3.49Å; E483-G485 VanDerWaalsContact C-N 3.32Å
486	F	94.2	Very high	94.2	Very high	73 Å²	73	74 Å²	74	32%	0.32	39%	0.39	S	S	.	.	P	Polyproline II helix	trans	-82.5	157.9	170.7	-62.6	-21.3	0	0	0	111.4	E481 L484	E481-F486 HydrophobicContact CB-CB 4.15Å; E481-F486 HydrophobicContact CG-CB 4.48Å; E481-F486 PolarHBondContact O-N 3.19Å; L484-F486 VanDerWaalsContact C-N 3.35Å; L484-F486 HydrophobicContact CB-CD2 4.16Å; L484-F486 HydrophobicContact CB-CE2 4.12Å; L484-F486 HydrophobicContact CB-CG 4.37Å; L484-F486 HydrophobicContact CB-CZ 4.31Å; L484-F486 HydrophobicContact CD1-CD2 4.39Å; L484-F486 HydrophobicContact CD1-CE2 3.9Å; L484-F486 HydrophobicContact CD1-CZ 4.45Å
487	E	94	Very high	93.7	Very high	183 Å²	183	74.3 Å²	74.3	86%	0.855	39%	0.386	S	S	*	.	P	Polyproline II helix	trans	-64.4	133.4	163.3	-174.5	174.8	-177.7	0	0	108.7	S489	E487-S489 PolarHBondContact O-N 3.4Å
488	V	95	Very high	93.3	Very high	38 Å²	38	76.3 Å²	76.3	23%	0.23	40%	0.401	C	S	.	.	P	Polyproline II helix	trans	-70.2	124.4	-179.3	-176.5	0	0	0	0	108.7	E481 K482 C492 D493	E481-V488 WeakPolarHBondContact OE2-CA 3.42Å; K482-V488 HydrophobicContact CD-CG2 4.17Å; K482-V488 HydrophobicContact CG-CG2 3.51Å; V488-C492 HydrophobicContact CG1-CB 4.02Å; V488-D493 HydrophobicContact CG1-CB 3.88Å
489	S	92.2	Very high	93.1	Very high	28 Å²	28	78.5 Å²	78.5	20%	0.196	41%	0.409	C	S	.	.	P	Polyproline II helix	trans	-59.5	148.9	-179.9	-71	0	0	0	0	110.9	E481 E487 M491 C492	E481-S489 VanDerWaalsContact OE1-CB 3.29Å; E481-S489 WeakPolarHBondContact OE1-CB 3.48Å; E481-S489 PolarHBondContact OE1-OG 3.34Å; E481-S489 PolarHBondContact OE2-N 2.88Å; E487-S489 PolarHBondContact O-N 3.4Å; S489-M491 PolarHBondContact O-N 2.92Å; S489-C492 WeakPolarHBondContact O-CB 3.33Å; S489-C492 PolarHBondContact O-N 2.92Å
490	P	89.2	Confident	92.9	Very high	121 Å²	121	78.1 Å²	78.1	79%	0.786	41%	0.406	S	S	*	.	T	Hydrogen-bonded Turn	trans	-49.4	145.1	169.4	-26.1	34.6	0	0	0	111	C492	P490-C492 PolarHBondContact O-N 3.5Å; P490-C492 VanDerWaalsContact O-N 3.08Å
491	M	90.6	Very high	92.6	Very high	65 Å²	65	76.7 Å²	76.7	32%	0.32	40%	0.4	S	S	.	.	T	Hydrogen-bonded Turn	trans	67.6	-9.1	-175.7	-58.7	-60	-58.8	0	0	116.6	L471 Y474 S489 V497	L471-M491 HydrophobicContact CD2-CE 4.01Å; Y474-M491 HydrophobicContact CD2-CB 4Å; Y474-M491 HydrophobicContact CE2-CB 4.37Å; S489-M491 PolarHBondContact O-N 2.92Å; M491-V497 HydrophobicContact CE-CG1 3.43Å; M491-V497 VanDerWaalsContact CE-CG1 3.43Å; M491-V497 HydrophobicContact CE-CG2 4.42Å; M491-V497 HydrophobicContact SD-CG1 4.17Å; M491-V497 HydrophobicContact SD-CG2 4.38Å
492	C	94	Very high	92.3	Very high	5 Å²	5	77.6 Å²	77.6	3%	0.034	41%	0.406	C	S	.	.			trans	-94.1	-10.1	-177.1	-60.4	0	0	0	0	113.7	Y474 V488 S489 P490 R494	Y474-C492 WeakPolarHBondContact O-CA 3.47Å; Y474-C492 VanDerWaalsContact O-CB 3.26Å; Y474-C492 WeakPolarHBondContact O-CB 3.17Å; Y474-C492 PolarHBondContact O-SG 3.22Å; V488-C492 HydrophobicContact CG1-CB 4.02Å; S489-C492 WeakPolarHBondContact O-CB 3.33Å; S489-C492 PolarHBondContact O-N 2.92Å; P490-C492 PolarHBondContact O-N 3.5Å; P490-C492 VanDerWaalsContact O-N 3.08Å; C492-R494 PolarHBondContact O-N 3.24Å
493	D	92.6	Very high	92.3	Very high	40 Å²	40	73.7 Å²	73.7	21%	0.214	39%	0.389	C	S	.	.			trans	-89.2	104.5	175.4	-168.5	15.8	0	0	0	112.3	K482 V488 Q495 N496 V497	K482-D493 IonicContact NZ-OD1 3.23Å; K482-D493 PolarHBondContact NZ-OD1 3.37Å; V488-D493 HydrophobicContact CG1-CB 3.88Å; D493-Q495 PolarHBondContact O-N 3.5Å; D493-N496 HydrophobicContact CB-CB 4.41Å; D493-N496 PolarHBondContact O-N 3.38Å; D493-V497 WeakPolarHBondContact O-CG2 3.44Å
494	R	92	Very high	92.2	Very high	105 Å²	105	66 Å²	66	40%	0.396	35%	0.353	S	S	.	.	T	Hydrogen-bonded Turn	trans	-52.1	-18.6	179.1	65.2	177.1	69.8	-129.8	1.4	115.4	W475 D479 C492	W475-R494 HydrophobicContact CB-CB 4.19Å; W475-R494 HydrophobicContact CD2-CB 3.73Å; W475-R494 HydrophobicContact CE3-CB 4.36Å; W475-R494 HydrophobicContact CG-CB 3.63Å; D479-R494 IonicContact OD1-NE 2.75Å; D479-R494 IonicContact OD1-NH2 3.17Å; D479-R494 IonicContact OD2-CZ 3.82Å; D479-R494 IonicContact OD2-NE 2.66Å; D479-R494 IonicContact OD2-NH2 2.78Å; D479-R494 PolarHBondContact OD2-NH2 2.91Å; C492-R494 PolarHBondContact O-N 3.24Å
495	Q	88.4	Confident	91.8	Very high	169 Å²	169	61.7 Å²	61.7	79%	0.79	33%	0.334	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.1	-15.9	-180	-60.8	-176.6	-0.2	0	0	114.1	D493	D493-Q495 PolarHBondContact O-N 3.5Å
496	N	88	Confident	91.7	Very high	135 Å²	135	61.6 Å²	61.6	72%	0.722	31%	0.314	S	S	*	.	S	Bend	trans	-131.4	37.9	-169.4	-166.7	33.8	0	0	0	112.3	D493	D493-N496 HydrophobicContact CB-CB 4.41Å; D493-N496 PolarHBondContact O-N 3.38Å
497	V	86.3	Confident	91.8	Very high	34 Å²	34	58.1 Å²	58.1	21%	0.206	30%	0.299	C	S	.	.			trans	-126.2	123.8	178.8	171.9	0	0	0	0	109.8	L471 M491 D493	L471-V497 HydrophobicContact CD2-CG1 4.11Å; M491-V497 HydrophobicContact CE-CG1 3.43Å; M491-V497 VanDerWaalsContact CE-CG1 3.43Å; M491-V497 HydrophobicContact CE-CG2 4.42Å; M491-V497 HydrophobicContact SD-CG1 4.17Å; M491-V497 HydrophobicContact SD-CG2 4.38Å; D493-V497 WeakPolarHBondContact O-CG2 3.44Å
498	S	89.7	Confident	91.7	Very high	47 Å²	47	51.1 Å²	51.1	33%	0.329	27%	0.268	S	S	.	.			trans	-89.3	110	166.1	171.7	0	0	0	0	108.9	E500 K501 S502	S498-E500 PolarHBondContact O-N 2.63Å; S498-K501 PolarHBondContact O-N 3.41Å; S498-K501 WeakPolarHBondContact OG-CB 3.29Å; S498-K501 PolarHBondContact OG-N 2.91Å; S498-S502 WeakPolarHBondContact O-CB 3.31Å; S498-S502 PolarHBondContact O-N 3.23Å; S498-S502 PolarHBondContact O-OG 3.2Å
499	R	92.6	Very high	91.3	Very high	45 Å²	45	56.3 Å²	56.3	17%	0.17	28%	0.284	C	S	.	.	H	α-helix	trans	-54.2	-54.6	179.1	175.4	176.8	-174.9	-84	1.1	109.9	V467 D468 L471 K501 S502 Q503 F540	V467-R499 HydrophobicContact CG1-CG 3.95Å; D468-R499 IonicContact OD1-CZ 3.33Å; D468-R499 IonicContact OD1-NE 3.58Å; D468-R499 PolarHBondContact OD1-NE 3.42Å; D468-R499 IonicContact OD1-NH2 3.3Å; D468-R499 PolarHBondContact OD1-NH2 2.92Å; L471-R499 HydrophobicContact CD1-CB 4.09Å; L471-R499 HydrophobicContact CD1-CG 3.86Å; R499-K501 PolarHBondContact O-N 3.03Å; R499-S502 PolarHBondContact O-N 2.88Å; R499-S502 PolarHBondContact O-OG 3.08Å; R499-Q503 WeakPolarHBondContact O-CG 3.47Å; R499-Q503 PolarHBondContact O-N 2.95Å; R499-F540 VanDerWaalsContact NH1-CE1 3.28Å
500	E	94	Very high	91.3	Very high	47 Å²	47	56.8 Å²	56.8	22%	0.22	28%	0.284	C	S	.	.	H	α-helix	trans	-63.1	-45.1	-176	-68.5	60.9	-139.4	0	0	112.2	S498 S502 Q503 V504 F540 R543 L544	S498-E500 PolarHBondContact O-N 2.63Å; E500-S502 VanDerWaalsContact C-N 3.33Å; E500-S502 PolarHBondContact O-N 3.3Å; E500-Q503 PolarHBondContact O-N 3.47Å; E500-V504 WeakPolarHBondContact O-CG2 3.43Å; E500-V504 PolarHBondContact O-N 3.44Å; E500-F540 HydrophobicContact CB-CD1 4.38Å; E500-F540 HydrophobicContact CG-CD1 4.18Å; E500-R543 HydrophobicContact CG-CB 3.66Å; E500-L544 HydrophobicContact CB-CD2 3.54Å; E500-L544 HydrophobicContact CB-CG 4.22Å
501	K	91	Very high	91.6	Very high	52 Å²	52	51 Å²	51	23%	0.226	25%	0.247	C	C	.	.	H	α-helix	trans	-63.5	-41.5	-178.4	-175.5	169.6	-167.3	162.4	0	111.7	S498 R499 Q503 G505 L544 D548 E551 F552	S498-K501 PolarHBondContact O-N 3.41Å; S498-K501 WeakPolarHBondContact OG-CB 3.29Å; S498-K501 PolarHBondContact OG-N 2.91Å; R499-K501 PolarHBondContact O-N 3.03Å; K501-Q503 VanDerWaalsContact C-N 3.32Å; K501-Q503 PolarHBondContact O-N 3.1Å; K501-G505 PolarHBondContact O-N 3Å; K501-L544 HydrophobicContact CB-CD2 3.92Å; K501-D548 IonicContact NZ-OD1 2.93Å; K501-D548 PolarHBondContact NZ-OD1 3.24Å; K501-E551 WeakPolarHBondContact CE-OE2 3.46Å; K501-E551 IonicContact NZ-OE1 2.89Å; K501-E551 PolarHBondContact NZ-OE1 3.02Å; K501-E551 IonicContact NZ-OE2 2.66Å; K501-E551 PolarHBondContact NZ-OE2 3.08Å; K501-F552 HydrophobicContact CG-CE2 3.85Å; K501-F552 HydrophobicContact CG-CZ 3.82Å
502	S	91.2	Very high	91.8	Very high	22 Å²	22	50 Å²	50	15%	0.154	24%	0.241	C	C	.	.	H	α-helix	trans	-62.8	-39	177.7	72.8	0	0	0	0	112.5	S498 R499 E500 F506	S498-S502 WeakPolarHBondContact O-CB 3.31Å; S498-S502 PolarHBondContact O-N 3.23Å; S498-S502 PolarHBondContact O-OG 3.2Å; R499-S502 PolarHBondContact O-N 2.88Å; R499-S502 PolarHBondContact O-OG 3.08Å; E500-S502 VanDerWaalsContact C-N 3.33Å; E500-S502 PolarHBondContact O-N 3.3Å; S502-F506 WeakPolarHBondContact O-CB 3.43Å; S502-F506 PolarHBondContact O-N 3.23Å
503	Q	96	Very high	91.9	Very high	10 Å²	10	51.1 Å²	51.1	5%	0.047	25%	0.248	C	C	.	.	H	α-helix	trans	-73.1	-41.5	-179.3	-64.9	-42.5	-70	0	0	112	Y463 V467 R499 E500 K501 F506 I507 F540	Y463-Q503 WeakPolarHBondContact OH-CB 3.32Å; Y463-Q503 PolarHBondContact OH-OE1 3.12Å; V467-Q503 HydrophobicContact CG1-CG 3.96Å; V467-Q503 HydrophobicContact CG2-CG 3.91Å; R499-Q503 WeakPolarHBondContact O-CG 3.47Å; R499-Q503 PolarHBondContact O-N 2.95Å; E500-Q503 PolarHBondContact O-N 3.47Å; K501-Q503 VanDerWaalsContact C-N 3.32Å; K501-Q503 PolarHBondContact O-N 3.1Å; Q503-F506 PolarHBondContact O-N 3.13Å; Q503-I507 VanDerWaalsContact O-CG1 3.29Å; Q503-I507 WeakPolarHBondContact O-CG1 3.46Å; Q503-I507 PolarHBondContact O-N 3.46Å; Q503-F540 HydrophobicContact CB-CB 4.47Å; Q503-F540 HydrophobicContact CB-CD1 3.83Å; Q503-F540 HydrophobicContact CB-CD2 4.28Å; Q503-F540 HydrophobicContact CB-CE1 4.01Å; Q503-F540 HydrophobicContact CB-CG 3.94Å; Q503-F540 HydrophobicContact CB-CZ 4.36Å; Q503-F540 HydrophobicContact CG-CD1 4.05Å; Q503-F540 HydrophobicContact CG-CE1 3.71Å; Q503-F540 HydrophobicContact CG-CZ 4Å
504	V	94.2	Very high	92	Very high	0 Å²	0	49.2 Å²	49.2	0%	0	24%	0.238	C	C	.	.	H	α-helix	trans	-60.3	-49.3	174.1	176.8	0	0	0	0	110.5	E500 F506 I507 D508 F540 F541 L544 F552	E500-V504 WeakPolarHBondContact O-CG2 3.43Å; E500-V504 PolarHBondContact O-N 3.44Å; V504-F506 PolarHBondContact O-N 3.01Å; V504-I507 PolarHBondContact O-N 2.79Å; V504-D508 WeakPolarHBondContact O-CB 3.45Å; V504-D508 VanDerWaalsContact O-CG 3.29Å; V504-D508 PolarHBondContact O-N 2.96Å; V504-F540 HydrophobicContact CG2-CB 3.9Å; V504-F541 HydrophobicContact CG1-CD2 4.39Å; V504-F541 HydrophobicContact CG2-CB 4.08Å; V504-L544 HydrophobicContact CG2-CD1 4.08Å; V504-F552 HydrophobicContact CB-CE1 4.29Å; V504-F552 HydrophobicContact CB-CE2 4.47Å; V504-F552 HydrophobicContact CB-CZ 4.23Å; V504-F552 HydrophobicContact CG1-CB 4.49Å; V504-F552 HydrophobicContact CG1-CD1 3.66Å; V504-F552 HydrophobicContact CG1-CD2 4.15Å; V504-F552 HydrophobicContact CG1-CE1 3.83Å; V504-F552 HydrophobicContact CG1-CE2 4.29Å; V504-F552 HydrophobicContact CG1-CG 3.84Å; V504-F552 HydrophobicContact CG1-CZ 4.14Å
505	G	87.5	Confident	92.1	Very high	11 Å²	11	44.4 Å²	44.4	11%	0.113	22%	0.22	C	C	.	.	H	α-helix	trans	-62.9	-41.4	177.9	0	0	0	0	0	113.4	K501 I507 D508 Y509	K501-G505 PolarHBondContact O-N 3Å; G505-I507 VanDerWaalsContact C-N 3.34Å; G505-I507 PolarHBondContact O-N 3.15Å; G505-D508 PolarHBondContact O-N 2.88Å; G505-Y509 WeakPolarHBondContact O-CB 3.43Å; G505-Y509 WeakPolarHBondContact O-CD2 3.44Å; G505-Y509 PolarHBondContact O-N 3.24Å
506	F	93.6	Very high	92.5	Very high	63 Å²	63	40.7 Å²	40.7	28%	0.276	20%	0.203	S	C	.	.	H	α-helix	trans	-62.2	-41.1	176.8	178.7	-121.6	0	0	0	112.2	L453 P456 S502 Q503 V504 I510 V511	L453-F506 HydrophobicContact CD2-CZ 3.88Å; P456-F506 HydrophobicContact CG-CD1 4.19Å; P456-F506 HydrophobicContact CG-CE1 3.93Å; S502-F506 WeakPolarHBondContact O-CB 3.43Å; S502-F506 PolarHBondContact O-N 3.23Å; Q503-F506 PolarHBondContact O-N 3.13Å; V504-F506 PolarHBondContact O-N 3.01Å; F506-I510 HydrophobicContact CD2-CB 3.93Å; F506-I510 HydrophobicContact CD2-CG1 4.05Å; F506-I510 HydrophobicContact CD2-CG2 4.33Å; F506-I510 HydrophobicContact CE2-CB 3.97Å; F506-I510 HydrophobicContact CE2-CG1 4.33Å; F506-I510 HydrophobicContact CE2-CG2 3.84Å; F506-I510 WeakPolarHBondContact O-CB 3.44Å; F506-I510 PolarHBondContact O-N 2.85Å; F506-I510 VanDerWaalsContact O-N 3.08Å; F506-V511 HydrophobicContact CD1-CG2 3.8Å; F506-V511 HydrophobicContact CD2-CG2 4.4Å; F506-V511 HydrophobicContact CE1-CG2 3.38Å; F506-V511 HydrophobicContact CE2-CG2 4.04Å; F506-V511 HydrophobicContact CG-CG2 4.3Å; F506-V511 HydrophobicContact CZ-CG2 3.53Å; F506-V511 PolarHBondContact O-N 3.32Å; F506-V511 VanDerWaalsContact O-N 3.12Å
507	I	96.2	Very high	92.8	Very high	0 Å²	0	34.7 Å²	34.7	0%	0	17%	0.171	C	C	.	.	I	π-helix	trans	-65.5	-53.5	175.3	-65.4	167.2	0	0	0	110.4	P456 Y463 Q503 V504 G505 Y509 V511 H512 L533 R537	P456-I507 HydrophobicContact CB-CD1 4.01Å; P456-I507 HydrophobicContact CB-CG1 3.82Å; P456-I507 HydrophobicContact CG-CG1 4.4Å; Y463-I507 HydrophobicContact CE1-CD1 4.19Å; Q503-I507 VanDerWaalsContact O-CG1 3.29Å; Q503-I507 WeakPolarHBondContact O-CG1 3.46Å; Q503-I507 PolarHBondContact O-N 3.46Å; V504-I507 PolarHBondContact O-N 2.79Å; G505-I507 VanDerWaalsContact C-N 3.34Å; G505-I507 PolarHBondContact O-N 3.15Å; I507-Y509 VanDerWaalsContact C-N 3.33Å; I507-Y509 PolarHBondContact O-N 2.88Å; I507-V511 PolarHBondContact O-N 3.45Å; I507-H512 HydrophobicContact CG2-CB 4.08Å; I507-H512 WeakPolarHBondContact O-CB 3.32Å; I507-H512 PolarHBondContact O-N 3.25Å; I507-L533 HydrophobicContact CD1-CD1 4.3Å; I507-L533 HydrophobicContact CG1-CD1 4.07Å; I507-L533 HydrophobicContact CG2-CD1 3.78Å; I507-L533 HydrophobicContact CG2-CD2 4.31Å; I507-L533 HydrophobicContact CG2-CG 3.94Å; I507-R537 HydrophobicContact CB-CB 4.42Å; I507-R537 HydrophobicContact CB-CG 4.14Å; I507-R537 HydrophobicContact CD1-CB 3.8Å; I507-R537 HydrophobicContact CD1-CG 4.24Å; I507-R537 HydrophobicContact CG2-CB 3.91Å; I507-R537 HydrophobicContact CG2-CG 3.81Å
508	D	91.2	Very high	93.1	Very high	36 Å²	36	33.4 Å²	33.4	19%	0.193	16%	0.163	C	C	.	.	I	π-helix	trans	-62.2	-38.3	-173	-69.3	-3.4	0	0	0	112.4	V504 G505 R537	V504-D508 WeakPolarHBondContact O-CB 3.45Å; V504-D508 VanDerWaalsContact O-CG 3.29Å; V504-D508 PolarHBondContact O-N 2.96Å; G505-D508 PolarHBondContact O-N 2.88Å; D508-R537 IonicContact OD1-CZ 3.95Å; D508-R537 IonicContact OD1-NE 3.11Å; D508-R537 PolarHBondContact OD1-NE 3.31Å; D508-R537 IonicContact OD1-NH2 3.6Å; D508-R537 IonicContact OD2-CZ 3.6Å; D508-R537 IonicContact OD2-NE 2.7Å; D508-R537 IonicContact OD2-NH2 3.93Å; D508-R537 PolarHBondContact OD2-NH2 2.69Å
509	Y	86.4	Confident	93.3	Very high	148 Å²	148	31.4 Å²	31.4	58%	0.58	15%	0.149	S	C	*	.	I	π-helix	trans	-98.4	-23.4	-172.8	-61.8	-58.4	0	0	0	115.5	G505 I507	G505-Y509 WeakPolarHBondContact O-CB 3.43Å; G505-Y509 WeakPolarHBondContact O-CD2 3.44Å; G505-Y509 PolarHBondContact O-N 3.24Å; I507-Y509 VanDerWaalsContact C-N 3.33Å; I507-Y509 PolarHBondContact O-N 2.88Å
510	I	91.6	Very high	93.2	Very high	38 Å²	38	32.4 Å²	32.4	20%	0.195	16%	0.158	C	C	.	.	I	π-helix	trans	-121.8	-58.2	-173.2	-54.8	-64	0	0	0	111.1	M407 H410 M411 L453 F506	M407-I510 HydrophobicContact CE-CG2 4.19Å; H410-I510 VanDerWaalsContact CE1-CG2 3.48Å; H410-I510 WeakPolarHBondContact CE1-CG2 3.47Å; H410-I510 PolarHBondContact CE1-O 3.49Å; M411-I510 HydrophobicContact CE-CD1 3.95Å; L453-I510 HydrophobicContact CD1-CG2 4.42Å; F506-I510 HydrophobicContact CD2-CB 3.93Å; F506-I510 HydrophobicContact CD2-CG1 4.05Å; F506-I510 HydrophobicContact CD2-CG2 4.33Å; F506-I510 HydrophobicContact CE2-CB 3.97Å; F506-I510 HydrophobicContact CE2-CG1 4.33Å; F506-I510 HydrophobicContact CE2-CG2 3.84Å; F506-I510 WeakPolarHBondContact O-CB 3.44Å; F506-I510 PolarHBondContact O-N 2.85Å; F506-I510 VanDerWaalsContact O-N 3.08Å
511	V	95.9	Very high	92.9	Very high	0 Å²	0	30.2 Å²	30.2	0%	0	15%	0.147	C	C	.	.	I	π-helix	trans	-79.6	-43.1	-167.8	-176.1	0	0	0	0	112.4	P456 F506 I507 L514 M515 L533	P456-V511 HydrophobicContact CB-CG1 4.37Å; P456-V511 HydrophobicContact CG-CG1 4.31Å; P456-V511 HydrophobicContact CG-CG2 4.17Å; F506-V511 HydrophobicContact CD1-CG2 3.8Å; F506-V511 HydrophobicContact CD2-CG2 4.4Å; F506-V511 HydrophobicContact CE1-CG2 3.38Å; F506-V511 HydrophobicContact CE2-CG2 4.04Å; F506-V511 HydrophobicContact CG-CG2 4.3Å; F506-V511 HydrophobicContact CZ-CG2 3.53Å; F506-V511 PolarHBondContact O-N 3.32Å; F506-V511 VanDerWaalsContact O-N 3.12Å; I507-V511 PolarHBondContact O-N 3.45Å; V511-L514 PolarHBondContact O-N 3.43Å; V511-M515 HydrophobicContact CG1-CE 4.19Å; V511-M515 HydrophobicContact CG1-CG 3.78Å; V511-M515 WeakPolarHBondContact O-CB 3.32Å; V511-M515 VanDerWaalsContact O-CG 3.23Å; V511-M515 WeakPolarHBondContact O-CG 3.2Å; V511-M515 PolarHBondContact O-N 3.27Å; V511-L533 HydrophobicContact CG1-CD1 3.83Å; V511-L533 HydrophobicContact CG1-CD2 4.09Å
512	H	95.5	Very high	92.9	Very high	43 Å²	43	27.8 Å²	27.8	20%	0.199	14%	0.137	C	C	.	.	H	α-helix	trans	-62.2	-50.6	-179.2	-173.7	-69.9	0	0	0	112.5	I507 L514 M515 E516 L533 E534	I507-H512 HydrophobicContact CG2-CB 4.08Å; I507-H512 WeakPolarHBondContact O-CB 3.32Å; I507-H512 PolarHBondContact O-N 3.25Å; H512-L514 PolarHBondContact O-N 3.46Å; H512-M515 PolarHBondContact O-N 2.99Å; H512-E516 IonicContact CE1-OE2 3.36Å; H512-E516 IonicContact ND1-OE2 3.67Å; H512-E516 WeakPolarHBondContact O-CB 3.45Å; H512-E516 PolarHBondContact O-N 2.86Å; H512-L533 HydrophobicContact CB-CD2 4.08Å; H512-E534 IonicContact NE2-OE1 3.47Å
513	P	95.3	Very high	92.7	Very high	28 Å²	28	34 Å²	34	18%	0.182	16%	0.158	C	C	.	.	H	α-helix	trans	-58	-36.6	178.1	-25.2	35.7	0	0	0	113.2	L414 T517	L414-P513 HydrophobicContact CD2-CB 3.98Å; P513-T517 WeakPolarHBondContact O-CB 3.33Å; P513-T517 PolarHBondContact O-N 3.39Å; P513-T517 PolarHBondContact O-OG1 2.88Å
514	L	94.8	Very high	92.4	Very high	0 Å²	0	37.3 Å²	37.3	0%	0	18%	0.18	C	C	.	.	H	α-helix	trans	-69.5	-50.7	177.4	177.9	64.6	0	0	0	112	L414 L417 I450 L453 V511 H512 T517 W518	L414-L514 HydrophobicContact CD1-CD1 4.38Å; L417-L514 HydrophobicContact CD2-CD1 4.13Å; I450-L514 HydrophobicContact CD1-CD1 4.22Å; I450-L514 HydrophobicContact CD1-CG 4.42Å; I450-L514 HydrophobicContact CG1-CD1 3.85Å; I450-L514 HydrophobicContact CG1-CD2 3.78Å; I450-L514 HydrophobicContact CG1-CG 3.68Å; L453-L514 HydrophobicContact CB-CD2 4.44Å; L453-L514 HydrophobicContact CD1-CD2 3.66Å; V511-L514 PolarHBondContact O-N 3.43Å; H512-L514 PolarHBondContact O-N 3.46Å; L514-T517 PolarHBondContact O-N 3.3Å; L514-W518 WeakPolarHBondContact O-CB 3.43Å; L514-W518 PolarHBondContact O-N 3.21Å
515	M	95.6	Very high	92	Very high	4 Å²	4	40.2 Å²	40.2	2%	0.02	20%	0.196	C	C	.	.	H	α-helix	trans	-66.7	-38.1	-178.4	-70.1	-70.7	-179.4	0	0	112.2	I450 V511 H512 W518 A519 I529 L530 L533	I450-M515 HydrophobicContact CG2-CE 3.7Å; I450-M515 HydrophobicContact CG2-SD 3.67Å; V511-M515 HydrophobicContact CG1-CE 4.19Å; V511-M515 HydrophobicContact CG1-CG 3.78Å; V511-M515 WeakPolarHBondContact O-CB 3.32Å; V511-M515 VanDerWaalsContact O-CG 3.23Å; V511-M515 WeakPolarHBondContact O-CG 3.2Å; V511-M515 PolarHBondContact O-N 3.27Å; H512-M515 PolarHBondContact O-N 2.99Å; M515-W518 PolarHBondContact O-N 2.94Å; M515-A519 VanDerWaalsContact O-CB 3.32Å; M515-A519 WeakPolarHBondContact O-CB 3.35Å; M515-A519 PolarHBondContact O-N 2.9Å; M515-I529 HydrophobicContact SD-CG2 4.11Å; M515-L530 HydrophobicContact CB-CD1 4.28Å; M515-L533 HydrophobicContact CB-CD2 3.83Å; M515-L533 HydrophobicContact CG-CD2 3.97Å
516	E	95.9	Very high	92.2	Very high	91 Å²	91	39.8 Å²	39.8	43%	0.425	19%	0.192	S	C	.	.	H	α-helix	trans	-61.6	-49.3	174.2	-179.7	-176.5	-150.6	0	0	110.8	H512 W518 A519 D520 L530	H512-E516 IonicContact CE1-OE2 3.36Å; H512-E516 IonicContact ND1-OE2 3.67Å; H512-E516 WeakPolarHBondContact O-CB 3.45Å; H512-E516 PolarHBondContact O-N 2.86Å; E516-W518 VanDerWaalsContact C-N 3.29Å; E516-W518 PolarHBondContact O-N 3.46Å; E516-A519 PolarHBondContact O-N 3Å; E516-D520 PolarHBondContact O-N 3Å; E516-L530 HydrophobicContact CB-CD1 4.23Å; E516-L530 HydrophobicContact CB-CD2 4.46Å
517	T	93.3	Very high	92.2	Very high	10 Å²	10	40.1 Å²	40.1	6%	0.061	19%	0.194	C	C	.	.	H	α-helix	trans	-62.5	-38.5	178.2	-52	0	0	0	0	111	L417 K418 V421 P513 L514 L521	L417-T517 HydrophobicContact CB-CG2 4.14Å; L417-T517 HydrophobicContact CD2-CG2 3.83Å; L417-T517 HydrophobicContact CG-CG2 3.67Å; K418-T517 HydrophobicContact CB-CG2 4.29Å; K418-T517 WeakPolarHBondContact CE-OG1 3.45Å; K418-T517 HydrophobicContact CG-CG2 3.55Å; V421-T517 HydrophobicContact CG2-CG2 3.93Å; V421-T517 WeakPolarHBondContact CG2-O 3.35Å; P513-T517 WeakPolarHBondContact O-CB 3.33Å; P513-T517 PolarHBondContact O-N 3.39Å; P513-T517 PolarHBondContact O-OG1 2.88Å; L514-T517 PolarHBondContact O-N 3.3Å; T517-L521 PolarHBondContact O-N 3.2Å; T517-L521 VanDerWaalsContact O-N 3.17Å
518	W	93.5	Very high	92.1	Very high	7 Å²	7	47.9 Å²	47.9	3%	0.027	23%	0.23	C	C	.	.	H	α-helix	trans	-64.9	-45.3	173.5	-179.4	-104.9	0	0	0	112.5	M309 L315 L417 V443 L447 I450 L514 M515 E516 D520 L521 V522	M309-W518 HydrophobicContact CE-CD2 4.11Å; M309-W518 HydrophobicContact CE-CH2 4.03Å; M309-W518 HydrophobicContact CE-CZ2 3.36Å; L315-W518 HydrophobicContact CD1-CH2 3.89Å; L315-W518 HydrophobicContact CD1-CZ2 3.9Å; L417-W518 HydrophobicContact CD1-CE3 4.3Å; L417-W518 HydrophobicContact CD2-CB 4.42Å; V443-W518 HydrophobicContact CG1-CH2 4.24Å; V443-W518 HydrophobicContact CG1-CZ3 4.08Å; L447-W518 HydrophobicContact CB-CH2 3.98Å; L447-W518 HydrophobicContact CB-CZ3 4.38Å; L447-W518 HydrophobicContact CD1-CH2 4.08Å; L447-W518 HydrophobicContact CD1-CZ2 4.5Å; L447-W518 HydrophobicContact CG-CH2 4.15Å; I450-W518 HydrophobicContact CD1-CB 3.54Å; I450-W518 HydrophobicContact CD1-CD2 3.38Å; I450-W518 HydrophobicContact CD1-CE3 3.3Å; I450-W518 HydrophobicContact CD1-CG 3.49Å; I450-W518 VanDerWaalsContact CD1-CG 3.49Å; I450-W518 HydrophobicContact CD1-CZ3 4.13Å; L514-W518 WeakPolarHBondContact O-CB 3.43Å; L514-W518 PolarHBondContact O-N 3.21Å; M515-W518 PolarHBondContact O-N 2.94Å; E516-W518 VanDerWaalsContact C-N 3.29Å; E516-W518 PolarHBondContact O-N 3.46Å; W518-D520 VanDerWaalsContact C-N 3.27Å; W518-D520 PolarHBondContact O-N 3.33Å; W518-L521 HydrophobicContact CE3-CD2 4.11Å; W518-L521 HydrophobicContact CZ3-CD2 3.98Å; W518-L521 WeakPolarHBondContact O-CA 3.47Å; W518-L521 WeakPolarHBondContact O-CB 3.49Å; W518-L521 PolarHBondContact O-N 2.88Å; W518-V522 HydrophobicContact CD2-CG1 4.36Å; W518-V522 HydrophobicContact CG-CG2 4.47Å; W518-V522 HydrophobicContact CH2-CG1 4.23Å; W518-V522 HydrophobicContact CZ2-CG1 3.7Å; W518-V522 WeakPolarHBondContact O-CG2 3.31Å; W518-V522 PolarHBondContact O-N 3.27Å
519	A	93.6	Very high	92.3	Very high	4 Å²	4	47.2 Å²	47.2	3%	0.033	23%	0.227	C	C	.	.	H	α-helix	trans	-59.1	-39.2	178.8	0	0	0	0	0	111.7	M515 E516 L521 V522 Y523 L530	M515-A519 VanDerWaalsContact O-CB 3.32Å; M515-A519 WeakPolarHBondContact O-CB 3.35Å; M515-A519 PolarHBondContact O-N 2.9Å; E516-A519 PolarHBondContact O-N 3Å; A519-L521 VanDerWaalsContact C-N 3.35Å; A519-L521 PolarHBondContact O-N 2.91Å; A519-V522 CarbonylContact O-C 3.59Å; A519-V522 PolarHBondContact O-N 3.14Å; A519-Y523 VanDerWaalsContact O-CA 3.25Å; A519-Y523 WeakPolarHBondContact O-CA 3.39Å; A519-Y523 WeakPolarHBondContact O-CB 3.48Å; A519-Y523 PolarHBondContact O-N 2.93Å; A519-L530 HydrophobicContact CB-CB 4.47Å; A519-L530 HydrophobicContact CB-CD2 4.27Å
520	D	91.1	Very high	92.8	Very high	67 Å²	67	40.8 Å²	40.8	36%	0.358	20%	0.202	S	C	.	.	H	α-helix	trans	-60.3	-41.8	170.6	-97.5	10.8	0	0	0	112.5	V421 K424 K425 E516 W518	V421-D520 HydrophobicContact CG1-CB 3.76Å; V421-D520 HydrophobicContact CG2-CB 4.27Å; K424-D520 PolarHBondContact NZ-O 3.31Å; K425-D520 IonicContact NZ-OD2 2.63Å; K425-D520 PolarHBondContact NZ-OD2 3.45Å; E516-D520 PolarHBondContact O-N 3Å; W518-D520 VanDerWaalsContact C-N 3.27Å; W518-D520 PolarHBondContact O-N 3.33Å
521	L	87.8	Confident	93.1	Very high	0 Å²	0	41.9 Å²	41.9	0%	0	21%	0.209	C	C	.	.	H	α-helix	trans	-66.6	-39.4	178.9	-171.9	69.1	0	0	0	112.2	L417 M420 V421 K424 L431 V443 T517 W518 A519	L417-L521 HydrophobicContact CD1-CD2 3.68Å; M420-L521 HydrophobicContact CG-CD1 4.22Å; M420-L521 HydrophobicContact SD-CD1 4.33Å; V421-L521 HydrophobicContact CG2-CB 3.79Å; V421-L521 HydrophobicContact CG2-CD1 4.05Å; K424-L521 HydrophobicContact CD-CD1 4.18Å; K424-L521 PolarHBondContact NZ-O 3.44Å; L431-L521 HydrophobicContact CD1-CD1 3.48Å; L431-L521 VanDerWaalsContact CD1-CD1 3.48Å; L431-L521 HydrophobicContact CD1-CD2 4.29Å; L431-L521 HydrophobicContact CD1-CG 3.65Å; V443-L521 HydrophobicContact CG1-CD2 4.35Å; T517-L521 PolarHBondContact O-N 3.2Å; T517-L521 VanDerWaalsContact O-N 3.17Å; W518-L521 HydrophobicContact CE3-CD2 4.11Å; W518-L521 HydrophobicContact CZ3-CD2 3.98Å; W518-L521 WeakPolarHBondContact O-CA 3.47Å; W518-L521 WeakPolarHBondContact O-CB 3.49Å; W518-L521 PolarHBondContact O-N 2.88Å; A519-L521 VanDerWaalsContact C-N 3.35Å; A519-L521 PolarHBondContact O-N 2.91Å
522	V	89.7	Confident	93.2	Very high	2 Å²	2	44 Å²	44	1%	0.012	22%	0.219	C	C	.	.	H	α-helix	trans	-106.9	11.9	-176.2	-59.6	0	0	0	0	114.4	S314 L315 W518 A519 D525	S314-V522 WeakPolarHBondContact OG-CA 3.26Å; S314-V522 VanDerWaalsContact OG-CB 3.29Å; S314-V522 WeakPolarHBondContact OG-CB 3.27Å; S314-V522 PolarHBondContact OG-O 2.93Å; L315-V522 HydrophobicContact CD1-CG1 4.28Å; L315-V522 HydrophobicContact CD2-CG1 4.23Å; L315-V522 HydrophobicContact CG-CG1 4.16Å; W518-V522 HydrophobicContact CD2-CG1 4.36Å; W518-V522 HydrophobicContact CG-CG2 4.47Å; W518-V522 HydrophobicContact CH2-CG1 4.23Å; W518-V522 HydrophobicContact CZ2-CG1 3.7Å; W518-V522 WeakPolarHBondContact O-CG2 3.31Å; W518-V522 PolarHBondContact O-N 3.27Å; A519-V522 CarbonylContact O-C 3.59Å; A519-V522 PolarHBondContact O-N 3.14Å; V522-D525 PolarHBondContact O-N 3.09Å
523	Y	87.7	Confident	93.3	Very high	151 Å²	151	42 Å²	42	59%	0.592	21%	0.209	S	C	*	.	T	Hydrogen-bonded Turn	trans	-47.7	133.9	-177.3	-176.5	-88	0	0	0	112.5	A519	A519-Y523 VanDerWaalsContact O-CA 3.25Å; A519-Y523 WeakPolarHBondContact O-CA 3.39Å; A519-Y523 WeakPolarHBondContact O-CB 3.48Å; A519-Y523 PolarHBondContact O-N 2.93Å
524	P	89.8	Confident	93.4	Very high	80 Å²	80	44.6 Å²	44.6	52%	0.519	22%	0.219	S	C	.	.	T	Hydrogen-bonded Turn	cis	-89.7	-2.6	7.1	35.5	-36.1	0	0	0	115.6	G526 Q527	P524-G526 VanDerWaalsContact C-N 3.29Å; P524-G526 PolarHBondContact O-N 2.74Å; P524-Q527 WeakPolarHBondContact O-CB 3.43Å; P524-Q527 PolarHBondContact O-N 3.22Å; P524-Q527 VanDerWaalsContact O-N 3.13Å
525	D	86.9	Confident	93.6	Very high	61 Å²	61	49.6 Å²	49.6	33%	0.326	24%	0.242	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.7	-29.6	-165.8	-61.4	-59.1	0	0	0	113.9	A312 P313 V522 Q527	A312-D525 HydrophobicContact CB-CB 4.3Å; P313-D525 WeakPolarHBondContact CD-OD1 3.46Å; P313-D525 VanDerWaalsContact CD-OD2 3.25Å; P313-D525 WeakPolarHBondContact CD-OD2 3.48Å; V522-D525 PolarHBondContact O-N 3.09Å; D525-Q527 VanDerWaalsContact C-N 3.32Å; D525-Q527 PolarHBondContact O-N 3.23Å
526	G	91.3	Very high	93.7	Very high	3 Å²	3	49.5 Å²	49.5	3%	0.031	24%	0.242	C	C	.	.	T	Hydrogen-bonded Turn	trans	-78	-11.7	179.1	0	0	0	0	0	114.7	P524 Q528 I529 L530	P524-G526 VanDerWaalsContact C-N 3.29Å; P524-G526 PolarHBondContact O-N 2.74Å; G526-Q528 PolarHBondContact O-N 3.18Å; G526-I529 WeakPolarHBondContact O-CB 3.42Å; G526-I529 PolarHBondContact O-N 2.97Å; G526-L530 PolarHBondContact O-N 3.47Å; G526-L530 VanDerWaalsContact O-N 3.14Å
527	Q	94.2	Very high	93.8	Very high	70 Å²	70	45.8 Å²	45.8	33%	0.327	22%	0.224	S	C	.	.	H	α-helix	trans	-64	-41.8	-173	-171.1	63.4	52.8	0	0	112.3	P524 D525 I529 L530 D531	P524-Q527 WeakPolarHBondContact O-CB 3.43Å; P524-Q527 PolarHBondContact O-N 3.22Å; P524-Q527 VanDerWaalsContact O-N 3.13Å; D525-Q527 VanDerWaalsContact C-N 3.32Å; D525-Q527 PolarHBondContact O-N 3.23Å; Q527-I529 PolarHBondContact O-N 3.26Å; Q527-L530 PolarHBondContact O-N 3.11Å; Q527-L530 VanDerWaalsContact O-N 3.14Å; Q527-D531 PolarHBondContact NE2-OD1 2.89Å; Q527-D531 PolarHBondContact O-N 2.93Å
528	Q	94.1	Very high	93.9	Very high	162 Å²	162	49.3 Å²	49.3	76%	0.757	24%	0.242	S	C	*	.	H	α-helix	trans	-62.5	-32.2	179.3	-67.4	-176.5	-8.4	0	0	112.5	G526 Q532	G526-Q528 PolarHBondContact O-N 3.18Å; Q528-Q532 WeakPolarHBondContact O-CB 3.4Å; Q528-Q532 PolarHBondContact O-N 2.98Å; Q528-Q532 VanDerWaalsContact O-N 3.14Å
529	I	95.4	Very high	94.1	Very high	22 Å²	22	51.9 Å²	51.9	11%	0.113	26%	0.257	C	S	.	.	H	α-helix	trans	-70	-43.4	177.3	-59.4	172.6	0	0	0	109.6	W237 M515 G526 Q527 Q532 L533	W237-I529 HydrophobicContact CD2-CD1 3.74Å; W237-I529 HydrophobicContact CD2-CG1 3.79Å; W237-I529 HydrophobicContact CE3-CD1 3.7Å; W237-I529 HydrophobicContact CE3-CG1 4.29Å; W237-I529 HydrophobicContact CG-CD1 4.48Å; W237-I529 HydrophobicContact CG-CG1 4.12Å; W237-I529 HydrophobicContact CH2-CD1 3.72Å; W237-I529 HydrophobicContact CH2-CG1 4.47Å; W237-I529 HydrophobicContact CH2-CG2 4.29Å; W237-I529 HydrophobicContact CZ2-CB 4.37Å; W237-I529 HydrophobicContact CZ2-CD1 3.75Å; W237-I529 HydrophobicContact CZ2-CG1 3.99Å; W237-I529 HydrophobicContact CZ2-CG2 3.48Å; W237-I529 VanDerWaalsContact CZ2-CG2 3.48Å; W237-I529 HydrophobicContact CZ3-CD1 3.69Å; M515-I529 HydrophobicContact SD-CG2 4.11Å; G526-I529 WeakPolarHBondContact O-CB 3.42Å; G526-I529 PolarHBondContact O-N 2.97Å; Q527-I529 PolarHBondContact O-N 3.26Å; I529-Q532 PolarHBondContact O-N 3.49Å; I529-L533 PolarHBondContact O-N 3.28Å
530	L	96.6	Very high	94.2	Very high	13 Å²	13	51.7 Å²	51.7	7%	0.068	26%	0.255	C	S	.	.	H	α-helix	trans	-65	-45.1	177.1	-169.6	61.9	0	0	0	111.6	M515 E516 A519 G526 Q527 Q532 L533 E534	M515-L530 HydrophobicContact CB-CD1 4.28Å; E516-L530 HydrophobicContact CB-CD1 4.23Å; E516-L530 HydrophobicContact CB-CD2 4.46Å; A519-L530 HydrophobicContact CB-CB 4.47Å; A519-L530 HydrophobicContact CB-CD2 4.27Å; G526-L530 PolarHBondContact O-N 3.47Å; G526-L530 VanDerWaalsContact O-N 3.14Å; Q527-L530 PolarHBondContact O-N 3.11Å; Q527-L530 VanDerWaalsContact O-N 3.14Å; L530-Q532 VanDerWaalsContact C-N 3.29Å; L530-Q532 PolarHBondContact O-N 3.03Å; L530-L533 HydrophobicContact CD1-CD2 4.26Å; L530-L533 WeakPolarHBondContact O-CB 3.43Å; L530-L533 PolarHBondContact O-N 2.99Å; L530-L533 VanDerWaalsContact O-N 3.1Å; L530-E534 WeakPolarHBondContact O-CG 3.48Å; L530-E534 PolarHBondContact O-N 3.2Å
531	D	97.3	Very high	94.4	Very high	62 Å²	62	49.7 Å²	49.7	33%	0.332	24%	0.243	S	C	.	.	H	α-helix	trans	-59.2	-40.3	176.4	-61.9	-12.1	0	0	0	111.4	Q527 Q535	Q527-D531 PolarHBondContact NE2-OD1 2.89Å; Q527-D531 PolarHBondContact O-N 2.93Å; D531-Q535 WeakPolarHBondContact O-CB 3.42Å; D531-Q535 VanDerWaalsContact O-CG 3.23Å; D531-Q535 WeakPolarHBondContact O-CG 2.96Å; D531-Q535 PolarHBondContact O-N 2.66Å; D531-Q535 PolarHBondContact O-NE2 3.48Å
532	Q	97.6	Very high	94.7	Very high	45 Å²	45	54.6 Å²	54.6	21%	0.21	27%	0.273	C	S	.	.	H	α-helix	trans	-67.7	-38	176.7	-178.9	61.3	86.4	0	0	112	S457 Q528 I529 L530 Q535 N536	S457-Q532 WeakPolarHBondContact O-CG 3.4Å; Q528-Q532 WeakPolarHBondContact O-CB 3.4Å; Q528-Q532 PolarHBondContact O-N 2.98Å; Q528-Q532 VanDerWaalsContact O-N 3.14Å; I529-Q532 PolarHBondContact O-N 3.49Å; L530-Q532 VanDerWaalsContact C-N 3.29Å; L530-Q532 PolarHBondContact O-N 3.03Å; Q532-Q535 PolarHBondContact O-N 3.48Å; Q532-N536 PolarHBondContact NE2-OD1 3.32Å; Q532-N536 VanDerWaalsContact NE2-OD1 3.13Å; Q532-N536 WeakPolarHBondContact O-CB 3.36Å; Q532-N536 VanDerWaalsContact O-CG 3.31Å; Q532-N536 PolarHBondContact O-N 3.08Å; Q532-N536 PolarHBondContact O-ND2 3.26Å
533	L	98.3	Very high	94.9	Very high	0 Å²	0	59.5 Å²	59.5	0%	0	29%	0.291	C	S	.	.	H	α-helix	trans	-61.7	-49.5	174.7	178	67.7	0	0	0	111.2	P456 I507 V511 H512 M515 I529 L530 Q535 N536 R537	P456-L533 HydrophobicContact CB-CD1 3.51Å; I507-L533 HydrophobicContact CD1-CD1 4.3Å; I507-L533 HydrophobicContact CG1-CD1 4.07Å; I507-L533 HydrophobicContact CG2-CD1 3.78Å; I507-L533 HydrophobicContact CG2-CD2 4.31Å; I507-L533 HydrophobicContact CG2-CG 3.94Å; V511-L533 HydrophobicContact CG1-CD1 3.83Å; V511-L533 HydrophobicContact CG1-CD2 4.09Å; H512-L533 HydrophobicContact CB-CD2 4.08Å; M515-L533 HydrophobicContact CB-CD2 3.83Å; M515-L533 HydrophobicContact CG-CD2 3.97Å; I529-L533 PolarHBondContact O-N 3.28Å; L530-L533 HydrophobicContact CD1-CD2 4.26Å; L530-L533 WeakPolarHBondContact O-CB 3.43Å; L530-L533 PolarHBondContact O-N 2.99Å; L530-L533 VanDerWaalsContact O-N 3.1Å; L533-Q535 VanDerWaalsContact C-N 3.34Å; L533-Q535 PolarHBondContact O-N 2.7Å; L533-N536 PolarHBondContact O-N 2.89Å; L533-R537 WeakPolarHBondContact O-CB 3.34Å; L533-R537 PolarHBondContact O-N 3.44Å
534	E	97.6	Very high	95.1	Very high	82 Å²	82	53 Å²	53	38%	0.383	27%	0.267	S	S	.	.	H	α-helix	trans	-60.8	-42.7	177.7	-71	176.8	-170.2	0	0	111.7	H512 L530 N536 R537 N538	H512-E534 IonicContact NE2-OE1 3.47Å; L530-E534 WeakPolarHBondContact O-CG 3.48Å; L530-E534 PolarHBondContact O-N 3.2Å; E534-N536 PolarHBondContact O-N 3.38Å; E534-R537 PolarHBondContact O-N 2.9Å; E534-N538 WeakPolarHBondContact O-CB 3.42Å; E534-N538 VanDerWaalsContact O-CG 3.32Å; E534-N538 PolarHBondContact O-N 3.29Å; E534-N538 PolarHBondContact O-ND2 2.98Å
535	Q	97.9	Very high	95	Very high	106 Å²	106	53 Å²	53	50%	0.495	27%	0.265	S	S	.	.	H	α-helix	trans	-59.9	-45.4	174.1	-75.4	172.2	42.9	0	0	111.8	D531 Q532 L533 N538 N539	D531-Q535 WeakPolarHBondContact O-CB 3.42Å; D531-Q535 VanDerWaalsContact O-CG 3.23Å; D531-Q535 WeakPolarHBondContact O-CG 2.96Å; D531-Q535 PolarHBondContact O-N 2.66Å; D531-Q535 PolarHBondContact O-NE2 3.48Å; Q532-Q535 PolarHBondContact O-N 3.48Å; L533-Q535 VanDerWaalsContact C-N 3.34Å; L533-Q535 PolarHBondContact O-N 2.7Å; Q535-N538 PolarHBondContact O-N 3.25Å; Q535-N539 PolarHBondContact O-N 3.09Å; Q535-N539 PolarHBondContact O-ND2 3.48Å
536	N	98.3	Very high	95	Very high	1 Å²	1	57.9 Å²	57.9	1%	0.005	29%	0.286	C	S	.	.	H	α-helix	trans	-66.5	-42.2	178.9	-76.1	-16.5	0	0	0	112	P456 K458 Y463 Q532 L533 E534 N538 N539 F540	P456-N536 WeakPolarHBondContact O-CB 3.35Å; P456-N536 PolarHBondContact O-ND2 3.42Å; K458-N536 PolarHBondContact O-ND2 3.41Å; Y463-N536 HydrophobicContact CD1-CB 3.89Å; Y463-N536 HydrophobicContact CE1-CB 4.11Å; Q532-N536 PolarHBondContact NE2-OD1 3.32Å; Q532-N536 VanDerWaalsContact NE2-OD1 3.13Å; Q532-N536 WeakPolarHBondContact O-CB 3.36Å; Q532-N536 VanDerWaalsContact O-CG 3.31Å; Q532-N536 PolarHBondContact O-N 3.08Å; Q532-N536 PolarHBondContact O-ND2 3.26Å; L533-N536 PolarHBondContact O-N 2.89Å; E534-N536 PolarHBondContact O-N 3.38Å; N536-N538 VanDerWaalsContact C-N 3.29Å; N536-N538 PolarHBondContact O-N 2.95Å; N536-N539 WeakPolarHBondContact O-CB 3.2Å; N536-N539 PolarHBondContact O-N 3.3Å; N536-N539 VanDerWaalsContact O-N 3.12Å; N536-F540 WeakPolarHBondContact O-CD2 3.49Å; N536-F540 PolarHBondContact O-N 2.99Å
537	R	97.5	Very high	94.6	Very high	13 Å²	13	65.2 Å²	65.2	5%	0.049	32%	0.317	C	S	.	.	H	α-helix	trans	-53.5	-48.6	172.4	-171.9	-91.2	-178.2	-150.3	-4.2	111	I507 D508 L533 E534 N539 F540 F541	I507-R537 HydrophobicContact CB-CB 4.42Å; I507-R537 HydrophobicContact CB-CG 4.14Å; I507-R537 HydrophobicContact CD1-CB 3.8Å; I507-R537 HydrophobicContact CD1-CG 4.24Å; I507-R537 HydrophobicContact CG2-CB 3.91Å; I507-R537 HydrophobicContact CG2-CG 3.81Å; D508-R537 IonicContact OD1-CZ 3.95Å; D508-R537 IonicContact OD1-NE 3.11Å; D508-R537 PolarHBondContact OD1-NE 3.31Å; D508-R537 IonicContact OD1-NH2 3.6Å; D508-R537 IonicContact OD2-CZ 3.6Å; D508-R537 IonicContact OD2-NE 2.7Å; D508-R537 IonicContact OD2-NH2 3.93Å; D508-R537 PolarHBondContact OD2-NH2 2.69Å; L533-R537 WeakPolarHBondContact O-CB 3.34Å; L533-R537 PolarHBondContact O-N 3.44Å; E534-R537 PolarHBondContact O-N 2.9Å; R537-N539 PolarHBondContact O-N 2.58Å; R537-F540 PolarHBondContact O-N 3.42Å; R537-F541 WeakPolarHBondContact O-CB 3.26Å; R537-F541 PolarHBondContact O-N 2.83Å
538	N	96.9	Very high	94.1	Very high	84 Å²	84	63.3 Å²	63.3	45%	0.449	31%	0.309	S	S	.	.	H	α-helix	trans	-64.3	-39.3	177.4	-72.5	-26.2	0	0	0	112.5	E534 Q535 N536 F540 F541 V542	E534-N538 WeakPolarHBondContact O-CB 3.42Å; E534-N538 VanDerWaalsContact O-CG 3.32Å; E534-N538 PolarHBondContact O-N 3.29Å; E534-N538 PolarHBondContact O-ND2 2.98Å; Q535-N538 PolarHBondContact O-N 3.25Å; N536-N538 VanDerWaalsContact C-N 3.29Å; N536-N538 PolarHBondContact O-N 2.95Å; N538-F540 VanDerWaalsContact C-N 3.29Å; N538-F540 PolarHBondContact O-N 3.5Å; N538-F541 PolarHBondContact O-N 2.95Å; N538-V542 WeakPolarHBondContact O-CG1 3.42Å; N538-V542 WeakPolarHBondContact O-CG2 3.5Å; N538-V542 PolarHBondContact O-N 3.39Å
539	N	96.6	Very high	93.5	Very high	61 Å²	61	58.4 Å²	58.4	33%	0.326	29%	0.286	S	S	.	.	H	α-helix	trans	-60.3	-36	175.2	-84.8	-75.5	0	0	0	113.1	L460 Q535 N536 R537 V542 R543	L460-N539 HydrophobicContact CD1-CB 4.11Å; L460-N539 HydrophobicContact CD2-CB 4Å; Q535-N539 PolarHBondContact O-N 3.09Å; Q535-N539 PolarHBondContact O-ND2 3.48Å; N536-N539 WeakPolarHBondContact O-CB 3.2Å; N536-N539 PolarHBondContact O-N 3.3Å; N536-N539 VanDerWaalsContact O-N 3.12Å; R537-N539 PolarHBondContact O-N 2.58Å; N539-V542 WeakPolarHBondContact O-CG2 3.45Å; N539-R543 WeakPolarHBondContact O-CD 2.96Å; N539-R543 VanDerWaalsContact O-CG 3.31Å; N539-R543 WeakPolarHBondContact O-CG 3.46Å; N539-R543 PolarHBondContact O-NE 2.88Å
540	F	95.6	Very high	92.8	Very high	0 Å²	0	65.3 Å²	65.3	0%	0	32%	0.318	C	S	.	.	H	α-helix	trans	-77.1	-40.2	173.2	-83.2	-83.7	0	0	0	112.2	L460 Y463 E464 V467 R499 E500 Q503 V504 N536 R537 N538 V542 R543	L460-F540 HydrophobicContact CD1-CE2 4.2Å; Y463-F540 HydrophobicContact CD1-CD2 4.35Å; Y463-F540 AromaticContact CD1-CE2 3.59Å; Y463-F540 HydrophobicContact CD1-CE2 3.59Å; Y463-F540 HydrophobicContact CD1-CZ 4.47Å; Y463-F540 AromaticContact CE1-CD2 3.74Å; Y463-F540 HydrophobicContact CE1-CD2 3.74Å; Y463-F540 AromaticContact CE1-CE2 3.24Å; Y463-F540 HydrophobicContact CE1-CE2 3.24Å; Y463-F540 HydrophobicContact CE1-CZ 4.14Å; Y463-F540 AromaticContact CZ-CE2 3.91Å; E464-F540 HydrophobicContact CG-CZ 4.29Å; V467-F540 HydrophobicContact CG2-CZ 4.1Å; R499-F540 VanDerWaalsContact NH1-CE1 3.28Å; E500-F540 HydrophobicContact CB-CD1 4.38Å; E500-F540 HydrophobicContact CG-CD1 4.18Å; Q503-F540 HydrophobicContact CB-CB 4.47Å; Q503-F540 HydrophobicContact CB-CD1 3.83Å; Q503-F540 HydrophobicContact CB-CD2 4.28Å; Q503-F540 HydrophobicContact CB-CE1 4.01Å; Q503-F540 HydrophobicContact CB-CG 3.94Å; Q503-F540 HydrophobicContact CB-CZ 4.36Å; Q503-F540 HydrophobicContact CG-CD1 4.05Å; Q503-F540 HydrophobicContact CG-CE1 3.71Å; Q503-F540 HydrophobicContact CG-CZ 4Å; V504-F540 HydrophobicContact CG2-CB 3.9Å; N536-F540 WeakPolarHBondContact O-CD2 3.49Å; N536-F540 PolarHBondContact O-N 2.99Å; R537-F540 PolarHBondContact O-N 3.42Å; N538-F540 VanDerWaalsContact C-N 3.29Å; N538-F540 PolarHBondContact O-N 3.5Å; F540-V542 PolarHBondContact O-N 3.43Å; F540-R543 WeakPolarHBondContact O-CB 3.23Å; F540-R543 PolarHBondContact O-N 3.03Å; F540-R543 VanDerWaalsContact O-N 3.12Å
541	F	94.5	Very high	91.9	Very high	26 Å²	26	69.6 Å²	69.6	11%	0.114	34%	0.337	C	S	.	.	H	α-helix	trans	-60.1	-43.2	179.6	179.7	-96.3	0	0	0	113.1	V504 R537 N538 R543 L544 Q549 F552 V554	V504-F541 HydrophobicContact CG1-CD2 4.39Å; V504-F541 HydrophobicContact CG2-CB 4.08Å; R537-F541 WeakPolarHBondContact O-CB 3.26Å; R537-F541 PolarHBondContact O-N 2.83Å; N538-F541 PolarHBondContact O-N 2.95Å; F541-R543 PolarHBondContact O-N 3.41Å; F541-R543 VanDerWaalsContact O-N 3.13Å; F541-L544 HydrophobicContact CD2-CD1 3.92Å; F541-L544 HydrophobicContact CE2-CD1 4.47Å; F541-L544 VanDerWaalsContact O-CB 3.32Å; F541-L544 WeakPolarHBondContact O-CB 3.44Å; F541-L544 PolarHBondContact O-N 3.39Å; F541-L544 VanDerWaalsContact O-N 3.1Å; F541-Q549 HydrophobicContact CD2-CG 4.46Å; F541-Q549 HydrophobicContact CE1-CG 4.19Å; F541-Q549 HydrophobicContact CE2-CB 4.02Å; F541-Q549 HydrophobicContact CE2-CG 3.9Å; F541-Q549 HydrophobicContact CZ-CB 3.82Å; F541-Q549 HydrophobicContact CZ-CG 3.75Å; F541-Q549 PolarHBondContact O-NE2 3.05Å; F541-F552 HydrophobicContact CD2-CB 4.49Å; F541-F552 HydrophobicContact CE2-CB 4.07Å; F541-V554 HydrophobicContact CZ-CG2 4.32Å
542	V	94.8	Very high	90.5	Very high	102 Å²	102	67.3 Å²	67.3	62%	0.618	33%	0.325	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.6	-11.6	178.7	-61.2	0	0	0	0	113.8	N538 N539 F540	N538-V542 WeakPolarHBondContact O-CG1 3.42Å; N538-V542 WeakPolarHBondContact O-CG2 3.5Å; N538-V542 PolarHBondContact O-N 3.39Å; N539-V542 WeakPolarHBondContact O-CG2 3.45Å; F540-V542 PolarHBondContact O-N 3.43Å
543	R	94.5	Very high	88.7	Confident	106 Å²	106	69.8 Å²	69.8	40%	0.4	35%	0.345	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94	-8.2	176.3	-60.3	173.1	-165.3	-168.2	4.8	113	E464 E500 N539 F540 F541	E464-R543 IonicContact OE1-CZ 3.86Å; E464-R543 IonicContact OE1-NH1 2.84Å; E464-R543 PolarHBondContact OE1-NH1 3.24Å; E464-R543 IonicContact OE1-NH2 2.77Å; E464-R543 PolarHBondContact OE1-NH2 3.06Å; E500-R543 HydrophobicContact CG-CB 3.66Å; N539-R543 WeakPolarHBondContact O-CD 2.96Å; N539-R543 VanDerWaalsContact O-CG 3.31Å; N539-R543 WeakPolarHBondContact O-CG 3.46Å; N539-R543 PolarHBondContact O-NE 2.88Å; F540-R543 WeakPolarHBondContact O-CB 3.23Å; F540-R543 PolarHBondContact O-N 3.03Å; F540-R543 VanDerWaalsContact O-N 3.12Å; F541-R543 PolarHBondContact O-N 3.41Å; F541-R543 VanDerWaalsContact O-N 3.13Å
544	L	91.3	Very high	86.7	Confident	15 Å²	15	74.8 Å²	74.8	8%	0.079	38%	0.375	C	S	.	.	S	Bend	trans	-68.4	155.7	174.8	-68.8	175.5	0	0	0	111.8	E500 K501 V504 F541 D548 Q549 F552	E500-L544 HydrophobicContact CB-CD2 3.54Å; E500-L544 HydrophobicContact CB-CG 4.22Å; K501-L544 HydrophobicContact CB-CD2 3.92Å; V504-L544 HydrophobicContact CG2-CD1 4.08Å; F541-L544 HydrophobicContact CD2-CD1 3.92Å; F541-L544 HydrophobicContact CE2-CD1 4.47Å; F541-L544 VanDerWaalsContact O-CB 3.32Å; F541-L544 WeakPolarHBondContact O-CB 3.44Å; F541-L544 PolarHBondContact O-N 3.39Å; F541-L544 VanDerWaalsContact O-N 3.1Å; L544-D548 HydrophobicContact CB-CB 4.15Å; L544-D548 HydrophobicContact CD2-CB 4.11Å; L544-Q549 HydrophobicContact CB-CG 3.7Å; L544-Q549 HydrophobicContact CD1-CG 4.36Å; L544-F552 HydrophobicContact CD1-CD2 3.92Å; L544-F552 HydrophobicContact CD1-CE2 3.96Å
545	T	88.3	Confident	84.5	Confident	79 Å²	79	76 Å²	76	49%	0.485	39%	0.388	S	S	.	.			trans	-68	152.9	167.4	72.9	0	0	0	0	110	K547 D548 Q549	T545-K547 PolarHBondContact O-N 2.99Å; T545-D548 PolarHBondContact O-N 2.91Å; T545-D548 PolarHBondContact OG1-N 3.28Å; T545-D548 PolarHBondContact OG1-OD2 2.79Å; T545-Q549 WeakPolarHBondContact O-CG 3.44Å; T545-Q549 PolarHBondContact O-N 3.38Å
546	E	85.5	Confident	81.5	Confident	163 Å²	163	80.5 Å²	80.5	76%	0.762	42%	0.423	S	S	*	.	H	α-helix	trans	-52.8	-40.4	177	-67	177.6	172.2	0	0	111.7	D548 Q549 E550	E546-D548 PolarHBondContact O-N 3.4Å; E546-Q549 PolarHBondContact O-N 3.45Å; E546-E550 PolarHBondContact O-N 2.88Å
547	K	83.3	Confident	80.6	Confident	158 Å²	158	84.5 Å²	84.5	69%	0.687	44%	0.444	S	S	*	.	H	α-helix	trans	-62	-41.5	176.1	-176.1	-175.1	173.6	-170	0	112.8	T545 Q549	T545-K547 PolarHBondContact O-N 2.99Å; K547-Q549 VanDerWaalsContact C-N 3.34Å
548	D	83.4	Confident	79.7	Confident	30 Å²	30	88.3 Å²	88.3	16%	0.16	47%	0.465	C	S	.	.	H	α-helix	trans	-73	-29.1	178.5	-70.1	-54.1	0	0	0	111.9	K501 L544 T545 E546 E550 E551 F552	K501-D548 IonicContact NZ-OD1 2.93Å; K501-D548 PolarHBondContact NZ-OD1 3.24Å; L544-D548 HydrophobicContact CB-CB 4.15Å; L544-D548 HydrophobicContact CD2-CB 4.11Å; T545-D548 PolarHBondContact O-N 2.91Å; T545-D548 PolarHBondContact OG1-N 3.28Å; T545-D548 PolarHBondContact OG1-OD2 2.79Å; E546-D548 PolarHBondContact O-N 3.4Å; D548-E550 VanDerWaalsContact C-N 3.31Å; D548-E550 PolarHBondContact O-N 3.16Å; D548-E551 PolarHBondContact O-N 3.3Å; D548-F552 VanDerWaalsContact O-CD2 3.32Å; D548-F552 WeakPolarHBondContact O-CD2 3.42Å
549	Q	82	Confident	78.8	Confident	58 Å²	58	88.5 Å²	88.5	27%	0.271	47%	0.466	S	S	.	.	H	α-helix	trans	-66	-33.6	176	-70.8	179.7	-12.5	0	0	112.2	F541 L544 T545 E546 K547 E551 F552	F541-Q549 HydrophobicContact CD2-CG 4.46Å; F541-Q549 HydrophobicContact CE1-CG 4.19Å; F541-Q549 HydrophobicContact CE2-CB 4.02Å; F541-Q549 HydrophobicContact CE2-CG 3.9Å; F541-Q549 HydrophobicContact CZ-CB 3.82Å; F541-Q549 HydrophobicContact CZ-CG 3.75Å; F541-Q549 PolarHBondContact O-NE2 3.05Å; L544-Q549 HydrophobicContact CB-CG 3.7Å; L544-Q549 HydrophobicContact CD1-CG 4.36Å; T545-Q549 WeakPolarHBondContact O-CG 3.44Å; T545-Q549 PolarHBondContact O-N 3.38Å; E546-Q549 PolarHBondContact O-N 3.45Å; K547-Q549 VanDerWaalsContact C-N 3.34Å; Q549-E551 PolarHBondContact O-N 3.48Å; Q549-F552 PolarHBondContact O-N 3.07Å; Q549-F552 VanDerWaalsContact O-N 3.11Å
550	E	81.3	Confident	77.7	Confident	168 Å²	168	90.1 Å²	90.1	79%	0.785	47%	0.474	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.4	-23.2	176.1	-69.1	177.9	178.7	0	0	113.2	E546 D548 F552	E546-E550 PolarHBondContact O-N 2.88Å; D548-E550 VanDerWaalsContact C-N 3.31Å; D548-E550 PolarHBondContact O-N 3.16Å; E550-F552 VanDerWaalsContact C-N 3.34Å
551	E	76.9	Confident	76.6	Confident	102 Å²	102	95.8 Å²	95.8	48%	0.477	50%	0.504	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.9	-18	178.2	-62.6	-176.2	-156	0	0	113.2	K501 D548 Q549	K501-E551 WeakPolarHBondContact CE-OE2 3.46Å; K501-E551 IonicContact NZ-OE1 2.89Å; K501-E551 PolarHBondContact NZ-OE1 3.02Å; K501-E551 IonicContact NZ-OE2 2.66Å; K501-E551 PolarHBondContact NZ-OE2 3.08Å; D548-E551 PolarHBondContact O-N 3.3Å; Q549-E551 PolarHBondContact O-N 3.48Å
552	F	69.4	Low	75.4	Confident	14 Å²	14	100.4 Å²	100.4	6%	0.061	53%	0.53	C	S	.	.	S	Bend	trans	-109.9	110.7	177.8	-61.8	-81.8	0	0	0	109.6	K501 V504 F541 L544 D548 Q549 E550 V554	K501-F552 HydrophobicContact CG-CE2 3.85Å; K501-F552 HydrophobicContact CG-CZ 3.82Å; V504-F552 HydrophobicContact CB-CE1 4.29Å; V504-F552 HydrophobicContact CB-CE2 4.47Å; V504-F552 HydrophobicContact CB-CZ 4.23Å; V504-F552 HydrophobicContact CG1-CB 4.49Å; V504-F552 HydrophobicContact CG1-CD1 3.66Å; V504-F552 HydrophobicContact CG1-CD2 4.15Å; V504-F552 HydrophobicContact CG1-CE1 3.83Å; V504-F552 HydrophobicContact CG1-CE2 4.29Å; V504-F552 HydrophobicContact CG1-CG 3.84Å; V504-F552 HydrophobicContact CG1-CZ 4.14Å; F541-F552 HydrophobicContact CD2-CB 4.49Å; F541-F552 HydrophobicContact CE2-CB 4.07Å; L544-F552 HydrophobicContact CD1-CD2 3.92Å; L544-F552 HydrophobicContact CD1-CE2 3.96Å; D548-F552 VanDerWaalsContact O-CD2 3.32Å; D548-F552 WeakPolarHBondContact O-CD2 3.42Å; Q549-F552 PolarHBondContact O-N 3.07Å; Q549-F552 VanDerWaalsContact O-N 3.11Å; E550-F552 VanDerWaalsContact C-N 3.34Å; F552-V554 PolarHBondContact O-N 2.86Å
553	P	59.8	Low	74	Confident	97 Å²	97	100.3 Å²	100.3	63%	0.63	52%	0.523	S	S	*	.			trans	-58.6	130.5	173.9	24.6	-31.1	0	0	0	108.8	T555	P553-T555 PolarHBondContact O-N 3.22Å
554	V	55.9	Low	72.5	Confident	106 Å²	106	99.8 Å²	99.8	64%	0.642	53%	0.533	S	S	*	.			trans	-63	105.1	171.4	-178.4	0	0	0	0	106.7	F541 F552 T556	F541-V554 HydrophobicContact CZ-CG2 4.32Å; F552-V554 PolarHBondContact O-N 2.86Å; V554-T556 PolarHBondContact O-N 3.18Å; V554-T556 VanDerWaalsContact O-N 3.09Å
555	T	51.5	Low	70.9	Confident	106 Å²	106	106.9 Å²	106.9	65%	0.65	57%	0.571	S	S	*	*			trans	-65.1	105.8	170	40.9	0	0	0	0	107.6	P553	P553-T555 PolarHBondContact O-N 3.22Å
556	T	33.4	Very low	69.3	Low	202 Å²	202	109.5 Å²	109.5	100%	1.239	58%	0.579	S	S	*	*			trans	-77.5	0	170.5	47.6	0	0	0	0	111.9	V554	V554-T556 PolarHBondContact O-N 3.18Å; V554-T556 VanDerWaalsContact O-N 3.09Å

Retrieved 556 of 556 residues in 687.2 ms (Link to these results)

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