A0A087XL99_POEFO Loading...

Potassium voltage-gated channel interacting protein 1

AlphaFold DB , UniProt , Accession A0A087XL99, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 215 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	38	Very low	31.6	Very low	252 Å²	252	148.3 Å²	148.3	100%	1.241	85%	0.846	S	S	*	*				0	104.9	0	-71.6	171.3	173.3	0	0	106
2	G	30.8	Very low	31.7	Very low	75 Å²	75	144.7 Å²	144.7	77%	0.773	84%	0.837	S	S	*	*			trans	-83.5	145	-164.5	0	0	0	0	0	112.9
3	L	30.6	Very low	31.7	Very low	174 Å²	174	148.8 Å²	148.8	91%	0.911	84%	0.839	S	S	*	*			trans	-67.6	131.3	172.7	-98.1	115.8	0	0	0	110.4	M5	L3-M5 PolarHBondContact O-N 2.89Å
4	V	31.6	Very low	31.8	Very low	140 Å²	140	152.5 Å²	152.5	85%	0.848	85%	0.846	S	S	*	*			trans	-76.5	101.6	173.3	-171	0	0	0	0	107.6	G6	V4-G6 PolarHBondContact O-N 2.69Å
5	M	33.8	Very low	31.8	Very low	164 Å²	164	150.8 Å²	150.8	81%	0.808	84%	0.841	S	S	*	*			trans	-62	119	163.6	-79.1	-80.7	-155.4	0	0	108.5	L3 T7	L3-M5 PolarHBondContact O-N 2.89Å; M5-T7 VanDerWaalsContact C-N 3.33Å; M5-T7 PolarHBondContact O-N 3.04Å
6	G	29.2	Very low	31.6	Very low	75 Å²	75	148.2 Å²	148.2	77%	0.773	84%	0.836	S	S	*	*			trans	-67.3	92.2	168.9	0	0	0	0	0	109.8	V4	V4-G6 PolarHBondContact O-N 2.69Å
7	T	31.8	Very low	31.2	Very low	120 Å²	120	152.8 Å²	152.8	74%	0.736	84%	0.839	S	S	*	*			trans	-68.4	124.1	172.4	48.7	0	0	0	0	110	M5 S9	M5-T7 VanDerWaalsContact C-N 3.33Å; M5-T7 PolarHBondContact O-N 3.04Å; T7-S9 PolarHBondContact O-N 2.82Å
8	F	31.4	Very low	31.1	Very low	200 Å²	200	154.3 Å²	154.3	88%	0.877	84%	0.838	S	S	*	*			trans	-54.7	117.1	162.4	-85.9	-99.1	0	0	0	109.4
9	S	28.2	Very low	31.5	Very low	101 Å²	101	155.6 Å²	155.6	71%	0.706	84%	0.835	S	S	*	*			trans	-104.6	99.6	169.4	-162.8	0	0	0	0	108.5	T7 Q11	T7-S9 PolarHBondContact O-N 2.82Å; S9-Q11 PolarHBondContact O-N 2.89Å
10	L	30.5	Very low	31.5	Very low	159 Å²	159	155.4 Å²	155.4	83%	0.832	83%	0.834	S	S	*	*			trans	-75.5	105.2	163.6	-97	96.2	0	0	0	107.9	S12	L10-S12 PolarHBondContact O-N 3Å
11	Q	31.3	Very low	31.8	Very low	171 Å²	171	157.4 Å²	157.4	80%	0.799	84%	0.835	S	S	*	*			trans	-73.7	110.6	167.7	-152.6	89.5	13.6	0	0	108.8	S9 K13	S9-Q11 PolarHBondContact O-N 2.89Å; Q11-K13 PolarHBondContact O-N 2.74Å
12	S	33.3	Very low	31.7	Very low	105 Å²	105	149.5 Å²	149.5	73%	0.734	81%	0.81	S	S	*	*			trans	-50.4	120.7	172.4	44.9	0	0	0	0	113.8	L10	L10-S12 PolarHBondContact O-N 3Å
13	K	31.5	Very low	31.9	Very low	199 Å²	199	152.3 Å²	152.3	87%	0.865	81%	0.807	S	S	*	*			trans	-107.4	115.3	151.2	-87.1	-177	176.2	178.7	0	108.1	Q11 V15	Q11-K13 PolarHBondContact O-N 2.74Å; K13-V15 PolarHBondContact O-N 2.97Å
14	Q	33.9	Very low	32.3	Very low	200 Å²	200	151.6 Å²	151.6	94%	0.935	80%	0.804	S	S	*	*			trans	-63.6	120	172.9	-77.9	177	-38.7	0	0	109.5
15	V	31.3	Very low	32.6	Very low	127 Å²	127	152 Å²	152	77%	0.77	80%	0.802	S	S	*	*			trans	-119.4	123.3	160.9	179.2	0	0	0	0	106.6	K13	K13-V15 PolarHBondContact O-N 2.97Å
16	S	27.8	Very low	32.8	Very low	109 Å²	109	150.5 Å²	150.5	76%	0.762	80%	0.796	S	S	*	*			trans	-65.3	128.1	-175.6	-159.3	0	0	0	0	110.4	H18	S16-H18 PolarHBondContact O-N 3.15Å
17	Y	25	Very low	33.3	Very low	227 Å²	227	156.1 Å²	156.1	89%	0.89	80%	0.802	S	S	*	*			trans	-74.6	101.6	174	-89.3	-94.4	0	0	0	109.7
18	H	29.2	Very low	33.5	Very low	179 Å²	179	157.6 Å²	157.6	83%	0.829	80%	0.803	S	S	*	*			trans	-97.9	123.1	151.8	-103	-75.8	0	0	0	108.7	S16 D20	S16-H18 PolarHBondContact O-N 3.15Å; H18-D20 PolarHBondContact O-N 3.3Å
19	K	39.6	Very low	33.4	Very low	180 Å²	180	153.4 Å²	153.4	78%	0.783	79%	0.793	S	S	*	*			trans	-82.2	107.2	-177.7	-179.5	176.7	-172.5	169.3	0	108.3
20	D	30.4	Very low	33.9	Very low	151 Å²	151	155.4 Å²	155.4	81%	0.807	80%	0.795	S	S	*	*			trans	-132.9	120.9	160.4	-97.2	-37.1	0	0	0	111.2	H18 A22	H18-D20 PolarHBondContact O-N 3.3Å; D20-A22 PolarHBondContact O-N 3.44Å
21	K	38.6	Very low	34.1	Very low	198 Å²	198	153.3 Å²	153.3	86%	0.861	79%	0.789	S	S	*	*	S	Bend	trans	-78.3	85.5	177.3	-73.5	175.6	169.9	176.9	0	108.2
22	A	36.5	Very low	34.5	Very low	85 Å²	85	150.2 Å²	150.2	70%	0.702	78%	0.784	S	S	*	*			trans	-161.1	8.2	171.6	0	0	0	0	0	115.9	D20	D20-A22 PolarHBondContact O-N 3.44Å
23	D	34.5	Very low	34.8	Very low	134 Å²	134	152.5 Å²	152.5	72%	0.717	78%	0.783	S	S	*	*			trans	-109.4	6.5	-173.5	-99.9	-25.6	0	0	0	115.2	D25	D23-D25 PolarHBondContact O-N 3.35Å
24	D	39.6	Very low	35.4	Very low	160 Å²	160	151.6 Å²	151.6	86%	0.856	77%	0.774	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.9	1.7	-179.9	-148	38	0	0	0	113.6
25	D	38.2	Very low	36.1	Very low	148 Å²	148	143.5 Å²	143.5	79%	0.791	74%	0.739	S	S	*	*	T	Hydrogen-bonded Turn	trans	-110	-0.7	-177.7	-97.3	-9.4	0	0	0	114.2	D23	D23-D25 PolarHBondContact O-N 3.35Å
26	L	37.7	Very low	36.9	Very low	132 Å²	132	147.1 Å²	147.1	69%	0.691	75%	0.747	S	S	*	*	S	Bend	trans	-113.6	1.1	-174.4	-150.4	66.9	0	0	0	115.9
27	E	39.2	Very low	38.5	Very low	194 Å²	194	142.4 Å²	142.4	91%	0.907	72%	0.717	S	S	*	*	S	Bend	trans	-105.7	16.8	168.8	-97.6	-163.1	169.1	0	0	113.7
28	M	35.4	Very low	40.6	Very low	151 Å²	151	132.2 Å²	132.2	74%	0.744	68%	0.677	S	S	*	*	S	Bend	trans	-111.9	35.5	177	-158.3	117.6	78.3	0	0	113.2
29	T	30.5	Very low	42.5	Very low	111 Å²	111	127.7 Å²	127.7	68%	0.681	66%	0.659	S	S	*	*			trans	-126.4	9.3	177.2	29.6	0	0	0	0	115.1	V31	T29-V31 VanDerWaalsContact C-N 3.26Å; T29-V31 PolarHBondContact O-N 3.44Å
30	I	37.8	Very low	44.1	Very low	143 Å²	143	124.8 Å²	124.8	73%	0.733	65%	0.649	S	S	*	*	S	Bend	trans	-74.3	94.5	159.1	-48.7	176.4	0	0	0	106.1	C32	I30-C32 PolarHBondContact O-N 2.89Å
31	V	35.6	Very low	46.2	Very low	116 Å²	116	117.8 Å²	117.8	70%	0.703	61%	0.611	S	S	*	*			trans	-9.5	93.2	166.6	-178.4	0	0	0	0	110.4	T29 H33	T29-V31 VanDerWaalsContact C-N 3.26Å; T29-V31 PolarHBondContact O-N 3.44Å; V31-H33 PolarHBondContact O-N 2.89Å
32	C	38.8	Very low	48.1	Very low	105 Å²	105	112 Å²	112	71%	0.709	59%	0.587	S	S	*	*			trans	-66.8	79.4	166.2	-68.6	0	0	0	0	105.9	I30 R34	I30-C32 PolarHBondContact O-N 2.89Å; C32-R34 PolarHBondContact O-N 3.1Å
33	H	39.2	Very low	50.1	Low	154 Å²	154	112.2 Å²	112.2	71%	0.713	59%	0.589	S	S	*	*			trans	-59.5	87.1	140.1	-99.5	-61	0	0	0	104.2	V31 P35	V31-H33 PolarHBondContact O-N 2.89Å; H33-P35 VanDerWaalsContact C-N 3.33Å; H33-P35 WeakPolarHBondContact O-CD 3.38Å
34	R	44.3	Very low	52	Low	180 Å²	180	111.6 Å²	111.6	68%	0.679	58%	0.582	S	S	*	*			trans	-46.9	111.5	150.3	-101.5	-177.7	175.3	-179.4	-3.4	103.1	C32 E36	C32-R34 PolarHBondContact O-N 3.1Å; R34-E36 PolarHBondContact O-N 3.11Å
35	P	48.1	Very low	53.8	Low	30 Å²	30	104.3 Å²	104.3	20%	0.195	54%	0.543	C	S	.	.			trans	-57.8	118.5	161.2	-13.8	32.6	0	0	0	102.7	H33 G37 L38 Y56	H33-P35 VanDerWaalsContact C-N 3.33Å; H33-P35 WeakPolarHBondContact O-CD 3.38Å; P35-G37 PolarHBondContact O-N 3.09Å; P35-L38 HydrophobicContact CB-CG 4.15Å; P35-L38 HydrophobicContact CG-CB 4.44Å; P35-L38 HydrophobicContact CG-CD1 3.63Å; P35-L38 HydrophobicContact CG-CG 3.67Å; P35-L38 PolarHBondContact O-N 2.93Å; P35-Y56 HydrophobicContact CG-CE1 4.44Å; P35-Y56 HydrophobicContact CG-CE2 4.42Å
36	E	49.2	Very low	55.7	Low	202 Å²	202	101.8 Å²	101.8	94%	0.944	53%	0.529	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.7	-3.7	177.6	-73.8	178.2	136	0	0	112	R34	R34-E36 PolarHBondContact O-N 3.11Å
37	G	61.1	Low	57.7	Low	11 Å²	11	96.2 Å²	96.2	11%	0.113	50%	0.499	C	S	.	.	T	Hydrogen-bonded Turn	trans	-106.8	0.3	170.7	0	0	0	0	0	117.4	P35 D39 Q40 L41	P35-G37 PolarHBondContact O-N 3.09Å; G37-D39 PolarHBondContact O-N 3.48Å; G37-Q40 CarbonylContact O-C 3.42Å; G37-Q40 PolarHBondContact O-N 2.89Å; G37-Q40 VanDerWaalsContact O-N 3.11Å; G37-L41 WeakPolarHBondContact O-CB 3.17Å; G37-L41 WeakPolarHBondContact O-CG 3.31Å; G37-L41 PolarHBondContact O-N 3.42Å
38	L	68.2	Low	59.8	Low	12 Å²	12	89.2 Å²	89.2	6%	0.063	47%	0.472	C	S	.	.	H	α-helix	trans	-61.6	-41.6	-177.1	-102.2	174.7	0	0	0	112.9	P35 Q40 E42 L52 Q53	P35-L38 HydrophobicContact CB-CG 4.15Å; P35-L38 HydrophobicContact CG-CB 4.44Å; P35-L38 HydrophobicContact CG-CD1 3.63Å; P35-L38 HydrophobicContact CG-CG 3.67Å; P35-L38 PolarHBondContact O-N 2.93Å; L38-Q40 VanDerWaalsContact C-N 3.29Å; L38-E42 WeakPolarHBondContact O-CB 3.27Å; L38-E42 PolarHBondContact O-N 3.22Å; L38-L52 HydrophobicContact CD2-CB 3.36Å; L38-L52 HydrophobicContact CD2-CD1 4.04Å; L38-L52 HydrophobicContact CD2-CG 4.31Å; L38-Q53 HydrophobicContact CD1-CG 4.13Å
39	D	69.8	Low	61.9	Low	84 Å²	84	85 Å²	85	45%	0.449	45%	0.45	S	S	.	.	H	α-helix	trans	-70.3	-29.8	177.4	-65.2	-40	0	0	0	111.2	G37 A43 K49	G37-D39 PolarHBondContact O-N 3.48Å; D39-A43 PolarHBondContact O-N 3.22Å; D39-K49 WeakPolarHBondContact OD1-CE 3.46Å; D39-K49 IonicContact OD1-NZ 3.64Å; D39-K49 PolarHBondContact OD1-NZ 3.42Å; D39-K49 IonicContact OD2-NZ 3.61Å
40	Q	74.1	Confident	64.3	Low	120 Å²	120	89.5 Å²	89.5	56%	0.561	45%	0.454	S	S	*	.	H	α-helix	trans	-76.1	-39.1	176.6	-162.5	169.3	21.9	0	0	111.5	G37 L38 A43 Q44	G37-Q40 CarbonylContact O-C 3.42Å; G37-Q40 PolarHBondContact O-N 2.89Å; G37-Q40 VanDerWaalsContact O-N 3.11Å; L38-Q40 VanDerWaalsContact C-N 3.29Å; Q40-A43 WeakPolarHBondContact O-CB 3.29Å; Q40-A43 PolarHBondContact O-N 3.43Å; Q40-Q44 WeakPolarHBondContact O-CB 3.25Å; Q40-Q44 VanDerWaalsContact O-CG 3.26Å; Q40-Q44 WeakPolarHBondContact O-CG 3.48Å; Q40-Q44 PolarHBondContact O-N 3.19Å
41	L	74	Confident	66.3	Low	4 Å²	4	85.9 Å²	85.9	2%	0.021	43%	0.434	C	S	.	.	H	α-helix	trans	-68.1	-36.5	173.4	-70.8	172.3	0	0	0	111.4	G37 A43 Q44 T45 L52 F107 E108 V111	G37-L41 WeakPolarHBondContact O-CB 3.17Å; G37-L41 WeakPolarHBondContact O-CG 3.31Å; G37-L41 PolarHBondContact O-N 3.42Å; L41-A43 PolarHBondContact O-N 3.08Å; L41-Q44 PolarHBondContact O-N 2.76Å; L41-T45 WeakPolarHBondContact O-CA 3.42Å; L41-T45 VanDerWaalsContact O-CB 3.25Å; L41-T45 WeakPolarHBondContact O-CB 3.29Å; L41-T45 WeakPolarHBondContact O-CG2 3.37Å; L41-T45 PolarHBondContact O-N 3.27Å; L41-T45 PolarHBondContact O-OG1 3Å; L41-L52 HydrophobicContact CB-CD1 4.01Å; L41-F107 HydrophobicContact CD1-CD1 3.87Å; L41-F107 HydrophobicContact CD1-CE1 3.78Å; L41-E108 HydrophobicContact CD1-CG 4.21Å; L41-E108 HydrophobicContact CD2-CB 4.06Å; L41-E108 HydrophobicContact CD2-CG 4.05Å; L41-V111 HydrophobicContact CD1-CG2 4.03Å; L41-V111 HydrophobicContact CD2-CG2 3.68Å; L41-V111 HydrophobicContact CG-CG2 4.3Å
42	E	79	Confident	68.5	Low	76 Å²	76	80.3 Å²	80.3	36%	0.355	40%	0.401	S	S	.	.	H	α-helix	trans	-62.5	-32.7	171	-178.8	167.9	-136.2	0	0	111.7	L38 T45 K49 L52	L38-E42 WeakPolarHBondContact O-CB 3.27Å; L38-E42 PolarHBondContact O-N 3.22Å; E42-T45 VanDerWaalsContact O-O 3.12Å; E42-K49 WeakPolarHBondContact OE1-CB 3.28Å; E42-K49 PolarHBondContact OE1-N 2.91Å; E42-L52 HydrophobicContact CB-CD1 4Å
43	A	77.1	Confident	70.4	Confident	89 Å²	89	79.5 Å²	79.5	74%	0.736	39%	0.386	S	S	*	.	H	α-helix	trans	-79.9	-25.3	175.7	0	0	0	0	0	113.9	D39 Q40 L41	D39-A43 PolarHBondContact O-N 3.22Å; Q40-A43 WeakPolarHBondContact O-CB 3.29Å; Q40-A43 PolarHBondContact O-N 3.43Å; L41-A43 PolarHBondContact O-N 3.08Å
44	Q	74.8	Confident	72.4	Confident	122 Å²	122	76.9 Å²	76.9	57%	0.57	38%	0.381	S	S	*	.	H	α-helix	trans	-98.9	-17.6	-176.8	-71	174.5	2.4	0	0	113.6	Q40 L41	Q40-Q44 WeakPolarHBondContact O-CB 3.25Å; Q40-Q44 VanDerWaalsContact O-CG 3.26Å; Q40-Q44 WeakPolarHBondContact O-CG 3.48Å; Q40-Q44 PolarHBondContact O-N 3.19Å; L41-Q44 PolarHBondContact O-N 2.76Å
45	T	78.3	Confident	74.1	Confident	7 Å²	7	70.5 Å²	70.5	4%	0.043	36%	0.36	C	S	.	.	S	Bend	trans	-118.5	157.4	-179.2	71.2	0	0	0	0	110.4	L41 E42 F47 V111	L41-T45 WeakPolarHBondContact O-CA 3.42Å; L41-T45 VanDerWaalsContact O-CB 3.25Å; L41-T45 WeakPolarHBondContact O-CB 3.29Å; L41-T45 WeakPolarHBondContact O-CG2 3.37Å; L41-T45 PolarHBondContact O-N 3.27Å; L41-T45 PolarHBondContact O-OG1 3Å; E42-T45 VanDerWaalsContact O-O 3.12Å; T45-F47 PolarHBondContact O-N 3.29Å; T45-F47 VanDerWaalsContact O-N 3.11Å; T45-V111 HydrophobicContact CG2-CB 4.48Å; T45-V111 HydrophobicContact CG2-CG2 4.08Å
46	N	77.1	Confident	75.7	Confident	95 Å²	95	72.2 Å²	72.2	51%	0.508	36%	0.363	S	S	.	.	S	Bend	trans	-81	22	177	-68.7	-40.9	0	0	0	112.3	S115 R119	N46-S115 PolarHBondContact N-OG 3.19Å; N46-R119 HydrophobicContact CB-CB 3.67Å; N46-R119 HydrophobicContact CB-CG 4.33Å; N46-R119 WeakPolarHBondContact O-CD 3.07Å; N46-R119 PolarHBondContact O-NH1 2.98Å
47	F	80.9	Confident	77.2	Confident	14 Å²	14	70.6 Å²	70.6	6%	0.061	35%	0.348	C	S	.	.			trans	-104.7	144.5	-178.7	-67.6	-65.7	0	0	0	112.7	T45 E51 L52 L55 L114 S115 L118	T45-F47 PolarHBondContact O-N 3.29Å; T45-F47 VanDerWaalsContact O-N 3.11Å; F47-E51 HydrophobicContact CB-CB 4.32Å; F47-E51 HydrophobicContact CD1-CB 4.25Å; F47-L52 HydrophobicContact CB-CD1 4.48Å; F47-L52 HydrophobicContact CB-CD2 3.84Å; F47-L52 HydrophobicContact CB-CG 3.8Å; F47-L52 HydrophobicContact CD2-CD2 4.2Å; F47-L52 HydrophobicContact CG-CD2 4.37Å; F47-L55 HydrophobicContact CD2-CD1 4.41Å; F47-L55 HydrophobicContact CE2-CD1 4.35Å; F47-L55 HydrophobicContact CZ-CD1 4.46Å; F47-L114 HydrophobicContact CE2-CB 4.02Å; F47-L114 HydrophobicContact CZ-CB 4.09Å; F47-S115 VanDerWaalsContact CE2-CA 3.5Å; F47-L118 HydrophobicContact CE1-CD1 4.33Å; F47-L118 HydrophobicContact CZ-CB 4.5Å; F47-L118 HydrophobicContact CZ-CD1 4.04Å
48	S	82.3	Confident	78	Confident	48 Å²	48	71.7 Å²	71.7	34%	0.336	36%	0.36	S	S	.	.			trans	-73.8	155	169.8	64.6	0	0	0	0	111.4	R50 E51 L52	S48-R50 PolarHBondContact O-N 3.42Å; S48-R50 VanDerWaalsContact O-N 3.1Å; S48-E51 PolarHBondContact N-OE2 2.95Å; S48-E51 WeakPolarHBondContact O-CB 3.35Å; S48-E51 PolarHBondContact O-N 3.41Å; S48-E51 VanDerWaalsContact OG-CD 3.29Å; S48-E51 VanDerWaalsContact OG-CG 3.28Å; S48-E51 WeakPolarHBondContact OG-CG 3.44Å; S48-E51 PolarHBondContact OG-N 2.92Å; S48-E51 PolarHBondContact OG-OE2 3.11Å; S48-L52 PolarHBondContact O-N 3.23Å
49	K	79.8	Confident	78.5	Confident	63 Å²	63	71.8 Å²	71.8	27%	0.274	36%	0.359	S	S	.	.	H	α-helix	trans	-50.9	-36.5	174.2	-164.8	165.8	-173	160.1	0	114.3	D39 E42 Q53	D39-K49 WeakPolarHBondContact OD1-CE 3.46Å; D39-K49 IonicContact OD1-NZ 3.64Å; D39-K49 PolarHBondContact OD1-NZ 3.42Å; D39-K49 IonicContact OD2-NZ 3.61Å; E42-K49 WeakPolarHBondContact OE1-CB 3.28Å; E42-K49 PolarHBondContact OE1-N 2.91Å; K49-Q53 VanDerWaalsContact O-CG 3.26Å; K49-Q53 WeakPolarHBondContact O-CG 3.14Å; K49-Q53 PolarHBondContact O-N 3.34Å
50	R	80.8	Confident	78.9	Confident	204 Å²	204	71.2 Å²	71.2	77%	0.77	35%	0.353	S	S	*	.	H	α-helix	trans	-67.6	-40.9	177.8	-177	-179.6	-94.6	-163.6	-5.1	111.4	S48 Q53 V54	S48-R50 PolarHBondContact O-N 3.42Å; S48-R50 VanDerWaalsContact O-N 3.1Å; R50-Q53 PolarHBondContact O-N 2.86Å; R50-V54 WeakPolarHBondContact O-CG2 3.25Å; R50-V54 PolarHBondContact O-N 3Å; R50-V54 VanDerWaalsContact O-N 3.17Å
51	E	79.8	Confident	79.2	Confident	67 Å²	67	71.7 Å²	71.7	31%	0.313	36%	0.359	S	S	.	.	H	α-helix	trans	-67.5	-43.8	177	-69.2	166.6	139.6	0	0	111.2	F47 S48 Q53 V54 L55 R119	F47-E51 HydrophobicContact CB-CB 4.32Å; F47-E51 HydrophobicContact CD1-CB 4.25Å; S48-E51 PolarHBondContact N-OE2 2.95Å; S48-E51 WeakPolarHBondContact O-CB 3.35Å; S48-E51 PolarHBondContact O-N 3.41Å; S48-E51 VanDerWaalsContact OG-CD 3.29Å; S48-E51 VanDerWaalsContact OG-CG 3.28Å; S48-E51 WeakPolarHBondContact OG-CG 3.44Å; S48-E51 PolarHBondContact OG-N 2.92Å; S48-E51 PolarHBondContact OG-OE2 3.11Å; E51-Q53 VanDerWaalsContact C-N 3.27Å; E51-Q53 PolarHBondContact O-N 2.69Å; E51-V54 PolarHBondContact O-N 3.47Å; E51-V54 VanDerWaalsContact O-N 3.1Å; E51-L55 WeakPolarHBondContact O-CG 3.32Å; E51-L55 PolarHBondContact O-N 3.35Å; E51-R119 VanDerWaalsContact CD-NH2 3.34Å; E51-R119 IonicContact OE1-CZ 2.74Å; E51-R119 IonicContact OE1-NH1 2.66Å; E51-R119 IonicContact OE1-NH2 3.57Å; E51-R119 PolarHBondContact OE1-NH2 3.25Å; E51-R119 IonicContact OE2-CZ 2.82Å; E51-R119 IonicContact OE2-NH1 3.43Å; E51-R119 PolarHBondContact OE2-NH1 3.06Å; E51-R119 IonicContact OE2-NH2 3.57Å; E51-R119 PolarHBondContact OE2-NH2 3.12Å
52	L	80.9	Confident	79.1	Confident	0 Å²	0	76.4 Å²	76.4	0%	0	38%	0.381	C	S	.	.	H	α-helix	trans	-60	-36.9	175.1	-68.2	172	0	0	0	112	L38 L41 E42 F47 S48 Y56 V111	L38-L52 HydrophobicContact CD2-CB 3.36Å; L38-L52 HydrophobicContact CD2-CD1 4.04Å; L38-L52 HydrophobicContact CD2-CG 4.31Å; L41-L52 HydrophobicContact CB-CD1 4.01Å; E42-L52 HydrophobicContact CB-CD1 4Å; F47-L52 HydrophobicContact CB-CD1 4.48Å; F47-L52 HydrophobicContact CB-CD2 3.84Å; F47-L52 HydrophobicContact CB-CG 3.8Å; F47-L52 HydrophobicContact CD2-CD2 4.2Å; F47-L52 HydrophobicContact CG-CD2 4.37Å; S48-L52 PolarHBondContact O-N 3.23Å; L52-Y56 VanDerWaalsContact O-CB 3.22Å; L52-Y56 WeakPolarHBondContact O-CB 3.38Å; L52-Y56 PolarHBondContact O-N 3.45Å; L52-V111 HydrophobicContact CD2-CB 4.03Å; L52-V111 HydrophobicContact CD2-CG1 3.92Å; L52-V111 HydrophobicContact CD2-CG2 4.31Å
53	Q	79.8	Confident	78.7	Confident	88 Å²	88	73 Å²	73	41%	0.411	37%	0.366	S	S	.	.	H	α-helix	trans	-65.1	-39.9	173.9	-77	173.9	-6.3	0	0	112.9	L38 K49 R50 E51 R57	L38-Q53 HydrophobicContact CD1-CG 4.13Å; K49-Q53 VanDerWaalsContact O-CG 3.26Å; K49-Q53 WeakPolarHBondContact O-CG 3.14Å; K49-Q53 PolarHBondContact O-N 3.34Å; R50-Q53 PolarHBondContact O-N 2.86Å; E51-Q53 VanDerWaalsContact C-N 3.27Å; E51-Q53 PolarHBondContact O-N 2.69Å; Q53-R57 WeakPolarHBondContact O-CG 3.4Å; Q53-R57 PolarHBondContact O-N 3.2Å
54	V	80.9	Confident	78.6	Confident	99 Å²	99	73.6 Å²	73.6	60%	0.6	36%	0.362	S	S	*	.	H	α-helix	trans	-66.6	-46.4	176.6	173.4	0	0	0	0	110.3	R50 E51 Y56 R57 G58	R50-V54 WeakPolarHBondContact O-CG2 3.25Å; R50-V54 PolarHBondContact O-N 3Å; R50-V54 VanDerWaalsContact O-N 3.17Å; E51-V54 PolarHBondContact O-N 3.47Å; E51-V54 VanDerWaalsContact O-N 3.1Å; V54-Y56 VanDerWaalsContact C-N 3.34Å; V54-Y56 PolarHBondContact O-N 3.32Å; V54-R57 PolarHBondContact O-N 3.27Å; V54-G58 PolarHBondContact O-N 2.73Å
55	L	80.7	Confident	78.5	Confident	46 Å²	46	72 Å²	72	24%	0.241	36%	0.364	C	S	.	.	H	α-helix	trans	-60	-43.9	175.5	-70.2	171.9	0	0	0	111.4	F47 E51 R57 G58 F59 F107 V111 L114	F47-L55 HydrophobicContact CD2-CD1 4.41Å; F47-L55 HydrophobicContact CE2-CD1 4.35Å; F47-L55 HydrophobicContact CZ-CD1 4.46Å; E51-L55 WeakPolarHBondContact O-CG 3.32Å; E51-L55 PolarHBondContact O-N 3.35Å; L55-R57 PolarHBondContact O-N 3.03Å; L55-G58 PolarHBondContact O-N 3.13Å; L55-F59 WeakPolarHBondContact O-CB 3.42Å; L55-F59 PolarHBondContact O-N 3Å; L55-F107 HydrophobicContact CB-CE2 4.22Å; L55-F107 HydrophobicContact CB-CZ 4.36Å; L55-V111 HydrophobicContact CD1-CG1 4.29Å; L55-L114 HydrophobicContact CD1-CD1 4.42Å; L55-L114 HydrophobicContact CD2-CD1 4.03Å
56	Y	81.2	Confident	78.3	Confident	65 Å²	65	72.6 Å²	72.6	26%	0.255	37%	0.372	S	S	.	.	H	α-helix	trans	-63.1	-41.6	178.2	-172.1	-103.7	0	0	0	112.3	P35 L52 V54 F59 K60 F107	P35-Y56 HydrophobicContact CG-CE1 4.44Å; P35-Y56 HydrophobicContact CG-CE2 4.42Å; L52-Y56 VanDerWaalsContact O-CB 3.22Å; L52-Y56 WeakPolarHBondContact O-CB 3.38Å; L52-Y56 PolarHBondContact O-N 3.45Å; V54-Y56 VanDerWaalsContact C-N 3.34Å; V54-Y56 PolarHBondContact O-N 3.32Å; Y56-F59 PolarHBondContact O-N 2.99Å; Y56-K60 HydrophobicContact CD1-CG 4.31Å; Y56-K60 HydrophobicContact CE1-CG 3.8Å; Y56-K60 HydrophobicContact CE2-CG 4.35Å; Y56-K60 WeakPolarHBondContact O-CB 3.45Å; Y56-K60 PolarHBondContact O-N 2.79Å; Y56-K60 WeakPolarHBondContact OH-CE 3.33Å; Y56-F107 HydrophobicContact CD2-CB 4.49Å; Y56-F107 AromaticContact CD2-CD1 3.66Å; Y56-F107 HydrophobicContact CD2-CD1 3.66Å; Y56-F107 AromaticContact CD2-CD2 3.82Å; Y56-F107 HydrophobicContact CD2-CD2 3.82Å; Y56-F107 AromaticContact CD2-CE1 3.7Å; Y56-F107 HydrophobicContact CD2-CE1 3.7Å; Y56-F107 AromaticContact CD2-CE2 3.88Å; Y56-F107 HydrophobicContact CD2-CE2 3.88Å; Y56-F107 AromaticContact CD2-CG 3.7Å; Y56-F107 HydrophobicContact CD2-CG 3.7Å; Y56-F107 AromaticContact CD2-CZ 3.81Å; Y56-F107 HydrophobicContact CD2-CZ 3.81Å; Y56-F107 HydrophobicContact CE2-CD1 4.23Å; Y56-F107 HydrophobicContact CE2-CG 4.2Å; Y56-F107 HydrophobicContact CG-CE1 4.38Å; Y56-F107 HydrophobicContact CG-CE2 4.37Å; Y56-F107 HydrophobicContact CG-CZ 4.19Å
57	R	80.1	Confident	78.4	Confident	169 Å²	169	70.6 Å²	70.6	64%	0.638	36%	0.363	S	S	*	.	H	α-helix	trans	-63.3	-44.4	175.2	-76.4	179.1	-177.9	-162	0.9	111.5	Q53 V54 L55 K60 N61	Q53-R57 WeakPolarHBondContact O-CG 3.4Å; Q53-R57 PolarHBondContact O-N 3.2Å; V54-R57 PolarHBondContact O-N 3.27Å; L55-R57 PolarHBondContact O-N 3.03Å; R57-K60 PolarHBondContact O-N 3.19Å; R57-N61 WeakPolarHBondContact O-CB 3.45Å; R57-N61 PolarHBondContact O-N 3.24Å; R57-N61 PolarHBondContact O-ND2 3.17Å
58	G	78.8	Confident	78.6	Confident	34 Å²	34	70.3 Å²	70.3	35%	0.351	36%	0.363	S	S	.	.	H	α-helix	trans	-58.8	-50.6	174.1	0	0	0	0	0	111.7	V54 L55 K60 N61 E62	V54-G58 PolarHBondContact O-N 2.73Å; L55-G58 PolarHBondContact O-N 3.13Å; G58-K60 VanDerWaalsContact C-N 3.34Å; G58-K60 PolarHBondContact O-N 2.93Å; G58-N61 PolarHBondContact O-N 2.77Å; G58-E62 PolarHBondContact O-N 2.82Å
59	F	78.2	Confident	78.7	Confident	13 Å²	13	71 Å²	71	6%	0.057	36%	0.362	C	S	.	.	H	α-helix	trans	-58.8	-42.3	178.6	-169.6	-84.5	0	0	0	112.6	L55 Y56 C63 V68 F107 F110	L55-F59 WeakPolarHBondContact O-CB 3.42Å; L55-F59 PolarHBondContact O-N 3Å; Y56-F59 PolarHBondContact O-N 2.99Å; F59-C63 HydrophobicContact CE1-CB 4.49Å; F59-C63 WeakPolarHBondContact O-CA 3.15Å; F59-C63 WeakPolarHBondContact O-CB 3.4Å; F59-C63 PolarHBondContact O-N 3.1Å; F59-V68 HydrophobicContact CD2-CG2 4.08Å; F59-V68 HydrophobicContact CE1-CG2 4.27Å; F59-V68 HydrophobicContact CE2-CB 4.42Å; F59-V68 HydrophobicContact CE2-CG2 3.28Å; F59-V68 HydrophobicContact CZ-CB 4.34Å; F59-V68 HydrophobicContact CZ-CG2 3.4Å; F59-F107 HydrophobicContact CB-CD2 3.93Å; F59-F107 HydrophobicContact CB-CE2 4.22Å; F59-F107 HydrophobicContact CD1-CB 4.38Å; F59-F107 HydrophobicContact CD1-CD2 4.16Å; F59-F107 HydrophobicContact CD2-CD2 4.1Å; F59-F107 HydrophobicContact CE1-CB 4.23Å; F59-F107 AromaticContact CG-CD2 3.82Å; F59-F107 HydrophobicContact CG-CD2 3.82Å; F59-F107 HydrophobicContact CZ-CB 4.42Å; F59-F110 HydrophobicContact CD2-CB 4.4Å; F59-F110 AromaticContact CD2-CD1 3.88Å; F59-F110 HydrophobicContact CD2-CD1 3.88Å; F59-F110 HydrophobicContact CD2-CE1 4.31Å; F59-F110 HydrophobicContact CD2-CG 4.09Å; F59-F110 HydrophobicContact CE2-CB 4Å; F59-F110 HydrophobicContact CE2-CD1 4.31Å; F59-F110 HydrophobicContact CE2-CG 4.05Å
60	K	79.1	Confident	79	Confident	73 Å²	73	70.7 Å²	70.7	32%	0.317	36%	0.362	S	S	.	.	H	α-helix	trans	-71.7	-31.2	177.6	-88.8	-66.5	-168	-178.2	0	113.9	Y56 R57 G58 C63 P64	Y56-K60 HydrophobicContact CD1-CG 4.31Å; Y56-K60 HydrophobicContact CE1-CG 3.8Å; Y56-K60 HydrophobicContact CE2-CG 4.35Å; Y56-K60 WeakPolarHBondContact O-CB 3.45Å; Y56-K60 PolarHBondContact O-N 2.79Å; Y56-K60 WeakPolarHBondContact OH-CE 3.33Å; R57-K60 PolarHBondContact O-N 3.19Å; G58-K60 VanDerWaalsContact C-N 3.34Å; G58-K60 PolarHBondContact O-N 2.93Å; K60-C63 CarbonylContact O-C 3.41Å; K60-P64 PolarHBondContact NZ-O 2.85Å
61	N	79	Confident	79.2	Confident	129 Å²	129	67.7 Å²	67.7	69%	0.69	36%	0.357	S	S	*	.	H	α-helix	trans	-69.2	-42.7	176	-76.5	-12.4	0	0	0	111.3	R57 G58	R57-N61 WeakPolarHBondContact O-CB 3.45Å; R57-N61 PolarHBondContact O-N 3.24Å; R57-N61 PolarHBondContact O-ND2 3.17Å; G58-N61 PolarHBondContact O-N 2.77Å
62	E	71.7	Confident	79.4	Confident	104 Å²	104	66.2 Å²	66.2	49%	0.486	35%	0.352	S	S	.	.	H	α-helix	trans	-75.7	-36	177.3	-63.2	-58.9	140.2	0	0	111.8	G58 I76	G58-E62 PolarHBondContact O-N 2.82Å; E62-I76 HydrophobicContact CB-CD1 4.12Å
63	C	72.4	Confident	79.5	Confident	3 Å²	3	66.8 Å²	66.8	2%	0.02	36%	0.355	C	S	.	.			trans	-127.1	86.6	-176.7	-61.3	0	0	0	0	111.7	F59 K60 S65 G66 V68 T72	F59-C63 HydrophobicContact CE1-CB 4.49Å; F59-C63 WeakPolarHBondContact O-CA 3.15Å; F59-C63 WeakPolarHBondContact O-CB 3.4Å; F59-C63 PolarHBondContact O-N 3.1Å; K60-C63 CarbonylContact O-C 3.41Å; C63-S65 PolarHBondContact O-N 2.78Å; C63-S65 VanDerWaalsContact O-N 3.15Å; C63-G66 PolarHBondContact O-N 3.4Å; C63-V68 HydrophobicContact CB-CG2 4.29Å; C63-V68 WeakPolarHBondContact SG-CG2 3.27Å; C63-T72 VanDerWaalsContact SG-CG2 3.6Å
64	P	73.7	Confident	79.7	Confident	102 Å²	102	65.4 Å²	65.4	66%	0.662	35%	0.348	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.7	-30.9	179	-23.8	33	0	0	0	113.1	K60 G66	K60-P64 PolarHBondContact NZ-O 2.85Å; P64-G66 PolarHBondContact O-N 3.25Å
65	S	73.4	Confident	79.7	Confident	88 Å²	88	66.6 Å²	66.6	62%	0.615	35%	0.347	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.7	-22.6	176	55.2	0	0	0	0	113.6	C63 V67	C63-S65 PolarHBondContact O-N 2.78Å; C63-S65 VanDerWaalsContact O-N 3.15Å; S65-V67 VanDerWaalsContact C-N 3.27Å; S65-V67 PolarHBondContact OG-N 3.28Å; S65-V67 PolarHBondContact OG-O 3.37Å
66	G	73.4	Confident	79.7	Confident	21 Å²	21	66.2 Å²	66.2	22%	0.216	34%	0.344	C	S	.	.	S	Bend	trans	78.5	7.1	-174.5	0	0	0	0	0	114.9	C63 P64	C63-G66 PolarHBondContact O-N 3.4Å; P64-G66 PolarHBondContact O-N 3.25Å
67	V	80	Confident	79.3	Confident	52 Å²	52	64.3 Å²	64.3	32%	0.315	34%	0.337	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.3	143.9	170.8	-66.9	0	0	0	0	109.2	S65 K106	S65-V67 VanDerWaalsContact C-N 3.27Å; S65-V67 PolarHBondContact OG-N 3.28Å; S65-V67 PolarHBondContact OG-O 3.37Å; V67-K106 HydrophobicContact CG1-CG 4.43Å
68	V	83.6	Confident	79.2	Confident	8 Å²	8	58.9 Å²	58.9	5%	0.048	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.3	121.5	173.2	178.5	0	0	0	0	108	F59 C63 F73 F94 S104 I105	F59-V68 HydrophobicContact CD2-CG2 4.08Å; F59-V68 HydrophobicContact CE1-CG2 4.27Å; F59-V68 HydrophobicContact CE2-CB 4.42Å; F59-V68 HydrophobicContact CE2-CG2 3.28Å; F59-V68 HydrophobicContact CZ-CB 4.34Å; F59-V68 HydrophobicContact CZ-CG2 3.4Å; C63-V68 HydrophobicContact CB-CG2 4.29Å; C63-V68 WeakPolarHBondContact SG-CG2 3.27Å; V68-F73 HydrophobicContact CG1-CB 3.78Å; V68-F73 HydrophobicContact CG1-CD2 3.91Å; V68-F73 HydrophobicContact CG1-CG 4.35Å; V68-F94 WeakPolarHBondContact O-CE2 3.15Å; V68-S104 CarbonylContact O-C 3.57Å; V68-S104 WeakPolarHBondContact O-CA 3.47Å; V68-I105 HydrophobicContact CB-CB 4.32Å; V68-I105 PolarHBondContact N-O 2.93Å; V68-I105 PolarHBondContact O-N 3.39Å
69	N	86.1	Confident	78.9	Confident	62 Å²	62	63.7 Å²	63.7	33%	0.332	34%	0.338	S	S	.	.			trans	-94.1	167.5	168.5	66	20.2	0	0	0	110.4	E71 T72 F73	N69-E71 VanDerWaalsContact C-N 3.31Å; N69-E71 PolarHBondContact O-N 2.89Å; N69-T72 PolarHBondContact O-N 2.88Å; N69-T72 WeakPolarHBondContact OD1-CB 3.35Å; N69-T72 PolarHBondContact OD1-N 2.97Å; N69-T72 PolarHBondContact OD1-OG1 2.94Å; N69-F73 WeakPolarHBondContact O-CB 3.02Å; N69-F73 PolarHBondContact O-N 2.76Å
70	E	85.5	Confident	78.5	Confident	57 Å²	57	70.1 Å²	70.1	27%	0.266	37%	0.366	S	S	.	.	H	α-helix	trans	-59.1	-40.4	-175.2	-166	-166	145.5	0	0	112.8	F73 K74 H91 F94	E70-F73 PolarHBondContact O-N 3.42Å; E70-K74 HydrophobicContact CG-CD 4.36Å; E70-K74 WeakPolarHBondContact O-CB 3.46Å; E70-K74 WeakPolarHBondContact O-CG 3.19Å; E70-K74 PolarHBondContact O-N 3.07Å; E70-K74 WeakPolarHBondContact OE1-CE 3.49Å; E70-K74 IonicContact OE1-NZ 2.62Å; E70-K74 PolarHBondContact OE1-NZ 3.4Å; E70-H91 IonicContact OE1-CE1 2.6Å; E70-H91 IonicContact OE1-CG 3.37Å; E70-H91 IonicContact OE1-ND1 2.69Å; E70-H91 PolarHBondContact OE1-ND1 2.94Å; E70-H91 IonicContact OE2-CE1 3.58Å; E70-H91 IonicContact OE2-ND1 2.61Å; E70-F94 HydrophobicContact CB-CD1 3.92Å; E70-F94 HydrophobicContact CB-CD2 4.24Å; E70-F94 HydrophobicContact CB-CE1 3.92Å; E70-F94 HydrophobicContact CB-CE2 4.24Å; E70-F94 HydrophobicContact CB-CG 4.09Å; E70-F94 HydrophobicContact CB-CZ 4.09Å; E70-F94 HydrophobicContact CG-CB 4.28Å; E70-F94 HydrophobicContact CG-CD1 3.88Å; E70-F94 HydrophobicContact CG-CD2 4.48Å; E70-F94 HydrophobicContact CG-CE1 4.37Å; E70-F94 HydrophobicContact CG-CG 3.95Å; E70-F94 VanDerWaalsContact N-CE2 3.31Å
71	E	84.5	Confident	78	Confident	142 Å²	142	69 Å²	69	66%	0.664	36%	0.362	S	S	*	.	H	α-helix	trans	-63.4	-44.1	178.7	-67.1	-172.1	163.8	0	0	112	N69 F73 K74 Q75	N69-E71 VanDerWaalsContact C-N 3.31Å; N69-E71 PolarHBondContact O-N 2.89Å; E71-F73 VanDerWaalsContact C-N 3.34Å; E71-K74 PolarHBondContact O-N 3.2Å; E71-Q75 WeakPolarHBondContact O-CG 3.48Å; E71-Q75 PolarHBondContact O-N 3.28Å
72	T	83.3	Confident	77.5	Confident	35 Å²	35	67.3 Å²	67.3	22%	0.215	36%	0.358	C	S	.	.	H	α-helix	trans	-65.8	-41.2	177.5	-52.4	0	0	0	0	110.2	C63 N69 K74 Q75 I76	C63-T72 VanDerWaalsContact SG-CG2 3.6Å; N69-T72 PolarHBondContact O-N 2.88Å; N69-T72 WeakPolarHBondContact OD1-CB 3.35Å; N69-T72 PolarHBondContact OD1-N 2.97Å; N69-T72 PolarHBondContact OD1-OG1 2.94Å; T72-K74 PolarHBondContact O-N 2.88Å; T72-Q75 PolarHBondContact O-N 3.28Å; T72-I76 HydrophobicContact CG2-CD1 4.04Å; T72-I76 VanDerWaalsContact O-CG1 3.3Å; T72-I76 WeakPolarHBondContact O-CG1 3.31Å; T72-I76 PolarHBondContact O-N 2.81Å
73	F	83.9	Confident	77.1	Confident	12 Å²	12	70 Å²	70	5%	0.053	37%	0.37	C	S	.	.	H	α-helix	trans	-61.1	-45.6	176.8	-164.4	-94	0	0	0	111.8	V68 N69 E70 E71 Q75 I76 Y77 A90 L93 F94 F97 I105	V68-F73 HydrophobicContact CG1-CB 3.78Å; V68-F73 HydrophobicContact CG1-CD2 3.91Å; V68-F73 HydrophobicContact CG1-CG 4.35Å; N69-F73 WeakPolarHBondContact O-CB 3.02Å; N69-F73 PolarHBondContact O-N 2.76Å; E70-F73 PolarHBondContact O-N 3.42Å; E71-F73 VanDerWaalsContact C-N 3.34Å; F73-Q75 VanDerWaalsContact C-N 3.34Å; F73-Q75 PolarHBondContact O-N 3.03Å; F73-I76 PolarHBondContact O-N 2.83Å; F73-Y77 AromaticContact CD1-CD2 3.83Å; F73-Y77 HydrophobicContact CD1-CD2 3.83Å; F73-Y77 HydrophobicContact CD1-CE2 4.2Å; F73-Y77 AromaticContact CE1-CD2 3.45Å; F73-Y77 HydrophobicContact CE1-CD2 3.45Å; F73-Y77 VanDerWaalsContact CE1-CD2 3.45Å; F73-Y77 AromaticContact CE1-CE2 3.39Å; F73-Y77 HydrophobicContact CE1-CE2 3.39Å; F73-Y77 HydrophobicContact CE1-CG 4.4Å; F73-Y77 HydrophobicContact CE2-CD2 4.43Å; F73-Y77 HydrophobicContact CE2-CE2 4.01Å; F73-Y77 HydrophobicContact CG-CD2 4.47Å; F73-Y77 AromaticContact CZ-CD2 3.8Å; F73-Y77 HydrophobicContact CZ-CD2 3.8Å; F73-Y77 AromaticContact CZ-CE2 3.28Å; F73-Y77 HydrophobicContact CZ-CE2 3.28Å; F73-Y77 PolarHBondContact O-N 3.46Å; F73-A90 HydrophobicContact CD1-CB 4.15Å; F73-A90 WeakPolarHBondContact CD1-O 3.25Å; F73-A90 HydrophobicContact CE1-CB 4.39Å; F73-L93 HydrophobicContact CE1-CB 4.01Å; F73-L93 HydrophobicContact CE1-CD2 3.86Å; F73-L93 HydrophobicContact CE1-CG 4.04Å; F73-L93 HydrophobicContact CZ-CB 4.43Å; F73-L93 HydrophobicContact CZ-CD2 3.8Å; F73-L93 HydrophobicContact CZ-CG 4Å; F73-F94 HydrophobicContact CB-CD2 3.76Å; F73-F94 HydrophobicContact CB-CE2 4.47Å; F73-F94 HydrophobicContact CD1-CB 3.95Å; F73-F94 HydrophobicContact CD1-CD2 4.39Å; F73-F94 HydrophobicContact CD2-CD2 4.32Å; F73-F94 HydrophobicContact CE1-CB 4.34Å; F73-F94 HydrophobicContact CG-CB 4.33Å; F73-F94 AromaticContact CG-CD2 3.92Å; F73-F94 HydrophobicContact CG-CD2 3.92Å; F73-F97 HydrophobicContact CZ-CD2 4.28Å; F73-F97 HydrophobicContact CZ-CE2 4.36Å; F73-I105 HydrophobicContact CD2-CD1 4.28Å; F73-I105 HydrophobicContact CE2-CD1 4.4Å
74	K	83.9	Confident	76.9	Confident	59 Å²	59	71.1 Å²	71.1	26%	0.257	38%	0.382	S	S	.	.	H	α-helix	trans	-59.8	-41.5	174.3	-77.9	171.3	167.5	173.2	0	112.4	E70 E71 T72 Y77 S78 S87 A90	E70-K74 HydrophobicContact CG-CD 4.36Å; E70-K74 WeakPolarHBondContact O-CB 3.46Å; E70-K74 WeakPolarHBondContact O-CG 3.19Å; E70-K74 PolarHBondContact O-N 3.07Å; E70-K74 WeakPolarHBondContact OE1-CE 3.49Å; E70-K74 IonicContact OE1-NZ 2.62Å; E70-K74 PolarHBondContact OE1-NZ 3.4Å; E71-K74 PolarHBondContact O-N 3.2Å; T72-K74 PolarHBondContact O-N 2.88Å; K74-Y77 PolarHBondContact O-N 2.94Å; K74-S78 WeakPolarHBondContact O-CB 3.46Å; K74-S78 PolarHBondContact O-N 3.33Å; K74-S78 PolarHBondContact O-OG 2.99Å; K74-S87 WeakPolarHBondContact CE-O 3.32Å; K74-A90 HydrophobicContact CG-CB 3.9Å
75	Q	82.1	Confident	77	Confident	125 Å²	125	70.3 Å²	70.3	58%	0.584	37%	0.372	S	S	*	.	H	α-helix	trans	-63.9	-44.9	177.5	-74.9	177.2	11.7	0	0	111.9	E71 T72 F73 S78 Q79	E71-Q75 WeakPolarHBondContact O-CG 3.48Å; E71-Q75 PolarHBondContact O-N 3.28Å; T72-Q75 PolarHBondContact O-N 3.28Å; F73-Q75 VanDerWaalsContact C-N 3.34Å; F73-Q75 PolarHBondContact O-N 3.03Å; Q75-S78 PolarHBondContact O-N 3.07Å; Q75-Q79 WeakPolarHBondContact O-CG 3.46Å; Q75-Q79 PolarHBondContact O-N 2.88Å
76	I	79.2	Confident	77.3	Confident	37 Å²	37	66.1 Å²	66.1	19%	0.19	34%	0.343	C	S	.	.	H	α-helix	trans	-60.2	-50.1	176.6	-66.5	164.5	0	0	0	109.8	E62 T72 F73 S78 Q79 F80	E62-I76 HydrophobicContact CB-CD1 4.12Å; T72-I76 HydrophobicContact CG2-CD1 4.04Å; T72-I76 VanDerWaalsContact O-CG1 3.3Å; T72-I76 WeakPolarHBondContact O-CG1 3.31Å; T72-I76 PolarHBondContact O-N 2.81Å; F73-I76 PolarHBondContact O-N 2.83Å; I76-S78 VanDerWaalsContact C-N 3.31Å; I76-S78 PolarHBondContact O-N 3.33Å; I76-Q79 WeakPolarHBondContact O-CB 3.48Å; I76-Q79 PolarHBondContact O-N 3.39Å; I76-Q79 VanDerWaalsContact O-N 3.12Å; I76-F80 HydrophobicContact CG2-CD2 4.44Å; I76-F80 HydrophobicContact CG2-CE2 3.83Å; I76-F80 VanDerWaalsContact O-CD2 3.23Å; I76-F80 WeakPolarHBondContact O-CD2 3.23Å
77	Y	74	Confident	77.7	Confident	26 Å²	26	66.9 Å²	66.9	10%	0.102	35%	0.345	C	S	.	.	H	α-helix	trans	-60.7	-37.9	178.5	-98.8	-93.7	0	0	0	113.2	F73 K74 Q79 F80 F81 A90 L93	F73-Y77 AromaticContact CD1-CD2 3.83Å; F73-Y77 HydrophobicContact CD1-CD2 3.83Å; F73-Y77 HydrophobicContact CD1-CE2 4.2Å; F73-Y77 AromaticContact CE1-CD2 3.45Å; F73-Y77 HydrophobicContact CE1-CD2 3.45Å; F73-Y77 VanDerWaalsContact CE1-CD2 3.45Å; F73-Y77 AromaticContact CE1-CE2 3.39Å; F73-Y77 HydrophobicContact CE1-CE2 3.39Å; F73-Y77 HydrophobicContact CE1-CG 4.4Å; F73-Y77 HydrophobicContact CE2-CD2 4.43Å; F73-Y77 HydrophobicContact CE2-CE2 4.01Å; F73-Y77 HydrophobicContact CG-CD2 4.47Å; F73-Y77 AromaticContact CZ-CD2 3.8Å; F73-Y77 HydrophobicContact CZ-CD2 3.8Å; F73-Y77 AromaticContact CZ-CE2 3.28Å; F73-Y77 HydrophobicContact CZ-CE2 3.28Å; F73-Y77 PolarHBondContact O-N 3.46Å; K74-Y77 PolarHBondContact O-N 2.94Å; Y77-Q79 PolarHBondContact O-N 3.38Å; Y77-F80 PolarHBondContact O-N 2.92Å; Y77-F80 VanDerWaalsContact O-N 3.14Å; Y77-F81 HydrophobicContact CD1-CE2 4.28Å; Y77-F81 WeakPolarHBondContact O-CD2 3.34Å; Y77-F81 PolarHBondContact O-N 3.37Å; Y77-A90 HydrophobicContact CG-CB 4.06Å; Y77-L93 HydrophobicContact CE1-CD2 3.69Å; Y77-L93 HydrophobicContact CE2-CD2 3.72Å; Y77-L93 WeakPolarHBondContact OH-CD2 3.43Å
78	S	76.4	Confident	77.9	Confident	54 Å²	54	66.6 Å²	66.6	38%	0.378	34%	0.343	S	S	.	.	H	α-helix	trans	-64	-26.2	178.3	-59.3	0	0	0	0	112.9	K74 Q75 I76 F81	K74-S78 WeakPolarHBondContact O-CB 3.46Å; K74-S78 PolarHBondContact O-N 3.33Å; K74-S78 PolarHBondContact O-OG 2.99Å; Q75-S78 PolarHBondContact O-N 3.07Å; I76-S78 VanDerWaalsContact C-N 3.31Å; I76-S78 PolarHBondContact O-N 3.33Å; S78-F81 CarbonylContact O-C 3.53Å; S78-F81 PolarHBondContact O-N 2.76Å
79	Q	73.7	Confident	78	Confident	135 Å²	135	66.4 Å²	66.4	63%	0.631	34%	0.341	S	S	*	.	H	α-helix	trans	-70.8	-31.8	175.9	-65.4	176.8	36.2	0	0	112.6	Q75 I76 Y77	Q75-Q79 WeakPolarHBondContact O-CG 3.46Å; Q75-Q79 PolarHBondContact O-N 2.88Å; I76-Q79 WeakPolarHBondContact O-CB 3.48Å; I76-Q79 PolarHBondContact O-N 3.39Å; I76-Q79 VanDerWaalsContact O-N 3.12Å; Y77-Q79 PolarHBondContact O-N 3.38Å
80	F	70.4	Confident	78	Confident	149 Å²	149	63.4 Å²	63.4	65%	0.654	33%	0.326	S	S	*	.	H	α-helix	trans	-77.1	-26.4	177.1	-67.8	-76.7	0	0	0	112.7	I76 Y77 P82	I76-F80 HydrophobicContact CG2-CD2 4.44Å; I76-F80 HydrophobicContact CG2-CE2 3.83Å; I76-F80 VanDerWaalsContact O-CD2 3.23Å; I76-F80 WeakPolarHBondContact O-CD2 3.23Å; Y77-F80 PolarHBondContact O-N 2.92Å; Y77-F80 VanDerWaalsContact O-N 3.14Å; F80-P82 VanDerWaalsContact O-CD 3.3Å; F80-P82 WeakPolarHBondContact O-CD 3.17Å
81	F	68.4	Low	78.1	Confident	49 Å²	49	63.3 Å²	63.3	22%	0.215	33%	0.325	C	S	.	.			trans	-121.8	64.1	-178.9	-60.8	-83.7	0	0	0	112.1	Y77 S78 H83 G84 A86 M156 V214	Y77-F81 HydrophobicContact CD1-CE2 4.28Å; Y77-F81 WeakPolarHBondContact O-CD2 3.34Å; Y77-F81 PolarHBondContact O-N 3.37Å; S78-F81 CarbonylContact O-C 3.53Å; S78-F81 PolarHBondContact O-N 2.76Å; F81-H83 PolarHBondContact O-N 3.31Å; F81-G84 PolarHBondContact O-N 2.78Å; F81-A86 HydrophobicContact CB-CB 4.18Å; F81-A86 HydrophobicContact CD2-CB 4.24Å; F81-A86 HydrophobicContact CG-CB 4.48Å; F81-M156 HydrophobicContact CB-CG 4.45Å; F81-M156 HydrophobicContact CD1-CG 3.93Å; F81-M156 HydrophobicContact CD1-SD 4.47Å; F81-M156 HydrophobicContact CD2-CG 4.15Å; F81-M156 HydrophobicContact CD2-SD 4.18Å; F81-M156 HydrophobicContact CE1-CG 4.21Å; F81-M156 HydrophobicContact CE1-SD 4.23Å; F81-M156 HydrophobicContact CE2-CG 4.43Å; F81-M156 HydrophobicContact CE2-SD 3.93Å; F81-M156 HydrophobicContact CG-CG 3.91Å; F81-M156 HydrophobicContact CG-SD 4.46Å; F81-M156 HydrophobicContact CZ-CG 4.46Å; F81-M156 HydrophobicContact CZ-SD 3.96Å; F81-V214 HydrophobicContact CE1-CG1 3.85Å; F81-V214 HydrophobicContact CZ-CG1 3.55Å
82	P	67.1	Low	78.2	Confident	94 Å²	94	57.9 Å²	57.9	61%	0.61	30%	0.299	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.6	-3.8	-173.2	28.6	-36.7	0	0	0	114.4	F80	F80-P82 VanDerWaalsContact O-CD 3.3Å; F80-P82 WeakPolarHBondContact O-CD 3.17Å
83	H	64.2	Low	78.3	Confident	160 Å²	160	56.2 Å²	56.2	74%	0.741	29%	0.288	S	S	*	.	T	Hydrogen-bonded Turn	trans	-121.1	-1.8	-174.9	-63.7	7.7	0	0	0	113.2	F81	F81-H83 PolarHBondContact O-N 3.31Å
84	G	68.4	Low	78.4	Confident	26 Å²	26	55.8 Å²	55.8	27%	0.268	29%	0.286	S	S	.	.	S	Bend	trans	-124.7	173.8	176.3	0	0	0	0	0	111.4	F81	F81-G84 PolarHBondContact O-N 2.78Å
85	D	75.9	Confident	78.5	Confident	85 Å²	85	55 Å²	55	46%	0.455	29%	0.285	S	S	.	.			trans	-101.1	91	172.3	-172.6	-1.9	0	0	0	109.5	S87 D155 M156	D85-S87 PolarHBondContact O-N 2.66Å; D85-S87 WeakPolarHBondContact OD1-CB 2.9Å; D85-S87 PolarHBondContact OD1-N 2.99Å; D85-S87 PolarHBondContact OD1-OG 2.87Å; D85-D155 PolarHBondContact N-O 3.43Å; D85-D155 CarbonylContact O-C 3.57Å; D85-M156 PolarHBondContact O-N 2.87Å
86	A	78.6	Confident	78.6	Confident	1 Å²	1	49.4 Å²	49.4	1%	0.008	26%	0.26	C	S	.	.			trans	-79.3	-2	177.7	0	0	0	0	0	113	F81 T88 Y89 A90 M156	F81-A86 HydrophobicContact CB-CB 4.18Å; F81-A86 HydrophobicContact CD2-CB 4.24Å; F81-A86 HydrophobicContact CG-CB 4.48Å; A86-T88 PolarHBondContact O-N 2.69Å; A86-Y89 PolarHBondContact O-N 2.84Å; A86-A90 WeakPolarHBondContact O-CB 3.25Å; A86-A90 PolarHBondContact O-N 3.46Å; A86-M156 HydrophobicContact CB-CB 4.47Å; A86-M156 HydrophobicContact CB-CG 3.89Å
87	S	82.9	Confident	78.8	Confident	37 Å²	37	47.9 Å²	47.9	26%	0.259	25%	0.252	S	S	.	.	H	α-helix	trans	-63.2	-40.4	-168.5	66.5	0	0	0	0	113	K74 D85 H91	K74-S87 WeakPolarHBondContact CE-O 3.32Å; D85-S87 PolarHBondContact O-N 2.66Å; D85-S87 WeakPolarHBondContact OD1-CB 2.9Å; D85-S87 PolarHBondContact OD1-N 2.99Å; D85-S87 PolarHBondContact OD1-OG 2.87Å; S87-H91 PolarHBondContact O-N 3.03Å; S87-H91 VanDerWaalsContact O-N 3.08Å
88	T	84.6	Confident	79.2	Confident	45 Å²	45	46.9 Å²	46.9	28%	0.276	25%	0.249	S	C	.	.	H	α-helix	trans	-74.6	-41	-178.2	-56	0	0	0	0	110.5	A86 H91 Y92 A152	A86-T88 PolarHBondContact O-N 2.69Å; T88-H91 WeakPolarHBondContact O-CB 3.46Å; T88-H91 PolarHBondContact O-N 2.94Å; T88-Y92 HydrophobicContact CG2-CD2 4.34Å; T88-Y92 HydrophobicContact CG2-CE2 3.62Å; T88-Y92 VanDerWaalsContact O-CD2 3.3Å; T88-Y92 WeakPolarHBondContact O-CD2 3.15Å; T88-Y92 PolarHBondContact O-N 3.36Å; T88-A152 HydrophobicContact CG2-CB 3.91Å
89	Y	84.6	Confident	79	Confident	4 Å²	4	48.8 Å²	48.8	2%	0.016	26%	0.258	C	S	.	.	H	α-helix	trans	-65.5	-42.5	175	-173.8	-104.6	0	0	0	111.7	A86 H91 Y92 L93 L132 A152 I153 M156 I215	A86-Y89 PolarHBondContact O-N 2.84Å; Y89-H91 PolarHBondContact O-N 2.94Å; Y89-Y92 PolarHBondContact O-N 3.45Å; Y89-L93 HydrophobicContact CE1-CD2 4.24Å; Y89-L93 VanDerWaalsContact O-CB 3.29Å; Y89-L93 WeakPolarHBondContact O-CB 3.28Å; Y89-L93 PolarHBondContact O-N 2.87Å; Y89-L132 HydrophobicContact CE2-CD2 4.41Å; Y89-A152 HydrophobicContact CD2-CB 4.47Å; Y89-I153 HydrophobicContact CD2-CG1 3.7Å; Y89-I153 HydrophobicContact CE2-CD1 4.14Å; Y89-I153 HydrophobicContact CE2-CG1 3.62Å; Y89-M156 HydrophobicContact CD1-CE 4.23Å; Y89-M156 HydrophobicContact CD1-SD 3.56Å; Y89-M156 VanDerWaalsContact CD1-SD 3.56Å; Y89-M156 HydrophobicContact CE1-CE 4.39Å; Y89-M156 HydrophobicContact CE1-SD 4.12Å; Y89-M156 HydrophobicContact CG-SD 4.09Å; Y89-I215 WeakPolarHBondContact OH-CD1 3.34Å
90	A	85.7	Confident	79	Confident	0 Å²	0	44.8 Å²	44.8	0%	0	25%	0.253	C	S	.	.	H	α-helix	trans	-61.4	-30.4	175	0	0	0	0	0	112.5	F73 K74 Y77 A86 F94	F73-A90 HydrophobicContact CD1-CB 4.15Å; F73-A90 WeakPolarHBondContact CD1-O 3.25Å; F73-A90 HydrophobicContact CE1-CB 4.39Å; K74-A90 HydrophobicContact CG-CB 3.9Å; Y77-A90 HydrophobicContact CG-CB 4.06Å; A86-A90 WeakPolarHBondContact O-CB 3.25Å; A86-A90 PolarHBondContact O-N 3.46Å; A90-F94 WeakPolarHBondContact O-CB 3.28Å; A90-F94 PolarHBondContact O-N 3.43Å
91	H	87.9	Confident	79.2	Confident	55 Å²	55	43 Å²	43	26%	0.255	25%	0.25	S	S	.	.	H	α-helix	trans	-65.5	-51.1	171.8	176.4	74.1	0	0	0	111.9	E70 S87 T88 Y89 L93 F94 N95	E70-H91 IonicContact OE1-CE1 2.6Å; E70-H91 IonicContact OE1-CG 3.37Å; E70-H91 IonicContact OE1-ND1 2.69Å; E70-H91 PolarHBondContact OE1-ND1 2.94Å; E70-H91 IonicContact OE2-CE1 3.58Å; E70-H91 IonicContact OE2-ND1 2.61Å; S87-H91 PolarHBondContact O-N 3.03Å; S87-H91 VanDerWaalsContact O-N 3.08Å; T88-H91 WeakPolarHBondContact O-CB 3.46Å; T88-H91 PolarHBondContact O-N 2.94Å; Y89-H91 PolarHBondContact O-N 2.94Å; H91-L93 VanDerWaalsContact C-N 3.29Å; H91-L93 PolarHBondContact O-N 2.77Å; H91-F94 WeakPolarHBondContact O-CB 3.18Å; H91-F94 PolarHBondContact O-N 2.92Å; H91-N95 PolarHBondContact NE2-ND2 2.89Å; H91-N95 PolarHBondContact O-N 2.84Å
92	Y	86.6	Confident	79.8	Confident	27 Å²	27	44.6 Å²	44.6	11%	0.106	26%	0.264	C	S	.	.	H	α-helix	trans	-62.6	-40.4	178.4	-61.1	-45.9	0	0	0	111.9	T88 Y89 N95 A96 I135 D148 I149 A152	T88-Y92 HydrophobicContact CG2-CD2 4.34Å; T88-Y92 HydrophobicContact CG2-CE2 3.62Å; T88-Y92 VanDerWaalsContact O-CD2 3.3Å; T88-Y92 WeakPolarHBondContact O-CD2 3.15Å; T88-Y92 PolarHBondContact O-N 3.36Å; Y89-Y92 PolarHBondContact O-N 3.45Å; Y92-N95 PolarHBondContact O-N 3.37Å; Y92-A96 PolarHBondContact O-N 2.89Å; Y92-I135 HydrophobicContact CD1-CD1 3.99Å; Y92-I135 HydrophobicContact CD1-CG1 3.94Å; Y92-I135 HydrophobicContact CD1-CG2 4.03Å; Y92-I135 HydrophobicContact CE1-CD1 3.54Å; Y92-I135 HydrophobicContact CE1-CG1 3.97Å; Y92-I135 HydrophobicContact CE1-CG2 3.83Å; Y92-I135 HydrophobicContact CE2-CD1 4.39Å; Y92-D148 HydrophobicContact CE2-CB 4.44Å; Y92-I149 HydrophobicContact CD1-CD1 4.45Å; Y92-I149 HydrophobicContact CD2-CD1 3.56Å; Y92-I149 HydrophobicContact CE2-CD1 4.21Å; Y92-I149 HydrophobicContact CG-CD1 3.69Å; Y92-A152 HydrophobicContact CD2-CB 4.07Å; Y92-A152 HydrophobicContact CE2-CB 3.92Å
93	L	85.4	Confident	80.5	Confident	0 Å²	0	42 Å²	42	0%	0	26%	0.255	C	S	.	.	H	α-helix	trans	-63.2	-48.5	175.6	-164.8	66.7	0	0	0	111	F73 Y77 Y89 H91 N95 A96 F97 W128 L132 I215	F73-L93 HydrophobicContact CE1-CB 4.01Å; F73-L93 HydrophobicContact CE1-CD2 3.86Å; F73-L93 HydrophobicContact CE1-CG 4.04Å; F73-L93 HydrophobicContact CZ-CB 4.43Å; F73-L93 HydrophobicContact CZ-CD2 3.8Å; F73-L93 HydrophobicContact CZ-CG 4Å; Y77-L93 HydrophobicContact CE1-CD2 3.69Å; Y77-L93 HydrophobicContact CE2-CD2 3.72Å; Y77-L93 WeakPolarHBondContact OH-CD2 3.43Å; Y89-L93 HydrophobicContact CE1-CD2 4.24Å; Y89-L93 VanDerWaalsContact O-CB 3.29Å; Y89-L93 WeakPolarHBondContact O-CB 3.28Å; Y89-L93 PolarHBondContact O-N 2.87Å; H91-L93 VanDerWaalsContact C-N 3.29Å; H91-L93 PolarHBondContact O-N 2.77Å; L93-N95 VanDerWaalsContact C-N 3.27Å; L93-N95 PolarHBondContact O-N 3.3Å; L93-A96 WeakPolarHBondContact O-CA 3.32Å; L93-A96 WeakPolarHBondContact O-CB 3.35Å; L93-A96 PolarHBondContact O-N 3.48Å; L93-F97 HydrophobicContact CD1-CD2 4.26Å; L93-F97 HydrophobicContact CD1-CE2 3.84Å; L93-F97 HydrophobicContact CD2-CE2 4.25Å; L93-F97 HydrophobicContact CG-CD2 3.94Å; L93-F97 HydrophobicContact CG-CE2 3.72Å; L93-F97 VanDerWaalsContact O-CD2 3.26Å; L93-F97 WeakPolarHBondContact O-CD2 3.38Å; L93-F97 PolarHBondContact O-N 2.88Å; L93-W128 HydrophobicContact CD1-CH2 3.47Å; L93-W128 VanDerWaalsContact CD1-CH2 3.47Å; L93-W128 HydrophobicContact CD1-CZ2 4.25Å; L93-W128 HydrophobicContact CD1-CZ3 4.28Å; L93-L132 HydrophobicContact CB-CD1 4.39Å; L93-L132 HydrophobicContact CD1-CD1 3.85Å; L93-L132 HydrophobicContact CD1-CD2 4.37Å; L93-I215 HydrophobicContact CD1-CD1 4.12Å; L93-I215 HydrophobicContact CD2-CG2 4.5Å
94	F	86.7	Confident	81.4	Confident	3 Å²	3	36.2 Å²	36.2	1%	0.013	23%	0.232	C	C	.	.	H	α-helix	trans	-53.9	-46.1	175.1	179.5	-90.1	0	0	0	111.6	V68 E70 F73 A90 H91 A96 F97 D98 I105	V68-F94 WeakPolarHBondContact O-CE2 3.15Å; E70-F94 HydrophobicContact CB-CD1 3.92Å; E70-F94 HydrophobicContact CB-CD2 4.24Å; E70-F94 HydrophobicContact CB-CE1 3.92Å; E70-F94 HydrophobicContact CB-CE2 4.24Å; E70-F94 HydrophobicContact CB-CG 4.09Å; E70-F94 HydrophobicContact CB-CZ 4.09Å; E70-F94 HydrophobicContact CG-CB 4.28Å; E70-F94 HydrophobicContact CG-CD1 3.88Å; E70-F94 HydrophobicContact CG-CD2 4.48Å; E70-F94 HydrophobicContact CG-CE1 4.37Å; E70-F94 HydrophobicContact CG-CG 3.95Å; E70-F94 VanDerWaalsContact N-CE2 3.31Å; F73-F94 HydrophobicContact CB-CD2 3.76Å; F73-F94 HydrophobicContact CB-CE2 4.47Å; F73-F94 HydrophobicContact CD1-CB 3.95Å; F73-F94 HydrophobicContact CD1-CD2 4.39Å; F73-F94 HydrophobicContact CD2-CD2 4.32Å; F73-F94 HydrophobicContact CE1-CB 4.34Å; F73-F94 HydrophobicContact CG-CB 4.33Å; F73-F94 AromaticContact CG-CD2 3.92Å; F73-F94 HydrophobicContact CG-CD2 3.92Å; A90-F94 WeakPolarHBondContact O-CB 3.28Å; A90-F94 PolarHBondContact O-N 3.43Å; H91-F94 WeakPolarHBondContact O-CB 3.18Å; H91-F94 PolarHBondContact O-N 2.92Å; F94-A96 PolarHBondContact O-N 2.89Å; F94-F97 PolarHBondContact O-N 2.81Å; F94-D98 HydrophobicContact CE1-CB 4.26Å; F94-D98 PolarHBondContact O-N 3.05Å; F94-I105 HydrophobicContact CD2-CD1 3.26Å; F94-I105 HydrophobicContact CD2-CG1 4Å; F94-I105 HydrophobicContact CE2-CB 4.49Å; F94-I105 HydrophobicContact CE2-CD1 3.4Å; F94-I105 VanDerWaalsContact CE2-CD1 3.4Å; F94-I105 HydrophobicContact CE2-CG1 3.63Å; F94-I105 HydrophobicContact CG-CD1 4.02Å; F94-I105 HydrophobicContact CZ-CD1 4.25Å; F94-I105 HydrophobicContact CZ-CG1 4.08Å
95	N	85.7	Confident	82.2	Confident	42 Å²	42	35 Å²	35	23%	0.225	22%	0.22	C	C	.	.	H	α-helix	trans	-61.4	-43.2	174.6	-74.7	0.6	0	0	0	111.1	H91 Y92 L93 F97 D98 R137	H91-N95 PolarHBondContact NE2-ND2 2.89Å; H91-N95 PolarHBondContact O-N 2.84Å; Y92-N95 PolarHBondContact O-N 3.37Å; L93-N95 VanDerWaalsContact C-N 3.27Å; L93-N95 PolarHBondContact O-N 3.3Å; N95-F97 PolarHBondContact O-N 3.44Å; N95-D98 PolarHBondContact O-N 3.16Å; N95-R137 PolarHBondContact O-NH2 3.03Å
96	A	84.1	Confident	82.6	Confident	8 Å²	8	36.2 Å²	36.2	7%	0.066	22%	0.221	C	C	.	.	H	α-helix	trans	-61.1	-32.3	177.2	0	0	0	0	0	113	Y92 L93 F94 W128 L132	Y92-A96 PolarHBondContact O-N 2.89Å; L93-A96 WeakPolarHBondContact O-CA 3.32Å; L93-A96 WeakPolarHBondContact O-CB 3.35Å; L93-A96 PolarHBondContact O-N 3.48Å; F94-A96 PolarHBondContact O-N 2.89Å; A96-W128 HydrophobicContact CB-CZ2 4.49Å; A96-L132 HydrophobicContact CB-CB 4.23Å; A96-L132 HydrophobicContact CB-CD1 3.84Å
97	F	82.8	Confident	82.8	Confident	6 Å²	6	37 Å²	37	3%	0.026	22%	0.224	C	C	.	.	H	α-helix	trans	-78.7	-35.3	174.8	-82.5	-93.6	0	0	0	113.4	F73 L93 F94 N95 T99 I105 F110 A113 L117 W128	F73-F97 HydrophobicContact CZ-CD2 4.28Å; F73-F97 HydrophobicContact CZ-CE2 4.36Å; L93-F97 HydrophobicContact CD1-CD2 4.26Å; L93-F97 HydrophobicContact CD1-CE2 3.84Å; L93-F97 HydrophobicContact CD2-CE2 4.25Å; L93-F97 HydrophobicContact CG-CD2 3.94Å; L93-F97 HydrophobicContact CG-CE2 3.72Å; L93-F97 VanDerWaalsContact O-CD2 3.26Å; L93-F97 WeakPolarHBondContact O-CD2 3.38Å; L93-F97 PolarHBondContact O-N 2.88Å; F94-F97 PolarHBondContact O-N 2.81Å; N95-F97 PolarHBondContact O-N 3.44Å; F97-T99 PolarHBondContact O-N 3.43Å; F97-I105 HydrophobicContact CB-CD1 3.45Å; F97-I105 VanDerWaalsContact CB-CD1 3.45Å; F97-I105 HydrophobicContact CB-CG1 4.01Å; F97-I105 HydrophobicContact CB-CG2 4.48Å; F97-I105 HydrophobicContact CG-CD1 4.33Å; F97-F110 HydrophobicContact CD1-CD2 4.48Å; F97-F110 HydrophobicContact CE1-CD2 4.23Å; F97-A113 HydrophobicContact CD1-CB 3.3Å; F97-A113 HydrophobicContact CE1-CB 3.19Å; F97-A113 HydrophobicContact CG-CB 4.32Å; F97-A113 HydrophobicContact CZ-CB 4.11Å; F97-L117 HydrophobicContact CZ-CD1 3.96Å; F97-W128 AromaticContact CD2-CZ2 3.95Å; F97-W128 HydrophobicContact CD2-CZ2 3.95Å; F97-W128 AromaticContact CE2-CH2 3.92Å; F97-W128 HydrophobicContact CE2-CH2 3.92Å; F97-W128 AromaticContact CE2-CZ2 3.55Å; F97-W128 HydrophobicContact CE2-CZ2 3.55Å; F97-W128 HydrophobicContact CZ-CH2 4.4Å; F97-W128 AromaticContact CZ-CZ2 3.89Å; F97-W128 HydrophobicContact CZ-CZ2 3.89Å
98	D	83.8	Confident	82.7	Confident	4 Å²	4	40.3 Å²	40.3	2%	0.021	24%	0.236	C	C	.	.			trans	-80.9	63.7	179.3	-176.6	24.5	0	0	0	111.7	F94 N95 G100 N101 T102 G103 I105 R137	F94-D98 HydrophobicContact CE1-CB 4.26Å; F94-D98 PolarHBondContact O-N 3.05Å; N95-D98 PolarHBondContact O-N 3.16Å; D98-G100 PolarHBondContact O-N 3.43Å; D98-N101 PolarHBondContact O-N 3.38Å; D98-N101 PolarHBondContact O-OD1 3.35Å; D98-N101 PolarHBondContact OD1-N 3.35Å; D98-N101 VanDerWaalsContact OD2-C 3.27Å; D98-N101 VanDerWaalsContact OD2-CA 3.27Å; D98-N101 WeakPolarHBondContact OD2-CA 3.26Å; D98-T102 VanDerWaalsContact CG-N 3.33Å; D98-T102 PolarHBondContact OD1-N 3.2Å; D98-T102 PolarHBondContact OD1-OG1 2.95Å; D98-T102 PolarHBondContact OD2-N 2.78Å; D98-G103 WeakPolarHBondContact OD2-CA 3.01Å; D98-G103 PolarHBondContact OD2-N 3.18Å; D98-I105 HydrophobicContact CB-CG1 4.13Å; D98-R137 PolarHBondContact O-NH2 2.86Å
99	T	72.5	Confident	82.6	Confident	95 Å²	95	40.3 Å²	40.3	58%	0.583	23%	0.234	S	C	*	.	T	Hydrogen-bonded Turn	trans	-54.5	-28.1	-179.6	49.5	0	0	0	0	112.9	F97 R137	F97-T99 PolarHBondContact O-N 3.43Å; T99-R137 PolarHBondContact O-NH1 2.6Å
100	G	72.8	Confident	82.5	Confident	51 Å²	51	42.3 Å²	42.3	53%	0.526	24%	0.243	S	C	.	.	T	Hydrogen-bonded Turn	trans	-81.3	-4.4	177.2	0	0	0	0	0	115.8	D98 T102	D98-G100 PolarHBondContact O-N 3.43Å; G100-T102 PolarHBondContact O-N 3.22Å; G100-T102 VanDerWaalsContact O-N 3.13Å
101	N	75.3	Confident	82.4	Confident	110 Å²	110	42.3 Å²	42.3	59%	0.588	24%	0.243	S	C	*	.			trans	46.8	38.4	-172	-72.7	-22.1	0	0	0	112.3	D98 G103 R137	D98-N101 PolarHBondContact O-N 3.38Å; D98-N101 PolarHBondContact O-OD1 3.35Å; D98-N101 PolarHBondContact OD1-N 3.35Å; D98-N101 VanDerWaalsContact OD2-C 3.27Å; D98-N101 VanDerWaalsContact OD2-CA 3.27Å; D98-N101 WeakPolarHBondContact OD2-CA 3.26Å; N101-G103 VanDerWaalsContact C-N 3.27Å; N101-R137 PolarHBondContact OD1-NH1 3.05Å; N101-R137 VanDerWaalsContact OD1-NH1 3.11Å; N101-R137 PolarHBondContact OD1-NH2 2.61Å; N101-R137 VanDerWaalsContact OD1-NH2 3.12Å
102	T	79.6	Confident	82.1	Confident	83 Å²	83	42.3 Å²	42.3	51%	0.509	25%	0.247	S	C	.	.	S	Bend	trans	-83.3	-9.9	-177.4	62.5	0	0	0	0	112.1	D98 G100 S104	D98-T102 VanDerWaalsContact CG-N 3.33Å; D98-T102 PolarHBondContact OD1-N 3.2Å; D98-T102 PolarHBondContact OD1-OG1 2.95Å; D98-T102 PolarHBondContact OD2-N 2.78Å; G100-T102 PolarHBondContact O-N 3.22Å; G100-T102 VanDerWaalsContact O-N 3.13Å; T102-S104 PolarHBondContact O-N 2.97Å; T102-S104 PolarHBondContact OG1-N 3.26Å; T102-S104 PolarHBondContact OG1-O 3.25Å
103	G	82.6	Confident	82	Confident	41 Å²	41	41.4 Å²	41.4	42%	0.423	25%	0.245	S	C	.	.	S	Bend	trans	71.5	14.6	-171.2	0	0	0	0	0	112.6	D98 N101	D98-G103 WeakPolarHBondContact OD2-CA 3.01Å; D98-G103 PolarHBondContact OD2-N 3.18Å; N101-G103 VanDerWaalsContact C-N 3.27Å
104	S	83.9	Confident	81.8	Confident	37 Å²	37	42.7 Å²	42.7	26%	0.259	25%	0.252	S	S	.	.	S	Bend	trans	-156	118.9	-176.5	-71.1	0	0	0	0	111.6	V68 T102	V68-S104 CarbonylContact O-C 3.57Å; V68-S104 WeakPolarHBondContact O-CA 3.47Å; T102-S104 PolarHBondContact O-N 2.97Å; T102-S104 PolarHBondContact OG1-N 3.26Å; T102-S104 PolarHBondContact OG1-O 3.25Å
105	I	84.4	Confident	81.6	Confident	1 Å²	1	42.9 Å²	42.9	1%	0.005	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.7	122.4	177	-59.6	163.6	0	0	0	108.6	V68 F73 F94 F97 D98 D109 F110	V68-I105 HydrophobicContact CB-CB 4.32Å; V68-I105 PolarHBondContact N-O 2.93Å; V68-I105 PolarHBondContact O-N 3.39Å; F73-I105 HydrophobicContact CD2-CD1 4.28Å; F73-I105 HydrophobicContact CE2-CD1 4.4Å; F94-I105 HydrophobicContact CD2-CD1 3.26Å; F94-I105 HydrophobicContact CD2-CG1 4Å; F94-I105 HydrophobicContact CE2-CB 4.49Å; F94-I105 HydrophobicContact CE2-CD1 3.4Å; F94-I105 VanDerWaalsContact CE2-CD1 3.4Å; F94-I105 HydrophobicContact CE2-CG1 3.63Å; F94-I105 HydrophobicContact CG-CD1 4.02Å; F94-I105 HydrophobicContact CZ-CD1 4.25Å; F94-I105 HydrophobicContact CZ-CG1 4.08Å; F97-I105 HydrophobicContact CB-CD1 3.45Å; F97-I105 VanDerWaalsContact CB-CD1 3.45Å; F97-I105 HydrophobicContact CB-CG1 4.01Å; F97-I105 HydrophobicContact CB-CG2 4.48Å; F97-I105 HydrophobicContact CG-CD1 4.33Å; D98-I105 HydrophobicContact CB-CG1 4.13Å; I105-D109 HydrophobicContact CG2-CB 4.03Å; I105-F110 HydrophobicContact CG2-CB 4.08Å
106	K	84.5	Confident	81.5	Confident	111 Å²	111	43 Å²	43	48%	0.483	25%	0.254	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.5	164.2	173	-60.7	174.3	-175.4	171	0	110.1	V67 E108 D109 F110	V67-K106 HydrophobicContact CG1-CG 4.43Å; K106-E108 PolarHBondContact O-N 2.89Å; K106-D109 WeakPolarHBondContact CB-OD2 3.26Å; K106-D109 PolarHBondContact N-OD2 3.11Å; K106-D109 VanDerWaalsContact N-OD2 3.17Å; K106-D109 PolarHBondContact O-N 2.63Å; K106-F110 PolarHBondContact O-N 2.8Å
107	F	82.1	Confident	81.3	Confident	16 Å²	16	43.6 Å²	43.6	7%	0.07	26%	0.256	C	S	.	.	H	α-helix	trans	-56.7	-38.6	175.8	-179.8	-108.8	0	0	0	112.4	L41 L55 Y56 F59 F110 V111	L41-F107 HydrophobicContact CD1-CD1 3.87Å; L41-F107 HydrophobicContact CD1-CE1 3.78Å; L55-F107 HydrophobicContact CB-CE2 4.22Å; L55-F107 HydrophobicContact CB-CZ 4.36Å; Y56-F107 HydrophobicContact CD2-CB 4.49Å; Y56-F107 AromaticContact CD2-CD1 3.66Å; Y56-F107 HydrophobicContact CD2-CD1 3.66Å; Y56-F107 AromaticContact CD2-CD2 3.82Å; Y56-F107 HydrophobicContact CD2-CD2 3.82Å; Y56-F107 AromaticContact CD2-CE1 3.7Å; Y56-F107 HydrophobicContact CD2-CE1 3.7Å; Y56-F107 AromaticContact CD2-CE2 3.88Å; Y56-F107 HydrophobicContact CD2-CE2 3.88Å; Y56-F107 AromaticContact CD2-CG 3.7Å; Y56-F107 HydrophobicContact CD2-CG 3.7Å; Y56-F107 AromaticContact CD2-CZ 3.81Å; Y56-F107 HydrophobicContact CD2-CZ 3.81Å; Y56-F107 HydrophobicContact CE2-CD1 4.23Å; Y56-F107 HydrophobicContact CE2-CG 4.2Å; Y56-F107 HydrophobicContact CG-CE1 4.38Å; Y56-F107 HydrophobicContact CG-CE2 4.37Å; Y56-F107 HydrophobicContact CG-CZ 4.19Å; F59-F107 HydrophobicContact CB-CD2 3.93Å; F59-F107 HydrophobicContact CB-CE2 4.22Å; F59-F107 HydrophobicContact CD1-CB 4.38Å; F59-F107 HydrophobicContact CD1-CD2 4.16Å; F59-F107 HydrophobicContact CD2-CD2 4.1Å; F59-F107 HydrophobicContact CE1-CB 4.23Å; F59-F107 AromaticContact CG-CD2 3.82Å; F59-F107 HydrophobicContact CG-CD2 3.82Å; F59-F107 HydrophobicContact CZ-CB 4.42Å; F107-F110 PolarHBondContact O-N 3.1Å; F107-V111 HydrophobicContact CD1-CG1 4.34Å; F107-V111 HydrophobicContact CD2-CG1 4.13Å; F107-V111 HydrophobicContact CE1-CG1 3.78Å; F107-V111 HydrophobicContact CE2-CG1 3.5Å; F107-V111 HydrophobicContact CZ-CG1 3.32Å; F107-V111 WeakPolarHBondContact O-CG2 3.42Å; F107-V111 PolarHBondContact O-N 2.89Å
108	E	82	Confident	81.1	Confident	107 Å²	107	48.7 Å²	48.7	50%	0.5	28%	0.283	S	S	.	.	H	α-helix	trans	-61	-47.6	178.8	-59.8	176.9	-162.7	0	0	111.7	L41 K106 F110 V111 T112	L41-E108 HydrophobicContact CD1-CG 4.21Å; L41-E108 HydrophobicContact CD2-CB 4.06Å; L41-E108 HydrophobicContact CD2-CG 4.05Å; K106-E108 PolarHBondContact O-N 2.89Å; E108-F110 VanDerWaalsContact C-N 3.32Å; E108-F110 PolarHBondContact O-N 2.88Å; E108-V111 WeakPolarHBondContact O-CG2 3.1Å; E108-V111 PolarHBondContact O-N 3.42Å; E108-T112 VanDerWaalsContact O-CB 3.31Å; E108-T112 WeakPolarHBondContact O-CB 3.43Å; E108-T112 PolarHBondContact O-N 2.96Å; E108-T112 PolarHBondContact O-OG1 2.89Å
109	D	82.3	Confident	80.9	Confident	46 Å²	46	53.7 Å²	53.7	25%	0.246	30%	0.301	C	S	.	.	H	α-helix	trans	-62.6	-42.4	177.5	-54.1	-46.7	0	0	0	110.7	I105 K106 T112 A113	I105-D109 HydrophobicContact CG2-CB 4.03Å; K106-D109 WeakPolarHBondContact CB-OD2 3.26Å; K106-D109 PolarHBondContact N-OD2 3.11Å; K106-D109 VanDerWaalsContact N-OD2 3.17Å; K106-D109 PolarHBondContact O-N 2.63Å; D109-T112 PolarHBondContact O-N 2.96Å; D109-A113 WeakPolarHBondContact O-CB 3.34Å; D109-A113 PolarHBondContact O-N 3.34Å
110	F	82.1	Confident	81.1	Confident	46 Å²	46	49.8 Å²	49.8	20%	0.202	28%	0.279	C	S	.	.	H	α-helix	trans	-61.8	-49.3	178.7	-177.2	-105.3	0	0	0	112.7	F59 F97 I105 K106 F107 E108 T112 L114	F59-F110 HydrophobicContact CD2-CB 4.4Å; F59-F110 AromaticContact CD2-CD1 3.88Å; F59-F110 HydrophobicContact CD2-CD1 3.88Å; F59-F110 HydrophobicContact CD2-CE1 4.31Å; F59-F110 HydrophobicContact CD2-CG 4.09Å; F59-F110 HydrophobicContact CE2-CB 4Å; F59-F110 HydrophobicContact CE2-CD1 4.31Å; F59-F110 HydrophobicContact CE2-CG 4.05Å; F97-F110 HydrophobicContact CD1-CD2 4.48Å; F97-F110 HydrophobicContact CE1-CD2 4.23Å; I105-F110 HydrophobicContact CG2-CB 4.08Å; K106-F110 PolarHBondContact O-N 2.8Å; F107-F110 PolarHBondContact O-N 3.1Å; E108-F110 VanDerWaalsContact C-N 3.32Å; E108-F110 PolarHBondContact O-N 2.88Å; F110-T112 VanDerWaalsContact C-N 3.34Å; F110-L114 HydrophobicContact CD1-CD1 3.93Å; F110-L114 HydrophobicContact CE1-CD1 3.37Å; F110-L114 HydrophobicContact CE1-CG 4.32Å; F110-L114 HydrophobicContact CE2-CD1 4.32Å; F110-L114 HydrophobicContact CZ-CD1 3.6Å; F110-L114 HydrophobicContact CZ-CG 4.27Å; F110-L114 WeakPolarHBondContact O-CG 3.4Å; F110-L114 PolarHBondContact O-N 3.22Å
111	V	82.9	Confident	81.8	Confident	0 Å²	0	50 Å²	50	0%	0	27%	0.273	C	S	.	.	H	α-helix	trans	-70.8	-31.2	179.6	-63.4	0	0	0	0	112.7	L41 T45 L52 L55 F107 E108 S115	L41-V111 HydrophobicContact CD1-CG2 4.03Å; L41-V111 HydrophobicContact CD2-CG2 3.68Å; L41-V111 HydrophobicContact CG-CG2 4.3Å; T45-V111 HydrophobicContact CG2-CB 4.48Å; T45-V111 HydrophobicContact CG2-CG2 4.08Å; L52-V111 HydrophobicContact CD2-CB 4.03Å; L52-V111 HydrophobicContact CD2-CG1 3.92Å; L52-V111 HydrophobicContact CD2-CG2 4.31Å; L55-V111 HydrophobicContact CD1-CG1 4.29Å; F107-V111 HydrophobicContact CD1-CG1 4.34Å; F107-V111 HydrophobicContact CD2-CG1 4.13Å; F107-V111 HydrophobicContact CE1-CG1 3.78Å; F107-V111 HydrophobicContact CE2-CG1 3.5Å; F107-V111 HydrophobicContact CZ-CG1 3.32Å; F107-V111 WeakPolarHBondContact O-CG2 3.42Å; F107-V111 PolarHBondContact O-N 2.89Å; E108-V111 WeakPolarHBondContact O-CG2 3.1Å; E108-V111 PolarHBondContact O-N 3.42Å; V111-S115 VanDerWaalsContact O-CB 3.3Å; V111-S115 WeakPolarHBondContact O-CB 3.45Å; V111-S115 PolarHBondContact O-N 3.01Å
112	T	83	Confident	82.1	Confident	54 Å²	54	48.6 Å²	48.6	33%	0.331	27%	0.268	S	S	.	.	H	α-helix	trans	-65.5	-47.4	176.5	-58.7	0	0	0	0	110.5	E108 D109 F110 S115 I116	E108-T112 VanDerWaalsContact O-CB 3.31Å; E108-T112 WeakPolarHBondContact O-CB 3.43Å; E108-T112 PolarHBondContact O-N 2.96Å; E108-T112 PolarHBondContact O-OG1 2.89Å; D109-T112 PolarHBondContact O-N 2.96Å; F110-T112 VanDerWaalsContact C-N 3.34Å; T112-S115 WeakPolarHBondContact O-CB 3.4Å; T112-S115 PolarHBondContact O-N 3.22Å; T112-I116 PolarHBondContact O-N 3.44Å
113	A	82.5	Confident	82.3	Confident	8 Å²	8	47.9 Å²	47.9	7%	0.066	26%	0.264	C	S	.	.	H	α-helix	trans	-64.4	-42.6	175.9	0	0	0	0	0	112.3	F97 D109 S115 I116 L117	F97-A113 HydrophobicContact CD1-CB 3.3Å; F97-A113 HydrophobicContact CE1-CB 3.19Å; F97-A113 HydrophobicContact CG-CB 4.32Å; F97-A113 HydrophobicContact CZ-CB 4.11Å; D109-A113 WeakPolarHBondContact O-CB 3.34Å; D109-A113 PolarHBondContact O-N 3.34Å; A113-S115 VanDerWaalsContact C-N 3.26Å; A113-S115 PolarHBondContact O-N 3.2Å; A113-I116 PolarHBondContact O-N 3.07Å; A113-L117 WeakPolarHBondContact O-CB 3.48Å; A113-L117 WeakPolarHBondContact O-CG 3.15Å; A113-L117 PolarHBondContact O-N 3.24Å
114	L	81.7	Confident	82.4	Confident	28 Å²	28	50 Å²	50	15%	0.147	26%	0.262	C	S	.	.	H	α-helix	trans	-62	-33.8	173.7	-77	-178.5	0	0	0	113	F47 L55 F110 I116 L117 L118	F47-L114 HydrophobicContact CE2-CB 4.02Å; F47-L114 HydrophobicContact CZ-CB 4.09Å; L55-L114 HydrophobicContact CD1-CD1 4.42Å; L55-L114 HydrophobicContact CD2-CD1 4.03Å; F110-L114 HydrophobicContact CD1-CD1 3.93Å; F110-L114 HydrophobicContact CE1-CD1 3.37Å; F110-L114 HydrophobicContact CE1-CG 4.32Å; F110-L114 HydrophobicContact CE2-CD1 4.32Å; F110-L114 HydrophobicContact CZ-CD1 3.6Å; F110-L114 HydrophobicContact CZ-CG 4.27Å; F110-L114 WeakPolarHBondContact O-CG 3.4Å; F110-L114 PolarHBondContact O-N 3.22Å; L114-I116 VanDerWaalsContact C-N 3.33Å; L114-L117 PolarHBondContact O-N 3.38Å; L114-L118 HydrophobicContact CD2-CD1 4.47Å; L114-L118 VanDerWaalsContact O-CB 3.29Å; L114-L118 WeakPolarHBondContact O-CB 3.41Å; L114-L118 WeakPolarHBondContact O-CG 3.44Å; L114-L118 PolarHBondContact O-N 2.89Å
115	S	83.6	Confident	82.5	Confident	7 Å²	7	50.8 Å²	50.8	5%	0.049	26%	0.262	C	S	.	.	H	α-helix	trans	-63.3	-42.9	177.3	178.5	0	0	0	0	110.8	N46 F47 V111 T112 A113 R119 G120	N46-S115 PolarHBondContact N-OG 3.19Å; F47-S115 VanDerWaalsContact CE2-CA 3.5Å; V111-S115 VanDerWaalsContact O-CB 3.3Å; V111-S115 WeakPolarHBondContact O-CB 3.45Å; V111-S115 PolarHBondContact O-N 3.01Å; T112-S115 WeakPolarHBondContact O-CB 3.4Å; T112-S115 PolarHBondContact O-N 3.22Å; A113-S115 VanDerWaalsContact C-N 3.26Å; A113-S115 PolarHBondContact O-N 3.2Å; S115-R119 CarbonylContact O-C 3.54Å; S115-R119 WeakPolarHBondContact O-CA 3.47Å; S115-R119 WeakPolarHBondContact O-CB 3.45Å; S115-R119 PolarHBondContact O-N 2.82Å; S115-G120 PolarHBondContact O-N 3.01Å
116	I	83.3	Confident	82.5	Confident	44 Å²	44	51.3 Å²	51.3	23%	0.226	26%	0.264	C	S	.	.	H	α-helix	trans	-66.6	-49.5	175.5	-67.3	159.5	0	0	0	110.5	T112 A113 L114 L118 G120 E124 K125 W128	T112-I116 PolarHBondContact O-N 3.44Å; A113-I116 PolarHBondContact O-N 3.07Å; L114-I116 VanDerWaalsContact C-N 3.33Å; I116-L118 PolarHBondContact O-N 3.46Å; I116-G120 WeakPolarHBondContact O-CA 3.43Å; I116-G120 PolarHBondContact O-N 2.87Å; I116-E124 HydrophobicContact CG2-CB 3.89Å; I116-K125 WeakPolarHBondContact O-CG 3.47Å; I116-W128 HydrophobicContact CG2-CB 4.05Å; I116-W128 HydrophobicContact CG2-CG 4.42Å
117	L	79.7	Confident	82.7	Confident	21 Å²	21	50.2 Å²	50.2	11%	0.11	26%	0.261	C	S	.	.	H	α-helix	trans	-61.5	-46.2	-177.7	-75.6	174.9	0	0	0	113.3	F97 A113 L114 K125 W128 I215	F97-L117 HydrophobicContact CZ-CD1 3.96Å; A113-L117 WeakPolarHBondContact O-CB 3.48Å; A113-L117 WeakPolarHBondContact O-CG 3.15Å; A113-L117 PolarHBondContact O-N 3.24Å; L114-L117 PolarHBondContact O-N 3.38Å; L117-K125 WeakPolarHBondContact O-CE 3.49Å; L117-K125 PolarHBondContact O-NZ 2.73Å; L117-W128 HydrophobicContact CD1-CH2 3.77Å; L117-W128 HydrophobicContact CD1-CZ2 3.84Å; L117-W128 HydrophobicContact CD1-CZ3 4.24Å; L117-W128 HydrophobicContact CD2-CD2 3.85Å; L117-W128 HydrophobicContact CD2-CE3 3.47Å; L117-W128 VanDerWaalsContact CD2-CE3 3.47Å; L117-W128 HydrophobicContact CD2-CH2 3.97Å; L117-W128 HydrophobicContact CD2-CZ2 4.37Å; L117-W128 HydrophobicContact CD2-CZ3 3.55Å; L117-W128 HydrophobicContact CG-CD2 4.27Å; L117-W128 HydrophobicContact CG-CE3 4.31Å; L117-W128 HydrophobicContact CG-CH2 4.29Å; L117-W128 HydrophobicContact CG-CZ2 4.31Å; L117-W128 HydrophobicContact CG-CZ3 4.34Å; L117-I215 HydrophobicContact CD1-CG2 4.34Å
118	L	78.1	Confident	82.8	Confident	113 Å²	113	50.3 Å²	50.3	59%	0.592	26%	0.261	S	S	*	.	H	α-helix	trans	-88	-36.8	-174	-62.6	179	0	0	0	112.6	F47 L114 I116	F47-L118 HydrophobicContact CE1-CD1 4.33Å; F47-L118 HydrophobicContact CZ-CB 4.5Å; F47-L118 HydrophobicContact CZ-CD1 4.04Å; L114-L118 HydrophobicContact CD2-CD1 4.47Å; L114-L118 VanDerWaalsContact O-CB 3.29Å; L114-L118 WeakPolarHBondContact O-CB 3.41Å; L114-L118 WeakPolarHBondContact O-CG 3.44Å; L114-L118 PolarHBondContact O-N 2.89Å; I116-L118 PolarHBondContact O-N 3.46Å
119	R	79.1	Confident	83	Confident	109 Å²	109	45.4 Å²	45.4	41%	0.411	24%	0.238	S	C	.	.	H	α-helix	trans	-128.2	-1.9	-169.2	-63.1	-175.3	177.2	173.8	5.1	114.4	N46 E51 S115	N46-R119 HydrophobicContact CB-CB 3.67Å; N46-R119 HydrophobicContact CB-CG 4.33Å; N46-R119 WeakPolarHBondContact O-CD 3.07Å; N46-R119 PolarHBondContact O-NH1 2.98Å; E51-R119 VanDerWaalsContact CD-NH2 3.34Å; E51-R119 IonicContact OE1-CZ 2.74Å; E51-R119 IonicContact OE1-NH1 2.66Å; E51-R119 IonicContact OE1-NH2 3.57Å; E51-R119 PolarHBondContact OE1-NH2 3.25Å; E51-R119 IonicContact OE2-CZ 2.82Å; E51-R119 IonicContact OE2-NH1 3.43Å; E51-R119 PolarHBondContact OE2-NH1 3.06Å; E51-R119 IonicContact OE2-NH2 3.57Å; E51-R119 PolarHBondContact OE2-NH2 3.12Å; S115-R119 CarbonylContact O-C 3.54Å; S115-R119 WeakPolarHBondContact O-CA 3.47Å; S115-R119 WeakPolarHBondContact O-CB 3.45Å; S115-R119 PolarHBondContact O-N 2.82Å
120	G	78.6	Confident	83.3	Confident	12 Å²	12	43.4 Å²	43.4	12%	0.124	23%	0.227	C	C	.	.	S	Bend	trans	-68.3	159.8	176.2	0	0	0	0	0	112.3	S115 I116 E124 K125	S115-G120 PolarHBondContact O-N 3.01Å; I116-G120 WeakPolarHBondContact O-CA 3.43Å; I116-G120 PolarHBondContact O-N 2.87Å; G120-E124 WeakPolarHBondContact CA-OE2 3.44Å; G120-K125 WeakPolarHBondContact O-CE 3.29Å
121	S	85.5	Confident	83.6	Confident	57 Å²	57	44.7 Å²	44.7	40%	0.399	24%	0.236	S	C	.	.			trans	-64	161.9	169	64.6	0	0	0	0	111.3	T123 E124 K125	S121-T123 PolarHBondContact O-N 3.14Å; S121-E124 WeakPolarHBondContact CB-OE2 3.25Å; S121-E124 PolarHBondContact N-OE2 3.08Å; S121-E124 PolarHBondContact O-N 2.9Å; S121-E124 VanDerWaalsContact OG-CG 3.32Å; S121-E124 WeakPolarHBondContact OG-CG 3.45Å; S121-E124 PolarHBondContact OG-N 2.9Å; S121-E124 PolarHBondContact OG-OE2 2.91Å; S121-K125 WeakPolarHBondContact O-CG 3.33Å; S121-K125 PolarHBondContact O-N 2.99Å
122	V	82.6	Confident	83.8	Confident	80 Å²	80	45 Å²	45	49%	0.485	24%	0.238	S	C	.	.	H	α-helix	trans	-55.4	-39.2	175.8	177.7	0	0	0	0	111	K125 L126 M205	V122-K125 PolarHBondContact O-N 3Å; V122-L126 HydrophobicContact CG1-CD1 4Å; V122-L126 HydrophobicContact CG1-CG 4.28Å; V122-L126 WeakPolarHBondContact O-CB 3.34Å; V122-L126 VanDerWaalsContact O-CG 3.25Å; V122-L126 WeakPolarHBondContact O-CG 3.23Å; V122-L126 PolarHBondContact O-N 3.16Å; V122-M205 HydrophobicContact CG1-CE 3.7Å
123	T	84.4	Confident	84.1	Confident	67 Å²	67	43 Å²	43	41%	0.411	22%	0.224	S	C	.	.	H	α-helix	trans	-65.4	-44.8	178.8	-53.3	0	0	0	0	112.5	S121 K125 L126 Q127	S121-T123 PolarHBondContact O-N 3.14Å; T123-K125 VanDerWaalsContact C-N 3.32Å; T123-K125 PolarHBondContact O-N 3.46Å; T123-L126 PolarHBondContact O-N 3.33Å; T123-Q127 WeakPolarHBondContact O-CB 3.41Å; T123-Q127 PolarHBondContact O-N 3.3Å
124	E	85	Confident	84.4	Confident	85 Å²	85	43 Å²	43	40%	0.397	22%	0.223	S	C	.	.	H	α-helix	trans	-64.6	-39	177.6	-70	163.8	127.7	0	0	111.3	I116 G120 S121 Q127 W128	I116-E124 HydrophobicContact CG2-CB 3.89Å; G120-E124 WeakPolarHBondContact CA-OE2 3.44Å; S121-E124 WeakPolarHBondContact CB-OE2 3.25Å; S121-E124 PolarHBondContact N-OE2 3.08Å; S121-E124 PolarHBondContact O-N 2.9Å; S121-E124 VanDerWaalsContact OG-CG 3.32Å; S121-E124 WeakPolarHBondContact OG-CG 3.45Å; S121-E124 PolarHBondContact OG-N 2.9Å; S121-E124 PolarHBondContact OG-OE2 2.91Å; E124-Q127 PolarHBondContact O-N 3.04Å; E124-W128 WeakPolarHBondContact O-CB 3.17Å; E124-W128 PolarHBondContact O-N 3.49Å
125	K	84.8	Confident	84.7	Confident	55 Å²	55	43.8 Å²	43.8	24%	0.239	23%	0.227	C	C	.	.	H	α-helix	trans	-62.3	-50.5	174.1	-67.4	-176.5	-169	-149.8	0	111.3	I116 L117 G120 S121 V122 T123 Q127 W128 T129	I116-K125 WeakPolarHBondContact O-CG 3.47Å; L117-K125 WeakPolarHBondContact O-CE 3.49Å; L117-K125 PolarHBondContact O-NZ 2.73Å; G120-K125 WeakPolarHBondContact O-CE 3.29Å; S121-K125 WeakPolarHBondContact O-CG 3.33Å; S121-K125 PolarHBondContact O-N 2.99Å; V122-K125 PolarHBondContact O-N 3Å; T123-K125 VanDerWaalsContact C-N 3.32Å; T123-K125 PolarHBondContact O-N 3.46Å; K125-Q127 VanDerWaalsContact C-N 3.28Å; K125-Q127 PolarHBondContact O-N 3.09Å; K125-W128 CarbonylContact O-C 2.92Å; K125-W128 WeakPolarHBondContact O-CA 2.84Å; K125-W128 WeakPolarHBondContact O-CB 3.35Å; K125-W128 PolarHBondContact O-N 3.2Å; K125-T129 PolarHBondContact O-N 3.35Å; K125-T129 PolarHBondContact O-OG1 2.88Å
126	L	85.3	Confident	84.8	Confident	12 Å²	12	47.6 Å²	47.6	6%	0.063	25%	0.247	C	C	.	.	H	α-helix	trans	-58.2	-39.5	177.2	-72.8	174.7	0	0	0	112.5	V122 T123 W128 T129 F130 F194 I195 C198	V122-L126 HydrophobicContact CG1-CD1 4Å; V122-L126 HydrophobicContact CG1-CG 4.28Å; V122-L126 WeakPolarHBondContact O-CB 3.34Å; V122-L126 VanDerWaalsContact O-CG 3.25Å; V122-L126 WeakPolarHBondContact O-CG 3.23Å; V122-L126 PolarHBondContact O-N 3.16Å; T123-L126 PolarHBondContact O-N 3.33Å; L126-W128 VanDerWaalsContact C-N 3.34Å; L126-T129 PolarHBondContact O-N 3.33Å; L126-F130 WeakPolarHBondContact O-CB 3.38Å; L126-F130 PolarHBondContact O-N 3.35Å; L126-F194 HydrophobicContact CB-CE1 4.43Å; L126-F194 HydrophobicContact CD2-CE1 4.12Å; L126-F194 WeakPolarHBondContact O-CE1 3.45Å; L126-I195 HydrophobicContact CB-CG1 4.43Å; L126-C198 HydrophobicContact CD1-CB 4.01Å; L126-C198 HydrophobicContact CD2-CB 3.83Å
127	Q	87.4	Confident	84.9	Confident	88 Å²	88	49.7 Å²	49.7	41%	0.411	25%	0.252	S	S	.	.	H	α-helix	trans	-67.5	-37.9	176.5	-169.2	171	7.1	0	0	111.6	T123 E124 K125 F130 N131 L191	T123-Q127 WeakPolarHBondContact O-CB 3.41Å; T123-Q127 PolarHBondContact O-N 3.3Å; E124-Q127 PolarHBondContact O-N 3.04Å; K125-Q127 VanDerWaalsContact C-N 3.28Å; K125-Q127 PolarHBondContact O-N 3.09Å; Q127-F130 WeakPolarHBondContact O-CB 3.25Å; Q127-F130 PolarHBondContact O-N 2.99Å; Q127-N131 VanDerWaalsContact O-CG 3.27Å; Q127-N131 PolarHBondContact O-N 3.43Å; Q127-N131 VanDerWaalsContact O-N 3.07Å; Q127-N131 PolarHBondContact O-OD1 3.09Å; Q127-L191 HydrophobicContact CB-CD1 4.47Å; Q127-L191 HydrophobicContact CG-CD1 4.19Å; Q127-L191 HydrophobicContact CG-CD2 4.19Å
128	W	85.8	Confident	85.4	Confident	18 Å²	18	52.6 Å²	52.6	7%	0.068	27%	0.267	C	S	.	.	H	α-helix	trans	-67.3	-41.4	172.9	-167.2	92	0	0	0	111.9	L93 A96 F97 I116 L117 E124 K125 L126 F130 N131 L132 I215	L93-W128 HydrophobicContact CD1-CH2 3.47Å; L93-W128 VanDerWaalsContact CD1-CH2 3.47Å; L93-W128 HydrophobicContact CD1-CZ2 4.25Å; L93-W128 HydrophobicContact CD1-CZ3 4.28Å; A96-W128 HydrophobicContact CB-CZ2 4.49Å; F97-W128 AromaticContact CD2-CZ2 3.95Å; F97-W128 HydrophobicContact CD2-CZ2 3.95Å; F97-W128 AromaticContact CE2-CH2 3.92Å; F97-W128 HydrophobicContact CE2-CH2 3.92Å; F97-W128 AromaticContact CE2-CZ2 3.55Å; F97-W128 HydrophobicContact CE2-CZ2 3.55Å; F97-W128 HydrophobicContact CZ-CH2 4.4Å; F97-W128 AromaticContact CZ-CZ2 3.89Å; F97-W128 HydrophobicContact CZ-CZ2 3.89Å; I116-W128 HydrophobicContact CG2-CB 4.05Å; I116-W128 HydrophobicContact CG2-CG 4.42Å; L117-W128 HydrophobicContact CD1-CH2 3.77Å; L117-W128 HydrophobicContact CD1-CZ2 3.84Å; L117-W128 HydrophobicContact CD1-CZ3 4.24Å; L117-W128 HydrophobicContact CD2-CD2 3.85Å; L117-W128 HydrophobicContact CD2-CE3 3.47Å; L117-W128 VanDerWaalsContact CD2-CE3 3.47Å; L117-W128 HydrophobicContact CD2-CH2 3.97Å; L117-W128 HydrophobicContact CD2-CZ2 4.37Å; L117-W128 HydrophobicContact CD2-CZ3 3.55Å; L117-W128 HydrophobicContact CG-CD2 4.27Å; L117-W128 HydrophobicContact CG-CE3 4.31Å; L117-W128 HydrophobicContact CG-CH2 4.29Å; L117-W128 HydrophobicContact CG-CZ2 4.31Å; L117-W128 HydrophobicContact CG-CZ3 4.34Å; E124-W128 WeakPolarHBondContact O-CB 3.17Å; E124-W128 PolarHBondContact O-N 3.49Å; K125-W128 CarbonylContact O-C 2.92Å; K125-W128 WeakPolarHBondContact O-CA 2.84Å; K125-W128 WeakPolarHBondContact O-CB 3.35Å; K125-W128 PolarHBondContact O-N 3.2Å; L126-W128 VanDerWaalsContact C-N 3.34Å; W128-F130 VanDerWaalsContact C-N 3.3Å; W128-F130 PolarHBondContact O-N 2.91Å; W128-N131 PolarHBondContact O-N 2.88Å; W128-L132 HydrophobicContact CZ3-CD2 4.15Å; W128-L132 PolarHBondContact O-N 3.34Å; W128-I215 HydrophobicContact CH2-CD1 4.12Å; W128-I215 HydrophobicContact CZ3-CD1 3.88Å
129	T	86.3	Confident	85.9	Confident	3 Å²	3	48.8 Å²	48.8	2%	0.018	26%	0.256	C	S	.	.	H	α-helix	trans	-59.8	-42.4	172.5	-35.5	0	0	0	0	110.6	K125 L126 N131 L132 Y133 F194 L208 E212	K125-T129 PolarHBondContact O-N 3.35Å; K125-T129 PolarHBondContact O-OG1 2.88Å; L126-T129 PolarHBondContact O-N 3.33Å; T129-N131 VanDerWaalsContact C-N 3.34Å; T129-N131 PolarHBondContact O-N 3.06Å; T129-L132 WeakPolarHBondContact O-CB 3.43Å; T129-L132 PolarHBondContact O-N 3.46Å; T129-L132 VanDerWaalsContact O-N 3.12Å; T129-Y133 HydrophobicContact CG2-CD2 4.02Å; T129-Y133 HydrophobicContact CG2-CE2 3.85Å; T129-Y133 VanDerWaalsContact O-CD2 3.28Å; T129-Y133 WeakPolarHBondContact O-CD2 3.41Å; T129-Y133 PolarHBondContact O-N 3.4Å; T129-F194 HydrophobicContact CG2-CZ 4.18Å; T129-L208 HydrophobicContact CG2-CD2 4.3Å; T129-E212 PolarHBondContact OG1-OE1 3.46Å
130	F	88.6	Confident	86.5	Confident	4 Å²	4	48.9 Å²	48.9	2%	0.018	26%	0.257	C	S	.	.	H	α-helix	trans	-58.3	-48	176.4	-178.6	-87.4	0	0	0	111	L126 Q127 W128 L132 Y133 D134 G139 I141 L191 F194	L126-F130 WeakPolarHBondContact O-CB 3.38Å; L126-F130 PolarHBondContact O-N 3.35Å; Q127-F130 WeakPolarHBondContact O-CB 3.25Å; Q127-F130 PolarHBondContact O-N 2.99Å; W128-F130 VanDerWaalsContact C-N 3.3Å; W128-F130 PolarHBondContact O-N 2.91Å; F130-L132 PolarHBondContact O-N 2.91Å; F130-Y133 PolarHBondContact O-N 3.31Å; F130-D134 HydrophobicContact CD1-CB 4.45Å; F130-D134 HydrophobicContact CE1-CB 4.12Å; F130-D134 WeakPolarHBondContact O-CB 3.28Å; F130-D134 PolarHBondContact O-N 3.4Å; F130-G139 WeakPolarHBondContact CZ-O 3.48Å; F130-I141 HydrophobicContact CD2-CD1 3.33Å; F130-I141 HydrophobicContact CD2-CG1 4.07Å; F130-I141 HydrophobicContact CE2-CD1 3.37Å; F130-I141 HydrophobicContact CE2-CG1 3.65Å; F130-I141 HydrophobicContact CG-CD1 4.09Å; F130-I141 HydrophobicContact CZ-CD1 4.14Å; F130-I141 HydrophobicContact CZ-CG1 3.95Å; F130-L191 HydrophobicContact CB-CD1 3.64Å; F130-L191 HydrophobicContact CD1-CB 4.37Å; F130-L191 HydrophobicContact CD1-CD1 3.92Å; F130-L191 HydrophobicContact CD2-CB 4.3Å; F130-L191 HydrophobicContact CD2-CD1 3.92Å; F130-L191 HydrophobicContact CE1-CB 4.25Å; F130-L191 HydrophobicContact CE2-CB 4.17Å; F130-L191 HydrophobicContact CG-CB 4.41Å; F130-L191 HydrophobicContact CG-CD1 3.53Å; F130-L191 HydrophobicContact CZ-CB 4.16Å; F130-F194 HydrophobicContact CB-CD1 4.14Å; F130-F194 HydrophobicContact CB-CE1 4.3Å; F130-F194 HydrophobicContact CD2-CB 3.76Å; F130-F194 HydrophobicContact CD2-CD1 4.15Å; F130-F194 HydrophobicContact CD2-CD2 4.36Å; F130-F194 AromaticContact CD2-CG 3.85Å; F130-F194 HydrophobicContact CD2-CG 3.85Å; F130-F194 HydrophobicContact CE2-CB 4.22Å
131	N	87.8	Confident	87.1	Confident	74 Å²	74	48.3 Å²	48.3	40%	0.396	25%	0.251	S	S	.	.	H	α-helix	trans	-63.4	-26.3	177.1	-65.7	-13	0	0	0	113.4	Q127 W128 T129	Q127-N131 VanDerWaalsContact O-CG 3.27Å; Q127-N131 PolarHBondContact O-N 3.43Å; Q127-N131 VanDerWaalsContact O-N 3.07Å; Q127-N131 PolarHBondContact O-OD1 3.09Å; W128-N131 PolarHBondContact O-N 2.88Å; T129-N131 VanDerWaalsContact C-N 3.34Å; T129-N131 PolarHBondContact O-N 3.06Å
132	L	87.7	Confident	87.4	Confident	7 Å²	7	47.5 Å²	47.5	4%	0.037	24%	0.242	C	C	.	.	H	α-helix	trans	-72.3	-35.4	172.2	177.2	66	0	0	0	111.7	Y89 L93 A96 W128 T129 F130 I149	Y89-L132 HydrophobicContact CE2-CD2 4.41Å; L93-L132 HydrophobicContact CB-CD1 4.39Å; L93-L132 HydrophobicContact CD1-CD1 3.85Å; L93-L132 HydrophobicContact CD1-CD2 4.37Å; A96-L132 HydrophobicContact CB-CB 4.23Å; A96-L132 HydrophobicContact CB-CD1 3.84Å; W128-L132 HydrophobicContact CZ3-CD2 4.15Å; W128-L132 PolarHBondContact O-N 3.34Å; T129-L132 WeakPolarHBondContact O-CB 3.43Å; T129-L132 PolarHBondContact O-N 3.46Å; T129-L132 VanDerWaalsContact O-N 3.12Å; F130-L132 PolarHBondContact O-N 2.91Å; L132-I149 VanDerWaalsContact O-CD1 3.24Å; L132-I149 WeakPolarHBondContact O-CD1 3.47Å
133	Y	87.9	Confident	87.7	Confident	10 Å²	10	48.2 Å²	48.2	4%	0.039	24%	0.239	C	C	.	.	H	α-helix	trans	-80.1	-31.8	179.1	-85.1	-109.9	0	0	0	113.3	T129 F130 I135 I141 M146 I149 L208	T129-Y133 HydrophobicContact CG2-CD2 4.02Å; T129-Y133 HydrophobicContact CG2-CE2 3.85Å; T129-Y133 VanDerWaalsContact O-CD2 3.28Å; T129-Y133 WeakPolarHBondContact O-CD2 3.41Å; T129-Y133 PolarHBondContact O-N 3.4Å; F130-Y133 PolarHBondContact O-N 3.31Å; Y133-I135 PolarHBondContact O-N 2.98Å; Y133-I135 VanDerWaalsContact O-N 3.14Å; Y133-I141 VanDerWaalsContact CB-CD1 3.5Å; Y133-I141 HydrophobicContact CG-CD1 4.43Å; Y133-M146 HydrophobicContact CD1-CG 4.36Å; Y133-M146 HydrophobicContact CE1-CG 4.29Å; Y133-I149 HydrophobicContact CD1-CB 4.29Å; Y133-I149 HydrophobicContact CD1-CG1 4.45Å; Y133-I149 HydrophobicContact CD1-CG2 4.1Å; Y133-I149 HydrophobicContact CD2-CG2 4.28Å; Y133-I149 HydrophobicContact CE1-CB 4.3Å; Y133-I149 HydrophobicContact CE1-CG2 3.82Å; Y133-I149 HydrophobicContact CE2-CG2 4.03Å; Y133-I149 HydrophobicContact CG-CG2 4.33Å; Y133-L208 HydrophobicContact CE2-CD2 3.92Å; Y133-L208 WeakPolarHBondContact OH-CD2 3.46Å
134	D	89.9	Confident	88	Confident	8 Å²	8	52.2 Å²	52.2	4%	0.043	25%	0.253	C	S	.	.			trans	-78.7	85.9	174.6	179	5.1	0	0	0	110.2	F130 N136 R137 D138 G139 I141	F130-D134 HydrophobicContact CD1-CB 4.45Å; F130-D134 HydrophobicContact CE1-CB 4.12Å; F130-D134 WeakPolarHBondContact O-CB 3.28Å; F130-D134 PolarHBondContact O-N 3.4Å; D134-N136 PolarHBondContact OD1-OD1 3.4Å; D134-R137 VanDerWaalsContact CG-CA 3.48Å; D134-R137 WeakPolarHBondContact OD1-CA 3.36Å; D134-R137 PolarHBondContact OD1-N 3.39Å; D134-R137 WeakPolarHBondContact OD2-CA 3.3Å; D134-D138 PolarHBondContact OD1-N 3.49Å; D134-G139 VanDerWaalsContact OD2-CA 3.28Å; D134-G139 WeakPolarHBondContact OD2-CA 3.28Å; D134-G139 PolarHBondContact OD2-N 3.46Å; D134-I141 HydrophobicContact CB-CG1 4.18Å
135	I	87.2	Confident	88.2	Confident	46 Å²	46	48.7 Å²	48.7	24%	0.236	24%	0.237	C	C	.	.	S	Bend	trans	-68.1	-41.4	-173.6	-62.5	170.4	0	0	0	110.8	Y92 Y133 E145 D148 I149	Y92-I135 HydrophobicContact CD1-CD1 3.99Å; Y92-I135 HydrophobicContact CD1-CG1 3.94Å; Y92-I135 HydrophobicContact CD1-CG2 4.03Å; Y92-I135 HydrophobicContact CE1-CD1 3.54Å; Y92-I135 HydrophobicContact CE1-CG1 3.97Å; Y92-I135 HydrophobicContact CE1-CG2 3.83Å; Y92-I135 HydrophobicContact CE2-CD1 4.39Å; Y133-I135 PolarHBondContact O-N 2.98Å; Y133-I135 VanDerWaalsContact O-N 3.14Å; I135-E145 HydrophobicContact CB-CG 4.19Å; I135-E145 HydrophobicContact CD1-CB 4.07Å; I135-E145 HydrophobicContact CD1-CG 4.19Å; I135-E145 HydrophobicContact CG1-CB 4.34Å; I135-E145 HydrophobicContact CG1-CG 4.36Å; I135-E145 PolarHBondContact N-OE1 2.89Å; I135-D148 HydrophobicContact CD1-CB 3.93Å; I135-I149 HydrophobicContact CD1-CD1 4.27Å; I135-I149 HydrophobicContact CD1-CG1 4.15Å; I135-I149 HydrophobicContact CG1-CD1 4.17Å; I135-I149 HydrophobicContact CG1-CG1 4.32Å
136	N	86.8	Confident	88.3	Confident	86 Å²	86	46.3 Å²	46.3	46%	0.46	23%	0.226	S	C	.	.	S	Bend	trans	-85.1	-10.1	-176.2	75.7	7.7	0	0	0	113.4	D134 D138 E145	D134-N136 PolarHBondContact OD1-OD1 3.4Å; N136-D138 VanDerWaalsContact C-N 3.32Å; N136-D138 PolarHBondContact ND2-OD2 2.91Å; N136-D138 VanDerWaalsContact OD1-CB 3.28Å; N136-D138 WeakPolarHBondContact OD1-CB 3.4Å; N136-D138 PolarHBondContact OD1-N 3.36Å; N136-D138 PolarHBondContact OD1-OD1 3.11Å; N136-D138 PolarHBondContact OD1-OD2 2.75Å; N136-E145 WeakPolarHBondContact CB-OE1 3.47Å; N136-E145 PolarHBondContact N-OE1 3.07Å; N136-E145 VanDerWaalsContact N-OE1 3.09Å; N136-E145 PolarHBondContact ND2-OE1 3.33Å; N136-E145 PolarHBondContact OD1-OE1 3.44Å
137	R	85.6	Confident	88.4	Confident	88 Å²	88	47.3 Å²	47.3	33%	0.332	23%	0.233	S	C	.	.			trans	60	35.2	-178.3	-56.9	-168.7	-175.4	170.7	7.4	114.2	N95 D98 T99 N101 D134 G139	N95-R137 PolarHBondContact O-NH2 3.03Å; D98-R137 PolarHBondContact O-NH2 2.86Å; T99-R137 PolarHBondContact O-NH1 2.6Å; N101-R137 PolarHBondContact OD1-NH1 3.05Å; N101-R137 VanDerWaalsContact OD1-NH1 3.11Å; N101-R137 PolarHBondContact OD1-NH2 2.61Å; N101-R137 VanDerWaalsContact OD1-NH2 3.12Å; D134-R137 VanDerWaalsContact CG-CA 3.48Å; D134-R137 WeakPolarHBondContact OD1-CA 3.36Å; D134-R137 PolarHBondContact OD1-N 3.39Å; D134-R137 WeakPolarHBondContact OD2-CA 3.3Å; R137-G139 VanDerWaalsContact C-N 3.26Å
138	D	88.4	Confident	88.4	Confident	82 Å²	82	45.3 Å²	45.3	44%	0.439	23%	0.225	S	C	.	.	S	Bend	trans	-83.8	-4.7	175.6	72.3	15.9	0	0	0	112.9	D134 N136 Y140	D134-D138 PolarHBondContact OD1-N 3.49Å; N136-D138 VanDerWaalsContact C-N 3.32Å; N136-D138 PolarHBondContact ND2-OD2 2.91Å; N136-D138 VanDerWaalsContact OD1-CB 3.28Å; N136-D138 WeakPolarHBondContact OD1-CB 3.4Å; N136-D138 PolarHBondContact OD1-N 3.36Å; N136-D138 PolarHBondContact OD1-OD1 3.11Å; N136-D138 PolarHBondContact OD1-OD2 2.75Å; D138-Y140 VanDerWaalsContact O-CD2 3.25Å; D138-Y140 WeakPolarHBondContact O-CD2 3.5Å; D138-Y140 WeakPolarHBondContact O-CE2 3.37Å; D138-Y140 WeakPolarHBondContact OD1-CA 3.34Å; D138-Y140 VanDerWaalsContact OD1-CB 3.31Å; D138-Y140 WeakPolarHBondContact OD1-CB 3.47Å; D138-Y140 PolarHBondContact OD1-N 2.71Å
139	G	89.1	Confident	88.4	Confident	34 Å²	34	44.5 Å²	44.5	35%	0.351	22%	0.222	S	C	.	.	S	Bend	trans	87.5	8.4	-178.4	0	0	0	0	0	113.6	F130 D134 R137	F130-G139 WeakPolarHBondContact CZ-O 3.48Å; D134-G139 VanDerWaalsContact OD2-CA 3.28Å; D134-G139 WeakPolarHBondContact OD2-CA 3.28Å; D134-G139 PolarHBondContact OD2-N 3.46Å; R137-G139 VanDerWaalsContact C-N 3.26Å
140	Y	92.8	Very high	88.2	Confident	111 Å²	111	44.6 Å²	44.6	44%	0.435	22%	0.222	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.6	136.8	-179.4	-55.5	-89.8	0	0	0	110.1	D138 V188 T190	D138-Y140 VanDerWaalsContact O-CD2 3.25Å; D138-Y140 WeakPolarHBondContact O-CD2 3.5Å; D138-Y140 WeakPolarHBondContact O-CE2 3.37Å; D138-Y140 WeakPolarHBondContact OD1-CA 3.34Å; D138-Y140 VanDerWaalsContact OD1-CB 3.31Å; D138-Y140 WeakPolarHBondContact OD1-CB 3.47Å; D138-Y140 PolarHBondContact OD1-N 2.71Å; Y140-V188 HydrophobicContact CD1-CB 4.33Å; Y140-V188 HydrophobicContact CD1-CG2 3.84Å; Y140-V188 HydrophobicContact CG-CG2 4.47Å; Y140-T190 HydrophobicContact CD1-CG2 3.71Å; Y140-T190 HydrophobicContact CE1-CG2 3.66Å
141	I	91.4	Very high	87.9	Confident	0 Å²	0	50 Å²	50	0%	0	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.1	113.4	172.4	-59.3	162.8	0	0	0	108	F130 Y133 D134 M146 V189 F194	F130-I141 HydrophobicContact CD2-CD1 3.33Å; F130-I141 HydrophobicContact CD2-CG1 4.07Å; F130-I141 HydrophobicContact CE2-CD1 3.37Å; F130-I141 HydrophobicContact CE2-CG1 3.65Å; F130-I141 HydrophobicContact CG-CD1 4.09Å; F130-I141 HydrophobicContact CZ-CD1 4.14Å; F130-I141 HydrophobicContact CZ-CG1 3.95Å; Y133-I141 VanDerWaalsContact CB-CD1 3.5Å; Y133-I141 HydrophobicContact CG-CD1 4.43Å; D134-I141 HydrophobicContact CB-CG1 4.18Å; I141-M146 HydrophobicContact CG2-CB 4.16Å; I141-M146 HydrophobicContact CG2-CE 4.17Å; I141-V189 HydrophobicContact CB-CB 4.28Å; I141-V189 PolarHBondContact N-O 3.24Å; I141-V189 PolarHBondContact O-N 2.88Å; I141-F194 HydrophobicContact CD1-CD2 4.23Å
142	N	91.4	Very high	87.7	Confident	39 Å²	39	46.5 Å²	46.5	21%	0.209	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.9	167.8	172.1	73	56	0	0	0	111.5	E144 E145 M146	N142-E144 VanDerWaalsContact C-N 3.27Å; N142-E144 PolarHBondContact O-N 3.01Å; N142-E144 WeakPolarHBondContact OD1-CA 3.31Å; N142-E144 WeakPolarHBondContact OD1-CB 3.39Å; N142-E144 PolarHBondContact OD1-N 3.33Å; N142-E145 VanDerWaalsContact CG-OE2 3.23Å; N142-E145 PolarHBondContact N-OE2 3.04Å; N142-E145 PolarHBondContact ND2-OE2 3Å; N142-E145 PolarHBondContact O-N 3.41Å; N142-E145 WeakPolarHBondContact OD1-CG 3.44Å; N142-E145 PolarHBondContact OD1-N 3.4Å; N142-M146 PolarHBondContact O-N 2.8Å; N142-M146 VanDerWaalsContact O-N 3.09Å
143	K	88.8	Confident	87.2	Confident	96 Å²	96	46.3 Å²	46.3	42%	0.417	22%	0.223	S	C	.	.	H	α-helix	trans	-64.7	-30.9	-176.8	-172.8	176	179.5	174.6	0	113.3	T147 V174 D175 F178	K143-T147 WeakPolarHBondContact O-CB 3.24Å; K143-T147 PolarHBondContact O-N 3.01Å; K143-T147 VanDerWaalsContact O-N 3.08Å; K143-T147 PolarHBondContact O-OG1 2.83Å; K143-V174 HydrophobicContact CG-CG1 4.23Å; K143-D175 WeakPolarHBondContact CE-OD1 3.31Å; K143-D175 IonicContact NZ-OD1 3.92Å; K143-D175 PolarHBondContact NZ-OD1 3.28Å; K143-F178 HydrophobicContact CB-CD2 4.08Å; K143-F178 HydrophobicContact CB-CE2 3.94Å; K143-F178 HydrophobicContact CB-CG 4.49Å; K143-F178 HydrophobicContact CB-CZ 4.22Å; K143-F178 HydrophobicContact CG-CD2 4.39Å
144	E	89.6	Confident	86.6	Confident	151 Å²	151	47.4 Å²	47.4	71%	0.706	23%	0.227	S	C	*	.	H	α-helix	trans	-69.6	-45.8	178.4	-59.7	-173.2	166.7	0	0	110.1	N142 M146 T147 D148	N142-E144 VanDerWaalsContact C-N 3.27Å; N142-E144 PolarHBondContact O-N 3.01Å; N142-E144 WeakPolarHBondContact OD1-CA 3.31Å; N142-E144 WeakPolarHBondContact OD1-CB 3.39Å; N142-E144 PolarHBondContact OD1-N 3.33Å; E144-M146 PolarHBondContact O-N 3.26Å; E144-T147 CarbonylContact O-C 3.35Å; E144-T147 WeakPolarHBondContact O-CA 3.36Å; E144-T147 WeakPolarHBondContact O-CB 3.28Å; E144-T147 PolarHBondContact O-N 3.29Å; E144-D148 PolarHBondContact O-N 3Å
145	E	89.9	Confident	86	Confident	11 Å²	11	50.5 Å²	50.5	5%	0.051	24%	0.244	C	C	.	.	H	α-helix	trans	-61.2	-45.7	177.3	-67.7	171.9	138	0	0	112	I135 N136 N142 T147 D148 I149	I135-E145 HydrophobicContact CB-CG 4.19Å; I135-E145 HydrophobicContact CD1-CB 4.07Å; I135-E145 HydrophobicContact CD1-CG 4.19Å; I135-E145 HydrophobicContact CG1-CB 4.34Å; I135-E145 HydrophobicContact CG1-CG 4.36Å; I135-E145 PolarHBondContact N-OE1 2.89Å; N136-E145 WeakPolarHBondContact CB-OE1 3.47Å; N136-E145 PolarHBondContact N-OE1 3.07Å; N136-E145 VanDerWaalsContact N-OE1 3.09Å; N136-E145 PolarHBondContact ND2-OE1 3.33Å; N136-E145 PolarHBondContact OD1-OE1 3.44Å; N142-E145 VanDerWaalsContact CG-OE2 3.23Å; N142-E145 PolarHBondContact N-OE2 3.04Å; N142-E145 PolarHBondContact ND2-OE2 3Å; N142-E145 PolarHBondContact O-N 3.41Å; N142-E145 WeakPolarHBondContact OD1-CG 3.44Å; N142-E145 PolarHBondContact OD1-N 3.4Å; E145-T147 PolarHBondContact O-N 3.47Å; E145-D148 PolarHBondContact O-N 2.96Å; E145-D148 VanDerWaalsContact O-N 3.16Å; E145-I149 WeakPolarHBondContact O-CG1 3.46Å; E145-I149 PolarHBondContact O-N 3.46Å
146	M	87.6	Confident	85.4	Confident	4 Å²	4	48.5 Å²	48.5	2%	0.02	23%	0.233	C	C	.	.	H	α-helix	trans	-60.1	-37.3	174.5	-170.7	175.4	-75	0	0	111.6	Y133 I141 N142 E144 V150 V174 F177 F178 M181	Y133-M146 HydrophobicContact CD1-CG 4.36Å; Y133-M146 HydrophobicContact CE1-CG 4.29Å; I141-M146 HydrophobicContact CG2-CB 4.16Å; I141-M146 HydrophobicContact CG2-CE 4.17Å; N142-M146 PolarHBondContact O-N 2.8Å; N142-M146 VanDerWaalsContact O-N 3.09Å; E144-M146 PolarHBondContact O-N 3.26Å; M146-V150 WeakPolarHBondContact O-CB 3.41Å; M146-V150 VanDerWaalsContact O-CG2 3.23Å; M146-V150 WeakPolarHBondContact O-CG2 3.44Å; M146-V150 PolarHBondContact O-N 2.82Å; M146-V150 VanDerWaalsContact O-N 3.09Å; M146-V174 HydrophobicContact CB-CG1 4.11Å; M146-V174 HydrophobicContact CG-CG1 3.93Å; M146-V174 HydrophobicContact CG-CG2 4.31Å; M146-V174 HydrophobicContact SD-CG1 4.05Å; M146-F177 HydrophobicContact SD-CB 4.02Å; M146-F178 HydrophobicContact CE-CD2 4.14Å; M146-F178 HydrophobicContact SD-CB 4.3Å; M146-F178 HydrophobicContact SD-CD2 4Å; M146-M181 HydrophobicContact CE-SD 3.77Å
147	T	86.4	Confident	84.5	Confident	33 Å²	33	47.9 Å²	47.9	20%	0.202	23%	0.229	C	C	.	.	H	α-helix	trans	-66.6	-42.1	176.4	-58.3	0	0	0	0	111.8	K143 E144 E145 R151	K143-T147 WeakPolarHBondContact O-CB 3.24Å; K143-T147 PolarHBondContact O-N 3.01Å; K143-T147 VanDerWaalsContact O-N 3.08Å; K143-T147 PolarHBondContact O-OG1 2.83Å; E144-T147 CarbonylContact O-C 3.35Å; E144-T147 WeakPolarHBondContact O-CA 3.36Å; E144-T147 WeakPolarHBondContact O-CB 3.28Å; E144-T147 PolarHBondContact O-N 3.29Å; E145-T147 PolarHBondContact O-N 3.47Å; T147-R151 VanDerWaalsContact O-CB 3.28Å; T147-R151 WeakPolarHBondContact O-CB 3.39Å; T147-R151 PolarHBondContact O-N 2.87Å
148	D	87.9	Confident	83.5	Confident	47 Å²	47	44.7 Å²	44.7	25%	0.251	22%	0.224	S	C	.	.	H	α-helix	trans	-65.8	-43.3	-179.3	-81.3	-22.9	0	0	0	112.1	Y92 I135 E144 E145 R151 A152	Y92-D148 HydrophobicContact CE2-CB 4.44Å; I135-D148 HydrophobicContact CD1-CB 3.93Å; E144-D148 PolarHBondContact O-N 3Å; E145-D148 PolarHBondContact O-N 2.96Å; E145-D148 VanDerWaalsContact O-N 3.16Å; D148-R151 PolarHBondContact O-N 3.28Å; D148-R151 IonicContact OD1-CZ 3.59Å; D148-R151 IonicContact OD1-NH1 2.69Å; D148-R151 IonicContact OD1-NH2 2.84Å; D148-R151 PolarHBondContact OD1-NH2 3.3Å; D148-A152 WeakPolarHBondContact O-CB 3.33Å; D148-A152 PolarHBondContact O-N 2.99Å
149	I	85.5	Confident	81.8	Confident	0 Å²	0	49.9 Å²	49.9	0%	0	24%	0.242	C	C	.	.	H	α-helix	trans	-63.4	-49.4	175.3	-65.1	-72	0	0	0	111.1	Y92 L132 Y133 I135 E145 R151 A152 I153	Y92-I149 HydrophobicContact CD1-CD1 4.45Å; Y92-I149 HydrophobicContact CD2-CD1 3.56Å; Y92-I149 HydrophobicContact CE2-CD1 4.21Å; Y92-I149 HydrophobicContact CG-CD1 3.69Å; L132-I149 VanDerWaalsContact O-CD1 3.24Å; L132-I149 WeakPolarHBondContact O-CD1 3.47Å; Y133-I149 HydrophobicContact CD1-CB 4.29Å; Y133-I149 HydrophobicContact CD1-CG1 4.45Å; Y133-I149 HydrophobicContact CD1-CG2 4.1Å; Y133-I149 HydrophobicContact CD2-CG2 4.28Å; Y133-I149 HydrophobicContact CE1-CB 4.3Å; Y133-I149 HydrophobicContact CE1-CG2 3.82Å; Y133-I149 HydrophobicContact CE2-CG2 4.03Å; Y133-I149 HydrophobicContact CG-CG2 4.33Å; I135-I149 HydrophobicContact CD1-CD1 4.27Å; I135-I149 HydrophobicContact CD1-CG1 4.15Å; I135-I149 HydrophobicContact CG1-CD1 4.17Å; I135-I149 HydrophobicContact CG1-CG1 4.32Å; E145-I149 WeakPolarHBondContact O-CG1 3.46Å; E145-I149 PolarHBondContact O-N 3.46Å; I149-R151 VanDerWaalsContact C-N 3.31Å; I149-R151 PolarHBondContact O-N 2.89Å; I149-A152 PolarHBondContact O-N 3.46Å; I149-I153 HydrophobicContact CG2-CD1 3.9Å; I149-I153 WeakPolarHBondContact O-CG1 3.43Å; I149-I153 PolarHBondContact O-N 3.17Å
150	V	82.1	Confident	79.9	Confident	5 Å²	5	56.3 Å²	56.3	3%	0.03	26%	0.257	C	S	.	.	H	α-helix	trans	-61.3	-42.7	179.4	172.4	0	0	0	0	110.2	M146 A152 I153 Y154 P170 V174	M146-V150 WeakPolarHBondContact O-CB 3.41Å; M146-V150 VanDerWaalsContact O-CG2 3.23Å; M146-V150 WeakPolarHBondContact O-CG2 3.44Å; M146-V150 PolarHBondContact O-N 2.82Å; M146-V150 VanDerWaalsContact O-N 3.09Å; V150-A152 PolarHBondContact O-N 3.1Å; V150-I153 PolarHBondContact O-N 3Å; V150-Y154 HydrophobicContact CG1-CD2 3.88Å; V150-Y154 HydrophobicContact CG1-CE2 3.55Å; V150-Y154 WeakPolarHBondContact O-CD2 3.32Å; V150-Y154 PolarHBondContact O-N 3.28Å; V150-P170 HydrophobicContact CG1-CB 4.21Å; V150-V174 HydrophobicContact CB-CG2 3.88Å; V150-V174 HydrophobicContact CG1-CG2 4.13Å; V150-V174 HydrophobicContact CG2-CG2 3.81Å
151	R	82.1	Confident	77.8	Confident	118 Å²	118	51.8 Å²	51.8	45%	0.445	24%	0.241	S	C	.	.	H	α-helix	trans	-60.9	-46.1	175.6	-174.6	-178.5	65.4	-147.4	-12.6	111.6	T147 D148 I149 I153 Y154 D155	T147-R151 VanDerWaalsContact O-CB 3.28Å; T147-R151 WeakPolarHBondContact O-CB 3.39Å; T147-R151 PolarHBondContact O-N 2.87Å; D148-R151 PolarHBondContact O-N 3.28Å; D148-R151 IonicContact OD1-CZ 3.59Å; D148-R151 IonicContact OD1-NH1 2.69Å; D148-R151 IonicContact OD1-NH2 2.84Å; D148-R151 PolarHBondContact OD1-NH2 3.3Å; I149-R151 VanDerWaalsContact C-N 3.31Å; I149-R151 PolarHBondContact O-N 2.89Å; R151-I153 VanDerWaalsContact C-N 3.28Å; R151-I153 PolarHBondContact O-N 2.96Å; R151-Y154 WeakPolarHBondContact O-CB 3.35Å; R151-Y154 PolarHBondContact O-N 3.2Å; R151-D155 PolarHBondContact O-N 3.28Å
152	A	83.1	Confident	75.2	Confident	0 Å²	0	62.3 Å²	62.3	0%	0	28%	0.282	C	S	.	.	H	α-helix	trans	-60.3	-37.9	179.6	0	0	0	0	0	112.6	T88 Y89 Y92 D148 I149 V150 D155 M156	T88-A152 HydrophobicContact CG2-CB 3.91Å; Y89-A152 HydrophobicContact CD2-CB 4.47Å; Y92-A152 HydrophobicContact CD2-CB 4.07Å; Y92-A152 HydrophobicContact CE2-CB 3.92Å; D148-A152 WeakPolarHBondContact O-CB 3.33Å; D148-A152 PolarHBondContact O-N 2.99Å; I149-A152 PolarHBondContact O-N 3.46Å; V150-A152 PolarHBondContact O-N 3.1Å; A152-D155 PolarHBondContact O-N 3.3Å; A152-M156 WeakPolarHBondContact O-CB 3.08Å; A152-M156 PolarHBondContact O-N 3.48Å
153	I	78.6	Confident	73	Confident	3 Å²	3	65 Å²	65	2%	0.015	30%	0.302	C	S	.	.	H	α-helix	trans	-65.9	-42.6	174.1	-66.5	164.8	0	0	0	111	Y89 I149 V150 R151 D155 M156 M157 F211	Y89-I153 HydrophobicContact CD2-CG1 3.7Å; Y89-I153 HydrophobicContact CE2-CD1 4.14Å; Y89-I153 HydrophobicContact CE2-CG1 3.62Å; I149-I153 HydrophobicContact CG2-CD1 3.9Å; I149-I153 WeakPolarHBondContact O-CG1 3.43Å; I149-I153 PolarHBondContact O-N 3.17Å; V150-I153 PolarHBondContact O-N 3Å; R151-I153 VanDerWaalsContact C-N 3.28Å; R151-I153 PolarHBondContact O-N 2.96Å; I153-D155 VanDerWaalsContact C-N 3.34Å; I153-D155 PolarHBondContact O-N 2.97Å; I153-M156 HydrophobicContact CG2-CE 4.4Å; I153-M156 PolarHBondContact O-N 3.09Å; I153-M157 HydrophobicContact CG2-CG 4.36Å; I153-M157 HydrophobicContact CG2-SD 3.98Å; I153-M157 WeakPolarHBondContact O-CG 3.35Å; I153-M157 PolarHBondContact O-N 3.47Å; I153-F211 HydrophobicContact CD1-CB 4.1Å; I153-F211 HydrophobicContact CD1-CD1 3.87Å; I153-F211 HydrophobicContact CD1-CD2 4.34Å; I153-F211 HydrophobicContact CD1-CE1 4.37Å; I153-F211 HydrophobicContact CD1-CG 3.85Å; I153-F211 HydrophobicContact CG2-CD1 3.59Å; I153-F211 HydrophobicContact CG2-CE1 3.68Å
154	Y	74.6	Confident	70.9	Confident	34 Å²	34	65.4 Å²	65.4	13%	0.133	31%	0.312	C	S	.	.	H	α-helix	trans	-63.4	-40.9	177.3	-86	-118.4	0	0	0	111.7	V150 R151 M156 M157 G158 L165 P170	V150-Y154 HydrophobicContact CG1-CD2 3.88Å; V150-Y154 HydrophobicContact CG1-CE2 3.55Å; V150-Y154 WeakPolarHBondContact O-CD2 3.32Å; V150-Y154 PolarHBondContact O-N 3.28Å; R151-Y154 WeakPolarHBondContact O-CB 3.35Å; R151-Y154 PolarHBondContact O-N 3.2Å; Y154-M156 VanDerWaalsContact C-N 3.34Å; Y154-M157 PolarHBondContact O-N 3.48Å; Y154-G158 PolarHBondContact O-N 2.85Å; Y154-L165 HydrophobicContact CE1-CB 3.79Å; Y154-L165 HydrophobicContact CE1-CD1 4.29Å; Y154-L165 WeakPolarHBondContact OH-CD1 3.3Å; Y154-P170 HydrophobicContact CD1-CG 4.06Å; Y154-P170 HydrophobicContact CE1-CG 3.93Å; Y154-P170 HydrophobicContact CG-CG 4.48Å
155	D	77.5	Confident	68.9	Low	72 Å²	72	62 Å²	62	39%	0.385	30%	0.298	S	S	.	.	H	α-helix	trans	-65.5	-38.7	176.8	-67.6	-24.5	0	0	0	111.3	D85 R151 A152 I153 G158	D85-D155 PolarHBondContact N-O 3.43Å; D85-D155 CarbonylContact O-C 3.57Å; R151-D155 PolarHBondContact O-N 3.28Å; A152-D155 PolarHBondContact O-N 3.3Å; I153-D155 VanDerWaalsContact C-N 3.34Å; I153-D155 PolarHBondContact O-N 2.97Å; D155-G158 PolarHBondContact O-N 3.27Å
156	M	73.9	Confident	66.8	Low	4 Å²	4	69.6 Å²	69.6	2%	0.02	33%	0.331	C	S	.	.	H	α-helix	trans	-66.1	-44.1	174.9	179.8	-173.3	65.3	0	0	112.8	F81 D85 A86 Y89 A152 I153 Y154 G158 V214	F81-M156 HydrophobicContact CB-CG 4.45Å; F81-M156 HydrophobicContact CD1-CG 3.93Å; F81-M156 HydrophobicContact CD1-SD 4.47Å; F81-M156 HydrophobicContact CD2-CG 4.15Å; F81-M156 HydrophobicContact CD2-SD 4.18Å; F81-M156 HydrophobicContact CE1-CG 4.21Å; F81-M156 HydrophobicContact CE1-SD 4.23Å; F81-M156 HydrophobicContact CE2-CG 4.43Å; F81-M156 HydrophobicContact CE2-SD 3.93Å; F81-M156 HydrophobicContact CG-CG 3.91Å; F81-M156 HydrophobicContact CG-SD 4.46Å; F81-M156 HydrophobicContact CZ-CG 4.46Å; F81-M156 HydrophobicContact CZ-SD 3.96Å; D85-M156 PolarHBondContact O-N 2.87Å; A86-M156 HydrophobicContact CB-CB 4.47Å; A86-M156 HydrophobicContact CB-CG 3.89Å; Y89-M156 HydrophobicContact CD1-CE 4.23Å; Y89-M156 HydrophobicContact CD1-SD 3.56Å; Y89-M156 VanDerWaalsContact CD1-SD 3.56Å; Y89-M156 HydrophobicContact CE1-CE 4.39Å; Y89-M156 HydrophobicContact CE1-SD 4.12Å; Y89-M156 HydrophobicContact CG-SD 4.09Å; A152-M156 WeakPolarHBondContact O-CB 3.08Å; A152-M156 PolarHBondContact O-N 3.48Å; I153-M156 HydrophobicContact CG2-CE 4.4Å; I153-M156 PolarHBondContact O-N 3.09Å; Y154-M156 VanDerWaalsContact C-N 3.34Å; M156-G158 PolarHBondContact O-N 3.44Å; M156-V214 HydrophobicContact CE-CB 4.41Å; M156-V214 HydrophobicContact CE-CG1 3.39Å; M156-V214 HydrophobicContact SD-CG1 4.28Å
157	M	68.2	Low	65.2	Low	73 Å²	73	76.2 Å²	76.2	36%	0.36	37%	0.372	S	S	.	.	H	α-helix	trans	-74	-16.1	178.7	-66.1	-177.5	79.4	0	0	112.7	I153 Y154 T161	I153-M157 HydrophobicContact CG2-CG 4.36Å; I153-M157 HydrophobicContact CG2-SD 3.98Å; I153-M157 WeakPolarHBondContact O-CG 3.35Å; I153-M157 PolarHBondContact O-N 3.47Å; Y154-M157 PolarHBondContact O-N 3.48Å; M157-T161 HydrophobicContact CB-CG2 3.78Å; M157-T161 HydrophobicContact CE-CG2 4.09Å; M157-T161 HydrophobicContact SD-CG2 4Å
158	G	64.6	Low	63.6	Low	22 Å²	22	80.3 Å²	80.3	23%	0.227	39%	0.393	C	S	.	.	G	3₁₀ helix	trans	60	-155.4	179.8	0	0	0	0	0	113.3	Y154 D155 M156 Y160	Y154-G158 PolarHBondContact O-N 2.85Å; D155-G158 PolarHBondContact O-N 3.27Å; M156-G158 PolarHBondContact O-N 3.44Å; G158-Y160 PolarHBondContact O-N 2.87Å
159	K	52.6	Low	62.4	Low	191 Å²	191	78.7 Å²	78.7	83%	0.83	39%	0.386	S	S	*	.	G	3₁₀ helix	trans	-71	6.2	-178.7	-66.9	-177	-179.3	175.6	0	114.8
160	Y	49.9	Very low	61.5	Low	169 Å²	169	80 Å²	80	66%	0.663	39%	0.394	S	S	*	.	G	3₁₀ helix	trans	-110.7	21.6	-173.2	-63.2	-75.7	0	0	0	113.8	G158 Y162	G158-Y160 PolarHBondContact O-N 2.87Å; Y160-Y162 PolarHBondContact O-N 3.29Å; Y160-Y162 VanDerWaalsContact O-N 3.07Å
161	T	47.9	Very low	61.1	Low	16 Å²	16	86.7 Å²	86.7	10%	0.098	42%	0.423	C	S	.	.			trans	-59.7	116.2	158.9	52.2	0	0	0	0	107.5	M157 P163 V164	M157-T161 HydrophobicContact CB-CG2 3.78Å; M157-T161 HydrophobicContact CE-CG2 4.09Å; M157-T161 HydrophobicContact SD-CG2 4Å; T161-P163 VanDerWaalsContact C-C 3.5Å; T161-P163 CarbonylContact C-O 3.41Å; T161-P163 CarbonylContact O-C 3.6Å; T161-P163 VanDerWaalsContact O-O 3.11Å; T161-V164 VanDerWaalsContact O-CA 3.26Å; T161-V164 WeakPolarHBondContact O-CA 3.28Å; T161-V164 PolarHBondContact O-N 3.41Å
162	Y	37.2	Very low	60.8	Low	221 Å²	221	87.4 Å²	87.4	87%	0.867	43%	0.431	S	S	*	.	S	Bend	trans	-102.3	111.3	167.3	-113.6	-89.6	0	0	0	106.9	Y160	Y160-Y162 PolarHBondContact O-N 3.29Å; Y160-Y162 VanDerWaalsContact O-N 3.07Å
163	P	45.6	Very low	60.5	Low	95 Å²	95	89.8 Å²	89.8	62%	0.617	44%	0.442	S	S	*	.	S	Bend	cis	-80.6	152.4	3.4	30.9	-27	0	0	0	112.9	T161 L165	T161-P163 VanDerWaalsContact C-C 3.5Å; T161-P163 CarbonylContact C-O 3.41Å; T161-P163 CarbonylContact O-C 3.6Å; T161-P163 VanDerWaalsContact O-O 3.11Å; P163-L165 PolarHBondContact O-N 3.19Å
164	V	43.4	Very low	60.7	Low	105 Å²	105	89.6 Å²	89.6	64%	0.636	44%	0.441	S	S	*	.			trans	-61.8	98.9	175.1	174.8	0	0	0	0	107.7	T161 K166	T161-V164 VanDerWaalsContact O-CA 3.26Å; T161-V164 WeakPolarHBondContact O-CA 3.28Å; T161-V164 PolarHBondContact O-N 3.41Å; V164-K166 PolarHBondContact O-N 3.23Å
165	L	48.3	Very low	61.3	Low	79 Å²	79	91.2 Å²	91.2	41%	0.414	45%	0.452	S	S	.	.			trans	-75.3	119.4	178.4	-79.7	157.6	0	0	0	107.4	Y154 P163 A169	Y154-L165 HydrophobicContact CE1-CB 3.79Å; Y154-L165 HydrophobicContact CE1-CD1 4.29Å; Y154-L165 WeakPolarHBondContact OH-CD1 3.3Å; P163-L165 PolarHBondContact O-N 3.19Å; L165-A169 HydrophobicContact CB-CB 3.72Å; L165-A169 HydrophobicContact CD2-CB 3.92Å; L165-A169 HydrophobicContact CG-CB 4.41Å
166	K	46.3	Very low	61.5	Low	171 Å²	171	90 Å²	90	74%	0.743	45%	0.452	S	S	*	.			trans	-51.6	155.1	-178.8	-68	178.6	177.8	178.2	0	110.6	V164 D168 A169	V164-K166 PolarHBondContact O-N 3.23Å; K166-D168 PolarHBondContact O-N 3.17Å; K166-A169 WeakPolarHBondContact O-CA 3.36Å; K166-A169 WeakPolarHBondContact O-CB 3.45Å; K166-A169 PolarHBondContact O-N 2.82Å
167	T	52.8	Low	61.9	Low	143 Å²	143	91 Å²	91	88%	0.877	46%	0.457	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.8	-20.8	-177.9	4.7	0	0	0	0	115.4
168	D	54	Low	62.8	Low	119 Å²	119	88.3 Å²	88.3	64%	0.636	44%	0.443	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.7	-5.2	173.4	-68.9	-48.4	0	0	0	114.4	K166 P170 Q172	K166-D168 PolarHBondContact O-N 3.17Å; D168-P170 VanDerWaalsContact C-CD 3.47Å; D168-Q172 PolarHBondContact O-N 2.69Å
169	A	62.9	Low	63.8	Low	13 Å²	13	93.9 Å²	93.9	11%	0.107	46%	0.463	C	S	.	.	H	α-helix	trans	-66.6	-35.1	-177.3	0	0	0	0	0	114.8	L165 K166 K171 Q172 H173	L165-A169 HydrophobicContact CB-CB 3.72Å; L165-A169 HydrophobicContact CD2-CB 3.92Å; L165-A169 HydrophobicContact CG-CB 4.41Å; K166-A169 WeakPolarHBondContact O-CA 3.36Å; K166-A169 WeakPolarHBondContact O-CB 3.45Å; K166-A169 PolarHBondContact O-N 2.82Å; A169-K171 PolarHBondContact O-N 3.35Å; A169-Q172 PolarHBondContact O-N 3.37Å; A169-H173 WeakPolarHBondContact O-CB 3.44Å; A169-H173 PolarHBondContact O-N 3.14Å
170	P	65.3	Low	65.4	Low	26 Å²	26	89.5 Å²	89.5	17%	0.169	44%	0.444	C	S	.	.	H	α-helix	trans	-62	-45.8	-178.8	-21.7	31.6	0	0	0	111.8	V150 Y154 D168 H173 V174	V150-P170 HydrophobicContact CG1-CB 4.21Å; Y154-P170 HydrophobicContact CD1-CG 4.06Å; Y154-P170 HydrophobicContact CE1-CG 3.93Å; Y154-P170 HydrophobicContact CG-CG 4.48Å; D168-P170 VanDerWaalsContact C-CD 3.47Å; P170-H173 PolarHBondContact O-N 3.5Å; P170-V174 WeakPolarHBondContact O-CB 3.26Å; P170-V174 WeakPolarHBondContact O-CG2 3.21Å; P170-V174 PolarHBondContact O-N 3.32Å
171	K	74.3	Confident	67.2	Low	146 Å²	146	81.5 Å²	81.5	64%	0.635	41%	0.412	S	S	*	.	H	α-helix	trans	-64.4	-45.1	178.1	-80.1	-174.2	174.4	-179.4	0	112.2	A169 H173 V174 D175	A169-K171 PolarHBondContact O-N 3.35Å; K171-H173 VanDerWaalsContact C-N 3.29Å; K171-H173 PolarHBondContact O-N 3.23Å; K171-V174 PolarHBondContact O-N 3.25Å; K171-D175 WeakPolarHBondContact O-CB 3.33Å; K171-D175 PolarHBondContact O-N 2.93Å
172	Q	76.6	Confident	69.2	Low	133 Å²	133	81.4 Å²	81.4	62%	0.621	41%	0.411	S	S	*	.	H	α-helix	trans	-65.2	-35.6	177.6	-68.8	179.5	2.9	0	0	112.2	D168 A169 A176	D168-Q172 PolarHBondContact O-N 2.69Å; A169-Q172 PolarHBondContact O-N 3.37Å; Q172-A176 WeakPolarHBondContact O-CB 3.25Å; Q172-A176 PolarHBondContact O-N 2.96Å
173	H	76.9	Confident	71.6	Confident	50 Å²	50	75.9 Å²	75.9	23%	0.231	39%	0.392	C	S	.	.	H	α-helix	trans	-66.6	-48.1	175.4	-165.2	84.1	0	0	0	110.6	A169 P170 K171 A176 F177	A169-H173 WeakPolarHBondContact O-CB 3.44Å; A169-H173 PolarHBondContact O-N 3.14Å; P170-H173 PolarHBondContact O-N 3.5Å; K171-H173 VanDerWaalsContact C-N 3.29Å; K171-H173 PolarHBondContact O-N 3.23Å; H173-A176 PolarHBondContact O-N 2.93Å; H173-F177 AromaticContact CD2-CD2 3.7Å; H173-F177 AromaticContact CD2-CE2 3.77Å; H173-F177 AromaticContact CE1-CD2 3.93Å; H173-F177 AromaticContact CE1-CE2 3.28Å; H173-F177 WeakPolarHBondContact CE1-CE2 3.33Å; H173-F177 AromaticContact ND1-CE2 3.94Å; H173-F177 AromaticContact NE2-CD2 3.6Å; H173-F177 AromaticContact NE2-CE2 3.15Å; H173-F177 WeakPolarHBondContact NE2-CE2 3.4Å; H173-F177 AromaticContact NE2-CZ 3.71Å; H173-F177 WeakPolarHBondContact O-CB 3.26Å; H173-F177 VanDerWaalsContact O-CD2 3.28Å; H173-F177 WeakPolarHBondContact O-CD2 3.22Å; H173-F177 PolarHBondContact O-N 2.83Å
174	V	82.8	Confident	73.7	Confident	0 Å²	0	75.8 Å²	75.8	0%	0	39%	0.386	C	S	.	.	H	α-helix	trans	-60.7	-46.9	176	172.6	0	0	0	0	110.6	K143 M146 V150 P170 K171 A176 F177 F178	K143-V174 HydrophobicContact CG-CG1 4.23Å; M146-V174 HydrophobicContact CB-CG1 4.11Å; M146-V174 HydrophobicContact CG-CG1 3.93Å; M146-V174 HydrophobicContact CG-CG2 4.31Å; M146-V174 HydrophobicContact SD-CG1 4.05Å; V150-V174 HydrophobicContact CB-CG2 3.88Å; V150-V174 HydrophobicContact CG1-CG2 4.13Å; V150-V174 HydrophobicContact CG2-CG2 3.81Å; P170-V174 WeakPolarHBondContact O-CB 3.26Å; P170-V174 WeakPolarHBondContact O-CG2 3.21Å; P170-V174 PolarHBondContact O-N 3.32Å; K171-V174 PolarHBondContact O-N 3.25Å; V174-A176 VanDerWaalsContact C-N 3.3Å; V174-A176 PolarHBondContact O-N 3.42Å; V174-F177 PolarHBondContact O-N 3.01Å; V174-F178 WeakPolarHBondContact O-CB 3.41Å; V174-F178 PolarHBondContact O-N 3.25Å
175	D	85.3	Confident	75.8	Confident	68 Å²	68	80 Å²	80	36%	0.364	39%	0.391	S	S	.	.	H	α-helix	trans	-56.3	-45	177.2	-72.5	-20.1	0	0	0	111.8	K143 K171 Q179	K143-D175 WeakPolarHBondContact CE-OD1 3.31Å; K143-D175 IonicContact NZ-OD1 3.92Å; K143-D175 PolarHBondContact NZ-OD1 3.28Å; K171-D175 WeakPolarHBondContact O-CB 3.33Å; K171-D175 PolarHBondContact O-N 2.93Å; D175-Q179 VanDerWaalsContact O-CB 3.23Å; D175-Q179 WeakPolarHBondContact O-CB 3.15Å; D175-Q179 PolarHBondContact O-N 3.17Å
176	A	82.9	Confident	77.8	Confident	46 Å²	46	80.4 Å²	80.4	38%	0.38	39%	0.393	S	S	.	.	H	α-helix	trans	-69.1	-37.6	179	0	0	0	0	0	112.9	Q172 H173 V174 K180	Q172-A176 WeakPolarHBondContact O-CB 3.25Å; Q172-A176 PolarHBondContact O-N 2.96Å; H173-A176 PolarHBondContact O-N 2.93Å; V174-A176 VanDerWaalsContact C-N 3.3Å; V174-A176 PolarHBondContact O-N 3.42Å; A176-K180 WeakPolarHBondContact O-CG 3.28Å; A176-K180 PolarHBondContact O-N 3.01Å
177	F	82.9	Confident	79.8	Confident	26 Å²	26	74 Å²	74	11%	0.114	38%	0.376	C	S	.	.	H	α-helix	trans	-68.9	-49.6	175.9	-93.8	-107.3	0	0	0	111	M146 H173 V174 Q179 K180 M181 I204 S207	M146-F177 HydrophobicContact SD-CB 4.02Å; H173-F177 AromaticContact CD2-CD2 3.7Å; H173-F177 AromaticContact CD2-CE2 3.77Å; H173-F177 AromaticContact CE1-CD2 3.93Å; H173-F177 AromaticContact CE1-CE2 3.28Å; H173-F177 WeakPolarHBondContact CE1-CE2 3.33Å; H173-F177 AromaticContact ND1-CE2 3.94Å; H173-F177 AromaticContact NE2-CD2 3.6Å; H173-F177 AromaticContact NE2-CE2 3.15Å; H173-F177 WeakPolarHBondContact NE2-CE2 3.4Å; H173-F177 AromaticContact NE2-CZ 3.71Å; H173-F177 WeakPolarHBondContact O-CB 3.26Å; H173-F177 VanDerWaalsContact O-CD2 3.28Å; H173-F177 WeakPolarHBondContact O-CD2 3.22Å; H173-F177 PolarHBondContact O-N 2.83Å; V174-F177 PolarHBondContact O-N 3.01Å; F177-Q179 PolarHBondContact O-N 3.22Å; F177-K180 PolarHBondContact O-N 2.97Å; F177-K180 VanDerWaalsContact O-N 3.08Å; F177-M181 HydrophobicContact CD1-CE 3.83Å; F177-M181 HydrophobicContact CE1-CE 4.39Å; F177-M181 WeakPolarHBondContact O-CG 3.44Å; F177-M181 PolarHBondContact O-N 2.72Å; F177-I204 HydrophobicContact CD1-CG1 4.44Å; F177-I204 HydrophobicContact CD1-CG2 4.38Å; F177-I204 HydrophobicContact CE1-CB 4.2Å; F177-I204 HydrophobicContact CE1-CG1 4.06Å; F177-I204 HydrophobicContact CE1-CG2 3.98Å; F177-I204 HydrophobicContact CZ-CG1 4.41Å; F177-S207 VanDerWaalsContact CZ-CB 3.43Å
178	F	86.1	Confident	81.7	Confident	16 Å²	16	69.1 Å²	69.1	7%	0.07	35%	0.346	C	S	.	.	H	α-helix	trans	-59.4	-46.8	-179.2	-155.7	-85.5	0	0	0	110.7	K143 M146 V174 K180 M181 D182 G187 V189	K143-F178 HydrophobicContact CB-CD2 4.08Å; K143-F178 HydrophobicContact CB-CE2 3.94Å; K143-F178 HydrophobicContact CB-CG 4.49Å; K143-F178 HydrophobicContact CB-CZ 4.22Å; K143-F178 HydrophobicContact CG-CD2 4.39Å; M146-F178 HydrophobicContact CE-CD2 4.14Å; M146-F178 HydrophobicContact SD-CB 4.3Å; M146-F178 HydrophobicContact SD-CD2 4Å; V174-F178 WeakPolarHBondContact O-CB 3.41Å; V174-F178 PolarHBondContact O-N 3.25Å; F178-K180 PolarHBondContact O-N 3.26Å; F178-M181 PolarHBondContact O-N 3.44Å; F178-D182 HydrophobicContact CD1-CB 3.96Å; F178-D182 HydrophobicContact CE1-CB 3.82Å; F178-D182 WeakPolarHBondContact CE1-OD2 3.43Å; F178-D182 WeakPolarHBondContact O-CB 3.43Å; F178-D182 PolarHBondContact O-N 2.89Å; F178-G187 VanDerWaalsContact CZ-O 3.25Å; F178-G187 WeakPolarHBondContact CZ-O 3.29Å; F178-V189 HydrophobicContact CD2-CG2 4.23Å; F178-V189 HydrophobicContact CE2-CG2 3.85Å; F178-V189 HydrophobicContact CZ-CG2 4.01Å
179	Q	86.8	Confident	83.5	Confident	138 Å²	138	63.5 Å²	63.5	65%	0.645	32%	0.316	S	S	*	.	H	α-helix	trans	-62.6	-26	178.4	-172.4	175	20.4	0	0	113.8	D175 F177	D175-Q179 VanDerWaalsContact O-CB 3.23Å; D175-Q179 WeakPolarHBondContact O-CB 3.15Å; D175-Q179 PolarHBondContact O-N 3.17Å; F177-Q179 PolarHBondContact O-N 3.22Å
180	K	85.5	Confident	84.9	Confident	99 Å²	99	64.5 Å²	64.5	43%	0.43	32%	0.321	S	S	.	.	H	α-helix	trans	-85	-34.6	176.7	-74.7	-176.2	174.9	-166.4	0	112.8	A176 F177 F178 K183 D201 I204	A176-K180 WeakPolarHBondContact O-CG 3.28Å; A176-K180 PolarHBondContact O-N 3.01Å; F177-K180 PolarHBondContact O-N 2.97Å; F177-K180 VanDerWaalsContact O-N 3.08Å; F178-K180 PolarHBondContact O-N 3.26Å; K180-K183 VanDerWaalsContact O-CE 3.29Å; K180-K183 WeakPolarHBondContact O-CE 3.46Å; K180-D201 IonicContact NZ-OD2 3.73Å; K180-D201 PolarHBondContact NZ-OD2 2.85Å; K180-I204 HydrophobicContact CB-CD1 3.75Å; K180-I204 HydrophobicContact CD-CD1 3.84Å; K180-I204 HydrophobicContact CD-CG1 4.36Å
181	M	86.4	Confident	86.1	Confident	1 Å²	1	65.4 Å²	65.4	1%	0.005	32%	0.324	C	S	.	.	H	α-helix	trans	-81.4	-41.3	-178.4	-71.9	-177.6	177.1	0	0	112.7	M146 F177 F178 K183 V189 F194 S197 I204 L208	M146-M181 HydrophobicContact CE-SD 3.77Å; F177-M181 HydrophobicContact CD1-CE 3.83Å; F177-M181 HydrophobicContact CE1-CE 4.39Å; F177-M181 WeakPolarHBondContact O-CG 3.44Å; F177-M181 PolarHBondContact O-N 2.72Å; F178-M181 PolarHBondContact O-N 3.44Å; M181-K183 PolarHBondContact O-N 2.59Å; M181-V189 HydrophobicContact CB-CG1 3.93Å; M181-V189 HydrophobicContact CB-CG2 3.81Å; M181-F194 HydrophobicContact CE-CD2 4.02Å; M181-F194 HydrophobicContact CE-CE2 3.82Å; M181-F194 HydrophobicContact SD-CD2 3.81Å; M181-F194 HydrophobicContact SD-CE2 4.08Å; M181-S197 WeakPolarHBondContact CA-OG 3.43Å; M181-I204 HydrophobicContact CE-CG2 3.28Å; M181-I204 HydrophobicContact CG-CD1 4.43Å; M181-L208 HydrophobicContact CE-CD1 3.93Å
182	D	90.1	Very high	86.9	Confident	14 Å²	14	64 Å²	64	8%	0.075	32%	0.323	C	S	.	.			trans	-75.2	88.7	177.3	-179.7	2.5	0	0	0	109.6	F178 N184 R185 D186 G187 V189	F178-D182 HydrophobicContact CD1-CB 3.96Å; F178-D182 HydrophobicContact CE1-CB 3.82Å; F178-D182 WeakPolarHBondContact CE1-OD2 3.43Å; F178-D182 WeakPolarHBondContact O-CB 3.43Å; F178-D182 PolarHBondContact O-N 2.89Å; D182-N184 PolarHBondContact OD1-OD1 3.28Å; D182-R185 VanDerWaalsContact CG-CA 3.48Å; D182-R185 WeakPolarHBondContact OD1-CA 3.35Å; D182-R185 PolarHBondContact OD1-N 3.42Å; D182-R185 WeakPolarHBondContact OD2-CA 3.26Å; D182-D186 PolarHBondContact OD1-N 2.85Å; D182-G187 WeakPolarHBondContact OD2-CA 3.41Å; D182-G187 PolarHBondContact OD2-N 3.12Å; D182-G187 VanDerWaalsContact OD2-N 3.1Å; D182-V189 HydrophobicContact CB-CG2 4.12Å
183	K	87.5	Confident	87.6	Confident	106 Å²	106	58.6 Å²	58.6	46%	0.461	30%	0.298	S	S	.	.	S	Bend	trans	-76.5	-39.4	-173.2	-66.2	-72.7	174.5	165.7	0	110.9	K180 M181 E193 S197 E200	K180-K183 VanDerWaalsContact O-CE 3.29Å; K180-K183 WeakPolarHBondContact O-CE 3.46Å; M181-K183 PolarHBondContact O-N 2.59Å; K183-E193 HydrophobicContact CB-CG 4.43Å; K183-E193 HydrophobicContact CG-CG 4.44Å; K183-E193 PolarHBondContact N-OE1 3.05Å; K183-S197 VanDerWaalsContact CE-OG 3.28Å; K183-S197 WeakPolarHBondContact CE-OG 3.46Å; K183-E200 IonicContact NZ-OE2 3.63Å; K183-E200 PolarHBondContact NZ-OE2 2.58Å
184	N	90	Very high	88.2	Confident	93 Å²	93	56.2 Å²	56.2	50%	0.497	29%	0.287	S	S	.	.	S	Bend	trans	-84.8	-11.8	-178.3	71.9	4.7	0	0	0	112.8	D182 D186 E193	D182-N184 PolarHBondContact OD1-OD1 3.28Å; N184-D186 VanDerWaalsContact C-N 3.31Å; N184-D186 VanDerWaalsContact ND2-CG 3.28Å; N184-D186 PolarHBondContact ND2-OD2 3.11Å; N184-D186 WeakPolarHBondContact OD1-CB 3.07Å; N184-D186 PolarHBondContact OD1-N 3.17Å; N184-D186 PolarHBondContact OD1-OD1 3.47Å; N184-D186 VanDerWaalsContact OD1-OD1 3.13Å; N184-D186 PolarHBondContact OD1-OD2 2.87Å; N184-E193 PolarHBondContact N-OE1 3.18Å; N184-E193 PolarHBondContact OD1-OE1 2.69Å
185	R	88.5	Confident	88.5	Confident	194 Å²	194	57.4 Å²	57.4	73%	0.732	29%	0.293	S	S	*	.			trans	61.5	35.4	-179.5	-57.8	-176.7	-176.8	172.1	2.2	113.4	D182 G187	D182-R185 VanDerWaalsContact CG-CA 3.48Å; D182-R185 WeakPolarHBondContact OD1-CA 3.35Å; D182-R185 PolarHBondContact OD1-N 3.42Å; D182-R185 WeakPolarHBondContact OD2-CA 3.26Å; R185-G187 VanDerWaalsContact C-N 3.28Å
186	D	90.2	Very high	88.6	Confident	87 Å²	87	58.4 Å²	58.4	47%	0.465	30%	0.298	S	S	.	.	S	Bend	trans	-84.6	-5.6	177	70.3	7.1	0	0	0	112.9	D182 N184 V188	D182-D186 PolarHBondContact OD1-N 2.85Å; N184-D186 VanDerWaalsContact C-N 3.31Å; N184-D186 VanDerWaalsContact ND2-CG 3.28Å; N184-D186 PolarHBondContact ND2-OD2 3.11Å; N184-D186 WeakPolarHBondContact OD1-CB 3.07Å; N184-D186 PolarHBondContact OD1-N 3.17Å; N184-D186 PolarHBondContact OD1-OD1 3.47Å; N184-D186 VanDerWaalsContact OD1-OD1 3.13Å; N184-D186 PolarHBondContact OD1-OD2 2.87Å; D186-V188 WeakPolarHBondContact OD1-CG2 3.3Å; D186-V188 PolarHBondContact OD1-N 3.29Å
187	G	88	Confident	88.9	Confident	37 Å²	37	56.3 Å²	56.3	38%	0.381	28%	0.281	S	S	.	.	S	Bend	trans	87.9	8.7	178.8	0	0	0	0	0	114	F178 D182 R185	F178-G187 VanDerWaalsContact CZ-O 3.25Å; F178-G187 WeakPolarHBondContact CZ-O 3.29Å; D182-G187 WeakPolarHBondContact OD2-CA 3.41Å; D182-G187 PolarHBondContact OD2-N 3.12Å; D182-G187 VanDerWaalsContact OD2-N 3.1Å; R185-G187 VanDerWaalsContact C-N 3.28Å
188	V	92.2	Very high	89	Confident	40 Å²	40	55.1 Å²	55.1	24%	0.242	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.3	158.2	171.6	-65.3	0	0	0	0	110.7	Y140 D186	Y140-V188 HydrophobicContact CD1-CB 4.33Å; Y140-V188 HydrophobicContact CD1-CG2 3.84Å; Y140-V188 HydrophobicContact CG-CG2 4.47Å; D186-V188 WeakPolarHBondContact OD1-CG2 3.3Å; D186-V188 PolarHBondContact OD1-N 3.29Å
189	V	92.3	Very high	88.9	Confident	0 Å²	0	60.5 Å²	60.5	0%	0	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	117.4	174.9	177.9	0	0	0	0	108.8	I141 F178 M181 D182 E193 F194	I141-V189 HydrophobicContact CB-CB 4.28Å; I141-V189 PolarHBondContact N-O 3.24Å; I141-V189 PolarHBondContact O-N 2.88Å; F178-V189 HydrophobicContact CD2-CG2 4.23Å; F178-V189 HydrophobicContact CE2-CG2 3.85Å; F178-V189 HydrophobicContact CZ-CG2 4.01Å; M181-V189 HydrophobicContact CB-CG1 3.93Å; M181-V189 HydrophobicContact CB-CG2 3.81Å; D182-V189 HydrophobicContact CB-CG2 4.12Å; V189-E193 HydrophobicContact CG1-CB 4.21Å; V189-F194 HydrophobicContact CG1-CB 4.07Å
190	T	93.2	Very high	88.9	Confident	35 Å²	35	60.4 Å²	60.4	22%	0.215	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.5	161.4	174.6	58.5	0	0	0	0	112.1	Y140 D192 E193 F194	Y140-T190 HydrophobicContact CD1-CG2 3.71Å; Y140-T190 HydrophobicContact CE1-CG2 3.66Å; T190-D192 PolarHBondContact O-N 3.41Å; T190-E193 PolarHBondContact N-OE2 3.12Å; T190-E193 PolarHBondContact O-N 3.44Å; T190-E193 WeakPolarHBondContact OG1-CB 3.23Å; T190-E193 VanDerWaalsContact OG1-CG 3.26Å; T190-E193 WeakPolarHBondContact OG1-CG 3.16Å; T190-E193 PolarHBondContact OG1-N 2.95Å; T190-E193 PolarHBondContact OG1-OE2 3.33Å; T190-F194 WeakPolarHBondContact O-CB 3.09Å; T190-F194 PolarHBondContact O-N 3.34Å
191	L	90.4	Very high	88.8	Confident	45 Å²	45	57.3 Å²	57.3	24%	0.236	29%	0.288	C	S	.	.	H	α-helix	trans	-55.2	-41.4	174.8	178.4	64.5	0	0	0	112.1	Q127 F130 F194 I195	Q127-L191 HydrophobicContact CB-CD1 4.47Å; Q127-L191 HydrophobicContact CG-CD1 4.19Å; Q127-L191 HydrophobicContact CG-CD2 4.19Å; F130-L191 HydrophobicContact CB-CD1 3.64Å; F130-L191 HydrophobicContact CD1-CB 4.37Å; F130-L191 HydrophobicContact CD1-CD1 3.92Å; F130-L191 HydrophobicContact CD2-CB 4.3Å; F130-L191 HydrophobicContact CD2-CD1 3.92Å; F130-L191 HydrophobicContact CE1-CB 4.25Å; F130-L191 HydrophobicContact CE2-CB 4.17Å; F130-L191 HydrophobicContact CG-CB 4.41Å; F130-L191 HydrophobicContact CG-CD1 3.53Å; F130-L191 HydrophobicContact CZ-CB 4.16Å; L191-F194 PolarHBondContact O-N 3.48Å; L191-I195 HydrophobicContact CD1-CD1 3.9Å; L191-I195 HydrophobicContact CD1-CG1 4.19Å; L191-I195 HydrophobicContact CG-CD1 3.92Å; L191-I195 WeakPolarHBondContact O-CG1 3.33Å; L191-I195 PolarHBondContact O-N 3.44Å
192	D	90.9	Very high	88.4	Confident	117 Å²	117	63.2 Å²	63.2	63%	0.626	32%	0.316	S	S	*	.	H	α-helix	trans	-65.3	-45.1	179.1	-72.4	-22.2	0	0	0	111.1	T190 F194 I195 L196	T190-D192 PolarHBondContact O-N 3.41Å; D192-F194 VanDerWaalsContact C-N 3.31Å; D192-F194 PolarHBondContact O-N 2.97Å; D192-I195 PolarHBondContact O-N 3.23Å; D192-L196 VanDerWaalsContact O-CB 3.27Å; D192-L196 WeakPolarHBondContact O-CB 3.37Å; D192-L196 WeakPolarHBondContact O-CD1 3.38Å; D192-L196 WeakPolarHBondContact O-CG 3.39Å; D192-L196 PolarHBondContact O-N 2.92Å
193	E	91.3	Very high	87.8	Confident	18 Å²	18	67.4 Å²	67.4	8%	0.084	34%	0.338	C	S	.	.	H	α-helix	trans	-63	-38.4	175.2	-76.1	172.4	131.6	0	0	112.5	K183 N184 V189 T190 S197	K183-E193 HydrophobicContact CB-CG 4.43Å; K183-E193 HydrophobicContact CG-CG 4.44Å; K183-E193 PolarHBondContact N-OE1 3.05Å; N184-E193 PolarHBondContact N-OE1 3.18Å; N184-E193 PolarHBondContact OD1-OE1 2.69Å; V189-E193 HydrophobicContact CG1-CB 4.21Å; T190-E193 PolarHBondContact N-OE2 3.12Å; T190-E193 PolarHBondContact O-N 3.44Å; T190-E193 WeakPolarHBondContact OG1-CB 3.23Å; T190-E193 VanDerWaalsContact OG1-CG 3.26Å; T190-E193 WeakPolarHBondContact OG1-CG 3.16Å; T190-E193 PolarHBondContact OG1-N 2.95Å; T190-E193 PolarHBondContact OG1-OE2 3.33Å; E193-S197 WeakPolarHBondContact O-CB 3.49Å; E193-S197 PolarHBondContact O-N 3.41Å; E193-S197 PolarHBondContact O-OG 2.96Å
194	F	89.3	Confident	87.4	Confident	0 Å²	0	62.5 Å²	62.5	0%	0	32%	0.317	C	S	.	.	H	α-helix	trans	-62.8	-51.4	176	-174.9	-97.3	0	0	0	111.2	L126 T129 F130 I141 M181 V189 T190 L191 D192 S197 C198 L208	L126-F194 HydrophobicContact CB-CE1 4.43Å; L126-F194 HydrophobicContact CD2-CE1 4.12Å; L126-F194 WeakPolarHBondContact O-CE1 3.45Å; T129-F194 HydrophobicContact CG2-CZ 4.18Å; F130-F194 HydrophobicContact CB-CD1 4.14Å; F130-F194 HydrophobicContact CB-CE1 4.3Å; F130-F194 HydrophobicContact CD2-CB 3.76Å; F130-F194 HydrophobicContact CD2-CD1 4.15Å; F130-F194 HydrophobicContact CD2-CD2 4.36Å; F130-F194 AromaticContact CD2-CG 3.85Å; F130-F194 HydrophobicContact CD2-CG 3.85Å; F130-F194 HydrophobicContact CE2-CB 4.22Å; I141-F194 HydrophobicContact CD1-CD2 4.23Å; M181-F194 HydrophobicContact CE-CD2 4.02Å; M181-F194 HydrophobicContact CE-CE2 3.82Å; M181-F194 HydrophobicContact SD-CD2 3.81Å; M181-F194 HydrophobicContact SD-CE2 4.08Å; V189-F194 HydrophobicContact CG1-CB 4.07Å; T190-F194 WeakPolarHBondContact O-CB 3.09Å; T190-F194 PolarHBondContact O-N 3.34Å; L191-F194 PolarHBondContact O-N 3.48Å; D192-F194 VanDerWaalsContact C-N 3.31Å; D192-F194 PolarHBondContact O-N 2.97Å; F194-S197 PolarHBondContact O-N 3.08Å; F194-C198 WeakPolarHBondContact O-CB 3.38Å; F194-C198 PolarHBondContact O-N 3.33Å; F194-C198 PolarHBondContact O-SG 2.98Å; F194-L208 HydrophobicContact CE1-CD1 4.32Å; F194-L208 HydrophobicContact CE2-CD1 3.83Å; F194-L208 HydrophobicContact CE2-CD2 4.27Å; F194-L208 HydrophobicContact CZ-CD1 3.49Å; F194-L208 VanDerWaalsContact CZ-CD1 3.49Å; F194-L208 HydrophobicContact CZ-CD2 4.1Å; F194-L208 HydrophobicContact CZ-CG 4.43Å
195	I	88.1	Confident	86.9	Confident	26 Å²	26	60.3 Å²	60.3	13%	0.133	30%	0.304	C	S	.	.	H	α-helix	trans	-62.6	-47	179.3	-68.3	171.5	0	0	0	110.6	L126 L191 D192 S197 C198 Q199	L126-I195 HydrophobicContact CB-CG1 4.43Å; L191-I195 HydrophobicContact CD1-CD1 3.9Å; L191-I195 HydrophobicContact CD1-CG1 4.19Å; L191-I195 HydrophobicContact CG-CD1 3.92Å; L191-I195 WeakPolarHBondContact O-CG1 3.33Å; L191-I195 PolarHBondContact O-N 3.44Å; D192-I195 PolarHBondContact O-N 3.23Å; I195-S197 VanDerWaalsContact C-N 3.33Å; I195-S197 PolarHBondContact O-N 3Å; I195-C198 PolarHBondContact O-N 2.71Å; I195-Q199 HydrophobicContact CG2-CG 4.47Å; I195-Q199 VanDerWaalsContact O-CG 3.31Å; I195-Q199 WeakPolarHBondContact O-CG 3.5Å; I195-Q199 PolarHBondContact O-N 3.33Å
196	L	88.7	Confident	86.2	Confident	89 Å²	89	57.8 Å²	57.8	47%	0.466	30%	0.295	S	S	.	.	H	α-helix	trans	-59.4	-45.4	178.1	-74	169.3	0	0	0	111.1	D192 C198 Q199 E200	D192-L196 VanDerWaalsContact O-CB 3.27Å; D192-L196 WeakPolarHBondContact O-CB 3.37Å; D192-L196 WeakPolarHBondContact O-CD1 3.38Å; D192-L196 WeakPolarHBondContact O-CG 3.39Å; D192-L196 PolarHBondContact O-N 2.92Å; L196-C198 VanDerWaalsContact C-N 3.34Å; L196-C198 PolarHBondContact O-N 3.49Å; L196-Q199 PolarHBondContact O-N 3.34Å; L196-Q199 VanDerWaalsContact O-N 3.15Å; L196-E200 WeakPolarHBondContact O-CB 3.17Å; L196-E200 WeakPolarHBondContact O-CG 3.5Å; L196-E200 PolarHBondContact O-N 3.02Å
197	S	88.1	Confident	85.2	Confident	2 Å²	2	55 Å²	55	1%	0.014	28%	0.283	C	S	.	.	H	α-helix	trans	-66.8	-35.8	-179.6	-60.7	0	0	0	0	112.6	M181 K183 E193 F194 I195 Q199 D201	M181-S197 WeakPolarHBondContact CA-OG 3.43Å; K183-S197 VanDerWaalsContact CE-OG 3.28Å; K183-S197 WeakPolarHBondContact CE-OG 3.46Å; E193-S197 WeakPolarHBondContact O-CB 3.49Å; E193-S197 PolarHBondContact O-N 3.41Å; E193-S197 PolarHBondContact O-OG 2.96Å; F194-S197 PolarHBondContact O-N 3.08Å; I195-S197 VanDerWaalsContact C-N 3.33Å; I195-S197 PolarHBondContact O-N 3Å; S197-Q199 VanDerWaalsContact C-N 3.33Å; S197-D201 PolarHBondContact O-N 2.79Å
198	C	85.4	Confident	84.4	Confident	1 Å²	1	53.4 Å²	53.4	1%	0.007	27%	0.265	C	S	.	.	H	α-helix	trans	-67.9	-32.9	173	-66.6	0	0	0	0	112.5	L126 F194 I195 L196 L208	L126-C198 HydrophobicContact CD1-CB 4.01Å; L126-C198 HydrophobicContact CD2-CB 3.83Å; F194-C198 WeakPolarHBondContact O-CB 3.38Å; F194-C198 PolarHBondContact O-N 3.33Å; F194-C198 PolarHBondContact O-SG 2.98Å; I195-C198 PolarHBondContact O-N 2.71Å; L196-C198 VanDerWaalsContact C-N 3.34Å; L196-C198 PolarHBondContact O-N 3.49Å; C198-L208 WeakPolarHBondContact SG-CD1 3.43Å
199	Q	84.1	Confident	83.2	Confident	128 Å²	128	55 Å²	55	60%	0.598	27%	0.27	S	S	*	.	H	α-helix	trans	-77.6	-32.7	177.2	-71.6	177.7	1.4	0	0	112.7	I195 L196 S197	I195-Q199 HydrophobicContact CG2-CG 4.47Å; I195-Q199 VanDerWaalsContact O-CG 3.31Å; I195-Q199 WeakPolarHBondContact O-CG 3.5Å; I195-Q199 PolarHBondContact O-N 3.33Å; L196-Q199 PolarHBondContact O-N 3.34Å; L196-Q199 VanDerWaalsContact O-N 3.15Å; S197-Q199 VanDerWaalsContact C-N 3.33Å
200	E	86	Confident	81.7	Confident	137 Å²	137	60.4 Å²	60.4	64%	0.64	30%	0.298	S	S	*	.	H	α-helix	trans	-82.3	-34.2	-179.1	-72.9	-175.2	159.9	0	0	113.8	K183 L196	K183-E200 IonicContact NZ-OE2 3.63Å; K183-E200 PolarHBondContact NZ-OE2 2.58Å; L196-E200 WeakPolarHBondContact O-CB 3.17Å; L196-E200 WeakPolarHBondContact O-CG 3.5Å; L196-E200 PolarHBondContact O-N 3.02Å
201	D	83.3	Confident	80.1	Confident	33 Å²	33	60.4 Å²	60.4	18%	0.176	30%	0.295	C	S	.	.			trans	-118.1	102.7	-176.7	-166.7	-23.8	0	0	0	111.8	K180 S197 N203 I204 M205	K180-D201 IonicContact NZ-OD2 3.73Å; K180-D201 PolarHBondContact NZ-OD2 2.85Å; S197-D201 PolarHBondContact O-N 2.79Å; D201-N203 PolarHBondContact O-N 3.01Å; D201-N203 VanDerWaalsContact O-N 3.11Å; D201-N203 VanDerWaalsContact OD1-CB 3.25Å; D201-N203 WeakPolarHBondContact OD1-CB 3.37Å; D201-N203 PolarHBondContact OD1-N 2.75Å; D201-N203 PolarHBondContact OD1-ND2 2.76Å; D201-I204 HydrophobicContact CB-CB 4.16Å; D201-I204 HydrophobicContact CB-CD1 3.92Å; D201-I204 HydrophobicContact CB-CG1 3.96Å; D201-I204 PolarHBondContact O-N 3.13Å; D201-I204 VanDerWaalsContact O-N 3.09Å; D201-M205 PolarHBondContact O-N 2.92Å; D201-M205 VanDerWaalsContact O-N 3.1Å
202	E	79.3	Confident	78.6	Confident	126 Å²	126	59.7 Å²	59.7	59%	0.589	29%	0.291	S	S	*	.	H	α-helix	trans	-57	-27	176.1	-73.9	-164.1	-171.8	0	0	113.3	R206	E202-R206 WeakPolarHBondContact O-CB 3.41Å; E202-R206 VanDerWaalsContact O-CG 3.29Å; E202-R206 WeakPolarHBondContact O-CG 3.16Å; E202-R206 PolarHBondContact O-N 3.39Å; E202-R206 IonicContact OE2-CZ 2.69Å; E202-R206 IonicContact OE2-NH2 3.77Å; E202-R206 PolarHBondContact OE2-NH2 3.15Å
203	N	77.6	Confident	76.8	Confident	101 Å²	101	60.5 Å²	60.5	54%	0.54	30%	0.295	S	S	.	.	H	α-helix	trans	-72.9	-39.6	179.3	-55.6	-73.5	0	0	0	110.9	D201 M205 R206 S207	D201-N203 PolarHBondContact O-N 3.01Å; D201-N203 VanDerWaalsContact O-N 3.11Å; D201-N203 VanDerWaalsContact OD1-CB 3.25Å; D201-N203 WeakPolarHBondContact OD1-CB 3.37Å; D201-N203 PolarHBondContact OD1-N 2.75Å; D201-N203 PolarHBondContact OD1-ND2 2.76Å; N203-M205 VanDerWaalsContact C-N 3.35Å; N203-R206 PolarHBondContact O-N 2.92Å; N203-S207 WeakPolarHBondContact O-CB 3.3Å; N203-S207 PolarHBondContact O-N 3Å; N203-S207 PolarHBondContact O-OG 2.87Å
204	I	78.1	Confident	74.8	Confident	3 Å²	3	61.7 Å²	61.7	2%	0.015	30%	0.303	C	S	.	.	H	α-helix	trans	-62.1	-48.3	174.2	-68.9	-178.6	0	0	0	109.3	F177 K180 M181 D201 R206 S207 L208	F177-I204 HydrophobicContact CD1-CG1 4.44Å; F177-I204 HydrophobicContact CD1-CG2 4.38Å; F177-I204 HydrophobicContact CE1-CB 4.2Å; F177-I204 HydrophobicContact CE1-CG1 4.06Å; F177-I204 HydrophobicContact CE1-CG2 3.98Å; F177-I204 HydrophobicContact CZ-CG1 4.41Å; K180-I204 HydrophobicContact CB-CD1 3.75Å; K180-I204 HydrophobicContact CD-CD1 3.84Å; K180-I204 HydrophobicContact CD-CG1 4.36Å; M181-I204 HydrophobicContact CE-CG2 3.28Å; M181-I204 HydrophobicContact CG-CD1 4.43Å; D201-I204 HydrophobicContact CB-CB 4.16Å; D201-I204 HydrophobicContact CB-CD1 3.92Å; D201-I204 HydrophobicContact CB-CG1 3.96Å; D201-I204 PolarHBondContact O-N 3.13Å; D201-I204 VanDerWaalsContact O-N 3.09Å; I204-R206 VanDerWaalsContact C-N 3.35Å; I204-R206 PolarHBondContact O-N 2.96Å; I204-S207 PolarHBondContact O-N 3.36Å; I204-L208 HydrophobicContact CG2-CD1 3.85Å; I204-L208 HydrophobicContact CG2-CG 4.47Å; I204-L208 WeakPolarHBondContact O-CG 3.27Å; I204-L208 PolarHBondContact O-N 3.48Å
205	M	79.3	Confident	72.8	Confident	47 Å²	47	65.5 Å²	65.5	23%	0.232	32%	0.323	C	S	.	.	H	α-helix	trans	-58.3	-46.1	177.7	-170.6	176.5	-179.1	0	0	111.7	V122 D201 N203 S207 L208 Q209	V122-M205 HydrophobicContact CG1-CE 3.7Å; D201-M205 PolarHBondContact O-N 2.92Å; D201-M205 VanDerWaalsContact O-N 3.1Å; N203-M205 VanDerWaalsContact C-N 3.35Å; M205-S207 PolarHBondContact O-N 3.42Å; M205-L208 PolarHBondContact O-N 2.95Å; M205-Q209 VanDerWaalsContact O-CB 3.32Å; M205-Q209 WeakPolarHBondContact O-CB 3.33Å; M205-Q209 VanDerWaalsContact O-CG 3.25Å; M205-Q209 WeakPolarHBondContact O-CG 3.21Å; M205-Q209 PolarHBondContact O-N 2.84Å
206	R	73.8	Confident	72	Confident	142 Å²	142	67.5 Å²	67.5	54%	0.536	33%	0.332	S	S	.	.	H	α-helix	trans	-64.9	-38.1	177.5	-77.6	-177.4	-157.8	166.7	10.6	112.9	E202 N203 I204 L210	E202-R206 WeakPolarHBondContact O-CB 3.41Å; E202-R206 VanDerWaalsContact O-CG 3.29Å; E202-R206 WeakPolarHBondContact O-CG 3.16Å; E202-R206 PolarHBondContact O-N 3.39Å; E202-R206 IonicContact OE2-CZ 2.69Å; E202-R206 IonicContact OE2-NH2 3.77Å; E202-R206 PolarHBondContact OE2-NH2 3.15Å; N203-R206 PolarHBondContact O-N 2.92Å; I204-R206 VanDerWaalsContact C-N 3.35Å; I204-R206 PolarHBondContact O-N 2.96Å; R206-L210 VanDerWaalsContact O-CB 3.31Å; R206-L210 WeakPolarHBondContact O-CB 3.36Å; R206-L210 PolarHBondContact O-N 2.87Å
207	S	70.6	Confident	71.1	Confident	29 Å²	29	66.3 Å²	66.3	20%	0.203	33%	0.325	C	S	.	.	H	α-helix	trans	-65.7	-45	176.4	-73.9	0	0	0	0	111.5	F177 N203 I204 M205 L210 F211	F177-S207 VanDerWaalsContact CZ-CB 3.43Å; N203-S207 WeakPolarHBondContact O-CB 3.3Å; N203-S207 PolarHBondContact O-N 3Å; N203-S207 PolarHBondContact O-OG 2.87Å; I204-S207 PolarHBondContact O-N 3.36Å; M205-S207 PolarHBondContact O-N 3.42Å; S207-L210 WeakPolarHBondContact O-CB 3.37Å; S207-L210 PolarHBondContact O-N 3.22Å; S207-F211 WeakPolarHBondContact O-CD2 3.14Å; S207-F211 VanDerWaalsContact O-CE2 3.25Å; S207-F211 WeakPolarHBondContact O-CE2 3.35Å; S207-F211 WeakPolarHBondContact O-CG 3.48Å; S207-F211 PolarHBondContact O-N 2.91Å
208	L	71.3	Confident	70.2	Confident	3 Å²	3	69.9 Å²	69.9	2%	0.016	34%	0.343	C	S	.	.	H	α-helix	trans	-63.4	-43.9	175.6	-70.2	168.7	0	0	0	111.9	T129 Y133 M181 F194 C198 I204 M205 L210 F211 E212	T129-L208 HydrophobicContact CG2-CD2 4.3Å; Y133-L208 HydrophobicContact CE2-CD2 3.92Å; Y133-L208 WeakPolarHBondContact OH-CD2 3.46Å; M181-L208 HydrophobicContact CE-CD1 3.93Å; F194-L208 HydrophobicContact CE1-CD1 4.32Å; F194-L208 HydrophobicContact CE2-CD1 3.83Å; F194-L208 HydrophobicContact CE2-CD2 4.27Å; F194-L208 HydrophobicContact CZ-CD1 3.49Å; F194-L208 VanDerWaalsContact CZ-CD1 3.49Å; F194-L208 HydrophobicContact CZ-CD2 4.1Å; F194-L208 HydrophobicContact CZ-CG 4.43Å; C198-L208 WeakPolarHBondContact SG-CD1 3.43Å; I204-L208 HydrophobicContact CG2-CD1 3.85Å; I204-L208 HydrophobicContact CG2-CG 4.47Å; I204-L208 WeakPolarHBondContact O-CG 3.27Å; I204-L208 PolarHBondContact O-N 3.48Å; M205-L208 PolarHBondContact O-N 2.95Å; L208-L210 VanDerWaalsContact C-N 3.3Å; L208-L210 PolarHBondContact O-N 3.32Å; L208-F211 WeakPolarHBondContact O-CB 3.42Å; L208-F211 PolarHBondContact O-N 2.93Å; L208-F211 VanDerWaalsContact O-N 3.07Å; L208-E212 PolarHBondContact O-N 2.83Å
209	Q	66.3	Low	69.3	Low	73 Å²	73	73.9 Å²	73.9	34%	0.341	36%	0.362	S	S	.	.	H	α-helix	trans	-64.2	-33.8	175.1	-75.9	-178.5	-16.4	0	0	112.8	M205 F211 E212 N213	M205-Q209 VanDerWaalsContact O-CB 3.32Å; M205-Q209 WeakPolarHBondContact O-CB 3.33Å; M205-Q209 VanDerWaalsContact O-CG 3.25Å; M205-Q209 WeakPolarHBondContact O-CG 3.21Å; M205-Q209 PolarHBondContact O-N 2.84Å; Q209-F211 PolarHBondContact O-N 2.94Å; Q209-E212 PolarHBondContact O-N 3.32Å; Q209-N213 WeakPolarHBondContact O-CB 3.44Å; Q209-N213 VanDerWaalsContact O-CG 3.29Å; Q209-N213 PolarHBondContact O-N 2.62Å; Q209-N213 PolarHBondContact O-ND2 3.26Å
210	L	61.4	Low	68.4	Low	114 Å²	114	70.6 Å²	70.6	60%	0.597	35%	0.348	S	S	*	.	H	α-helix	trans	-59.6	-36.7	173.5	-104	157.3	0	0	0	110.9	R206 S207 L208 V214	R206-L210 VanDerWaalsContact O-CB 3.31Å; R206-L210 WeakPolarHBondContact O-CB 3.36Å; R206-L210 PolarHBondContact O-N 2.87Å; S207-L210 WeakPolarHBondContact O-CB 3.37Å; S207-L210 PolarHBondContact O-N 3.22Å; L208-L210 VanDerWaalsContact C-N 3.3Å; L208-L210 PolarHBondContact O-N 3.32Å; L210-V214 WeakPolarHBondContact O-CG2 3.15Å
211	F	58.7	Low	67.2	Low	34 Å²	34	66.1 Å²	66.1	15%	0.149	33%	0.328	C	S	.	.	H	α-helix	trans	-77.3	-34.4	176.3	-56.1	-52.5	0	0	0	112.6	I153 S207 L208 Q209 V214	I153-F211 HydrophobicContact CD1-CB 4.1Å; I153-F211 HydrophobicContact CD1-CD1 3.87Å; I153-F211 HydrophobicContact CD1-CD2 4.34Å; I153-F211 HydrophobicContact CD1-CE1 4.37Å; I153-F211 HydrophobicContact CD1-CG 3.85Å; I153-F211 HydrophobicContact CG2-CD1 3.59Å; I153-F211 HydrophobicContact CG2-CE1 3.68Å; S207-F211 WeakPolarHBondContact O-CD2 3.14Å; S207-F211 VanDerWaalsContact O-CE2 3.25Å; S207-F211 WeakPolarHBondContact O-CE2 3.35Å; S207-F211 WeakPolarHBondContact O-CG 3.48Å; S207-F211 PolarHBondContact O-N 2.91Å; L208-F211 WeakPolarHBondContact O-CB 3.42Å; L208-F211 PolarHBondContact O-N 2.93Å; L208-F211 VanDerWaalsContact O-N 3.07Å; Q209-F211 PolarHBondContact O-N 2.94Å; F211-V214 PolarHBondContact O-N 3.21Å
212	E	59.8	Low	66	Low	31 Å²	31	68.5 Å²	68.5	15%	0.145	34%	0.339	C	S	.	.	H	α-helix	trans	-65.7	-38.2	171.8	-75.2	-171.1	140.3	0	0	113.1	T129 L208 Q209 V214 I215	T129-E212 PolarHBondContact OG1-OE1 3.46Å; L208-E212 PolarHBondContact O-N 2.83Å; Q209-E212 PolarHBondContact O-N 3.32Å; E212-V214 PolarHBondContact O-N 2.89Å; E212-V214 VanDerWaalsContact O-N 3.16Å; E212-I215 WeakPolarHBondContact O-CB 3.46Å; E212-I215 PolarHBondContact O-N 2.62Å
213	N	52.3	Low	65	Low	133 Å²	133	64.1 Å²	64.1	71%	0.711	32%	0.32	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.2	-5.5	179.7	-72	-56.5	0	0	0	113.6	Q209 I215	Q209-N213 WeakPolarHBondContact O-CB 3.44Å; Q209-N213 VanDerWaalsContact O-CG 3.29Å; Q209-N213 PolarHBondContact O-N 2.62Å; Q209-N213 PolarHBondContact O-ND2 3.26Å; N213-I215 VanDerWaalsContact C-N 3.33Å
214	V	50	Low	64	Low	43 Å²	43	61 Å²	61	26%	0.261	30%	0.301	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.1	-14	172.4	-180	0	0	0	0	111.1	F81 M156 L210 F211 E212	F81-V214 HydrophobicContact CE1-CG1 3.85Å; F81-V214 HydrophobicContact CZ-CG1 3.55Å; M156-V214 HydrophobicContact CE-CB 4.41Å; M156-V214 HydrophobicContact CE-CG1 3.39Å; M156-V214 HydrophobicContact SD-CG1 4.28Å; L210-V214 WeakPolarHBondContact O-CG2 3.15Å; F211-V214 PolarHBondContact O-N 3.21Å; E212-V214 PolarHBondContact O-N 2.89Å; E212-V214 VanDerWaalsContact O-N 3.16Å
215	I	46.1	Very low	62.7	Low	80 Å²	80	66.3 Å²	66.3	41%	0.41	33%	0.327	S	S	.	.			trans	-84.8	0	175.7	-50.2	175.2	0	0	0	110.4	Y89 L93 L117 W128 E212 N213	Y89-I215 WeakPolarHBondContact OH-CD1 3.34Å; L93-I215 HydrophobicContact CD1-CD1 4.12Å; L93-I215 HydrophobicContact CD2-CG2 4.5Å; L117-I215 HydrophobicContact CD1-CG2 4.34Å; W128-I215 HydrophobicContact CH2-CD1 4.12Å; W128-I215 HydrophobicContact CZ3-CD1 3.88Å; E212-I215 WeakPolarHBondContact O-CB 3.46Å; E212-I215 PolarHBondContact O-N 2.62Å; N213-I215 VanDerWaalsContact C-N 3.33Å

Retrieved 215 of 215 residues in 101.7 ms (Link to these results)

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