A0A060YWI4_ONCMY Loading...

BTB domain-containing protein

AlphaFold DB , UniProt , Accession A0A060YWI4, Species ONCMY (Oncorhynchus mykiss, Rainbow trout), Gene LOC118942847, Length 494 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	35.5	Very low	32.6	Very low	237 Å²	237	147.2 Å²	147.2	100%	1.167	85%	0.845	S	S	*	*				0	119.4	0	-162.2	166.8	-174.2	0	0	106.8
2	T	34.9	Very low	32.8	Very low	133 Å²	133	145.8 Å²	145.8	82%	0.816	84%	0.841	S	S	*	*			trans	64.3	93.2	168.8	28.5	0	0	0	0	119.9
3	V	32.5	Very low	32.7	Very low	132 Å²	132	143.7 Å²	143.7	80%	0.8	84%	0.841	S	S	*	*			trans	-70.4	142.3	142.5	177.4	0	0	0	0	108.9
4	V	33.1	Very low	32.6	Very low	141 Å²	141	142.1 Å²	142.1	86%	0.855	83%	0.834	S	S	*	*			trans	-146.7	123	144.8	178.9	0	0	0	0	109.5
5	A	33.9	Very low	32.5	Very low	85 Å²	85	143.5 Å²	143.5	70%	0.702	84%	0.835	S	S	*	*			trans	-88.7	163.6	169.9	0	0	0	0	0	110.8
6	G	29.1	Very low	33.2	Very low	81 Å²	81	141.9 Å²	141.9	84%	0.835	83%	0.831	S	S	*	*			trans	-145	113.8	170.9	0	0	0	0	0	110.4
7	D	33.1	Very low	32.9	Very low	140 Å²	140	138.1 Å²	138.1	75%	0.749	83%	0.829	S	S	*	*			trans	-77	160.2	-166.8	-84.5	-33.6	0	0	0	117.3
8	N	30.6	Very low	32.9	Very low	138 Å²	138	139.3 Å²	139.3	74%	0.738	82%	0.824	S	S	*	*			trans	63.6	129.5	138	-67.4	-16.7	0	0	0	121.3
9	M	30.1	Very low	32.8	Very low	182 Å²	182	140.8 Å²	140.8	90%	0.897	83%	0.827	S	S	*	*				175.2	140.1	78.4	-125.5	156.5	106.4	0	0	111.4
10	D	34.9	Very low	33.2	Very low	156 Å²	156	141.2 Å²	141.2	83%	0.834	82%	0.82	S	S	*	*			trans	-70.3	144	169.1	-78	-47.2	0	0	0	111.9
11	E	31.3	Very low	33.1	Very low	194 Å²	194	141 Å²	141	91%	0.907	82%	0.816	S	S	*	*			trans	-147.3	122.2	150.3	-136.9	177.9	-179.2	0	0	111.6
12	T	35	Very low	33.2	Very low	130 Å²	130	135.9 Å²	135.9	80%	0.798	80%	0.798	S	S	*	*			trans	-84.7	135.1	178.5	-31.9	0	0	0	0	109.7
13	S	30.6	Very low	33.1	Very low	119 Å²	119	138.7 Å²	138.7	83%	0.832	80%	0.795	S	S	*	*			trans	-151.1	139.2	159.9	36.5	0	0	0	0	112.2
14	T	31.6	Very low	33.5	Very low	121 Å²	121	137 Å²	137	74%	0.742	79%	0.787	S	S	*	*			trans	-101.2	131.7	-161.9	43.9	0	0	0	0	113.5
15	L	30.9	Very low	33.9	Very low	163 Å²	163	135.2 Å²	135.2	85%	0.853	78%	0.778	S	S	*	*			trans	56.8	163.6	147.3	-83	141.2	0	0	0	120.3
16	P	43.7	Very low	34.2	Very low	119 Å²	119	136.5 Å²	136.5	77%	0.773	77%	0.774	S	S	*	*			cis	-137.6	174.8	-8	35.6	-15.3	0	0	0	116.1
17	G	28	Very low	35	Very low	77 Å²	77	140.2 Å²	140.2	79%	0.794	77%	0.769	S	S	*	*			trans	125.5	97.1	144.4	0	0	0	0	0	119
18	H	33.6	Very low	35.5	Very low	160 Å²	160	141.9 Å²	141.9	74%	0.741	77%	0.772	S	S	*	*			trans	6.6	130.3	152.1	-120.5	-37.5	0	0	0	121.2
19	L	30	Very low	36	Very low	168 Å²	168	140.6 Å²	140.6	88%	0.88	77%	0.765	S	S	*	*				-152	136.7	121.3	-109.2	154.1	0	0	0	109.4
20	Q	41.6	Very low	36.8	Very low	147 Å²	147	139.4 Å²	139.4	69%	0.687	76%	0.757	S	S	*	*			trans	-95.2	98.4	-167.2	-171.8	158	5.1	0	0	108.6
21	D	31	Very low	37.6	Very low	137 Å²	137	139.5 Å²	139.5	73%	0.733	75%	0.753	S	S	*	*			trans	-91.3	109.1	169.7	-78.4	-29.6	0	0	0	109.4	Y23	D21-Y23 PolarHBondContact O-N 3.19Å
22	T	38.2	Very low	38.5	Very low	131 Å²	131	133.5 Å²	133.5	80%	0.804	73%	0.731	S	S	*	*			trans	-66.2	102.7	170.4	-53.5	0	0	0	0	108.5
23	Y	32.4	Very low	40.1	Very low	192 Å²	192	131.1 Å²	131.1	75%	0.753	72%	0.719	S	S	*	*	P	Polyproline II helix	trans	-75.3	136.6	164	-79.5	-93.6	0	0	0	109.4	D21	D21-Y23 PolarHBondContact O-N 3.19Å
24	P	40.3	Very low	42.9	Very low	97 Å²	97	130.7 Å²	130.7	63%	0.63	70%	0.704	S	S	*	*	P	Polyproline II helix	trans	-65.7	156	167.2	30.8	-31.5	0	0	0	109.1	D26	P24-D26 PolarHBondContact O-N 3.21Å
25	P	42.3	Very low	45.8	Very low	102 Å²	102	132.8 Å²	132.8	66%	0.662	70%	0.698	S	S	*	*	P	Polyproline II helix	trans	-69.4	120.6	-177.5	28.6	-31.1	0	0	0	109.7	H27	P25-H27 VanDerWaalsContact C-N 3.29Å; P25-H27 PolarHBondContact O-N 2.88Å
26	D	40.8	Very low	48.9	Very low	113 Å²	113	125.6 Å²	125.6	60%	0.604	66%	0.661	S	S	*	*			trans	-62.2	88.6	167.4	-69.7	-38.8	0	0	0	109.2	P24	P24-D26 PolarHBondContact O-N 3.21Å
27	H	45	Very low	51.5	Low	158 Å²	158	121.5 Å²	121.5	73%	0.731	63%	0.633	S	S	*	*			trans	-89.6	-7.7	174.8	-96.5	-65.3	0	0	0	113.3	P25	P25-H27 VanDerWaalsContact C-N 3.29Å; P25-H27 PolarHBondContact O-N 2.88Å
28	E	43.3	Very low	54.9	Low	176 Å²	176	117.9 Å²	117.9	82%	0.822	60%	0.596	S	S	*	*	S	Bend	trans	-96.1	-18.2	-176.7	-68.2	-169.8	163.6	0	0	114.3
29	D	42.3	Very low	57.9	Low	110 Å²	110	110.4 Å²	110.4	59%	0.588	56%	0.562	S	S	*	*	S	Bend	trans	-85.9	-12.2	-176.1	-77	-24.4	0	0	0	114.5
30	H	46.7	Very low	61.2	Low	158 Å²	158	102.4 Å²	102.4	73%	0.731	52%	0.52	S	S	*	.	S	Bend	trans	-79.7	-23	-176.8	-88.3	-56.7	0	0	0	114.8	C32	H30-C32 VanDerWaalsContact C-N 3.29Å; H30-C32 PolarHBondContact O-N 3.3Å
31	E	50.8	Low	63.8	Low	158 Å²	158	97 Å²	97	74%	0.738	50%	0.498	S	S	*	.	G	3₁₀ helix	trans	-72.3	-22.4	174.4	-85.1	-173.2	156	0	0	112.7	C33	E31-C33 PolarHBondContact O-N 2.59Å; E31-C33 VanDerWaalsContact O-N 3.16Å
32	C	51.2	Low	66.9	Low	68 Å²	68	93 Å²	93	46%	0.459	49%	0.49	S	S	.	.	G	3₁₀ helix	trans	-70.9	-10.6	-175.5	-76.6	0	0	0	0	114.8	H30 K50	H30-C32 VanDerWaalsContact C-N 3.29Å; H30-C32 PolarHBondContact O-N 3.3Å; C32-K50 WeakPolarHBondContact O-CD 3.33Å; C32-K50 WeakPolarHBondContact O-CE 3.39Å; C32-K50 PolarHBondContact O-NZ 2.83Å
33	C	67.9	Low	69.7	Low	80 Å²	80	89.9 Å²	89.9	54%	0.541	47%	0.467	S	S	.	.	G	3₁₀ helix	trans	-132	7.9	-171.4	-70.9	0	0	0	0	114.8	E31 R35	E31-C33 PolarHBondContact O-N 2.59Å; E31-C33 VanDerWaalsContact O-N 3.16Å; C33-R35 PolarHBondContact O-N 3.34Å
34	E	88.8	Confident	72.8	Confident	109 Å²	109	87.2 Å²	87.2	51%	0.509	46%	0.456	S	S	.	.			trans	-61.3	127.9	178.4	-167.9	177.7	179.8	0	0	110.7	Q48 L49	E34-Q48 CarbonylContact O-C 3.57Å; E34-Q48 WeakPolarHBondContact O-CA 3.4Å; E34-L49 HydrophobicContact CB-CB 4.22Å; E34-L49 HydrophobicContact CB-CD2 4.44Å; E34-L49 PolarHBondContact O-N 2.82Å; E34-L49 WeakPolarHBondContact OE2-CD2 3.47Å
35	R	93.7	Very high	75.5	Confident	165 Å²	165	84 Å²	84	62%	0.623	43%	0.432	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-94.5	139.2	179.7	-73.2	171.4	70.1	169.7	7.6	110.1	C33 E46 T47	C33-R35 PolarHBondContact O-N 3.34Å; R35-E46 IonicContact CZ-OE2 3.22Å; R35-E46 IonicContact NE-OE2 3.34Å; R35-E46 PolarHBondContact NE-OE2 2.94Å; R35-E46 IonicContact NH2-OE2 2.59Å; R35-E46 PolarHBondContact NH2-OE2 3.1Å; R35-T47 CarbonylContact C-O 3.56Å; R35-T47 VanDerWaalsContact CA-O 3.31Å; R35-T47 WeakPolarHBondContact CA-O 3.31Å
36	V	95.7	Very high	78.1	Confident	12 Å²	12	83.5 Å²	83.5	7%	0.073	42%	0.421	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	129.4	176.4	-179.2	0	0	0	0	108.7	I38 E46 T47 L49 L52 Y77	V36-I38 HydrophobicContact CG1-CG1 4.09Å; V36-E46 WeakPolarHBondContact O-CA 3.42Å; V36-T47 PolarHBondContact N-O 2.79Å; V36-T47 PolarHBondContact O-N 3.08Å; V36-T47 VanDerWaalsContact O-N 3.08Å; V36-L49 HydrophobicContact CG2-CB 3.97Å; V36-L49 HydrophobicContact CG2-CD1 3.85Å; V36-L52 HydrophobicContact CB-CD1 4.3Å; V36-L52 HydrophobicContact CG1-CD1 4.15Å; V36-L52 HydrophobicContact CG2-CD1 4.38Å; V36-Y77 HydrophobicContact CG1-CD2 3.54Å; V36-Y77 HydrophobicContact CG1-CE2 3.56Å
37	V	98	Very high	80.8	Confident	33 Å²	33	78.8 Å²	78.8	20%	0.2	40%	0.396	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	128	173.2	-174.5	0	0	0	0	108.8	F45 E46 E76 Y77	V37-F45 WeakPolarHBondContact CA-O 3.4Å; V37-E46 HydrophobicContact CG1-CG 4.43Å; V37-E46 HydrophobicContact CG2-CG 4.17Å; V37-E76 HydrophobicContact CB-CB 3.86Å; V37-E76 HydrophobicContact CG1-CB 3.77Å; V37-E76 WeakPolarHBondContact O-CA 3.41Å; V37-Y77 PolarHBondContact O-N 3.38Å
38	I	98.4	Very high	83.3	Confident	1 Å²	1	74.7 Å²	74.7	1%	0.005	38%	0.378	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	120.8	177.1	-52.3	173.4	0	0	0	108	V36 I40 F45 L52 L60 Y77 F79 F86	V36-I38 HydrophobicContact CG1-CG1 4.09Å; I38-I40 HydrophobicContact CG2-CD1 3.69Å; I38-I40 HydrophobicContact CG2-CG1 4.42Å; I38-F45 PolarHBondContact N-O 3.16Å; I38-F45 PolarHBondContact O-N 3.48Å; I38-L52 HydrophobicContact CD1-CD1 4.26Å; I38-L60 HydrophobicContact CD1-CD1 4.18Å; I38-L60 HydrophobicContact CD1-CD2 4.26Å; I38-Y77 CarbonylContact C-O 3.56Å; I38-Y77 WeakPolarHBondContact CA-O 3.47Å; I38-F79 HydrophobicContact CG2-CD2 3.78Å; I38-F79 HydrophobicContact CG2-CE2 3.82Å; I38-F86 HydrophobicContact CB-CE1 4.21Å; I38-F86 HydrophobicContact CB-CZ 4.11Å; I38-F86 HydrophobicContact CD1-CE1 4.35Å; I38-F86 HydrophobicContact CD1-CZ 3.8Å; I38-F86 HydrophobicContact CG2-CE1 3.97Å; I38-F86 HydrophobicContact CG2-CE2 4.26Å; I38-F86 HydrophobicContact CG2-CZ 3.56Å
39	N	98.3	Very high	85.7	Confident	4 Å²	4	68 Å²	68	2%	0.021	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	114.9	-178.6	-178.8	-4.4	0	0	0	110.1	G42 L43 R44 E76 Y77 F78 F79	N39-G42 VanDerWaalsContact OD1-C 3.28Å; N39-G42 WeakPolarHBondContact OD1-CA 3.38Å; N39-G42 PolarHBondContact OD1-N 3.4Å; N39-L43 WeakPolarHBondContact CA-O 3.28Å; N39-L43 PolarHBondContact OD1-N 2.9Å; N39-R44 HydrophobicContact CB-CG 4.38Å; N39-E76 HydrophobicContact CB-CG 4.24Å; N39-E76 PolarHBondContact ND2-OE1 2.99Å; N39-Y77 PolarHBondContact N-O 3.42Å; N39-F78 HydrophobicContact CB-CD2 4.12Å; N39-F78 WeakPolarHBondContact O-CA 3.34Å; N39-F79 PolarHBondContact O-N 2.9Å
40	I	98.3	Very high	88.2	Confident	0 Å²	0	67.8 Å²	67.8	0%	0	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	101.5	178.8	-48.4	-59.1	0	0	0	108.8	I38 G42 L43 F45 F79 R83 F86	I38-I40 HydrophobicContact CG2-CD1 3.69Å; I38-I40 HydrophobicContact CG2-CG1 4.42Å; I40-G42 PolarHBondContact O-N 3.33Å; I40-L43 PolarHBondContact N-O 3.06Å; I40-L43 WeakPolarHBondContact O-CB 3.4Å; I40-L43 PolarHBondContact O-N 2.77Å; I40-F45 HydrophobicContact CB-CE2 4.2Å; I40-F45 HydrophobicContact CG1-CD2 3.86Å; I40-F45 HydrophobicContact CG1-CE2 3.86Å; I40-F79 CarbonylContact C-O 3.55Å; I40-F79 WeakPolarHBondContact CA-O 3.24Å; I40-F79 HydrophobicContact CD1-CB 3.75Å; I40-F79 HydrophobicContact CD1-CD2 3.77Å; I40-F79 HydrophobicContact CD1-CG 4.09Å; I40-R83 HydrophobicContact CG2-CG 4.27Å; I40-R83 WeakPolarHBondContact O-CG 3.48Å; I40-F86 HydrophobicContact CB-CB 4.49Å; I40-F86 HydrophobicContact CD1-CB 4.42Å; I40-F86 HydrophobicContact CD1-CD1 4.07Å; I40-F86 HydrophobicContact CD1-CD2 3.57Å; I40-F86 HydrophobicContact CD1-CE1 4.18Å; I40-F86 HydrophobicContact CD1-CE2 3.7Å; I40-F86 HydrophobicContact CD1-CG 3.76Å; I40-F86 HydrophobicContact CD1-CZ 4.02Å; I40-F86 HydrophobicContact CG1-CB 3.8Å; I40-F86 HydrophobicContact CG1-CD1 3.57Å; I40-F86 HydrophobicContact CG1-CD2 3.83Å; I40-F86 HydrophobicContact CG1-CE1 4.04Å; I40-F86 HydrophobicContact CG1-CE2 4.28Å; I40-F86 HydrophobicContact CG1-CG 3.44Å; I40-F86 VanDerWaalsContact CG1-CG 3.44Å; I40-F86 HydrophobicContact CG1-CZ 4.39Å; I40-F86 HydrophobicContact CG2-CB 4.33Å
41	S	96.9	Very high	90.6	Very high	34 Å²	34	61.3 Å²	61.3	24%	0.238	31%	0.312	C	S	.	.	T	Hydrogen-bonded Turn	trans	42	44	-177.7	-56.9	0	0	0	0	113.5	F79 D80 R81	S41-F79 PolarHBondContact N-O 3.44Å; S41-D80 WeakPolarHBondContact OG-CA 3.21Å; S41-D80 PolarHBondContact OG-OD1 2.97Å; S41-R81 PolarHBondContact OG-N 3.46Å; S41-R81 PolarHBondContact OG-O 2.98Å
42	G	94.9	Very high	92.8	Very high	53 Å²	53	53.8 Å²	53.8	55%	0.546	28%	0.278	S	S	.	.	T	Hydrogen-bonded Turn	trans	96.5	-13.1	178.8	0	0	0	0	0	115.4	N39 I40	N39-G42 VanDerWaalsContact OD1-C 3.28Å; N39-G42 WeakPolarHBondContact OD1-CA 3.38Å; N39-G42 PolarHBondContact OD1-N 3.4Å; I40-G42 PolarHBondContact O-N 3.33Å
43	L	97.2	Very high	94.8	Very high	65 Å²	65	53.2 Å²	53.2	34%	0.34	27%	0.274	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.9	117.4	173	-172.7	58.4	0	0	0	110.2	N39 I40 F45 R83	N39-L43 WeakPolarHBondContact CA-O 3.28Å; N39-L43 PolarHBondContact OD1-N 2.9Å; I40-L43 PolarHBondContact N-O 3.06Å; I40-L43 WeakPolarHBondContact O-CB 3.4Å; I40-L43 PolarHBondContact O-N 2.77Å; L43-F45 HydrophobicContact CB-CE2 4.07Å; L43-F45 HydrophobicContact CD2-CE2 3.57Å; L43-F45 HydrophobicContact CD2-CZ 3.51Å; L43-F45 HydrophobicContact CG-CD2 4.29Å; L43-F45 HydrophobicContact CG-CE2 3.55Å; L43-F45 HydrophobicContact CG-CZ 3.92Å; L43-F45 WeakPolarHBondContact O-CD2 3.43Å; L43-R83 HydrophobicContact CD2-CB 4.36Å
44	R	97.5	Very high	96.2	Very high	135 Å²	135	54.4 Å²	54.4	51%	0.509	27%	0.272	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.6	131.9	-179.5	-71.4	-177.2	170.8	152.3	-5.4	111.7	N39 E76	N39-R44 HydrophobicContact CB-CG 4.38Å; R44-E76 IonicContact CZ-OE2 3.27Å; R44-E76 IonicContact NE-OE2 3.08Å; R44-E76 PolarHBondContact NE-OE2 3.42Å; R44-E76 IonicContact NH2-OE2 2.67Å; R44-E76 PolarHBondContact NH2-OE2 2.7Å; R44-E76 VanDerWaalsContact NH2-OE2 3.1Å
45	F	97.9	Very high	96.6	Very high	29 Å²	29	51.1 Å²	51.1	13%	0.127	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	149.5	171.9	-66.1	-95.1	0	0	0	109	V37 I38 I40 L43 F86 D87 L90	V37-F45 WeakPolarHBondContact CA-O 3.4Å; I38-F45 PolarHBondContact N-O 3.16Å; I38-F45 PolarHBondContact O-N 3.48Å; I40-F45 HydrophobicContact CB-CE2 4.2Å; I40-F45 HydrophobicContact CG1-CD2 3.86Å; I40-F45 HydrophobicContact CG1-CE2 3.86Å; L43-F45 HydrophobicContact CB-CE2 4.07Å; L43-F45 HydrophobicContact CD2-CE2 3.57Å; L43-F45 HydrophobicContact CD2-CZ 3.51Å; L43-F45 HydrophobicContact CG-CD2 4.29Å; L43-F45 HydrophobicContact CG-CE2 3.55Å; L43-F45 HydrophobicContact CG-CZ 3.92Å; L43-F45 WeakPolarHBondContact O-CD2 3.43Å; F45-F86 HydrophobicContact CB-CD1 4.21Å; F45-F86 HydrophobicContact CB-CE1 3.85Å; F45-F86 AromaticContact CD1-CD1 3.87Å; F45-F86 HydrophobicContact CD1-CD1 3.87Å; F45-F86 HydrophobicContact CD1-CE1 4.26Å; F45-F86 AromaticContact CD2-CD1 3.4Å; F45-F86 HydrophobicContact CD2-CD1 3.4Å; F45-F86 AromaticContact CD2-CE1 3.84Å; F45-F86 HydrophobicContact CD2-CE1 3.84Å; F45-F86 HydrophobicContact CD2-CG 4.42Å; F45-F86 HydrophobicContact CE1-CD1 4.01Å; F45-F86 HydrophobicContact CE2-CB 4.14Å; F45-F86 AromaticContact CE2-CD1 3.55Å; F45-F86 HydrophobicContact CE2-CD1 3.55Å; F45-F86 HydrophobicContact CE2-CE1 4.43Å; F45-F86 HydrophobicContact CE2-CG 4.24Å; F45-F86 AromaticContact CG-CD1 3.56Å; F45-F86 HydrophobicContact CG-CD1 3.56Å; F45-F86 AromaticContact CG-CE1 3.73Å; F45-F86 HydrophobicContact CG-CE1 3.73Å; F45-F86 HydrophobicContact CZ-CB 4.17Å; F45-F86 AromaticContact CZ-CD1 3.85Å; F45-F86 HydrophobicContact CZ-CD1 3.85Å; F45-D87 HydrophobicContact CE1-CB 4.41Å; F45-L90 HydrophobicContact CB-CD2 3.92Å; F45-L90 HydrophobicContact CD1-CD2 3.83Å; F45-L90 HydrophobicContact CG-CD2 4.27Å
46	E	97.1	Very high	96.7	Very high	93 Å²	93	46.7 Å²	46.7	44%	0.435	25%	0.249	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.5	139.3	179.6	-61.3	-170.2	-141.3	0	0	110	R35 V36 V37	R35-E46 IonicContact CZ-OE2 3.22Å; R35-E46 IonicContact NE-OE2 3.34Å; R35-E46 PolarHBondContact NE-OE2 2.94Å; R35-E46 IonicContact NH2-OE2 2.59Å; R35-E46 PolarHBondContact NH2-OE2 3.1Å; V36-E46 WeakPolarHBondContact O-CA 3.42Å; V37-E46 HydrophobicContact CG1-CG 4.43Å; V37-E46 HydrophobicContact CG2-CG 4.17Å
47	T	96.9	Very high	96.7	Very high	13 Å²	13	53 Å²	53	8%	0.08	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150	177.2	177.2	-166.7	0	0	0	0	110.3	R35 V36 T51 L52 L90	R35-T47 CarbonylContact C-O 3.56Å; R35-T47 VanDerWaalsContact CA-O 3.31Å; R35-T47 WeakPolarHBondContact CA-O 3.31Å; V36-T47 PolarHBondContact N-O 2.79Å; V36-T47 PolarHBondContact O-N 3.08Å; V36-T47 VanDerWaalsContact O-N 3.08Å; T47-T51 WeakPolarHBondContact OG1-CB 3.47Å; T47-L52 HydrophobicContact CG2-CD1 4.09Å; T47-L52 HydrophobicContact CG2-CD2 3.94Å; T47-L52 HydrophobicContact CG2-CG 3.85Å; T47-L90 HydrophobicContact CG2-CD1 3.94Å
48	Q	96.6	Very high	96.7	Very high	73 Å²	73	51.7 Å²	51.7	34%	0.341	27%	0.269	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.3	145	173.8	-63.2	174.1	-36.8	0	0	109.8	E34 K50 T51	E34-Q48 CarbonylContact O-C 3.57Å; E34-Q48 WeakPolarHBondContact O-CA 3.4Å; Q48-K50 HydrophobicContact CB-CG 3.93Å; Q48-K50 PolarHBondContact O-N 2.76Å; Q48-T51 VanDerWaalsContact O-CB 3.24Å; Q48-T51 WeakPolarHBondContact O-CB 3.47Å; Q48-T51 PolarHBondContact O-N 2.86Å; Q48-T51 PolarHBondContact O-OG1 2.78Å
49	L	94.9	Very high	96.7	Very high	35 Å²	35	51.8 Å²	51.8	18%	0.183	27%	0.27	C	S	.	.	H	α-helix	trans	-56.4	-41	178.1	-178.1	60.8	0	0	0	111.2	E34 V36 T51 L52 S53	E34-L49 HydrophobicContact CB-CB 4.22Å; E34-L49 HydrophobicContact CB-CD2 4.44Å; E34-L49 PolarHBondContact O-N 2.82Å; E34-L49 WeakPolarHBondContact OE2-CD2 3.47Å; V36-L49 HydrophobicContact CG2-CB 3.97Å; V36-L49 HydrophobicContact CG2-CD1 3.85Å; L49-T51 PolarHBondContact O-N 3.5Å; L49-L52 PolarHBondContact O-N 2.82Å; L49-L52 VanDerWaalsContact O-N 3.11Å; L49-S53 PolarHBondContact O-N 2.89Å; L49-S53 PolarHBondContact O-OG 2.83Å; L49-S53 VanDerWaalsContact O-OG 3.09Å
50	K	94.8	Very high	96.7	Very high	105 Å²	105	51.7 Å²	51.7	46%	0.457	27%	0.269	S	S	.	.	H	α-helix	trans	-58	-32.4	175.4	67.5	179.5	172.6	-160.8	0	114.1	C32 Q48 L52 S53 Q54	C32-K50 WeakPolarHBondContact O-CD 3.33Å; C32-K50 WeakPolarHBondContact O-CE 3.39Å; C32-K50 PolarHBondContact O-NZ 2.83Å; Q48-K50 HydrophobicContact CB-CG 3.93Å; Q48-K50 PolarHBondContact O-N 2.76Å; K50-L52 VanDerWaalsContact C-N 3.34Å; K50-S53 PolarHBondContact O-N 2.75Å; K50-Q54 PolarHBondContact O-N 2.82Å
51	T	96.3	Very high	96.6	Very high	22 Å²	22	51.8 Å²	51.8	14%	0.135	27%	0.271	C	S	.	.	H	α-helix	trans	-66	-41	178.2	-53.2	0	0	0	0	110.4	T47 Q48 L49 Q54 Q94	T47-T51 WeakPolarHBondContact OG1-CB 3.47Å; Q48-T51 VanDerWaalsContact O-CB 3.24Å; Q48-T51 WeakPolarHBondContact O-CB 3.47Å; Q48-T51 PolarHBondContact O-N 2.86Å; Q48-T51 PolarHBondContact O-OG1 2.78Å; L49-T51 PolarHBondContact O-N 3.5Å; T51-Q54 WeakPolarHBondContact O-CB 3.06Å; T51-Q94 HydrophobicContact CG2-CG 4.02Å
52	L	96.6	Very high	96.6	Very high	1 Å²	1	51.7 Å²	51.7	1%	0.005	27%	0.267	C	S	.	.	H	α-helix	trans	-71.3	-40.6	175.2	-58.5	-179.1	0	0	0	111.4	V36 I38 T47 L49 K50 Q54 F55 L60 G61 Y93	V36-L52 HydrophobicContact CB-CD1 4.3Å; V36-L52 HydrophobicContact CG1-CD1 4.15Å; V36-L52 HydrophobicContact CG2-CD1 4.38Å; I38-L52 HydrophobicContact CD1-CD1 4.26Å; T47-L52 HydrophobicContact CG2-CD1 4.09Å; T47-L52 HydrophobicContact CG2-CD2 3.94Å; T47-L52 HydrophobicContact CG2-CG 3.85Å; L49-L52 PolarHBondContact O-N 2.82Å; L49-L52 VanDerWaalsContact O-N 3.11Å; K50-L52 VanDerWaalsContact C-N 3.34Å; L52-Q54 PolarHBondContact O-N 3.04Å; L52-Q54 VanDerWaalsContact O-N 3.09Å; L52-F55 PolarHBondContact O-N 3.49Å; L52-F55 VanDerWaalsContact O-N 3.15Å; L52-L60 HydrophobicContact CD1-CB 4.49Å; L52-L60 HydrophobicContact CD2-CB 4.09Å; L52-L60 HydrophobicContact CD2-CD1 4.49Å; L52-G61 WeakPolarHBondContact O-CA 3.47Å; L52-Y93 HydrophobicContact CD2-CD1 4.03Å; L52-Y93 HydrophobicContact CD2-CD2 4.39Å; L52-Y93 HydrophobicContact CD2-CE1 4.32Å; L52-Y93 HydrophobicContact CD2-CG 4.08Å
53	S	95.1	Very high	96.6	Very high	56 Å²	56	52.6 Å²	52.6	39%	0.392	26%	0.263	S	S	.	.	H	α-helix	trans	-62.9	-13.4	178.4	-59.4	0	0	0	0	113.9	L49 K50 F55 P56	L49-S53 PolarHBondContact O-N 2.89Å; L49-S53 PolarHBondContact O-OG 2.83Å; L49-S53 VanDerWaalsContact O-OG 3.09Å; K50-S53 PolarHBondContact O-N 2.75Å; S53-F55 PolarHBondContact O-N 2.98Å; S53-P56 WeakPolarHBondContact O-CD 3.49Å; S53-P56 WeakPolarHBondContact O-CG 3.3Å
54	Q	95.6	Very high	96.6	Very high	104 Å²	104	58.5 Å²	58.5	49%	0.486	29%	0.286	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.4	-26	172.8	-172.8	171	-0.4	0	0	112.8	K50 T51 L52 Y93	K50-Q54 PolarHBondContact O-N 2.82Å; T51-Q54 WeakPolarHBondContact O-CB 3.06Å; L52-Q54 PolarHBondContact O-N 3.04Å; L52-Q54 VanDerWaalsContact O-N 3.09Å; Q54-Y93 PolarHBondContact OE1-O 2.83Å
55	F	97.4	Very high	96.5	Very high	41 Å²	41	55.4 Å²	55.4	18%	0.18	28%	0.277	C	S	.	.	S	Bend	trans	-126.4	75.8	178.7	-61.9	-83.4	0	0	0	111.4	L52 S53 E57 T58 G61 Y92 Y93	L52-F55 PolarHBondContact O-N 3.49Å; L52-F55 VanDerWaalsContact O-N 3.15Å; S53-F55 PolarHBondContact O-N 2.98Å; F55-E57 PolarHBondContact O-N 3.24Å; F55-E57 VanDerWaalsContact O-N 3.14Å; F55-T58 HydrophobicContact CB-CG2 3.64Å; F55-T58 WeakPolarHBondContact O-CB 3.49Å; F55-T58 PolarHBondContact O-N 3.37Å; F55-T58 PolarHBondContact O-OG1 3.28Å; F55-G61 WeakPolarHBondContact O-CA 3.36Å; F55-Y92 HydrophobicContact CD1-CE1 4.03Å; F55-Y92 HydrophobicContact CD2-CD1 4.43Å; F55-Y92 AromaticContact CD2-CE1 3.93Å; F55-Y92 HydrophobicContact CD2-CE1 3.93Å; F55-Y92 HydrophobicContact CE1-CE1 4.02Å; F55-Y92 AromaticContact CE1-CZ 3.87Å; F55-Y92 WeakPolarHBondContact CE1-OH 3.24Å; F55-Y92 HydrophobicContact CE2-CD1 4.34Å; F55-Y92 AromaticContact CE2-CE1 3.93Å; F55-Y92 HydrophobicContact CE2-CE1 3.93Å; F55-Y92 AromaticContact CG-CE1 3.98Å; F55-Y92 HydrophobicContact CG-CE1 3.98Å; F55-Y92 AromaticContact CZ-CE1 3.97Å; F55-Y92 HydrophobicContact CZ-CE1 3.97Å; F55-Y92 AromaticContact CZ-CZ 3.98Å; F55-Y93 HydrophobicContact CB-CD1 4.25Å; F55-Y93 HydrophobicContact CB-CE1 3.93Å; F55-Y93 AromaticContact CD2-CD1 3.66Å; F55-Y93 HydrophobicContact CD2-CD1 3.66Å; F55-Y93 HydrophobicContact CD2-CE1 4.14Å; F55-Y93 HydrophobicContact CD2-CG 4.31Å; F55-Y93 HydrophobicContact CG-CD1 4.4Å; F55-Y93 HydrophobicContact CG-CE1 4.46Å
56	P	96.8	Very high	96.4	Very high	72 Å²	72	54.7 Å²	54.7	47%	0.468	27%	0.273	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.1	-23.2	-169.8	-22.9	33.2	0	0	0	115.7	S53 T58 N62	S53-P56 WeakPolarHBondContact O-CD 3.49Å; S53-P56 WeakPolarHBondContact O-CG 3.3Å; P56-T58 VanDerWaalsContact C-N 3.32Å; P56-N62 WeakPolarHBondContact O-CA 3.47Å; P56-N62 VanDerWaalsContact O-CB 3.24Å; P56-N62 WeakPolarHBondContact O-CB 3.44Å; P56-N62 PolarHBondContact O-N 3.24Å; P56-N62 PolarHBondContact O-ND2 2.84Å
57	E	96.1	Very high	96.4	Very high	144 Å²	144	55.6 Å²	55.6	67%	0.673	28%	0.279	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.7	-16.3	-178.1	-65.2	-53.5	133.3	0	0	113.3	F55 K65	F55-E57 PolarHBondContact O-N 3.24Å; F55-E57 VanDerWaalsContact O-N 3.14Å; E57-K65 PolarHBondContact O-NZ 3.2Å
58	T	97.8	Very high	96.3	Very high	5 Å²	5	65 Å²	65	3%	0.031	31%	0.312	C	S	.	.	S	Bend	trans	-76.4	164.3	-179.1	66	0	0	0	0	112.4	F55 P56 L60 G61 N62 Y93 E118 L119	F55-T58 HydrophobicContact CB-CG2 3.64Å; F55-T58 WeakPolarHBondContact O-CB 3.49Å; F55-T58 PolarHBondContact O-N 3.37Å; F55-T58 PolarHBondContact O-OG1 3.28Å; P56-T58 VanDerWaalsContact C-N 3.32Å; T58-L60 VanDerWaalsContact C-N 3.34Å; T58-L60 PolarHBondContact O-N 3.11Å; T58-G61 PolarHBondContact O-N 2.88Å; T58-G61 WeakPolarHBondContact OG1-CA 3.49Å; T58-G61 PolarHBondContact OG1-N 2.76Å; T58-N62 WeakPolarHBondContact O-CB 3.4Å; T58-N62 PolarHBondContact O-N 3.15Å; T58-Y93 WeakPolarHBondContact CB-OH 3.26Å; T58-Y93 HydrophobicContact CG2-CE1 4.42Å; T58-Y93 WeakPolarHBondContact OG1-CE1 3.39Å; T58-Y93 PolarHBondContact OG1-OH 3.09Å; T58-E118 WeakPolarHBondContact CA-O 3.48Å; T58-L119 HydrophobicContact CG2-CD2 4.22Å
59	L	98	Very high	96.4	Very high	4 Å²	4	64.1 Å²	64.1	2%	0.021	31%	0.307	C	S	.	.	T	Hydrogen-bonded Turn	trans	-58.1	-47.4	177.9	-174.8	155.8	0	0	0	111.3	K65 R66 Y69 F79 F116 Y117 E118	L59-K65 HydrophobicContact CG-CB 4.47Å; L59-R66 HydrophobicContact CD2-CB 4.48Å; L59-R66 WeakPolarHBondContact O-CB 3.22Å; L59-R66 PolarHBondContact O-N 2.96Å; L59-Y69 HydrophobicContact CD1-CE2 4.06Å; L59-Y69 HydrophobicContact CD2-CD2 4.29Å; L59-Y69 HydrophobicContact CD2-CE2 4.25Å; L59-Y69 HydrophobicContact CG-CE2 4.49Å; L59-F79 HydrophobicContact CD2-CE1 3.66Å; L59-F79 HydrophobicContact CD2-CZ 3.62Å; L59-F116 HydrophobicContact CD1-CE1 4.1Å; L59-F116 HydrophobicContact CD1-CE2 4.45Å; L59-F116 HydrophobicContact CD1-CZ 4.04Å; L59-F116 WeakPolarHBondContact CD1-O 3.45Å; L59-Y117 WeakPolarHBondContact CB-O 3.48Å; L59-Y117 PolarHBondContact N-O 2.83Å; L59-E118 HydrophobicContact CB-CB 4.46Å; L59-E118 HydrophobicContact CB-CG 4.45Å
60	L	97.6	Very high	96.5	Very high	1 Å²	1	65.6 Å²	65.6	1%	0.005	31%	0.312	C	S	.	.	T	Hydrogen-bonded Turn	trans	-78.9	-30.2	-177.2	-62	175.8	0	0	0	112.7	I38 L52 T58 R66 F79 F86 Y93 Y117	I38-L60 HydrophobicContact CD1-CD1 4.18Å; I38-L60 HydrophobicContact CD1-CD2 4.26Å; L52-L60 HydrophobicContact CD1-CB 4.49Å; L52-L60 HydrophobicContact CD2-CB 4.09Å; L52-L60 HydrophobicContact CD2-CD1 4.49Å; T58-L60 VanDerWaalsContact C-N 3.34Å; T58-L60 PolarHBondContact O-N 3.11Å; L60-R66 WeakPolarHBondContact O-CD 3.46Å; L60-R66 PolarHBondContact O-NH1 3.23Å; L60-F79 HydrophobicContact CD2-CE2 3.78Å; L60-F79 HydrophobicContact CD2-CZ 3.62Å; L60-F86 HydrophobicContact CD1-CE2 3.87Å; L60-F86 HydrophobicContact CD1-CZ 3.92Å; L60-Y93 HydrophobicContact CD1-CE2 4.15Å; L60-Y117 HydrophobicContact CD1-CD1 4.04Å; L60-Y117 HydrophobicContact CD1-CE1 4.36Å; L60-Y117 HydrophobicContact CD2-CD1 4.43Å; L60-Y117 HydrophobicContact CD2-CE1 4.48Å; L60-Y117 HydrophobicContact CG-CD1 4.03Å; L60-Y117 HydrophobicContact CG-CE1 4.49Å
61	G	96.4	Very high	96.6	Very high	3 Å²	3	62.8 Å²	62.8	3%	0.031	30%	0.301	C	S	.	.	T	Hydrogen-bonded Turn	trans	-74.3	-30.9	176.4	0	0	0	0	0	113.3	L52 F55 T58 P63 R66	L52-G61 WeakPolarHBondContact O-CA 3.47Å; F55-G61 WeakPolarHBondContact O-CA 3.36Å; T58-G61 PolarHBondContact O-N 2.88Å; T58-G61 WeakPolarHBondContact OG1-CA 3.49Å; T58-G61 PolarHBondContact OG1-N 2.76Å; G61-P63 WeakPolarHBondContact O-CD 3.28Å; G61-R66 PolarHBondContact O-NH1 2.87Å
62	N	97	Very high	96.6	Very high	32 Å²	32	66.6 Å²	66.6	17%	0.171	33%	0.327	C	S	.	.			trans	-86	115.9	-178.5	-165	-59.1	0	0	0	112.6	P56 T58 K64 K65 R66	P56-N62 WeakPolarHBondContact O-CA 3.47Å; P56-N62 VanDerWaalsContact O-CB 3.24Å; P56-N62 WeakPolarHBondContact O-CB 3.44Å; P56-N62 PolarHBondContact O-N 3.24Å; P56-N62 PolarHBondContact O-ND2 2.84Å; T58-N62 WeakPolarHBondContact O-CB 3.4Å; T58-N62 PolarHBondContact O-N 3.15Å; N62-K64 VanDerWaalsContact C-N 3.27Å; N62-K64 PolarHBondContact O-N 3.4Å; N62-K64 WeakPolarHBondContact OD1-CB 3.41Å; N62-K64 PolarHBondContact OD1-N 3.21Å; N62-K65 HydrophobicContact CB-CB 3.96Å; N62-K65 HydrophobicContact CB-CD 3.8Å; N62-K65 HydrophobicContact CB-CG 3.76Å; N62-K65 PolarHBondContact O-N 2.9Å; N62-K65 PolarHBondContact OD1-N 3.14Å; N62-R66 WeakPolarHBondContact O-CG 3.39Å; N62-R66 PolarHBondContact O-N 3.08Å; N62-R66 VanDerWaalsContact O-N 3.1Å
63	P	95.6	Very high	96.6	Very high	71 Å²	71	74.3 Å²	74.3	46%	0.461	37%	0.367	S	S	.	.	H	α-helix	trans	-57.7	-36.8	-179.4	-22.5	31.8	0	0	0	113.7	G61 M67	G61-P63 WeakPolarHBondContact O-CD 3.28Å; P63-M67 WeakPolarHBondContact O-CB 3.36Å; P63-M67 PolarHBondContact O-N 2.86Å; P63-M67 VanDerWaalsContact O-N 3.15Å
64	K	96.3	Very high	96.5	Very high	189 Å²	189	78 Å²	78	82%	0.822	37%	0.373	S	S	*	.	H	α-helix	trans	-70.5	-38.6	-178.9	-63.3	-179	179.3	176.6	0	111.7	N62	N62-K64 VanDerWaalsContact C-N 3.27Å; N62-K64 PolarHBondContact O-N 3.4Å; N62-K64 WeakPolarHBondContact OD1-CB 3.41Å; N62-K64 PolarHBondContact OD1-N 3.21Å
65	K	96.6	Very high	96.5	Very high	70 Å²	70	78.3 Å²	78.3	30%	0.304	38%	0.377	S	S	.	.	H	α-helix	trans	-70.5	-48.5	179.8	-61.3	-177.2	-177.9	-178.8	0	111.2	E57 L59 N62 M67 E118	E57-K65 PolarHBondContact O-NZ 3.2Å; L59-K65 HydrophobicContact CG-CB 4.47Å; N62-K65 HydrophobicContact CB-CB 3.96Å; N62-K65 HydrophobicContact CB-CD 3.8Å; N62-K65 HydrophobicContact CB-CG 3.76Å; N62-K65 PolarHBondContact O-N 2.9Å; N62-K65 PolarHBondContact OD1-N 3.14Å; K65-M67 VanDerWaalsContact C-N 3.33Å; K65-M67 PolarHBondContact O-N 3.21Å; K65-E118 WeakPolarHBondContact CD-OE2 3.35Å; K65-E118 WeakPolarHBondContact CE-OE2 3.49Å; K65-E118 IonicContact NZ-OE2 2.82Å; K65-E118 PolarHBondContact NZ-OE2 3.37Å
66	R	96.1	Very high	96.5	Very high	14 Å²	14	76.5 Å²	76.5	5%	0.053	37%	0.369	C	S	.	.	H	α-helix	trans	-70.6	-23.4	-179.2	69.8	177.7	176.2	-96.1	-3.6	114.4	L59 L60 G61 N62 R68 Y69 Y77	L59-R66 HydrophobicContact CD2-CB 4.48Å; L59-R66 WeakPolarHBondContact O-CB 3.22Å; L59-R66 PolarHBondContact O-N 2.96Å; L60-R66 WeakPolarHBondContact O-CD 3.46Å; L60-R66 PolarHBondContact O-NH1 3.23Å; G61-R66 PolarHBondContact O-NH1 2.87Å; N62-R66 WeakPolarHBondContact O-CG 3.39Å; N62-R66 PolarHBondContact O-N 3.08Å; N62-R66 VanDerWaalsContact O-N 3.1Å; R66-R68 PolarHBondContact O-N 3.31Å; R66-R68 VanDerWaalsContact O-N 3.08Å; R66-Y69 PolarHBondContact O-N 3.38Å; R66-Y77 HydrophobicContact CB-CD1 4.13Å; R66-Y77 HydrophobicContact CB-CE1 3.86Å; R66-Y77 HydrophobicContact CG-CD1 4.36Å; R66-Y77 HydrophobicContact CG-CE1 3.62Å; R66-Y77 PolarHBondContact NE-OH 2.87Å; R66-Y77 VanDerWaalsContact O-CD1 3.28Å; R66-Y77 WeakPolarHBondContact O-CD1 3.34Å; R66-Y77 VanDerWaalsContact O-CE1 3.26Å; R66-Y77 WeakPolarHBondContact O-CE1 3.39Å
67	M	95.5	Very high	96.6	Very high	112 Å²	112	74.3 Å²	74.3	55%	0.552	35%	0.352	S	S	*	.	G	3₁₀ helix	trans	-54.2	-33	-177.7	-170.6	60.8	67.4	0	0	113.1	P63 K65 Y69 F70	P63-M67 WeakPolarHBondContact O-CB 3.36Å; P63-M67 PolarHBondContact O-N 2.86Å; P63-M67 VanDerWaalsContact O-N 3.15Å; K65-M67 VanDerWaalsContact C-N 3.33Å; K65-M67 PolarHBondContact O-N 3.21Å; M67-Y69 PolarHBondContact O-N 2.82Å; M67-Y69 VanDerWaalsContact O-N 3.14Å; M67-F70 WeakPolarHBondContact O-CB 3.5Å; M67-F70 PolarHBondContact O-N 3.28Å; M67-F70 HydrophobicContact SD-CB 4.37Å
68	R	96.2	Very high	96.7	Very high	210 Å²	210	71.6 Å²	71.6	79%	0.792	34%	0.338	S	S	*	.	G	3₁₀ helix	trans	-57.3	-26.9	176.2	-179.6	178.1	178.5	-177.6	0.1	113.5	R66	R66-R68 PolarHBondContact O-N 3.31Å; R66-R68 VanDerWaalsContact O-N 3.08Å
69	Y	97.3	Very high	96.7	Very high	55 Å²	55	71.5 Å²	71.5	22%	0.216	34%	0.337	C	S	.	.	G	3₁₀ helix	trans	-102	3.3	-174.2	-58.6	-85.1	0	0	0	112.9	L59 R66 M67 Y77 F78 F79 F116	L59-Y69 HydrophobicContact CD1-CE2 4.06Å; L59-Y69 HydrophobicContact CD2-CD2 4.29Å; L59-Y69 HydrophobicContact CD2-CE2 4.25Å; L59-Y69 HydrophobicContact CG-CE2 4.49Å; R66-Y69 PolarHBondContact O-N 3.38Å; M67-Y69 PolarHBondContact O-N 2.82Å; M67-Y69 VanDerWaalsContact O-N 3.14Å; Y69-Y77 CarbonylContact O-C 3.45Å; Y69-Y77 VanDerWaalsContact O-CA 3.3Å; Y69-Y77 WeakPolarHBondContact O-CA 3.46Å; Y69-F78 PolarHBondContact O-N 2.97Å; Y69-F79 AromaticContact CD1-CD1 3.7Å; Y69-F79 HydrophobicContact CD1-CD1 3.7Å; Y69-F79 AromaticContact CD1-CE1 3.56Å; Y69-F79 HydrophobicContact CD1-CE1 3.56Å; Y69-F79 HydrophobicContact CD1-CZ 4.31Å; Y69-F79 AromaticContact CD2-CE1 3.65Å; Y69-F79 HydrophobicContact CD2-CE1 3.65Å; Y69-F79 HydrophobicContact CD2-CZ 4Å; Y69-F79 AromaticContact CE1-CD1 3.97Å; Y69-F79 HydrophobicContact CE1-CD1 3.97Å; Y69-F79 AromaticContact CE1-CE1 3.9Å; Y69-F79 HydrophobicContact CE1-CE1 3.9Å; Y69-F79 AromaticContact CE2-CE1 3.99Å; Y69-F79 HydrophobicContact CE2-CE1 3.99Å; Y69-F79 HydrophobicContact CG-CD1 4.03Å; Y69-F79 AromaticContact CG-CE1 3.43Å; Y69-F79 HydrophobicContact CG-CE1 3.43Å; Y69-F79 VanDerWaalsContact CG-CE1 3.43Å; Y69-F79 AromaticContact CG-CZ 3.79Å; Y69-F79 HydrophobicContact CG-CZ 3.79Å; Y69-F116 HydrophobicContact CE1-CZ 4.18Å; Y69-F116 AromaticContact CZ-CZ 4Å
70	F	97.8	Very high	96.7	Very high	67 Å²	67	77.5 Å²	77.5	29%	0.294	37%	0.37	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.5	126.4	-176.4	-171.7	-114.3	0	0	0	111.9	M67 P72 N75 Y77	M67-F70 WeakPolarHBondContact O-CB 3.5Å; M67-F70 PolarHBondContact O-N 3.28Å; M67-F70 HydrophobicContact SD-CB 4.37Å; F70-P72 HydrophobicContact CE1-CB 4.19Å; F70-P72 WeakPolarHBondContact O-CD 3.44Å; F70-N75 WeakPolarHBondContact CZ-OD1 3.48Å; F70-Y77 HydrophobicContact CB-CD1 3.86Å; F70-Y77 HydrophobicContact CB-CE1 3.61Å; F70-Y77 HydrophobicContact CD2-CD1 4.02Å; F70-Y77 HydrophobicContact CD2-CD2 4.27Å; F70-Y77 AromaticContact CD2-CE1 3.72Å; F70-Y77 HydrophobicContact CD2-CE1 3.72Å; F70-Y77 HydrophobicContact CD2-CE2 4Å; F70-Y77 HydrophobicContact CD2-CG 4.29Å; F70-Y77 AromaticContact CD2-CZ 3.71Å; F70-Y77 HydrophobicContact CE2-CE2 4.48Å; F70-Y77 HydrophobicContact CG-CD1 4.44Å; F70-Y77 HydrophobicContact CG-CE1 4.06Å
71	D	96.8	Very high	96.6	Very high	45 Å²	45	80.7 Å²	80.7	24%	0.241	38%	0.381	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.8	106.9	170.2	-178.4	-8.6	0	0	0	109.8	L73 R74 N75 E76	D71-L73 VanDerWaalsContact C-N 3.26Å; D71-L73 PolarHBondContact O-N 3.09Å; D71-L73 WeakPolarHBondContact OD1-CB 3.46Å; D71-L73 PolarHBondContact OD1-N 3.28Å; D71-R74 PolarHBondContact O-N 3.15Å; D71-R74 VanDerWaalsContact OD2-CD 3.28Å; D71-R74 WeakPolarHBondContact OD2-CD 3.37Å; D71-R74 WeakPolarHBondContact OD2-CG 3.13Å; D71-N75 WeakPolarHBondContact O-CA 3.21Å; D71-N75 PolarHBondContact O-N 3.14Å; D71-E76 PolarHBondContact N-O 3.3Å; D71-E76 PolarHBondContact O-N 3.39Å
72	P	95.6	Very high	96.6	Very high	102 Å²	102	82.4 Å²	82.4	66%	0.662	39%	0.39	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.6	-19.7	-178	30.2	-35.6	0	0	0	113.4	F70	F70-P72 HydrophobicContact CE1-CB 4.19Å; F70-P72 WeakPolarHBondContact O-CD 3.44Å
73	L	96.4	Very high	96.6	Very high	163 Å²	163	86.3 Å²	86.3	85%	0.853	40%	0.402	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77	-31.3	179.6	-62.7	176.2	0	0	0	111.7	D71	D71-L73 VanDerWaalsContact C-N 3.26Å; D71-L73 PolarHBondContact O-N 3.09Å; D71-L73 WeakPolarHBondContact OD1-CB 3.46Å; D71-L73 PolarHBondContact OD1-N 3.28Å
74	R	94.4	Very high	96.6	Very high	135 Å²	135	85.7 Å²	85.7	51%	0.509	40%	0.398	S	S	.	.	T	Hydrogen-bonded Turn	trans	-109	-6.4	-176.5	-58.4	-176.8	96.8	-163.7	14.4	113.1	D71 E76	D71-R74 PolarHBondContact O-N 3.15Å; D71-R74 VanDerWaalsContact OD2-CD 3.28Å; D71-R74 WeakPolarHBondContact OD2-CD 3.37Å; D71-R74 WeakPolarHBondContact OD2-CG 3.13Å; R74-E76 VanDerWaalsContact C-N 3.26Å; R74-E76 HydrophobicContact CB-CG 3.78Å; R74-E76 IonicContact CZ-OE1 2.94Å; R74-E76 IonicContact NE-OE1 3.1Å; R74-E76 IonicContact NH1-OE1 3.45Å; R74-E76 PolarHBondContact NH1-OE1 3.25Å; R74-E76 PolarHBondContact O-N 3.09Å
75	N	95.5	Very high	96.6	Very high	110 Å²	110	76.7 Å²	76.7	59%	0.588	36%	0.359	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.4	44	-176.5	-163.7	44.4	0	0	0	112.2	F70 D71	F70-N75 WeakPolarHBondContact CZ-OD1 3.48Å; D71-N75 WeakPolarHBondContact O-CA 3.21Å; D71-N75 PolarHBondContact O-N 3.14Å
76	E	97.3	Very high	96.7	Very high	2 Å²	2	73.3 Å²	73.3	1%	0.009	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.9	154.8	-178.3	69.5	-172.7	-161.6	0	0	110.7	V37 N39 R44 D71 R74	V37-E76 HydrophobicContact CB-CB 3.86Å; V37-E76 HydrophobicContact CG1-CB 3.77Å; V37-E76 WeakPolarHBondContact O-CA 3.41Å; N39-E76 HydrophobicContact CB-CG 4.24Å; N39-E76 PolarHBondContact ND2-OE1 2.99Å; R44-E76 IonicContact CZ-OE2 3.27Å; R44-E76 IonicContact NE-OE2 3.08Å; R44-E76 PolarHBondContact NE-OE2 3.42Å; R44-E76 IonicContact NH2-OE2 2.67Å; R44-E76 PolarHBondContact NH2-OE2 2.7Å; R44-E76 VanDerWaalsContact NH2-OE2 3.1Å; D71-E76 PolarHBondContact N-O 3.3Å; D71-E76 PolarHBondContact O-N 3.39Å; R74-E76 VanDerWaalsContact C-N 3.26Å; R74-E76 HydrophobicContact CB-CG 3.78Å; R74-E76 IonicContact CZ-OE1 2.94Å; R74-E76 IonicContact NE-OE1 3.1Å; R74-E76 IonicContact NH1-OE1 3.45Å; R74-E76 PolarHBondContact NH1-OE1 3.25Å; R74-E76 PolarHBondContact O-N 3.09Å
77	Y	98.2	Very high	96.7	Very high	27 Å²	27	77.5 Å²	77.5	11%	0.106	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.7	124.4	168.3	-66.6	-85.2	0	0	0	109.7	V36 V37 I38 N39 R66 Y69 F70	V36-Y77 HydrophobicContact CG1-CD2 3.54Å; V36-Y77 HydrophobicContact CG1-CE2 3.56Å; V37-Y77 PolarHBondContact O-N 3.38Å; I38-Y77 CarbonylContact C-O 3.56Å; I38-Y77 WeakPolarHBondContact CA-O 3.47Å; N39-Y77 PolarHBondContact N-O 3.42Å; R66-Y77 HydrophobicContact CB-CD1 4.13Å; R66-Y77 HydrophobicContact CB-CE1 3.86Å; R66-Y77 HydrophobicContact CG-CD1 4.36Å; R66-Y77 HydrophobicContact CG-CE1 3.62Å; R66-Y77 PolarHBondContact NE-OH 2.87Å; R66-Y77 VanDerWaalsContact O-CD1 3.28Å; R66-Y77 WeakPolarHBondContact O-CD1 3.34Å; R66-Y77 VanDerWaalsContact O-CE1 3.26Å; R66-Y77 WeakPolarHBondContact O-CE1 3.39Å; Y69-Y77 CarbonylContact O-C 3.45Å; Y69-Y77 VanDerWaalsContact O-CA 3.3Å; Y69-Y77 WeakPolarHBondContact O-CA 3.46Å; F70-Y77 HydrophobicContact CB-CD1 3.86Å; F70-Y77 HydrophobicContact CB-CE1 3.61Å; F70-Y77 HydrophobicContact CD2-CD1 4.02Å; F70-Y77 HydrophobicContact CD2-CD2 4.27Å; F70-Y77 AromaticContact CD2-CE1 3.72Å; F70-Y77 HydrophobicContact CD2-CE1 3.72Å; F70-Y77 HydrophobicContact CD2-CE2 4Å; F70-Y77 HydrophobicContact CD2-CG 4.29Å; F70-Y77 AromaticContact CD2-CZ 3.71Å; F70-Y77 HydrophobicContact CE2-CE2 4.48Å; F70-Y77 HydrophobicContact CG-CD1 4.44Å; F70-Y77 HydrophobicContact CG-CE1 4.06Å
78	F	98.3	Very high	96.8	Very high	87 Å²	87	72.6 Å²	72.6	38%	0.382	35%	0.345	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.1	129.5	-177.8	-179.9	-101.7	0	0	0	112.5	N39 Y69 D80	N39-F78 HydrophobicContact CB-CD2 4.12Å; N39-F78 WeakPolarHBondContact O-CA 3.34Å; Y69-F78 PolarHBondContact O-N 2.97Å; F78-D80 HydrophobicContact CE1-CB 4Å; F78-D80 HydrophobicContact CZ-CB 4.22Å
79	F	98.3	Very high	96.9	Very high	2 Å²	2	62.6 Å²	62.6	1%	0.009	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	124.6	174.3	-61.6	-89.3	0	0	0	109.9	I38 N39 I40 S41 L59 L60 Y69 R81 F116 Y117	I38-F79 HydrophobicContact CG2-CD2 3.78Å; I38-F79 HydrophobicContact CG2-CE2 3.82Å; N39-F79 PolarHBondContact O-N 2.9Å; I40-F79 CarbonylContact C-O 3.55Å; I40-F79 WeakPolarHBondContact CA-O 3.24Å; I40-F79 HydrophobicContact CD1-CB 3.75Å; I40-F79 HydrophobicContact CD1-CD2 3.77Å; I40-F79 HydrophobicContact CD1-CG 4.09Å; S41-F79 PolarHBondContact N-O 3.44Å; L59-F79 HydrophobicContact CD2-CE1 3.66Å; L59-F79 HydrophobicContact CD2-CZ 3.62Å; L60-F79 HydrophobicContact CD2-CE2 3.78Å; L60-F79 HydrophobicContact CD2-CZ 3.62Å; Y69-F79 AromaticContact CD1-CD1 3.7Å; Y69-F79 HydrophobicContact CD1-CD1 3.7Å; Y69-F79 AromaticContact CD1-CE1 3.56Å; Y69-F79 HydrophobicContact CD1-CE1 3.56Å; Y69-F79 HydrophobicContact CD1-CZ 4.31Å; Y69-F79 AromaticContact CD2-CE1 3.65Å; Y69-F79 HydrophobicContact CD2-CE1 3.65Å; Y69-F79 HydrophobicContact CD2-CZ 4Å; Y69-F79 AromaticContact CE1-CD1 3.97Å; Y69-F79 HydrophobicContact CE1-CD1 3.97Å; Y69-F79 AromaticContact CE1-CE1 3.9Å; Y69-F79 HydrophobicContact CE1-CE1 3.9Å; Y69-F79 AromaticContact CE2-CE1 3.99Å; Y69-F79 HydrophobicContact CE2-CE1 3.99Å; Y69-F79 HydrophobicContact CG-CD1 4.03Å; Y69-F79 AromaticContact CG-CE1 3.43Å; Y69-F79 HydrophobicContact CG-CE1 3.43Å; Y69-F79 VanDerWaalsContact CG-CE1 3.43Å; Y69-F79 AromaticContact CG-CZ 3.79Å; Y69-F79 HydrophobicContact CG-CZ 3.79Å; F79-R81 HydrophobicContact CB-CB 4.5Å; F79-R81 HydrophobicContact CB-CG 4.3Å; F79-R81 PolarHBondContact O-N 3.35Å; F79-F116 AromaticContact CD1-CE1 3.63Å; F79-F116 HydrophobicContact CD1-CE1 3.63Å; F79-F116 AromaticContact CD1-CZ 3.78Å; F79-F116 HydrophobicContact CD1-CZ 3.78Å; F79-F116 AromaticContact CE1-CE1 3.89Å; F79-F116 HydrophobicContact CE1-CE1 3.89Å; F79-F116 HydrophobicContact CE1-CZ 4.02Å; F79-Y117 HydrophobicContact CD1-CE1 4.23Å; F79-Y117 HydrophobicContact CE1-CE1 4.23Å; F79-Y117 HydrophobicContact CG-CE1 4.44Å; F79-Y117 HydrophobicContact CZ-CE1 4.44Å
80	D	97.4	Very high	96.9	Very high	131 Å²	131	60.3 Å²	60.3	70%	0.701	30%	0.299	S	S	*	.			trans	-89.3	77.6	173.1	-166.1	20.4	0	0	0	110.3	S41 F78	S41-D80 WeakPolarHBondContact OG-CA 3.21Å; S41-D80 PolarHBondContact OG-OD1 2.97Å; F78-D80 HydrophobicContact CE1-CB 4Å; F78-D80 HydrophobicContact CZ-CB 4.22Å
81	R	96.9	Very high	96.9	Very high	67 Å²	67	62.1 Å²	62.1	25%	0.253	30%	0.304	S	S	.	.	S	Bend	trans	-144	178.1	-167.9	-66.3	-158.6	71.9	99.3	6.7	113.1	S41 F79 R83 E113 F116	S41-R81 PolarHBondContact OG-N 3.46Å; S41-R81 PolarHBondContact OG-O 2.98Å; F79-R81 HydrophobicContact CB-CB 4.5Å; F79-R81 HydrophobicContact CB-CG 4.3Å; F79-R81 PolarHBondContact O-N 3.35Å; R81-R83 PolarHBondContact O-N 3.42Å; R81-R83 VanDerWaalsContact O-N 3.09Å; R81-E113 IonicContact CZ-OE1 3.97Å; R81-E113 IonicContact CZ-OE2 3.63Å; R81-E113 VanDerWaalsContact NE-CD 3.27Å; R81-E113 IonicContact NE-OE1 3.56Å; R81-E113 PolarHBondContact NE-OE1 2.91Å; R81-E113 IonicContact NE-OE2 2.94Å; R81-E113 PolarHBondContact NE-OE2 3.42Å; R81-E113 IonicContact NH2-OE1 2.81Å; R81-E113 PolarHBondContact NH2-OE1 3.17Å; R81-E113 IonicContact NH2-OE2 3.78Å; R81-F116 HydrophobicContact CG-CE1 4.42Å; R81-F116 VanDerWaalsContact CZ-CB 3.49Å; R81-F116 VanDerWaalsContact NE-CD1 3.35Å; R81-F116 VanDerWaalsContact NH1-CE2 3.33Å
82	N	95.5	Very high	97	Very high	39 Å²	39	60.8 Å²	60.8	21%	0.209	30%	0.296	C	S	.	.			trans	-62.9	112.2	-176.9	-175.6	-95.9	0	0	0	112.1	P84 S85 M109 E113	N82-P84 VanDerWaalsContact OD1-CD 3.31Å; N82-P84 WeakPolarHBondContact OD1-CD 3.28Å; N82-S85 WeakPolarHBondContact OD1-CB 3.45Å; N82-S85 PolarHBondContact OD1-N 3.24Å; N82-S85 PolarHBondContact OD1-OG 3.42Å; N82-M109 HydrophobicContact CB-CG 4.39Å; N82-M109 HydrophobicContact CB-SD 4.26Å; N82-M109 VanDerWaalsContact CG-SD 3.54Å; N82-M109 PolarHBondContact ND2-SD 3.08Å; N82-E113 HydrophobicContact CB-CG 4.26Å
83	R	96.4	Very high	97.1	Very high	115 Å²	115	56 Å²	56	43%	0.434	27%	0.265	S	S	.	.	H	α-helix	trans	-63.2	-48.4	-176.4	-52.3	170.4	56.4	173.1	-1.8	113.2	I40 L43 R81 S85 F86	I40-R83 HydrophobicContact CG2-CG 4.27Å; I40-R83 WeakPolarHBondContact O-CG 3.48Å; L43-R83 HydrophobicContact CD2-CB 4.36Å; R81-R83 PolarHBondContact O-N 3.42Å; R81-R83 VanDerWaalsContact O-N 3.09Å; R83-S85 VanDerWaalsContact C-N 3.25Å; R83-S85 PolarHBondContact O-N 2.91Å; R83-F86 PolarHBondContact O-N 3.46Å
84	P	96.2	Very high	97.1	Very high	57 Å²	57	52.9 Å²	52.9	37%	0.37	25%	0.246	S	C	.	.	H	α-helix	trans	-63.3	-28.6	-176.6	-25.3	36.4	0	0	0	114.2	N82 V105	N82-P84 VanDerWaalsContact OD1-CD 3.31Å; N82-P84 WeakPolarHBondContact OD1-CD 3.28Å; P84-V105 HydrophobicContact CB-CG2 3.55Å
85	S	97	Very high	97.3	Very high	0 Å²	0	48.2 Å²	48.2	0%	0	23%	0.234	C	C	.	.	H	α-helix	trans	-68.8	-33	179.6	-65.1	0	0	0	0	113.5	N82 R83 D87 A88 I89 V105	N82-S85 WeakPolarHBondContact OD1-CB 3.45Å; N82-S85 PolarHBondContact OD1-N 3.24Å; N82-S85 PolarHBondContact OD1-OG 3.42Å; R83-S85 VanDerWaalsContact C-N 3.25Å; R83-S85 PolarHBondContact O-N 2.91Å; S85-D87 PolarHBondContact O-N 2.82Å; S85-A88 PolarHBondContact O-N 3.42Å; S85-I89 PolarHBondContact O-N 3.1Å; S85-V105 WeakPolarHBondContact OG-CG1 3.41Å
86	F	98	Very high	97.2	Very high	0 Å²	0	44.7 Å²	44.7	0%	0	22%	0.223	C	C	.	.	H	α-helix	trans	-67.7	-24.5	-168.2	-167.1	-102.6	0	0	0	113.9	I38 I40 F45 L60 R83 A88 I89 L90 Y117	I38-F86 HydrophobicContact CB-CE1 4.21Å; I38-F86 HydrophobicContact CB-CZ 4.11Å; I38-F86 HydrophobicContact CD1-CE1 4.35Å; I38-F86 HydrophobicContact CD1-CZ 3.8Å; I38-F86 HydrophobicContact CG2-CE1 3.97Å; I38-F86 HydrophobicContact CG2-CE2 4.26Å; I38-F86 HydrophobicContact CG2-CZ 3.56Å; I40-F86 HydrophobicContact CB-CB 4.49Å; I40-F86 HydrophobicContact CD1-CB 4.42Å; I40-F86 HydrophobicContact CD1-CD1 4.07Å; I40-F86 HydrophobicContact CD1-CD2 3.57Å; I40-F86 HydrophobicContact CD1-CE1 4.18Å; I40-F86 HydrophobicContact CD1-CE2 3.7Å; I40-F86 HydrophobicContact CD1-CG 3.76Å; I40-F86 HydrophobicContact CD1-CZ 4.02Å; I40-F86 HydrophobicContact CG1-CB 3.8Å; I40-F86 HydrophobicContact CG1-CD1 3.57Å; I40-F86 HydrophobicContact CG1-CD2 3.83Å; I40-F86 HydrophobicContact CG1-CE1 4.04Å; I40-F86 HydrophobicContact CG1-CE2 4.28Å; I40-F86 HydrophobicContact CG1-CG 3.44Å; I40-F86 VanDerWaalsContact CG1-CG 3.44Å; I40-F86 HydrophobicContact CG1-CZ 4.39Å; I40-F86 HydrophobicContact CG2-CB 4.33Å; F45-F86 HydrophobicContact CB-CD1 4.21Å; F45-F86 HydrophobicContact CB-CE1 3.85Å; F45-F86 AromaticContact CD1-CD1 3.87Å; F45-F86 HydrophobicContact CD1-CD1 3.87Å; F45-F86 HydrophobicContact CD1-CE1 4.26Å; F45-F86 AromaticContact CD2-CD1 3.4Å; F45-F86 HydrophobicContact CD2-CD1 3.4Å; F45-F86 AromaticContact CD2-CE1 3.84Å; F45-F86 HydrophobicContact CD2-CE1 3.84Å; F45-F86 HydrophobicContact CD2-CG 4.42Å; F45-F86 HydrophobicContact CE1-CD1 4.01Å; F45-F86 HydrophobicContact CE2-CB 4.14Å; F45-F86 AromaticContact CE2-CD1 3.55Å; F45-F86 HydrophobicContact CE2-CD1 3.55Å; F45-F86 HydrophobicContact CE2-CE1 4.43Å; F45-F86 HydrophobicContact CE2-CG 4.24Å; F45-F86 AromaticContact CG-CD1 3.56Å; F45-F86 HydrophobicContact CG-CD1 3.56Å; F45-F86 AromaticContact CG-CE1 3.73Å; F45-F86 HydrophobicContact CG-CE1 3.73Å; F45-F86 HydrophobicContact CZ-CB 4.17Å; F45-F86 AromaticContact CZ-CD1 3.85Å; F45-F86 HydrophobicContact CZ-CD1 3.85Å; L60-F86 HydrophobicContact CD1-CE2 3.87Å; L60-F86 HydrophobicContact CD1-CZ 3.92Å; R83-F86 PolarHBondContact O-N 3.46Å; F86-A88 VanDerWaalsContact C-N 3.31Å; F86-A88 PolarHBondContact O-N 3.39Å; F86-I89 HydrophobicContact CD2-CB 4.16Å; F86-I89 HydrophobicContact CD2-CG2 4.26Å; F86-I89 HydrophobicContact CE2-CG2 4.18Å; F86-I89 PolarHBondContact O-N 3.17Å; F86-L90 HydrophobicContact CD1-CB 4.33Å; F86-L90 HydrophobicContact CE1-CB 4.05Å; F86-L90 HydrophobicContact CE1-CD2 4.39Å; F86-L90 WeakPolarHBondContact O-CB 3.44Å; F86-L90 PolarHBondContact O-N 3.21Å; F86-Y117 HydrophobicContact CD2-CE1 4.09Å; F86-Y117 AromaticContact CD2-CE2 3.87Å; F86-Y117 HydrophobicContact CD2-CE2 3.87Å; F86-Y117 AromaticContact CD2-CZ 3.51Å; F86-Y117 WeakPolarHBondContact CD2-OH 3.38Å; F86-Y117 HydrophobicContact CE2-CD1 4.42Å; F86-Y117 AromaticContact CE2-CE1 3.7Å; F86-Y117 HydrophobicContact CE2-CE1 3.7Å; F86-Y117 HydrophobicContact CE2-CE2 4.27Å; F86-Y117 AromaticContact CE2-CZ 3.64Å
87	D	96.6	Very high	97.1	Very high	102 Å²	102	45.3 Å²	45.3	55%	0.545	23%	0.23	S	C	.	.	H	α-helix	trans	-58.2	-46.5	176.4	-163.9	15.8	0	0	0	111	F45 S85 L90 Y91	F45-D87 HydrophobicContact CE1-CB 4.41Å; S85-D87 PolarHBondContact O-N 2.82Å; D87-L90 PolarHBondContact O-N 3.19Å; D87-Y91 VanDerWaalsContact O-CB 3.28Å; D87-Y91 WeakPolarHBondContact O-CB 3.37Å; D87-Y91 PolarHBondContact O-N 3.33Å
88	A	97.3	Very high	97	Very high	9 Å²	9	51.9 Å²	51.9	7%	0.074	26%	0.255	C	S	.	.	H	α-helix	trans	-69.7	-35.9	175.7	0	0	0	0	0	113.1	S85 F86 Y91 Y92 R100 P102 F110	S85-A88 PolarHBondContact O-N 3.42Å; F86-A88 VanDerWaalsContact C-N 3.31Å; F86-A88 PolarHBondContact O-N 3.39Å; A88-Y91 PolarHBondContact O-N 3.21Å; A88-Y92 PolarHBondContact O-N 3.03Å; A88-R100 WeakPolarHBondContact CB-O 3.42Å; A88-P102 HydrophobicContact CB-CG 3.96Å; A88-F110 HydrophobicContact CB-CE2 3.72Å; A88-F110 HydrophobicContact CB-CZ 3.56Å
89	I	98.2	Very high	96.9	Very high	0 Å²	0	48.2 Å²	48.2	0%	0	24%	0.239	C	C	.	.	H	α-helix	trans	-63	-44.3	175.2	-60.6	-63.9	0	0	0	110.4	S85 F86 Y92 Y93 F110 I114 Y117 L119	S85-I89 PolarHBondContact O-N 3.1Å; F86-I89 HydrophobicContact CD2-CB 4.16Å; F86-I89 HydrophobicContact CD2-CG2 4.26Å; F86-I89 HydrophobicContact CE2-CG2 4.18Å; F86-I89 PolarHBondContact O-N 3.17Å; I89-Y92 WeakPolarHBondContact O-CB 3.29Å; I89-Y92 PolarHBondContact O-N 3.27Å; I89-Y93 HydrophobicContact CG2-CE2 4.25Å; I89-Y93 WeakPolarHBondContact O-CD2 3.31Å; I89-Y93 WeakPolarHBondContact O-CE2 3.44Å; I89-F110 HydrophobicContact CD1-CE2 4.26Å; I89-F110 HydrophobicContact CD1-CZ 4.42Å; I89-F110 HydrophobicContact CG1-CE2 4.45Å; I89-I114 HydrophobicContact CD1-CG1 4.18Å; I89-Y117 HydrophobicContact CB-CD2 4.3Å; I89-Y117 HydrophobicContact CD1-CD2 4.05Å; I89-Y117 HydrophobicContact CG1-CD2 3.8Å; I89-Y117 HydrophobicContact CG1-CE2 4.13Å; I89-Y117 HydrophobicContact CG2-CD1 4.39Å; I89-Y117 HydrophobicContact CG2-CD2 3.7Å; I89-Y117 HydrophobicContact CG2-CE2 4.27Å; I89-Y117 HydrophobicContact CG2-CG 3.79Å; I89-L119 HydrophobicContact CD1-CD1 3.76Å
90	L	98.1	Very high	96.7	Very high	6 Å²	6	55.3 Å²	55.3	3%	0.031	27%	0.266	C	S	.	.	H	α-helix	trans	-69.6	-41.1	178.5	-176	61.1	0	0	0	111.5	F45 T47 F86 D87 Y92 Y93 Q94	F45-L90 HydrophobicContact CB-CD2 3.92Å; F45-L90 HydrophobicContact CD1-CD2 3.83Å; F45-L90 HydrophobicContact CG-CD2 4.27Å; T47-L90 HydrophobicContact CG2-CD1 3.94Å; F86-L90 HydrophobicContact CD1-CB 4.33Å; F86-L90 HydrophobicContact CE1-CB 4.05Å; F86-L90 HydrophobicContact CE1-CD2 4.39Å; F86-L90 WeakPolarHBondContact O-CB 3.44Å; F86-L90 PolarHBondContact O-N 3.21Å; D87-L90 PolarHBondContact O-N 3.19Å; L90-Y92 PolarHBondContact O-N 3.09Å; L90-Y93 PolarHBondContact O-N 3.18Å; L90-Y93 VanDerWaalsContact O-N 3.09Å; L90-Q94 WeakPolarHBondContact O-CG 3.26Å; L90-Q94 PolarHBondContact O-N 3.49Å; L90-Q94 VanDerWaalsContact O-N 3.14Å
91	Y	97.9	Very high	96.6	Very high	105 Å²	105	52.2 Å²	52.2	41%	0.412	24%	0.244	S	C	.	.	H	α-helix	trans	-61.6	-30	176.8	-174.3	-107.2	0	0	0	112.6	D87 A88 Y93 Q94 S95 R98	D87-Y91 VanDerWaalsContact O-CB 3.28Å; D87-Y91 WeakPolarHBondContact O-CB 3.37Å; D87-Y91 PolarHBondContact O-N 3.33Å; A88-Y91 PolarHBondContact O-N 3.21Å; Y91-Y93 VanDerWaalsContact C-N 3.31Å; Y91-Y93 PolarHBondContact O-N 3.03Å; Y91-Q94 PolarHBondContact O-N 2.97Å; Y91-S95 WeakPolarHBondContact O-CB 3.35Å; Y91-S95 PolarHBondContact O-N 3.36Å; Y91-S95 PolarHBondContact O-OG 3.3Å; Y91-R98 HydrophobicContact CE1-CB 4.21Å
92	Y	98.1	Very high	96.5	Very high	18 Å²	18	50.3 Å²	50.3	7%	0.071	24%	0.241	C	C	.	.	H	α-helix	trans	-55.3	-45.3	171.5	170.9	-96.4	0	0	0	112	F55 A88 I89 L90 S95 G96 G97 R98 L99 L119 A123	F55-Y92 HydrophobicContact CD1-CE1 4.03Å; F55-Y92 HydrophobicContact CD2-CD1 4.43Å; F55-Y92 AromaticContact CD2-CE1 3.93Å; F55-Y92 HydrophobicContact CD2-CE1 3.93Å; F55-Y92 HydrophobicContact CE1-CE1 4.02Å; F55-Y92 AromaticContact CE1-CZ 3.87Å; F55-Y92 WeakPolarHBondContact CE1-OH 3.24Å; F55-Y92 HydrophobicContact CE2-CD1 4.34Å; F55-Y92 AromaticContact CE2-CE1 3.93Å; F55-Y92 HydrophobicContact CE2-CE1 3.93Å; F55-Y92 AromaticContact CG-CE1 3.98Å; F55-Y92 HydrophobicContact CG-CE1 3.98Å; F55-Y92 AromaticContact CZ-CE1 3.97Å; F55-Y92 HydrophobicContact CZ-CE1 3.97Å; F55-Y92 AromaticContact CZ-CZ 3.98Å; A88-Y92 PolarHBondContact O-N 3.03Å; I89-Y92 WeakPolarHBondContact O-CB 3.29Å; I89-Y92 PolarHBondContact O-N 3.27Å; L90-Y92 PolarHBondContact O-N 3.09Å; Y92-S95 PolarHBondContact O-OG 2.9Å; Y92-G96 PolarHBondContact O-N 3.18Å; Y92-G97 VanDerWaalsContact CE2-CA 3.45Å; Y92-G97 PolarHBondContact O-N 3.45Å; Y92-R98 WeakPolarHBondContact CA-O 3.14Å; Y92-L99 HydrophobicContact CD2-CB 3.93Å; Y92-L99 HydrophobicContact CD2-CD1 4.49Å; Y92-L119 HydrophobicContact CD1-CD1 4.12Å; Y92-L119 HydrophobicContact CD1-CD2 3.96Å; Y92-L119 HydrophobicContact CE1-CD1 4.49Å; Y92-L119 HydrophobicContact CE1-CD2 4.08Å; Y92-L119 HydrophobicContact CG-CD1 4.17Å; Y92-A123 HydrophobicContact CE2-CB 3.98Å
93	Y	97.5	Very high	96.3	Very high	0 Å²	0	55.2 Å²	55.2	0%	0	27%	0.272	C	S	.	.	H	α-helix	trans	-68.5	-45.9	175.8	-63.1	-98.6	0	0	0	111.3	L52 Q54 F55 T58 L60 I89 L90 Y91 S95 G96 L119	L52-Y93 HydrophobicContact CD2-CD1 4.03Å; L52-Y93 HydrophobicContact CD2-CD2 4.39Å; L52-Y93 HydrophobicContact CD2-CE1 4.32Å; L52-Y93 HydrophobicContact CD2-CG 4.08Å; Q54-Y93 PolarHBondContact OE1-O 2.83Å; F55-Y93 HydrophobicContact CB-CD1 4.25Å; F55-Y93 HydrophobicContact CB-CE1 3.93Å; F55-Y93 AromaticContact CD2-CD1 3.66Å; F55-Y93 HydrophobicContact CD2-CD1 3.66Å; F55-Y93 HydrophobicContact CD2-CE1 4.14Å; F55-Y93 HydrophobicContact CD2-CG 4.31Å; F55-Y93 HydrophobicContact CG-CD1 4.4Å; F55-Y93 HydrophobicContact CG-CE1 4.46Å; T58-Y93 WeakPolarHBondContact CB-OH 3.26Å; T58-Y93 HydrophobicContact CG2-CE1 4.42Å; T58-Y93 WeakPolarHBondContact OG1-CE1 3.39Å; T58-Y93 PolarHBondContact OG1-OH 3.09Å; L60-Y93 HydrophobicContact CD1-CE2 4.15Å; I89-Y93 HydrophobicContact CG2-CE2 4.25Å; I89-Y93 WeakPolarHBondContact O-CD2 3.31Å; I89-Y93 WeakPolarHBondContact O-CE2 3.44Å; L90-Y93 PolarHBondContact O-N 3.18Å; L90-Y93 VanDerWaalsContact O-N 3.09Å; Y91-Y93 VanDerWaalsContact C-N 3.31Å; Y91-Y93 PolarHBondContact O-N 3.03Å; Y93-S95 VanDerWaalsContact C-N 3.33Å; Y93-S95 PolarHBondContact O-N 2.68Å; Y93-G96 PolarHBondContact O-N 3.14Å; Y93-L119 HydrophobicContact CE2-CD2 3.94Å; Y93-L119 WeakPolarHBondContact OH-CD2 3.37Å
94	Q	97.2	Very high	96.1	Very high	99 Å²	99	55.2 Å²	55.2	46%	0.463	28%	0.281	S	S	.	.	H	α-helix	trans	-64	-36.9	-176.7	-66.4	171	-17.1	0	0	113.3	T51 L90 Y91 G96	T51-Q94 HydrophobicContact CG2-CG 4.02Å; L90-Q94 WeakPolarHBondContact O-CG 3.26Å; L90-Q94 PolarHBondContact O-N 3.49Å; L90-Q94 VanDerWaalsContact O-N 3.14Å; Y91-Q94 PolarHBondContact O-N 2.97Å; Q94-G96 VanDerWaalsContact C-N 3.32Å
95	S	96.8	Very high	96	Very high	37 Å²	37	52.7 Å²	52.7	26%	0.259	26%	0.264	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.6	-5.1	-179.5	64.9	0	0	0	0	113.5	Y91 Y92 Y93 R98	Y91-S95 WeakPolarHBondContact O-CB 3.35Å; Y91-S95 PolarHBondContact O-N 3.36Å; Y91-S95 PolarHBondContact O-OG 3.3Å; Y92-S95 PolarHBondContact O-OG 2.9Å; Y93-S95 VanDerWaalsContact C-N 3.33Å; Y93-S95 PolarHBondContact O-N 2.68Å; S95-R98 VanDerWaalsContact OG-CB 3.26Å; S95-R98 WeakPolarHBondContact OG-CB 3.5Å; S95-R98 PolarHBondContact OG-N 2.76Å; S95-R98 PolarHBondContact OG-O 3.08Å
96	G	95.3	Very high	95.7	Very high	35 Å²	35	55.8 Å²	55.8	36%	0.361	28%	0.284	S	S	.	.	T	Hydrogen-bonded Turn	trans	68.6	31.6	-174.8	0	0	0	0	0	113.9	Y92 Y93 Q94	Y92-G96 PolarHBondContact O-N 3.18Å; Y93-G96 PolarHBondContact O-N 3.14Å; Q94-G96 VanDerWaalsContact C-N 3.32Å
97	G	94.7	Very high	95.2	Very high	15 Å²	15	57.8 Å²	57.8	16%	0.155	29%	0.294	C	S	.	.	S	Bend	trans	125	12.8	168.7	0	0	0	0	0	116.5	Y92	Y92-G97 VanDerWaalsContact CE2-CA 3.45Å; Y92-G97 PolarHBondContact O-N 3.45Å
98	R	95.4	Very high	94.7	Very high	165 Å²	165	57.9 Å²	57.9	62%	0.623	30%	0.295	S	S	*	.			trans	-85.3	115.7	174.3	-56	-178.2	-179.1	-178.8	-1.1	110	Y91 Y92 S95	Y91-R98 HydrophobicContact CE1-CB 4.21Å; Y92-R98 WeakPolarHBondContact CA-O 3.14Å; S95-R98 VanDerWaalsContact OG-CB 3.26Å; S95-R98 WeakPolarHBondContact OG-CB 3.5Å; S95-R98 PolarHBondContact OG-N 2.76Å; S95-R98 PolarHBondContact OG-O 3.08Å
99	L	95.9	Very high	94.3	Very high	11 Å²	11	60.6 Å²	60.6	6%	0.058	31%	0.307	C	S	.	.			trans	-114.5	117	178.8	-169.7	56.5	0	0	0	109.3	Y92 F110 I114 L119 A123 F127	Y92-L99 HydrophobicContact CD2-CB 3.93Å; Y92-L99 HydrophobicContact CD2-CD1 4.49Å; L99-F110 HydrophobicContact CD1-CE1 4.09Å; L99-F110 HydrophobicContact CD1-CZ 3.78Å; L99-F110 HydrophobicContact CG-CE1 4.3Å; L99-F110 HydrophobicContact CG-CZ 4.47Å; L99-I114 HydrophobicContact CD1-CG1 4.49Å; L99-I114 HydrophobicContact CD2-CD1 3.76Å; L99-I114 HydrophobicContact CD2-CG1 3.98Å; L99-I114 HydrophobicContact CD2-CG2 4.18Å; L99-I114 HydrophobicContact CG-CD1 4.34Å; L99-L119 HydrophobicContact CD1-CD1 3.93Å; L99-L119 HydrophobicContact CD2-CD1 3.95Å; L99-A123 HydrophobicContact CD2-CB 4.32Å; L99-F127 HydrophobicContact CD2-CB 4.01Å; L99-F127 HydrophobicContact CG-CB 4.48Å
100	R	94.4	Very high	94.2	Very high	151 Å²	151	60.6 Å²	60.6	57%	0.57	31%	0.307	S	S	*	.			trans	-136	126.5	179	-70.2	-70.5	170.8	149.4	-9.5	109.1	A88 D130	A88-R100 WeakPolarHBondContact CB-O 3.42Å; R100-D130 IonicContact CZ-OD2 3.53Å; R100-D130 IonicContact NE-OD2 2.66Å; R100-D130 PolarHBondContact NE-OD2 3.24Å; R100-D130 IonicContact NH2-OD1 2.77Å; R100-D130 PolarHBondContact NH2-OD1 3.3Å; R100-D130 IonicContact NH2-OD2 3.76Å; R100-D130 PolarHBondContact NH2-OD2 3.03Å
101	R	94.9	Very high	93.9	Very high	65 Å²	65	61 Å²	61	25%	0.245	31%	0.31	C	S	.	.			trans	-66.9	133.4	178.3	-177.4	173.3	58.1	79.4	1.8	110.4	V103 V105 F110 F127 E131	R101-V103 PolarHBondContact O-N 3.37Å; R101-V105 WeakPolarHBondContact CD-O 3.1Å; R101-V105 HydrophobicContact CG-CB 4.41Å; R101-V105 PolarHBondContact NH1-O 2.66Å; R101-F110 HydrophobicContact CB-CD1 3.54Å; R101-F110 HydrophobicContact CB-CE1 3.84Å; R101-F110 HydrophobicContact CB-CG 4.09Å; R101-F110 HydrophobicContact CG-CB 3.77Å; R101-F110 HydrophobicContact CG-CD1 3.68Å; R101-F110 HydrophobicContact CG-CD2 4.46Å; R101-F110 HydrophobicContact CG-CE1 4.39Å; R101-F110 HydrophobicContact CG-CG 3.71Å; R101-F127 HydrophobicContact CB-CE2 3.92Å; R101-E131 WeakPolarHBondContact CB-OE1 3.47Å; R101-E131 IonicContact CZ-OE1 3.91Å; R101-E131 IonicContact CZ-OE2 3.84Å; R101-E131 IonicContact NE-OE1 3.43Å; R101-E131 PolarHBondContact NE-OE1 2.96Å; R101-E131 IonicContact NE-OE2 2.7Å; R101-E131 PolarHBondContact NE-OE2 3.34Å; R101-E131 IonicContact NH2-OE1 3.2Å; R101-E131 IonicContact NH2-OE2 2.93Å; R101-E131 PolarHBondContact NH2-OE2 3.46Å
102	P	95.3	Very high	93.7	Very high	27 Å²	27	61 Å²	61	18%	0.175	31%	0.314	C	S	.	.			trans	-61.7	133.9	168.9	-20.7	32.8	0	0	0	110.5	A88 N104 V105	A88-P102 HydrophobicContact CB-CG 3.96Å; P102-N104 VanDerWaalsContact CB-OD1 3.27Å; P102-N104 WeakPolarHBondContact CB-OD1 3.43Å; P102-N104 PolarHBondContact O-N 2.91Å; P102-V105 HydrophobicContact CB-CB 4.37Å; P102-V105 HydrophobicContact CB-CG2 3.86Å; P102-V105 HydrophobicContact CG-CG2 4.1Å; P102-V105 PolarHBondContact O-N 3.05Å
103	V	91.3	Very high	93.6	Very high	143 Å²	143	60.5 Å²	60.5	87%	0.867	31%	0.312	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.3	-25	-173.5	-64.2	0	0	0	0	114.1	R101	R101-V103 PolarHBondContact O-N 3.37Å
104	N	93	Very high	93.5	Very high	115 Å²	115	60.6 Å²	60.6	62%	0.615	31%	0.313	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88	0.5	178.4	63.6	-35.5	0	0	0	113.8	P102	P102-N104 VanDerWaalsContact CB-OD1 3.27Å; P102-N104 WeakPolarHBondContact CB-OD1 3.43Å; P102-N104 PolarHBondContact O-N 2.91Å
105	V	93.3	Very high	93.4	Very high	3 Å²	3	59.3 Å²	59.3	2%	0.018	31%	0.306	C	S	.	.	S	Bend	trans	-106.8	125.6	179.2	-179.4	0	0	0	0	109.4	P84 S85 R101 P102 M109 F110	P84-V105 HydrophobicContact CB-CG2 3.55Å; S85-V105 WeakPolarHBondContact OG-CG1 3.41Å; R101-V105 WeakPolarHBondContact CD-O 3.1Å; R101-V105 HydrophobicContact CG-CB 4.41Å; R101-V105 PolarHBondContact NH1-O 2.66Å; P102-V105 HydrophobicContact CB-CB 4.37Å; P102-V105 HydrophobicContact CB-CG2 3.86Å; P102-V105 HydrophobicContact CG-CG2 4.1Å; P102-V105 PolarHBondContact O-N 3.05Å; V105-M109 HydrophobicContact CG1-CB 4.35Å; V105-M109 HydrophobicContact CG1-CG 4.33Å; V105-M109 HydrophobicContact CG1-SD 4.48Å; V105-F110 HydrophobicContact CG1-CB 3.83Å; V105-F110 HydrophobicContact CG1-CD2 4.4Å
106	P	91.3	Very high	93.5	Very high	65 Å²	65	59.7 Å²	59.7	42%	0.422	30%	0.303	S	S	.	.			trans	-55.7	147.7	172.6	-27	36.7	0	0	0	113	D108 M109 F110	P106-D108 WeakPolarHBondContact CB-OD1 3.43Å; P106-M109 HydrophobicContact CB-CB 4.18Å; P106-M109 PolarHBondContact O-N 3.17Å; P106-F110 PolarHBondContact O-N 2.89Å
107	L	86.8	Confident	93.6	Very high	42 Å²	42	58 Å²	58	22%	0.22	29%	0.286	C	S	.	.	H	α-helix	trans	-60.2	-48.4	-176.5	179.9	80.2	0	0	0	112.4	F110 S111 F127 E131 F133	L107-F110 PolarHBondContact O-N 3.25Å; L107-S111 WeakPolarHBondContact O-CB 3.27Å; L107-S111 PolarHBondContact O-N 3.26Å; L107-F127 HydrophobicContact CD1-CE1 4.21Å; L107-F127 HydrophobicContact CD1-CZ 3.65Å; L107-E131 HydrophobicContact CD1-CB 4.07Å; L107-E131 HydrophobicContact CD1-CG 3.72Å; L107-F133 HydrophobicContact CD1-CE2 4.03Å; L107-F133 HydrophobicContact CD2-CD2 4.5Å; L107-F133 HydrophobicContact CD2-CE1 4.45Å; L107-F133 HydrophobicContact CD2-CE2 3.31Å; L107-F133 HydrophobicContact CD2-CZ 3.28Å; L107-F133 HydrophobicContact CG-CE2 4.29Å
108	D	86.3	Confident	93.7	Very high	104 Å²	104	61.3 Å²	61.3	56%	0.556	30%	0.297	S	S	*	.	H	α-helix	trans	-56.8	-51.2	178.4	59.6	-38.2	0	0	0	110.7	P106 F110 S111 E112	P106-D108 WeakPolarHBondContact CB-OD1 3.43Å; D108-F110 PolarHBondContact O-N 2.79Å; D108-S111 WeakPolarHBondContact O-CB 3.17Å; D108-S111 PolarHBondContact O-N 2.8Å; D108-S111 VanDerWaalsContact O-N 3.16Å; D108-S111 PolarHBondContact O-OG 2.67Å; D108-E112 PolarHBondContact O-N 2.93Å
109	M	89.9	Confident	93.8	Very high	67 Å²	67	53.8 Å²	53.8	33%	0.33	27%	0.269	S	S	.	.	H	α-helix	trans	-59.6	-45.9	178.4	-176.1	173.8	-70.4	0	0	112.3	N82 V105 P106 S111 E112 E113	N82-M109 HydrophobicContact CB-CG 4.39Å; N82-M109 HydrophobicContact CB-SD 4.26Å; N82-M109 VanDerWaalsContact CG-SD 3.54Å; N82-M109 PolarHBondContact ND2-SD 3.08Å; V105-M109 HydrophobicContact CG1-CB 4.35Å; V105-M109 HydrophobicContact CG1-CG 4.33Å; V105-M109 HydrophobicContact CG1-SD 4.48Å; P106-M109 HydrophobicContact CB-CB 4.18Å; P106-M109 PolarHBondContact O-N 3.17Å; M109-S111 VanDerWaalsContact C-N 3.32Å; M109-S111 PolarHBondContact O-N 3.01Å; M109-E112 PolarHBondContact O-N 2.7Å; M109-E113 WeakPolarHBondContact O-CG 3.36Å; M109-E113 PolarHBondContact O-N 2.9Å
110	F	95.4	Very high	93.6	Very high	0 Å²	0	55.2 Å²	55.2	0%	0	29%	0.287	C	S	.	.	H	α-helix	trans	-66.1	-37.2	178.1	-167.5	-117.8	0	0	0	111.8	A88 I89 L99 R101 V105 P106 L107 D108 E112 E113 I114 F127	A88-F110 HydrophobicContact CB-CE2 3.72Å; A88-F110 HydrophobicContact CB-CZ 3.56Å; I89-F110 HydrophobicContact CD1-CE2 4.26Å; I89-F110 HydrophobicContact CD1-CZ 4.42Å; I89-F110 HydrophobicContact CG1-CE2 4.45Å; L99-F110 HydrophobicContact CD1-CE1 4.09Å; L99-F110 HydrophobicContact CD1-CZ 3.78Å; L99-F110 HydrophobicContact CG-CE1 4.3Å; L99-F110 HydrophobicContact CG-CZ 4.47Å; R101-F110 HydrophobicContact CB-CD1 3.54Å; R101-F110 HydrophobicContact CB-CE1 3.84Å; R101-F110 HydrophobicContact CB-CG 4.09Å; R101-F110 HydrophobicContact CG-CB 3.77Å; R101-F110 HydrophobicContact CG-CD1 3.68Å; R101-F110 HydrophobicContact CG-CD2 4.46Å; R101-F110 HydrophobicContact CG-CE1 4.39Å; R101-F110 HydrophobicContact CG-CG 3.71Å; V105-F110 HydrophobicContact CG1-CB 3.83Å; V105-F110 HydrophobicContact CG1-CD2 4.4Å; P106-F110 PolarHBondContact O-N 2.89Å; L107-F110 PolarHBondContact O-N 3.25Å; D108-F110 PolarHBondContact O-N 2.79Å; F110-E112 VanDerWaalsContact C-N 3.3Å; F110-E112 PolarHBondContact O-N 3.19Å; F110-E113 PolarHBondContact O-N 3.13Å; F110-I114 HydrophobicContact CD1-CD1 3.68Å; F110-I114 HydrophobicContact CD1-CG1 4.25Å; F110-I114 HydrophobicContact CE1-CD1 3.63Å; F110-I114 HydrophobicContact CE1-CG1 4.06Å; F110-I114 HydrophobicContact CZ-CD1 4.4Å; F110-I114 HydrophobicContact CZ-CG1 4.36Å; F110-I114 WeakPolarHBondContact O-CG1 3.37Å; F110-I114 PolarHBondContact O-N 3.04Å; F110-F127 HydrophobicContact CD1-CD2 4.27Å; F110-F127 HydrophobicContact CD1-CE1 4.44Å; F110-F127 AromaticContact CD1-CE2 3.56Å; F110-F127 HydrophobicContact CD1-CE2 3.56Å; F110-F127 AromaticContact CD1-CZ 3.64Å; F110-F127 HydrophobicContact CD1-CZ 3.64Å; F110-F127 HydrophobicContact CE1-CD2 4.14Å; F110-F127 AromaticContact CE1-CE2 3.83Å; F110-F127 HydrophobicContact CE1-CE2 3.83Å; F110-F127 HydrophobicContact CE1-CZ 4.32Å
111	S	91.1	Very high	93.4	Very high	14 Å²	14	52 Å²	52	10%	0.098	29%	0.292	C	S	.	.	H	α-helix	trans	-62.9	-36.4	176.3	83.1	0	0	0	0	112.4	L107 D108 M109 I114 K115 M124	L107-S111 WeakPolarHBondContact O-CB 3.27Å; L107-S111 PolarHBondContact O-N 3.26Å; D108-S111 WeakPolarHBondContact O-CB 3.17Å; D108-S111 PolarHBondContact O-N 2.8Å; D108-S111 VanDerWaalsContact O-N 3.16Å; D108-S111 PolarHBondContact O-OG 2.67Å; M109-S111 VanDerWaalsContact C-N 3.32Å; M109-S111 PolarHBondContact O-N 3.01Å; S111-I114 PolarHBondContact O-N 2.98Å; S111-K115 WeakPolarHBondContact O-CG 3.5Å; S111-K115 PolarHBondContact O-N 3.07Å; S111-M124 WeakPolarHBondContact O-CE 3.37Å
112	E	93.3	Very high	93.1	Very high	106 Å²	106	56.9 Å²	56.9	50%	0.495	32%	0.318	S	S	.	.	H	α-helix	trans	-65.9	-38.5	173.6	-71.1	-175.6	171.2	0	0	112.1	D108 M109 F110 K115 F116	D108-E112 PolarHBondContact O-N 2.93Å; M109-E112 PolarHBondContact O-N 2.7Å; F110-E112 VanDerWaalsContact C-N 3.3Å; F110-E112 PolarHBondContact O-N 3.19Å; E112-K115 PolarHBondContact O-N 3.37Å; E112-F116 WeakPolarHBondContact O-CB 3.33Å; E112-F116 PolarHBondContact O-N 3.45Å
113	E	96.9	Very high	93	Very high	7 Å²	7	56 Å²	56	3%	0.033	31%	0.313	C	S	.	.	H	α-helix	trans	-66.8	-42.5	175.6	-64	-60.7	128	0	0	111.6	R81 N82 M109 F110 K115 F116 Y117	R81-E113 IonicContact CZ-OE1 3.97Å; R81-E113 IonicContact CZ-OE2 3.63Å; R81-E113 VanDerWaalsContact NE-CD 3.27Å; R81-E113 IonicContact NE-OE1 3.56Å; R81-E113 PolarHBondContact NE-OE1 2.91Å; R81-E113 IonicContact NE-OE2 2.94Å; R81-E113 PolarHBondContact NE-OE2 3.42Å; R81-E113 IonicContact NH2-OE1 2.81Å; R81-E113 PolarHBondContact NH2-OE1 3.17Å; R81-E113 IonicContact NH2-OE2 3.78Å; N82-E113 HydrophobicContact CB-CG 4.26Å; M109-E113 WeakPolarHBondContact O-CG 3.36Å; M109-E113 PolarHBondContact O-N 2.9Å; F110-E113 PolarHBondContact O-N 3.13Å; E113-K115 VanDerWaalsContact C-N 3.28Å; E113-K115 PolarHBondContact O-N 3.21Å; E113-F116 PolarHBondContact O-N 3.46Å; E113-Y117 HydrophobicContact CB-CD2 4.38Å; E113-Y117 HydrophobicContact CB-CE2 4.38Å; E113-Y117 WeakPolarHBondContact O-CD2 3.47Å; E113-Y117 PolarHBondContact O-N 3.16Å; E113-Y117 VanDerWaalsContact OE2-CE2 3.29Å; E113-Y117 WeakPolarHBondContact OE2-CE2 3.14Å
114	I	95.6	Very high	92.9	Very high	2 Å²	2	50.3 Å²	50.3	1%	0.01	28%	0.277	C	S	.	.	H	α-helix	trans	-58.4	-43	174.7	-63.1	165.6	0	0	0	110.6	I89 L99 F110 S111 E118 L119 M124 F127	I89-I114 HydrophobicContact CD1-CG1 4.18Å; L99-I114 HydrophobicContact CD1-CG1 4.49Å; L99-I114 HydrophobicContact CD2-CD1 3.76Å; L99-I114 HydrophobicContact CD2-CG1 3.98Å; L99-I114 HydrophobicContact CD2-CG2 4.18Å; L99-I114 HydrophobicContact CG-CD1 4.34Å; F110-I114 HydrophobicContact CD1-CD1 3.68Å; F110-I114 HydrophobicContact CD1-CG1 4.25Å; F110-I114 HydrophobicContact CE1-CD1 3.63Å; F110-I114 HydrophobicContact CE1-CG1 4.06Å; F110-I114 HydrophobicContact CZ-CD1 4.4Å; F110-I114 HydrophobicContact CZ-CG1 4.36Å; F110-I114 WeakPolarHBondContact O-CG1 3.37Å; F110-I114 PolarHBondContact O-N 3.04Å; S111-I114 PolarHBondContact O-N 2.98Å; I114-E118 PolarHBondContact O-N 3.01Å; I114-L119 HydrophobicContact CG2-CB 4.03Å; I114-L119 HydrophobicContact CG2-CD1 4.2Å; I114-L119 HydrophobicContact CG2-CG 4.31Å; I114-L119 PolarHBondContact O-N 3.18Å; I114-M124 HydrophobicContact CB-CE 3.71Å; I114-M124 HydrophobicContact CD1-CE 4.5Å; I114-M124 HydrophobicContact CG2-CB 4.45Å; I114-M124 HydrophobicContact CG2-CE 3.51Å; I114-M124 HydrophobicContact CG2-SD 4.47Å; I114-F127 HydrophobicContact CD1-CB 4.21Å; I114-F127 HydrophobicContact CD1-CD1 3.43Å; I114-F127 VanDerWaalsContact CD1-CD1 3.43Å; I114-F127 HydrophobicContact CD1-CD2 4.02Å; I114-F127 HydrophobicContact CD1-CE1 3.7Å; I114-F127 HydrophobicContact CD1-CE2 4.28Å; I114-F127 HydrophobicContact CD1-CG 3.58Å; I114-F127 HydrophobicContact CD1-CZ 4.12Å
115	K	95.4	Very high	92.5	Very high	72 Å²	72	48.9 Å²	48.9	31%	0.313	27%	0.267	S	S	.	.	H	α-helix	trans	-63.4	-47.2	175	-71.6	176.6	-175.5	179.1	0	111.2	S111 E112 E113 E118 M124	S111-K115 WeakPolarHBondContact O-CG 3.5Å; S111-K115 PolarHBondContact O-N 3.07Å; E112-K115 PolarHBondContact O-N 3.37Å; E113-K115 VanDerWaalsContact C-N 3.28Å; E113-K115 PolarHBondContact O-N 3.21Å; K115-E118 WeakPolarHBondContact O-CA 3.34Å; K115-E118 PolarHBondContact O-N 3.43Å; K115-E118 VanDerWaalsContact O-N 3.08Å; K115-M124 HydrophobicContact CG-CE 3.69Å
116	F	97.3	Very high	92.3	Very high	44 Å²	44	54.4 Å²	54.4	19%	0.193	29%	0.29	C	S	.	.	H	α-helix	trans	-63	-44.4	-177.8	172.4	-98.2	0	0	0	113.1	L59 Y69 F79 R81 E112 E113 E118	L59-F116 HydrophobicContact CD1-CE1 4.1Å; L59-F116 HydrophobicContact CD1-CE2 4.45Å; L59-F116 HydrophobicContact CD1-CZ 4.04Å; L59-F116 WeakPolarHBondContact CD1-O 3.45Å; Y69-F116 HydrophobicContact CE1-CZ 4.18Å; Y69-F116 AromaticContact CZ-CZ 4Å; F79-F116 AromaticContact CD1-CE1 3.63Å; F79-F116 HydrophobicContact CD1-CE1 3.63Å; F79-F116 AromaticContact CD1-CZ 3.78Å; F79-F116 HydrophobicContact CD1-CZ 3.78Å; F79-F116 AromaticContact CE1-CE1 3.89Å; F79-F116 HydrophobicContact CE1-CE1 3.89Å; F79-F116 HydrophobicContact CE1-CZ 4.02Å; R81-F116 HydrophobicContact CG-CE1 4.42Å; R81-F116 VanDerWaalsContact CZ-CB 3.49Å; R81-F116 VanDerWaalsContact NE-CD1 3.35Å; R81-F116 VanDerWaalsContact NH1-CE2 3.33Å; E112-F116 WeakPolarHBondContact O-CB 3.33Å; E112-F116 PolarHBondContact O-N 3.45Å; E113-F116 PolarHBondContact O-N 3.46Å; F116-E118 PolarHBondContact O-N 3.43Å
117	Y	98	Very high	92.2	Very high	0 Å²	0	51.5 Å²	51.5	0%	0	27%	0.271	C	S	.	.	T	Hydrogen-bonded Turn	trans	-76.6	1.3	176.8	-69.2	-69	0	0	0	113	L59 L60 F79 F86 I89 E113 L119	L59-Y117 WeakPolarHBondContact CB-O 3.48Å; L59-Y117 PolarHBondContact N-O 2.83Å; L60-Y117 HydrophobicContact CD1-CD1 4.04Å; L60-Y117 HydrophobicContact CD1-CE1 4.36Å; L60-Y117 HydrophobicContact CD2-CD1 4.43Å; L60-Y117 HydrophobicContact CD2-CE1 4.48Å; L60-Y117 HydrophobicContact CG-CD1 4.03Å; L60-Y117 HydrophobicContact CG-CE1 4.49Å; F79-Y117 HydrophobicContact CD1-CE1 4.23Å; F79-Y117 HydrophobicContact CE1-CE1 4.23Å; F79-Y117 HydrophobicContact CG-CE1 4.44Å; F79-Y117 HydrophobicContact CZ-CE1 4.44Å; F86-Y117 HydrophobicContact CD2-CE1 4.09Å; F86-Y117 AromaticContact CD2-CE2 3.87Å; F86-Y117 HydrophobicContact CD2-CE2 3.87Å; F86-Y117 AromaticContact CD2-CZ 3.51Å; F86-Y117 WeakPolarHBondContact CD2-OH 3.38Å; F86-Y117 HydrophobicContact CE2-CD1 4.42Å; F86-Y117 AromaticContact CE2-CE1 3.7Å; F86-Y117 HydrophobicContact CE2-CE1 3.7Å; F86-Y117 HydrophobicContact CE2-CE2 4.27Å; F86-Y117 AromaticContact CE2-CZ 3.64Å; I89-Y117 HydrophobicContact CB-CD2 4.3Å; I89-Y117 HydrophobicContact CD1-CD2 4.05Å; I89-Y117 HydrophobicContact CG1-CD2 3.8Å; I89-Y117 HydrophobicContact CG1-CE2 4.13Å; I89-Y117 HydrophobicContact CG2-CD1 4.39Å; I89-Y117 HydrophobicContact CG2-CD2 3.7Å; I89-Y117 HydrophobicContact CG2-CE2 4.27Å; I89-Y117 HydrophobicContact CG2-CG 3.79Å; E113-Y117 HydrophobicContact CB-CD2 4.38Å; E113-Y117 HydrophobicContact CB-CE2 4.38Å; E113-Y117 WeakPolarHBondContact O-CD2 3.47Å; E113-Y117 PolarHBondContact O-N 3.16Å; E113-Y117 VanDerWaalsContact OE2-CE2 3.29Å; E113-Y117 WeakPolarHBondContact OE2-CE2 3.14Å; Y117-L119 VanDerWaalsContact C-N 3.31Å; Y117-L119 PolarHBondContact O-N 2.76Å
118	E	97.4	Very high	92.1	Very high	84 Å²	84	53.9 Å²	53.9	39%	0.393	28%	0.277	S	S	.	.	T	Hydrogen-bonded Turn	trans	54.7	44	175.2	-57.6	176.4	-150.6	0	0	112.1	T58 L59 K65 I114 K115 F116 G120	T58-E118 WeakPolarHBondContact CA-O 3.48Å; L59-E118 HydrophobicContact CB-CB 4.46Å; L59-E118 HydrophobicContact CB-CG 4.45Å; K65-E118 WeakPolarHBondContact CD-OE2 3.35Å; K65-E118 WeakPolarHBondContact CE-OE2 3.49Å; K65-E118 IonicContact NZ-OE2 2.82Å; K65-E118 PolarHBondContact NZ-OE2 3.37Å; I114-E118 PolarHBondContact O-N 3.01Å; K115-E118 WeakPolarHBondContact O-CA 3.34Å; K115-E118 PolarHBondContact O-N 3.43Å; K115-E118 VanDerWaalsContact O-N 3.08Å; F116-E118 PolarHBondContact O-N 3.43Å; E118-G120 PolarHBondContact O-N 3.3Å
119	L	96.4	Very high	91.9	Very high	8 Å²	8	54 Å²	54	4%	0.042	27%	0.274	C	S	.	.			trans	-64.3	-11.9	-178.2	-60.5	-168.5	0	0	0	113.8	T58 I89 Y92 Y93 L99 I114 Y117 A123	T58-L119 HydrophobicContact CG2-CD2 4.22Å; I89-L119 HydrophobicContact CD1-CD1 3.76Å; Y92-L119 HydrophobicContact CD1-CD1 4.12Å; Y92-L119 HydrophobicContact CD1-CD2 3.96Å; Y92-L119 HydrophobicContact CE1-CD1 4.49Å; Y92-L119 HydrophobicContact CE1-CD2 4.08Å; Y92-L119 HydrophobicContact CG-CD1 4.17Å; Y93-L119 HydrophobicContact CE2-CD2 3.94Å; Y93-L119 WeakPolarHBondContact OH-CD2 3.37Å; L99-L119 HydrophobicContact CD1-CD1 3.93Å; L99-L119 HydrophobicContact CD2-CD1 3.95Å; I114-L119 HydrophobicContact CG2-CB 4.03Å; I114-L119 HydrophobicContact CG2-CD1 4.2Å; I114-L119 HydrophobicContact CG2-CG 4.31Å; I114-L119 PolarHBondContact O-N 3.18Å; Y117-L119 VanDerWaalsContact C-N 3.31Å; Y117-L119 PolarHBondContact O-N 2.76Å; L119-A123 HydrophobicContact CB-CB 3.97Å; L119-A123 WeakPolarHBondContact O-CB 3.41Å
120	G	92.6	Very high	91.6	Very high	41 Å²	41	54.3 Å²	54.3	42%	0.423	28%	0.277	S	S	.	.			trans	100.9	162.6	175.9	0	0	0	0	0	113.6	E118 E122 A123 M124	E118-G120 PolarHBondContact O-N 3.3Å; G120-E122 VanDerWaalsContact C-N 3.34Å; G120-A123 PolarHBondContact O-N 2.96Å; G120-M124 PolarHBondContact O-N 2.68Å; G120-M124 VanDerWaalsContact O-N 3.13Å
121	A	89.7	Confident	91.1	Very high	84 Å²	84	57 Å²	57	69%	0.694	29%	0.29	S	S	*	.	H	α-helix	trans	-64.7	-38.3	-179.6	0	0	0	0	0	112.2	M124 E125	A121-M124 PolarHBondContact O-N 3.02Å; A121-E125 WeakPolarHBondContact O-CB 3.06Å; A121-E125 PolarHBondContact O-N 3.43Å
122	E	89.9	Confident	90.1	Very high	167 Å²	167	57.6 Å²	57.6	78%	0.78	30%	0.298	S	S	*	.	H	α-helix	trans	-63.5	-44.1	178.8	-171.8	-178.4	175.1	0	0	112	G120 E125 K126	G120-E122 VanDerWaalsContact C-N 3.34Å; E122-E125 PolarHBondContact O-N 3.02Å; E122-K126 WeakPolarHBondContact O-CB 3.39Å; E122-K126 PolarHBondContact O-N 3.49Å
123	A	91.9	Very high	89.1	Confident	8 Å²	8	56.1 Å²	56.1	7%	0.066	29%	0.29	C	S	.	.	H	α-helix	trans	-65.7	-39.6	176.4	0	0	0	0	0	111.9	Y92 L99 L119 G120 F127	Y92-A123 HydrophobicContact CE2-CB 3.98Å; L99-A123 HydrophobicContact CD2-CB 4.32Å; L119-A123 HydrophobicContact CB-CB 3.97Å; L119-A123 WeakPolarHBondContact O-CB 3.41Å; G120-A123 PolarHBondContact O-N 2.96Å; A123-F127 VanDerWaalsContact O-CB 3.25Å; A123-F127 WeakPolarHBondContact O-CB 3.39Å; A123-F127 PolarHBondContact O-N 2.83Å
124	M	89.4	Confident	87.5	Confident	23 Å²	23	61.1 Å²	61.1	11%	0.113	32%	0.316	C	S	.	.	H	α-helix	trans	-65.1	-41	175	177.6	60.9	71.7	0	0	112.2	S111 I114 K115 G120 A121 F127 R128	S111-M124 WeakPolarHBondContact O-CE 3.37Å; I114-M124 HydrophobicContact CB-CE 3.71Å; I114-M124 HydrophobicContact CD1-CE 4.5Å; I114-M124 HydrophobicContact CG2-CB 4.45Å; I114-M124 HydrophobicContact CG2-CE 3.51Å; I114-M124 HydrophobicContact CG2-SD 4.47Å; K115-M124 HydrophobicContact CG-CE 3.69Å; G120-M124 PolarHBondContact O-N 2.68Å; G120-M124 VanDerWaalsContact O-N 3.13Å; A121-M124 PolarHBondContact O-N 3.02Å; M124-F127 PolarHBondContact O-N 3Å; M124-F127 HydrophobicContact SD-CD1 4.01Å; M124-R128 VanDerWaalsContact O-CG 3.31Å; M124-R128 WeakPolarHBondContact O-CG 3.38Å; M124-R128 PolarHBondContact O-N 3.27Å; M124-R128 HydrophobicContact SD-CG 4.47Å
125	E	85.6	Confident	85.7	Confident	85 Å²	85	68 Å²	68	40%	0.397	34%	0.342	S	S	.	.	H	α-helix	trans	-65.8	-48	178	-173.4	168.2	-152.4	0	0	110.7	A121 E122 F127 R128 E129 R135	A121-E125 WeakPolarHBondContact O-CB 3.06Å; A121-E125 PolarHBondContact O-N 3.43Å; E122-E125 PolarHBondContact O-N 3.02Å; E125-F127 VanDerWaalsContact C-N 3.29Å; E125-F127 PolarHBondContact O-N 3.41Å; E125-R128 WeakPolarHBondContact O-CB 3.37Å; E125-R128 PolarHBondContact O-N 3.35Å; E125-R128 VanDerWaalsContact O-N 3.1Å; E125-E129 WeakPolarHBondContact O-CG 3.38Å; E125-E129 PolarHBondContact O-N 3.37Å; E125-R135 IonicContact OE1-NH1 2.85Å
126	K	87.5	Confident	84	Confident	119 Å²	119	71.6 Å²	71.6	52%	0.517	36%	0.36	S	S	.	.	H	α-helix	trans	-61.1	-37.9	176.1	-165.7	176.1	-173.2	174.6	0	112.8	E122 D130	E122-K126 WeakPolarHBondContact O-CB 3.39Å; E122-K126 PolarHBondContact O-N 3.49Å; K126-D130 WeakPolarHBondContact O-CB 3.25Å; K126-D130 PolarHBondContact O-N 3.31Å
127	F	89.4	Confident	82.2	Confident	4 Å²	4	78 Å²	78	2%	0.018	39%	0.391	C	S	.	.	H	α-helix	trans	-62.9	-45.1	173	165.2	-110.2	0	0	0	112.1	L99 R101 L107 F110 I114 A123 M124 E125 D130 E131	L99-F127 HydrophobicContact CD2-CB 4.01Å; L99-F127 HydrophobicContact CG-CB 4.48Å; R101-F127 HydrophobicContact CB-CE2 3.92Å; L107-F127 HydrophobicContact CD1-CE1 4.21Å; L107-F127 HydrophobicContact CD1-CZ 3.65Å; F110-F127 HydrophobicContact CD1-CD2 4.27Å; F110-F127 HydrophobicContact CD1-CE1 4.44Å; F110-F127 AromaticContact CD1-CE2 3.56Å; F110-F127 HydrophobicContact CD1-CE2 3.56Å; F110-F127 AromaticContact CD1-CZ 3.64Å; F110-F127 HydrophobicContact CD1-CZ 3.64Å; F110-F127 HydrophobicContact CE1-CD2 4.14Å; F110-F127 AromaticContact CE1-CE2 3.83Å; F110-F127 HydrophobicContact CE1-CE2 3.83Å; F110-F127 HydrophobicContact CE1-CZ 4.32Å; I114-F127 HydrophobicContact CD1-CB 4.21Å; I114-F127 HydrophobicContact CD1-CD1 3.43Å; I114-F127 VanDerWaalsContact CD1-CD1 3.43Å; I114-F127 HydrophobicContact CD1-CD2 4.02Å; I114-F127 HydrophobicContact CD1-CE1 3.7Å; I114-F127 HydrophobicContact CD1-CE2 4.28Å; I114-F127 HydrophobicContact CD1-CG 3.58Å; I114-F127 HydrophobicContact CD1-CZ 4.12Å; A123-F127 VanDerWaalsContact O-CB 3.25Å; A123-F127 WeakPolarHBondContact O-CB 3.39Å; A123-F127 PolarHBondContact O-N 2.83Å; M124-F127 PolarHBondContact O-N 3Å; M124-F127 HydrophobicContact SD-CD1 4.01Å; E125-F127 VanDerWaalsContact C-N 3.29Å; E125-F127 PolarHBondContact O-N 3.41Å; F127-D130 PolarHBondContact O-N 3.48Å; F127-E131 HydrophobicContact CD2-CG 3.9Å; F127-E131 HydrophobicContact CE1-CG 4.46Å; F127-E131 HydrophobicContact CE2-CG 3.33Å; F127-E131 WeakPolarHBondContact CE2-OE1 3.36Å; F127-E131 HydrophobicContact CZ-CG 3.69Å; F127-E131 WeakPolarHBondContact O-CG 3.31Å; F127-E131 PolarHBondContact O-N 2.96Å
128	R	84.6	Confident	80.6	Confident	92 Å²	92	84.9 Å²	84.9	35%	0.347	42%	0.423	S	S	.	.	H	α-helix	trans	-59.3	-47.6	176.1	-78.4	174.8	-179.5	-133	-0.9	111.2	M124 E125 D130 E131 G132 F133	M124-R128 VanDerWaalsContact O-CG 3.31Å; M124-R128 WeakPolarHBondContact O-CG 3.38Å; M124-R128 PolarHBondContact O-N 3.27Å; M124-R128 HydrophobicContact SD-CG 4.47Å; E125-R128 WeakPolarHBondContact O-CB 3.37Å; E125-R128 PolarHBondContact O-N 3.35Å; E125-R128 VanDerWaalsContact O-N 3.1Å; R128-D130 PolarHBondContact O-N 3.1Å; R128-E131 PolarHBondContact O-N 3.34Å; R128-G132 PolarHBondContact O-N 2.93Å; R128-F133 CarbonylContact C-O 3.56Å; R128-F133 HydrophobicContact CB-CB 3.94Å; R128-F133 HydrophobicContact CG-CB 4.47Å; R128-F133 WeakPolarHBondContact O-CA 3.3Å; R128-F133 VanDerWaalsContact O-CB 3.3Å; R128-F133 WeakPolarHBondContact O-CB 3.49Å; R128-F133 PolarHBondContact O-N 3.43Å
129	E	82.3	Confident	79.4	Confident	106 Å²	106	87.4 Å²	87.4	50%	0.495	43%	0.432	S	S	.	.	H	α-helix	trans	-59.5	-45.8	177.4	-70	-179.7	170.3	0	0	112.1	E125 E131 G132	E125-E129 WeakPolarHBondContact O-CG 3.38Å; E125-E129 PolarHBondContact O-N 3.37Å; E129-E131 VanDerWaalsContact C-N 3.31Å; E129-E131 PolarHBondContact O-N 3.46Å; E129-G132 PolarHBondContact O-N 3.31Å
130	D	84.7	Confident	78.6	Confident	74 Å²	74	91.4 Å²	91.4	40%	0.396	46%	0.459	S	S	.	.	H	α-helix	trans	-65.3	-30.3	179	-90.3	-9.2	0	0	0	113	R100 K126 F127 R128 G132	R100-D130 IonicContact CZ-OD2 3.53Å; R100-D130 IonicContact NE-OD2 2.66Å; R100-D130 PolarHBondContact NE-OD2 3.24Å; R100-D130 IonicContact NH2-OD1 2.77Å; R100-D130 PolarHBondContact NH2-OD1 3.3Å; R100-D130 IonicContact NH2-OD2 3.76Å; R100-D130 PolarHBondContact NH2-OD2 3.03Å; K126-D130 WeakPolarHBondContact O-CB 3.25Å; K126-D130 PolarHBondContact O-N 3.31Å; F127-D130 PolarHBondContact O-N 3.48Å; R128-D130 PolarHBondContact O-N 3.1Å; D130-G132 VanDerWaalsContact C-N 3.26Å
131	E	83.1	Confident	78.2	Confident	56 Å²	56	92.8 Å²	92.8	26%	0.262	46%	0.456	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.5	0.1	173.5	-69.3	-73.8	162.3	0	0	113	R101 L107 F127 R128 E129 F133	R101-E131 WeakPolarHBondContact CB-OE1 3.47Å; R101-E131 IonicContact CZ-OE1 3.91Å; R101-E131 IonicContact CZ-OE2 3.84Å; R101-E131 IonicContact NE-OE1 3.43Å; R101-E131 PolarHBondContact NE-OE1 2.96Å; R101-E131 IonicContact NE-OE2 2.7Å; R101-E131 PolarHBondContact NE-OE2 3.34Å; R101-E131 IonicContact NH2-OE1 3.2Å; R101-E131 IonicContact NH2-OE2 2.93Å; R101-E131 PolarHBondContact NH2-OE2 3.46Å; L107-E131 HydrophobicContact CD1-CB 4.07Å; L107-E131 HydrophobicContact CD1-CG 3.72Å; F127-E131 HydrophobicContact CD2-CG 3.9Å; F127-E131 HydrophobicContact CE1-CG 4.46Å; F127-E131 HydrophobicContact CE2-CG 3.33Å; F127-E131 WeakPolarHBondContact CE2-OE1 3.36Å; F127-E131 HydrophobicContact CZ-CG 3.69Å; F127-E131 WeakPolarHBondContact O-CG 3.31Å; F127-E131 PolarHBondContact O-N 2.96Å; R128-E131 PolarHBondContact O-N 3.34Å; E129-E131 VanDerWaalsContact C-N 3.31Å; E129-E131 PolarHBondContact O-N 3.46Å; E131-F133 HydrophobicContact CB-CD2 3.81Å; E131-F133 HydrophobicContact CB-CE2 3.98Å
132	G	71.6	Confident	78.2	Confident	27 Å²	27	89.1 Å²	89.1	28%	0.278	43%	0.425	S	S	.	.	T	Hydrogen-bonded Turn	trans	91.8	5.4	177.9	0	0	0	0	0	115	R128 E129 D130 I134	R128-G132 PolarHBondContact O-N 2.93Å; E129-G132 PolarHBondContact O-N 3.31Å; D130-G132 VanDerWaalsContact C-N 3.26Å; G132-I134 VanDerWaalsContact C-N 3.29Å; G132-I134 PolarHBondContact O-N 2.98Å
133	F	71.4	Confident	78.1	Confident	75 Å²	75	90.6 Å²	90.6	33%	0.329	43%	0.432	S	S	.	.			trans	-81.5	77.4	170.3	-61	-87.8	0	0	0	109.9	L107 R128 E131 R135 Q421	L107-F133 HydrophobicContact CD1-CE2 4.03Å; L107-F133 HydrophobicContact CD2-CD2 4.5Å; L107-F133 HydrophobicContact CD2-CE1 4.45Å; L107-F133 HydrophobicContact CD2-CE2 3.31Å; L107-F133 HydrophobicContact CD2-CZ 3.28Å; L107-F133 HydrophobicContact CG-CE2 4.29Å; R128-F133 CarbonylContact C-O 3.56Å; R128-F133 HydrophobicContact CB-CB 3.94Å; R128-F133 HydrophobicContact CG-CB 4.47Å; R128-F133 WeakPolarHBondContact O-CA 3.3Å; R128-F133 VanDerWaalsContact O-CB 3.3Å; R128-F133 WeakPolarHBondContact O-CB 3.49Å; R128-F133 PolarHBondContact O-N 3.43Å; E131-F133 HydrophobicContact CB-CD2 3.81Å; E131-F133 HydrophobicContact CB-CE2 3.98Å; F133-R135 PolarHBondContact O-N 3.05Å; F133-Q421 VanDerWaalsContact CZ-OE1 3.22Å
134	I	63	Low	78.1	Confident	113 Å²	113	96.9 Å²	96.9	58%	0.579	46%	0.458	S	S	*	.			trans	-66.8	128.3	169.1	-56.7	168.5	0	0	0	107.4	G132 E136	G132-I134 VanDerWaalsContact C-N 3.29Å; G132-I134 PolarHBondContact O-N 2.98Å; I134-E136 PolarHBondContact O-N 3.03Å
135	R	59	Low	78.1	Confident	146 Å²	146	103.1 Å²	103.1	55%	0.551	49%	0.487	S	S	*	.			trans	-45.7	125.6	175.8	-175	173.1	175.1	169	-2.3	109.8	E125 F133 E137 E138	E125-R135 IonicContact OE1-NH1 2.85Å; F133-R135 PolarHBondContact O-N 3.05Å; R135-E137 PolarHBondContact O-N 3.25Å; R135-E138 IonicContact CZ-OE1 2.9Å; R135-E138 IonicContact NE-OE1 3.25Å; R135-E138 IonicContact NH2-OE1 3.19Å; R135-E138 PolarHBondContact NH2-OE1 3.42Å
136	E	59.3	Low	78.4	Confident	148 Å²	148	106.3 Å²	106.3	69%	0.692	50%	0.5	S	S	*	.			trans	-55.8	114.9	163.9	-75	-175.4	-177.8	0	0	106.6	I134 E138	I134-E136 PolarHBondContact O-N 3.03Å; E136-E138 PolarHBondContact O-N 3.46Å
137	E	59	Low	78.6	Confident	178 Å²	178	103.5 Å²	103.5	83%	0.832	49%	0.488	S	S	*	.			trans	-51.1	114.1	172.2	-84.3	-176.4	154.9	0	0	107.2	R135 K139	R135-E137 PolarHBondContact O-N 3.25Å; E137-K139 PolarHBondContact O-N 2.81Å
138	E	64.3	Low	78.8	Confident	145 Å²	145	109.1 Å²	109.1	68%	0.678	51%	0.509	S	S	*	.			trans	-56.5	108.8	178.5	-85	175.4	-146.1	0	0	107.6	R135 E136 P140	R135-E138 IonicContact CZ-OE1 2.9Å; R135-E138 IonicContact NE-OE1 3.25Å; R135-E138 IonicContact NH2-OE1 3.19Å; R135-E138 PolarHBondContact NH2-OE1 3.42Å; E136-E138 PolarHBondContact O-N 3.46Å; E138-P140 WeakPolarHBondContact O-CD 3.41Å
139	K	72.5	Confident	79.2	Confident	136 Å²	136	110.7 Å²	110.7	59%	0.591	52%	0.521	S	S	*	.			trans	-66	113.2	-175.3	-59.2	-179.6	-169.9	168.9	0	106.9	E137 L141 Y156	E137-K139 PolarHBondContact O-N 2.81Å; K139-L141 PolarHBondContact O-N 3.3Å; K139-Y156 VanDerWaalsContact CB-OH 3.23Å; K139-Y156 WeakPolarHBondContact CB-OH 3.4Å; K139-Y156 HydrophobicContact CD-CE1 3.66Å; K139-Y156 WeakPolarHBondContact CD-OH 3.45Å
140	P	78.8	Confident	79.8	Confident	92 Å²	92	107 Å²	107	60%	0.597	51%	0.505	S	S	*	.	P	Polyproline II helix	trans	-61.6	130.9	-174.1	23.5	-32.6	0	0	0	109.2	E138 P239	E138-P140 WeakPolarHBondContact O-CD 3.41Å; P140-P239 HydrophobicContact CB-CB 4.3Å; P140-P239 HydrophobicContact CB-CG 4.22Å; P140-P239 HydrophobicContact CG-CG 4.06Å; P140-P239 WeakPolarHBondContact O-CG 3.12Å
141	L	85.9	Confident	80.2	Confident	71 Å²	71	104.2 Å²	104.2	37%	0.372	49%	0.49	S	S	.	.	P	Polyproline II helix	trans	-96.9	146	175	-67.2	174	0	0	0	109.6	K139 L152	K139-L141 PolarHBondContact O-N 3.3Å; L141-L152 HydrophobicContact CD2-CD2 4.25Å
142	P	89.1	Confident	80.6	Confident	6 Å²	6	104.1 Å²	104.1	4%	0.039	49%	0.49	C	S	.	.	P	Polyproline II helix	trans	-59.2	139.5	171.8	-21	31.9	0	0	0	111.1	K144 Q147 R148 W151 A237 P239	P142-K144 PolarHBondContact O-N 2.92Å; P142-Q147 HydrophobicContact CB-CB 3.76Å; P142-Q147 HydrophobicContact CG-CB 4.37Å; P142-R148 HydrophobicContact CB-CB 4.48Å; P142-W151 HydrophobicContact CG-CB 3.85Å; P142-W151 HydrophobicContact CG-CG 3.94Å; P142-A237 WeakPolarHBondContact CG-O 3.47Å; P142-P239 HydrophobicContact CG-CB 4.48Å
143	E	87.1	Confident	81.6	Confident	199 Å²	199	105.1 Å²	105.1	93%	0.93	49%	0.489	S	S	*	.	S	Bend	trans	-66.6	-36.6	179.9	-64.3	178.1	176.4	0	0	112.3
144	K	91.8	Very high	82.7	Confident	139 Å²	139	102.5 Å²	102.5	60%	0.604	48%	0.478	S	S	*	.	S	Bend	trans	-78.3	129.5	-178.2	-62.8	-177.7	-177.5	178.1	0	110.6	P142 F146 Q147 R148	P142-K144 PolarHBondContact O-N 2.92Å; K144-F146 PolarHBondContact O-N 3.37Å; K144-Q147 HydrophobicContact CB-CB 4.18Å; K144-Q147 HydrophobicContact CB-CG 4.15Å; K144-Q147 PolarHBondContact O-N 3.01Å; K144-Q147 VanDerWaalsContact O-N 3.11Å; K144-R148 WeakPolarHBondContact O-CB 3.36Å; K144-R148 PolarHBondContact O-N 3.39Å
145	E	91.1	Very high	84	Confident	154 Å²	154	98.4 Å²	98.4	72%	0.72	46%	0.456	S	S	*	.	H	α-helix	trans	-56.3	-45	-176.7	-67.1	-166.9	157.7	0	0	113.7	Q147 R148 Q149	E145-Q147 PolarHBondContact O-N 3.18Å; E145-R148 WeakPolarHBondContact O-CB 3.36Å; E145-R148 PolarHBondContact O-N 3.29Å; E145-Q149 WeakPolarHBondContact O-CG 2.95Å; E145-Q149 PolarHBondContact O-N 2.85Å
146	F	91.6	Very high	85.4	Confident	152 Å²	152	94.2 Å²	94.2	67%	0.667	44%	0.441	S	S	*	.	H	α-helix	trans	-62.7	-44.5	178	-179.8	-101	0	0	0	112	K144 R148 Q149 V150	K144-F146 PolarHBondContact O-N 3.37Å; F146-R148 VanDerWaalsContact C-N 3.31Å; F146-R148 PolarHBondContact O-N 3.27Å; F146-Q149 PolarHBondContact O-N 3.18Å; F146-V150 HydrophobicContact CD1-CG2 4.37Å; F146-V150 HydrophobicContact CE1-CG2 3.94Å; F146-V150 HydrophobicContact CE2-CG2 4.19Å; F146-V150 HydrophobicContact CZ-CG2 3.84Å; F146-V150 WeakPolarHBondContact O-CG2 3.33Å; F146-V150 PolarHBondContact O-N 3.45Å
147	Q	91.9	Very high	86.7	Confident	60 Å²	60	88.9 Å²	88.9	28%	0.28	42%	0.419	S	S	.	.	H	α-helix	trans	-63.9	-40	176.9	-69.6	179.8	-21.4	0	0	110.9	P142 K144 E145 V150 W151	P142-Q147 HydrophobicContact CB-CB 3.76Å; P142-Q147 HydrophobicContact CG-CB 4.37Å; K144-Q147 HydrophobicContact CB-CB 4.18Å; K144-Q147 HydrophobicContact CB-CG 4.15Å; K144-Q147 PolarHBondContact O-N 3.01Å; K144-Q147 VanDerWaalsContact O-N 3.11Å; E145-Q147 PolarHBondContact O-N 3.18Å; Q147-V150 PolarHBondContact O-N 3.17Å; Q147-W151 WeakPolarHBondContact O-CB 3.42Å; Q147-W151 PolarHBondContact O-N 3.11Å
148	R	93	Very high	87.9	Confident	122 Å²	122	86.7 Å²	86.7	46%	0.46	41%	0.409	S	S	.	.	H	α-helix	trans	-61.9	-45	175.8	-176.2	179.5	172.2	-174.1	1.9	111.9	P142 K144 E145 F146 W151 L152	P142-R148 HydrophobicContact CB-CB 4.48Å; K144-R148 WeakPolarHBondContact O-CB 3.36Å; K144-R148 PolarHBondContact O-N 3.39Å; E145-R148 WeakPolarHBondContact O-CB 3.36Å; E145-R148 PolarHBondContact O-N 3.29Å; F146-R148 VanDerWaalsContact C-N 3.31Å; F146-R148 PolarHBondContact O-N 3.27Å; R148-W151 PolarHBondContact O-N 3.08Å; R148-L152 HydrophobicContact CG-CD1 4.15Å; R148-L152 WeakPolarHBondContact O-CB 3.39Å; R148-L152 VanDerWaalsContact O-CG 3.24Å; R148-L152 WeakPolarHBondContact O-CG 3.44Å; R148-L152 PolarHBondContact O-N 3.44Å
149	Q	92.5	Very high	89	Confident	126 Å²	126	82.2 Å²	82.2	59%	0.589	39%	0.393	S	S	*	.	H	α-helix	trans	-61.7	-47.3	177	-74.2	176.5	-3.3	0	0	111.7	E145 F146 L152 L153	E145-Q149 WeakPolarHBondContact O-CG 2.95Å; E145-Q149 PolarHBondContact O-N 2.85Å; F146-Q149 PolarHBondContact O-N 3.18Å; Q149-L152 PolarHBondContact O-N 3.07Å; Q149-L153 WeakPolarHBondContact O-CB 3.2Å; Q149-L153 PolarHBondContact O-N 3.32Å
150	V	94.3	Very high	90	Very high	28 Å²	28	77.9 Å²	77.9	17%	0.17	38%	0.38	C	S	.	.	H	α-helix	trans	-64.4	-41.2	177.5	175	0	0	0	0	111.3	F146 Q147 L153 F154 V233 A237	F146-V150 HydrophobicContact CD1-CG2 4.37Å; F146-V150 HydrophobicContact CE1-CG2 3.94Å; F146-V150 HydrophobicContact CE2-CG2 4.19Å; F146-V150 HydrophobicContact CZ-CG2 3.84Å; F146-V150 WeakPolarHBondContact O-CG2 3.33Å; F146-V150 PolarHBondContact O-N 3.45Å; Q147-V150 PolarHBondContact O-N 3.17Å; V150-L153 WeakPolarHBondContact O-CB 3.3Å; V150-L153 PolarHBondContact O-N 3.43Å; V150-F154 HydrophobicContact CG1-CD2 4.27Å; V150-F154 PolarHBondContact O-N 2.76Å; V150-F154 VanDerWaalsContact O-N 3.12Å; V150-V233 HydrophobicContact CG1-CG1 3.39Å; V150-A237 HydrophobicContact CB-CB 4.12Å; V150-A237 HydrophobicContact CG1-CB 3.78Å
151	W	94.2	Very high	90.7	Very high	16 Å²	16	76.1 Å²	76.1	6%	0.061	38%	0.379	C	S	.	.	H	α-helix	trans	-61.9	-46.5	176.8	-175.7	-108.2	0	0	0	111.5	P142 Q147 R148 L153 F154 E155 Y156 R234 A237 C238	P142-W151 HydrophobicContact CG-CB 3.85Å; P142-W151 HydrophobicContact CG-CG 3.94Å; Q147-W151 WeakPolarHBondContact O-CB 3.42Å; Q147-W151 PolarHBondContact O-N 3.11Å; R148-W151 PolarHBondContact O-N 3.08Å; W151-L153 VanDerWaalsContact C-N 3.29Å; W151-L153 PolarHBondContact O-N 3.48Å; W151-F154 PolarHBondContact O-N 2.91Å; W151-E155 HydrophobicContact CD2-CB 4.14Å; W151-E155 HydrophobicContact CG-CB 4.49Å; W151-E155 HydrophobicContact CH2-CG 4.21Å; W151-E155 HydrophobicContact CZ2-CB 4.23Å; W151-E155 HydrophobicContact CZ2-CG 3.71Å; W151-E155 WeakPolarHBondContact O-CB 3.28Å; W151-E155 PolarHBondContact O-N 3.28Å; W151-Y156 AromaticContact NE1-CE2 3.81Å; W151-R234 HydrophobicContact CZ3-CB 4.12Å; W151-R234 WeakPolarHBondContact CZ3-O 3.19Å; W151-A237 HydrophobicContact CB-CB 4.17Å; W151-A237 HydrophobicContact CE3-CB 4.14Å; W151-C238 VanDerWaalsContact CE3-CA 3.5Å; W151-C238 HydrophobicContact CE3-CB 3.9Å; W151-C238 HydrophobicContact CH2-CB 3.6Å; W151-C238 HydrophobicContact CZ2-CB 4.4Å; W151-C238 VanDerWaalsContact CZ3-CA 3.5Å; W151-C238 HydrophobicContact CZ3-CB 3.31Å
152	L	91.5	Very high	91.2	Very high	53 Å²	53	77 Å²	77	28%	0.277	39%	0.389	S	S	.	.	H	α-helix	trans	-59.2	-42.2	175.3	-72.6	171	0	0	0	111.8	L141 R148 Q149 F154 Y156 S159	L141-L152 HydrophobicContact CD2-CD2 4.25Å; R148-L152 HydrophobicContact CG-CD1 4.15Å; R148-L152 WeakPolarHBondContact O-CB 3.39Å; R148-L152 VanDerWaalsContact O-CG 3.24Å; R148-L152 WeakPolarHBondContact O-CG 3.44Å; R148-L152 PolarHBondContact O-N 3.44Å; Q149-L152 PolarHBondContact O-N 3.07Å; L152-F154 PolarHBondContact O-N 3.22Å; L152-Y156 HydrophobicContact CD2-CD2 3.86Å; L152-Y156 HydrophobicContact CD2-CE2 4.42Å; L152-Y156 CarbonylContact O-C 3.56Å; L152-Y156 PolarHBondContact O-N 3.46Å; L152-S159 PolarHBondContact O-OG 3.33Å
153	L	93.2	Very high	91.3	Very high	48 Å²	48	76.8 Å²	76.8	25%	0.251	39%	0.387	S	S	.	.	H	α-helix	trans	-64.1	-37.3	-178.6	-172.5	69.5	0	0	0	113.5	Q149 V150 W151 P162 A163 I166	Q149-L153 WeakPolarHBondContact O-CB 3.2Å; Q149-L153 PolarHBondContact O-N 3.32Å; V150-L153 WeakPolarHBondContact O-CB 3.3Å; V150-L153 PolarHBondContact O-N 3.43Å; W151-L153 VanDerWaalsContact C-N 3.29Å; W151-L153 PolarHBondContact O-N 3.48Å; L153-P162 HydrophobicContact CD1-CB 3.84Å; L153-A163 HydrophobicContact CD1-CB 3.99Å; L153-A163 WeakPolarHBondContact O-CB 3.27Å; L153-I166 HydrophobicContact CD1-CD1 3.83Å; L153-I166 HydrophobicContact CD2-CD1 3.65Å; L153-I166 HydrophobicContact CG-CD1 3.53Å
154	F	92.9	Very high	91.7	Very high	20 Å²	20	73.7 Å²	73.7	9%	0.088	37%	0.367	C	S	.	.	H	α-helix	trans	-100.8	-27.1	-175.5	-83.6	-95.1	0	0	0	114.6	V150 W151 L152 I166 F229 E230 V233 R234	V150-F154 HydrophobicContact CG1-CD2 4.27Å; V150-F154 PolarHBondContact O-N 2.76Å; V150-F154 VanDerWaalsContact O-N 3.12Å; W151-F154 PolarHBondContact O-N 2.91Å; L152-F154 PolarHBondContact O-N 3.22Å; F154-I166 HydrophobicContact CD1-CG2 4.2Å; F154-I166 HydrophobicContact CE1-CG2 3.99Å; F154-I166 HydrophobicContact CE2-CD1 4.31Å; F154-I166 HydrophobicContact CZ-CD1 4.37Å; F154-I166 HydrophobicContact CZ-CG2 4.39Å; F154-F229 HydrophobicContact CE1-CD1 4.46Å; F154-F229 AromaticContact CE1-CE1 3.81Å; F154-F229 HydrophobicContact CE1-CE1 3.81Å; F154-F229 HydrophobicContact CE1-CZ 4.45Å; F154-F229 AromaticContact CZ-CE1 3.61Å; F154-F229 HydrophobicContact CZ-CE1 3.61Å; F154-F229 AromaticContact CZ-CZ 3.87Å; F154-F229 HydrophobicContact CZ-CZ 3.87Å; F154-E230 HydrophobicContact CD1-CG 4.39Å; F154-E230 HydrophobicContact CE1-CG 4.22Å; F154-V233 HydrophobicContact CD1-CG1 4.34Å; F154-V233 HydrophobicContact CD2-CG1 3.65Å; F154-V233 HydrophobicContact CE1-CG1 4.39Å; F154-V233 HydrophobicContact CE2-CG1 3.71Å; F154-V233 HydrophobicContact CG-CG1 3.98Å; F154-V233 HydrophobicContact CZ-CG1 4.09Å; F154-R234 HydrophobicContact CB-CG 4.03Å; F154-R234 PolarHBondContact O-NE 3.01Å; F154-R234 VanDerWaalsContact O-NE 3.12Å; F154-R234 PolarHBondContact O-NH2 3.34Å
155	E	90.2	Very high	91.8	Very high	27 Å²	27	68.7 Å²	68.7	13%	0.126	36%	0.355	C	S	.	.	H	α-helix	trans	-92.7	-35.8	-177.2	-165.6	67.2	-169.6	0	0	112.1	W151 P157 R234 R304	W151-E155 HydrophobicContact CD2-CB 4.14Å; W151-E155 HydrophobicContact CG-CB 4.49Å; W151-E155 HydrophobicContact CH2-CG 4.21Å; W151-E155 HydrophobicContact CZ2-CB 4.23Å; W151-E155 HydrophobicContact CZ2-CG 3.71Å; W151-E155 WeakPolarHBondContact O-CB 3.28Å; W151-E155 PolarHBondContact O-N 3.28Å; E155-P157 WeakPolarHBondContact O-CD 3.28Å; E155-R234 IonicContact OE2-NE 3.41Å; E155-R304 IonicContact OE1-CZ 3.69Å; E155-R304 IonicContact OE1-NH1 3.58Å; E155-R304 PolarHBondContact OE1-NH1 3.34Å; E155-R304 IonicContact OE2-CZ 3.03Å; E155-R304 IonicContact OE2-NH1 2.93Å; E155-R304 PolarHBondContact OE2-NH1 3.47Å
156	Y	88.4	Confident	92	Very high	59 Å²	59	63 Å²	63	23%	0.231	33%	0.329	C	S	.	.			trans	-120.7	96.6	-173.4	-59.3	-75.6	0	0	0	111.5	K139 W151 L152 E158 S159	K139-Y156 VanDerWaalsContact CB-OH 3.23Å; K139-Y156 WeakPolarHBondContact CB-OH 3.4Å; K139-Y156 HydrophobicContact CD-CE1 3.66Å; K139-Y156 WeakPolarHBondContact CD-OH 3.45Å; W151-Y156 AromaticContact NE1-CE2 3.81Å; L152-Y156 HydrophobicContact CD2-CD2 3.86Å; L152-Y156 HydrophobicContact CD2-CE2 4.42Å; L152-Y156 CarbonylContact O-C 3.56Å; L152-Y156 PolarHBondContact O-N 3.46Å; Y156-E158 PolarHBondContact O-N 3.26Å; Y156-E158 VanDerWaalsContact O-N 3.17Å; Y156-S159 VanDerWaalsContact O-CB 3.26Å; Y156-S159 WeakPolarHBondContact O-CB 3.12Å; Y156-S159 PolarHBondContact O-N 3.47Å; Y156-S159 PolarHBondContact O-OG 2.96Å
157	P	87.8	Confident	92.1	Very high	36 Å²	36	56.4 Å²	56.4	23%	0.234	30%	0.303	C	S	.	.	G	3₁₀ helix	trans	-55.5	-34.2	178	-26.8	35.4	0	0	0	113.3	E155 S159 R164 A167	E155-P157 WeakPolarHBondContact O-CD 3.28Å; P157-S159 PolarHBondContact O-N 2.83Å; P157-R164 WeakPolarHBondContact O-CG 3.28Å; P157-R164 PolarHBondContact O-N 3.47Å; P157-A167 HydrophobicContact CB-CB 3.79Å; P157-A167 HydrophobicContact CG-CB 3.84Å
158	E	83.6	Confident	92.3	Very high	132 Å²	132	58.5 Å²	58.5	62%	0.617	32%	0.315	S	S	*	.	G	3₁₀ helix	trans	-74.5	-6.3	-179.6	-58.5	-50.9	141.5	0	0	114.5	Y156 S160 R164	Y156-E158 PolarHBondContact O-N 3.26Å; Y156-E158 VanDerWaalsContact O-N 3.17Å; E158-S160 VanDerWaalsContact C-N 3.34Å; E158-S160 PolarHBondContact O-N 3.42Å; E158-R164 IonicContact OE2-CZ 3.31Å; E158-R164 VanDerWaalsContact OE2-CZ 3.27Å; E158-R164 IonicContact OE2-NE 3.45Å; E158-R164 PolarHBondContact OE2-NE 3.25Å; E158-R164 VanDerWaalsContact OE2-NE 3.08Å; E158-R164 IonicContact OE2-NH2 2.78Å; E158-R164 PolarHBondContact OE2-NH2 3.21Å
159	S	88.6	Confident	92.5	Very high	51 Å²	51	55.8 Å²	55.8	36%	0.357	31%	0.312	S	S	.	.	G	3₁₀ helix	trans	-67.1	-33.1	-177.5	65.2	0	0	0	0	113.4	L152 Y156 P157 A163	L152-S159 PolarHBondContact O-OG 3.33Å; Y156-S159 VanDerWaalsContact O-CB 3.26Å; Y156-S159 WeakPolarHBondContact O-CB 3.12Å; Y156-S159 PolarHBondContact O-N 3.47Å; Y156-S159 PolarHBondContact O-OG 2.96Å; P157-S159 PolarHBondContact O-N 2.83Å; S159-A163 VanDerWaalsContact OG-CB 3.29Å; S159-A163 WeakPolarHBondContact OG-CB 3.23Å
160	S	92.9	Very high	92.6	Very high	45 Å²	45	49.8 Å²	49.8	32%	0.315	28%	0.284	S	S	.	.			trans	-165.7	162.4	-175.9	65.1	0	0	0	0	112.8	E158 A163 R164	E158-S160 VanDerWaalsContact C-N 3.34Å; E158-S160 PolarHBondContact O-N 3.42Å; S160-A163 WeakPolarHBondContact O-CB 3.48Å; S160-A163 PolarHBondContact O-N 2.98Å; S160-A163 VanDerWaalsContact O-N 3.13Å; S160-A163 WeakPolarHBondContact OG-CB 3.3Å; S160-A163 PolarHBondContact OG-N 3.33Å; S160-R164 PolarHBondContact O-N 2.85Å
161	G	93.6	Very high	92.7	Very high	55 Å²	55	50.2 Å²	50.2	57%	0.567	29%	0.286	S	S	*	.	H	α-helix	trans	-55	-47	173.6	0	0	0	0	0	114.1	A163 R164 G165	G161-A163 VanDerWaalsContact C-N 3.33Å; G161-A163 PolarHBondContact O-N 3.45Å; G161-R164 WeakPolarHBondContact O-CB 3.26Å; G161-R164 PolarHBondContact O-N 3.08Å; G161-G165 PolarHBondContact O-N 2.92Å
162	P	95.2	Very high	92.8	Very high	90 Å²	90	54.3 Å²	54.3	58%	0.584	31%	0.307	S	S	*	.	H	α-helix	trans	-60.6	-36.6	173	-27.4	37.1	0	0	0	113.9	L153 G165 I166	L153-P162 HydrophobicContact CD1-CB 3.84Å; P162-G165 PolarHBondContact O-N 3.18Å; P162-I166 PolarHBondContact O-N 3.36Å
163	A	93.3	Very high	93.1	Very high	1 Å²	1	52.9 Å²	52.9	1%	0.008	30%	0.301	C	S	.	.	H	α-helix	trans	-62.8	-43.5	175.7	0	0	0	0	0	111.3	L153 S159 S160 G161 G165 I166 A167	L153-A163 HydrophobicContact CD1-CB 3.99Å; L153-A163 WeakPolarHBondContact O-CB 3.27Å; S159-A163 VanDerWaalsContact OG-CB 3.29Å; S159-A163 WeakPolarHBondContact OG-CB 3.23Å; S160-A163 WeakPolarHBondContact O-CB 3.48Å; S160-A163 PolarHBondContact O-N 2.98Å; S160-A163 VanDerWaalsContact O-N 3.13Å; S160-A163 WeakPolarHBondContact OG-CB 3.3Å; S160-A163 PolarHBondContact OG-N 3.33Å; G161-A163 VanDerWaalsContact C-N 3.33Å; G161-A163 PolarHBondContact O-N 3.45Å; A163-G165 VanDerWaalsContact C-N 3.31Å; A163-G165 PolarHBondContact O-N 3.47Å; A163-I166 PolarHBondContact O-N 2.95Å; A163-A167 WeakPolarHBondContact O-CB 3.23Å; A163-A167 PolarHBondContact O-N 3.39Å
164	R	93.7	Very high	93.3	Very high	133 Å²	133	50.6 Å²	50.6	50%	0.502	29%	0.289	S	S	.	.	H	α-helix	trans	-59.1	-42.4	172	-65.3	-173.8	175.8	162.5	-0.4	111.7	P157 E158 S160 G161 A167 I168	P157-R164 WeakPolarHBondContact O-CG 3.28Å; P157-R164 PolarHBondContact O-N 3.47Å; E158-R164 IonicContact OE2-CZ 3.31Å; E158-R164 VanDerWaalsContact OE2-CZ 3.27Å; E158-R164 IonicContact OE2-NE 3.45Å; E158-R164 PolarHBondContact OE2-NE 3.25Å; E158-R164 VanDerWaalsContact OE2-NE 3.08Å; E158-R164 IonicContact OE2-NH2 2.78Å; E158-R164 PolarHBondContact OE2-NH2 3.21Å; S160-R164 PolarHBondContact O-N 2.85Å; G161-R164 WeakPolarHBondContact O-CB 3.26Å; G161-R164 PolarHBondContact O-N 3.08Å; R164-A167 PolarHBondContact O-N 3.29Å; R164-I168 VanDerWaalsContact O-CG1 3.3Å; R164-I168 WeakPolarHBondContact O-CG1 3.42Å; R164-I168 PolarHBondContact O-N 2.88Å
165	G	95.3	Very high	93.5	Very high	34 Å²	34	53.3 Å²	53.3	35%	0.351	30%	0.304	S	S	.	.	H	α-helix	trans	-58.7	-48.1	175.7	0	0	0	0	0	113.1	G161 P162 A163 A167 I168 V169	G161-G165 PolarHBondContact O-N 2.92Å; P162-G165 PolarHBondContact O-N 3.18Å; A163-G165 VanDerWaalsContact C-N 3.31Å; A163-G165 PolarHBondContact O-N 3.47Å; G165-A167 VanDerWaalsContact C-N 3.33Å; G165-A167 PolarHBondContact O-N 2.98Å; G165-I168 PolarHBondContact O-N 3.18Å; G165-V169 WeakPolarHBondContact O-CG2 3.44Å; G165-V169 PolarHBondContact O-N 2.89Å
166	I	95.1	Very high	93.7	Very high	34 Å²	34	56.1 Å²	56.1	17%	0.174	32%	0.319	C	S	.	.	H	α-helix	trans	-63.5	-39.7	177.1	-70.9	164	0	0	0	111.3	L153 F154 P162 A163 V169 S170	L153-I166 HydrophobicContact CD1-CD1 3.83Å; L153-I166 HydrophobicContact CD2-CD1 3.65Å; L153-I166 HydrophobicContact CG-CD1 3.53Å; F154-I166 HydrophobicContact CD1-CG2 4.2Å; F154-I166 HydrophobicContact CE1-CG2 3.99Å; F154-I166 HydrophobicContact CE2-CD1 4.31Å; F154-I166 HydrophobicContact CZ-CD1 4.37Å; F154-I166 HydrophobicContact CZ-CG2 4.39Å; P162-I166 PolarHBondContact O-N 3.36Å; A163-I166 PolarHBondContact O-N 2.95Å; I166-V169 PolarHBondContact O-N 2.76Å; I166-S170 WeakPolarHBondContact O-CB 3.14Å; I166-S170 PolarHBondContact O-N 3.39Å; I166-S170 PolarHBondContact O-OG 3.43Å
167	A	94.1	Very high	94.1	Very high	14 Å²	14	53.4 Å²	53.4	12%	0.116	31%	0.308	C	S	.	.	H	α-helix	trans	-61.9	-44.1	175.9	0	0	0	0	0	111.7	P157 A163 R164 G165 S170 V171	P157-A167 HydrophobicContact CB-CB 3.79Å; P157-A167 HydrophobicContact CG-CB 3.84Å; A163-A167 WeakPolarHBondContact O-CB 3.23Å; A163-A167 PolarHBondContact O-N 3.39Å; R164-A167 PolarHBondContact O-N 3.29Å; G165-A167 VanDerWaalsContact C-N 3.33Å; G165-A167 PolarHBondContact O-N 2.98Å; A167-S170 PolarHBondContact O-N 3.32Å; A167-V171 WeakPolarHBondContact O-CG2 3.42Å; A167-V171 PolarHBondContact O-N 3.34Å
168	I	95.4	Very high	94.4	Very high	104 Å²	104	53.4 Å²	53.4	53%	0.533	31%	0.306	S	S	.	.	H	α-helix	trans	-61.3	-46.9	176.3	-68.1	163.8	0	0	0	110.8	R164 G165 S170 V171 M172	R164-I168 VanDerWaalsContact O-CG1 3.3Å; R164-I168 WeakPolarHBondContact O-CG1 3.42Å; R164-I168 PolarHBondContact O-N 2.88Å; G165-I168 PolarHBondContact O-N 3.18Å; I168-S170 VanDerWaalsContact C-N 3.29Å; I168-S170 PolarHBondContact O-N 3.3Å; I168-V171 PolarHBondContact O-N 2.95Å; I168-M172 WeakPolarHBondContact O-CG 3.27Å; I168-M172 PolarHBondContact O-N 3.28Å
169	V	96.5	Very high	94.9	Very high	66 Å²	66	51 Å²	51	40%	0.4	30%	0.3	S	S	.	.	H	α-helix	trans	-59	-43.8	176.7	173.2	0	0	0	0	110.6	G165 I166 V171 M172 V173 W226	G165-V169 WeakPolarHBondContact O-CG2 3.44Å; G165-V169 PolarHBondContact O-N 2.89Å; I166-V169 PolarHBondContact O-N 2.76Å; V169-V171 PolarHBondContact O-N 3.28Å; V169-M172 PolarHBondContact O-N 3.23Å; V169-M172 VanDerWaalsContact O-N 3.17Å; V169-V173 HydrophobicContact CG1-CG2 4.35Å; V169-V173 WeakPolarHBondContact O-CG2 3.41Å; V169-V173 PolarHBondContact O-N 3.08Å; V169-W226 HydrophobicContact CB-CZ2 4.18Å; V169-W226 HydrophobicContact CG1-CH2 3.75Å; V169-W226 HydrophobicContact CG1-CZ2 3.53Å; V169-W226 HydrophobicContact CG1-CZ3 4.41Å
170	S	95.9	Very high	95.1	Very high	0 Å²	0	49.8 Å²	49.8	0%	0	29%	0.289	C	S	.	.	H	α-helix	trans	-63.3	-42.4	180	-56.6	0	0	0	0	111.9	I166 A167 I168 M172 V173 I174 W226 E230	I166-S170 WeakPolarHBondContact O-CB 3.14Å; I166-S170 PolarHBondContact O-N 3.39Å; I166-S170 PolarHBondContact O-OG 3.43Å; A167-S170 PolarHBondContact O-N 3.32Å; I168-S170 VanDerWaalsContact C-N 3.29Å; I168-S170 PolarHBondContact O-N 3.3Å; S170-M172 PolarHBondContact O-N 2.93Å; S170-V173 PolarHBondContact O-N 3.24Å; S170-I174 WeakPolarHBondContact O-CD1 3.46Å; S170-I174 WeakPolarHBondContact O-CG1 3.41Å; S170-I174 PolarHBondContact O-N 2.93Å; S170-W226 PolarHBondContact OG-NE1 3.31Å; S170-E230 PolarHBondContact OG-OE1 3.5Å
171	V	96	Very high	94.9	Very high	36 Å²	36	49.4 Å²	49.4	22%	0.218	28%	0.282	C	S	.	.	H	α-helix	trans	-60.1	-44.8	172.5	172.1	0	0	0	0	111.2	A167 I168 V169 V173 I174 L175 L302 H305	A167-V171 WeakPolarHBondContact O-CG2 3.42Å; A167-V171 PolarHBondContact O-N 3.34Å; I168-V171 PolarHBondContact O-N 2.95Å; V169-V171 PolarHBondContact O-N 3.28Å; V171-V173 PolarHBondContact O-N 2.95Å; V171-I174 PolarHBondContact O-N 2.85Å; V171-L175 HydrophobicContact CG1-CD1 4.17Å; V171-L175 HydrophobicContact CG1-CG 4.41Å; V171-L175 WeakPolarHBondContact O-CG 3.37Å; V171-L175 PolarHBondContact O-N 3.18Å; V171-L302 HydrophobicContact CG1-CD2 4.24Å; V171-H305 HydrophobicContact CG2-CB 3.72Å
172	M	96.9	Very high	94.8	Very high	103 Å²	103	49.9 Å²	49.9	51%	0.507	28%	0.276	S	S	.	.	H	α-helix	trans	-62.4	-43.1	178.5	-69.7	-63.1	158.1	0	0	112.4	I168 V169 S170 I174 L175 I176	I168-M172 WeakPolarHBondContact O-CG 3.27Å; I168-M172 PolarHBondContact O-N 3.28Å; V169-M172 PolarHBondContact O-N 3.23Å; V169-M172 VanDerWaalsContact O-N 3.17Å; S170-M172 PolarHBondContact O-N 2.93Å; M172-I174 VanDerWaalsContact C-N 3.31Å; M172-I174 PolarHBondContact O-N 3.46Å; M172-L175 PolarHBondContact O-N 3.21Å; M172-L175 HydrophobicContact SD-CD1 4.49Å; M172-I176 WeakPolarHBondContact O-CB 3.42Å; M172-I176 VanDerWaalsContact O-CG1 3.28Å; M172-I176 WeakPolarHBondContact O-CG1 3.23Å; M172-I176 PolarHBondContact O-N 2.89Å
173	V	97.4	Very high	94.6	Very high	23 Å²	23	48.5 Å²	48.5	14%	0.139	26%	0.263	C	S	.	.	H	α-helix	trans	-62	-40.2	175.4	175.4	0	0	0	0	111	V169 S170 V171 S177 C223 W226 F227	V169-V173 HydrophobicContact CG1-CG2 4.35Å; V169-V173 WeakPolarHBondContact O-CG2 3.41Å; V169-V173 PolarHBondContact O-N 3.08Å; S170-V173 PolarHBondContact O-N 3.24Å; V171-V173 PolarHBondContact O-N 2.95Å; V173-S177 VanDerWaalsContact O-CB 3.29Å; V173-S177 WeakPolarHBondContact O-CB 3.5Å; V173-S177 PolarHBondContact O-N 2.7Å; V173-C223 HydrophobicContact CG1-CB 3.97Å; V173-W226 HydrophobicContact CB-CG 4.45Å; V173-W226 HydrophobicContact CG1-CB 4.1Å; V173-W226 HydrophobicContact CG1-CG 4.15Å; V173-W226 HydrophobicContact CG2-CD2 4.46Å; V173-W226 HydrophobicContact CG2-CG 4.09Å; V173-F227 HydrophobicContact CB-CE1 4.45Å; V173-F227 HydrophobicContact CG1-CD1 4.39Å; V173-F227 HydrophobicContact CG1-CE1 3.77Å; V173-F227 HydrophobicContact CG1-CZ 4.2Å
174	I	96.6	Very high	94.3	Very high	0 Å²	0	50.7 Å²	50.7	0%	0	27%	0.273	C	S	.	.	H	α-helix	trans	-60.6	-48.9	174.6	-64.2	160.1	0	0	0	110.9	S170 V171 M172 S177 I178 F227 K301 L302	S170-I174 WeakPolarHBondContact O-CD1 3.46Å; S170-I174 WeakPolarHBondContact O-CG1 3.41Å; S170-I174 PolarHBondContact O-N 2.93Å; V171-I174 PolarHBondContact O-N 2.85Å; M172-I174 VanDerWaalsContact C-N 3.31Å; M172-I174 PolarHBondContact O-N 3.46Å; I174-S177 WeakPolarHBondContact O-CB 3.46Å; I174-S177 PolarHBondContact O-N 3.25Å; I174-S177 PolarHBondContact O-OG 3.32Å; I174-I178 HydrophobicContact CG2-CD1 3.82Å; I174-I178 WeakPolarHBondContact O-CG1 3.48Å; I174-I178 PolarHBondContact O-N 3.45Å; I174-F227 HydrophobicContact CB-CZ 4.43Å; I174-F227 HydrophobicContact CG1-CE1 3.65Å; I174-F227 HydrophobicContact CG1-CZ 3.79Å; I174-K301 HydrophobicContact CD1-CB 3.92Å; I174-K301 HydrophobicContact CD1-CD 3.91Å; I174-K301 HydrophobicContact CD1-CG 3.67Å; I174-K301 HydrophobicContact CG1-CB 4.35Å; I174-K301 HydrophobicContact CG1-CD 4.05Å; I174-K301 HydrophobicContact CG1-CG 4.28Å; I174-L302 HydrophobicContact CB-CD2 4.12Å; I174-L302 HydrophobicContact CD1-CD2 4.13Å; I174-L302 HydrophobicContact CG2-CD1 4.5Å; I174-L302 HydrophobicContact CG2-CD2 3.73Å; I174-L302 HydrophobicContact CG2-CG 3.81Å
175	L	96.3	Very high	93.9	Very high	76 Å²	76	48.2 Å²	48.2	40%	0.398	27%	0.273	S	S	.	.	H	α-helix	trans	-62	-46.5	179.4	-66.6	177.9	0	0	0	112.1	V171 M172 S177 I178 V179	V171-L175 HydrophobicContact CG1-CD1 4.17Å; V171-L175 HydrophobicContact CG1-CG 4.41Å; V171-L175 WeakPolarHBondContact O-CG 3.37Å; V171-L175 PolarHBondContact O-N 3.18Å; M172-L175 PolarHBondContact O-N 3.21Å; M172-L175 HydrophobicContact SD-CD1 4.49Å; L175-S177 VanDerWaalsContact C-N 3.29Å; L175-S177 PolarHBondContact O-N 2.71Å; L175-I178 PolarHBondContact O-N 2.91Å; L175-V179 WeakPolarHBondContact O-CG2 3.47Å; L175-V179 PolarHBondContact O-N 3.33Å
176	I	96.1	Very high	93.5	Very high	87 Å²	87	49.9 Å²	49.9	45%	0.446	27%	0.274	S	S	.	.	H	α-helix	trans	-57.3	-46.2	175.4	-70.4	166.4	0	0	0	110	M172 I178 V179 I180 V219	M172-I176 WeakPolarHBondContact O-CB 3.42Å; M172-I176 VanDerWaalsContact O-CG1 3.28Å; M172-I176 WeakPolarHBondContact O-CG1 3.23Å; M172-I176 PolarHBondContact O-N 2.89Å; I176-I178 VanDerWaalsContact C-N 3.35Å; I176-I178 PolarHBondContact O-N 3.5Å; I176-V179 PolarHBondContact O-N 2.81Å; I176-I180 HydrophobicContact CG2-CG1 4.28Å; I176-I180 WeakPolarHBondContact O-CB 3.28Å; I176-I180 VanDerWaalsContact O-CG1 3.3Å; I176-I180 WeakPolarHBondContact O-CG1 3.14Å; I176-I180 PolarHBondContact O-N 3.01Å; I176-V219 HydrophobicContact CG2-CG1 3.85Å
177	S	95.3	Very high	92.9	Very high	1 Å²	1	52.7 Å²	52.7	1%	0.007	29%	0.294	C	S	.	.	H	α-helix	trans	-57	-50.8	179.4	83.1	0	0	0	0	110.2	V173 I174 L175 V179 I180 F181 R298	V173-S177 VanDerWaalsContact O-CB 3.29Å; V173-S177 WeakPolarHBondContact O-CB 3.5Å; V173-S177 PolarHBondContact O-N 2.7Å; I174-S177 WeakPolarHBondContact O-CB 3.46Å; I174-S177 PolarHBondContact O-N 3.25Å; I174-S177 PolarHBondContact O-OG 3.32Å; L175-S177 VanDerWaalsContact C-N 3.29Å; L175-S177 PolarHBondContact O-N 2.71Å; S177-V179 PolarHBondContact O-N 2.87Å; S177-I180 PolarHBondContact O-N 3.17Å; S177-F181 PolarHBondContact O-N 3.25Å; S177-R298 VanDerWaalsContact C-CZ 3.4Å; S177-R298 VanDerWaalsContact O-CZ 3.29Å; S177-R298 PolarHBondContact O-NH2 3.23Å; S177-R298 WeakPolarHBondContact OG-CD 3.34Å; S177-R298 PolarHBondContact OG-NE 3.11Å
178	I	94.6	Very high	92.2	Very high	37 Å²	37	59.1 Å²	59.1	19%	0.19	32%	0.322	C	S	.	.	H	α-helix	trans	-58.6	-48.3	179.7	-65.4	162.6	0	0	0	111	I174 L175 I176 I180 F181 C182 I299	I174-I178 HydrophobicContact CG2-CD1 3.82Å; I174-I178 WeakPolarHBondContact O-CG1 3.48Å; I174-I178 PolarHBondContact O-N 3.45Å; L175-I178 PolarHBondContact O-N 2.91Å; I176-I178 VanDerWaalsContact C-N 3.35Å; I176-I178 PolarHBondContact O-N 3.5Å; I178-I180 VanDerWaalsContact C-N 3.31Å; I178-I180 PolarHBondContact O-N 3.32Å; I178-F181 PolarHBondContact O-N 2.91Å; I178-C182 PolarHBondContact O-N 2.86Å; I178-C182 PolarHBondContact O-SG 3.13Å; I178-C182 VanDerWaalsContact O-SG 3.37Å; I178-I299 HydrophobicContact CD1-CB 4.13Å; I178-I299 HydrophobicContact CD1-CD1 4.49Å; I178-I299 HydrophobicContact CD1-CG1 3.9Å
179	V	94.6	Very high	91.3	Very high	80 Å²	80	57.9 Å²	57.9	49%	0.485	32%	0.316	S	S	.	.	H	α-helix	trans	-57.2	-46.7	178.2	170	0	0	0	0	110.7	L175 I176 S177 F181 C182 L183	L175-V179 WeakPolarHBondContact O-CG2 3.47Å; L175-V179 PolarHBondContact O-N 3.33Å; I176-V179 PolarHBondContact O-N 2.81Å; S177-V179 PolarHBondContact O-N 2.87Å; V179-F181 VanDerWaalsContact C-N 3.33Å; V179-F181 PolarHBondContact O-N 3.22Å; V179-C182 WeakPolarHBondContact O-CB 3.32Å; V179-C182 PolarHBondContact O-N 3.43Å; V179-C182 VanDerWaalsContact O-N 3.14Å; V179-L183 HydrophobicContact CG1-CD1 3.87Å; V179-L183 HydrophobicContact CG1-CG 4.21Å; V179-L183 VanDerWaalsContact O-CG 3.32Å; V179-L183 WeakPolarHBondContact O-CG 3.41Å; V179-L183 PolarHBondContact O-N 3.33Å
180	I	91.7	Very high	90	Very high	26 Å²	26	60.5 Å²	60.5	13%	0.133	32%	0.322	C	S	.	.	H	α-helix	trans	-60.1	-41.7	178.6	-72.2	-67.4	0	0	0	112.1	I176 S177 I178 C182 L183 E184 F216 V219	I176-I180 HydrophobicContact CG2-CG1 4.28Å; I176-I180 WeakPolarHBondContact O-CB 3.28Å; I176-I180 VanDerWaalsContact O-CG1 3.3Å; I176-I180 WeakPolarHBondContact O-CG1 3.14Å; I176-I180 PolarHBondContact O-N 3.01Å; S177-I180 PolarHBondContact O-N 3.17Å; I178-I180 VanDerWaalsContact C-N 3.31Å; I178-I180 PolarHBondContact O-N 3.32Å; I180-C182 PolarHBondContact O-N 2.88Å; I180-L183 PolarHBondContact O-N 3.31Å; I180-E184 PolarHBondContact O-N 3.5Å; I180-F216 HydrophobicContact CD1-CD1 4.08Å; I180-F216 HydrophobicContact CD1-CE1 4.32Å; I180-F216 HydrophobicContact CG2-CD1 4.06Å; I180-V219 HydrophobicContact CD1-CB 4.36Å; I180-V219 HydrophobicContact CD1-CG1 4.11Å; I180-V219 HydrophobicContact CG1-CB 4.36Å; I180-V219 HydrophobicContact CG1-CG1 3.72Å
181	F	90.6	Very high	88.4	Confident	37 Å²	37	67.3 Å²	67.3	16%	0.162	35%	0.354	C	S	.	.	H	α-helix	trans	-64.8	-39	175	165.6	-97.4	0	0	0	112.8	S177 I178 V179 T185 R292 R295 V296	S177-F181 PolarHBondContact O-N 3.25Å; I178-F181 PolarHBondContact O-N 2.91Å; V179-F181 VanDerWaalsContact C-N 3.33Å; V179-F181 PolarHBondContact O-N 3.22Å; F181-T185 WeakPolarHBondContact O-CG2 3.46Å; F181-R292 WeakPolarHBondContact CE2-O 3.48Å; F181-R295 HydrophobicContact CD2-CB 4.19Å; F181-R295 HydrophobicContact CE2-CB 4.17Å; F181-V296 HydrophobicContact CE1-CB 4.32Å; F181-V296 HydrophobicContact CE1-CG2 4.09Å; F181-V296 HydrophobicContact CZ-CB 4.38Å
182	C	91.4	Very high	86.2	Confident	66 Å²	66	70 Å²	70	45%	0.446	37%	0.367	S	S	.	.	H	α-helix	trans	-63	-44.5	173.1	-64.5	0	0	0	0	110.9	I178 V179 I180 E184 T185	I178-C182 PolarHBondContact O-N 2.86Å; I178-C182 PolarHBondContact O-SG 3.13Å; I178-C182 VanDerWaalsContact O-SG 3.37Å; V179-C182 WeakPolarHBondContact O-CB 3.32Å; V179-C182 PolarHBondContact O-N 3.43Å; V179-C182 VanDerWaalsContact O-N 3.14Å; I180-C182 PolarHBondContact O-N 2.88Å; C182-E184 PolarHBondContact O-N 3.47Å; C182-T185 PolarHBondContact O-N 3.43Å; C182-T185 VanDerWaalsContact O-N 3.16Å; C182-T185 PolarHBondContact O-OG1 3.47Å
183	L	90.4	Very high	84	Confident	60 Å²	60	71.4 Å²	71.4	31%	0.314	38%	0.384	S	S	.	.	H	α-helix	trans	-64.2	-38.1	179.5	-68.1	177	0	0	0	112.6	V179 I180 T185 L186 L189 F216	V179-L183 HydrophobicContact CG1-CD1 3.87Å; V179-L183 HydrophobicContact CG1-CG 4.21Å; V179-L183 VanDerWaalsContact O-CG 3.32Å; V179-L183 WeakPolarHBondContact O-CG 3.41Å; V179-L183 PolarHBondContact O-N 3.33Å; I180-L183 PolarHBondContact O-N 3.31Å; L183-T185 PolarHBondContact O-N 3.19Å; L183-T185 VanDerWaalsContact O-N 3.14Å; L183-L186 HydrophobicContact CD2-CD1 3.71Å; L183-L186 WeakPolarHBondContact O-CB 3.46Å; L183-L186 PolarHBondContact O-N 3.42Å; L183-L189 HydrophobicContact CB-CD1 4.03Å; L183-L189 HydrophobicContact CD2-CD1 4.16Å; L183-F216 HydrophobicContact CB-CE1 3.88Å; L183-F216 HydrophobicContact CB-CZ 4.45Å
184	E	85.8	Confident	81.5	Confident	47 Å²	47	79.8 Å²	79.8	22%	0.22	41%	0.413	C	S	.	.	H	α-helix	trans	-60.7	-23.6	176.5	-161.9	-162.9	150	0	0	112.4	I180 C182 K190 R292 R295	I180-E184 PolarHBondContact O-N 3.5Å; C182-E184 PolarHBondContact O-N 3.47Å; E184-K190 WeakPolarHBondContact O-CE 3.35Å; E184-R292 IonicContact OE1-NH1 3.76Å; E184-R295 IonicContact OE2-NH1 3.97Å
185	T	85.7	Confident	79.3	Confident	81 Å²	81	82 Å²	82	50%	0.497	44%	0.436	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.8	-19.1	176.9	68.4	0	0	0	0	113.7	F181 C182 L183 K190	F181-T185 WeakPolarHBondContact O-CG2 3.46Å; C182-T185 PolarHBondContact O-N 3.43Å; C182-T185 VanDerWaalsContact O-N 3.16Å; C182-T185 PolarHBondContact O-OG1 3.47Å; L183-T185 PolarHBondContact O-N 3.19Å; L183-T185 VanDerWaalsContact O-N 3.14Å; T185-K190 PolarHBondContact O-NZ 2.93Å
186	L	86.3	Confident	77.2	Confident	69 Å²	69	87 Å²	87	36%	0.361	45%	0.449	S	S	.	.			trans	-66.7	128.7	-176	-67.9	178.3	0	0	0	111.3	L183 E188 L189 K190	L183-L186 HydrophobicContact CD2-CD1 3.71Å; L183-L186 WeakPolarHBondContact O-CB 3.46Å; L183-L186 PolarHBondContact O-N 3.42Å; L186-E188 PolarHBondContact O-N 3.1Å; L186-L189 HydrophobicContact CB-CB 4.38Å; L186-L189 HydrophobicContact CB-CD1 4.2Å; L186-L189 HydrophobicContact CB-CG 4.33Å; L186-L189 HydrophobicContact CD1-CD1 3.84Å; L186-L189 PolarHBondContact O-N 3.4Å; L186-K190 PolarHBondContact O-N 3.42Å; L186-K190 VanDerWaalsContact O-N 3.09Å
187	P	82.6	Confident	75.2	Confident	93 Å²	93	87.2 Å²	87.2	60%	0.604	45%	0.449	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.9	-26.8	-179	27.1	-33.8	0	0	0	112.7	L189	P187-L189 VanDerWaalsContact C-N 3.29Å; P187-L189 PolarHBondContact O-N 2.99Å
188	E	81.3	Confident	73.2	Confident	150 Å²	150	93.6 Å²	93.6	70%	0.701	48%	0.479	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72	-24.4	178.5	-57.3	80.3	-173.2	0	0	113	L186	L186-E188 PolarHBondContact O-N 3.1Å
189	L	75.6	Confident	71.5	Confident	77 Å²	77	96.2 Å²	96.2	40%	0.403	50%	0.497	S	S	.	.	T	Hydrogen-bonded Turn	trans	-100.4	-17	-179.3	-63.5	173.9	0	0	0	112.5	L183 L186 P187 E191 F216	L183-L189 HydrophobicContact CB-CD1 4.03Å; L183-L189 HydrophobicContact CD2-CD1 4.16Å; L186-L189 HydrophobicContact CB-CB 4.38Å; L186-L189 HydrophobicContact CB-CD1 4.2Å; L186-L189 HydrophobicContact CB-CG 4.33Å; L186-L189 HydrophobicContact CD1-CD1 3.84Å; L186-L189 PolarHBondContact O-N 3.4Å; P187-L189 VanDerWaalsContact C-N 3.29Å; P187-L189 PolarHBondContact O-N 2.99Å; L189-E191 PolarHBondContact O-N 3.43Å; L189-E191 VanDerWaalsContact O-N 3.12Å; L189-F216 HydrophobicContact CB-CE2 4.25Å; L189-F216 HydrophobicContact CB-CZ 4.1Å; L189-F216 HydrophobicContact CD1-CZ 3.97Å; L189-F216 HydrophobicContact CG-CZ 4.43Å
190	K	69.1	Low	69.9	Low	122 Å²	122	97 Å²	97	53%	0.53	50%	0.502	S	S	.	.	S	Bend	trans	-66.6	109.4	165.6	-79.1	175.8	178.9	161.6	0	107.9	E184 T185 L186 D192	E184-K190 WeakPolarHBondContact O-CE 3.35Å; T185-K190 PolarHBondContact O-NZ 2.93Å; L186-K190 PolarHBondContact O-N 3.42Å; L186-K190 VanDerWaalsContact O-N 3.09Å; K190-D192 PolarHBondContact O-N 2.87Å
191	E	61.4	Low	69	Low	142 Å²	142	98.8 Å²	98.8	66%	0.664	53%	0.527	S	S	*	.			trans	-47.8	126.8	171.5	-66	-169.8	152.9	0	0	109	L189 P193	L189-E191 PolarHBondContact O-N 3.43Å; L189-E191 VanDerWaalsContact O-N 3.12Å; E191-P193 WeakPolarHBondContact O-CD 3.13Å; E191-P193 VanDerWaalsContact O-N 3.16Å
192	D	49.8	Very low	68.2	Low	93 Å²	93	105.2 Å²	105.2	50%	0.497	56%	0.563	S	S	.	*			trans	-54	123.8	175.9	-172.2	1.7	0	0	0	107	K190 R194 G195	K190-D192 PolarHBondContact O-N 2.87Å; D192-R194 PolarHBondContact O-N 2.85Å; D192-R194 WeakPolarHBondContact OD1-CG 3.1Å; D192-R194 IonicContact OD1-NE 3.95Å; D192-R194 IonicContact OD2-NE 2.85Å; D192-G195 PolarHBondContact O-N 3.11Å
193	P	51.8	Low	66.9	Low	132 Å²	132	106 Å²	106	86%	0.857	57%	0.565	S	S	*	*	T	Hydrogen-bonded Turn	trans	-58.5	-1.8	177.7	20.1	-31.2	0	0	0	113.6	E191	E191-P193 WeakPolarHBondContact O-CD 3.13Å; E191-P193 VanDerWaalsContact O-N 3.16Å
194	R	45.8	Very low	65.8	Low	199 Å²	199	106 Å²	106	75%	0.751	57%	0.568	S	S	*	*	T	Hydrogen-bonded Turn	trans	-89.9	-6.4	172.2	-53.6	177.8	-152.5	-153.3	2.4	114.7	D192	D192-R194 PolarHBondContact O-N 2.85Å; D192-R194 WeakPolarHBondContact OD1-CG 3.1Å; D192-R194 IonicContact OD1-NE 3.95Å; D192-R194 IonicContact OD2-NE 2.85Å
195	G	48.5	Very low	64.5	Low	47 Å²	47	109.2 Å²	109.2	49%	0.485	58%	0.582	S	S	.	*	T	Hydrogen-bonded Turn	trans	-91.1	115.5	174.8	0	0	0	0	0	110.8	D192	D192-G195 PolarHBondContact O-N 3.11Å
196	R	52.9	Low	63.2	Low	180 Å²	180	113.6 Å²	113.6	68%	0.679	59%	0.59	S	S	*	*	T	Hydrogen-bonded Turn	cis	-134.5	102.2	12.2	-62.8	170.4	-171.8	172.2	2.8	107.7	E198 F205 Y207	R196-E198 PolarHBondContact O-N 2.88Å; R196-F205 VanDerWaalsContact O-O 3.07Å; R196-Y207 PolarHBondContact O-N 3.07Å
197	M	53.7	Low	61.8	Low	92 Å²	92	117.1 Å²	117.1	45%	0.453	60%	0.6	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-80.8	90.3	161	-74.1	179.4	75.8	0	0	107.6	T199 T204 F205 Y206	M197-T199 PolarHBondContact O-N 3.25Å; M197-T204 HydrophobicContact CB-CG2 4.33Å; M197-T204 HydrophobicContact CE-CG2 3.43Å; M197-T204 VanDerWaalsContact CE-CG2 3.43Å; M197-F205 WeakPolarHBondContact CA-O 3.43Å; M197-Y206 HydrophobicContact CE-CE1 3.75Å; M197-Y206 HydrophobicContact CE-CE2 4.36Å; M197-Y206 WeakPolarHBondContact CE-OH 3.45Å; M197-Y206 HydrophobicContact CG-CD1 3.97Å; M197-Y206 HydrophobicContact CG-CE1 3.74Å; M197-Y206 HydrophobicContact SD-CD1 4.44Å; M197-Y206 HydrophobicContact SD-CE1 3.64Å
198	E	54.2	Low	60.5	Low	136 Å²	136	119.8 Å²	119.8	64%	0.636	60%	0.602	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-80.2	111.5	169.5	-119.3	-179.1	175.7	0	0	107.8	R196 F205	R196-E198 PolarHBondContact O-N 2.88Å; E198-F205 PolarHBondContact N-O 3.43Å; E198-F205 PolarHBondContact O-N 3.06Å
199	T	58.4	Low	59.4	Low	92 Å²	92	115.3 Å²	115.3	56%	0.564	59%	0.586	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-92.7	103.2	175.3	-48.3	0	0	0	0	107.6	M197 G201 T204	M197-T199 PolarHBondContact O-N 3.25Å; T199-G201 WeakPolarHBondContact CG2-O 3.45Å; T199-T204 HydrophobicContact CG2-CG2 4.36Å; T199-T204 WeakPolarHBondContact OG1-CG2 3.43Å
200	V	61.3	Low	58.8	Low	95 Å²	95	116.5 Å²	116.5	58%	0.576	59%	0.592	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-105.6	101.5	174	-178.5	0	0	0	0	107.3	V203 F205	V200-V203 PolarHBondContact N-O 2.83Å; V200-V203 VanDerWaalsContact N-O 3.11Å; V200-V203 PolarHBondContact O-N 2.73Å; V200-F205 HydrophobicContact CB-CD2 4.47Å; V200-F205 HydrophobicContact CB-CE2 4.14Å
201	G	72.8	Confident	58.6	Low	64 Å²	64	114 Å²	114	66%	0.66	58%	0.584	S	S	*	*	T	Hydrogen-bonded Turn	trans	71.9	-128.2	-173.8	0	0	0	0	0	112.5	T199	T199-G201 WeakPolarHBondContact CG2-O 3.45Å
202	N	73.8	Confident	58.7	Low	172 Å²	172	113.7 Å²	113.7	92%	0.92	59%	0.586	S	S	*	*	T	Hydrogen-bonded Turn	trans	-91.4	5.8	177.3	-80.6	-2.5	0	0	0	113.7
203	V	63.4	Low	59.7	Low	83 Å²	83	113.8 Å²	113.8	50%	0.503	59%	0.59	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-113.8	127.1	-175.2	-171.4	0	0	0	0	109.6	V200 F205	V200-V203 PolarHBondContact N-O 2.83Å; V200-V203 VanDerWaalsContact N-O 3.11Å; V200-V203 PolarHBondContact O-N 2.73Å; V203-F205 HydrophobicContact CB-CE2 4.21Å; V203-F205 HydrophobicContact CB-CZ 4.49Å; V203-F205 HydrophobicContact CG1-CE1 4.46Å; V203-F205 HydrophobicContact CG1-CE2 4.09Å; V203-F205 HydrophobicContact CG1-CZ 4.05Å
204	T	67.2	Low	61.1	Low	59 Å²	59	110.1 Å²	110.1	36%	0.362	56%	0.564	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-96	115	174.8	-0.1	0	0	0	0	109.1	M197 T199	M197-T204 HydrophobicContact CB-CG2 4.33Å; M197-T204 HydrophobicContact CE-CG2 3.43Å; M197-T204 VanDerWaalsContact CE-CG2 3.43Å; T199-T204 HydrophobicContact CG2-CG2 4.36Å; T199-T204 WeakPolarHBondContact OG1-CG2 3.43Å
205	F	60.1	Low	63	Low	116 Å²	116	104.8 Å²	104.8	51%	0.509	56%	0.555	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-88.7	122.2	173.8	-66.8	-84.8	0	0	0	109.2	R196 M197 E198 V200 V203	R196-F205 VanDerWaalsContact O-O 3.07Å; M197-F205 WeakPolarHBondContact CA-O 3.43Å; E198-F205 PolarHBondContact N-O 3.43Å; E198-F205 PolarHBondContact O-N 3.06Å; V200-F205 HydrophobicContact CB-CD2 4.47Å; V200-F205 HydrophobicContact CB-CE2 4.14Å; V203-F205 HydrophobicContact CB-CE2 4.21Å; V203-F205 HydrophobicContact CB-CZ 4.49Å; V203-F205 HydrophobicContact CG1-CE1 4.46Å; V203-F205 HydrophobicContact CG1-CE2 4.09Å; V203-F205 HydrophobicContact CG1-CZ 4.05Å
206	Y	58.3	Low	64.8	Low	172 Å²	172	104.5 Å²	104.5	68%	0.675	54%	0.54	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-92.4	104.2	169.7	-68.8	-88.8	0	0	0	108.2	M197 K208	M197-Y206 HydrophobicContact CE-CE1 3.75Å; M197-Y206 HydrophobicContact CE-CE2 4.36Å; M197-Y206 WeakPolarHBondContact CE-OH 3.45Å; M197-Y206 HydrophobicContact CG-CD1 3.97Å; M197-Y206 HydrophobicContact CG-CE1 3.74Å; M197-Y206 HydrophobicContact SD-CD1 4.44Å; M197-Y206 HydrophobicContact SD-CE1 3.64Å; Y206-K208 PolarHBondContact O-N 2.76Å
207	Y	56	Low	66.4	Low	144 Å²	144	97.4 Å²	97.4	57%	0.565	51%	0.514	S	S	*	.			trans	-82.1	105.1	171.8	-153.2	-93.2	0	0	0	108.5	R196 P209	R196-Y207 PolarHBondContact O-N 3.07Å; Y207-P209 VanDerWaalsContact O-CD 3.24Å; Y207-P209 WeakPolarHBondContact O-CD 3.28Å
208	K	55.8	Low	68.1	Low	149 Å²	149	96.6 Å²	96.6	65%	0.648	51%	0.511	S	S	*	.			trans	-75.1	110.8	165.4	-171	-179.8	179.6	-173.1	0	105.9	Y206 N210	Y206-K208 PolarHBondContact O-N 2.76Å; K208-N210 PolarHBondContact O-N 2.59Å
209	P	58	Low	69.9	Low	56 Å²	56	92.3 Å²	92.3	36%	0.364	49%	0.494	S	S	.	.			trans	-59.6	140	177.8	23.9	-31	0	0	0	109.4	Y207 I211	Y207-P209 VanDerWaalsContact O-CD 3.24Å; Y207-P209 WeakPolarHBondContact O-CD 3.28Å; P209-I211 PolarHBondContact O-N 3.43Å
210	N	63.4	Low	71.5	Confident	101 Å²	101	88.6 Å²	88.6	54%	0.54	47%	0.47	S	S	.	.			trans	-65.1	125.7	175.8	-80.7	-25.6	0	0	0	108.6	K208 L212 T213	K208-N210 PolarHBondContact O-N 2.59Å; N210-L212 PolarHBondContact O-N 2.98Å; N210-L212 VanDerWaalsContact O-N 3.15Å; N210-T213 HydrophobicContact CB-CG2 4.17Å; N210-T213 PolarHBondContact O-N 3.01Å; N210-T213 PolarHBondContact O-OG1 3.39Å
211	I	64.9	Low	73	Confident	69 Å²	69	85.4 Å²	85.4	35%	0.354	45%	0.451	S	S	.	.	G	3₁₀ helix	trans	-56.2	-34.8	177.9	-32	171.1	0	0	0	110.6	P209 T213 D214 F217	P209-I211 PolarHBondContact O-N 3.43Å; I211-T213 PolarHBondContact O-N 2.88Å; I211-T213 VanDerWaalsContact O-N 3.16Å; I211-D214 WeakPolarHBondContact O-CB 3.42Å; I211-D214 PolarHBondContact O-N 3.29Å; I211-D214 VanDerWaalsContact O-N 3.13Å; I211-F217 HydrophobicContact CG2-CB 4.33Å; I211-F217 HydrophobicContact CG2-CD1 4.25Å; I211-F217 HydrophobicContact CG2-CD2 3.79Å; I211-F217 HydrophobicContact CG2-CE2 4.14Å; I211-F217 HydrophobicContact CG2-CG 3.85Å; I211-F217 WeakPolarHBondContact O-CD1 3.25Å
212	L	63.7	Low	74	Confident	136 Å²	136	87.4 Å²	87.4	71%	0.712	45%	0.446	S	S	*	.	G	3₁₀ helix	trans	-65.9	-12.7	176.4	-65.6	169.7	0	0	0	114.6	N210 F217 I218	N210-L212 PolarHBondContact O-N 2.98Å; N210-L212 VanDerWaalsContact O-N 3.15Å; L212-F217 HydrophobicContact CD2-CE1 4.07Å; L212-I218 WeakPolarHBondContact O-CD1 3.38Å
213	T	69.6	Low	75.1	Confident	96 Å²	96	79.6 Å²	79.6	59%	0.589	41%	0.405	S	S	*	.	G	3₁₀ helix	trans	-100.4	-8.5	176	54.9	0	0	0	0	113.2	N210 I211 P215	N210-T213 HydrophobicContact CB-CG2 4.17Å; N210-T213 PolarHBondContact O-N 3.01Å; N210-T213 PolarHBondContact O-OG1 3.39Å; I211-T213 PolarHBondContact O-N 2.88Å; I211-T213 VanDerWaalsContact O-N 3.16Å; T213-P215 WeakPolarHBondContact O-CD 3.33Å
214	D	81.3	Confident	76.7	Confident	55 Å²	55	75.9 Å²	75.9	29%	0.294	38%	0.382	S	S	.	.			trans	-71.4	118.4	175.3	171.5	25.4	0	0	0	110.2	I211 F216 F217 I218	I211-D214 WeakPolarHBondContact O-CB 3.42Å; I211-D214 PolarHBondContact O-N 3.29Å; I211-D214 VanDerWaalsContact O-N 3.13Å; D214-F216 PolarHBondContact O-N 3.45Å; D214-F216 WeakPolarHBondContact OD1-CD2 3.46Å; D214-F216 PolarHBondContact OD1-N 3.49Å; D214-F217 HydrophobicContact CB-CB 3.96Å; D214-F217 PolarHBondContact O-N 3.49Å; D214-F217 PolarHBondContact OD2-N 3.37Å; D214-F217 VanDerWaalsContact OD2-N 3.08Å; D214-I218 WeakPolarHBondContact O-CG1 3.14Å; D214-I218 PolarHBondContact O-N 3.37Å
215	P	85.8	Confident	78.1	Confident	87 Å²	87	77.9 Å²	77.9	57%	0.565	39%	0.389	S	S	*	.	H	α-helix	trans	-56.4	-34.3	177.1	-24.3	35	0	0	0	113.2	T213 I218 V219	T213-P215 WeakPolarHBondContact O-CD 3.33Å; P215-I218 PolarHBondContact O-N 3.49Å; P215-V219 VanDerWaalsContact O-CG2 3.32Å; P215-V219 WeakPolarHBondContact O-CG2 3.47Å; P215-V219 PolarHBondContact O-N 3.06Å
216	F	86.8	Confident	79.9	Confident	40 Å²	40	75.5 Å²	75.5	18%	0.175	38%	0.377	C	S	.	.	H	α-helix	trans	-68.7	-46.9	179.4	-65	-67.8	0	0	0	111.2	I180 L183 L189 D214 I218 V219 E220	I180-F216 HydrophobicContact CD1-CD1 4.08Å; I180-F216 HydrophobicContact CD1-CE1 4.32Å; I180-F216 HydrophobicContact CG2-CD1 4.06Å; L183-F216 HydrophobicContact CB-CE1 3.88Å; L183-F216 HydrophobicContact CB-CZ 4.45Å; L189-F216 HydrophobicContact CB-CE2 4.25Å; L189-F216 HydrophobicContact CB-CZ 4.1Å; L189-F216 HydrophobicContact CD1-CZ 3.97Å; L189-F216 HydrophobicContact CG-CZ 4.43Å; D214-F216 PolarHBondContact O-N 3.45Å; D214-F216 WeakPolarHBondContact OD1-CD2 3.46Å; D214-F216 PolarHBondContact OD1-N 3.49Å; F216-I218 VanDerWaalsContact C-N 3.34Å; F216-I218 PolarHBondContact O-N 2.85Å; F216-V219 PolarHBondContact O-N 3.26Å; F216-E220 WeakPolarHBondContact O-CB 3.49Å; F216-E220 PolarHBondContact O-N 2.93Å
217	F	85.8	Confident	81.8	Confident	32 Å²	32	67.3 Å²	67.3	14%	0.14	35%	0.345	C	S	.	.	H	α-helix	trans	-57.9	-42.8	173.3	-176.7	-98.4	0	0	0	112.7	I211 L212 D214 E220 T221 Y260	I211-F217 HydrophobicContact CG2-CB 4.33Å; I211-F217 HydrophobicContact CG2-CD1 4.25Å; I211-F217 HydrophobicContact CG2-CD2 3.79Å; I211-F217 HydrophobicContact CG2-CE2 4.14Å; I211-F217 HydrophobicContact CG2-CG 3.85Å; I211-F217 WeakPolarHBondContact O-CD1 3.25Å; L212-F217 HydrophobicContact CD2-CE1 4.07Å; D214-F217 HydrophobicContact CB-CB 3.96Å; D214-F217 PolarHBondContact O-N 3.49Å; D214-F217 PolarHBondContact OD2-N 3.37Å; D214-F217 VanDerWaalsContact OD2-N 3.08Å; F217-E220 PolarHBondContact O-N 3.39Å; F217-T221 WeakPolarHBondContact CE1-OG1 3.3Å; F217-T221 VanDerWaalsContact O-CB 3.26Å; F217-T221 WeakPolarHBondContact O-CB 3.41Å; F217-T221 PolarHBondContact O-N 2.88Å; F217-T221 PolarHBondContact O-OG1 3.41Å; F217-Y260 HydrophobicContact CE2-CE2 4.07Å; F217-Y260 HydrophobicContact CZ-CE2 4.39Å
218	I	89.2	Confident	83.7	Confident	75 Å²	75	61.2 Å²	61.2	39%	0.385	32%	0.323	S	S	.	.	H	α-helix	trans	-61.5	-50.7	178.3	-66.4	166	0	0	0	110.6	L212 D214 P215 F216 T221 L222	L212-I218 WeakPolarHBondContact O-CD1 3.38Å; D214-I218 WeakPolarHBondContact O-CG1 3.14Å; D214-I218 PolarHBondContact O-N 3.37Å; P215-I218 PolarHBondContact O-N 3.49Å; F216-I218 VanDerWaalsContact C-N 3.34Å; F216-I218 PolarHBondContact O-N 2.85Å; I218-T221 WeakPolarHBondContact O-CB 3.19Å; I218-T221 PolarHBondContact O-N 3.48Å; I218-L222 HydrophobicContact CG2-CD1 4.19Å; I218-L222 WeakPolarHBondContact O-CG 3.28Å; I218-L222 PolarHBondContact O-N 2.94Å
219	V	92	Very high	85.7	Confident	45 Å²	45	58.7 Å²	58.7	27%	0.273	31%	0.313	S	S	.	.	H	α-helix	trans	-66.6	-40.3	-178.3	178.9	0	0	0	0	111	I176 I180 P215 F216 L222 C223	I176-V219 HydrophobicContact CG2-CG1 3.85Å; I180-V219 HydrophobicContact CD1-CB 4.36Å; I180-V219 HydrophobicContact CD1-CG1 4.11Å; I180-V219 HydrophobicContact CG1-CB 4.36Å; I180-V219 HydrophobicContact CG1-CG1 3.72Å; P215-V219 VanDerWaalsContact O-CG2 3.32Å; P215-V219 WeakPolarHBondContact O-CG2 3.47Å; P215-V219 PolarHBondContact O-N 3.06Å; F216-V219 PolarHBondContact O-N 3.26Å; V219-L222 PolarHBondContact O-N 3.46Å; V219-C223 PolarHBondContact O-N 3.06Å; V219-C223 PolarHBondContact O-SG 2.97Å
220	E	91.7	Very high	87.5	Confident	15 Å²	15	56 Å²	56	7%	0.07	30%	0.295	C	S	.	.	H	α-helix	trans	-58.7	-48.4	173.5	-179.3	167.4	-153.9	0	0	110.8	F216 F217 L222 C223 I224 Y260 R295	F216-E220 WeakPolarHBondContact O-CB 3.49Å; F216-E220 PolarHBondContact O-N 2.93Å; F217-E220 PolarHBondContact O-N 3.39Å; E220-L222 VanDerWaalsContact C-N 3.33Å; E220-L222 PolarHBondContact O-N 3.1Å; E220-C223 WeakPolarHBondContact O-CB 3.35Å; E220-C223 PolarHBondContact O-N 3.5Å; E220-C223 VanDerWaalsContact O-N 3.14Å; E220-I224 HydrophobicContact CG-CG1 4.24Å; E220-I224 VanDerWaalsContact O-CG1 3.29Å; E220-I224 WeakPolarHBondContact O-CG1 3.5Å; E220-I224 PolarHBondContact O-N 3.01Å; E220-Y260 HydrophobicContact CG-CD2 4.12Å; E220-R295 IonicContact OE1-CZ 3.68Å; E220-R295 IonicContact OE1-NE 3.88Å; E220-R295 PolarHBondContact OE1-NE 2.81Å; E220-R295 IonicContact OE1-NH1 3.57Å; E220-R295 PolarHBondContact OE1-NH1 3.32Å; E220-R295 IonicContact OE1-NH2 2.85Å; E220-R295 IonicContact OE2-CZ 2.76Å; E220-R295 IonicContact OE2-NH1 3.73Å; E220-R295 PolarHBondContact OE2-NH1 3.45Å; E220-R295 IonicContact OE2-NH2 3.83Å
221	T	92.7	Very high	89.1	Confident	28 Å²	28	52.2 Å²	52.2	17%	0.172	28%	0.275	C	S	.	.	H	α-helix	trans	-57.3	-45.6	177.8	-60	0	0	0	0	111.5	F217 I218 C223 I224 I225 Y260	F217-T221 WeakPolarHBondContact CE1-OG1 3.3Å; F217-T221 VanDerWaalsContact O-CB 3.26Å; F217-T221 WeakPolarHBondContact O-CB 3.41Å; F217-T221 PolarHBondContact O-N 2.88Å; F217-T221 PolarHBondContact O-OG1 3.41Å; I218-T221 WeakPolarHBondContact O-CB 3.19Å; I218-T221 PolarHBondContact O-N 3.48Å; T221-C223 PolarHBondContact O-N 2.97Å; T221-I224 PolarHBondContact O-N 3.2Å; T221-I225 HydrophobicContact CG2-CD1 3.85Å; T221-I225 HydrophobicContact CG2-CG1 4.41Å; T221-I225 WeakPolarHBondContact O-CB 3.42Å; T221-I225 VanDerWaalsContact O-CG1 3.23Å; T221-I225 WeakPolarHBondContact O-CG1 3.22Å; T221-I225 PolarHBondContact O-N 3.39Å; T221-Y260 WeakPolarHBondContact CG2-OH 3.46Å; T221-Y260 PolarHBondContact OG1-OH 3.37Å
222	L	95.6	Very high	90.6	Very high	106 Å²	106	53.1 Å²	53.1	56%	0.555	28%	0.279	S	S	*	.	H	α-helix	trans	-62	-41.7	176.9	-69.3	174.6	0	0	0	112.3	I218 V219 E220 I225 W226	I218-L222 HydrophobicContact CG2-CD1 4.19Å; I218-L222 WeakPolarHBondContact O-CG 3.28Å; I218-L222 PolarHBondContact O-N 2.94Å; V219-L222 PolarHBondContact O-N 3.46Å; E220-L222 VanDerWaalsContact C-N 3.33Å; E220-L222 PolarHBondContact O-N 3.1Å; L222-I225 PolarHBondContact O-N 3Å; L222-W226 PolarHBondContact O-N 3.49Å; L222-W226 VanDerWaalsContact O-N 3.09Å
223	C	96.4	Very high	92.1	Very high	7 Å²	7	47.9 Å²	47.9	5%	0.047	25%	0.253	C	S	.	.	H	α-helix	trans	-63.7	-43.3	176.3	-65.1	0	0	0	0	111.5	V173 V219 E220 T221 W226 F227	V173-C223 HydrophobicContact CG1-CB 3.97Å; V219-C223 PolarHBondContact O-N 3.06Å; V219-C223 PolarHBondContact O-SG 2.97Å; E220-C223 WeakPolarHBondContact O-CB 3.35Å; E220-C223 PolarHBondContact O-N 3.5Å; E220-C223 VanDerWaalsContact O-N 3.14Å; T221-C223 PolarHBondContact O-N 2.97Å; C223-W226 WeakPolarHBondContact O-CB 3.33Å; C223-W226 PolarHBondContact O-N 2.92Å; C223-F227 WeakPolarHBondContact O-CG 3.23Å; C223-F227 PolarHBondContact O-N 3.5Å
224	I	95.9	Very high	93.3	Very high	5 Å²	5	43.4 Å²	43.4	3%	0.026	23%	0.225	C	C	.	.	H	α-helix	trans	-69.7	-35.5	179.6	-62.7	-65.7	0	0	0	111.5	E220 T221 W226 F227 S228 I257 Y260 F261	E220-I224 HydrophobicContact CG-CG1 4.24Å; E220-I224 VanDerWaalsContact O-CG1 3.29Å; E220-I224 WeakPolarHBondContact O-CG1 3.5Å; E220-I224 PolarHBondContact O-N 3.01Å; T221-I224 PolarHBondContact O-N 3.2Å; I224-W226 VanDerWaalsContact C-N 3.32Å; I224-W226 PolarHBondContact O-N 2.86Å; I224-F227 HydrophobicContact CD1-CD2 4.18Å; I224-F227 PolarHBondContact O-N 3.26Å; I224-S228 VanDerWaalsContact O-CB 3.23Å; I224-S228 WeakPolarHBondContact O-CB 3.49Å; I224-S228 PolarHBondContact O-N 3.48Å; I224-S228 PolarHBondContact O-OG 3.34Å; I224-I257 HydrophobicContact CD1-CG2 4.45Å; I224-I257 HydrophobicContact CG2-CB 4.43Å; I224-I257 HydrophobicContact CG2-CG2 4.37Å; I224-Y260 HydrophobicContact CB-CD1 4.3Å; I224-Y260 HydrophobicContact CB-CD2 4.49Å; I224-Y260 HydrophobicContact CB-CG 4.16Å; I224-Y260 HydrophobicContact CG1-CD1 4.47Å; I224-Y260 HydrophobicContact CG1-CD2 4.01Å; I224-Y260 HydrophobicContact CG1-CG 3.84Å; I224-Y260 HydrophobicContact CG2-CD1 3.66Å; I224-Y260 HydrophobicContact CG2-CE1 4.29Å; I224-Y260 HydrophobicContact CG2-CG 3.87Å; I224-F261 HydrophobicContact CG2-CE2 4.12Å; I224-F261 HydrophobicContact CG2-CZ 4.44Å
225	I	97.3	Very high	94	Very high	101 Å²	101	43.7 Å²	43.7	52%	0.518	22%	0.224	S	C	.	.	H	α-helix	trans	-58.7	-46.5	171.1	-73.6	166.6	0	0	0	109.9	T221 L222 S228 F229	T221-I225 HydrophobicContact CG2-CD1 3.85Å; T221-I225 HydrophobicContact CG2-CG1 4.41Å; T221-I225 WeakPolarHBondContact O-CB 3.42Å; T221-I225 VanDerWaalsContact O-CG1 3.23Å; T221-I225 WeakPolarHBondContact O-CG1 3.22Å; T221-I225 PolarHBondContact O-N 3.39Å; L222-I225 PolarHBondContact O-N 3Å; I225-S228 PolarHBondContact O-N 3.5Å; I225-F229 VanDerWaalsContact O-CB 3.28Å; I225-F229 WeakPolarHBondContact O-CB 3.44Å; I225-F229 PolarHBondContact O-N 2.89Å
226	W	97.8	Very high	94.5	Very high	67 Å²	67	45.8 Å²	45.8	25%	0.254	22%	0.224	S	C	.	.	H	α-helix	trans	-62	-47.2	176.9	-176	-94.6	0	0	0	112.3	V169 S170 V173 L222 C223 I224 S228 F229 E230	V169-W226 HydrophobicContact CB-CZ2 4.18Å; V169-W226 HydrophobicContact CG1-CH2 3.75Å; V169-W226 HydrophobicContact CG1-CZ2 3.53Å; V169-W226 HydrophobicContact CG1-CZ3 4.41Å; S170-W226 PolarHBondContact OG-NE1 3.31Å; V173-W226 HydrophobicContact CB-CG 4.45Å; V173-W226 HydrophobicContact CG1-CB 4.1Å; V173-W226 HydrophobicContact CG1-CG 4.15Å; V173-W226 HydrophobicContact CG2-CD2 4.46Å; V173-W226 HydrophobicContact CG2-CG 4.09Å; L222-W226 PolarHBondContact O-N 3.49Å; L222-W226 VanDerWaalsContact O-N 3.09Å; C223-W226 WeakPolarHBondContact O-CB 3.33Å; C223-W226 PolarHBondContact O-N 2.92Å; I224-W226 VanDerWaalsContact C-N 3.32Å; I224-W226 PolarHBondContact O-N 2.86Å; W226-S228 VanDerWaalsContact C-N 3.33Å; W226-S228 PolarHBondContact O-N 3.3Å; W226-F229 HydrophobicContact CE3-CD1 4.49Å; W226-F229 WeakPolarHBondContact O-CB 3.05Å; W226-F229 PolarHBondContact O-N 3.31Å; W226-E230 WeakPolarHBondContact O-CB 3.45Å; W226-E230 PolarHBondContact O-N 2.9Å
227	F	97.3	Very high	94.8	Very high	0 Å²	0	44 Å²	44	0%	0	22%	0.218	C	C	.	.	H	α-helix	trans	-62.9	-39.2	177.6	-66.2	-17.3	0	0	0	112.9	V173 I174 C223 I224 E230 L231 I257 K301	V173-F227 HydrophobicContact CB-CE1 4.45Å; V173-F227 HydrophobicContact CG1-CD1 4.39Å; V173-F227 HydrophobicContact CG1-CE1 3.77Å; V173-F227 HydrophobicContact CG1-CZ 4.2Å; I174-F227 HydrophobicContact CB-CZ 4.43Å; I174-F227 HydrophobicContact CG1-CE1 3.65Å; I174-F227 HydrophobicContact CG1-CZ 3.79Å; C223-F227 WeakPolarHBondContact O-CG 3.23Å; C223-F227 PolarHBondContact O-N 3.5Å; I224-F227 HydrophobicContact CD1-CD2 4.18Å; I224-F227 PolarHBondContact O-N 3.26Å; F227-E230 WeakPolarHBondContact O-CB 3.29Å; F227-L231 WeakPolarHBondContact O-CB 3.13Å; F227-L231 PolarHBondContact O-N 2.97Å; F227-I257 HydrophobicContact CB-CG2 3.54Å; F227-I257 HydrophobicContact CD2-CG2 4.4Å; F227-I257 HydrophobicContact CG-CG2 4.5Å; F227-K301 HydrophobicContact CD1-CD 4.04Å; F227-K301 HydrophobicContact CE1-CD 4.02Å; F227-K301 HydrophobicContact CG-CD 4.47Å; F227-K301 HydrophobicContact CZ-CD 4.41Å
228	S	97.3	Very high	95.2	Very high	16 Å²	16	42.7 Å²	42.7	11%	0.112	21%	0.212	C	C	.	.	H	α-helix	trans	-66.7	-44.1	176.6	-58.3	0	0	0	0	110.5	I224 I225 W226 E230 L231 I232	I224-S228 VanDerWaalsContact O-CB 3.23Å; I224-S228 WeakPolarHBondContact O-CB 3.49Å; I224-S228 PolarHBondContact O-N 3.48Å; I224-S228 PolarHBondContact O-OG 3.34Å; I225-S228 PolarHBondContact O-N 3.5Å; W226-S228 VanDerWaalsContact C-N 3.33Å; W226-S228 PolarHBondContact O-N 3.3Å; S228-E230 PolarHBondContact O-N 3.09Å; S228-L231 PolarHBondContact O-N 3.49Å; S228-I232 VanDerWaalsContact O-CB 3.27Å; S228-I232 WeakPolarHBondContact O-CB 3.49Å; S228-I232 WeakPolarHBondContact O-CD1 3.36Å; S228-I232 WeakPolarHBondContact O-CG1 3.34Å; S228-I232 PolarHBondContact O-N 2.79Å
229	F	97.3	Very high	95.2	Very high	96 Å²	96	41.7 Å²	41.7	42%	0.421	21%	0.21	S	C	.	.	H	α-helix	trans	-56.6	-50.9	174.5	166.2	-105.3	0	0	0	111.4	F154 I225 W226 L231 I232 V233	F154-F229 HydrophobicContact CE1-CD1 4.46Å; F154-F229 AromaticContact CE1-CE1 3.81Å; F154-F229 HydrophobicContact CE1-CE1 3.81Å; F154-F229 HydrophobicContact CE1-CZ 4.45Å; F154-F229 AromaticContact CZ-CE1 3.61Å; F154-F229 HydrophobicContact CZ-CE1 3.61Å; F154-F229 AromaticContact CZ-CZ 3.87Å; F154-F229 HydrophobicContact CZ-CZ 3.87Å; I225-F229 VanDerWaalsContact O-CB 3.28Å; I225-F229 WeakPolarHBondContact O-CB 3.44Å; I225-F229 PolarHBondContact O-N 2.89Å; W226-F229 HydrophobicContact CE3-CD1 4.49Å; W226-F229 WeakPolarHBondContact O-CB 3.05Å; W226-F229 PolarHBondContact O-N 3.31Å; F229-L231 PolarHBondContact O-N 3.05Å; F229-I232 PolarHBondContact O-N 3.44Å; F229-V233 HydrophobicContact CD2-CG2 3.87Å; F229-V233 HydrophobicContact CE1-CG2 4.41Å; F229-V233 HydrophobicContact CE2-CG2 3.5Å; F229-V233 HydrophobicContact CG-CG2 4.47Å; F229-V233 HydrophobicContact CZ-CG2 3.81Å; F229-V233 WeakPolarHBondContact O-CB 3.46Å; F229-V233 VanDerWaalsContact O-CG2 3.28Å; F229-V233 WeakPolarHBondContact O-CG2 3.23Å; F229-V233 PolarHBondContact O-N 2.98Å
230	E	96.4	Very high	95.2	Very high	0 Å²	0	42.1 Å²	42.1	0%	0	22%	0.216	C	C	.	.	H	α-helix	trans	-55.4	-47.7	175.5	-91.4	-156.2	104.2	0	0	113.2	F154 S170 W226 F227 S228 R234 K301	F154-E230 HydrophobicContact CD1-CG 4.39Å; F154-E230 HydrophobicContact CE1-CG 4.22Å; S170-E230 PolarHBondContact OG-OE1 3.5Å; W226-E230 WeakPolarHBondContact O-CB 3.45Å; W226-E230 PolarHBondContact O-N 2.9Å; F227-E230 WeakPolarHBondContact O-CB 3.29Å; S228-E230 PolarHBondContact O-N 3.09Å; E230-R234 VanDerWaalsContact CB-NH1 3.27Å; E230-R234 WeakPolarHBondContact O-CB 3.47Å; E230-R234 VanDerWaalsContact O-CG 3.31Å; E230-R234 WeakPolarHBondContact O-CG 3.2Å; E230-R234 PolarHBondContact O-N 3.07Å; E230-R234 VanDerWaalsContact O-N 3.08Å; E230-R234 PolarHBondContact O-NH1 3.25Å; E230-R234 IonicContact OE1-CZ 3.67Å; E230-R234 VanDerWaalsContact OE1-CZ 3.31Å; E230-R234 IonicContact OE1-NH1 3.01Å; E230-R234 PolarHBondContact OE1-NH1 3.49Å; E230-R234 IonicContact OE1-NH2 2.8Å; E230-R234 PolarHBondContact OE1-NH2 2.82Å; E230-R234 IonicContact OE2-NH1 3.21Å; E230-K301 WeakPolarHBondContact OE2-CE 3.29Å; E230-K301 IonicContact OE2-NZ 3.62Å; E230-K301 PolarHBondContact OE2-NZ 3.12Å
231	L	96.2	Very high	95.2	Very high	20 Å²	20	45.1 Å²	45.1	11%	0.105	23%	0.228	C	C	.	.	H	α-helix	trans	-64.5	-44.4	178.6	178.2	68.4	0	0	0	111.4	F227 S228 F229 R234 F235 F244 D253 I254 I257	F227-L231 WeakPolarHBondContact O-CB 3.13Å; F227-L231 PolarHBondContact O-N 2.97Å; S228-L231 PolarHBondContact O-N 3.49Å; F229-L231 PolarHBondContact O-N 3.05Å; L231-R234 PolarHBondContact O-N 3.44Å; L231-F235 VanDerWaalsContact O-CB 3.28Å; L231-F235 WeakPolarHBondContact O-CB 3.3Å; L231-F235 PolarHBondContact O-N 3.44Å; L231-F244 HydrophobicContact CD1-CE1 3.93Å; L231-F244 HydrophobicContact CD1-CZ 3.82Å; L231-D253 HydrophobicContact CD1-CB 3.91Å; L231-I254 HydrophobicContact CD1-CG1 3.96Å; L231-I254 HydrophobicContact CD2-CG1 3.86Å; L231-I257 HydrophobicContact CD2-CD1 3.56Å; L231-I257 HydrophobicContact CD2-CG1 4.49Å
232	I	96.5	Very high	95.2	Very high	88 Å²	88	47.1 Å²	47.1	45%	0.451	25%	0.248	S	C	.	.	H	α-helix	trans	-64.4	-47.5	-179.4	-73	167.7	0	0	0	110.6	S228 F229 R234 F235 F236	S228-I232 VanDerWaalsContact O-CB 3.27Å; S228-I232 WeakPolarHBondContact O-CB 3.49Å; S228-I232 WeakPolarHBondContact O-CD1 3.36Å; S228-I232 WeakPolarHBondContact O-CG1 3.34Å; S228-I232 PolarHBondContact O-N 2.79Å; F229-I232 PolarHBondContact O-N 3.44Å; I232-R234 VanDerWaalsContact C-N 3.35Å; I232-R234 PolarHBondContact O-N 3Å; I232-F235 PolarHBondContact O-N 3.12Å; I232-F236 HydrophobicContact CG2-CD2 3.58Å; I232-F236 HydrophobicContact CG2-CE2 3.5Å; I232-F236 WeakPolarHBondContact O-CD2 3.31Å; I232-F236 PolarHBondContact O-N 3.01Å
233	V	95.8	Very high	94.9	Very high	27 Å²	27	44.6 Å²	44.6	16%	0.164	24%	0.242	C	C	.	.	H	α-helix	trans	-60.2	-46.6	178.3	170.7	0	0	0	0	110.4	V150 F154 F229 F236 A237	V150-V233 HydrophobicContact CG1-CG1 3.39Å; F154-V233 HydrophobicContact CD1-CG1 4.34Å; F154-V233 HydrophobicContact CD2-CG1 3.65Å; F154-V233 HydrophobicContact CE1-CG1 4.39Å; F154-V233 HydrophobicContact CE2-CG1 3.71Å; F154-V233 HydrophobicContact CG-CG1 3.98Å; F154-V233 HydrophobicContact CZ-CG1 4.09Å; F229-V233 HydrophobicContact CD2-CG2 3.87Å; F229-V233 HydrophobicContact CE1-CG2 4.41Å; F229-V233 HydrophobicContact CE2-CG2 3.5Å; F229-V233 HydrophobicContact CG-CG2 4.47Å; F229-V233 HydrophobicContact CZ-CG2 3.81Å; F229-V233 WeakPolarHBondContact O-CB 3.46Å; F229-V233 VanDerWaalsContact O-CG2 3.28Å; F229-V233 WeakPolarHBondContact O-CG2 3.23Å; F229-V233 PolarHBondContact O-N 2.98Å; V233-F236 PolarHBondContact O-N 3.45Å; V233-A237 VanDerWaalsContact O-CB 3.24Å; V233-A237 WeakPolarHBondContact O-CB 3.46Å; V233-A237 PolarHBondContact O-N 3.46Å
234	R	94.8	Very high	94.7	Very high	2 Å²	2	44.5 Å²	44.5	1%	0.008	24%	0.241	C	C	.	.	H	α-helix	trans	-63	-43.5	176	-72	-175.7	-174.4	94.3	3.5	111.8	W151 F154 E155 E230 L231 I232 F236 A237 C238 F244	W151-R234 HydrophobicContact CZ3-CB 4.12Å; W151-R234 WeakPolarHBondContact CZ3-O 3.19Å; F154-R234 HydrophobicContact CB-CG 4.03Å; F154-R234 PolarHBondContact O-NE 3.01Å; F154-R234 VanDerWaalsContact O-NE 3.12Å; F154-R234 PolarHBondContact O-NH2 3.34Å; E155-R234 IonicContact OE2-NE 3.41Å; E230-R234 VanDerWaalsContact CB-NH1 3.27Å; E230-R234 WeakPolarHBondContact O-CB 3.47Å; E230-R234 VanDerWaalsContact O-CG 3.31Å; E230-R234 WeakPolarHBondContact O-CG 3.2Å; E230-R234 PolarHBondContact O-N 3.07Å; E230-R234 VanDerWaalsContact O-N 3.08Å; E230-R234 PolarHBondContact O-NH1 3.25Å; E230-R234 IonicContact OE1-CZ 3.67Å; E230-R234 VanDerWaalsContact OE1-CZ 3.31Å; E230-R234 IonicContact OE1-NH1 3.01Å; E230-R234 PolarHBondContact OE1-NH1 3.49Å; E230-R234 IonicContact OE1-NH2 2.8Å; E230-R234 PolarHBondContact OE1-NH2 2.82Å; E230-R234 IonicContact OE2-NH1 3.21Å; L231-R234 PolarHBondContact O-N 3.44Å; I232-R234 VanDerWaalsContact C-N 3.35Å; I232-R234 PolarHBondContact O-N 3Å; R234-F236 VanDerWaalsContact C-N 3.31Å; R234-F236 PolarHBondContact O-N 2.93Å; R234-A237 PolarHBondContact O-N 3.47Å; R234-C238 VanDerWaalsContact O-CB 3.26Å; R234-C238 WeakPolarHBondContact O-CB 3.34Å; R234-C238 PolarHBondContact O-N 2.88Å; R234-F244 HydrophobicContact CB-CE2 3.96Å; R234-F244 HydrophobicContact CB-CZ 4.29Å
235	F	96.1	Very high	94.5	Very high	61 Å²	61	49.9 Å²	49.9	27%	0.268	26%	0.264	S	S	.	.	H	α-helix	trans	-59.8	-41.2	177.8	177.6	-103.1	0	0	0	111.9	L231 I232 C238 K241 F244 F245	L231-F235 VanDerWaalsContact O-CB 3.28Å; L231-F235 WeakPolarHBondContact O-CB 3.3Å; L231-F235 PolarHBondContact O-N 3.44Å; I232-F235 PolarHBondContact O-N 3.12Å; F235-C238 PolarHBondContact O-SG 3.3Å; F235-K241 HydrophobicContact CE2-CB 4.22Å; F235-K241 HydrophobicContact CE2-CD 4.16Å; F235-K241 HydrophobicContact CZ-CB 4.47Å; F235-K241 HydrophobicContact CZ-CD 4.25Å; F235-K241 HydrophobicContact CZ-CG 4.46Å; F235-K241 WeakPolarHBondContact O-CD 3.29Å; F235-K241 VanDerWaalsContact O-CE 3.29Å; F235-K241 WeakPolarHBondContact O-CE 3.42Å; F235-K241 PolarHBondContact O-NZ 3.5Å; F235-F244 HydrophobicContact CB-CE1 4.23Å; F235-F244 HydrophobicContact CB-CZ 4.15Å; F235-F244 AromaticContact CD2-CD1 3.83Å; F235-F244 HydrophobicContact CD2-CD1 3.83Å; F235-F244 HydrophobicContact CD2-CE1 4.05Å; F235-F244 HydrophobicContact CD2-CG 4.26Å; F235-F245 HydrophobicContact CD2-CE2 4.37Å; F235-F245 HydrophobicContact CD2-CZ 4.28Å; F235-F245 AromaticContact CE2-CE2 3.68Å; F235-F245 HydrophobicContact CE2-CE2 3.68Å; F235-F245 AromaticContact CE2-CZ 3.87Å; F235-F245 HydrophobicContact CE2-CZ 3.87Å
236	F	94.9	Very high	94.1	Very high	130 Å²	130	53.8 Å²	53.8	57%	0.57	28%	0.278	S	S	*	.	H	α-helix	trans	-76.5	-34.2	178.3	-73.9	-59.5	0	0	0	113.3	I232 V233 R234 K241	I232-F236 HydrophobicContact CG2-CD2 3.58Å; I232-F236 HydrophobicContact CG2-CE2 3.5Å; I232-F236 WeakPolarHBondContact O-CD2 3.31Å; I232-F236 PolarHBondContact O-N 3.01Å; V233-F236 PolarHBondContact O-N 3.45Å; R234-F236 VanDerWaalsContact C-N 3.31Å; R234-F236 PolarHBondContact O-N 2.93Å; F236-K241 PolarHBondContact O-NZ 3.45Å
237	A	94.1	Very high	93.8	Very high	4 Å²	4	53.6 Å²	53.6	3%	0.033	28%	0.282	C	S	.	.	H	α-helix	trans	-82.4	-16.1	-179.6	0	0	0	0	0	114.5	P142 V150 W151 V233 R234	P142-A237 WeakPolarHBondContact CG-O 3.47Å; V150-A237 HydrophobicContact CB-CB 4.12Å; V150-A237 HydrophobicContact CG1-CB 3.78Å; W151-A237 HydrophobicContact CB-CB 4.17Å; W151-A237 HydrophobicContact CE3-CB 4.14Å; V233-A237 VanDerWaalsContact O-CB 3.24Å; V233-A237 WeakPolarHBondContact O-CB 3.46Å; V233-A237 PolarHBondContact O-N 3.46Å; R234-A237 PolarHBondContact O-N 3.47Å
238	C	93	Very high	93.5	Very high	3 Å²	3	60 Å²	60	2%	0.02	31%	0.313	C	S	.	.			trans	-67.4	149.4	-175	73.5	0	0	0	0	113.8	W151 R234 F235 K241 F244	W151-C238 VanDerWaalsContact CE3-CA 3.5Å; W151-C238 HydrophobicContact CE3-CB 3.9Å; W151-C238 HydrophobicContact CH2-CB 3.6Å; W151-C238 HydrophobicContact CZ2-CB 4.4Å; W151-C238 VanDerWaalsContact CZ3-CA 3.5Å; W151-C238 HydrophobicContact CZ3-CB 3.31Å; R234-C238 VanDerWaalsContact O-CB 3.26Å; R234-C238 WeakPolarHBondContact O-CB 3.34Å; R234-C238 PolarHBondContact O-N 2.88Å; F235-C238 PolarHBondContact O-SG 3.3Å; C238-K241 PolarHBondContact O-NZ 3.19Å; C238-K241 WeakPolarHBondContact SG-CD 3.41Å; C238-K241 PolarHBondContact SG-NZ 3.32Å; C238-K241 VanDerWaalsContact SG-NZ 3.44Å; C238-F244 HydrophobicContact CB-CD2 3.78Å; C238-F244 HydrophobicContact CB-CE2 4.44Å
239	P	90.8	Very high	93.2	Very high	54 Å²	54	61.1 Å²	61.1	35%	0.351	32%	0.317	S	S	.	.	S	Bend	trans	-67.2	-35.6	-178	27.8	-37.7	0	0	0	113.2	P140 P142	P140-P239 HydrophobicContact CB-CB 4.3Å; P140-P239 HydrophobicContact CB-CG 4.22Å; P140-P239 HydrophobicContact CG-CG 4.06Å; P140-P239 WeakPolarHBondContact O-CG 3.12Å; P142-P239 HydrophobicContact CG-CB 4.48Å
240	S	92.1	Very high	93.1	Very high	55 Å²	55	56.6 Å²	56.6	39%	0.385	30%	0.297	S	S	.	.			trans	-138	121.6	-179.9	171.7	0	0	0	0	111.2	A243 F244	S240-A243 PolarHBondContact O-N 3.21Å; S240-A243 PolarHBondContact OG-N 2.71Å; S240-F244 PolarHBondContact O-N 2.85Å
241	K	91.8	Very high	93	Very high	77 Å²	77	59.3 Å²	59.3	34%	0.335	31%	0.314	S	S	.	.	H	α-helix	trans	-69.4	-34.1	-178.7	-51.4	-47.4	-178.7	-155.4	0	112.3	F235 F236 C238 F244 F245	F235-K241 HydrophobicContact CE2-CB 4.22Å; F235-K241 HydrophobicContact CE2-CD 4.16Å; F235-K241 HydrophobicContact CZ-CB 4.47Å; F235-K241 HydrophobicContact CZ-CD 4.25Å; F235-K241 HydrophobicContact CZ-CG 4.46Å; F235-K241 WeakPolarHBondContact O-CD 3.29Å; F235-K241 VanDerWaalsContact O-CE 3.29Å; F235-K241 WeakPolarHBondContact O-CE 3.42Å; F235-K241 PolarHBondContact O-NZ 3.5Å; F236-K241 PolarHBondContact O-NZ 3.45Å; C238-K241 PolarHBondContact O-NZ 3.19Å; C238-K241 WeakPolarHBondContact SG-CD 3.41Å; C238-K241 PolarHBondContact SG-NZ 3.32Å; C238-K241 VanDerWaalsContact SG-NZ 3.44Å; K241-F244 WeakPolarHBondContact O-CB 3.09Å; K241-F244 PolarHBondContact O-N 3.34Å; K241-F245 WeakPolarHBondContact O-CD2 3.43Å
242	A	90.7	Very high	92.9	Very high	70 Å²	70	59.9 Å²	59.9	58%	0.579	32%	0.317	S	S	*	.	H	α-helix	trans	-73.1	-39.8	178	0	0	0	0	0	111.9	F244	A242-F244 VanDerWaalsContact C-N 3.25Å; A242-F244 PolarHBondContact O-N 2.99Å
243	A	89.9	Confident	92.8	Very high	53 Å²	53	55.9 Å²	55.9	44%	0.438	30%	0.296	S	S	.	.	H	α-helix	trans	-67.4	-30	175.3	0	0	0	0	0	111.8	S240 F245 K246 N247	S240-A243 PolarHBondContact O-N 3.21Å; S240-A243 PolarHBondContact OG-N 2.71Å; A243-F245 VanDerWaalsContact C-N 3.34Å; A243-F245 PolarHBondContact O-N 3.48Å; A243-K246 PolarHBondContact O-N 3.13Å; A243-K246 VanDerWaalsContact O-N 3.08Å; A243-N247 PolarHBondContact O-N 2.94Å
244	F	92.4	Very high	92.8	Very high	6 Å²	6	56.4 Å²	56.4	3%	0.026	30%	0.298	C	S	.	.	H	α-helix	trans	-54.1	-47.5	178.3	-173.2	-93	0	0	0	112.7	L231 R234 F235 C238 S240 K241 A242 K246 N247 N250	L231-F244 HydrophobicContact CD1-CE1 3.93Å; L231-F244 HydrophobicContact CD1-CZ 3.82Å; R234-F244 HydrophobicContact CB-CE2 3.96Å; R234-F244 HydrophobicContact CB-CZ 4.29Å; F235-F244 HydrophobicContact CB-CE1 4.23Å; F235-F244 HydrophobicContact CB-CZ 4.15Å; F235-F244 AromaticContact CD2-CD1 3.83Å; F235-F244 HydrophobicContact CD2-CD1 3.83Å; F235-F244 HydrophobicContact CD2-CE1 4.05Å; F235-F244 HydrophobicContact CD2-CG 4.26Å; C238-F244 HydrophobicContact CB-CD2 3.78Å; C238-F244 HydrophobicContact CB-CE2 4.44Å; S240-F244 PolarHBondContact O-N 2.85Å; K241-F244 WeakPolarHBondContact O-CB 3.09Å; K241-F244 PolarHBondContact O-N 3.34Å; A242-F244 VanDerWaalsContact C-N 3.25Å; A242-F244 PolarHBondContact O-N 2.99Å; F244-K246 VanDerWaalsContact C-N 3.31Å; F244-K246 PolarHBondContact O-N 3.3Å; F244-N247 WeakPolarHBondContact O-CB 3.49Å; F244-N247 PolarHBondContact O-N 3.46Å; F244-N250 HydrophobicContact CD1-CB 4.18Å; F244-N250 WeakPolarHBondContact CD2-ND2 3.32Å; F244-N250 HydrophobicContact CE1-CB 3.83Å; F244-N250 HydrophobicContact CE2-CB 4.19Å; F244-N250 VanDerWaalsContact CE2-CG 3.43Å; F244-N250 VanDerWaalsContact CE2-ND2 3.26Å; F244-N250 WeakPolarHBondContact CE2-ND2 3.49Å; F244-N250 HydrophobicContact CZ-CB 3.84Å; F244-N250 VanDerWaalsContact O-CB 3.32Å; F244-N250 WeakPolarHBondContact O-CB 3.25Å; F244-N250 PolarHBondContact O-ND2 2.82Å
245	F	91.2	Very high	92.7	Very high	117 Å²	117	58.6 Å²	58.6	51%	0.513	31%	0.311	S	S	.	.	H	α-helix	trans	-76	-15.6	179.8	-67.7	-73.1	0	0	0	114	F235 K241 A243 I254	F235-F245 HydrophobicContact CD2-CE2 4.37Å; F235-F245 HydrophobicContact CD2-CZ 4.28Å; F235-F245 AromaticContact CE2-CE2 3.68Å; F235-F245 HydrophobicContact CE2-CE2 3.68Å; F235-F245 AromaticContact CE2-CZ 3.87Å; F235-F245 HydrophobicContact CE2-CZ 3.87Å; K241-F245 WeakPolarHBondContact O-CD2 3.43Å; A243-F245 VanDerWaalsContact C-N 3.34Å; A243-F245 PolarHBondContact O-N 3.48Å; F245-I254 HydrophobicContact CD1-CD1 3.71Å; F245-I254 HydrophobicContact CE1-CD1 3.72Å
246	K	90.1	Very high	92.7	Very high	184 Å²	184	55.9 Å²	55.9	80%	0.8	30%	0.3	S	S	*	.	H	α-helix	trans	-83.9	-15.4	173.5	-66.3	-177.4	-179.9	-178.2	0	112.6	A243 F244	A243-K246 PolarHBondContact O-N 3.13Å; A243-K246 VanDerWaalsContact O-N 3.08Å; F244-K246 VanDerWaalsContact C-N 3.31Å; F244-K246 PolarHBondContact O-N 3.3Å
247	N	90.4	Very high	92.7	Very high	63 Å²	63	50.5 Å²	50.5	34%	0.337	28%	0.277	S	S	.	.	S	Bend	trans	-76.4	126.2	178.5	-174.1	-27.9	0	0	0	110.3	A243 F244 M249 N250 T251	A243-N247 PolarHBondContact O-N 2.94Å; F244-N247 WeakPolarHBondContact O-CB 3.49Å; F244-N247 PolarHBondContact O-N 3.46Å; N247-M249 VanDerWaalsContact C-N 3.29Å; N247-M249 PolarHBondContact O-N 3.07Å; N247-M249 PolarHBondContact OD1-N 2.86Å; N247-N250 HydrophobicContact CB-CB 4.38Å; N247-N250 WeakPolarHBondContact CB-ND2 3.26Å; N247-N250 PolarHBondContact O-N 3.1Å; N247-T251 PolarHBondContact O-N 3.05Å; N247-T251 VanDerWaalsContact O-N 3.09Å; N247-T251 PolarHBondContact O-OG1 2.52Å
248	M	91.4	Very high	92.6	Very high	135 Å²	135	53.7 Å²	53.7	67%	0.665	29%	0.293	S	S	*	.	H	α-helix	trans	-57.3	-40	179.6	-176.7	61.9	75.1	0	0	112.3	N250 T251 I252	M248-N250 PolarHBondContact O-N 3.33Å; M248-T251 WeakPolarHBondContact O-CB 3.16Å; M248-T251 PolarHBondContact O-N 3.39Å; M248-I252 HydrophobicContact CG-CD1 4.34Å; M248-I252 WeakPolarHBondContact O-CG1 3.49Å; M248-I252 PolarHBondContact O-N 2.73Å
249	M	91.6	Very high	92.6	Very high	38 Å²	38	53.7 Å²	53.7	19%	0.187	29%	0.292	C	S	.	.	H	α-helix	trans	-65.2	-41.7	-178.7	-63.2	-54.8	-158.6	0	0	112.3	N247 T251 I252 D253 S303 Q310	N247-M249 VanDerWaalsContact C-N 3.29Å; N247-M249 PolarHBondContact O-N 3.07Å; N247-M249 PolarHBondContact OD1-N 2.86Å; M249-T251 VanDerWaalsContact C-N 3.29Å; M249-T251 PolarHBondContact O-N 3.29Å; M249-I252 WeakPolarHBondContact O-CB 3.41Å; M249-I252 PolarHBondContact O-N 2.97Å; M249-I252 HydrophobicContact SD-CD1 4.32Å; M249-D253 PolarHBondContact O-N 3.22Å; M249-S303 PolarHBondContact SD-OG 2.96Å; M249-Q310 HydrophobicContact CE-CG 3.5Å
250	N	94.2	Very high	92.6	Very high	2 Å²	2	52.3 Å²	52.3	1%	0.011	28%	0.28	C	S	.	.	H	α-helix	trans	-70.2	-30.8	177.3	-60.8	-24.9	0	0	0	111.4	F244 N247 M248 D253 I254 R304	F244-N250 HydrophobicContact CD1-CB 4.18Å; F244-N250 WeakPolarHBondContact CD2-ND2 3.32Å; F244-N250 HydrophobicContact CE1-CB 3.83Å; F244-N250 HydrophobicContact CE2-CB 4.19Å; F244-N250 VanDerWaalsContact CE2-CG 3.43Å; F244-N250 VanDerWaalsContact CE2-ND2 3.26Å; F244-N250 WeakPolarHBondContact CE2-ND2 3.49Å; F244-N250 HydrophobicContact CZ-CB 3.84Å; F244-N250 VanDerWaalsContact O-CB 3.32Å; F244-N250 WeakPolarHBondContact O-CB 3.25Å; F244-N250 PolarHBondContact O-ND2 2.82Å; N247-N250 HydrophobicContact CB-CB 4.38Å; N247-N250 WeakPolarHBondContact CB-ND2 3.26Å; N247-N250 PolarHBondContact O-N 3.1Å; M248-N250 PolarHBondContact O-N 3.33Å; N250-D253 PolarHBondContact O-N 2.91Å; N250-I254 WeakPolarHBondContact O-CG1 3.34Å; N250-I254 PolarHBondContact O-N 3.37Å; N250-R304 PolarHBondContact OD1-NH2 2.88Å
251	T	94	Very high	92.6	Very high	56 Å²	56	54.6 Å²	54.6	34%	0.344	28%	0.284	S	S	.	.	H	α-helix	trans	-63.2	-43.1	172.5	-55.7	0	0	0	0	110.9	N247 M248 M249 D253 I254 V255	N247-T251 PolarHBondContact O-N 3.05Å; N247-T251 VanDerWaalsContact O-N 3.09Å; N247-T251 PolarHBondContact O-OG1 2.52Å; M248-T251 WeakPolarHBondContact O-CB 3.16Å; M248-T251 PolarHBondContact O-N 3.39Å; M249-T251 VanDerWaalsContact C-N 3.29Å; M249-T251 PolarHBondContact O-N 3.29Å; T251-D253 PolarHBondContact O-N 2.92Å; T251-I254 PolarHBondContact O-N 3.36Å; T251-V255 WeakPolarHBondContact O-CG2 3.44Å; T251-V255 PolarHBondContact O-N 2.94Å
252	I	94.6	Very high	92.5	Very high	33 Å²	33	54.6 Å²	54.6	17%	0.169	29%	0.286	C	S	.	.	H	α-helix	trans	-61.1	-43.3	174.6	-66.9	164.1	0	0	0	111	M248 M249 I254 V255 A256 F300 K301	M248-I252 HydrophobicContact CG-CD1 4.34Å; M248-I252 WeakPolarHBondContact O-CG1 3.49Å; M248-I252 PolarHBondContact O-N 2.73Å; M249-I252 WeakPolarHBondContact O-CB 3.41Å; M249-I252 PolarHBondContact O-N 2.97Å; M249-I252 HydrophobicContact SD-CD1 4.32Å; I252-I254 VanDerWaalsContact C-N 3.29Å; I252-I254 PolarHBondContact O-N 3.33Å; I252-V255 PolarHBondContact O-N 2.87Å; I252-A256 WeakPolarHBondContact O-CB 3.34Å; I252-A256 PolarHBondContact O-N 2.86Å; I252-F300 HydrophobicContact CD1-CB 4.2Å; I252-F300 HydrophobicContact CG1-CB 4.47Å; I252-F300 HydrophobicContact CG2-CB 3.84Å; I252-K301 HydrophobicContact CG2-CB 4.39Å
253	D	95	Very high	92.2	Very high	3 Å²	3	51.8 Å²	51.8	2%	0.016	26%	0.262	C	S	.	.	H	α-helix	trans	-59.5	-38.1	176.3	-78.1	-48.3	0	0	0	112.4	L231 M249 N250 T251 K301 R304	L231-D253 HydrophobicContact CD1-CB 3.91Å; M249-D253 PolarHBondContact O-N 3.22Å; N250-D253 PolarHBondContact O-N 2.91Å; T251-D253 PolarHBondContact O-N 2.92Å; D253-K301 VanDerWaalsContact OD1-CD 3.31Å; D253-K301 WeakPolarHBondContact OD1-CD 3.31Å; D253-K301 WeakPolarHBondContact OD1-CE 3.44Å; D253-K301 WeakPolarHBondContact OD1-CG 3.41Å; D253-K301 IonicContact OD1-NZ 2.8Å; D253-K301 PolarHBondContact OD1-NZ 3.37Å; D253-R304 IonicContact OD2-CZ 3.57Å; D253-R304 IonicContact OD2-NE 3.48Å; D253-R304 PolarHBondContact OD2-NE 2.96Å; D253-R304 IonicContact OD2-NH2 3.72Å; D253-R304 PolarHBondContact OD2-NH2 3.39Å
254	I	94.9	Very high	91.9	Very high	39 Å²	39	51.8 Å²	51.8	20%	0.2	25%	0.254	C	S	.	.	H	α-helix	trans	-69.3	-49.6	175.9	-68.1	162.5	0	0	0	111	L231 F245 N250 T251 I252 A256 I257 I258	L231-I254 HydrophobicContact CD1-CG1 3.96Å; L231-I254 HydrophobicContact CD2-CG1 3.86Å; F245-I254 HydrophobicContact CD1-CD1 3.71Å; F245-I254 HydrophobicContact CE1-CD1 3.72Å; N250-I254 WeakPolarHBondContact O-CG1 3.34Å; N250-I254 PolarHBondContact O-N 3.37Å; T251-I254 PolarHBondContact O-N 3.36Å; I252-I254 VanDerWaalsContact C-N 3.29Å; I252-I254 PolarHBondContact O-N 3.33Å; I254-A256 PolarHBondContact O-N 2.86Å; I254-I257 WeakPolarHBondContact O-CG1 3.38Å; I254-I257 PolarHBondContact O-N 3.3Å; I254-I257 VanDerWaalsContact O-N 3.13Å; I254-I258 HydrophobicContact CG2-CD1 3.61Å; I254-I258 HydrophobicContact CG2-CG1 4.16Å; I254-I258 WeakPolarHBondContact O-CG1 3.34Å; I254-I258 PolarHBondContact O-N 2.78Å
255	V	94.3	Very high	91.5	Very high	48 Å²	48	53.4 Å²	53.4	29%	0.291	27%	0.273	S	S	.	.	H	α-helix	trans	-59.1	-32.2	179.5	171.3	0	0	0	0	111.5	T251 I252 I257 P259 V294 F297	T251-V255 WeakPolarHBondContact O-CG2 3.44Å; T251-V255 PolarHBondContact O-N 2.94Å; I252-V255 PolarHBondContact O-N 2.87Å; V255-I257 VanDerWaalsContact C-N 3.31Å; V255-I257 PolarHBondContact O-N 3.42Å; V255-P259 WeakPolarHBondContact O-CD 3.21Å; V255-V294 HydrophobicContact CG1-CG1 4.06Å; V255-F297 HydrophobicContact CG1-CB 4.05Å; V255-F297 HydrophobicContact CG1-CD2 4.36Å; V255-F297 HydrophobicContact CG1-CG 4.49Å
256	A	94.4	Very high	91	Very high	3 Å²	3	49.8 Å²	49.8	3%	0.025	26%	0.261	C	S	.	.	H	α-helix	trans	-66.4	-26.1	179.2	0	0	0	0	0	114.5	I252 I254 R298	I252-A256 WeakPolarHBondContact O-CB 3.34Å; I252-A256 PolarHBondContact O-N 2.86Å; I254-A256 PolarHBondContact O-N 2.86Å; A256-R298 HydrophobicContact CB-CB 3.72Å
257	I	95	Very high	90.2	Very high	18 Å²	18	43.5 Å²	43.5	9%	0.092	23%	0.234	C	C	.	.	H	α-helix	trans	-101.7	-25.1	-178.1	62.4	168.3	0	0	0	113.6	I224 F227 L231 I254 V255 P259 Y260 F261	I224-I257 HydrophobicContact CD1-CG2 4.45Å; I224-I257 HydrophobicContact CG2-CB 4.43Å; I224-I257 HydrophobicContact CG2-CG2 4.37Å; F227-I257 HydrophobicContact CB-CG2 3.54Å; F227-I257 HydrophobicContact CD2-CG2 4.4Å; F227-I257 HydrophobicContact CG-CG2 4.5Å; L231-I257 HydrophobicContact CD2-CD1 3.56Å; L231-I257 HydrophobicContact CD2-CG1 4.49Å; I254-I257 WeakPolarHBondContact O-CG1 3.38Å; I254-I257 PolarHBondContact O-N 3.3Å; I254-I257 VanDerWaalsContact O-N 3.13Å; V255-I257 VanDerWaalsContact C-N 3.31Å; V255-I257 PolarHBondContact O-N 3.42Å; I257-P259 VanDerWaalsContact C-CD 3.47Å; I257-Y260 PolarHBondContact O-N 2.94Å; I257-F261 HydrophobicContact CB-CD2 4.39Å; I257-F261 HydrophobicContact CB-CE2 4.17Å; I257-F261 HydrophobicContact CD1-CE2 4.14Å; I257-F261 HydrophobicContact CG1-CE2 4.47Å; I257-F261 WeakPolarHBondContact O-CD2 3.38Å
258	I	93.3	Very high	89.5	Confident	71 Å²	71	45.1 Å²	45.1	36%	0.364	24%	0.242	S	C	.	.	H	α-helix	trans	-50.8	-46.8	-177.1	-79	170.3	0	0	0	112.9	I254 Y260 F261 I262	I254-I258 HydrophobicContact CG2-CD1 3.61Å; I254-I258 HydrophobicContact CG2-CG1 4.16Å; I254-I258 WeakPolarHBondContact O-CG1 3.34Å; I254-I258 PolarHBondContact O-N 2.78Å; I258-Y260 VanDerWaalsContact C-N 3.28Å; I258-Y260 PolarHBondContact O-N 3.47Å; I258-F261 PolarHBondContact O-N 3.36Å; I258-I262 HydrophobicContact CG2-CD1 3.37Å; I258-I262 HydrophobicContact CG2-CG1 4Å; I258-I262 WeakPolarHBondContact O-CG1 3.41Å; I258-I262 PolarHBondContact O-N 2.65Å
259	P	91.6	Very high	88.8	Confident	2 Å²	2	41.2 Å²	41.2	1%	0.013	23%	0.232	C	C	.	.	H	α-helix	trans	-56.6	-40.2	-176.4	-30.5	38	0	0	0	114	V255 I257 I262 T263 I291 V294 R295	V255-P259 WeakPolarHBondContact O-CD 3.21Å; I257-P259 VanDerWaalsContact C-CD 3.47Å; P259-I262 PolarHBondContact O-N 3.16Å; P259-T263 WeakPolarHBondContact O-CB 3.37Å; P259-T263 PolarHBondContact O-N 3.3Å; P259-T263 PolarHBondContact O-OG1 3.26Å; P259-I291 HydrophobicContact CB-CG2 3.72Å; P259-V294 HydrophobicContact CG-CB 3.8Å; P259-V294 HydrophobicContact CG-CG1 3.59Å; P259-R295 HydrophobicContact CB-CG 3.57Å; P259-R295 HydrophobicContact CG-CG 4.1Å
260	Y	91.5	Very high	87.7	Confident	25 Å²	25	44 Å²	44	10%	0.098	24%	0.244	C	C	.	.	H	α-helix	trans	-64	-48.3	-179.9	175.2	-91.8	0	0	0	111.5	F217 E220 T221 I224 I257 I258 I262 T263 L264	F217-Y260 HydrophobicContact CE2-CE2 4.07Å; F217-Y260 HydrophobicContact CZ-CE2 4.39Å; E220-Y260 HydrophobicContact CG-CD2 4.12Å; T221-Y260 WeakPolarHBondContact CG2-OH 3.46Å; T221-Y260 PolarHBondContact OG1-OH 3.37Å; I224-Y260 HydrophobicContact CB-CD1 4.3Å; I224-Y260 HydrophobicContact CB-CD2 4.49Å; I224-Y260 HydrophobicContact CB-CG 4.16Å; I224-Y260 HydrophobicContact CG1-CD1 4.47Å; I224-Y260 HydrophobicContact CG1-CD2 4.01Å; I224-Y260 HydrophobicContact CG1-CG 3.84Å; I224-Y260 HydrophobicContact CG2-CD1 3.66Å; I224-Y260 HydrophobicContact CG2-CE1 4.29Å; I224-Y260 HydrophobicContact CG2-CG 3.87Å; I257-Y260 PolarHBondContact O-N 2.94Å; I258-Y260 VanDerWaalsContact C-N 3.28Å; I258-Y260 PolarHBondContact O-N 3.47Å; Y260-I262 VanDerWaalsContact C-N 3.35Å; Y260-I262 PolarHBondContact O-N 3.09Å; Y260-T263 PolarHBondContact O-N 3.4Å; Y260-L264 HydrophobicContact CE1-CD2 4.02Å; Y260-L264 WeakPolarHBondContact O-CB 3.18Å; Y260-L264 PolarHBondContact O-N 3.3Å
261	F	91.8	Very high	86.3	Confident	104 Å²	104	49.4 Å²	49.4	46%	0.456	27%	0.273	S	S	.	.	H	α-helix	trans	-67.3	-34.5	-179.5	-70.9	-71.8	0	0	0	112.6	I224 I257 I258 G265	I224-F261 HydrophobicContact CG2-CE2 4.12Å; I224-F261 HydrophobicContact CG2-CZ 4.44Å; I257-F261 HydrophobicContact CB-CD2 4.39Å; I257-F261 HydrophobicContact CB-CE2 4.17Å; I257-F261 HydrophobicContact CD1-CE2 4.14Å; I257-F261 HydrophobicContact CG1-CE2 4.47Å; I257-F261 WeakPolarHBondContact O-CD2 3.38Å; I258-F261 PolarHBondContact O-N 3.36Å; F261-G265 PolarHBondContact O-N 2.99Å
262	I	89.3	Confident	84.8	Confident	76 Å²	76	54.9 Å²	54.9	39%	0.39	30%	0.295	S	S	.	.	H	α-helix	trans	-67.3	-45.2	173.9	-61.3	174.6	0	0	0	110.5	I258 P259 Y260 G265 T266 I291	I258-I262 HydrophobicContact CG2-CD1 3.37Å; I258-I262 HydrophobicContact CG2-CG1 4Å; I258-I262 WeakPolarHBondContact O-CG1 3.41Å; I258-I262 PolarHBondContact O-N 2.65Å; P259-I262 PolarHBondContact O-N 3.16Å; Y260-I262 VanDerWaalsContact C-N 3.35Å; Y260-I262 PolarHBondContact O-N 3.09Å; I262-G265 PolarHBondContact O-N 2.84Å; I262-T266 WeakPolarHBondContact O-CB 3.24Å; I262-T266 PolarHBondContact O-N 3.39Å; I262-T266 PolarHBondContact O-OG1 3.27Å; I262-I291 HydrophobicContact CB-CD1 4.29Å; I262-I291 HydrophobicContact CG2-CD1 3.43Å; I262-I291 VanDerWaalsContact CG2-CD1 3.43Å; I262-I291 HydrophobicContact CG2-CG1 4.42Å
263	T	84.4	Confident	83	Confident	12 Å²	12	60.5 Å²	60.5	7%	0.074	32%	0.32	C	S	.	.	H	α-helix	trans	-59.1	-51.8	177	-59.4	0	0	0	0	110.8	P259 Y260 G265 T266 E267 R295	P259-T263 WeakPolarHBondContact O-CB 3.37Å; P259-T263 PolarHBondContact O-N 3.3Å; P259-T263 PolarHBondContact O-OG1 3.26Å; Y260-T263 PolarHBondContact O-N 3.4Å; T263-G265 PolarHBondContact O-N 3Å; T263-T266 PolarHBondContact O-N 3.02Å; T263-E267 WeakPolarHBondContact CG2-OE1 3.26Å; T263-E267 WeakPolarHBondContact O-CG 3.36Å; T263-E267 PolarHBondContact O-N 3.08Å; T263-R295 PolarHBondContact OG1-NH2 3.26Å
264	L	84.5	Confident	81	Confident	52 Å²	52	63.6 Å²	63.6	27%	0.272	35%	0.353	S	S	.	.	H	α-helix	trans	-60.6	-42.6	179.6	-176.6	63.9	0	0	0	112.2	Y260 E267 L268	Y260-L264 HydrophobicContact CE1-CD2 4.02Å; Y260-L264 WeakPolarHBondContact O-CB 3.18Å; Y260-L264 PolarHBondContact O-N 3.3Å; L264-E267 PolarHBondContact O-N 2.67Å; L264-L268 HydrophobicContact CD1-CD1 4.2Å; L264-L268 HydrophobicContact CD1-CG 4.34Å; L264-L268 HydrophobicContact CG-CD1 3.99Å; L264-L268 WeakPolarHBondContact O-CB 3.48Å; L264-L268 VanDerWaalsContact O-CG 3.24Å; L264-L268 WeakPolarHBondContact O-CG 3.33Å; L264-L268 PolarHBondContact O-N 3.12Å
265	G	84.2	Confident	79	Confident	41 Å²	41	71.3 Å²	71.3	42%	0.423	39%	0.385	S	S	.	.	H	α-helix	trans	-65.3	-36.9	178	0	0	0	0	0	113.3	F261 I262 T263 A269	F261-G265 PolarHBondContact O-N 2.99Å; I262-G265 PolarHBondContact O-N 2.84Å; T263-G265 PolarHBondContact O-N 3Å; G265-A269 WeakPolarHBondContact O-CB 3.43Å; G265-A269 PolarHBondContact O-N 3.17Å; G265-A269 VanDerWaalsContact O-N 3.11Å
266	T	79.7	Confident	76.8	Confident	40 Å²	40	77.4 Å²	77.4	25%	0.245	41%	0.41	C	S	.	.	H	α-helix	trans	-68.8	-44.9	177.1	-50.6	0	0	0	0	110.7	I262 T263 A269 E270 L288	I262-T266 WeakPolarHBondContact O-CB 3.24Å; I262-T266 PolarHBondContact O-N 3.39Å; I262-T266 PolarHBondContact O-OG1 3.27Å; T263-T266 PolarHBondContact O-N 3.02Å; T266-A269 PolarHBondContact O-N 3.42Å; T266-E270 WeakPolarHBondContact O-CG 3.35Å; T266-E270 PolarHBondContact O-N 3.45Å; T266-L288 HydrophobicContact CG2-CD1 4.35Å; T266-L288 HydrophobicContact CG2-CD2 4.29Å
267	E	74.4	Confident	74.8	Confident	53 Å²	53	83.4 Å²	83.4	25%	0.248	44%	0.436	C	S	.	.	H	α-helix	trans	-65	-40.3	178.7	-70.6	177.4	-176.2	0	0	112.4	T263 L264 A269 E270 D271	T263-E267 WeakPolarHBondContact CG2-OE1 3.26Å; T263-E267 WeakPolarHBondContact O-CG 3.36Å; T263-E267 PolarHBondContact O-N 3.08Å; L264-E267 PolarHBondContact O-N 2.67Å; E267-A269 VanDerWaalsContact C-N 3.35Å; E267-E270 PolarHBondContact O-N 3.5Å; E267-D271 PolarHBondContact O-N 3.48Å
268	L	76.1	Confident	72.8	Confident	97 Å²	97	87.8 Å²	87.8	51%	0.508	47%	0.465	S	S	.	.	H	α-helix	trans	-67.9	-33.4	176.1	-71.7	172.2	0	0	0	113	L264	L264-L268 HydrophobicContact CD1-CD1 4.2Å; L264-L268 HydrophobicContact CD1-CG 4.34Å; L264-L268 HydrophobicContact CG-CD1 3.99Å; L264-L268 WeakPolarHBondContact O-CB 3.48Å; L264-L268 VanDerWaalsContact O-CG 3.24Å; L264-L268 WeakPolarHBondContact O-CG 3.33Å; L264-L268 PolarHBondContact O-N 3.12Å
269	A	76.2	Confident	70.8	Confident	53 Å²	53	89.6 Å²	89.6	44%	0.438	48%	0.484	S	S	.	.	H	α-helix	trans	-69.3	-38.8	175.4	0	0	0	0	0	111.4	G265 T266 E267 D271 Q272 E273	G265-A269 WeakPolarHBondContact O-CB 3.43Å; G265-A269 PolarHBondContact O-N 3.17Å; G265-A269 VanDerWaalsContact O-N 3.11Å; T266-A269 PolarHBondContact O-N 3.42Å; E267-A269 VanDerWaalsContact C-N 3.35Å; A269-D271 VanDerWaalsContact C-N 3.31Å; A269-D271 PolarHBondContact O-N 3.46Å; A269-Q272 PolarHBondContact O-N 3.08Å; A269-E273 PolarHBondContact O-N 3.35Å
270	E	68.1	Low	69.1	Low	96 Å²	96	95.1 Å²	95.1	45%	0.449	51%	0.51	S	S	.	.	H	α-helix	trans	-63.9	-32.2	175.9	-74	-178.1	178.6	0	0	113	T266 E267	T266-E270 WeakPolarHBondContact O-CG 3.35Å; T266-E270 PolarHBondContact O-N 3.45Å; E267-E270 PolarHBondContact O-N 3.5Å
271	D	64.4	Low	67.5	Low	116 Å²	116	99.1 Å²	99.1	62%	0.62	53%	0.529	S	S	*	.	H	α-helix	trans	-76.1	-19.2	177.1	-81.2	-16.6	0	0	0	113.3	E267 A269	E267-D271 PolarHBondContact O-N 3.48Å; A269-D271 VanDerWaalsContact C-N 3.31Å; A269-D271 PolarHBondContact O-N 3.46Å
272	Q	62.7	Low	65.8	Low	170 Å²	170	97.5 Å²	97.5	79%	0.794	54%	0.536	S	S	*	.	H	α-helix	trans	-92.7	-31.9	179.4	-70.3	-171.2	1.7	0	0	113.8	A269 G274	A269-Q272 PolarHBondContact O-N 3.08Å; Q272-G274 PolarHBondContact O-N 3.05Å
273	E	56.9	Low	64.4	Low	152 Å²	152	96.5 Å²	96.5	71%	0.71	54%	0.539	S	S	*	.	S	Bend	trans	-91.4	99.1	176.3	-70.3	-166.7	164.3	0	0	110.6	A269 K275	A269-E273 PolarHBondContact O-N 3.35Å; E273-K275 PolarHBondContact O-N 3.22Å
274	G	52.9	Low	63.5	Low	68 Å²	68	97.2 Å²	97.2	70%	0.701	54%	0.544	S	S	*	.			trans	-51.4	110.8	178.1	0	0	0	0	0	113.5	Q272 E276	Q272-G274 PolarHBondContact O-N 3.05Å; G274-E276 PolarHBondContact O-N 3.24Å
275	K	52.9	Low	62.8	Low	201 Å²	201	99.4 Å²	99.4	87%	0.874	56%	0.556	S	S	*	*	S	Bend	trans	22	53.2	149.9	-70.6	-175.1	172.8	177.1	0	119	E273	E273-K275 PolarHBondContact O-N 3.22Å
276	E	48.8	Very low	62.2	Low	176 Å²	176	100 Å²	100	82%	0.822	56%	0.557	S	S	*	*			trans	-139.2	15.9	172.9	-76.7	-160.7	170.9	0	0	117.9	G274	G274-E276 PolarHBondContact O-N 3.24Å
277	K	52.6	Low	62	Low	128 Å²	128	103 Å²	103	56%	0.557	57%	0.57	S	S	*	*			trans	-128.6	89.7	171.5	-71.1	-173.6	-177.4	173.7	0	114.5	S279 E280	K277-S279 VanDerWaalsContact C-N 3.26Å; K277-S279 PolarHBondContact O-N 2.98Å; K277-E280 VanDerWaalsContact CD-OE2 3.23Å; K277-E280 WeakPolarHBondContact CD-OE2 3.23Å; K277-E280 IonicContact NZ-OE2 2.59Å
278	P	53.5	Low	62.1	Low	110 Å²	110	101.5 Å²	101.5	71%	0.714	56%	0.564	S	S	*	*	H	α-helix	trans	-66.8	-21.8	178.4	-16.5	29	0	0	0	114.3
279	S	50.3	Low	62.2	Low	109 Å²	109	105.9 Å²	105.9	76%	0.762	57%	0.573	S	S	*	*	H	α-helix	trans	-83.2	-24.6	-173.3	-171.9	0	0	0	0	114.4	K277	K277-S279 VanDerWaalsContact C-N 3.26Å; K277-S279 PolarHBondContact O-N 2.98Å
280	E	57.1	Low	62.5	Low	119 Å²	119	107.7 Å²	107.7	56%	0.556	58%	0.579	S	S	*	*	H	α-helix	trans	-87.4	-18.8	179.1	-74.4	173.6	165.5	0	0	112	K277 A282 A283 S284	K277-E280 VanDerWaalsContact CD-OE2 3.23Å; K277-E280 WeakPolarHBondContact CD-OE2 3.23Å; K277-E280 IonicContact NZ-OE2 2.59Å; E280-A282 PolarHBondContact O-N 3.45Å; E280-A283 PolarHBondContact O-N 3.13Å; E280-S284 PolarHBondContact O-N 3.47Å
281	Q	56.9	Low	63.3	Low	108 Å²	108	104 Å²	104	51%	0.505	56%	0.562	S	S	.	*	H	α-helix	trans	-66.2	-35.3	-179.4	-70.5	176.6	-21.9	0	0	113.5	S284 L285	Q281-S284 WeakPolarHBondContact CA-OG 3.26Å; Q281-S284 PolarHBondContact O-OG 3.2Å; Q281-L285 WeakPolarHBondContact O-CB 3.5Å; Q281-L285 WeakPolarHBondContact O-CD1 3.37Å; Q281-L285 WeakPolarHBondContact O-CG 3.4Å; Q281-L285 PolarHBondContact O-N 3.08Å
282	A	56.1	Low	64.1	Low	71 Å²	71	103.8 Å²	103.8	59%	0.587	55%	0.552	S	S	*	*	H	α-helix	trans	-69.7	-35.3	178.3	0	0	0	0	0	112.2	E280 A286	E280-A282 PolarHBondContact O-N 3.45Å; A282-A286 PolarHBondContact O-N 3.44Å
283	A	60.8	Low	65.2	Low	55 Å²	55	101.1 Å²	101.1	46%	0.455	54%	0.543	S	S	.	.	H	α-helix	trans	-72.8	-41.3	176.9	0	0	0	0	0	111.5	E280 L285 A286 I287	E280-A283 PolarHBondContact O-N 3.13Å; A283-L285 PolarHBondContact O-N 3.16Å; A283-A286 PolarHBondContact O-N 3.04Å; A283-I287 WeakPolarHBondContact O-CD1 3.41Å; A283-I287 VanDerWaalsContact O-CG1 3.26Å; A283-I287 WeakPolarHBondContact O-CG1 3.48Å; A283-I287 PolarHBondContact O-N 3.09Å
284	S	65.4	Low	66.7	Low	26 Å²	26	95.8 Å²	95.8	18%	0.182	52%	0.521	C	S	.	.	H	α-helix	trans	-62	-42.2	174.9	67.2	0	0	0	0	111.7	E280 Q281 A286 I287 L288	E280-S284 PolarHBondContact O-N 3.47Å; Q281-S284 WeakPolarHBondContact CA-OG 3.26Å; Q281-S284 PolarHBondContact O-OG 3.2Å; S284-A286 PolarHBondContact O-N 3.34Å; S284-I287 PolarHBondContact O-N 3.3Å; S284-L288 WeakPolarHBondContact O-CB 3.17Å; S284-L288 VanDerWaalsContact O-CG 3.23Å; S284-L288 WeakPolarHBondContact O-CG 3.5Å; S284-L288 PolarHBondContact O-N 3.34Å
285	L	68.8	Low	68.6	Low	99 Å²	99	93.3 Å²	93.3	52%	0.518	49%	0.49	S	S	.	.	H	α-helix	trans	-63.4	-37.6	175.8	-70	172.7	0	0	0	113.3	Q281 A283 R289	Q281-L285 WeakPolarHBondContact O-CB 3.5Å; Q281-L285 WeakPolarHBondContact O-CD1 3.37Å; Q281-L285 WeakPolarHBondContact O-CG 3.4Å; Q281-L285 PolarHBondContact O-N 3.08Å; A283-L285 PolarHBondContact O-N 3.16Å; L285-R289 WeakPolarHBondContact O-CG 3.13Å; L285-R289 PolarHBondContact O-N 3.22Å
286	A	71.1	Confident	70.4	Confident	54 Å²	54	87 Å²	87	45%	0.446	47%	0.469	S	S	.	.	H	α-helix	trans	-67.3	-42.7	175.8	0	0	0	0	0	111.7	A282 A283 S284 R289 V290	A282-A286 PolarHBondContact O-N 3.44Å; A283-A286 PolarHBondContact O-N 3.04Å; S284-A286 PolarHBondContact O-N 3.34Å; A286-R289 WeakPolarHBondContact O-CB 3.32Å; A286-R289 PolarHBondContact O-N 3.44Å; A286-V290 PolarHBondContact O-N 3.01Å
287	I	76.8	Confident	72.4	Confident	103 Å²	103	83.3 Å²	83.3	53%	0.528	45%	0.45	S	S	.	.	H	α-helix	trans	-64.4	-42.3	177.4	-67.9	164.2	0	0	0	110.6	A283 S284 R289 V290 I291	A283-I287 WeakPolarHBondContact O-CD1 3.41Å; A283-I287 VanDerWaalsContact O-CG1 3.26Å; A283-I287 WeakPolarHBondContact O-CG1 3.48Å; A283-I287 PolarHBondContact O-N 3.09Å; S284-I287 PolarHBondContact O-N 3.3Å; I287-R289 VanDerWaalsContact C-N 3.29Å; I287-R289 PolarHBondContact O-N 2.97Å; I287-V290 PolarHBondContact O-N 2.88Å; I287-V290 VanDerWaalsContact O-N 3.14Å; I287-I291 HydrophobicContact CG2-CD1 3.65Å; I287-I291 HydrophobicContact CG2-CG1 4.36Å; I287-I291 WeakPolarHBondContact O-CD1 3.26Å; I287-I291 VanDerWaalsContact O-CG1 3.32Å; I287-I291 WeakPolarHBondContact O-CG1 3.49Å; I287-I291 PolarHBondContact O-N 3.49Å
288	L	76	Confident	74.4	Confident	21 Å²	21	77.5 Å²	77.5	11%	0.11	43%	0.425	C	S	.	.	H	α-helix	trans	-61.1	-34.1	176	-71.6	172.7	0	0	0	112.8	T266 S284 I291 R292	T266-L288 HydrophobicContact CG2-CD1 4.35Å; T266-L288 HydrophobicContact CG2-CD2 4.29Å; S284-L288 WeakPolarHBondContact O-CB 3.17Å; S284-L288 VanDerWaalsContact O-CG 3.23Å; S284-L288 WeakPolarHBondContact O-CG 3.5Å; S284-L288 PolarHBondContact O-N 3.34Å; L288-I291 HydrophobicContact CD2-CD1 4.28Å; L288-I291 PolarHBondContact O-N 3.42Å; L288-R292 WeakPolarHBondContact O-CG 3.3Å; L288-R292 PolarHBondContact O-N 3.49Å; L288-R292 VanDerWaalsContact O-N 3.08Å
289	R	78.3	Confident	76.3	Confident	189 Å²	189	75.9 Å²	75.9	71%	0.713	41%	0.409	S	S	*	.	H	α-helix	trans	-64.9	-42.3	173.9	-71.2	172.9	-174.4	-170	1.9	112.1	L285 A286 I287 R292 L293	L285-R289 WeakPolarHBondContact O-CG 3.13Å; L285-R289 PolarHBondContact O-N 3.22Å; A286-R289 WeakPolarHBondContact O-CB 3.32Å; A286-R289 PolarHBondContact O-N 3.44Å; I287-R289 VanDerWaalsContact C-N 3.29Å; I287-R289 PolarHBondContact O-N 2.97Å; R289-R292 PolarHBondContact O-N 3.16Å; R289-L293 PolarHBondContact O-N 3.3Å
290	V	81.8	Confident	78.5	Confident	90 Å²	90	75.2 Å²	75.2	55%	0.545	39%	0.393	S	S	.	.	H	α-helix	trans	-66.8	-41.3	177.1	178.8	0	0	0	0	110.6	A286 I287 R292 L293 V294	A286-V290 PolarHBondContact O-N 3.01Å; I287-V290 PolarHBondContact O-N 2.88Å; I287-V290 VanDerWaalsContact O-N 3.14Å; V290-R292 VanDerWaalsContact C-N 3.28Å; V290-R292 PolarHBondContact O-N 3.49Å; V290-L293 WeakPolarHBondContact O-CB 3.45Å; V290-L293 PolarHBondContact O-N 3.14Å; V290-V294 PolarHBondContact O-N 3.07Å
291	I	84.6	Confident	80.2	Confident	18 Å²	18	69.7 Å²	69.7	9%	0.092	37%	0.367	C	S	.	.	H	α-helix	trans	-60.4	-37.4	177	-68.4	159.6	0	0	0	111.6	P259 I262 I287 L288 L293 V294	P259-I291 HydrophobicContact CB-CG2 3.72Å; I262-I291 HydrophobicContact CB-CD1 4.29Å; I262-I291 HydrophobicContact CG2-CD1 3.43Å; I262-I291 VanDerWaalsContact CG2-CD1 3.43Å; I262-I291 HydrophobicContact CG2-CG1 4.42Å; I287-I291 HydrophobicContact CG2-CD1 3.65Å; I287-I291 HydrophobicContact CG2-CG1 4.36Å; I287-I291 WeakPolarHBondContact O-CD1 3.26Å; I287-I291 VanDerWaalsContact O-CG1 3.32Å; I287-I291 WeakPolarHBondContact O-CG1 3.49Å; I287-I291 PolarHBondContact O-N 3.49Å; L288-I291 HydrophobicContact CD2-CD1 4.28Å; L288-I291 PolarHBondContact O-N 3.42Å; I291-L293 VanDerWaalsContact C-N 3.28Å; I291-L293 PolarHBondContact O-N 3.25Å; I291-V294 WeakPolarHBondContact O-CB 3.47Å; I291-V294 PolarHBondContact O-N 3.06Å; I291-V294 VanDerWaalsContact O-N 3.13Å
292	R	82.8	Confident	82	Confident	112 Å²	112	66.5 Å²	66.5	42%	0.423	35%	0.353	S	S	.	.	H	α-helix	trans	-61	-36.2	173.9	-71.8	178.4	-169.8	-155.6	3.8	112.3	F181 E184 L288 R289 V290 V294 R295	F181-R292 WeakPolarHBondContact CE2-O 3.48Å; E184-R292 IonicContact OE1-NH1 3.76Å; L288-R292 WeakPolarHBondContact O-CG 3.3Å; L288-R292 PolarHBondContact O-N 3.49Å; L288-R292 VanDerWaalsContact O-N 3.08Å; R289-R292 PolarHBondContact O-N 3.16Å; V290-R292 VanDerWaalsContact C-N 3.28Å; V290-R292 PolarHBondContact O-N 3.49Å; R292-V294 VanDerWaalsContact C-N 3.3Å; R292-V294 PolarHBondContact O-N 3.26Å; R292-R295 VanDerWaalsContact O-CB 3.23Å; R292-R295 WeakPolarHBondContact O-CB 3.39Å; R292-R295 WeakPolarHBondContact O-CG 3.26Å; R292-R295 PolarHBondContact O-N 2.91Å
293	L	84.9	Confident	83.7	Confident	114 Å²	114	63.6 Å²	63.6	60%	0.597	33%	0.328	S	S	*	.	H	α-helix	trans	-65.2	-35.3	175.3	-62	177	0	0	0	111.9	R289 V290 I291 R295 V296	R289-L293 PolarHBondContact O-N 3.3Å; V290-L293 WeakPolarHBondContact O-CB 3.45Å; V290-L293 PolarHBondContact O-N 3.14Å; I291-L293 VanDerWaalsContact C-N 3.28Å; I291-L293 PolarHBondContact O-N 3.25Å; L293-R295 PolarHBondContact O-N 2.82Å; L293-R295 VanDerWaalsContact O-N 3.16Å; L293-V296 WeakPolarHBondContact O-CB 3.01Å; L293-V296 WeakPolarHBondContact O-CG1 3.13Å; L293-V296 PolarHBondContact O-N 3.27Å
294	V	89.4	Confident	85.2	Confident	41 Å²	41	62 Å²	62	25%	0.248	31%	0.31	C	S	.	.	H	α-helix	trans	-59.9	-27.4	177	-179.2	0	0	0	0	111.5	V255 P259 V290 I291 R292 V296 F297	V255-V294 HydrophobicContact CG1-CG1 4.06Å; P259-V294 HydrophobicContact CG-CB 3.8Å; P259-V294 HydrophobicContact CG-CG1 3.59Å; V290-V294 PolarHBondContact O-N 3.07Å; I291-V294 WeakPolarHBondContact O-CB 3.47Å; I291-V294 PolarHBondContact O-N 3.06Å; I291-V294 VanDerWaalsContact O-N 3.13Å; R292-V294 VanDerWaalsContact C-N 3.3Å; R292-V294 PolarHBondContact O-N 3.26Å; V294-V296 PolarHBondContact O-N 3.04Å; V294-V296 VanDerWaalsContact O-N 3.14Å; V294-F297 HydrophobicContact CB-CD2 4.24Å; V294-F297 HydrophobicContact CG1-CD2 3.89Å; V294-F297 HydrophobicContact CG1-CE2 4.46Å; V294-F297 WeakPolarHBondContact O-CB 3.4Å; V294-F297 VanDerWaalsContact O-CD2 3.3Å; V294-F297 WeakPolarHBondContact O-CD2 3.4Å; V294-F297 PolarHBondContact O-N 3.47Å
295	R	90.9	Very high	86.3	Confident	15 Å²	15	63.1 Å²	63.1	6%	0.057	31%	0.313	C	S	.	.	G	3₁₀ helix	trans	-57.8	-27.4	174.8	-59.5	177.2	-178.2	-162.3	-11.9	112.6	F181 E184 E220 P259 T263 R292 L293 F297 R298	F181-R295 HydrophobicContact CD2-CB 4.19Å; F181-R295 HydrophobicContact CE2-CB 4.17Å; E184-R295 IonicContact OE2-NH1 3.97Å; E220-R295 IonicContact OE1-CZ 3.68Å; E220-R295 IonicContact OE1-NE 3.88Å; E220-R295 PolarHBondContact OE1-NE 2.81Å; E220-R295 IonicContact OE1-NH1 3.57Å; E220-R295 PolarHBondContact OE1-NH1 3.32Å; E220-R295 IonicContact OE1-NH2 2.85Å; E220-R295 IonicContact OE2-CZ 2.76Å; E220-R295 IonicContact OE2-NH1 3.73Å; E220-R295 PolarHBondContact OE2-NH1 3.45Å; E220-R295 IonicContact OE2-NH2 3.83Å; P259-R295 HydrophobicContact CB-CG 3.57Å; P259-R295 HydrophobicContact CG-CG 4.1Å; T263-R295 PolarHBondContact OG1-NH2 3.26Å; R292-R295 VanDerWaalsContact O-CB 3.23Å; R292-R295 WeakPolarHBondContact O-CB 3.39Å; R292-R295 WeakPolarHBondContact O-CG 3.26Å; R292-R295 PolarHBondContact O-N 2.91Å; L293-R295 PolarHBondContact O-N 2.82Å; L293-R295 VanDerWaalsContact O-N 3.16Å; R295-F297 PolarHBondContact O-N 2.8Å; R295-R298 WeakPolarHBondContact O-CD 3.21Å; R295-R298 WeakPolarHBondContact O-CG 3.46Å; R295-R298 PolarHBondContact O-N 3.29Å; R295-R298 PolarHBondContact O-NE 2.94Å
296	V	90.8	Very high	87.3	Confident	70 Å²	70	60.8 Å²	60.8	42%	0.424	30%	0.304	S	S	.	.	G	3₁₀ helix	trans	-62.4	-30	177.9	88.7	0	0	0	0	111.7	F181 L293 V294 R298 I299	F181-V296 HydrophobicContact CE1-CB 4.32Å; F181-V296 HydrophobicContact CE1-CG2 4.09Å; F181-V296 HydrophobicContact CZ-CB 4.38Å; L293-V296 WeakPolarHBondContact O-CB 3.01Å; L293-V296 WeakPolarHBondContact O-CG1 3.13Å; L293-V296 PolarHBondContact O-N 3.27Å; V294-V296 PolarHBondContact O-N 3.04Å; V294-V296 VanDerWaalsContact O-N 3.14Å; V296-R298 PolarHBondContact O-N 2.86Å; V296-R298 VanDerWaalsContact O-N 3.1Å; V296-I299 WeakPolarHBondContact O-CB 3.47Å; V296-I299 WeakPolarHBondContact O-CG2 3.12Å; V296-I299 PolarHBondContact O-N 3.43Å
297	F	91.2	Very high	88.1	Confident	97 Å²	97	62.9 Å²	62.9	43%	0.425	30%	0.304	S	S	.	.	G	3₁₀ helix	trans	-63.8	-18.2	-178.2	-68.4	-61.7	0	0	0	113.4	V255 V294 R295 I299 F300	V255-F297 HydrophobicContact CG1-CB 4.05Å; V255-F297 HydrophobicContact CG1-CD2 4.36Å; V255-F297 HydrophobicContact CG1-CG 4.49Å; V294-F297 HydrophobicContact CB-CD2 4.24Å; V294-F297 HydrophobicContact CG1-CD2 3.89Å; V294-F297 HydrophobicContact CG1-CE2 4.46Å; V294-F297 WeakPolarHBondContact O-CB 3.4Å; V294-F297 VanDerWaalsContact O-CD2 3.3Å; V294-F297 WeakPolarHBondContact O-CD2 3.4Å; V294-F297 PolarHBondContact O-N 3.47Å; R295-F297 PolarHBondContact O-N 2.8Å; F297-I299 PolarHBondContact O-N 2.61Å; F297-I299 VanDerWaalsContact O-N 3.08Å; F297-F300 HydrophobicContact CB-CD2 4.34Å; F297-F300 AromaticContact CD1-CD2 3.89Å; F297-F300 HydrophobicContact CD1-CD2 3.89Å; F297-F300 AromaticContact CD1-CE2 3.7Å; F297-F300 HydrophobicContact CD1-CE2 3.7Å; F297-F300 HydrophobicContact CE1-CE2 4.31Å; F297-F300 WeakPolarHBondContact O-CB 3.41Å; F297-F300 WeakPolarHBondContact O-CD2 3.38Å; F297-F300 PolarHBondContact O-N 2.93Å
298	R	94.3	Very high	88.7	Confident	7 Å²	7	59.8 Å²	59.8	3%	0.026	30%	0.297	C	S	.	.	G	3₁₀ helix	trans	-61.5	-17.2	173.3	78.4	-165.5	165.6	178.5	-3.9	113.1	S177 A256 R295 V296 F300 K301	S177-R298 VanDerWaalsContact C-CZ 3.4Å; S177-R298 VanDerWaalsContact O-CZ 3.29Å; S177-R298 PolarHBondContact O-NH2 3.23Å; S177-R298 WeakPolarHBondContact OG-CD 3.34Å; S177-R298 PolarHBondContact OG-NE 3.11Å; A256-R298 HydrophobicContact CB-CB 3.72Å; R295-R298 WeakPolarHBondContact O-CD 3.21Å; R295-R298 WeakPolarHBondContact O-CG 3.46Å; R295-R298 PolarHBondContact O-N 3.29Å; R295-R298 PolarHBondContact O-NE 2.94Å; V296-R298 PolarHBondContact O-N 2.86Å; V296-R298 VanDerWaalsContact O-N 3.1Å; R298-F300 PolarHBondContact O-N 3.22Å; R298-K301 WeakPolarHBondContact O-CB 3.15Å; R298-K301 PolarHBondContact O-N 2.84Å
299	I	94.7	Very high	89.4	Confident	76 Å²	76	61.2 Å²	61.2	39%	0.39	30%	0.304	S	S	.	.	G	3₁₀ helix	trans	-56.5	-34.5	169.7	-164.7	168.8	0	0	0	111.7	I178 V296 F297 K301 L302	I178-I299 HydrophobicContact CD1-CB 4.13Å; I178-I299 HydrophobicContact CD1-CD1 4.49Å; I178-I299 HydrophobicContact CD1-CG1 3.9Å; V296-I299 WeakPolarHBondContact O-CB 3.47Å; V296-I299 WeakPolarHBondContact O-CG2 3.12Å; V296-I299 PolarHBondContact O-N 3.43Å; F297-I299 PolarHBondContact O-N 2.61Å; F297-I299 VanDerWaalsContact O-N 3.08Å; I299-K301 PolarHBondContact O-N 2.79Å; I299-L302 HydrophobicContact CG1-CD1 4.21Å; I299-L302 VanDerWaalsContact O-CB 3.31Å; I299-L302 WeakPolarHBondContact O-CB 3.36Å; I299-L302 WeakPolarHBondContact O-CG 3.38Å; I299-L302 PolarHBondContact O-N 3.12Å; I299-L302 VanDerWaalsContact O-N 3.12Å
300	F	94.9	Very high	90	Very high	95 Å²	95	55.2 Å²	55.2	42%	0.417	29%	0.285	S	S	.	.	G	3₁₀ helix	trans	-67.7	-14.7	177.7	-68.3	-71.5	0	0	0	112.7	I252 F297 R298 L302 S303	I252-F300 HydrophobicContact CD1-CB 4.2Å; I252-F300 HydrophobicContact CG1-CB 4.47Å; I252-F300 HydrophobicContact CG2-CB 3.84Å; F297-F300 HydrophobicContact CB-CD2 4.34Å; F297-F300 AromaticContact CD1-CD2 3.89Å; F297-F300 HydrophobicContact CD1-CD2 3.89Å; F297-F300 AromaticContact CD1-CE2 3.7Å; F297-F300 HydrophobicContact CD1-CE2 3.7Å; F297-F300 HydrophobicContact CE1-CE2 4.31Å; F297-F300 WeakPolarHBondContact O-CB 3.41Å; F297-F300 WeakPolarHBondContact O-CD2 3.38Å; F297-F300 PolarHBondContact O-N 2.93Å; R298-F300 PolarHBondContact O-N 3.22Å; F300-L302 PolarHBondContact O-N 3.25Å; F300-S303 WeakPolarHBondContact O-CB 3.37Å; F300-S303 PolarHBondContact O-N 3.13Å; F300-S303 PolarHBondContact O-OG 3.18Å
301	K	94.7	Very high	90.5	Very high	2 Å²	2	51.2 Å²	51.2	1%	0.009	26%	0.26	C	S	.	.	G	3₁₀ helix	trans	-62	-25.1	172.4	-167.8	172.7	166.2	133.5	0	112.1	I174 F227 E230 I252 D253 R298 I299 S303 R304	I174-K301 HydrophobicContact CD1-CB 3.92Å; I174-K301 HydrophobicContact CD1-CD 3.91Å; I174-K301 HydrophobicContact CD1-CG 3.67Å; I174-K301 HydrophobicContact CG1-CB 4.35Å; I174-K301 HydrophobicContact CG1-CD 4.05Å; I174-K301 HydrophobicContact CG1-CG 4.28Å; F227-K301 HydrophobicContact CD1-CD 4.04Å; F227-K301 HydrophobicContact CE1-CD 4.02Å; F227-K301 HydrophobicContact CG-CD 4.47Å; F227-K301 HydrophobicContact CZ-CD 4.41Å; E230-K301 WeakPolarHBondContact OE2-CE 3.29Å; E230-K301 IonicContact OE2-NZ 3.62Å; E230-K301 PolarHBondContact OE2-NZ 3.12Å; I252-K301 HydrophobicContact CG2-CB 4.39Å; D253-K301 VanDerWaalsContact OD1-CD 3.31Å; D253-K301 WeakPolarHBondContact OD1-CD 3.31Å; D253-K301 WeakPolarHBondContact OD1-CE 3.44Å; D253-K301 WeakPolarHBondContact OD1-CG 3.41Å; D253-K301 IonicContact OD1-NZ 2.8Å; D253-K301 PolarHBondContact OD1-NZ 3.37Å; R298-K301 WeakPolarHBondContact O-CB 3.15Å; R298-K301 PolarHBondContact O-N 2.84Å; I299-K301 PolarHBondContact O-N 2.79Å; K301-S303 PolarHBondContact O-N 3.46Å; K301-S303 VanDerWaalsContact O-N 3.13Å; K301-R304 PolarHBondContact O-N 3.01Å
302	L	93.6	Very high	90.9	Very high	41 Å²	41	54 Å²	54	22%	0.215	28%	0.275	C	S	.	.	G	3₁₀ helix	trans	-58.8	-22.3	170.7	-65.8	174.3	0	0	0	112.8	V171 I174 I299 F300 R304 H305 S306	V171-L302 HydrophobicContact CG1-CD2 4.24Å; I174-L302 HydrophobicContact CB-CD2 4.12Å; I174-L302 HydrophobicContact CD1-CD2 4.13Å; I174-L302 HydrophobicContact CG2-CD1 4.5Å; I174-L302 HydrophobicContact CG2-CD2 3.73Å; I174-L302 HydrophobicContact CG2-CG 3.81Å; I299-L302 HydrophobicContact CG1-CD1 4.21Å; I299-L302 VanDerWaalsContact O-CB 3.31Å; I299-L302 WeakPolarHBondContact O-CB 3.36Å; I299-L302 WeakPolarHBondContact O-CG 3.38Å; I299-L302 PolarHBondContact O-N 3.12Å; I299-L302 VanDerWaalsContact O-N 3.12Å; F300-L302 PolarHBondContact O-N 3.25Å; L302-R304 PolarHBondContact O-N 3.4Å; L302-H305 CarbonylContact O-C 3.5Å; L302-H305 PolarHBondContact O-N 3.33Å; L302-S306 WeakPolarHBondContact O-CB 3.45Å; L302-S306 PolarHBondContact O-N 2.87Å
303	S	92.6	Very high	91.4	Very high	10 Å²	10	50.4 Å²	50.4	7%	0.07	27%	0.273	C	S	.	.	G	3₁₀ helix	trans	-60.9	-29.7	178.4	66.2	0	0	0	0	112.9	M249 F300 K301 H305 S306 Q310	M249-S303 PolarHBondContact SD-OG 2.96Å; F300-S303 WeakPolarHBondContact O-CB 3.37Å; F300-S303 PolarHBondContact O-N 3.13Å; F300-S303 PolarHBondContact O-OG 3.18Å; K301-S303 PolarHBondContact O-N 3.46Å; K301-S303 VanDerWaalsContact O-N 3.13Å; S303-H305 PolarHBondContact O-N 3.4Å; S303-S306 PolarHBondContact O-N 3.29Å; S303-Q310 WeakPolarHBondContact O-CG 3.3Å; S303-Q310 PolarHBondContact O-NE2 3.32Å
304	R	90.8	Very high	91.7	Very high	21 Å²	21	48.3 Å²	48.3	8%	0.079	26%	0.26	C	S	.	.	G	3₁₀ helix	trans	-62.7	-30.6	173.7	-175.4	176	-68.3	-80.6	9.7	112.4	E155 N250 D253 K301 L302 Q310	E155-R304 IonicContact OE1-CZ 3.69Å; E155-R304 IonicContact OE1-NH1 3.58Å; E155-R304 PolarHBondContact OE1-NH1 3.34Å; E155-R304 IonicContact OE2-CZ 3.03Å; E155-R304 IonicContact OE2-NH1 2.93Å; E155-R304 PolarHBondContact OE2-NH1 3.47Å; N250-R304 PolarHBondContact OD1-NH2 2.88Å; D253-R304 IonicContact OD2-CZ 3.57Å; D253-R304 IonicContact OD2-NE 3.48Å; D253-R304 PolarHBondContact OD2-NE 2.96Å; D253-R304 IonicContact OD2-NH2 3.72Å; D253-R304 PolarHBondContact OD2-NH2 3.39Å; K301-R304 PolarHBondContact O-N 3.01Å; L302-R304 PolarHBondContact O-N 3.4Å; R304-Q310 PolarHBondContact O-NE2 3.28Å
305	H	89.5	Confident	91.9	Very high	51 Å²	51	46.4 Å²	46.4	24%	0.236	25%	0.249	C	C	.	.	G	3₁₀ helix	trans	-105.5	-0.1	-176	-54.9	-63.5	0	0	0	113.2	V171 L302 S303	V171-H305 HydrophobicContact CG2-CB 3.72Å; L302-H305 CarbonylContact O-C 3.5Å; L302-H305 PolarHBondContact O-N 3.33Å; S303-H305 PolarHBondContact O-N 3.4Å
306	S	90.3	Very high	92	Very high	49 Å²	49	49.1 Å²	49.1	34%	0.343	26%	0.264	S	S	.	.			trans	-124.7	104.3	-178.5	176.8	0	0	0	0	110.5	L302 S303 G308 L309 Q310	L302-S306 WeakPolarHBondContact O-CB 3.45Å; L302-S306 PolarHBondContact O-N 2.87Å; S303-S306 PolarHBondContact O-N 3.29Å; S306-G308 PolarHBondContact O-N 3.12Å; S306-L309 PolarHBondContact O-N 2.76Å; S306-L309 VanDerWaalsContact O-N 3.12Å; S306-L309 PolarHBondContact OG-N 2.91Å; S306-Q310 WeakPolarHBondContact O-CG 3.49Å; S306-Q310 PolarHBondContact O-N 3.31Å; S306-Q310 VanDerWaalsContact O-N 3.16Å
307	K	86.9	Confident	92.1	Very high	99 Å²	99	54 Å²	54	43%	0.43	28%	0.28	S	S	.	.	H	α-helix	trans	-53.4	-41.7	172.1	-70.4	-174.7	171.4	-174.8	0	111.3	L309 Q310 I311 E419	K307-L309 VanDerWaalsContact C-N 3.32Å; K307-L309 PolarHBondContact O-N 3.15Å; K307-Q310 WeakPolarHBondContact O-CB 3.05Å; K307-Q310 PolarHBondContact O-N 2.96Å; K307-Q310 VanDerWaalsContact O-N 3.09Å; K307-I311 VanDerWaalsContact O-CG1 3.29Å; K307-I311 WeakPolarHBondContact O-CG1 3.4Å; K307-I311 PolarHBondContact O-N 3.05Å; K307-E419 IonicContact NZ-OE1 4Å; K307-E419 PolarHBondContact NZ-OE1 3.29Å; K307-E419 IonicContact NZ-OE2 3.19Å; K307-E419 PolarHBondContact NZ-OE2 2.96Å
308	G	89.9	Confident	92.1	Very high	38 Å²	38	51.9 Å²	51.9	39%	0.392	28%	0.279	S	S	.	.	H	α-helix	trans	-58.3	-40.5	178	0	0	0	0	0	113.4	S306 I311 L312	S306-G308 PolarHBondContact O-N 3.12Å; G308-I311 PolarHBondContact O-N 2.94Å; G308-L312 WeakPolarHBondContact O-CB 3.48Å; G308-L312 PolarHBondContact O-N 3.32Å
309	L	91.3	Very high	92.2	Very high	50 Å²	50	51.6 Å²	51.6	26%	0.262	28%	0.278	S	S	.	.	H	α-helix	trans	-74	-28.7	178	-169.8	54.6	0	0	0	112.2	S306 K307 L312 G313	S306-L309 PolarHBondContact O-N 2.76Å; S306-L309 VanDerWaalsContact O-N 3.12Å; S306-L309 PolarHBondContact OG-N 2.91Å; K307-L309 VanDerWaalsContact C-N 3.32Å; K307-L309 PolarHBondContact O-N 3.15Å; L309-L312 HydrophobicContact CD1-CD2 3.94Å; L309-G313 PolarHBondContact O-N 3.43Å
310	Q	91	Very high	92.2	Very high	63 Å²	63	53.5 Å²	53.5	29%	0.294	29%	0.287	S	S	.	.	H	α-helix	trans	-67.2	-46.9	170.9	-62.9	178.9	14.4	0	0	111.4	M249 S303 R304 S306 K307 L312 G313 Q314	M249-Q310 HydrophobicContact CE-CG 3.5Å; S303-Q310 WeakPolarHBondContact O-CG 3.3Å; S303-Q310 PolarHBondContact O-NE2 3.32Å; R304-Q310 PolarHBondContact O-NE2 3.28Å; S306-Q310 WeakPolarHBondContact O-CG 3.49Å; S306-Q310 PolarHBondContact O-N 3.31Å; S306-Q310 VanDerWaalsContact O-N 3.16Å; K307-Q310 WeakPolarHBondContact O-CB 3.05Å; K307-Q310 PolarHBondContact O-N 2.96Å; K307-Q310 VanDerWaalsContact O-N 3.09Å; Q310-L312 VanDerWaalsContact C-N 3.31Å; Q310-L312 PolarHBondContact O-N 3.43Å; Q310-G313 PolarHBondContact O-N 3.25Å; Q310-G313 VanDerWaalsContact O-N 3.12Å; Q310-Q314 WeakPolarHBondContact O-CG 3.43Å; Q310-Q314 PolarHBondContact O-N 3.02Å
311	I	91.4	Very high	92.1	Very high	6 Å²	6	58 Å²	58	3%	0.031	30%	0.301	C	S	.	.	H	α-helix	trans	-59.3	-44.1	175.6	-66.6	161	0	0	0	110	K307 G308 G313 Q314 T315 F408 F411 Y412 E415	K307-I311 VanDerWaalsContact O-CG1 3.29Å; K307-I311 WeakPolarHBondContact O-CG1 3.4Å; K307-I311 PolarHBondContact O-N 3.05Å; G308-I311 PolarHBondContact O-N 2.94Å; I311-G313 VanDerWaalsContact C-N 3.34Å; I311-G313 PolarHBondContact O-N 3.13Å; I311-Q314 PolarHBondContact O-N 2.61Å; I311-T315 WeakPolarHBondContact O-CB 3.38Å; I311-T315 PolarHBondContact O-N 3.24Å; I311-T315 PolarHBondContact O-OG1 3.49Å; I311-F408 HydrophobicContact CG2-CD2 3.97Å; I311-F408 HydrophobicContact CG2-CE2 3.77Å; I311-F408 HydrophobicContact CG2-CZ 4.5Å; I311-F411 HydrophobicContact CG2-CB 3.92Å; I311-Y412 HydrophobicContact CD1-CD2 4.09Å; I311-E415 HydrophobicContact CD1-CB 4.08Å; I311-E415 HydrophobicContact CD1-CG 4.25Å; I311-E415 HydrophobicContact CG1-CB 4.34Å; I311-E415 HydrophobicContact CG1-CG 4.49Å
312	L	93.6	Very high	92.2	Very high	76 Å²	76	58.8 Å²	58.8	40%	0.398	31%	0.305	S	S	.	.	H	α-helix	trans	-58.6	-45.8	174.2	-178.9	62.7	0	0	0	111.4	G308 L309 Q310 Q314 T315 L316	G308-L312 WeakPolarHBondContact O-CB 3.48Å; G308-L312 PolarHBondContact O-N 3.32Å; L309-L312 HydrophobicContact CD1-CD2 3.94Å; Q310-L312 VanDerWaalsContact C-N 3.31Å; Q310-L312 PolarHBondContact O-N 3.43Å; L312-Q314 PolarHBondContact O-N 3.44Å; L312-T315 WeakPolarHBondContact O-CB 3.33Å; L312-T315 PolarHBondContact O-N 2.95Å; L312-L316 HydrophobicContact CD1-CD1 4.37Å; L312-L316 HydrophobicContact CD1-CG 4.32Å; L312-L316 HydrophobicContact CG-CD1 4.17Å; L312-L316 WeakPolarHBondContact O-CB 3.28Å; L312-L316 WeakPolarHBondContact O-CG 3.29Å; L312-L316 PolarHBondContact O-N 3.06Å
313	G	92.1	Very high	92.2	Very high	38 Å²	38	59.2 Å²	59.2	39%	0.392	31%	0.307	S	S	.	.	H	α-helix	trans	-61.2	-43.2	177.1	0	0	0	0	0	113.4	L309 Q310 I311 L316 K317	L309-G313 PolarHBondContact O-N 3.43Å; Q310-G313 PolarHBondContact O-N 3.25Å; Q310-G313 VanDerWaalsContact O-N 3.12Å; I311-G313 VanDerWaalsContact C-N 3.34Å; I311-G313 PolarHBondContact O-N 3.13Å; G313-L316 PolarHBondContact O-N 3.34Å; G313-K317 WeakPolarHBondContact O-CB 3.3Å; G313-K317 PolarHBondContact O-N 2.89Å
314	Q	90.9	Very high	92.3	Very high	70 Å²	70	60.5 Å²	60.5	33%	0.327	32%	0.322	S	S	.	.	H	α-helix	trans	-63.5	-43.6	175.1	-69.2	-179.7	10.3	0	0	111.5	Q310 I311 L312 K317 A318 F411	Q310-Q314 WeakPolarHBondContact O-CG 3.43Å; Q310-Q314 PolarHBondContact O-N 3.02Å; I311-Q314 PolarHBondContact O-N 2.61Å; L312-Q314 PolarHBondContact O-N 3.44Å; Q314-K317 PolarHBondContact O-N 2.64Å; Q314-A318 WeakPolarHBondContact O-CB 3.39Å; Q314-A318 PolarHBondContact O-N 2.68Å; Q314-F411 HydrophobicContact CB-CD2 4.48Å; Q314-F411 HydrophobicContact CB-CG 4.42Å
315	T	94	Very high	92.4	Very high	1 Å²	1	63.4 Å²	63.4	1%	0.006	34%	0.339	C	S	.	.	H	α-helix	trans	-59.9	-48.4	177.1	-57.9	0	0	0	0	111.3	I311 L312 K317 A318 S319 I404 N407 F408	I311-T315 WeakPolarHBondContact O-CB 3.38Å; I311-T315 PolarHBondContact O-N 3.24Å; I311-T315 PolarHBondContact O-OG1 3.49Å; L312-T315 WeakPolarHBondContact O-CB 3.33Å; L312-T315 PolarHBondContact O-N 2.95Å; T315-K317 PolarHBondContact O-N 3.24Å; T315-A318 PolarHBondContact O-N 3.34Å; T315-S319 VanDerWaalsContact O-CB 3.23Å; T315-S319 WeakPolarHBondContact O-CB 3.31Å; T315-S319 PolarHBondContact O-N 3.37Å; T315-S319 PolarHBondContact O-OG 3.29Å; T315-I404 HydrophobicContact CG2-CG2 4.16Å; T315-I404 WeakPolarHBondContact CG2-O 3.5Å; T315-N407 HydrophobicContact CG2-CB 4.04Å; T315-F408 HydrophobicContact CG2-CB 3.83Å; T315-F408 WeakPolarHBondContact OG1-CA 3.24Å
316	L	93.9	Very high	92.6	Very high	71 Å²	71	62.3 Å²	62.3	37%	0.372	34%	0.335	S	S	.	.	H	α-helix	trans	-62.5	-43.8	178.4	-72.3	173.8	0	0	0	111.1	L312 G313 A318 S319 M320 L323	L312-L316 HydrophobicContact CD1-CD1 4.37Å; L312-L316 HydrophobicContact CD1-CG 4.32Å; L312-L316 HydrophobicContact CG-CD1 4.17Å; L312-L316 WeakPolarHBondContact O-CB 3.28Å; L312-L316 WeakPolarHBondContact O-CG 3.29Å; L312-L316 PolarHBondContact O-N 3.06Å; G313-L316 PolarHBondContact O-N 3.34Å; L316-A318 VanDerWaalsContact C-N 3.34Å; L316-A318 PolarHBondContact O-N 2.94Å; L316-S319 CarbonylContact O-C 3.36Å; L316-S319 PolarHBondContact O-N 3.14Å; L316-M320 WeakPolarHBondContact O-CG 3.24Å; L316-M320 PolarHBondContact O-N 3.25Å; L316-M320 VanDerWaalsContact O-N 3.08Å; L316-L323 HydrophobicContact CD2-CD2 4.47Å
317	K	92.4	Very high	92.9	Very high	174 Å²	174	65.2 Å²	65.2	76%	0.757	35%	0.345	S	S	*	.	H	α-helix	trans	-60	-44.2	176.7	-175	-177.7	177.1	-172.9	0	111.8	G313 Q314 T315 S319 M320	G313-K317 WeakPolarHBondContact O-CB 3.3Å; G313-K317 PolarHBondContact O-N 2.89Å; Q314-K317 PolarHBondContact O-N 2.64Å; T315-K317 PolarHBondContact O-N 3.24Å; K317-S319 VanDerWaalsContact C-N 3.31Å; K317-M320 WeakPolarHBondContact O-CG 3.37Å
318	A	92.2	Very high	93.3	Very high	51 Å²	51	66 Å²	66	42%	0.421	35%	0.349	S	S	.	.	H	α-helix	trans	-70.1	-28.5	177.8	0	0	0	0	0	112.7	Q314 T315 L316 F411	Q314-A318 WeakPolarHBondContact O-CB 3.39Å; Q314-A318 PolarHBondContact O-N 2.68Å; T315-A318 PolarHBondContact O-N 3.34Å; L316-A318 VanDerWaalsContact C-N 3.34Å; L316-A318 PolarHBondContact O-N 2.94Å; A318-F411 HydrophobicContact CB-CE2 3.64Å; A318-F411 HydrophobicContact CB-CZ 3.96Å
319	S	95.6	Very high	93.6	Very high	1 Å²	1	68.7 Å²	68.7	1%	0.007	35%	0.35	C	S	.	.	T	Hydrogen-bonded Turn	trans	-101.9	17.8	-175.6	-43	0	0	0	0	113.7	T315 L316 K317 R321 E322 L323 N407	T315-S319 VanDerWaalsContact O-CB 3.23Å; T315-S319 WeakPolarHBondContact O-CB 3.31Å; T315-S319 PolarHBondContact O-N 3.37Å; T315-S319 PolarHBondContact O-OG 3.29Å; L316-S319 CarbonylContact O-C 3.36Å; L316-S319 PolarHBondContact O-N 3.14Å; K317-S319 VanDerWaalsContact C-N 3.31Å; S319-R321 PolarHBondContact O-N 3.37Å; S319-E322 VanDerWaalsContact CA-OE2 3.28Å; S319-E322 WeakPolarHBondContact CA-OE2 3.13Å; S319-E322 PolarHBondContact O-N 3.43Å; S319-L323 WeakPolarHBondContact O-CB 3.44Å; S319-L323 PolarHBondContact O-N 2.81Å; S319-N407 PolarHBondContact OG-ND2 3.36Å
320	M	94	Very high	93.8	Very high	117 Å²	117	68.3 Å²	68.3	58%	0.576	35%	0.348	S	S	*	.	H	α-helix	trans	-59.3	-32.4	-177.5	-78.8	-60.6	-61.9	0	0	112.5	L316 K317 L323 G324	L316-M320 WeakPolarHBondContact O-CG 3.24Å; L316-M320 PolarHBondContact O-N 3.25Å; L316-M320 VanDerWaalsContact O-N 3.08Å; K317-M320 WeakPolarHBondContact O-CG 3.37Å; M320-L323 HydrophobicContact SD-CD2 4.47Å; M320-G324 PolarHBondContact O-N 3.25Å
321	R	94.5	Very high	94.1	Very high	189 Å²	189	71.2 Å²	71.2	71%	0.713	36%	0.36	S	S	*	.	H	α-helix	trans	-67.2	-46.9	177.5	-179.2	-177.8	66.3	169.6	0.3	110.8	S319 G324 L325	S319-R321 PolarHBondContact O-N 3.37Å; R321-G324 PolarHBondContact O-N 2.97Å; R321-L325 WeakPolarHBondContact O-CG 3.12Å; R321-L325 PolarHBondContact O-N 3.31Å
322	E	94.9	Very high	94.4	Very high	19 Å²	19	74.7 Å²	74.7	9%	0.089	38%	0.378	C	S	.	.	H	α-helix	trans	-67.4	-41.4	-179.5	-65.8	66.9	-149.3	0	0	110.8	S319 G324 L325 L326 V403 I404	S319-E322 VanDerWaalsContact CA-OE2 3.28Å; S319-E322 WeakPolarHBondContact CA-OE2 3.13Å; S319-E322 PolarHBondContact O-N 3.43Å; E322-G324 VanDerWaalsContact C-N 3.33Å; E322-L325 PolarHBondContact O-N 3.45Å; E322-L326 PolarHBondContact O-N 3.47Å; E322-V403 HydrophobicContact CG-CB 4.11Å; E322-V403 HydrophobicContact CG-CG1 3.73Å; E322-I404 HydrophobicContact CB-CG1 4.29Å
323	L	94	Very high	94.6	Very high	50 Å²	50	71.5 Å²	71.5	26%	0.262	36%	0.363	S	S	.	.	H	α-helix	trans	-62.7	-40.8	172.9	-173.1	64.5	0	0	0	111.5	L316 S319 M320 L326 I327	L316-L323 HydrophobicContact CD2-CD2 4.47Å; S319-L323 WeakPolarHBondContact O-CB 3.44Å; S319-L323 PolarHBondContact O-N 2.81Å; M320-L323 HydrophobicContact SD-CD2 4.47Å; L323-L326 HydrophobicContact CD1-CD2 4.47Å; L323-L326 WeakPolarHBondContact O-CB 3.43Å; L323-L326 PolarHBondContact O-N 3.5Å; L323-I327 HydrophobicContact CG-CD1 4.29Å; L323-I327 WeakPolarHBondContact O-CG1 3.12Å; L323-I327 PolarHBondContact O-N 2.91Å
324	G	94.7	Very high	94.9	Very high	37 Å²	37	70.1 Å²	70.1	38%	0.381	35%	0.347	S	S	.	.	H	α-helix	trans	-61.4	-42.5	173.9	0	0	0	0	0	112.7	M320 R321 E322 I327 F328	M320-G324 PolarHBondContact O-N 3.25Å; R321-G324 PolarHBondContact O-N 2.97Å; E322-G324 VanDerWaalsContact C-N 3.33Å; G324-I327 PolarHBondContact O-N 3.48Å; G324-F328 VanDerWaalsContact O-CB 3.28Å; G324-F328 WeakPolarHBondContact O-CB 3.14Å; G324-F328 PolarHBondContact O-N 2.73Å
325	L	93.3	Very high	95.2	Very high	81 Å²	81	70 Å²	70	42%	0.424	35%	0.348	S	S	.	.	H	α-helix	trans	-64.4	-40.9	175	-71.8	173.8	0	0	0	112.3	R321 E322 F328 F329	R321-L325 WeakPolarHBondContact O-CG 3.12Å; R321-L325 PolarHBondContact O-N 3.31Å; E322-L325 PolarHBondContact O-N 3.45Å; L325-F328 PolarHBondContact O-N 3.08Å; L325-F329 HydrophobicContact CB-CE2 4.44Å; L325-F329 VanDerWaalsContact O-CD2 3.26Å; L325-F329 WeakPolarHBondContact O-CD2 3.31Å; L325-F329 PolarHBondContact O-N 3.06Å
326	L	94.4	Very high	95.5	Very high	29 Å²	29	75 Å²	75	15%	0.152	37%	0.374	C	S	.	.	H	α-helix	trans	-58.2	-51.4	175.2	176.7	61.1	0	0	0	111.2	E322 L323 F328 F329 L330 I397 P400	E322-L326 PolarHBondContact O-N 3.47Å; L323-L326 HydrophobicContact CD1-CD2 4.47Å; L323-L326 WeakPolarHBondContact O-CB 3.43Å; L323-L326 PolarHBondContact O-N 3.5Å; L326-F328 VanDerWaalsContact C-N 3.28Å; L326-F328 PolarHBondContact O-N 3.28Å; L326-F329 PolarHBondContact O-N 3.1Å; L326-L330 VanDerWaalsContact O-CB 3.3Å; L326-L330 WeakPolarHBondContact O-CB 3.46Å; L326-L330 PolarHBondContact O-N 3.18Å; L326-I397 HydrophobicContact CD1-CG1 4.38Å; L326-P400 HydrophobicContact CB-CB 4.1Å; L326-P400 HydrophobicContact CB-CG 3.89Å; L326-P400 HydrophobicContact CD1-CG 4.07Å
327	I	95.4	Very high	95.7	Very high	110 Å²	110	72.9 Å²	72.9	56%	0.564	36%	0.362	S	S	*	.	H	α-helix	trans	-62.1	-40.1	179.2	-65.8	167.5	0	0	0	110.4	L323 G324 L330 F331	L323-I327 HydrophobicContact CG-CD1 4.29Å; L323-I327 WeakPolarHBondContact O-CG1 3.12Å; L323-I327 PolarHBondContact O-N 2.91Å; G324-I327 PolarHBondContact O-N 3.48Å; I327-L330 PolarHBondContact O-N 3.28Å; I327-F331 VanDerWaalsContact O-CB 3.28Å; I327-F331 WeakPolarHBondContact O-CB 3.39Å; I327-F331 PolarHBondContact O-N 2.93Å
328	F	95.8	Very high	96	Very high	116 Å²	116	64.6 Å²	64.6	51%	0.509	33%	0.326	S	S	.	.	H	α-helix	trans	-63.2	-48.7	178.6	178.9	-109.6	0	0	0	112.8	G324 L325 L326 F331 I332	G324-F328 VanDerWaalsContact O-CB 3.28Å; G324-F328 WeakPolarHBondContact O-CB 3.14Å; G324-F328 PolarHBondContact O-N 2.73Å; L325-F328 PolarHBondContact O-N 3.08Å; L326-F328 VanDerWaalsContact C-N 3.28Å; L326-F328 PolarHBondContact O-N 3.28Å; F328-F331 PolarHBondContact O-N 3.08Å; F328-I332 HydrophobicContact CD1-CD1 4Å; F328-I332 HydrophobicContact CD2-CD1 4.49Å; F328-I332 HydrophobicContact CE1-CD1 3.49Å; F328-I332 VanDerWaalsContact CE1-CD1 3.49Å; F328-I332 HydrophobicContact CE2-CD1 4.03Å; F328-I332 HydrophobicContact CG-CD1 4.49Å; F328-I332 HydrophobicContact CZ-CD1 3.52Å; F328-I332 HydrophobicContact CZ-CG1 4.48Å; F328-I332 WeakPolarHBondContact O-CG1 3.43Å; F328-I332 PolarHBondContact O-N 2.85Å
329	F	95.4	Very high	96.3	Very high	93 Å²	93	63.7 Å²	63.7	41%	0.408	32%	0.316	S	S	.	.	H	α-helix	trans	-67.2	-37.8	177.6	-69.8	-47	0	0	0	112.5	L325 L326 F331 I332 G333 T396	L325-F329 HydrophobicContact CB-CE2 4.44Å; L325-F329 VanDerWaalsContact O-CD2 3.26Å; L325-F329 WeakPolarHBondContact O-CD2 3.31Å; L325-F329 PolarHBondContact O-N 3.06Å; L326-F329 PolarHBondContact O-N 3.1Å; F329-F331 VanDerWaalsContact C-N 3.33Å; F329-F331 PolarHBondContact O-N 2.99Å; F329-I332 PolarHBondContact O-N 2.8Å; F329-G333 PolarHBondContact O-N 3.03Å; F329-T396 HydrophobicContact CB-CG2 3.57Å
330	L	95.9	Very high	96.4	Very high	43 Å²	43	65.5 Å²	65.5	23%	0.225	33%	0.331	C	S	.	.	H	α-helix	trans	-62.4	-43	174.5	-167.4	150.4	0	0	0	110.7	L326 I327 I332 G333 V334 V364 T368	L326-L330 VanDerWaalsContact O-CB 3.3Å; L326-L330 WeakPolarHBondContact O-CB 3.46Å; L326-L330 PolarHBondContact O-N 3.18Å; I327-L330 PolarHBondContact O-N 3.28Å; L330-I332 PolarHBondContact O-N 2.88Å; L330-G333 PolarHBondContact O-N 3Å; L330-V334 HydrophobicContact CD2-CG2 3.76Å; L330-V334 WeakPolarHBondContact O-CB 3.5Å; L330-V334 VanDerWaalsContact O-CG2 3.25Å; L330-V334 WeakPolarHBondContact O-CG2 3.36Å; L330-V334 PolarHBondContact O-N 3.49Å; L330-V364 HydrophobicContact CD2-CG2 4.45Å; L330-T368 HydrophobicContact CD1-CG2 4.46Å
331	F	97.5	Very high	96.6	Very high	124 Å²	124	59.9 Å²	59.9	54%	0.544	30%	0.303	S	S	.	.	H	α-helix	trans	-61.4	-44.6	177	-177.1	-108.1	0	0	0	112.7	I327 F328 F329 V334 I335	I327-F331 VanDerWaalsContact O-CB 3.28Å; I327-F331 WeakPolarHBondContact O-CB 3.39Å; I327-F331 PolarHBondContact O-N 2.93Å; F328-F331 PolarHBondContact O-N 3.08Å; F329-F331 VanDerWaalsContact C-N 3.33Å; F329-F331 PolarHBondContact O-N 2.99Å; F331-V334 PolarHBondContact O-N 3.26Å; F331-I335 HydrophobicContact CD1-CD1 4Å; F331-I335 HydrophobicContact CE1-CD1 3.46Å; F331-I335 VanDerWaalsContact CE1-CD1 3.46Å; F331-I335 HydrophobicContact CE2-CD1 4.02Å; F331-I335 HydrophobicContact CZ-CD1 3.48Å; F331-I335 VanDerWaalsContact CZ-CD1 3.48Å; F331-I335 HydrophobicContact CZ-CG1 4.47Å; F331-I335 WeakPolarHBondContact O-CG1 3.37Å; F331-I335 PolarHBondContact O-N 3.29Å; F331-I335 VanDerWaalsContact O-N 3.1Å
332	I	97.8	Very high	96.7	Very high	79 Å²	79	54.2 Å²	54.2	41%	0.405	28%	0.282	S	S	.	.	H	α-helix	trans	-60.8	-47.1	174.5	-68.2	170.5	0	0	0	110.7	F328 F329 L330 V334 I335 L336	F328-I332 HydrophobicContact CD1-CD1 4Å; F328-I332 HydrophobicContact CD2-CD1 4.49Å; F328-I332 HydrophobicContact CE1-CD1 3.49Å; F328-I332 VanDerWaalsContact CE1-CD1 3.49Å; F328-I332 HydrophobicContact CE2-CD1 4.03Å; F328-I332 HydrophobicContact CG-CD1 4.49Å; F328-I332 HydrophobicContact CZ-CD1 3.52Å; F328-I332 HydrophobicContact CZ-CG1 4.48Å; F328-I332 WeakPolarHBondContact O-CG1 3.43Å; F328-I332 PolarHBondContact O-N 2.85Å; F329-I332 PolarHBondContact O-N 2.8Å; L330-I332 PolarHBondContact O-N 2.88Å; I332-V334 PolarHBondContact O-N 3.19Å; I332-I335 PolarHBondContact O-N 2.78Å; I332-L336 WeakPolarHBondContact O-CB 3.41Å; I332-L336 PolarHBondContact O-N 2.77Å
333	G	97.7	Very high	96.8	Very high	8 Å²	8	60.1 Å²	60.1	8%	0.082	31%	0.308	C	S	.	.	H	α-helix	trans	-60.3	-45.3	179.3	0	0	0	0	0	112.2	F329 L330 I335 L336 F337	F329-G333 PolarHBondContact O-N 3.03Å; L330-G333 PolarHBondContact O-N 3Å; G333-I335 PolarHBondContact O-N 3.38Å; G333-L336 PolarHBondContact O-N 2.9Å; G333-F337 WeakPolarHBondContact O-CB 3.22Å; G333-F337 WeakPolarHBondContact O-CD2 3.4Å; G333-F337 PolarHBondContact O-N 2.97Å
334	V	98.4	Very high	96.9	Very high	9 Å²	9	59.4 Å²	59.4	6%	0.055	31%	0.309	C	S	.	.	H	α-helix	trans	-57.3	-52	176.5	167.9	0	0	0	0	110.7	L330 F331 I332 L336 S338 F360 A363 V364 M367	L330-V334 HydrophobicContact CD2-CG2 3.76Å; L330-V334 WeakPolarHBondContact O-CB 3.5Å; L330-V334 VanDerWaalsContact O-CG2 3.25Å; L330-V334 WeakPolarHBondContact O-CG2 3.36Å; L330-V334 PolarHBondContact O-N 3.49Å; F331-V334 PolarHBondContact O-N 3.26Å; I332-V334 PolarHBondContact O-N 3.19Å; V334-L336 VanDerWaalsContact C-N 3.33Å; V334-L336 PolarHBondContact O-N 3.39Å; V334-S338 WeakPolarHBondContact O-CB 3.37Å; V334-S338 PolarHBondContact O-N 3.48Å; V334-S338 PolarHBondContact O-OG 2.95Å; V334-F360 HydrophobicContact CG1-CB 3.76Å; V334-F360 HydrophobicContact CG1-CD1 3.51Å; V334-F360 HydrophobicContact CG1-CE1 4.25Å; V334-F360 HydrophobicContact CG1-CG 3.74Å; V334-A363 HydrophobicContact CB-CB 4.48Å; V334-A363 HydrophobicContact CG1-CB 4.37Å; V334-A363 HydrophobicContact CG2-CB 4.37Å; V334-V364 HydrophobicContact CG1-CG2 4.32Å; V334-V364 HydrophobicContact CG2-CG2 3.5Å; V334-V364 VanDerWaalsContact CG2-CG2 3.5Å; V334-M367 HydrophobicContact CG2-SD 4.13Å
335	I	98.4	Very high	97	Very high	68 Å²	68	57.7 Å²	57.7	35%	0.349	29%	0.292	S	S	.	.	H	α-helix	trans	-59.9	-45.4	179.5	-68.4	173.6	0	0	0	111.4	F331 I332 G333 S339 F360	F331-I335 HydrophobicContact CD1-CD1 4Å; F331-I335 HydrophobicContact CE1-CD1 3.46Å; F331-I335 VanDerWaalsContact CE1-CD1 3.46Å; F331-I335 HydrophobicContact CE2-CD1 4.02Å; F331-I335 HydrophobicContact CZ-CD1 3.48Å; F331-I335 VanDerWaalsContact CZ-CD1 3.48Å; F331-I335 HydrophobicContact CZ-CG1 4.47Å; F331-I335 WeakPolarHBondContact O-CG1 3.37Å; F331-I335 PolarHBondContact O-N 3.29Å; F331-I335 VanDerWaalsContact O-N 3.1Å; I332-I335 PolarHBondContact O-N 2.78Å; G333-I335 PolarHBondContact O-N 3.38Å; I335-S339 VanDerWaalsContact O-CB 3.31Å; I335-S339 WeakPolarHBondContact O-CB 3.38Å; I335-S339 PolarHBondContact O-N 3.47Å; I335-S339 VanDerWaalsContact O-N 3.1Å; I335-S339 PolarHBondContact O-OG 3.4Å; I335-F360 HydrophobicContact CG1-CE1 4.17Å; I335-F360 HydrophobicContact CG1-CZ 4.2Å
336	L	98.6	Very high	96.9	Very high	106 Å²	106	56.7 Å²	56.7	56%	0.555	30%	0.295	S	S	*	.	H	α-helix	trans	-63.9	-54.1	-176.9	-178.9	68.2	0	0	0	111.9	I332 G333 V334 S339 A340	I332-L336 WeakPolarHBondContact O-CB 3.41Å; I332-L336 PolarHBondContact O-N 2.77Å; G333-L336 PolarHBondContact O-N 2.9Å; V334-L336 VanDerWaalsContact C-N 3.33Å; V334-L336 PolarHBondContact O-N 3.39Å; L336-S339 PolarHBondContact O-N 3.17Å; L336-A340 WeakPolarHBondContact O-CB 3.19Å; L336-A340 PolarHBondContact O-N 3.25Å
337	F	98.5	Very high	96.5	Very high	27 Å²	27	64 Å²	64	12%	0.118	33%	0.328	C	S	.	.	H	α-helix	trans	-73	-34.9	-175	-69.9	-63.1	0	0	0	112.5	G333 A340 V341 W362 M367 V385 L388 C389 A392	G333-F337 WeakPolarHBondContact O-CB 3.22Å; G333-F337 WeakPolarHBondContact O-CD2 3.4Å; G333-F337 PolarHBondContact O-N 2.97Å; F337-A340 PolarHBondContact O-N 3.03Å; F337-V341 WeakPolarHBondContact O-CB 3.16Å; F337-V341 WeakPolarHBondContact O-CG1 3.13Å; F337-V341 PolarHBondContact O-N 3.29Å; F337-W362 HydrophobicContact CB-CZ3 4.4Å; F337-M367 HydrophobicContact CD2-SD 4.21Å; F337-V385 HydrophobicContact CD1-CG1 4.15Å; F337-L388 HydrophobicContact CE1-CB 4.11Å; F337-C389 HydrophobicContact CB-CB 4.1Å; F337-C389 HydrophobicContact CD1-CB 3.69Å; F337-C389 HydrophobicContact CD2-CB 4.07Å; F337-C389 HydrophobicContact CE1-CB 4.11Å; F337-C389 HydrophobicContact CE2-CB 4.47Å; F337-C389 HydrophobicContact CG-CB 3.68Å; F337-C389 HydrophobicContact CZ-CB 4.49Å; F337-A392 HydrophobicContact CE2-CB 3.55Å; F337-A392 HydrophobicContact CZ-CB 3.51Å
338	S	98.4	Very high	96.2	Very high	0 Å²	0	63.7 Å²	63.7	0%	0	32%	0.324	C	S	.	.	H	α-helix	trans	-65	-39.9	173.6	-62.9	0	0	0	0	112.2	V334 V341 Y342 A359 F360 A363	V334-S338 WeakPolarHBondContact O-CB 3.37Å; V334-S338 PolarHBondContact O-N 3.48Å; V334-S338 PolarHBondContact O-OG 2.95Å; S338-V341 WeakPolarHBondContact O-CG1 3.42Å; S338-Y342 WeakPolarHBondContact O-CB 3.27Å; S338-Y342 PolarHBondContact O-N 3.47Å; S338-Y342 VanDerWaalsContact O-N 3.07Å; S338-A359 PolarHBondContact OG-O 3.3Å; S338-F360 WeakPolarHBondContact OG-CA 3.35Å; S338-F360 WeakPolarHBondContact OG-CD1 3.22Å; S338-F360 PolarHBondContact OG-N 2.95Å; S338-A363 WeakPolarHBondContact OG-CB 3.21Å
339	S	98.3	Very high	95.6	Very high	32 Å²	32	68.3 Å²	68.3	22%	0.224	34%	0.344	C	S	.	.	H	α-helix	trans	-66.6	-44.1	175	-56.7	0	0	0	0	111.2	I335 L336 Y342 F343	I335-S339 VanDerWaalsContact O-CB 3.31Å; I335-S339 WeakPolarHBondContact O-CB 3.38Å; I335-S339 PolarHBondContact O-N 3.47Å; I335-S339 VanDerWaalsContact O-N 3.1Å; I335-S339 PolarHBondContact O-OG 3.4Å; L336-S339 PolarHBondContact O-N 3.17Å; S339-Y342 PolarHBondContact O-N 2.96Å; S339-F343 WeakPolarHBondContact O-CD2 3.17Å; S339-F343 PolarHBondContact O-N 3.22Å; S339-F343 VanDerWaalsContact O-N 3.13Å
340	A	98.3	Very high	95.1	Very high	38 Å²	38	71.9 Å²	71.9	31%	0.314	36%	0.362	S	S	.	.	H	α-helix	trans	-64.2	-45	-179.7	0	0	0	0	0	112.6	L336 F337 A344 V385	L336-A340 WeakPolarHBondContact O-CB 3.19Å; L336-A340 PolarHBondContact O-N 3.25Å; F337-A340 PolarHBondContact O-N 3.03Å; A340-A344 VanDerWaalsContact O-CB 3.3Å; A340-A344 WeakPolarHBondContact O-CB 3.35Å; A340-A344 PolarHBondContact O-N 3.16Å; A340-V385 HydrophobicContact CB-CG1 3.82Å; A340-V385 HydrophobicContact CB-CG2 4.09Å
341	V	98	Very high	94.8	Very high	0 Å²	0	71.1 Å²	71.1	0%	0	36%	0.361	C	S	.	.	H	α-helix	trans	-69.1	-37.6	179.2	76.6	0	0	0	0	111.2	F337 S338 F343 A344 E345 F353 A359 W362 P377 V385	F337-V341 WeakPolarHBondContact O-CB 3.16Å; F337-V341 WeakPolarHBondContact O-CG1 3.13Å; F337-V341 PolarHBondContact O-N 3.29Å; S338-V341 WeakPolarHBondContact O-CG1 3.42Å; V341-F343 PolarHBondContact O-N 3.13Å; V341-A344 PolarHBondContact O-N 3.2Å; V341-E345 HydrophobicContact CG2-CG 4.07Å; V341-E345 WeakPolarHBondContact O-CB 3.38Å; V341-E345 VanDerWaalsContact O-CG 3.29Å; V341-E345 WeakPolarHBondContact O-CG 3.39Å; V341-E345 PolarHBondContact O-N 3.45Å; V341-F353 HydrophobicContact CG1-CD1 3.72Å; V341-F353 HydrophobicContact CG1-CE1 3.67Å; V341-F353 HydrophobicContact CG1-CG 4.33Å; V341-F353 HydrophobicContact CG1-CZ 4.27Å; V341-F353 HydrophobicContact CG2-CD1 4.42Å; V341-F353 HydrophobicContact CG2-CD2 4.29Å; V341-F353 HydrophobicContact CG2-CE1 3.99Å; V341-F353 HydrophobicContact CG2-CE2 3.88Å; V341-F353 HydrophobicContact CG2-CZ 3.71Å; V341-A359 HydrophobicContact CG1-CB 4.17Å; V341-W362 HydrophobicContact CB-CE3 4.32Å; V341-W362 HydrophobicContact CB-CH2 3.99Å; V341-W362 HydrophobicContact CB-CZ3 3.73Å; V341-W362 HydrophobicContact CG1-CE3 3.68Å; V341-W362 HydrophobicContact CG1-CH2 4.26Å; V341-W362 HydrophobicContact CG1-CZ3 3.53Å; V341-W362 HydrophobicContact CG2-CH2 3.98Å; V341-W362 HydrophobicContact CG2-CZ2 4.34Å; V341-W362 HydrophobicContact CG2-CZ3 4.11Å; V341-P377 HydrophobicContact CG2-CB 4.08Å; V341-V385 HydrophobicContact CB-CG1 4.05Å
342	Y	97.7	Very high	94.5	Very high	69 Å²	69	69.3 Å²	69.3	27%	0.271	35%	0.353	S	S	.	.	H	α-helix	trans	-57.8	-51.1	176.2	172.4	-100.7	0	0	0	110.9	S338 S339 A344 E345 A346 F353 I356	S338-Y342 WeakPolarHBondContact O-CB 3.27Å; S338-Y342 PolarHBondContact O-N 3.47Å; S338-Y342 VanDerWaalsContact O-N 3.07Å; S339-Y342 PolarHBondContact O-N 2.96Å; Y342-A344 VanDerWaalsContact C-N 3.33Å; Y342-A344 PolarHBondContact O-N 3.14Å; Y342-E345 PolarHBondContact O-N 3.18Å; Y342-A346 WeakPolarHBondContact O-CA 3.41Å; Y342-A346 WeakPolarHBondContact O-CB 3.33Å; Y342-A346 PolarHBondContact O-N 3.33Å; Y342-F353 WeakPolarHBondContact CD2-O 3.45Å; Y342-I356 HydrophobicContact CD1-CD1 4.22Å; Y342-I356 HydrophobicContact CD1-CG1 3.75Å; Y342-I356 HydrophobicContact CD2-CG1 4.47Å; Y342-I356 HydrophobicContact CE1-CG1 4.38Å; Y342-I356 HydrophobicContact CG-CG1 3.8Å
343	F	97.1	Very high	94.4	Very high	143 Å²	143	65.9 Å²	65.9	63%	0.627	34%	0.335	S	S	*	.	H	α-helix	trans	-69	-30.1	178	-71.8	-61.1	0	0	0	113.3	S339 V341 E345	S339-F343 WeakPolarHBondContact O-CD2 3.17Å; S339-F343 PolarHBondContact O-N 3.22Å; S339-F343 VanDerWaalsContact O-N 3.13Å; V341-F343 PolarHBondContact O-N 3.13Å; F343-E345 VanDerWaalsContact C-N 3.29Å; F343-E345 PolarHBondContact O-N 3.21Å
344	A	96.4	Very high	94.2	Very high	35 Å²	35	70.3 Å²	70.3	29%	0.289	36%	0.36	S	S	.	.	H	α-helix	trans	-70.7	-25.2	175.9	0	0	0	0	0	113.2	A340 V341 Y342 T379	A340-A344 VanDerWaalsContact O-CB 3.3Å; A340-A344 WeakPolarHBondContact O-CB 3.35Å; A340-A344 PolarHBondContact O-N 3.16Å; V341-A344 PolarHBondContact O-N 3.2Å; Y342-A344 VanDerWaalsContact C-N 3.33Å; Y342-A344 PolarHBondContact O-N 3.14Å; A344-T379 PolarHBondContact O-OG1 3.03Å
345	E	95.8	Very high	94	Very high	2 Å²	2	71.6 Å²	71.6	1%	0.009	37%	0.369	C	S	.	.	H	α-helix	trans	-110.1	1.1	-177.3	-59	-79.8	129.8	0	0	112.9	V341 Y342 F343 E347 E348 S351 F353 P377 V378 T379 G382	V341-E345 HydrophobicContact CG2-CG 4.07Å; V341-E345 WeakPolarHBondContact O-CB 3.38Å; V341-E345 VanDerWaalsContact O-CG 3.29Å; V341-E345 WeakPolarHBondContact O-CG 3.39Å; V341-E345 PolarHBondContact O-N 3.45Å; Y342-E345 PolarHBondContact O-N 3.18Å; F343-E345 VanDerWaalsContact C-N 3.29Å; F343-E345 PolarHBondContact O-N 3.21Å; E345-E347 PolarHBondContact O-N 3.13Å; E345-E348 PolarHBondContact O-N 2.99Å; E345-E348 VanDerWaalsContact O-N 3.14Å; E345-S351 WeakPolarHBondContact CB-OG 3.37Å; E345-S351 WeakPolarHBondContact O-CB 3.38Å; E345-F353 HydrophobicContact CB-CD2 3.93Å; E345-F353 HydrophobicContact CG-CD2 3.7Å; E345-F353 HydrophobicContact CG-CE2 4Å; E345-P377 HydrophobicContact CG-CB 4.24Å; E345-P377 WeakPolarHBondContact OE1-CB 3.49Å; E345-V378 PolarHBondContact OE1-N 3.41Å; E345-V378 WeakPolarHBondContact OE2-CG2 3.29Å; E345-V378 PolarHBondContact OE2-N 3.08Å; E345-T379 WeakPolarHBondContact OE1-CA 3.48Å; E345-T379 WeakPolarHBondContact OE1-CB 3.28Å; E345-T379 VanDerWaalsContact OE1-CG2 3.32Å; E345-T379 WeakPolarHBondContact OE1-CG2 3.45Å; E345-T379 PolarHBondContact OE1-N 2.97Å; E345-T379 PolarHBondContact OE1-OG1 2.74Å; E345-G382 WeakPolarHBondContact OE1-CA 3.32Å
346	A	91.2	Very high	94	Very high	59 Å²	59	70.6 Å²	70.6	49%	0.488	37%	0.365	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64	-26.1	-171.4	0	0	0	0	0	114.2	Y342 E348	Y342-A346 WeakPolarHBondContact O-CA 3.41Å; Y342-A346 WeakPolarHBondContact O-CB 3.33Å; Y342-A346 PolarHBondContact O-N 3.33Å; A346-E348 VanDerWaalsContact C-N 3.35Å
347	E	86.7	Confident	94	Very high	184 Å²	184	69.4 Å²	69.4	86%	0.86	36%	0.363	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.8	-8.3	-179	-61.9	-172.6	170.5	0	0	112.8	E345	E345-E347 PolarHBondContact O-N 3.13Å
348	E	89.1	Confident	93.8	Very high	103 Å²	103	71.7 Å²	71.7	48%	0.481	38%	0.377	S	S	.	.			trans	-98.4	121.5	-170.8	-142.4	58.2	-168.1	0	0	112.4	E345 A346 E350 S351 V378 T379	E345-E348 PolarHBondContact O-N 2.99Å; E345-E348 VanDerWaalsContact O-N 3.14Å; A346-E348 VanDerWaalsContact C-N 3.35Å; E348-E350 VanDerWaalsContact C-N 3.29Å; E348-E350 PolarHBondContact O-N 3.38Å; E348-S351 WeakPolarHBondContact O-CB 3.47Å; E348-S351 PolarHBondContact O-N 2.88Å; E348-S351 VanDerWaalsContact O-N 3.14Å; E348-V378 HydrophobicContact CB-CG2 4.48Å; E348-V378 HydrophobicContact CG-CG2 3.95Å; E348-T379 HydrophobicContact CB-CG2 4.15Å; E348-T379 HydrophobicContact CG-CG2 4.19Å
349	K	81.8	Confident	93.8	Very high	212 Å²	212	71.7 Å²	71.7	92%	0.922	38%	0.377	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.3	-24.5	-171.8	-70.2	-176.7	-179.6	176.6	0	114.5
350	E	85	Confident	93.8	Very high	169 Å²	169	73.5 Å²	73.5	79%	0.79	38%	0.381	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.3	16.6	177.5	-61.2	-167.7	169.9	0	0	112.3	E348	E348-E350 VanDerWaalsContact C-N 3.29Å; E348-E350 PolarHBondContact O-N 3.38Å
351	S	89.8	Confident	93.8	Very high	27 Å²	27	77.3 Å²	77.3	19%	0.189	39%	0.387	C	S	.	.			trans	-67	134.5	177.9	177.6	0	0	0	0	111.9	E345 E348 F353	E345-S351 WeakPolarHBondContact CB-OG 3.37Å; E345-S351 WeakPolarHBondContact O-CB 3.38Å; E348-S351 WeakPolarHBondContact O-CB 3.47Å; E348-S351 PolarHBondContact O-N 2.88Å; E348-S351 VanDerWaalsContact O-N 3.14Å; S351-F353 PolarHBondContact O-N 2.85Å; S351-F353 PolarHBondContact OG-N 3.3Å
352	F	91.8	Very high	93.8	Very high	86 Å²	86	78 Å²	78	38%	0.377	39%	0.389	S	S	.	.	S	Bend	trans	-77.1	-10.5	170.9	-60.5	-82	0	0	0	112.5	T354 M375 Y376	F352-T354 PolarHBondContact O-N 3.3Å; F352-M375 HydrophobicContact CB-CB 4.35Å; F352-M375 HydrophobicContact CB-CE 4.34Å; F352-M375 HydrophobicContact CB-CG 4.25Å; F352-M375 VanDerWaalsContact O-CE 3.3Å; F352-M375 WeakPolarHBondContact O-CE 3.37Å; F352-Y376 HydrophobicContact CD2-CE1 4.47Å; F352-Y376 HydrophobicContact CE2-CD1 4.26Å; F352-Y376 AromaticContact CE2-CE1 3.73Å; F352-Y376 HydrophobicContact CE2-CE1 3.73Å; F352-Y376 HydrophobicContact CE2-CE2 4.08Å; F352-Y376 AromaticContact CE2-CZ 3.63Å; F352-Y376 HydrophobicContact CZ-CE1 4.08Å
353	F	95.1	Very high	93.8	Very high	6 Å²	6	74.7 Å²	74.7	3%	0.026	38%	0.376	C	S	.	.			trans	-93.2	75.7	-172.9	-56.9	-81.6	0	0	0	111.5	V341 Y342 E345 S351 A359 W362 M375 P377	V341-F353 HydrophobicContact CG1-CD1 3.72Å; V341-F353 HydrophobicContact CG1-CE1 3.67Å; V341-F353 HydrophobicContact CG1-CG 4.33Å; V341-F353 HydrophobicContact CG1-CZ 4.27Å; V341-F353 HydrophobicContact CG2-CD1 4.42Å; V341-F353 HydrophobicContact CG2-CD2 4.29Å; V341-F353 HydrophobicContact CG2-CE1 3.99Å; V341-F353 HydrophobicContact CG2-CE2 3.88Å; V341-F353 HydrophobicContact CG2-CZ 3.71Å; Y342-F353 WeakPolarHBondContact CD2-O 3.45Å; E345-F353 HydrophobicContact CB-CD2 3.93Å; E345-F353 HydrophobicContact CG-CD2 3.7Å; E345-F353 HydrophobicContact CG-CE2 4Å; S351-F353 PolarHBondContact O-N 2.85Å; S351-F353 PolarHBondContact OG-N 3.3Å; F353-A359 HydrophobicContact CD1-CB 3.75Å; F353-A359 HydrophobicContact CE1-CB 4.43Å; F353-W362 HydrophobicContact CE1-CB 3.77Å; F353-W362 AromaticContact CE1-CD2 3.65Å; F353-W362 HydrophobicContact CE1-CD2 3.65Å; F353-W362 AromaticContact CE1-CE3 4Å; F353-W362 HydrophobicContact CE1-CE3 4Å; F353-W362 AromaticContact CE1-CG 3.53Å; F353-W362 HydrophobicContact CE1-CG 3.53Å; F353-W362 AromaticContact CZ-CD2 3.93Å; F353-W362 HydrophobicContact CZ-CD2 3.93Å; F353-W362 AromaticContact CZ-CG 3.89Å; F353-W362 HydrophobicContact CZ-CG 3.89Å; F353-M375 HydrophobicContact CD1-CE 3.79Å; F353-M375 HydrophobicContact CE1-CE 3.99Å; F353-M375 HydrophobicContact CG-CE 4.48Å; F353-P377 HydrophobicContact CE2-CB 4.23Å
354	T	93.3	Very high	93.9	Very high	102 Å²	102	70.4 Å²	70.4	63%	0.626	36%	0.362	S	S	*	.			trans	-69.5	-34.3	-178.1	41.2	0	0	0	0	114	F352 D358	F352-T354 PolarHBondContact O-N 3.3Å; T354-D358 PolarHBondContact OG1-OD2 3.28Å
355	S	95.7	Very high	94	Very high	35 Å²	35	69 Å²	69	25%	0.245	35%	0.35	C	S	.	.	S	Bend	trans	-151	162.3	177.9	75.8	0	0	0	0	111.3	P357 D358 A359	S355-P357 WeakPolarHBondContact OG-CD 3.32Å; S355-D358 WeakPolarHBondContact CB-OD2 3.5Å; S355-D358 PolarHBondContact N-OD2 2.91Å; S355-D358 PolarHBondContact O-N 3.44Å; S355-D358 PolarHBondContact OG-N 3.49Å; S355-D358 PolarHBondContact OG-OD2 3.37Å; S355-A359 PolarHBondContact O-N 2.95Å
356	I	97.3	Very high	94.1	Very high	48 Å²	48	70 Å²	70	25%	0.246	36%	0.357	C	S	.	.	H	α-helix	trans	-60.2	-44.1	176.3	-61.5	173	0	0	0	111.6	Y342 D358 A359 F360	Y342-I356 HydrophobicContact CD1-CD1 4.22Å; Y342-I356 HydrophobicContact CD1-CG1 3.75Å; Y342-I356 HydrophobicContact CD2-CG1 4.47Å; Y342-I356 HydrophobicContact CE1-CG1 4.38Å; Y342-I356 HydrophobicContact CG-CG1 3.8Å; I356-D358 VanDerWaalsContact C-N 3.35Å; I356-D358 PolarHBondContact O-N 3.43Å; I356-A359 CarbonylContact O-C 3.51Å; I356-A359 WeakPolarHBondContact O-CA 3.28Å; I356-A359 WeakPolarHBondContact O-CB 3.43Å; I356-A359 PolarHBondContact O-N 3.24Å; I356-A359 VanDerWaalsContact O-N 3.16Å; I356-F360 HydrophobicContact CG2-CD1 4.43Å; I356-F360 HydrophobicContact CG2-CE1 3.7Å; I356-F360 HydrophobicContact CG2-CZ 4.22Å; I356-F360 WeakPolarHBondContact O-CD1 3.37Å; I356-F360 PolarHBondContact O-N 3.37Å; I356-F360 VanDerWaalsContact O-N 3.13Å
357	P	97.8	Very high	94.4	Very high	81 Å²	81	67.3 Å²	67.3	53%	0.526	34%	0.335	S	S	.	.	H	α-helix	trans	-60	-38.7	173.5	-27.5	36.7	0	0	0	114.3	S355 A359 F360	S355-P357 WeakPolarHBondContact OG-CD 3.32Å; P357-A359 VanDerWaalsContact C-N 3.28Å; P357-A359 PolarHBondContact O-N 2.95Å; P357-F360 HydrophobicContact CB-CD2 4.4Å; P357-F360 HydrophobicContact CB-CE2 4.45Å; P357-F360 VanDerWaalsContact O-CB 3.23Å; P357-F360 WeakPolarHBondContact O-CB 3.29Å; P357-F360 PolarHBondContact O-N 3.42Å; P357-F360 VanDerWaalsContact O-N 3.08Å
358	D	95.8	Very high	94.9	Very high	75 Å²	75	60.7 Å²	60.7	40%	0.401	31%	0.307	S	S	.	.	H	α-helix	trans	-64.6	-38.1	175.2	-59.7	-37	0	0	0	110.5	T354 S355 I356 F360 W361	T354-D358 PolarHBondContact OG1-OD2 3.28Å; S355-D358 WeakPolarHBondContact CB-OD2 3.5Å; S355-D358 PolarHBondContact N-OD2 2.91Å; S355-D358 PolarHBondContact O-N 3.44Å; S355-D358 PolarHBondContact OG-N 3.49Å; S355-D358 PolarHBondContact OG-OD2 3.37Å; I356-D358 VanDerWaalsContact C-N 3.35Å; I356-D358 PolarHBondContact O-N 3.43Å; D358-F360 PolarHBondContact O-N 3Å; D358-W361 PolarHBondContact O-N 3.19Å
359	A	97.7	Very high	95.2	Very high	0 Å²	0	60.4 Å²	60.4	0%	0	31%	0.312	C	S	.	.	H	α-helix	trans	-67.3	-14.6	174.3	0	0	0	0	0	113.8	S338 V341 F353 S355 I356 P357 W361 W362 A363	S338-A359 PolarHBondContact OG-O 3.3Å; V341-A359 HydrophobicContact CG1-CB 4.17Å; F353-A359 HydrophobicContact CD1-CB 3.75Å; F353-A359 HydrophobicContact CE1-CB 4.43Å; S355-A359 PolarHBondContact O-N 2.95Å; I356-A359 CarbonylContact O-C 3.51Å; I356-A359 WeakPolarHBondContact O-CA 3.28Å; I356-A359 WeakPolarHBondContact O-CB 3.43Å; I356-A359 PolarHBondContact O-N 3.24Å; I356-A359 VanDerWaalsContact O-N 3.16Å; P357-A359 VanDerWaalsContact C-N 3.28Å; P357-A359 PolarHBondContact O-N 2.95Å; A359-W361 VanDerWaalsContact C-N 3.29Å; A359-W361 PolarHBondContact O-N 3.4Å; A359-W362 PolarHBondContact O-N 3.01Å; A359-A363 PolarHBondContact O-N 2.67Å
360	F	98.4	Very high	96	Very high	70 Å²	70	53.9 Å²	53.9	31%	0.307	29%	0.29	S	S	.	.	H	α-helix	trans	-62.3	-39	173.2	-67.4	-17.9	0	0	0	111.3	V334 I335 S338 I356 P357 D358 A363 V364	V334-F360 HydrophobicContact CG1-CB 3.76Å; V334-F360 HydrophobicContact CG1-CD1 3.51Å; V334-F360 HydrophobicContact CG1-CE1 4.25Å; V334-F360 HydrophobicContact CG1-CG 3.74Å; I335-F360 HydrophobicContact CG1-CE1 4.17Å; I335-F360 HydrophobicContact CG1-CZ 4.2Å; S338-F360 WeakPolarHBondContact OG-CA 3.35Å; S338-F360 WeakPolarHBondContact OG-CD1 3.22Å; S338-F360 PolarHBondContact OG-N 2.95Å; I356-F360 HydrophobicContact CG2-CD1 4.43Å; I356-F360 HydrophobicContact CG2-CE1 3.7Å; I356-F360 HydrophobicContact CG2-CZ 4.22Å; I356-F360 WeakPolarHBondContact O-CD1 3.37Å; I356-F360 PolarHBondContact O-N 3.37Å; I356-F360 VanDerWaalsContact O-N 3.13Å; P357-F360 HydrophobicContact CB-CD2 4.4Å; P357-F360 HydrophobicContact CB-CE2 4.45Å; P357-F360 VanDerWaalsContact O-CB 3.23Å; P357-F360 WeakPolarHBondContact O-CB 3.29Å; P357-F360 PolarHBondContact O-N 3.42Å; P357-F360 VanDerWaalsContact O-N 3.08Å; D358-F360 PolarHBondContact O-N 3Å; F360-A363 PolarHBondContact O-N 3.24Å; F360-V364 WeakPolarHBondContact O-CG2 3.32Å; F360-V364 PolarHBondContact O-N 3.3Å
361	W	98.1	Very high	96.6	Very high	118 Å²	118	48.3 Å²	48.3	45%	0.447	28%	0.278	S	S	.	.	H	α-helix	trans	-58.1	-51.3	176.6	170.2	-114.9	0	0	0	111.2	D358 A359 A363 V364 V365 Y372 D374	D358-W361 PolarHBondContact O-N 3.19Å; A359-W361 VanDerWaalsContact C-N 3.29Å; A359-W361 PolarHBondContact O-N 3.4Å; W361-A363 VanDerWaalsContact C-N 3.34Å; W361-A363 PolarHBondContact O-N 3.44Å; W361-V364 PolarHBondContact O-N 2.94Å; W361-V365 HydrophobicContact CD2-CG2 3.85Å; W361-V365 HydrophobicContact CE3-CG2 3.95Å; W361-V365 HydrophobicContact CH2-CG2 3.85Å; W361-V365 HydrophobicContact CZ2-CG2 3.73Å; W361-V365 HydrophobicContact CZ3-CG2 3.95Å; W361-V365 WeakPolarHBondContact O-CB 3.35Å; W361-V365 VanDerWaalsContact O-CG2 3.26Å; W361-V365 WeakPolarHBondContact O-CG2 3.28Å; W361-V365 PolarHBondContact O-N 2.87Å; W361-Y372 HydrophobicContact CH2-CD2 4Å; W361-Y372 AromaticContact CH2-CE2 3.59Å; W361-Y372 HydrophobicContact CH2-CE2 3.59Å; W361-Y372 AromaticContact CZ2-CD2 3.52Å; W361-Y372 HydrophobicContact CZ2-CD2 3.52Å; W361-Y372 AromaticContact CZ2-CE2 3.62Å; W361-Y372 HydrophobicContact CZ2-CE2 3.62Å; W361-D374 PolarHBondContact NE1-OD2 3.38Å
362	W	98.3	Very high	96.9	Very high	13 Å²	13	54.3 Å²	54.3	5%	0.049	30%	0.297	C	S	.	.	H	α-helix	trans	-58.2	-43.8	176.5	170.3	80.5	0	0	0	112.6	F337 V341 F353 A359 V365 S366 M375 P377 V385 C389	F337-W362 HydrophobicContact CB-CZ3 4.4Å; V341-W362 HydrophobicContact CB-CE3 4.32Å; V341-W362 HydrophobicContact CB-CH2 3.99Å; V341-W362 HydrophobicContact CB-CZ3 3.73Å; V341-W362 HydrophobicContact CG1-CE3 3.68Å; V341-W362 HydrophobicContact CG1-CH2 4.26Å; V341-W362 HydrophobicContact CG1-CZ3 3.53Å; V341-W362 HydrophobicContact CG2-CH2 3.98Å; V341-W362 HydrophobicContact CG2-CZ2 4.34Å; V341-W362 HydrophobicContact CG2-CZ3 4.11Å; F353-W362 HydrophobicContact CE1-CB 3.77Å; F353-W362 AromaticContact CE1-CD2 3.65Å; F353-W362 HydrophobicContact CE1-CD2 3.65Å; F353-W362 AromaticContact CE1-CE3 4Å; F353-W362 HydrophobicContact CE1-CE3 4Å; F353-W362 AromaticContact CE1-CG 3.53Å; F353-W362 HydrophobicContact CE1-CG 3.53Å; F353-W362 AromaticContact CZ-CD2 3.93Å; F353-W362 HydrophobicContact CZ-CD2 3.93Å; F353-W362 AromaticContact CZ-CG 3.89Å; F353-W362 HydrophobicContact CZ-CG 3.89Å; A359-W362 PolarHBondContact O-N 3.01Å; W362-V365 PolarHBondContact O-N 3.41Å; W362-S366 PolarHBondContact NE1-OG 3.24Å; W362-S366 WeakPolarHBondContact O-CB 3.41Å; W362-S366 PolarHBondContact O-N 3.44Å; W362-S366 PolarHBondContact O-OG 3.14Å; W362-M375 HydrophobicContact CB-CB 4.06Å; W362-M375 HydrophobicContact CB-CE 4.29Å; W362-M375 HydrophobicContact CB-SD 4.28Å; W362-M375 HydrophobicContact CG-CB 4.38Å; W362-P377 HydrophobicContact CZ2-CG 4.4Å; W362-V385 HydrophobicContact CH2-CG1 4.4Å; W362-C389 HydrophobicContact CH2-CB 4.18Å
363	A	98.3	Very high	97.1	Very high	0 Å²	0	52.5 Å²	52.5	0%	0	30%	0.303	C	S	.	.	H	α-helix	trans	-66.9	-43.5	-179.2	0	0	0	0	0	111.9	V334 S338 A359 F360 W361 S366 M367	V334-A363 HydrophobicContact CB-CB 4.48Å; V334-A363 HydrophobicContact CG1-CB 4.37Å; V334-A363 HydrophobicContact CG2-CB 4.37Å; S338-A363 WeakPolarHBondContact OG-CB 3.21Å; A359-A363 PolarHBondContact O-N 2.67Å; F360-A363 PolarHBondContact O-N 3.24Å; W361-A363 VanDerWaalsContact C-N 3.34Å; W361-A363 PolarHBondContact O-N 3.44Å; A363-S366 PolarHBondContact O-N 3.21Å; A363-M367 VanDerWaalsContact O-CB 3.25Å; A363-M367 WeakPolarHBondContact O-CB 3.48Å; A363-M367 WeakPolarHBondContact O-CG 3.39Å; A363-M367 PolarHBondContact O-N 2.89Å
364	V	98.2	Very high	97.1	Very high	53 Å²	53	56 Å²	56	32%	0.321	32%	0.321	S	S	.	.	H	α-helix	trans	-59.6	-49.3	175.1	172.1	0	0	0	0	110.6	L330 V334 F360 W361 S366 M367 T368	L330-V364 HydrophobicContact CD2-CG2 4.45Å; V334-V364 HydrophobicContact CG1-CG2 4.32Å; V334-V364 HydrophobicContact CG2-CG2 3.5Å; V334-V364 VanDerWaalsContact CG2-CG2 3.5Å; F360-V364 WeakPolarHBondContact O-CG2 3.32Å; F360-V364 PolarHBondContact O-N 3.3Å; W361-V364 PolarHBondContact O-N 2.94Å; V364-S366 VanDerWaalsContact C-N 3.32Å; V364-S366 PolarHBondContact O-N 3.02Å; V364-M367 PolarHBondContact O-N 3.3Å; V364-T368 WeakPolarHBondContact O-CB 3.35Å; V364-T368 WeakPolarHBondContact O-CG2 3.48Å; V364-T368 PolarHBondContact O-N 3.02Å; V364-T368 PolarHBondContact O-OG1 3.23Å
365	V	98.1	Very high	97.3	Very high	7 Å²	7	52.4 Å²	52.4	4%	0.042	30%	0.298	C	S	.	.	H	α-helix	trans	-63.1	-37.5	-179.5	168.9	0	0	0	0	111.9	W361 W362 T368 T369 V370 G371 Y372	W361-V365 HydrophobicContact CD2-CG2 3.85Å; W361-V365 HydrophobicContact CE3-CG2 3.95Å; W361-V365 HydrophobicContact CH2-CG2 3.85Å; W361-V365 HydrophobicContact CZ2-CG2 3.73Å; W361-V365 HydrophobicContact CZ3-CG2 3.95Å; W361-V365 WeakPolarHBondContact O-CB 3.35Å; W361-V365 VanDerWaalsContact O-CG2 3.26Å; W361-V365 WeakPolarHBondContact O-CG2 3.28Å; W361-V365 PolarHBondContact O-N 2.87Å; W362-V365 PolarHBondContact O-N 3.41Å; V365-T368 PolarHBondContact O-OG1 3.43Å; V365-T369 PolarHBondContact O-N 3.26Å; V365-V370 HydrophobicContact CG1-CB 4.13Å; V365-V370 HydrophobicContact CG1-CG1 4.35Å; V365-V370 PolarHBondContact O-N 2.91Å; V365-G371 VanDerWaalsContact CG1-N 3.29Å; V365-G371 PolarHBondContact O-N 2.95Å; V365-Y372 HydrophobicContact CG1-CD2 3.8Å; V365-Y372 HydrophobicContact CG1-CG 4.4Å; V365-Y372 HydrophobicContact CG2-CD2 3.81Å; V365-Y372 HydrophobicContact CG2-CE2 4.04Å
366	S	98	Very high	97.3	Very high	23 Å²	23	56.4 Å²	56.4	16%	0.161	31%	0.309	C	S	.	.	H	α-helix	trans	-76.4	-43.9	179.2	-59.7	0	0	0	0	112.3	W362 A363 V364 T368 T369	W362-S366 PolarHBondContact NE1-OG 3.24Å; W362-S366 WeakPolarHBondContact O-CB 3.41Å; W362-S366 PolarHBondContact O-N 3.44Å; W362-S366 PolarHBondContact O-OG 3.14Å; A363-S366 PolarHBondContact O-N 3.21Å; V364-S366 VanDerWaalsContact C-N 3.32Å; V364-S366 PolarHBondContact O-N 3.02Å; S366-T368 VanDerWaalsContact C-N 3.3Å; S366-T368 PolarHBondContact O-N 3.34Å; S366-T369 PolarHBondContact O-N 3.28Å
367	M	97.4	Very high	97.2	Very high	2 Å²	2	54.8 Å²	54.8	1%	0.01	30%	0.301	C	S	.	.	H	α-helix	trans	-65.9	-34	178.5	-73.4	-176.8	71.6	0	0	112.3	V334 F337 A363 V364 T369 C389 G393	V334-M367 HydrophobicContact CG2-SD 4.13Å; F337-M367 HydrophobicContact CD2-SD 4.21Å; A363-M367 VanDerWaalsContact O-CB 3.25Å; A363-M367 WeakPolarHBondContact O-CB 3.48Å; A363-M367 WeakPolarHBondContact O-CG 3.39Å; A363-M367 PolarHBondContact O-N 2.89Å; V364-M367 PolarHBondContact O-N 3.3Å; M367-T369 PolarHBondContact O-N 3.33Å; M367-C389 VanDerWaalsContact CG-SG 3.55Å; M367-G393 CarbonylContact O-C 3.57Å; M367-G393 VanDerWaalsContact O-CA 3.28Å; M367-G393 WeakPolarHBondContact O-CA 3.32Å
368	T	97.1	Very high	97.1	Very high	45 Å²	45	53.2 Å²	53.2	28%	0.276	29%	0.29	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.8	2	174.6	56.3	0	0	0	0	113.2	L330 V364 V365 S366 V370 I397	L330-T368 HydrophobicContact CD1-CG2 4.46Å; V364-T368 WeakPolarHBondContact O-CB 3.35Å; V364-T368 WeakPolarHBondContact O-CG2 3.48Å; V364-T368 PolarHBondContact O-N 3.02Å; V364-T368 PolarHBondContact O-OG1 3.23Å; V365-T368 PolarHBondContact O-OG1 3.43Å; S366-T368 VanDerWaalsContact C-N 3.3Å; S366-T368 PolarHBondContact O-N 3.34Å; T368-V370 PolarHBondContact O-N 3.23Å; T368-V370 WeakPolarHBondContact OG1-CG2 3.43Å; T368-I397 HydrophobicContact CG2-CD1 4.24Å
369	T	97.3	Very high	97.1	Very high	96 Å²	96	51 Å²	51	59%	0.589	28%	0.28	S	S	*	.	T	Hydrogen-bonded Turn	trans	60.2	20.2	179.8	68.9	0	0	0	0	114.7	V365 S366 M367 V394	V365-T369 PolarHBondContact O-N 3.26Å; S366-T369 PolarHBondContact O-N 3.28Å; M367-T369 PolarHBondContact O-N 3.33Å; T369-V394 HydrophobicContact CG2-CG2 3.61Å
370	V	98	Very high	97	Very high	76 Å²	76	57.6 Å²	57.6	46%	0.461	31%	0.313	S	S	.	.			trans	-71.9	-49.1	177.7	174	0	0	0	0	110.7	V365 T368 Y372	V365-V370 HydrophobicContact CG1-CB 4.13Å; V365-V370 HydrophobicContact CG1-CG1 4.35Å; V365-V370 PolarHBondContact O-N 2.91Å; T368-V370 PolarHBondContact O-N 3.23Å; T368-V370 WeakPolarHBondContact OG1-CG2 3.43Å; V370-Y372 HydrophobicContact CG1-CD1 4.06Å; V370-Y372 HydrophobicContact CG1-CD2 3.95Å; V370-Y372 HydrophobicContact CG1-CE1 3.74Å; V370-Y372 HydrophobicContact CG1-CE2 3.6Å; V370-Y372 HydrophobicContact CG1-CG 4.16Å; V370-Y372 VanDerWaalsContact CG1-CZ 3.5Å
371	G	96.8	Very high	97	Very high	52 Å²	52	56 Å²	56	54%	0.536	32%	0.316	S	S	.	.			trans	57.7	55.9	170.9	0	0	0	0	0	115.7	V365 G373	V365-G371 VanDerWaalsContact CG1-N 3.29Å; V365-G371 PolarHBondContact O-N 2.95Å; G371-G373 PolarHBondContact O-N 3.38Å; G371-G373 VanDerWaalsContact O-N 3.15Å
372	Y	97.2	Very high	96.9	Very high	153 Å²	153	50.3 Å²	50.3	60%	0.6	30%	0.295	S	S	*	.			trans	-56.7	-29.2	178.8	-70	-59.2	0	0	0	114.3	W361 V365 V370 D374	W361-Y372 HydrophobicContact CH2-CD2 4Å; W361-Y372 AromaticContact CH2-CE2 3.59Å; W361-Y372 HydrophobicContact CH2-CE2 3.59Å; W361-Y372 AromaticContact CZ2-CD2 3.52Å; W361-Y372 HydrophobicContact CZ2-CD2 3.52Å; W361-Y372 AromaticContact CZ2-CE2 3.62Å; W361-Y372 HydrophobicContact CZ2-CE2 3.62Å; V365-Y372 HydrophobicContact CG1-CD2 3.8Å; V365-Y372 HydrophobicContact CG1-CG 4.4Å; V365-Y372 HydrophobicContact CG2-CD2 3.81Å; V365-Y372 HydrophobicContact CG2-CE2 4.04Å; V370-Y372 HydrophobicContact CG1-CD1 4.06Å; V370-Y372 HydrophobicContact CG1-CD2 3.95Å; V370-Y372 HydrophobicContact CG1-CE1 3.74Å; V370-Y372 HydrophobicContact CG1-CE2 3.6Å; V370-Y372 HydrophobicContact CG1-CG 4.16Å; V370-Y372 VanDerWaalsContact CG1-CZ 3.5Å; Y372-D374 VanDerWaalsContact C-N 3.33Å; Y372-D374 WeakPolarHBondContact CB-OD1 3.23Å
373	G	95	Very high	96.9	Very high	47 Å²	47	55.2 Å²	55.2	49%	0.485	32%	0.316	S	S	.	.	S	Bend	trans	81.6	8.7	178.4	0	0	0	0	0	114.6	G371	G371-G373 PolarHBondContact O-N 3.38Å; G371-G373 VanDerWaalsContact O-N 3.15Å
374	D	96.1	Very high	96.9	Very high	79 Å²	79	60 Å²	60	42%	0.422	34%	0.34	S	S	.	.	S	Bend	trans	-73.9	-26.9	173.6	61.3	-38.6	0	0	0	113	W361 Y372	W361-D374 PolarHBondContact NE1-OD2 3.38Å; Y372-D374 VanDerWaalsContact C-N 3.33Å; Y372-D374 WeakPolarHBondContact CB-OD1 3.23Å
375	M	96.1	Very high	96.9	Very high	28 Å²	28	58.5 Å²	58.5	14%	0.138	33%	0.332	C	S	.	.	S	Bend	trans	-130	134.7	170.2	-61.9	-178.3	66.5	0	0	109.9	F352 F353 W362	F352-M375 HydrophobicContact CB-CB 4.35Å; F352-M375 HydrophobicContact CB-CE 4.34Å; F352-M375 HydrophobicContact CB-CG 4.25Å; F352-M375 VanDerWaalsContact O-CE 3.3Å; F352-M375 WeakPolarHBondContact O-CE 3.37Å; F353-M375 HydrophobicContact CD1-CE 3.79Å; F353-M375 HydrophobicContact CE1-CE 3.99Å; F353-M375 HydrophobicContact CG-CE 4.48Å; W362-M375 HydrophobicContact CB-CB 4.06Å; W362-M375 HydrophobicContact CB-CE 4.29Å; W362-M375 HydrophobicContact CB-SD 4.28Å; W362-M375 HydrophobicContact CG-CB 4.38Å
376	Y	96.3	Very high	96.9	Very high	118 Å²	118	58.9 Å²	58.9	46%	0.463	34%	0.337	S	S	.	.			trans	-156.9	147.8	176.2	56.2	-88.4	0	0	0	111.6	F352 V378	F352-Y376 HydrophobicContact CD2-CE1 4.47Å; F352-Y376 HydrophobicContact CE2-CD1 4.26Å; F352-Y376 AromaticContact CE2-CE1 3.73Å; F352-Y376 HydrophobicContact CE2-CE1 3.73Å; F352-Y376 HydrophobicContact CE2-CE2 4.08Å; F352-Y376 AromaticContact CE2-CZ 3.63Å; F352-Y376 HydrophobicContact CZ-CE1 4.08Å; Y376-V378 HydrophobicContact CD2-CG1 4.19Å; Y376-V378 HydrophobicContact CE2-CG1 3.86Å
377	P	96.4	Very high	96.8	Very high	14 Å²	14	61.3 Å²	61.3	9%	0.091	35%	0.354	C	S	.	.			trans	-73.4	135.4	175.6	28.6	-32.9	0	0	0	112.1	V341 E345 F353 W362 G382 K383	V341-P377 HydrophobicContact CG2-CB 4.08Å; E345-P377 HydrophobicContact CG-CB 4.24Å; E345-P377 WeakPolarHBondContact OE1-CB 3.49Å; F353-P377 HydrophobicContact CE2-CB 4.23Å; W362-P377 HydrophobicContact CZ2-CG 4.4Å; P377-G382 WeakPolarHBondContact CG-O 3.3Å; P377-K383 HydrophobicContact CG-CG 4.4Å
378	V	95	Very high	96.9	Very high	49 Å²	49	65.9 Å²	65.9	30%	0.297	38%	0.378	S	S	.	.			trans	-96.4	-32.7	177.2	-66.6	0	0	0	0	111.8	E345 E348 Y376 K383	E345-V378 PolarHBondContact OE1-N 3.41Å; E345-V378 WeakPolarHBondContact OE2-CG2 3.29Å; E345-V378 PolarHBondContact OE2-N 3.08Å; E348-V378 HydrophobicContact CB-CG2 4.48Å; E348-V378 HydrophobicContact CG-CG2 3.95Å; Y376-V378 HydrophobicContact CD2-CG1 4.19Å; Y376-V378 HydrophobicContact CE2-CG1 3.86Å; V378-K383 WeakPolarHBondContact O-CE 3.23Å; V378-K383 PolarHBondContact O-NZ 3.24Å
379	T	96.3	Very high	96.9	Very high	29 Å²	29	63.8 Å²	63.8	18%	0.178	37%	0.365	C	S	.	.	S	Bend	trans	-73.6	160	-178.8	78.1	0	0	0	0	111.6	A344 E345 E348 G381 G382 K383	A344-T379 PolarHBondContact O-OG1 3.03Å; E345-T379 WeakPolarHBondContact OE1-CA 3.48Å; E345-T379 WeakPolarHBondContact OE1-CB 3.28Å; E345-T379 VanDerWaalsContact OE1-CG2 3.32Å; E345-T379 WeakPolarHBondContact OE1-CG2 3.45Å; E345-T379 PolarHBondContact OE1-N 2.97Å; E345-T379 PolarHBondContact OE1-OG1 2.74Å; E348-T379 HydrophobicContact CB-CG2 4.15Å; E348-T379 HydrophobicContact CG-CG2 4.19Å; T379-G381 VanDerWaalsContact C-N 3.31Å; T379-G381 PolarHBondContact O-N 2.9Å; T379-G381 PolarHBondContact OG1-N 3.26Å; T379-G382 PolarHBondContact OG1-N 3.09Å; T379-K383 WeakPolarHBondContact O-CB 3.43Å; T379-K383 WeakPolarHBondContact O-CD 3.46Å; T379-K383 VanDerWaalsContact O-CG 3.26Å; T379-K383 WeakPolarHBondContact O-CG 3.48Å; T379-K383 PolarHBondContact O-N 3.44Å
380	I	95.8	Very high	97	Very high	138 Å²	138	61 Å²	61	71%	0.708	35%	0.352	S	S	*	.	H	α-helix	trans	-63.8	-40.8	175.4	-60.4	169	0	0	0	110.3	K383 I384	I380-K383 PolarHBondContact O-N 2.93Å; I380-I384 HydrophobicContact CG2-CD1 4.32Å; I380-I384 WeakPolarHBondContact O-CG1 3.26Å; I380-I384 PolarHBondContact O-N 3.3Å; I380-I384 VanDerWaalsContact O-N 3.09Å
381	G	96.7	Very high	97	Very high	35 Å²	35	62.4 Å²	62.4	36%	0.361	36%	0.356	S	S	.	.	H	α-helix	trans	-62.6	-48.2	178.5	0	0	0	0	0	111.9	T379 K383 I384 V385	T379-G381 VanDerWaalsContact C-N 3.31Å; T379-G381 PolarHBondContact O-N 2.9Å; T379-G381 PolarHBondContact OG1-N 3.26Å; G381-K383 VanDerWaalsContact C-N 3.31Å; G381-K383 PolarHBondContact O-N 3.4Å; G381-I384 PolarHBondContact O-N 2.82Å; G381-V385 WeakPolarHBondContact O-CG2 3.47Å; G381-V385 PolarHBondContact O-N 3.49Å
382	G	96.9	Very high	97	Very high	0 Å²	0	61.1 Å²	61.1	0%	0	34%	0.34	C	S	.	.	H	α-helix	trans	-61.5	-37.6	176.4	0	0	0	0	0	112.7	E345 P377 T379 I384 V385 G386	E345-G382 WeakPolarHBondContact OE1-CA 3.32Å; P377-G382 WeakPolarHBondContact CG-O 3.3Å; T379-G382 PolarHBondContact OG1-N 3.09Å; G382-I384 PolarHBondContact O-N 3.46Å; G382-V385 PolarHBondContact O-N 3.4Å; G382-G386 PolarHBondContact O-N 2.85Å
383	K	97.6	Very high	97	Very high	116 Å²	116	53.8 Å²	53.8	50%	0.504	31%	0.311	S	S	.	.	H	α-helix	trans	-64.7	-37.2	174.9	-74.6	168	-178.6	160.3	0	113.2	P377 V378 T379 I380 G381 G386 S387	P377-K383 HydrophobicContact CG-CG 4.4Å; V378-K383 WeakPolarHBondContact O-CE 3.23Å; V378-K383 PolarHBondContact O-NZ 3.24Å; T379-K383 WeakPolarHBondContact O-CB 3.43Å; T379-K383 WeakPolarHBondContact O-CD 3.46Å; T379-K383 VanDerWaalsContact O-CG 3.26Å; T379-K383 WeakPolarHBondContact O-CG 3.48Å; T379-K383 PolarHBondContact O-N 3.44Å; I380-K383 PolarHBondContact O-N 2.93Å; G381-K383 VanDerWaalsContact C-N 3.31Å; G381-K383 PolarHBondContact O-N 3.4Å; K383-G386 PolarHBondContact O-N 2.86Å; K383-S387 WeakPolarHBondContact O-CB 3.23Å; K383-S387 PolarHBondContact O-N 2.65Å; K383-S387 PolarHBondContact O-OG 3.16Å
384	I	98.2	Very high	97.1	Very high	99 Å²	99	55.2 Å²	55.2	51%	0.508	31%	0.311	S	S	.	.	H	α-helix	trans	-64.7	-46.9	172.4	-66.4	167.6	0	0	0	109.7	I380 G381 G382 G386 S387 L388	I380-I384 HydrophobicContact CG2-CD1 4.32Å; I380-I384 WeakPolarHBondContact O-CG1 3.26Å; I380-I384 PolarHBondContact O-N 3.3Å; I380-I384 VanDerWaalsContact O-N 3.09Å; G381-I384 PolarHBondContact O-N 2.82Å; G382-I384 PolarHBondContact O-N 3.46Å; I384-G386 VanDerWaalsContact C-N 3.33Å; I384-G386 PolarHBondContact O-N 3.49Å; I384-S387 WeakPolarHBondContact O-CB 3.45Å; I384-S387 PolarHBondContact O-N 3.14Å; I384-L388 HydrophobicContact CG2-CD1 4.24Å; I384-L388 WeakPolarHBondContact O-CG 3.43Å; I384-L388 PolarHBondContact O-N 3.21Å
385	V	98.3	Very high	97.1	Very high	23 Å²	23	56.5 Å²	56.5	14%	0.139	32%	0.317	C	S	.	.	H	α-helix	trans	-58.4	-45.5	176.3	175.3	0	0	0	0	111	F337 A340 V341 W362 G381 G382 S387 L388 C389	F337-V385 HydrophobicContact CD1-CG1 4.15Å; A340-V385 HydrophobicContact CB-CG1 3.82Å; A340-V385 HydrophobicContact CB-CG2 4.09Å; V341-V385 HydrophobicContact CB-CG1 4.05Å; W362-V385 HydrophobicContact CH2-CG1 4.4Å; G381-V385 WeakPolarHBondContact O-CG2 3.47Å; G381-V385 PolarHBondContact O-N 3.49Å; G382-V385 PolarHBondContact O-N 3.4Å; V385-S387 VanDerWaalsContact C-N 3.34Å; V385-S387 PolarHBondContact O-N 2.89Å; V385-L388 PolarHBondContact O-N 3.44Å; V385-C389 VanDerWaalsContact O-CB 3.23Å; V385-C389 WeakPolarHBondContact O-CB 3.45Å; V385-C389 PolarHBondContact O-N 3.4Å
386	G	97.8	Very high	97	Very high	15 Å²	15	56.4 Å²	56.4	16%	0.155	32%	0.318	C	S	.	.	H	α-helix	trans	-61.1	-40.7	177.1	0	0	0	0	0	112.9	G382 K383 I384 C389 A390	G382-G386 PolarHBondContact O-N 2.85Å; K383-G386 PolarHBondContact O-N 2.86Å; I384-G386 VanDerWaalsContact C-N 3.33Å; I384-G386 PolarHBondContact O-N 3.49Å; G386-C389 WeakPolarHBondContact O-CB 3.37Å; G386-C389 PolarHBondContact O-N 3.16Å; G386-A390 PolarHBondContact O-N 3.04Å
387	S	97.9	Very high	96.9	Very high	74 Å²	74	53.5 Å²	53.5	52%	0.517	31%	0.31	S	S	.	.	H	α-helix	trans	-63.5	-45.5	176.3	-59.1	0	0	0	0	111.8	K383 I384 V385 A390 I391	K383-S387 WeakPolarHBondContact O-CB 3.23Å; K383-S387 PolarHBondContact O-N 2.65Å; K383-S387 PolarHBondContact O-OG 3.16Å; I384-S387 WeakPolarHBondContact O-CB 3.45Å; I384-S387 PolarHBondContact O-N 3.14Å; V385-S387 VanDerWaalsContact C-N 3.34Å; V385-S387 PolarHBondContact O-N 2.89Å; S387-A390 PolarHBondContact O-N 3.24Å; S387-I391 WeakPolarHBondContact O-CG1 3.4Å; S387-I391 PolarHBondContact O-N 2.59Å
388	L	98.2	Very high	96.8	Very high	98 Å²	98	55.3 Å²	55.3	51%	0.513	33%	0.326	S	S	.	.	H	α-helix	trans	-65.8	-38.8	175.5	-67.1	175.1	0	0	0	112	F337 I384 V385 I391 A392	F337-L388 HydrophobicContact CE1-CB 4.11Å; I384-L388 HydrophobicContact CG2-CD1 4.24Å; I384-L388 WeakPolarHBondContact O-CG 3.43Å; I384-L388 PolarHBondContact O-N 3.21Å; V385-L388 PolarHBondContact O-N 3.44Å; L388-I391 PolarHBondContact O-N 2.93Å; L388-A392 VanDerWaalsContact O-CB 3.23Å; L388-A392 WeakPolarHBondContact O-CB 3.46Å; L388-A392 PolarHBondContact O-N 3.49Å
389	C	98.3	Very high	96.6	Very high	0 Å²	0	59.1 Å²	59.1	0%	0	34%	0.344	C	S	.	.	H	α-helix	trans	-60.5	-45.4	177.1	-177.2	0	0	0	0	111.7	F337 W362 M367 V385 G386 A392 G393	F337-C389 HydrophobicContact CB-CB 4.1Å; F337-C389 HydrophobicContact CD1-CB 3.69Å; F337-C389 HydrophobicContact CD2-CB 4.07Å; F337-C389 HydrophobicContact CE1-CB 4.11Å; F337-C389 HydrophobicContact CE2-CB 4.47Å; F337-C389 HydrophobicContact CG-CB 3.68Å; F337-C389 HydrophobicContact CZ-CB 4.49Å; W362-C389 HydrophobicContact CH2-CB 4.18Å; M367-C389 VanDerWaalsContact CG-SG 3.55Å; V385-C389 VanDerWaalsContact O-CB 3.23Å; V385-C389 WeakPolarHBondContact O-CB 3.45Å; V385-C389 PolarHBondContact O-N 3.4Å; G386-C389 WeakPolarHBondContact O-CB 3.37Å; G386-C389 PolarHBondContact O-N 3.16Å; C389-A392 PolarHBondContact O-N 3.03Å; C389-G393 PolarHBondContact O-N 3.21Å
390	A	97.9	Very high	96.3	Very high	39 Å²	39	58.3 Å²	58.3	32%	0.322	34%	0.339	S	S	.	.	H	α-helix	trans	-63.1	-46.8	178.2	0	0	0	0	0	111.7	G386 S387 G393 V394	G386-A390 PolarHBondContact O-N 3.04Å; S387-A390 PolarHBondContact O-N 3.24Å; A390-G393 PolarHBondContact O-N 2.99Å; A390-V394 WeakPolarHBondContact O-CG2 3.39Å; A390-V394 PolarHBondContact O-N 2.87Å; A390-V394 VanDerWaalsContact O-N 3.13Å
391	I	97.8	Very high	96.3	Very high	104 Å²	104	54.4 Å²	54.4	53%	0.533	32%	0.322	S	S	.	.	H	α-helix	trans	-61.7	-47.9	177.7	-64.9	167.5	0	0	0	110.5	S387 L388 G393 V394 L395	S387-I391 WeakPolarHBondContact O-CG1 3.4Å; S387-I391 PolarHBondContact O-N 2.59Å; L388-I391 PolarHBondContact O-N 2.93Å; I391-G393 VanDerWaalsContact C-N 3.31Å; I391-G393 PolarHBondContact O-N 2.9Å; I391-V394 PolarHBondContact O-N 3.43Å; I391-L395 HydrophobicContact CG2-CD1 4.04Å; I391-L395 WeakPolarHBondContact O-CG 3.23Å; I391-L395 PolarHBondContact O-N 2.74Å; I391-L395 VanDerWaalsContact O-N 3.1Å
392	A	97.7	Very high	96.2	Very high	25 Å²	25	56.5 Å²	56.5	21%	0.207	33%	0.329	C	S	.	.	H	α-helix	trans	-63	-37.3	179.2	0	0	0	0	0	112.3	F337 L388 C389 L395 T396	F337-A392 HydrophobicContact CE2-CB 3.55Å; F337-A392 HydrophobicContact CZ-CB 3.51Å; L388-A392 VanDerWaalsContact O-CB 3.23Å; L388-A392 WeakPolarHBondContact O-CB 3.46Å; L388-A392 PolarHBondContact O-N 3.49Å; C389-A392 PolarHBondContact O-N 3.03Å; A392-L395 PolarHBondContact O-N 3.3Å; A392-T396 VanDerWaalsContact O-CB 3.27Å; A392-T396 WeakPolarHBondContact O-CB 3.46Å; A392-T396 PolarHBondContact O-N 3.26Å; A392-T396 PolarHBondContact O-OG1 3.45Å
393	G	97.1	Very high	96.1	Very high	0 Å²	0	59.6 Å²	59.6	0%	0	35%	0.347	C	S	.	.	H	α-helix	trans	-61.2	-50.1	175.8	0	0	0	0	0	112.9	M367 C389 A390 I391 L395 T396 I397	M367-G393 CarbonylContact O-C 3.57Å; M367-G393 VanDerWaalsContact O-CA 3.28Å; M367-G393 WeakPolarHBondContact O-CA 3.32Å; C389-G393 PolarHBondContact O-N 3.21Å; A390-G393 PolarHBondContact O-N 2.99Å; I391-G393 VanDerWaalsContact C-N 3.31Å; I391-G393 PolarHBondContact O-N 2.9Å; G393-L395 VanDerWaalsContact C-N 3.34Å; G393-L395 PolarHBondContact O-N 2.9Å; G393-T396 PolarHBondContact O-N 2.96Å; G393-I397 WeakPolarHBondContact O-CG1 3.49Å; G393-I397 PolarHBondContact O-N 3.29Å
394	V	96.8	Very high	95.9	Very high	77 Å²	77	55.5 Å²	55.5	47%	0.467	33%	0.331	S	S	.	.	H	α-helix	trans	-57.8	-47.5	176.2	173.6	0	0	0	0	111	T369 A390 I391 T396 I397 A398	T369-V394 HydrophobicContact CG2-CG2 3.61Å; A390-V394 WeakPolarHBondContact O-CG2 3.39Å; A390-V394 PolarHBondContact O-N 2.87Å; A390-V394 VanDerWaalsContact O-N 3.13Å; I391-V394 PolarHBondContact O-N 3.43Å; V394-T396 PolarHBondContact O-N 3.42Å; V394-I397 PolarHBondContact O-N 3.49Å; V394-A398 WeakPolarHBondContact O-CB 3.48Å; V394-A398 PolarHBondContact O-N 2.92Å
395	L	95.7	Very high	95.8	Very high	106 Å²	106	54.9 Å²	54.9	56%	0.555	33%	0.331	S	S	*	.	H	α-helix	trans	-62.9	-41.7	178.1	-67.8	173.5	0	0	0	112	I391 A392 G393 I397 A398 L399	I391-L395 HydrophobicContact CG2-CD1 4.04Å; I391-L395 WeakPolarHBondContact O-CG 3.23Å; I391-L395 PolarHBondContact O-N 2.74Å; I391-L395 VanDerWaalsContact O-N 3.1Å; A392-L395 PolarHBondContact O-N 3.3Å; G393-L395 VanDerWaalsContact C-N 3.34Å; G393-L395 PolarHBondContact O-N 2.9Å; L395-I397 PolarHBondContact O-N 3.3Å; L395-A398 PolarHBondContact O-N 2.98Å; L395-L399 WeakPolarHBondContact O-CG 3.35Å; L395-L399 PolarHBondContact O-N 3.44Å
396	T	95.1	Very high	95.6	Very high	25 Å²	25	57.4 Å²	57.4	15%	0.153	35%	0.35	C	S	.	.	H	α-helix	trans	-62.8	-42.1	179.9	-61.9	0	0	0	0	111.8	F329 A392 G393 V394 P400	F329-T396 HydrophobicContact CB-CG2 3.57Å; A392-T396 VanDerWaalsContact O-CB 3.27Å; A392-T396 WeakPolarHBondContact O-CB 3.46Å; A392-T396 PolarHBondContact O-N 3.26Å; A392-T396 PolarHBondContact O-OG1 3.45Å; G393-T396 PolarHBondContact O-N 2.96Å; V394-T396 PolarHBondContact O-N 3.42Å; T396-P400 WeakPolarHBondContact O-CD 3.26Å
397	I	94.3	Very high	95.3	Very high	58 Å²	58	58.7 Å²	58.7	30%	0.297	35%	0.353	S	S	.	.	H	α-helix	trans	-73.6	-37.4	178.3	-65	171.4	0	0	0	110.8	L326 T368 G393 V394 L395 L399 P400 V401	L326-I397 HydrophobicContact CD1-CG1 4.38Å; T368-I397 HydrophobicContact CG2-CD1 4.24Å; G393-I397 WeakPolarHBondContact O-CG1 3.49Å; G393-I397 PolarHBondContact O-N 3.29Å; V394-I397 PolarHBondContact O-N 3.49Å; L395-I397 PolarHBondContact O-N 3.3Å; I397-L399 VanDerWaalsContact C-N 3.28Å; I397-L399 PolarHBondContact O-N 3.16Å; I397-P400 WeakPolarHBondContact O-CD 3.34Å; I397-V401 HydrophobicContact CG2-CG2 4Å; I397-V401 WeakPolarHBondContact O-CG2 3.5Å
398	A	94.4	Very high	95.1	Very high	52 Å²	52	58.9 Å²	58.9	43%	0.43	35%	0.345	S	S	.	.	H	α-helix	trans	-66.6	-23.2	-176.5	0	0	0	0	0	114.4	V394 L395 P402	V394-A398 WeakPolarHBondContact O-CB 3.48Å; V394-A398 PolarHBondContact O-N 2.92Å; L395-A398 PolarHBondContact O-N 2.98Å; A398-P402 WeakPolarHBondContact O-CD 3.42Å; A398-P402 VanDerWaalsContact O-CG 3.3Å; A398-P402 WeakPolarHBondContact O-CG 3.15Å
399	L	89.4	Confident	94.8	Very high	129 Å²	129	58.2 Å²	58.2	68%	0.675	34%	0.342	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.2	-49.4	-176.1	-65.7	169.4	0	0	0	113.8	L395 I397	L395-L399 WeakPolarHBondContact O-CG 3.35Å; L395-L399 PolarHBondContact O-N 3.44Å; I397-L399 VanDerWaalsContact C-N 3.28Å; I397-L399 PolarHBondContact O-N 3.16Å
400	P	91.6	Very high	94.3	Very high	12 Å²	12	63 Å²	63	8%	0.078	36%	0.36	C	S	.	.	T	Hydrogen-bonded Turn	trans	-83.3	-26.7	-175.9	-16.7	35.6	0	0	0	113.4	L326 T396 I397 V403 I404	L326-P400 HydrophobicContact CB-CB 4.1Å; L326-P400 HydrophobicContact CB-CG 3.89Å; L326-P400 HydrophobicContact CD1-CG 4.07Å; T396-P400 WeakPolarHBondContact O-CD 3.26Å; I397-P400 WeakPolarHBondContact O-CD 3.34Å; P400-V403 PolarHBondContact O-N 3.46Å; P400-I404 PolarHBondContact O-N 2.8Å
401	V	94.4	Very high	93.9	Very high	56 Å²	56	62.5 Å²	62.5	34%	0.339	35%	0.351	S	S	.	.	H	α-helix	trans	-59.2	-45.5	-175	169.3	0	0	0	0	113.1	I397 V403 I404 V405	I397-V401 HydrophobicContact CG2-CG2 4Å; I397-V401 WeakPolarHBondContact O-CG2 3.5Å; V401-V403 PolarHBondContact O-N 2.86Å; V401-I404 PolarHBondContact O-N 3.49Å; V401-I404 VanDerWaalsContact O-N 3.11Å; V401-V405 HydrophobicContact CG1-CG2 3.97Å; V401-V405 WeakPolarHBondContact O-CG2 3.34Å; V401-V405 PolarHBondContact O-N 3.01Å
402	P	95.4	Very high	93.5	Very high	78 Å²	78	62.7 Å²	62.7	51%	0.506	35%	0.346	S	S	.	.	H	α-helix	trans	-57.2	-34.6	177.8	-27.9	35.9	0	0	0	113.8	A398 V405 S406	A398-P402 WeakPolarHBondContact O-CD 3.42Å; A398-P402 VanDerWaalsContact O-CG 3.3Å; A398-P402 WeakPolarHBondContact O-CG 3.15Å; P402-V405 PolarHBondContact O-N 2.7Å; P402-S406 WeakPolarHBondContact O-CB 3.45Å; P402-S406 PolarHBondContact O-N 3.47Å
403	V	93.9	Very high	92.8	Very high	65 Å²	65	64.9 Å²	64.9	39%	0.394	35%	0.352	S	S	.	.	H	α-helix	trans	-70.1	-43.6	177.4	-174.3	0	0	0	0	110.7	E322 P400 V401 V405 S406 N407	E322-V403 HydrophobicContact CG-CB 4.11Å; E322-V403 HydrophobicContact CG-CG1 3.73Å; P400-V403 PolarHBondContact O-N 3.46Å; V401-V403 PolarHBondContact O-N 2.86Å; V403-V405 VanDerWaalsContact C-N 3.32Å; V403-V405 PolarHBondContact O-N 3.3Å; V403-S406 PolarHBondContact O-N 3.37Å; V403-N407 PolarHBondContact O-N 3.14Å
404	I	94.4	Very high	92.1	Very high	31 Å²	31	68.8 Å²	68.8	16%	0.159	37%	0.367	C	S	.	.	H	α-helix	trans	-61.2	-43.1	175	-60.2	170.9	0	0	0	110.3	T315 E322 P400 V401 N407 F408	T315-I404 HydrophobicContact CG2-CG2 4.16Å; T315-I404 WeakPolarHBondContact CG2-O 3.5Å; E322-I404 HydrophobicContact CB-CG1 4.29Å; P400-I404 PolarHBondContact O-N 2.8Å; V401-I404 PolarHBondContact O-N 3.49Å; V401-I404 VanDerWaalsContact O-N 3.11Å; I404-N407 PolarHBondContact O-N 2.87Å; I404-F408 PolarHBondContact O-N 3.34Å
405	V	95.8	Very high	91.2	Very high	85 Å²	85	67.9 Å²	67.9	52%	0.515	36%	0.357	S	S	.	.	H	α-helix	trans	-64.9	-40.1	176.9	172.5	0	0	0	0	111.3	V401 P402 V403 F408 N409	V401-V405 HydrophobicContact CG1-CG2 3.97Å; V401-V405 WeakPolarHBondContact O-CG2 3.34Å; V401-V405 PolarHBondContact O-N 3.01Å; P402-V405 PolarHBondContact O-N 2.7Å; V403-V405 VanDerWaalsContact C-N 3.32Å; V403-V405 PolarHBondContact O-N 3.3Å; V405-F408 WeakPolarHBondContact O-CB 3.37Å; V405-F408 PolarHBondContact O-N 2.95Å; V405-N409 WeakPolarHBondContact O-CB 3.41Å; V405-N409 PolarHBondContact O-N 3.05Å
406	S	93.2	Very high	90.4	Very high	76 Å²	76	65.7 Å²	65.7	53%	0.531	35%	0.348	S	S	.	.	H	α-helix	trans	-62.4	-42.5	175	-172.5	0	0	0	0	111.5	P402 V403 N409 Y410	P402-S406 WeakPolarHBondContact O-CB 3.45Å; P402-S406 PolarHBondContact O-N 3.47Å; V403-S406 PolarHBondContact O-N 3.37Å; S406-N409 PolarHBondContact O-N 3.14Å; S406-Y410 WeakPolarHBondContact O-CB 3.42Å; S406-Y410 PolarHBondContact O-N 3.42Å
407	N	92.5	Very high	89.2	Confident	42 Å²	42	68.6 Å²	68.6	23%	0.225	36%	0.36	C	S	.	.	H	α-helix	trans	-65.4	-39.8	174.7	-75	-21	0	0	0	111.5	T315 S319 V403 I404 Y410 F411	T315-N407 HydrophobicContact CG2-CB 4.04Å; S319-N407 PolarHBondContact OG-ND2 3.36Å; V403-N407 PolarHBondContact O-N 3.14Å; I404-N407 PolarHBondContact O-N 2.87Å; N407-Y410 PolarHBondContact O-N 3.29Å; N407-F411 WeakPolarHBondContact O-CD2 3.49Å; N407-F411 PolarHBondContact O-N 2.98Å
408	F	93.8	Very high	87.7	Confident	79 Å²	79	66.9 Å²	66.9	35%	0.346	36%	0.357	S	S	.	.	H	α-helix	trans	-60	-49.2	174.7	-179.3	-100.1	0	0	0	111.1	I311 T315 I404 V405 Y410 F411 Y412	I311-F408 HydrophobicContact CG2-CD2 3.97Å; I311-F408 HydrophobicContact CG2-CE2 3.77Å; I311-F408 HydrophobicContact CG2-CZ 4.5Å; T315-F408 HydrophobicContact CG2-CB 3.83Å; T315-F408 WeakPolarHBondContact OG1-CA 3.24Å; I404-F408 PolarHBondContact O-N 3.34Å; V405-F408 WeakPolarHBondContact O-CB 3.37Å; V405-F408 PolarHBondContact O-N 2.95Å; F408-Y410 VanDerWaalsContact C-N 3.34Å; F408-Y410 PolarHBondContact O-N 3.35Å; F408-F411 PolarHBondContact O-N 3.06Å; F408-Y412 HydrophobicContact CE1-CD2 4.49Å; F408-Y412 HydrophobicContact CE1-CG 4.48Å; F408-Y412 HydrophobicContact CZ-CD2 4.33Å; F408-Y412 WeakPolarHBondContact O-CB 3.32Å; F408-Y412 PolarHBondContact O-N 3.11Å
409	N	91.4	Very high	86.2	Confident	83 Å²	83	68.4 Å²	68.4	44%	0.444	36%	0.355	S	S	.	.	H	α-helix	trans	-58.8	-47.1	178	-176.1	-69.4	0	0	0	110.5	V405 S406 F411 Y412 H413	V405-N409 WeakPolarHBondContact O-CB 3.41Å; V405-N409 PolarHBondContact O-N 3.05Å; S406-N409 PolarHBondContact O-N 3.14Å; N409-F411 PolarHBondContact O-N 3.06Å; N409-Y412 PolarHBondContact O-N 3.2Å; N409-H413 PolarHBondContact O-CD2 3.12Å; N409-H413 VanDerWaalsContact O-CD2 3.29Å; N409-H413 PolarHBondContact O-N 3Å; N409-H413 PolarHBondContact OD1-CD2 3.18Å
410	Y	88.1	Confident	84.9	Confident	100 Å²	100	68.1 Å²	68.1	39%	0.392	35%	0.351	S	S	.	.	H	α-helix	trans	-54.9	-52.7	175.4	173	-99.5	0	0	0	112.7	S406 N407 F408 Y412 R414	S406-Y410 WeakPolarHBondContact O-CB 3.42Å; S406-Y410 PolarHBondContact O-N 3.42Å; N407-Y410 PolarHBondContact O-N 3.29Å; F408-Y410 VanDerWaalsContact C-N 3.34Å; F408-Y410 PolarHBondContact O-N 3.35Å; Y410-Y412 VanDerWaalsContact C-N 3.34Å; Y410-Y412 PolarHBondContact O-N 3.19Å; Y410-R414 WeakPolarHBondContact O-CB 3.36Å; Y410-R414 PolarHBondContact O-N 3.47Å
411	F	88.4	Confident	83.3	Confident	29 Å²	29	70.8 Å²	70.8	13%	0.127	36%	0.362	C	S	.	.	H	α-helix	trans	-69.2	-32.1	-180	-71.6	-61.6	0	0	0	113	I311 Q314 A318 N407 F408 N409 E415	I311-F411 HydrophobicContact CG2-CB 3.92Å; Q314-F411 HydrophobicContact CB-CD2 4.48Å; Q314-F411 HydrophobicContact CB-CG 4.42Å; A318-F411 HydrophobicContact CB-CE2 3.64Å; A318-F411 HydrophobicContact CB-CZ 3.96Å; N407-F411 WeakPolarHBondContact O-CD2 3.49Å; N407-F411 PolarHBondContact O-N 2.98Å; F408-F411 PolarHBondContact O-N 3.06Å; N409-F411 PolarHBondContact O-N 3.06Å; F411-E415 WeakPolarHBondContact O-CB 3.5Å; F411-E415 PolarHBondContact O-N 3.09Å; F411-E415 VanDerWaalsContact O-N 3.07Å
412	Y	89.6	Confident	81.5	Confident	108 Å²	108	69.9 Å²	69.9	42%	0.424	36%	0.36	S	S	.	.	H	α-helix	trans	-67.2	-50.2	177.6	-179.8	-97.6	0	0	0	112	I311 F408 N409 Y410 E415 T416	I311-Y412 HydrophobicContact CD1-CD2 4.09Å; F408-Y412 HydrophobicContact CE1-CD2 4.49Å; F408-Y412 HydrophobicContact CE1-CG 4.48Å; F408-Y412 HydrophobicContact CZ-CD2 4.33Å; F408-Y412 WeakPolarHBondContact O-CB 3.32Å; F408-Y412 PolarHBondContact O-N 3.11Å; N409-Y412 PolarHBondContact O-N 3.2Å; Y410-Y412 VanDerWaalsContact C-N 3.34Å; Y410-Y412 PolarHBondContact O-N 3.19Å; Y412-E415 PolarHBondContact O-N 3.08Å; Y412-T416 WeakPolarHBondContact O-CB 3.34Å; Y412-T416 PolarHBondContact O-N 3.01Å; Y412-T416 PolarHBondContact O-OG1 3.48Å
413	H	84.1	Confident	79.7	Confident	71 Å²	71	72.6 Å²	72.6	33%	0.329	37%	0.366	S	S	.	.	H	α-helix	trans	-65.9	-40.2	176	-80.3	-83.7	0	0	0	111.1	N409 E415 T416 E417	N409-H413 PolarHBondContact O-CD2 3.12Å; N409-H413 VanDerWaalsContact O-CD2 3.29Å; N409-H413 PolarHBondContact O-N 3Å; N409-H413 PolarHBondContact OD1-CD2 3.18Å; H413-E415 VanDerWaalsContact C-N 3.34Å; H413-E415 PolarHBondContact O-N 3.22Å; H413-T416 PolarHBondContact O-N 3.39Å; H413-E417 IonicContact CE1-OE1 2.8Å; H413-E417 IonicContact CG-OE1 2.79Å; H413-E417 IonicContact ND1-OE1 2.88Å; H413-E417 PolarHBondContact ND1-OE1 3.48Å; H413-E417 VanDerWaalsContact O-CB 3.28Å; H413-E417 WeakPolarHBondContact O-CB 3.23Å; H413-E417 PolarHBondContact O-N 3Å
414	R	81.1	Confident	78	Confident	83 Å²	83	75.3 Å²	75.3	31%	0.313	38%	0.378	S	S	.	.	H	α-helix	trans	-58.4	-43.8	176.5	-172.3	-176.9	71.7	149.6	2.4	112.9	Y410 G418	Y410-R414 WeakPolarHBondContact O-CB 3.36Å; Y410-R414 PolarHBondContact O-N 3.47Å; R414-G418 VanDerWaalsContact O-CA 3.28Å; R414-G418 WeakPolarHBondContact O-CA 3.42Å; R414-G418 PolarHBondContact O-N 3.01Å
415	E	79.1	Confident	76	Confident	58 Å²	58	76.1 Å²	76.1	27%	0.271	38%	0.382	S	S	.	.	H	α-helix	trans	-72.5	-31.7	178.9	-165.1	74.6	-166.9	0	0	112	I311 F411 Y412 H413 E419	I311-E415 HydrophobicContact CD1-CB 4.08Å; I311-E415 HydrophobicContact CD1-CG 4.25Å; I311-E415 HydrophobicContact CG1-CB 4.34Å; I311-E415 HydrophobicContact CG1-CG 4.49Å; F411-E415 WeakPolarHBondContact O-CB 3.5Å; F411-E415 PolarHBondContact O-N 3.09Å; F411-E415 VanDerWaalsContact O-N 3.07Å; Y412-E415 PolarHBondContact O-N 3.08Å; H413-E415 VanDerWaalsContact C-N 3.34Å; H413-E415 PolarHBondContact O-N 3.22Å; E415-E419 WeakPolarHBondContact O-CG 3.45Å
416	T	78.3	Confident	74	Confident	60 Å²	60	77 Å²	77	37%	0.368	38%	0.384	S	S	.	.	H	α-helix	trans	-81.7	-48.6	-177.7	-49.5	0	0	0	0	111.8	Y412 H413	Y412-T416 WeakPolarHBondContact O-CB 3.34Å; Y412-T416 PolarHBondContact O-N 3.01Å; Y412-T416 PolarHBondContact O-OG1 3.48Å; H413-T416 PolarHBondContact O-N 3.39Å
417	E	69.9	Low	72	Confident	85 Å²	85	77.5 Å²	77.5	40%	0.397	38%	0.384	S	S	.	.	H	α-helix	trans	-82.8	-28.4	-177.5	-62.4	174.6	-169.8	0	0	112.4	H413 E419 E420 Q421	H413-E417 IonicContact CE1-OE1 2.8Å; H413-E417 IonicContact CG-OE1 2.79Å; H413-E417 IonicContact ND1-OE1 2.88Å; H413-E417 PolarHBondContact ND1-OE1 3.48Å; H413-E417 VanDerWaalsContact O-CB 3.28Å; H413-E417 WeakPolarHBondContact O-CB 3.23Å; H413-E417 PolarHBondContact O-N 3Å; E417-E419 VanDerWaalsContact C-N 3.26Å; E417-E419 PolarHBondContact O-N 3.48Å; E417-E420 PolarHBondContact O-N 3.26Å; E417-Q421 PolarHBondContact O-N 3.24Å
418	G	63.3	Low	69.8	Low	23 Å²	23	77.9 Å²	77.9	24%	0.237	39%	0.39	C	S	.	.	H	α-helix	trans	-60.4	-36.9	174.4	0	0	0	0	0	112.2	R414 A422	R414-G418 VanDerWaalsContact O-CA 3.28Å; R414-G418 WeakPolarHBondContact O-CA 3.42Å; R414-G418 PolarHBondContact O-N 3.01Å; G418-A422 WeakPolarHBondContact O-CB 3.38Å; G418-A422 PolarHBondContact O-N 3.23Å
419	E	62	Low	67.2	Low	83 Å²	83	77.8 Å²	77.8	39%	0.388	39%	0.393	S	S	.	.	H	α-helix	trans	-65.7	-39	174.8	-71.7	-174.7	155.8	0	0	112.1	K307 E415 E417 Q423	K307-E419 IonicContact NZ-OE1 4Å; K307-E419 PolarHBondContact NZ-OE1 3.29Å; K307-E419 IonicContact NZ-OE2 3.19Å; K307-E419 PolarHBondContact NZ-OE2 2.96Å; E415-E419 WeakPolarHBondContact O-CG 3.45Å; E417-E419 VanDerWaalsContact C-N 3.26Å; E417-E419 PolarHBondContact O-N 3.48Å; E419-Q423 VanDerWaalsContact O-CG 3.23Å; E419-Q423 WeakPolarHBondContact O-CG 3.24Å; E419-Q423 PolarHBondContact O-N 3.42Å
420	E	61.7	Low	64.8	Low	124 Å²	124	80.7 Å²	80.7	58%	0.579	40%	0.404	S	S	*	.	H	α-helix	trans	-72.1	-45.2	178.6	-64.2	-176.2	164.6	0	0	111.9	E417 Q423 L424	E417-E420 PolarHBondContact O-N 3.26Å; E420-Q423 WeakPolarHBondContact O-CB 3.32Å; E420-Q423 PolarHBondContact O-N 3.31Å; E420-L424 WeakPolarHBondContact O-CG 3.2Å; E420-L424 PolarHBondContact O-N 3.23Å; E420-L424 VanDerWaalsContact O-N 3.08Å
421	Q	59	Low	62.6	Low	67 Å²	67	81 Å²	81	31%	0.313	41%	0.413	S	S	.	.	H	α-helix	trans	-72.1	-35.4	-179.4	-71.2	-178.6	1.6	0	0	112.7	F133 E417 Q423 L424 L425	F133-Q421 VanDerWaalsContact CZ-OE1 3.22Å; E417-Q421 PolarHBondContact O-N 3.24Å; Q421-Q423 VanDerWaalsContact C-N 3.29Å; Q421-Q423 PolarHBondContact O-N 3.37Å; Q421-L424 PolarHBondContact O-N 3.06Å; Q421-L425 WeakPolarHBondContact O-CB 3.4Å; Q421-L425 WeakPolarHBondContact O-CG 3.42Å; Q421-L425 PolarHBondContact O-N 3.22Å
422	A	57.1	Low	60.5	Low	37 Å²	37	85.8 Å²	85.8	31%	0.306	44%	0.439	S	S	.	.	H	α-helix	trans	-63.1	-37.2	172.4	0	0	0	0	0	111.6	G418 N426	G418-A422 WeakPolarHBondContact O-CB 3.38Å; G418-A422 PolarHBondContact O-N 3.23Å; A422-N426 VanDerWaalsContact O-CB 3.27Å; A422-N426 WeakPolarHBondContact O-CB 3.48Å; A422-N426 VanDerWaalsContact O-CG 3.23Å; A422-N426 PolarHBondContact O-N 3.3Å; A422-N426 PolarHBondContact O-ND2 2.87Å
423	Q	56.8	Low	58	Low	135 Å²	135	87.7 Å²	87.7	63%	0.631	46%	0.456	S	S	*	.	H	α-helix	trans	-64.1	-46	173.3	-74.6	173.2	20.1	0	0	111.5	E419 E420 Q421 N426 V427	E419-Q423 VanDerWaalsContact O-CG 3.23Å; E419-Q423 WeakPolarHBondContact O-CG 3.24Å; E419-Q423 PolarHBondContact O-N 3.42Å; E420-Q423 WeakPolarHBondContact O-CB 3.32Å; E420-Q423 PolarHBondContact O-N 3.31Å; Q421-Q423 VanDerWaalsContact C-N 3.29Å; Q421-Q423 PolarHBondContact O-N 3.37Å; Q423-N426 PolarHBondContact O-N 2.66Å; Q423-V427 VanDerWaalsContact O-CG2 3.3Å; Q423-V427 WeakPolarHBondContact O-CG2 3.48Å; Q423-V427 PolarHBondContact O-N 2.86Å; Q423-V427 VanDerWaalsContact O-N 3.07Å
424	L	57.6	Low	55.6	Low	122 Å²	122	87.6 Å²	87.6	64%	0.639	46%	0.464	S	S	*	.	H	α-helix	trans	-62.4	-44	178.2	-69.7	167.9	0	0	0	112.7	E420 Q421 V427 S428	E420-L424 WeakPolarHBondContact O-CG 3.2Å; E420-L424 PolarHBondContact O-N 3.23Å; E420-L424 VanDerWaalsContact O-N 3.08Å; Q421-L424 PolarHBondContact O-N 3.06Å; L424-V427 PolarHBondContact O-N 3.15Å; L424-S428 PolarHBondContact O-N 3.13Å
425	L	54.2	Low	53.4	Low	49 Å²	49	91 Å²	91	26%	0.257	49%	0.488	S	S	.	.	H	α-helix	trans	-69.3	-33.2	178.8	-72.6	169.9	0	0	0	112.9	Q421 N429	Q421-L425 WeakPolarHBondContact O-CB 3.4Å; Q421-L425 WeakPolarHBondContact O-CG 3.42Å; Q421-L425 PolarHBondContact O-N 3.22Å; L425-N429 PolarHBondContact O-N 3.16Å
426	N	52.6	Low	51.5	Low	103 Å²	103	93 Å²	93	55%	0.551	51%	0.509	S	S	*	.	H	α-helix	trans	-72	-35.3	176.1	-78.4	-22.5	0	0	0	112.6	A422 Q423 N429 Q430	A422-N426 VanDerWaalsContact O-CB 3.27Å; A422-N426 WeakPolarHBondContact O-CB 3.48Å; A422-N426 VanDerWaalsContact O-CG 3.23Å; A422-N426 PolarHBondContact O-N 3.3Å; A422-N426 PolarHBondContact O-ND2 2.87Å; Q423-N426 PolarHBondContact O-N 2.66Å; N426-N429 PolarHBondContact O-N 2.88Å; N426-Q430 PolarHBondContact O-N 3.46Å
427	V	50.8	Low	49.4	Very low	86 Å²	86	97.4 Å²	97.4	52%	0.521	53%	0.53	S	S	.	.	H	α-helix	trans	-62.9	-45.8	172.5	172.8	0	0	0	0	110.3	Q423 L424 N429 Q430 D431	Q423-V427 VanDerWaalsContact O-CG2 3.3Å; Q423-V427 WeakPolarHBondContact O-CG2 3.48Å; Q423-V427 PolarHBondContact O-N 2.86Å; Q423-V427 VanDerWaalsContact O-N 3.07Å; L424-V427 PolarHBondContact O-N 3.15Å; V427-N429 VanDerWaalsContact C-N 3.29Å; V427-N429 PolarHBondContact O-N 3Å; V427-Q430 PolarHBondContact O-N 3.46Å; V427-Q430 VanDerWaalsContact O-N 3.11Å; V427-D431 PolarHBondContact O-N 2.76Å
428	S	45.9	Very low	47.5	Very low	51 Å²	51	98.9 Å²	98.9	36%	0.357	55%	0.549	S	S	.	.	H	α-helix	trans	-62.8	-30.6	178.1	-174.9	0	0	0	0	113.7	L424	L424-S428 PolarHBondContact O-N 3.13Å
429	N	41	Very low	46.2	Very low	77 Å²	77	103.2 Å²	103.2	41%	0.412	58%	0.576	S	S	.	*	H	α-helix	trans	-78.6	-24.6	174.8	-83.5	-20.9	0	0	0	113.7	L425 N426 V427	L425-N429 PolarHBondContact O-N 3.16Å; N426-N429 PolarHBondContact O-N 2.88Å; V427-N429 VanDerWaalsContact C-N 3.29Å; V427-N429 PolarHBondContact O-N 3Å
430	Q	40	Very low	45.1	Very low	144 Å²	144	110.4 Å²	110.4	67%	0.673	60%	0.6	S	S	*	*	H	α-helix	trans	-72.3	-31.2	176.5	-79.8	-174.6	-13.1	0	0	112.5	N426 V427 L432 N433	N426-Q430 PolarHBondContact O-N 3.46Å; V427-Q430 PolarHBondContact O-N 3.46Å; V427-Q430 VanDerWaalsContact O-N 3.11Å; Q430-L432 PolarHBondContact O-N 3.35Å; Q430-N433 PolarHBondContact O-N 3.24Å
431	D	41.6	Very low	43.6	Very low	107 Å²	107	116.5 Å²	116.5	57%	0.572	62%	0.617	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.2	-15.5	177.2	-72	-28.9	0	0	0	113.6	V427 S434	V427-D431 PolarHBondContact O-N 2.76Å; D431-S434 PolarHBondContact O-OG 3.49Å
432	L	45.3	Very low	42.2	Very low	129 Å²	129	118.4 Å²	118.4	68%	0.675	64%	0.638	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83	-20.8	174.6	-79.6	159.3	0	0	0	113.7	Q430	Q430-L432 PolarHBondContact O-N 3.35Å
433	N	35.8	Very low	41.1	Very low	148 Å²	148	122.1 Å²	122.1	79%	0.791	66%	0.662	S	S	*	*	T	Hydrogen-bonded Turn	trans	-95.7	-6.4	-179.1	-85.5	-16.8	0	0	0	113.8	Q430	Q430-N433 PolarHBondContact O-N 3.24Å
434	S	33.8	Very low	39.7	Very low	69 Å²	69	123.3 Å²	123.3	48%	0.483	67%	0.672	S	S	.	*	S	Bend	trans	-97.9	-10.9	-177.2	56.2	0	0	0	0	114.6	D431 S436	D431-S434 PolarHBondContact O-OG 3.49Å; S434-S436 VanDerWaalsContact C-N 3.25Å; S434-S436 PolarHBondContact O-N 3.28Å
435	D	36	Very low	38.4	Very low	154 Å²	154	123.2 Å²	123.2	82%	0.824	68%	0.682	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85	47.6	-175.9	-96.2	-3.3	0	0	0	114.6
436	S	38.3	Very low	37.1	Very low	101 Å²	101	128.4 Å²	128.4	71%	0.706	71%	0.708	S	S	*	*	T	Hydrogen-bonded Turn	trans	-135.4	6.8	166.4	55	0	0	0	0	115.8	S434	S434-S436 VanDerWaalsContact C-N 3.25Å; S434-S436 PolarHBondContact O-N 3.28Å
437	N	35.3	Very low	36	Very low	152 Å²	152	128.3 Å²	128.3	81%	0.813	72%	0.722	S	S	*	*	S	Bend	trans	-167.3	99.1	164.8	-98.2	-33.9	0	0	0	112.1
438	S	29.6	Very low	34.9	Very low	116 Å²	116	129.9 Å²	129.9	81%	0.811	74%	0.737	S	S	*	*				175.7	104.3	129.3	51.3	0	0	0	0	111.9
439	S	36.3	Very low	34	Very low	113 Å²	113	136.6 Å²	136.6	79%	0.79	76%	0.759	S	S	*	*			trans	-67.9	133.2	153.2	54.1	0	0	0	0	109.6
440	R	38.3	Very low	33.5	Very low	235 Å²	235	137.7 Å²	137.7	89%	0.887	77%	0.773	S	S	*	*			trans	82.5	102.2	170.6	-59.2	175.1	168.5	167	-3.1	116.5
441	R	30.3	Very low	32.9	Very low	251 Å²	251	139.5 Å²	139.5	95%	0.947	78%	0.782	S	S	*	*				-161.7	151.1	123.2	-110.4	166.3	179.4	-176.5	-0.6	112.9
442	S	30.1	Very low	32.2	Very low	107 Å²	107	144.4 Å²	144.4	75%	0.748	79%	0.794	S	S	*	*			trans	-60.7	145.1	-167.5	48	0	0	0	0	115.8
443	S	33.7	Very low	31.3	Very low	116 Å²	116	146.2 Å²	146.2	81%	0.811	80%	0.801	S	S	*	*			trans	-50.6	128	168.2	-25.4	0	0	0	0	112.6
444	N	27.8	Very low	30.9	Very low	159 Å²	159	147.6 Å²	147.6	85%	0.85	80%	0.803	S	S	*	*			trans	-143.5	109.6	150.9	-96.4	-13.7	0	0	0	107.8	I446	N444-I446 PolarHBondContact O-N 2.93Å
445	S	28.7	Very low	30.7	Very low	121 Å²	121	151.7 Å²	151.7	85%	0.846	82%	0.817	S	S	*	*			trans	-70.8	118.6	177.2	52.3	0	0	0	0	110.8
446	I	27.8	Very low	30.2	Very low	157 Å²	157	151.4 Å²	151.4	81%	0.805	82%	0.816	S	S	*	*			trans	-105.6	107.3	162.5	-64.2	175.7	0	0	0	106.5	N444 S448	N444-I446 PolarHBondContact O-N 2.93Å; I446-S448 PolarHBondContact O-N 3.37Å
447	A	29	Very low	30	Very low	102 Å²	102	155.8 Å²	155.8	84%	0.843	83%	0.825	S	S	*	*			trans	-76.2	111.8	171.2	0	0	0	0	0	108.7
448	S	27.7	Very low	29.7	Very low	118 Å²	118	151.5 Å²	151.5	83%	0.825	82%	0.817	S	S	*	*			trans	-89.6	125.9	166.7	-105.4	0	0	0	0	109.5	I446	I446-S448 PolarHBondContact O-N 3.37Å
449	K	28.3	Very low	29.7	Very low	192 Å²	192	153.3 Å²	153.3	84%	0.835	82%	0.816	S	S	*	*			trans	-81.2	111.4	-175.5	-161	-176.1	-173.4	-164.8	0	108.3
450	S	29.1	Very low	29.3	Very low	100 Å²	100	154.3 Å²	154.3	70%	0.699	81%	0.812	S	S	*	*			trans	-89.7	115.2	166.2	65.3	0	0	0	0	108.9	Y452	S450-Y452 PolarHBondContact O-N 3.5Å
451	E	27.3	Very low	28.8	Very low	183 Å²	183	149.9 Å²	149.9	86%	0.855	81%	0.806	S	S	*	*			trans	-74.9	106.8	163.8	-99.7	169.9	168.4	0	0	108.2
452	Y	27.6	Very low	28.7	Very low	209 Å²	209	143.7 Å²	143.7	82%	0.82	80%	0.801	S	S	*	*			trans	-92	124	161.6	-115.9	-97.3	0	0	0	107.3	S450	S450-Y452 PolarHBondContact O-N 3.5Å
453	M	26.8	Very low	28.8	Very low	168 Å²	168	145.9 Å²	145.9	83%	0.828	80%	0.803	S	S	*	*			trans	-91.4	97	171.1	-162.1	174.3	71.9	0	0	107.3
454	E	27.5	Very low	28.5	Very low	177 Å²	177	146.8 Å²	146.8	83%	0.827	80%	0.799	S	S	*	*			trans	-72.8	124.8	169	-79.3	-179.3	158.7	0	0	109.3
455	I	28.1	Very low	28.5	Very low	155 Å²	155	146.3 Å²	146.3	80%	0.795	80%	0.796	S	S	*	*			trans	-87.5	101.4	163.9	-61.6	173.9	0	0	0	105.7
456	D	27.1	Very low	28.3	Very low	147 Å²	147	151.1 Å²	151.1	79%	0.786	80%	0.802	S	S	*	*			trans	-89.8	107.7	174.3	-166.3	33.3	0	0	0	109.6	G458	D456-G458 PolarHBondContact O-N 3.11Å
457	E	33.7	Very low	28.3	Very low	193 Å²	193	154.6 Å²	154.6	90%	0.902	81%	0.805	S	S	*	*			trans	-83.8	94.3	161.8	-87.1	-168.4	155.2	0	0	108.6
458	G	28.3	Very low	28.3	Very low	62 Å²	62	157.1 Å²	157.1	64%	0.639	81%	0.805	S	S	*	*			trans	-125.4	111.3	178.4	0	0	0	0	0	112.7	D456	D456-G458 PolarHBondContact O-N 3.11Å
459	I	30.2	Very low	28.2	Very low	155 Å²	155	156 Å²	156	80%	0.795	80%	0.802	S	S	*	*			trans	-74.7	135.1	177.4	-76.4	169	0	0	0	112.1
460	N	28.1	Very low	28.1	Very low	133 Å²	133	154.8 Å²	154.8	71%	0.711	81%	0.805	S	S	*	*			trans	76.9	127.3	151.5	-75.6	-13.6	0	0	0	123.8
461	N	28.7	Very low	28.1	Very low	142 Å²	142	157.6 Å²	157.6	76%	0.759	81%	0.811	S	S	*	*			trans	73.9	103.7	138	-62.7	-14	0	0	0	120.1
462	S	27.1	Very low	28.1	Very low	121 Å²	121	159.7 Å²	159.7	85%	0.846	81%	0.811	S	S	*	*				-177.6	131	115.9	47.3	0	0	0	0	112.6
463	I	31.8	Very low	28.2	Very low	154 Å²	154	156.4 Å²	156.4	79%	0.79	81%	0.813	S	S	*	*			trans	-65.2	126.5	165.6	-71.3	159	0	0	0	109.1
464	D	28.7	Very low	28.1	Very low	135 Å²	135	152.6 Å²	152.6	72%	0.722	81%	0.809	S	S	*	*			trans	159.5	145.3	130.6	-90.8	-34.5	0	0	0	113.1
465	N	27.5	Very low	28.1	Very low	149 Å²	149	151.7 Å²	151.7	80%	0.797	81%	0.809	S	S	*	*			trans	89.8	81.5	162.1	-55.1	-38.8	0	0	0	118.9
466	F	24.4	Very low	28	Very low	221 Å²	221	149.5 Å²	149.5	97%	0.969	81%	0.807	S	S	*	*			trans	-119.5	91.5	148.7	-113.2	-87	0	0	0	110.1
467	R	28.1	Very low	28.1	Very low	231 Å²	231	149.2 Å²	149.2	87%	0.872	81%	0.81	S	S	*	*			trans	-154.1	100.9	158.8	-106.9	-176.1	167.7	161.5	-2.9	106.8
468	D	27.6	Very low	28.1	Very low	155 Å²	155	145.7 Å²	145.7	83%	0.829	80%	0.804	S	S	*	*				172.4	146.6	117	-91.6	-24.9	0	0	0	113.5
469	A	27.3	Very low	28.2	Very low	93 Å²	93	149.9 Å²	149.9	77%	0.769	82%	0.817	S	S	*	*			trans	75.8	77.2	149.3	0	0	0	0	0	119.4
470	N	26	Very low	28.1	Very low	167 Å²	167	149.5 Å²	149.5	89%	0.893	82%	0.816	S	S	*	*			trans	-79.1	121.3	135.7	-101.4	-37.3	0	0	0	109
471	L	28	Very low	28	Very low	159 Å²	159	148.9 Å²	148.9	83%	0.832	81%	0.812	S	S	*	*			trans	-160.5	131.6	158.2	-109.4	155	0	0	0	111
472	R	28.5	Very low	28.1	Very low	228 Å²	228	149.4 Å²	149.4	86%	0.86	81%	0.81	S	S	*	*			trans	88	122.5	176.5	-54.3	179	178.1	-177	-0.3	113
473	T	27.8	Very low	28.2	Very low	140 Å²	140	150.1 Å²	150.1	86%	0.859	80%	0.804	S	S	*	*			cis	-160	137.9	31.6	-26.4	0	0	0	0	109.3
474	A	26.6	Very low	28	Very low	88 Å²	88	149 Å²	149	73%	0.727	81%	0.809	S	S	*	*			trans	-90.1	149	173.3	0	0	0	0	0	111.1
475	N	26.3	Very low	28	Very low	158 Å²	158	149 Å²	149	85%	0.845	81%	0.814	S	S	*	*			trans	-159.3	106.7	141.6	-103.5	-10.1	0	0	0	112.4
476	C	26.2	Very low	28	Very low	109 Å²	109	149.5 Å²	149.5	74%	0.736	82%	0.816	S	S	*	*			trans	49.3	115.8	139.6	-58.5	0	0	0	0	122.4
477	T	29.2	Very low	28.4	Very low	141 Å²	141	148.6 Å²	148.6	87%	0.865	81%	0.812	S	S	*	*				-172.3	152	96.2	25.8	0	0	0	0	111.5
478	P	33.3	Very low	28.6	Very low	118 Å²	118	141 Å²	141	77%	0.766	81%	0.805	S	S	*	*			trans	-105	134.3	-170	36.1	-25.2	0	0	0	112.5
479	V	30	Very low	28.9	Very low	151 Å²	151	143.4 Å²	143.4	92%	0.915	81%	0.809	S	S	*	*			trans	-136.6	137.7	154.5	-176.2	0	0	0	0	109.9
480	L	27.9	Very low	29.1	Very low	146 Å²	146	147.2 Å²	147.2	76%	0.764	82%	0.815	S	S	*	*			trans	-65.3	156.8	-168	-149.5	80	0	0	0	114.8
481	N	27.7	Very low	29.7	Very low	120 Å²	120	146.4 Å²	146.4	64%	0.642	81%	0.81	S	S	*	*			trans	95.3	108.6	148.2	-80	-12.2	0	0	0	121.8
482	Q	29.5	Very low	30.2	Very low	154 Å²	154	144.1 Å²	144.1	72%	0.72	80%	0.803	S	S	*	*				96	117.1	119.8	-86.9	178.5	-30.5	0	0	121.2
483	N	29.6	Very low	30.5	Very low	135 Å²	135	140.1 Å²	140.1	72%	0.722	80%	0.798	S	S	*	*			trans	86.8	86.5	136.8	-63.4	-13.7	0	0	0	118.9
484	C	27	Very low	31	Very low	131 Å²	131	143.9 Å²	143.9	89%	0.885	82%	0.82	S	S	*	*			trans	-61.1	131.7	149.5	-60	0	0	0	0	111.2
485	V	29.4	Very low	31.2	Very low	136 Å²	136	146.7 Å²	146.7	82%	0.824	83%	0.825	S	S	*	*			trans	-119.4	118.5	152.3	175.7	0	0	0	0	108.1
486	N	28.6	Very low	31.4	Very low	158 Å²	158	146.1 Å²	146.1	85%	0.845	82%	0.824	S	S	*	*			trans	-79.5	125.2	178.3	-146.8	-1.5	0	0	0	108.3
487	K	32.2	Very low	31.7	Very low	203 Å²	203	148.1 Å²	148.1	88%	0.883	83%	0.829	S	S	*	*			trans	-111.5	97.5	165.3	-105.1	-175.3	178.1	179.9	0	109
488	G	31.2	Very low	31.9	Very low	71 Å²	71	148.5 Å²	148.5	73%	0.732	83%	0.827	S	S	*	*			trans	-70.7	148.2	168.7	0	0	0	0	0	111.9
489	K	35.5	Very low	31.8	Very low	206 Å²	206	150.4 Å²	150.4	90%	0.896	83%	0.831	S	S	*	*			trans	-37.8	144.1	169	-67.6	170.9	171	178.5	0	114.3
490	L	31.4	Very low	31.9	Very low	172 Å²	172	150.4 Å²	150.4	90%	0.901	83%	0.825	S	S	*	*			trans	-142.1	116.4	138.2	-143	86.5	0	0	0	109.5
491	L	38.3	Very low	32.2	Very low	151 Å²	151	150.7 Å²	150.7	79%	0.791	83%	0.829	S	S	*	*			trans	-84.5	142.3	161.7	-136.5	100.1	0	0	0	106.6
492	T	38.1	Very low	32.6	Very low	110 Å²	110	153.1 Å²	153.1	68%	0.675	84%	0.844	S	S	*	*				164.2	129.7	125.8	41.9	0	0	0	0	111.8
493	D	33.6	Very low	32.8	Very low	145 Å²	145	153 Å²	153	78%	0.775	85%	0.854	S	S	*	*			trans	54.6	102.7	138.8	-53.1	-21.7	0	0	0	120.3
494	V	38.8	Very low	33.1	Very low	218 Å²	218	154.6 Å²	154.6	100%	1.321	87%	0.866	S	S	*	*				-172	0	100.9	159.3	0	0	0	0	108.4

Retrieved 494 of 494 residues in 136.9 ms (Link to these results)

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