A0A077ZA74_TRITR Loading...

L-Fucosyltransferase

AlphaFold DB , UniProt , Accession A0A077ZA74, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 339 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	41.2	Very low	35.6	Very low	244 Å²	244	143.1 Å²	143.1	100%	1.202	76%	0.759	S	S	*	*				0	116.8	0	-69.9	179.9	-120.4	0	0	106	E3	M1-E3 PolarHBondContact O-N 3.16Å
2	A	36.7	Very low	35.9	Very low	95 Å²	95	140.6 Å²	140.6	79%	0.785	75%	0.753	S	S	*	*			trans	-77.1	121.3	-178.4	0	0	0	0	0	108.9	I4	A2-I4 PolarHBondContact O-N 2.75Å
3	E	36.4	Very low	36	Very low	153 Å²	153	142.8 Å²	142.8	72%	0.715	76%	0.759	S	S	*	*			trans	-65.4	112.9	171.4	-82	-178.9	145.8	0	0	109	M1 Y5	M1-E3 PolarHBondContact O-N 3.16Å; E3-Y5 HydrophobicContact CB-CE2 4.14Å; E3-Y5 PolarHBondContact O-N 3.31Å
4	I	33.9	Very low	36.5	Very low	149 Å²	149	141.3 Å²	141.3	76%	0.764	75%	0.752	S	S	*	*			trans	-81.7	103.6	173.7	-61.8	173.3	0	0	0	106.8	A2 I6	A2-I4 PolarHBondContact O-N 2.75Å; I4-I6 HydrophobicContact CG2-CG1 4.2Å; I4-I6 PolarHBondContact O-N 2.74Å
5	Y	30.7	Very low	36.7	Very low	185 Å²	185	141.8 Å²	141.8	73%	0.725	75%	0.751	S	S	*	*			trans	-74.3	105.2	171	-72.1	-87.5	0	0	0	109.6	E3 I7	E3-Y5 HydrophobicContact CB-CE2 4.14Å; E3-Y5 PolarHBondContact O-N 3.31Å; Y5-I7 PolarHBondContact O-N 3.01Å
6	I	36.4	Very low	36.9	Very low	143 Å²	143	142.7 Å²	142.7	73%	0.733	75%	0.746	S	S	*	*			trans	-83.3	97.2	171.5	-57.8	175.8	0	0	0	107.7	I4 K8	I4-I6 HydrophobicContact CG2-CG1 4.2Å; I4-I6 PolarHBondContact O-N 2.74Å; I6-K8 PolarHBondContact O-N 2.71Å
7	I	36.7	Very low	36.9	Very low	153 Å²	153	138.3 Å²	138.3	79%	0.785	74%	0.744	S	S	*	*			trans	-73.5	105.7	171.6	-57.6	174.6	0	0	0	107.4	Y5	Y5-I7 PolarHBondContact O-N 3.01Å
8	K	34.4	Very low	36.7	Very low	178 Å²	178	137.1 Å²	137.1	77%	0.774	76%	0.756	S	S	*	*	P	Polyproline II helix	trans	-71.3	129.9	171.2	-77.2	-176.2	177.5	178.2	0	109.1	I6 A10	I6-K8 PolarHBondContact O-N 2.71Å; K8-A10 PolarHBondContact O-N 3.38Å
9	P	35.3	Very low	36.5	Very low	115 Å²	115	133.6 Å²	133.6	75%	0.747	76%	0.755	S	S	*	*	P	Polyproline II helix	trans	-66.8	118.2	174.6	25.6	-30.7	0	0	0	109.2	T11	P9-T11 PolarHBondContact O-N 3.19Å
10	A	34.2	Very low	36.3	Very low	66 Å²	66	136.3 Å²	136.3	55%	0.545	76%	0.761	S	S	.	*	P	Polyproline II helix	trans	-60.3	119	168.7	0	0	0	0	0	108.1	K8 D14	K8-A10 PolarHBondContact O-N 3.38Å; A10-D14 HydrophobicContact CB-CB 4.43Å
11	T	35.7	Very low	36.3	Very low	93 Å²	93	134.9 Å²	134.9	57%	0.571	76%	0.757	S	S	*	*	P	Polyproline II helix	trans	-74.3	151.7	176	53.9	0	0	0	0	109.2	P9 M13 D14	P9-T11 PolarHBondContact O-N 3.19Å; T11-M13 PolarHBondContact O-N 3.43Å; T11-D14 PolarHBondContact O-N 3.45Å
12	T	40	Very low	35.9	Very low	113 Å²	113	131.4 Å²	131.4	69%	0.693	74%	0.743	S	S	*	*	T	Hydrogen-bonded Turn	trans	-52.8	-17.7	-172.9	-9.9	0	0	0	0	114.6	F16	T12-F16 HydrophobicContact CG2-CE2 4.5Å; T12-F16 WeakPolarHBondContact O-CD2 3.46Å
13	M	36.2	Very low	35.9	Very low	169 Å²	169	135.7 Å²	135.7	83%	0.833	74%	0.744	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.6	-24.1	173.4	-77.7	-155.3	160.7	0	0	114.5	T11 M15	T11-M13 PolarHBondContact O-N 3.43Å; M13-M15 VanDerWaalsContact C-N 3.3Å; M13-M15 PolarHBondContact O-N 2.85Å
14	D	42.9	Very low	35.9	Very low	122 Å²	122	136.6 Å²	136.6	65%	0.652	75%	0.753	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.5	-20.7	178.5	-67.5	-35.6	0	0	0	112.5	A10 T11	A10-D14 HydrophobicContact CB-CB 4.43Å; T11-D14 PolarHBondContact O-N 3.45Å
15	M	40.2	Very low	36	Very low	149 Å²	149	133.2 Å²	133.2	73%	0.734	75%	0.747	S	S	*	*	T	Hydrogen-bonded Turn	trans	-94.4	-20.6	-179.3	-75.4	-170.3	169.1	0	0	114.2	M13	M13-M15 VanDerWaalsContact C-N 3.3Å; M13-M15 PolarHBondContact O-N 2.85Å
16	F	40.1	Very low	36	Very low	156 Å²	156	136.2 Å²	136.2	68%	0.684	76%	0.757	S	S	*	*	S	Bend	trans	-126.1	87.3	-176.4	-60.4	-74.7	0	0	0	108.8	T12	T12-F16 HydrophobicContact CG2-CE2 4.5Å; T12-F16 WeakPolarHBondContact O-CD2 3.46Å
17	G	36.5	Very low	36.1	Very low	68 Å²	68	136.8 Å²	136.8	70%	0.701	76%	0.76	S	S	*	*			trans	-47.5	151	178.8	0	0	0	0	0	113.1	G19	G17-G19 PolarHBondContact O-N 3Å
18	A	33.9	Very low	36.2	Very low	117 Å²	117	134.4 Å²	134.4	97%	0.967	76%	0.755	S	S	*	*			trans	-46.5	94.2	-175.6	0	0	0	0	0	113.4
19	G	33.1	Very low	36.6	Very low	71 Å²	71	131.8 Å²	131.8	73%	0.732	76%	0.756	S	S	*	*			trans	-104.2	116.7	168.8	0	0	0	0	0	109.2	G17	G17-G19 PolarHBondContact O-N 3Å
20	E	32.8	Very low	36.9	Very low	187 Å²	187	137.4 Å²	137.4	87%	0.874	76%	0.762	S	S	*	*			trans	-54.1	144.5	-176.1	-68.3	-175.5	145.1	0	0	114	L22	E20-L22 PolarHBondContact O-N 3.37Å; E20-L22 VanDerWaalsContact O-N 3.17Å
21	P	35.6	Very low	37.4	Very low	106 Å²	106	146 Å²	146	69%	0.688	78%	0.78	S	S	*	*			trans	-72.6	107.1	173.8	28.8	-32	0	0	0	110.9	F23	P21-F23 PolarHBondContact O-N 2.03Å
22	L	33.1	Very low	37.7	Very low	171 Å²	171	150 Å²	150	90%	0.895	79%	0.79	S	S	*	*			trans	-69.2	96.4	165.8	-97.8	156.8	0	0	0	109.7	E20 L24	E20-L22 PolarHBondContact O-N 3.37Å; E20-L22 VanDerWaalsContact O-N 3.17Å; L22-L24 PolarHBondContact O-N 2.73Å
23	F	35.4	Very low	38	Very low	185 Å²	185	156.4 Å²	156.4	81%	0.811	80%	0.801	S	S	*	*			trans	-54.5	105.9	166.7	-86.8	-99.2	0	0	0	110.7	P21 A25	P21-F23 PolarHBondContact O-N 2.03Å; F23-A25 VanDerWaalsContact C-N 3.27Å; F23-A25 PolarHBondContact O-N 2.76Å
24	L	36.8	Very low	38.4	Very low	172 Å²	172	152.4 Å²	152.4	90%	0.901	78%	0.782	S	S	*	*			trans	-77.9	82.9	159.9	-76.8	170	0	0	0	108.8	L22 R26	L22-L24 PolarHBondContact O-N 2.73Å; L24-R26 PolarHBondContact O-N 2.82Å
25	A	36.3	Very low	38.8	Very low	78 Å²	78	151.5 Å²	151.5	65%	0.645	78%	0.781	S	S	*	*			trans	-62.5	116.4	166.9	0	0	0	0	0	109.6	F23 I27	F23-A25 VanDerWaalsContact C-N 3.27Å; F23-A25 PolarHBondContact O-N 2.76Å; A25-I27 PolarHBondContact O-N 3.49Å
26	R	31.7	Very low	39.9	Very low	249 Å²	249	148 Å²	148	94%	0.94	78%	0.775	S	S	*	*			trans	-58.5	100.9	167	-83.7	179.2	175	169.1	-0.8	109.5	L24	L24-R26 PolarHBondContact O-N 2.82Å
27	I	38.6	Very low	41.3	Very low	154 Å²	154	145.4 Å²	145.4	79%	0.79	78%	0.776	S	S	*	*			trans	-91.4	121.7	163.1	-59.1	177.5	0	0	0	107.7	A25	A25-I27 PolarHBondContact O-N 3.49Å
28	P	38.4	Very low	43	Very low	104 Å²	104	144.1 Å²	144.1	68%	0.675	76%	0.756	S	S	*	*			trans	-70.7	151.8	-175.4	27.7	-33.3	0	0	0	112.2	R30	P28-R30 PolarHBondContact O-N 2.81Å
29	P	42	Very low	45	Very low	122 Å²	122	143 Å²	143	79%	0.792	73%	0.733	S	S	*	*			trans	-72.7	104.3	-173.1	29	-33.5	0	0	0	111.2	R31	P29-R31 PolarHBondContact O-N 2.87Å
30	R	42.3	Very low	47.3	Very low	233 Å²	233	144.8 Å²	144.8	88%	0.879	73%	0.725	S	S	*	*			trans	-72	95.6	163	-102.8	-177.8	173.7	172.1	-1.3	109.1	P28 K32	P28-R30 PolarHBondContact O-N 2.81Å; R30-K32 VanDerWaalsContact C-N 3.35Å; R30-K32 PolarHBondContact O-N 3.13Å
31	R	43.5	Very low	49.6	Very low	246 Å²	246	143.5 Å²	143.5	93%	0.928	72%	0.716	S	S	*	*			trans	-60.8	91.5	164.5	-80.2	-177.5	177.8	176.8	-0.4	109.5	P29	P29-R31 PolarHBondContact O-N 2.87Å
32	K	42.7	Very low	51.8	Low	178 Å²	178	144.6 Å²	144.6	77%	0.774	71%	0.71	S	S	*	*			trans	-80.4	116.5	159.4	-77.1	-172.5	176.8	-178	0	107.6	R30 M34	R30-K32 VanDerWaalsContact C-N 3.35Å; R30-K32 PolarHBondContact O-N 3.13Å; K32-M34 PolarHBondContact O-N 2.87Å
33	R	45.8	Very low	54.3	Low	248 Å²	248	141.2 Å²	141.2	94%	0.936	69%	0.692	S	S	*	*			trans	-54.2	104.5	167.9	-85.4	-178.6	177.6	174	-0.8	107.9	T35	R33-T35 PolarHBondContact O-N 2.82Å
34	M	44.6	Very low	56.7	Low	85 Å²	85	136.4 Å²	136.4	42%	0.419	68%	0.675	S	S	.	*			trans	-77.2	112.7	169.3	-71.8	-176.8	73.7	0	0	107.2	K32 S38 K42	K32-M34 PolarHBondContact O-N 2.87Å; M34-S38 VanDerWaalsContact CE-OG 3.29Å; M34-S38 WeakPolarHBondContact CE-OG 3.38Å; M34-K42 HydrophobicContact CE-CD 3.74Å; M34-K42 VanDerWaalsContact CE-CE 3.46Å
35	T	51.5	Low	59	Low	102 Å²	102	132.3 Å²	132.3	63%	0.626	66%	0.657	S	S	*	*			trans	-64.3	145.4	168.7	45.2	0	0	0	0	109.2	R33 C37 S38	R33-T35 PolarHBondContact O-N 2.82Å; T35-C37 PolarHBondContact O-N 3.44Å; T35-S38 WeakPolarHBondContact O-CB 3.36Å; T35-S38 PolarHBondContact O-N 2.81Å
36	A	64.3	Low	61.4	Low	75 Å²	75	135 Å²	135	62%	0.62	66%	0.655	S	S	*	*	H	α-helix	trans	-51.4	-30.6	-174.2	0	0	0	0	0	113.7	S38 L39 I40	A36-S38 VanDerWaalsContact C-N 3.3Å; A36-S38 PolarHBondContact O-N 3.43Å; A36-L39 PolarHBondContact O-N 3.05Å; A36-I40 PolarHBondContact O-N 3.39Å
37	C	69.5	Low	64.2	Low	103 Å²	103	127.9 Å²	127.9	70%	0.696	64%	0.635	S	S	*	*	H	α-helix	trans	-64.8	-29.3	176.7	-150	0	0	0	0	113.3	T35 K41	T35-C37 PolarHBondContact O-N 3.44Å; C37-K41 PolarHBondContact O-N 2.82Å
38	S	71.5	Confident	66.6	Low	41 Å²	41	127.4 Å²	127.4	29%	0.287	63%	0.627	S	S	.	*	H	α-helix	trans	-73.5	-34.9	176.3	179.5	0	0	0	0	112.8	M34 T35 A36 K41 K42	M34-S38 VanDerWaalsContact CE-OG 3.29Å; M34-S38 WeakPolarHBondContact CE-OG 3.38Å; T35-S38 WeakPolarHBondContact O-CB 3.36Å; T35-S38 PolarHBondContact O-N 2.81Å; A36-S38 VanDerWaalsContact C-N 3.3Å; A36-S38 PolarHBondContact O-N 3.43Å; S38-K41 PolarHBondContact O-N 3.29Å; S38-K42 PolarHBondContact O-N 2.92Å; S38-K42 VanDerWaalsContact O-N 3.11Å
39	L	75.7	Confident	69	Low	93 Å²	93	126.5 Å²	126.5	49%	0.487	62%	0.62	S	S	.	*	H	α-helix	trans	-68.3	-44.7	179.7	-112.3	147.6	0	0	0	111.3	A36 K41 K42 L43	A36-L39 PolarHBondContact O-N 3.05Å; L39-K41 VanDerWaalsContact C-N 3.34Å; L39-K41 PolarHBondContact O-N 3.04Å; L39-K42 PolarHBondContact O-N 3.1Å; L39-L43 HydrophobicContact CD2-CD1 4.42Å; L39-L43 PolarHBondContact O-N 3.01Å
40	I	81.7	Confident	71.2	Confident	108 Å²	108	123.2 Å²	123.2	55%	0.554	60%	0.597	S	S	*	*	H	α-helix	trans	-60.5	-43.8	175.9	-65.7	170.7	0	0	0	110.6	A36 K42 L43 L44	A36-I40 PolarHBondContact O-N 3.39Å; I40-K42 PolarHBondContact O-N 3.31Å; I40-L43 PolarHBondContact O-N 2.96Å; I40-L44 HydrophobicContact CG2-CD1 3.78Å; I40-L44 WeakPolarHBondContact O-CB 3.3Å; I40-L44 PolarHBondContact O-N 3Å
41	K	80.6	Confident	73.6	Confident	160 Å²	160	116.9 Å²	116.9	70%	0.696	58%	0.58	S	S	*	*	H	α-helix	trans	-59.6	-46.3	176.2	-114.5	-178.3	179.3	-179.1	0	112.1	C37 S38 L39 L44 T45	C37-K41 PolarHBondContact O-N 2.82Å; S38-K41 PolarHBondContact O-N 3.29Å; L39-K41 VanDerWaalsContact C-N 3.34Å; L39-K41 PolarHBondContact O-N 3.04Å; K41-L44 PolarHBondContact O-N 2.9Å; K41-T45 PolarHBondContact O-N 2.63Å; K41-T45 PolarHBondContact O-OG1 3.31Å
42	K	81.8	Confident	75.7	Confident	129 Å²	129	106.6 Å²	106.6	56%	0.561	55%	0.551	S	S	*	*	H	α-helix	trans	-65.5	-41.1	179	-72.9	-167.8	-173.6	179.8	0	112.8	M34 S38 L39 I40 T45 F46	M34-K42 HydrophobicContact CE-CD 3.74Å; M34-K42 VanDerWaalsContact CE-CE 3.46Å; S38-K42 PolarHBondContact O-N 2.92Å; S38-K42 VanDerWaalsContact O-N 3.11Å; L39-K42 PolarHBondContact O-N 3.1Å; I40-K42 PolarHBondContact O-N 3.31Å; K42-T45 PolarHBondContact O-N 3.39Å; K42-F46 PolarHBondContact O-N 3.12Å
43	L	85.3	Confident	77.9	Confident	100 Å²	100	101 Å²	101	52%	0.524	54%	0.538	S	S	.	.	H	α-helix	trans	-62.9	-45.2	176.9	-108.4	145	0	0	0	111.9	L39 I40 T45 F46 L47	L39-L43 HydrophobicContact CD2-CD1 4.42Å; L39-L43 PolarHBondContact O-N 3.01Å; I40-L43 PolarHBondContact O-N 2.96Å; L43-T45 VanDerWaalsContact C-N 3.35Å; L43-T45 PolarHBondContact O-N 3.41Å; L43-F46 PolarHBondContact O-N 3.31Å; L43-L47 WeakPolarHBondContact O-CG 2.97Å; L43-L47 PolarHBondContact O-N 2.73Å
44	L	85.7	Confident	79.9	Confident	85 Å²	85	93.9 Å²	93.9	45%	0.445	52%	0.518	S	S	.	.	H	α-helix	trans	-60.2	-45	173.5	-86	155.4	0	0	0	111.3	I40 K41 F46 L47 F48	I40-L44 HydrophobicContact CG2-CD1 3.78Å; I40-L44 WeakPolarHBondContact O-CB 3.3Å; I40-L44 PolarHBondContact O-N 3Å; K41-L44 PolarHBondContact O-N 2.9Å; L44-F46 VanDerWaalsContact C-N 3.32Å; L44-F46 PolarHBondContact O-N 3.21Å; L44-L47 PolarHBondContact O-N 2.65Å; L44-F48 HydrophobicContact CB-CD2 4.47Å; L44-F48 HydrophobicContact CB-CE2 4.44Å; L44-F48 HydrophobicContact CD2-CE2 3.82Å; L44-F48 WeakPolarHBondContact O-CD2 3.14Å; L44-F48 PolarHBondContact O-N 3.23Å
45	T	84.8	Confident	81.9	Confident	86 Å²	86	94 Å²	94	53%	0.528	52%	0.52	S	S	.	.	H	α-helix	trans	-60.7	-42.6	179.2	-37.9	0	0	0	0	111.3	K41 K42 L43 F48 T49	K41-T45 PolarHBondContact O-N 2.63Å; K41-T45 PolarHBondContact O-OG1 3.31Å; K42-T45 PolarHBondContact O-N 3.39Å; L43-T45 VanDerWaalsContact C-N 3.35Å; L43-T45 PolarHBondContact O-N 3.41Å; T45-F48 PolarHBondContact O-N 3.32Å; T45-T49 WeakPolarHBondContact O-CG2 3.27Å; T45-T49 PolarHBondContact O-N 2.82Å; T45-T49 PolarHBondContact O-OG1 3.12Å
46	F	88.3	Confident	83.5	Confident	135 Å²	135	92.7 Å²	92.7	59%	0.592	51%	0.511	S	S	*	.	H	α-helix	trans	-67	-38.2	177.1	-174.7	-94.8	0	0	0	113	K42 L43 L44 T49 T50	K42-F46 PolarHBondContact O-N 3.12Å; L43-F46 PolarHBondContact O-N 3.31Å; L44-F46 VanDerWaalsContact C-N 3.32Å; L44-F46 PolarHBondContact O-N 3.21Å; F46-T49 WeakPolarHBondContact CA-OG1 3.42Å; F46-T49 PolarHBondContact O-N 3.3Å; F46-T49 PolarHBondContact O-OG1 2.74Å; F46-T50 HydrophobicContact CD1-CG2 4.17Å; F46-T50 HydrophobicContact CE1-CG2 3.74Å; F46-T50 HydrophobicContact CE2-CG2 4.29Å; F46-T50 HydrophobicContact CZ-CG2 3.81Å; F46-T50 WeakPolarHBondContact O-CB 3.37Å; F46-T50 WeakPolarHBondContact O-CG2 3.11Å; F46-T50 PolarHBondContact O-N 2.99Å; F46-T50 PolarHBondContact O-OG1 3.45Å
47	L	89.6	Confident	84.4	Confident	99 Å²	99	95.3 Å²	95.3	52%	0.518	51%	0.506	S	S	.	.	H	α-helix	trans	-66	-42	174.7	-79.4	163.8	0	0	0	111.3	L43 L44 T50 L51	L43-L47 WeakPolarHBondContact O-CG 2.97Å; L43-L47 PolarHBondContact O-N 2.73Å; L44-L47 PolarHBondContact O-N 2.65Å; L47-T50 WeakPolarHBondContact CA-OG1 3.46Å; L47-T50 PolarHBondContact O-OG1 3.41Å; L47-T50 VanDerWaalsContact O-OG1 3.09Å; L47-L51 WeakPolarHBondContact O-CB 3.09Å; L47-L51 PolarHBondContact O-N 3.48Å
48	F	88.9	Confident	85	Confident	144 Å²	144	95.5 Å²	95.5	63%	0.632	50%	0.498	S	S	*	.	H	α-helix	trans	-65.9	-37.7	176.6	-79.4	-65.1	0	0	0	112.7	L44 T45 G52	L44-F48 HydrophobicContact CB-CD2 4.47Å; L44-F48 HydrophobicContact CB-CE2 4.44Å; L44-F48 HydrophobicContact CD2-CE2 3.82Å; L44-F48 WeakPolarHBondContact O-CD2 3.14Å; L44-F48 PolarHBondContact O-N 3.23Å; T45-F48 PolarHBondContact O-N 3.32Å; F48-G52 PolarHBondContact O-N 2.86Å
49	T	88.1	Confident	85.5	Confident	85 Å²	85	99 Å²	99	52%	0.521	51%	0.51	S	S	.	.	H	α-helix	trans	-71.6	-40.3	177.3	52.8	0	0	0	0	112.7	T45 F46 G52 A53	T45-T49 WeakPolarHBondContact O-CG2 3.27Å; T45-T49 PolarHBondContact O-N 2.82Å; T45-T49 PolarHBondContact O-OG1 3.12Å; F46-T49 WeakPolarHBondContact CA-OG1 3.42Å; F46-T49 PolarHBondContact O-N 3.3Å; F46-T49 PolarHBondContact O-OG1 2.74Å; T49-G52 PolarHBondContact O-N 2.7Å; T49-A53 WeakPolarHBondContact O-CB 3.46Å; T49-A53 PolarHBondContact O-N 2.95Å
50	T	89.8	Confident	85.6	Confident	52 Å²	52	99.8 Å²	99.8	32%	0.319	51%	0.514	S	S	.	.	H	α-helix	trans	-68.8	-41	177.1	49.1	0	0	0	0	111.8	F46 L47 A53 L54	F46-T50 HydrophobicContact CD1-CG2 4.17Å; F46-T50 HydrophobicContact CE1-CG2 3.74Å; F46-T50 HydrophobicContact CE2-CG2 4.29Å; F46-T50 HydrophobicContact CZ-CG2 3.81Å; F46-T50 WeakPolarHBondContact O-CB 3.37Å; F46-T50 WeakPolarHBondContact O-CG2 3.11Å; F46-T50 PolarHBondContact O-N 2.99Å; F46-T50 PolarHBondContact O-OG1 3.45Å; L47-T50 WeakPolarHBondContact CA-OG1 3.46Å; L47-T50 PolarHBondContact O-OG1 3.41Å; L47-T50 VanDerWaalsContact O-OG1 3.09Å; T50-A53 PolarHBondContact O-N 3.06Å; T50-L54 WeakPolarHBondContact O-CB 3.14Å; T50-L54 PolarHBondContact O-N 2.02Å
51	L	91.2	Very high	85.1	Confident	100 Å²	100	101.8 Å²	101.8	52%	0.524	52%	0.515	S	S	.	.	H	α-helix	trans	-64.5	-42.4	173.7	-163.3	72.3	0	0	0	111.6	L47 L54 I55	L47-L51 WeakPolarHBondContact O-CB 3.09Å; L47-L51 PolarHBondContact O-N 3.48Å; L51-L54 PolarHBondContact O-N 3.17Å; L51-I55 HydrophobicContact CG-CD1 4.18Å; L51-I55 VanDerWaalsContact O-CG1 3.31Å; L51-I55 WeakPolarHBondContact O-CG1 3.41Å; L51-I55 PolarHBondContact O-N 3.32Å
52	G	88.8	Confident	84.5	Confident	31 Å²	31	102.3 Å²	102.3	32%	0.32	52%	0.52	S	S	.	.	H	α-helix	trans	-59	-47.3	174.5	0	0	0	0	0	112.1	F48 T49 L54 I55 T56	F48-G52 PolarHBondContact O-N 2.86Å; T49-G52 PolarHBondContact O-N 2.7Å; G52-L54 VanDerWaalsContact C-N 3.33Å; G52-L54 PolarHBondContact O-N 3.04Å; G52-I55 PolarHBondContact O-N 3.14Å; G52-T56 PolarHBondContact O-N 3.37Å; G52-T56 PolarHBondContact O-OG1 3.35Å
53	A	88	Confident	83.3	Confident	61 Å²	61	103.9 Å²	103.9	50%	0.504	53%	0.529	S	S	.	.	H	α-helix	trans	-61.9	-38.8	176.3	0	0	0	0	0	112.6	T49 T50 T56 Y57	T49-A53 WeakPolarHBondContact O-CB 3.46Å; T49-A53 PolarHBondContact O-N 2.95Å; T50-A53 PolarHBondContact O-N 3.06Å; A53-T56 PolarHBondContact O-N 2.72Å; A53-Y57 VanDerWaalsContact O-CB 3.27Å; A53-Y57 WeakPolarHBondContact O-CB 3.47Å; A53-Y57 PolarHBondContact O-N 2.83Å
54	L	89	Confident	81.5	Confident	98 Å²	98	101.6 Å²	101.6	51%	0.513	53%	0.525	S	S	.	.	H	α-helix	trans	-65.5	-42.8	175.1	-102.2	152.9	0	0	0	112.4	T50 L51 G52 Y57 M58	T50-L54 WeakPolarHBondContact O-CB 3.14Å; T50-L54 PolarHBondContact O-N 2.02Å; L51-L54 PolarHBondContact O-N 3.17Å; G52-L54 VanDerWaalsContact C-N 3.33Å; G52-L54 PolarHBondContact O-N 3.04Å; L54-Y57 PolarHBondContact O-N 2.94Å; L54-M58 WeakPolarHBondContact O-CB 3.47Å; L54-M58 VanDerWaalsContact O-CG 3.26Å; L54-M58 WeakPolarHBondContact O-CG 3.37Å; L54-M58 PolarHBondContact O-N 3.39Å
55	I	87	Confident	79.5	Confident	88 Å²	88	102.7 Å²	102.7	45%	0.451	54%	0.537	S	S	.	.	H	α-helix	trans	-64.4	-45.2	176.2	-68.2	166.4	0	0	0	110	L51 G52 Y57 M58 Q59	L51-I55 HydrophobicContact CG-CD1 4.18Å; L51-I55 VanDerWaalsContact O-CG1 3.31Å; L51-I55 WeakPolarHBondContact O-CG1 3.41Å; L51-I55 PolarHBondContact O-N 3.32Å; G52-I55 PolarHBondContact O-N 3.14Å; I55-Y57 VanDerWaalsContact C-N 3.35Å; I55-Y57 PolarHBondContact O-N 3.44Å; I55-M58 PolarHBondContact O-N 3.06Å; I55-Q59 HydrophobicContact CG2-CG 4.36Å; I55-Q59 WeakPolarHBondContact O-CB 3.42Å; I55-Q59 WeakPolarHBondContact O-CG 3.31Å; I55-Q59 PolarHBondContact O-N 3.46Å
56	T	83.5	Confident	77.7	Confident	73 Å²	73	103.6 Å²	103.6	45%	0.448	55%	0.546	S	S	.	.	H	α-helix	trans	-62.2	-42.7	176.2	-49.2	0	0	0	0	111.3	G52 A53 M58 Q59 I60	G52-T56 PolarHBondContact O-N 3.37Å; G52-T56 PolarHBondContact O-OG1 3.35Å; A53-T56 PolarHBondContact O-N 2.72Å; T56-M58 PolarHBondContact O-N 3.25Å; T56-Q59 PolarHBondContact O-N 2.99Å; T56-I60 HydrophobicContact CG2-CD1 3.96Å; T56-I60 WeakPolarHBondContact O-CB 3.43Å; T56-I60 VanDerWaalsContact O-CG1 3.23Å; T56-I60 WeakPolarHBondContact O-CG1 3.09Å; T56-I60 PolarHBondContact O-N 3.46Å
57	Y	84.2	Confident	75.6	Confident	131 Å²	131	102.8 Å²	102.8	51%	0.514	56%	0.555	S	S	.	*	H	α-helix	trans	-60.4	-45.7	175.1	-177.8	-93.4	0	0	0	111.7	A53 L54 I55 I60 Y61	A53-Y57 VanDerWaalsContact O-CB 3.27Å; A53-Y57 WeakPolarHBondContact O-CB 3.47Å; A53-Y57 PolarHBondContact O-N 2.83Å; L54-Y57 PolarHBondContact O-N 2.94Å; I55-Y57 VanDerWaalsContact C-N 3.35Å; I55-Y57 PolarHBondContact O-N 3.44Å; Y57-I60 PolarHBondContact O-N 3.36Å; Y57-Y61 HydrophobicContact CD1-CD2 4.23Å; Y57-Y61 AromaticContact CE1-CD2 3.69Å; Y57-Y61 HydrophobicContact CE1-CD2 3.69Å; Y57-Y61 AromaticContact CE1-CE2 3.9Å; Y57-Y61 HydrophobicContact CE1-CE2 3.9Å; Y57-Y61 HydrophobicContact CE1-CG 4.46Å; Y57-Y61 HydrophobicContact CE2-CD2 4.05Å; Y57-Y61 AromaticContact CE2-CE2 3.88Å; Y57-Y61 HydrophobicContact CE2-CE2 3.88Å; Y57-Y61 AromaticContact CZ-CD2 3.6Å; Y57-Y61 AromaticContact CZ-CE2 3.37Å; Y57-Y61 WeakPolarHBondContact O-CB 3.32Å; Y57-Y61 PolarHBondContact O-N 3.25Å; Y57-Y61 WeakPolarHBondContact OH-CE2 3.45Å
58	M	82.3	Confident	73.6	Confident	106 Å²	106	102.5 Å²	102.5	52%	0.522	56%	0.561	S	S	.	*	H	α-helix	trans	-65	-39.7	176.8	-75.3	-71.5	-174	0	0	112.3	L54 I55 T56 Y61 H62	L54-M58 WeakPolarHBondContact O-CB 3.47Å; L54-M58 VanDerWaalsContact O-CG 3.26Å; L54-M58 WeakPolarHBondContact O-CG 3.37Å; L54-M58 PolarHBondContact O-N 3.39Å; I55-M58 PolarHBondContact O-N 3.06Å; T56-M58 PolarHBondContact O-N 3.25Å; M58-Y61 PolarHBondContact O-N 3.16Å; M58-H62 WeakPolarHBondContact O-CB 3.37Å; M58-H62 PolarHBondContact O-N 2.92Å
59	Q	81.1	Confident	71.7	Confident	115 Å²	115	107.1 Å²	107.1	54%	0.537	57%	0.574	S	S	.	*	H	α-helix	trans	-66.2	-42.2	176.1	-76.9	179.8	-25	0	0	111.7	I55 T56 Y61 H62 Q63	I55-Q59 HydrophobicContact CG2-CG 4.36Å; I55-Q59 WeakPolarHBondContact O-CB 3.42Å; I55-Q59 WeakPolarHBondContact O-CG 3.31Å; I55-Q59 PolarHBondContact O-N 3.46Å; T56-Q59 PolarHBondContact O-N 2.99Å; Q59-Y61 VanDerWaalsContact C-N 3.3Å; Q59-Y61 PolarHBondContact O-N 3.23Å; Q59-H62 PolarHBondContact O-N 2.91Å; Q59-Q63 VanDerWaalsContact O-CB 3.32Å; Q59-Q63 WeakPolarHBondContact O-CB 3.43Å; Q59-Q63 WeakPolarHBondContact O-CG 3.37Å; Q59-Q63 PolarHBondContact O-N 3.28Å
60	I	78.3	Confident	70.2	Confident	110 Å²	110	111 Å²	111	56%	0.564	58%	0.584	S	S	*	*	H	α-helix	trans	-61.8	-40.9	173.3	-68.7	166.3	0	0	0	110.2	T56 Y57 A64	T56-I60 HydrophobicContact CG2-CD1 3.96Å; T56-I60 WeakPolarHBondContact O-CB 3.43Å; T56-I60 VanDerWaalsContact O-CG1 3.23Å; T56-I60 WeakPolarHBondContact O-CG1 3.09Å; T56-I60 PolarHBondContact O-N 3.46Å; Y57-I60 PolarHBondContact O-N 3.36Å; I60-A64 WeakPolarHBondContact O-CB 3.03Å; I60-A64 PolarHBondContact O-N 2.57Å
61	Y	71.4	Confident	69.3	Low	149 Å²	149	117.1 Å²	117.1	58%	0.584	61%	0.609	S	S	*	*	H	α-helix	trans	-71.6	-34.8	177.9	-110.5	-92.2	0	0	0	113.8	Y57 M58 Q59	Y57-Y61 HydrophobicContact CD1-CD2 4.23Å; Y57-Y61 AromaticContact CE1-CD2 3.69Å; Y57-Y61 HydrophobicContact CE1-CD2 3.69Å; Y57-Y61 AromaticContact CE1-CE2 3.9Å; Y57-Y61 HydrophobicContact CE1-CE2 3.9Å; Y57-Y61 HydrophobicContact CE1-CG 4.46Å; Y57-Y61 HydrophobicContact CE2-CD2 4.05Å; Y57-Y61 AromaticContact CE2-CE2 3.88Å; Y57-Y61 HydrophobicContact CE2-CE2 3.88Å; Y57-Y61 AromaticContact CZ-CD2 3.6Å; Y57-Y61 AromaticContact CZ-CE2 3.37Å; Y57-Y61 WeakPolarHBondContact O-CB 3.32Å; Y57-Y61 PolarHBondContact O-N 3.25Å; Y57-Y61 WeakPolarHBondContact OH-CE2 3.45Å; M58-Y61 PolarHBondContact O-N 3.16Å; Q59-Y61 VanDerWaalsContact C-N 3.3Å; Q59-Y61 PolarHBondContact O-N 3.23Å
62	H	67.4	Low	68.6	Low	171 Å²	171	119 Å²	119	79%	0.792	61%	0.609	S	S	*	*	H	α-helix	trans	-77.5	-30.7	177.3	-105.1	-68.1	0	0	0	112.9	M58 Q59	M58-H62 WeakPolarHBondContact O-CB 3.37Å; M58-H62 PolarHBondContact O-N 2.92Å; Q59-H62 PolarHBondContact O-N 2.91Å
63	Q	57.4	Low	68.4	Low	163 Å²	163	118.6 Å²	118.6	76%	0.762	60%	0.601	S	S	*	*	H	α-helix	trans	-86.4	-14.6	173.8	-72	-173.3	-11.7	0	0	113.2	Q59 P65	Q59-Q63 VanDerWaalsContact O-CB 3.32Å; Q59-Q63 WeakPolarHBondContact O-CB 3.43Å; Q59-Q63 WeakPolarHBondContact O-CG 3.37Å; Q59-Q63 PolarHBondContact O-N 3.28Å; Q63-P65 WeakPolarHBondContact O-CD 3.18Å
64	A	46.8	Very low	68.5	Low	52 Å²	52	117.3 Å²	117.3	43%	0.43	59%	0.593	S	S	.	*	S	Bend	trans	-59	112.9	166.6	0	0	0	0	0	106.4	I60 S66	I60-A64 WeakPolarHBondContact O-CB 3.03Å; I60-A64 PolarHBondContact O-N 2.57Å; A64-S66 PolarHBondContact O-N 3.03Å
65	P	42.6	Very low	68.6	Low	108 Å²	108	113 Å²	113	70%	0.701	57%	0.572	S	S	*	*			trans	-52.3	125.6	172.2	20.6	-29.7	0	0	0	106.1	Q63	Q63-P65 WeakPolarHBondContact O-CD 3.18Å
66	S	47	Very low	68.8	Low	104 Å²	104	108.8 Å²	108.8	73%	0.727	55%	0.55	S	S	*	*			trans	-36.2	121.4	163	171.2	0	0	0	0	105.6	A64 S68	A64-S66 PolarHBondContact O-N 3.03Å; S66-S68 PolarHBondContact O-N 3.49Å
67	P	45.6	Very low	69.1	Low	118 Å²	118	106.7 Å²	106.7	77%	0.766	54%	0.536	S	S	*	.			trans	-58.3	96.1	-172.2	21.8	-31.7	0	0	0	106.2	R69	P67-R69 PolarHBondContact O-N 2.89Å
68	S	46.2	Very low	69.4	Low	93 Å²	93	100.5 Å²	100.5	65%	0.65	51%	0.511	S	S	*	.			trans	-49.8	115.7	169.6	56.4	0	0	0	0	101.6	S66 K70	S66-S68 PolarHBondContact O-N 3.49Å; S68-K70 PolarHBondContact O-N 3.37Å
69	R	50.8	Low	69.5	Low	242 Å²	242	95.6 Å²	95.6	91%	0.913	49%	0.487	S	S	*	.			trans	-41.7	100.7	176.2	-94.7	177.8	169.7	178.3	-2.8	105.7	P67 E71	P67-R69 PolarHBondContact O-N 2.89Å; R69-E71 PolarHBondContact O-N 2.8Å
70	K	56.1	Low	69.2	Low	166 Å²	166	90.5 Å²	90.5	72%	0.722	47%	0.465	S	S	*	.	P	Polyproline II helix	trans	-56.7	117.3	178.8	-86.3	-174.6	176.4	-179.5	0	103.2	S68 R72	S68-K70 PolarHBondContact O-N 3.37Å; K70-R72 PolarHBondContact O-N 3.47Å
71	E	69.9	Low	69.2	Low	180 Å²	180	85.6 Å²	85.6	84%	0.841	44%	0.44	S	S	*	.	P	Polyproline II helix	trans	-54.4	118.7	-175.2	-163.7	166.2	-167.3	0	0	106.7	R69 C73	R69-E71 PolarHBondContact O-N 2.8Å; E71-C73 PolarHBondContact O-N 3.3Å
72	R	76.8	Confident	69.1	Low	140 Å²	140	82.3 Å²	82.3	53%	0.528	43%	0.432	S	S	.	.	P	Polyproline II helix	trans	-66.5	136.1	-172.1	-73.8	-172.9	-178.6	173.5	1.3	108.4	K70 G74	K70-R72 PolarHBondContact O-N 3.47Å; R72-G74 PolarHBondContact O-N 2.91Å
73	C	85.6	Confident	69.5	Low	23 Å²	23	80.9 Å²	80.9	16%	0.155	43%	0.43	C	S	.	.			trans	-72.8	53.7	-176.9	-78.9	0	0	0	0	113	E71 N103 K104 C157	E71-C73 PolarHBondContact O-N 3.3Å; C73-N103 PolarHBondContact N-O 2.8Å; C73-K104 HydrophobicContact CB-CG 4.13Å; C73-K104 WeakPolarHBondContact O-CG 3.43Å; C73-K104 PolarHBondContact O-NZ 3.2Å; C73-C157 CarbonylContact C-O 3.18Å; C73-C157 HydrophobicContact CB-CB 3.68Å; C73-C157 WeakPolarHBondContact CB-O 3.47Å; C73-C157 WeakPolarHBondContact CB-SG 3.42Å; C73-C157 WeakPolarHBondContact SG-CB 3.28Å; C73-C157 CovalentContact SG-SG 2.03Å; C73-C157 PolarHBondContact SG-SG 2.96Å
74	G	89.1	Confident	70.8	Confident	33 Å²	33	74.6 Å²	74.6	34%	0.34	40%	0.402	S	S	.	.	S	Bend	trans	73.2	-153.2	-172.4	0	0	0	0	0	113.2	R72 R105	R72-G74 PolarHBondContact O-N 2.91Å; G74-R105 PolarHBondContact O-N 2.88Å
75	A	91	Very high	72.8	Confident	7 Å²	7	74 Å²	74	6%	0.058	39%	0.393	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	156.9	-172.2	0	0	0	0	0	114.1	R105 K107 S160 A161	A75-R105 CarbonylContact C-O 3.52Å; A75-R105 WeakPolarHBondContact CA-O 3.36Å; A75-R105 HydrophobicContact CB-CB 4.3Å; A75-R105 WeakPolarHBondContact CB-O 3.46Å; A75-K107 HydrophobicContact CB-CD 3.91Å; A75-K107 HydrophobicContact CB-CG 4.08Å; A75-S160 PolarHBondContact N-OG 3.32Å; A75-S160 VanDerWaalsContact N-OG 3.13Å; A75-S160 CarbonylContact O-C 3.54Å; A75-S160 WeakPolarHBondContact O-CA 3.4Å; A75-S160 WeakPolarHBondContact O-CB 3Å; A75-A161 PolarHBondContact O-N 3Å
76	I	91.8	Very high	75.1	Confident	0 Å²	0	69 Å²	69	0%	0	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	125.7	165.9	-59.4	-178.8	0	0	0	107.4	V78 L95 I98 N102 K104 R105 P106 K107 L155 A161 I163	I76-V78 HydrophobicContact CG2-CG2 4.4Å; I76-L95 HydrophobicContact CB-CD1 4Å; I76-L95 HydrophobicContact CG2-CD1 3.76Å; I76-L95 WeakPolarHBondContact O-CD1 3.4Å; I76-I98 HydrophobicContact CD1-CB 4.32Å; I76-I98 HydrophobicContact CD1-CG2 3.45Å; I76-I98 VanDerWaalsContact CD1-CG2 3.45Å; I76-N102 HydrophobicContact CD1-CB 4.36Å; I76-K104 HydrophobicContact CD1-CB 4.01Å; I76-K104 HydrophobicContact CD1-CD 3.87Å; I76-K104 HydrophobicContact CD1-CG 4.42Å; I76-K104 HydrophobicContact CG1-CB 3.69Å; I76-K104 HydrophobicContact CG1-CD 3.49Å; I76-K104 VanDerWaalsContact CG1-CD 3.49Å; I76-K104 HydrophobicContact CG1-CG 4.17Å; I76-R105 PolarHBondContact N-O 3.33Å; I76-P106 CarbonylContact O-C 3.46Å; I76-K107 PolarHBondContact O-N 2.9Å; I76-L155 HydrophobicContact CD1-CD1 3.59Å; I76-L155 HydrophobicContact CG1-CD1 4.07Å; I76-A161 CarbonylContact C-O 3.58Å; I76-A161 WeakPolarHBondContact CA-O 3.26Å; I76-I163 HydrophobicContact CG2-CD1 3.5Å; I76-I163 VanDerWaalsContact CG2-CD1 3.5Å; I76-I163 HydrophobicContact CG2-CG1 4.18Å
77	E	90.2	Very high	77.2	Confident	30 Å²	30	64.2 Å²	64.2	14%	0.14	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	130.1	178	-168.8	177.3	135.6	0	0	110.4	K107 N109 A161 I162 I163	E77-K107 WeakPolarHBondContact CA-O 3.49Å; E77-K107 HydrophobicContact CB-CB 4.15Å; E77-K107 HydrophobicContact CG-CB 4.14Å; E77-N109 HydrophobicContact CG-CB 3.95Å; E77-N109 PolarHBondContact OE1-ND2 3.41Å; E77-A161 PolarHBondContact N-O 3.16Å; E77-I162 HydrophobicContact CB-CG1 4.37Å; E77-I163 PolarHBondContact O-N 2.9Å
78	V	89.3	Confident	79.4	Confident	0 Å²	0	59.3 Å²	59.3	0%	0	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	130.8	176.6	169.3	0	0	0	0	108.8	I76 Q91 L95 K107 N109 I163 L167	I76-V78 HydrophobicContact CG2-CG2 4.4Å; V78-Q91 HydrophobicContact CG1-CB 3.75Å; V78-Q91 HydrophobicContact CG1-CG 4.01Å; V78-L95 HydrophobicContact CB-CB 4.45Å; V78-L95 HydrophobicContact CB-CD1 4.38Å; V78-L95 HydrophobicContact CB-CD2 4.4Å; V78-L95 HydrophobicContact CG2-CB 4.15Å; V78-L95 HydrophobicContact CG2-CD1 3.86Å; V78-L95 HydrophobicContact CG2-CG 4.45Å; V78-K107 PolarHBondContact N-O 3.34Å; V78-K107 VanDerWaalsContact N-O 3.12Å; V78-N109 WeakPolarHBondContact O-CB 3.49Å; V78-N109 PolarHBondContact O-N 3.23Å; V78-I163 HydrophobicContact CG2-CB 3.99Å; V78-I163 HydrophobicContact CG2-CD1 4.31Å; V78-I163 HydrophobicContact CG2-CG2 4.23Å; V78-L167 HydrophobicContact CG1-CD1 4.28Å; V78-L167 HydrophobicContact CG2-CD1 3.84Å
79	S	84.3	Confident	81.7	Confident	3 Å²	3	55 Å²	55	2%	0.021	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.3	156.8	175.2	-59.2	0	0	0	0	111.7	F138	S79-F138 WeakPolarHBondContact O-CE1 3.37Å
80	C	76.7	Confident	83.8	Confident	9 Å²	9	43.6 Å²	43.6	6%	0.061	22%	0.222	C	C	.	.	P	Polyproline II helix	trans	-85.5	148.8	177.5	-102.4	0	0	0	0	114.6	C110 F138	C80-C110 HydrophobicContact CB-CB 3.49Å; C80-C110 VanDerWaalsContact CB-CB 3.49Å; C80-C110 WeakPolarHBondContact CB-SG 3.4Å; C80-C110 WeakPolarHBondContact SG-CB 3.47Å; C80-C110 CovalentContact SG-SG 1.98Å; C80-C110 PolarHBondContact SG-SG 2.86Å; C80-F138 VanDerWaalsContact C-CE1 3.4Å; C80-F138 WeakPolarHBondContact O-CD1 3.27Å; C80-F138 PolarHBondContact O-N 3.03Å
81	P	77.9	Confident	85.5	Confident	6 Å²	6	35.8 Å²	35.8	4%	0.039	19%	0.188	C	C	.	.	B	Isolated β-bridge	trans	-72.7	156.7	162.7	30.2	-28.4	0	0	0	110	A87 I88 F138	P81-A87 HydrophobicContact CB-CB 4.14Å; P81-A87 HydrophobicContact CG-CB 3.39Å; P81-I88 HydrophobicContact CG-CG1 4.45Å; P81-F138 HydrophobicContact CB-CE1 3.94Å; P81-F138 HydrophobicContact CB-CE2 4.38Å; P81-F138 HydrophobicContact CB-CZ 3.68Å; P81-F138 HydrophobicContact CG-CE1 4.32Å; P81-F138 HydrophobicContact CG-CZ 4.24Å
82	L	69.2	Low	86.6	Confident	81 Å²	81	27.2 Å²	27.2	42%	0.424	15%	0.148	S	C	.	.	S	Bend	trans	-67.1	128.6	169.8	-80.9	158.9	0	0	0	110.8	D84 K137	L82-D84 PolarHBondContact O-N 2.81Å; L82-K137 HydrophobicContact CD2-CD 3.19Å; L82-K137 HydrophobicContact CD2-CG 4.45Å; L82-K137 HydrophobicContact CG-CB 4.14Å; L82-K137 HydrophobicContact CG-CD 3.66Å
83	D	75	Confident	87.5	Confident	140 Å²	140	20.6 Å²	20.6	75%	0.749	12%	0.123	S	C	*	.	S	Bend	trans	50.7	25.9	156.6	-49.3	-34.8	0	0	0	117.7
84	D	85.5	Confident	88	Confident	31 Å²	31	19.5 Å²	19.5	17%	0.166	12%	0.115	C	C	.	.			trans	-120.4	100.2	176.1	179.9	-0.1	0	0	0	111.5	L82 A86 A87 I88 R168	L82-D84 PolarHBondContact O-N 2.81Å; D84-A86 PolarHBondContact O-N 3.47Å; D84-A86 WeakPolarHBondContact OD1-CB 2.99Å; D84-A86 PolarHBondContact OD1-N 2.86Å; D84-A87 HydrophobicContact CB-CB 3.95Å; D84-A87 PolarHBondContact O-N 3.39Å; D84-A87 VanDerWaalsContact O-N 3.16Å; D84-A87 PolarHBondContact OD1-N 3.5Å; D84-A87 VanDerWaalsContact OD2-CB 3.26Å; D84-A87 WeakPolarHBondContact OD2-CB 3.27Å; D84-I88 WeakPolarHBondContact O-CG1 3.44Å; D84-I88 PolarHBondContact O-N 3.5Å; D84-R168 IonicContact OD2-CZ 3.91Å; D84-R168 IonicContact OD2-NH2 2.8Å; D84-R168 PolarHBondContact OD2-NH2 2.79Å
85	P	89.3	Confident	88.3	Confident	40 Å²	40	17.9 Å²	17.9	26%	0.26	10%	0.099	S	C	.	.	H	α-helix	trans	-51.4	-38.7	176.1	-30.9	37.6	0	0	0	114.5	I88 I89 W116 L301	P85-I88 PolarHBondContact O-N 2.93Å; P85-I89 VanDerWaalsContact O-CG1 3.26Å; P85-I89 WeakPolarHBondContact O-CG1 3.43Å; P85-I89 PolarHBondContact O-N 2.83Å; P85-I89 VanDerWaalsContact O-N 3.15Å; P85-W116 HydrophobicContact CB-CH2 3.61Å; P85-W116 HydrophobicContact CB-CZ2 3.73Å; P85-W116 HydrophobicContact CB-CZ3 4.1Å; P85-W116 HydrophobicContact CG-CZ2 4.29Å; P85-L301 HydrophobicContact CB-CD2 4.21Å
86	A	90.8	Very high	88.5	Confident	2 Å²	2	18 Å²	18	2%	0.017	10%	0.099	C	C	.	.	H	α-helix	trans	-70.8	-40.3	-178	0	0	0	0	0	111.7	D84 I89 F90 G300 L301 W304	D84-A86 PolarHBondContact O-N 3.47Å; D84-A86 WeakPolarHBondContact OD1-CB 2.99Å; D84-A86 PolarHBondContact OD1-N 2.86Å; A86-I89 PolarHBondContact O-N 3.28Å; A86-F90 VanDerWaalsContact O-CD2 3.28Å; A86-F90 WeakPolarHBondContact O-CD2 3.3Å; A86-F90 PolarHBondContact O-N 3.2Å; A86-G300 WeakPolarHBondContact CB-O 2.78Å; A86-L301 HydrophobicContact CB-CD2 4.46Å; A86-W304 PolarHBondContact O-NE1 3.48Å
87	A	90.3	Very high	88.7	Confident	4 Å²	4	18.2 Å²	18.2	3%	0.033	10%	0.101	C	C	.	.	H	α-helix	trans	-70.6	-32.7	177.3	0	0	0	0	0	112.1	P81 D84 I89 F90 Q91	P81-A87 HydrophobicContact CB-CB 4.14Å; P81-A87 HydrophobicContact CG-CB 3.39Å; D84-A87 HydrophobicContact CB-CB 3.95Å; D84-A87 PolarHBondContact O-N 3.39Å; D84-A87 VanDerWaalsContact O-N 3.16Å; D84-A87 PolarHBondContact OD1-N 3.5Å; D84-A87 VanDerWaalsContact OD2-CB 3.26Å; D84-A87 WeakPolarHBondContact OD2-CB 3.27Å; A87-I89 VanDerWaalsContact C-N 3.33Å; A87-I89 PolarHBondContact O-N 2.91Å; A87-F90 PolarHBondContact O-N 2.91Å; A87-Q91 WeakPolarHBondContact O-CG 3.06Å; A87-Q91 PolarHBondContact O-N 2.84Å
88	I	91.5	Very high	88.9	Confident	16 Å²	16	16.8 Å²	16.8	8%	0.082	9%	0.094	C	C	.	.	H	α-helix	trans	-57.5	-46.8	169.2	-68.5	165.4	0	0	0	110.6	P81 D84 P85 F90 Q91 Y92 F108 L117	P81-I88 HydrophobicContact CG-CG1 4.45Å; D84-I88 WeakPolarHBondContact O-CG1 3.44Å; D84-I88 PolarHBondContact O-N 3.5Å; P85-I88 PolarHBondContact O-N 2.93Å; I88-F90 VanDerWaalsContact C-N 3.34Å; I88-F90 PolarHBondContact O-N 3.41Å; I88-Q91 PolarHBondContact O-N 2.77Å; I88-Y92 WeakPolarHBondContact O-CB 3.48Å; I88-Y92 PolarHBondContact O-N 3.4Å; I88-F108 HydrophobicContact CG2-CZ 4.32Å; I88-L117 HydrophobicContact CG2-CD1 3.78Å; I88-L117 HydrophobicContact CG2-CD2 4.39Å; I88-L117 HydrophobicContact CG2-CG 3.87Å
89	I	94.2	Very high	89.1	Confident	2 Å²	2	17 Å²	17	1%	0.01	10%	0.096	C	C	.	.	H	α-helix	trans	-64	-39.6	178.2	-57.8	160.5	0	0	0	111	P85 A86 A87 Y92 A93 W116 L117 F121 L184 L301 W304	P85-I89 VanDerWaalsContact O-CG1 3.26Å; P85-I89 WeakPolarHBondContact O-CG1 3.43Å; P85-I89 PolarHBondContact O-N 2.83Å; P85-I89 VanDerWaalsContact O-N 3.15Å; A86-I89 PolarHBondContact O-N 3.28Å; A87-I89 VanDerWaalsContact C-N 3.33Å; A87-I89 PolarHBondContact O-N 2.91Å; I89-Y92 WeakPolarHBondContact O-CB 3.35Å; I89-Y92 PolarHBondContact O-N 2.89Å; I89-A93 WeakPolarHBondContact O-CB 3.32Å; I89-A93 PolarHBondContact O-N 3.21Å; I89-W116 HydrophobicContact CD1-CH2 4.22Å; I89-W116 HydrophobicContact CD1-CZ3 4.16Å; I89-W116 HydrophobicContact CG1-CZ3 4.01Å; I89-L117 HydrophobicContact CB-CD2 4.44Å; I89-L117 HydrophobicContact CG1-CD2 3.64Å; I89-F121 HydrophobicContact CD1-CE2 4.31Å; I89-F121 HydrophobicContact CD1-CZ 4.41Å; I89-L184 HydrophobicContact CG2-CD1 3.42Å; I89-L184 VanDerWaalsContact CG2-CD1 3.42Å; I89-L184 HydrophobicContact CG2-CD2 3.75Å; I89-L184 HydrophobicContact CG2-CG 4.24Å; I89-L301 HydrophobicContact CD1-CD2 4.08Å; I89-W304 HydrophobicContact CB-CD2 4.01Å; I89-W304 HydrophobicContact CB-CG 4.37Å; I89-W304 HydrophobicContact CB-CZ2 3.9Å; I89-W304 HydrophobicContact CD1-CD2 4.42Å; I89-W304 HydrophobicContact CD1-CG 4.03Å; I89-W304 HydrophobicContact CG2-CD2 3.41Å; I89-W304 VanDerWaalsContact CG2-CD2 3.41Å; I89-W304 HydrophobicContact CG2-CE3 3.62Å; I89-W304 HydrophobicContact CG2-CG 4.15Å; I89-W304 HydrophobicContact CG2-CH2 3.61Å; I89-W304 HydrophobicContact CG2-CZ2 3.41Å; I89-W304 VanDerWaalsContact CG2-CZ2 3.41Å; I89-W304 HydrophobicContact CG2-CZ3 3.7Å
90	F	94.4	Very high	89.5	Confident	2 Å²	2	19.8 Å²	19.8	1%	0.009	12%	0.115	C	C	.	.	H	α-helix	trans	-60	-48.6	173.5	-88.3	-70.7	0	0	0	112.7	A86 A87 I88 Y92 A93 A94 R168 F173 W303 W304 Y331	A86-F90 VanDerWaalsContact O-CD2 3.28Å; A86-F90 WeakPolarHBondContact O-CD2 3.3Å; A86-F90 PolarHBondContact O-N 3.2Å; A87-F90 PolarHBondContact O-N 2.91Å; I88-F90 VanDerWaalsContact C-N 3.34Å; I88-F90 PolarHBondContact O-N 3.41Å; F90-Y92 VanDerWaalsContact C-N 3.28Å; F90-Y92 PolarHBondContact O-N 2.78Å; F90-A93 PolarHBondContact O-N 2.79Å; F90-A94 WeakPolarHBondContact O-CB 3.15Å; F90-A94 PolarHBondContact O-N 2.76Å; F90-R168 HydrophobicContact CB-CG 4.18Å; F90-R168 HydrophobicContact CD1-CB 4.44Å; F90-R168 HydrophobicContact CD2-CB 4.39Å; F90-R168 HydrophobicContact CD2-CG 3.83Å; F90-R168 HydrophobicContact CE2-CG 4.32Å; F90-R168 HydrophobicContact CG-CB 4.32Å; F90-R168 HydrophobicContact CG-CG 3.96Å; F90-F173 AromaticContact CD1-CE1 3.99Å; F90-F173 HydrophobicContact CD1-CE1 3.99Å; F90-F173 HydrophobicContact CD1-CZ 4.14Å; F90-F173 HydrophobicContact CE1-CE1 4.35Å; F90-F173 HydrophobicContact CE1-CZ 4.14Å; F90-W303 HydrophobicContact CE1-CD2 4.25Å; F90-W303 AromaticContact CE1-CE3 4Å; F90-W303 HydrophobicContact CE1-CE3 4Å; F90-W303 AromaticContact CE1-CH2 3.8Å; F90-W303 HydrophobicContact CE1-CH2 3.8Å; F90-W303 HydrophobicContact CE1-CZ2 4.02Å; F90-W303 AromaticContact CE1-CZ3 3.77Å; F90-W303 HydrophobicContact CE1-CZ3 3.77Å; F90-W303 HydrophobicContact CE2-CD2 4.12Å; F90-W303 AromaticContact CE2-CE3 4Å; F90-W303 HydrophobicContact CE2-CE3 4Å; F90-W303 HydrophobicContact CE2-CG 4.42Å; F90-W303 AromaticContact CZ-CD2 3.41Å; F90-W303 HydrophobicContact CZ-CD2 3.41Å; F90-W303 VanDerWaalsContact CZ-CD2 3.41Å; F90-W303 AromaticContact CZ-CE2 3.66Å; F90-W303 AromaticContact CZ-CE3 3.39Å; F90-W303 HydrophobicContact CZ-CE3 3.39Å; F90-W303 HydrophobicContact CZ-CG 4.01Å; F90-W303 AromaticContact CZ-CH2 3.96Å; F90-W303 HydrophobicContact CZ-CH2 3.96Å; F90-W303 AromaticContact CZ-CZ2 3.95Å; F90-W303 HydrophobicContact CZ-CZ2 3.95Å; F90-W303 AromaticContact CZ-CZ3 3.68Å; F90-W303 HydrophobicContact CZ-CZ3 3.68Å; F90-W304 HydrophobicContact CB-CZ2 4.21Å; F90-W304 AromaticContact CD1-CZ2 3.71Å; F90-W304 HydrophobicContact CD1-CZ2 3.71Å; F90-W304 AromaticContact CD2-CE2 3.96Å; F90-W304 AromaticContact CD2-CZ2 3.97Å; F90-W304 HydrophobicContact CD2-CZ2 3.97Å; F90-W304 AromaticContact CD2-NE1 3.4Å; F90-W304 HydrophobicContact CE1-CZ2 4.05Å; F90-W304 HydrophobicContact CE2-CZ2 4.28Å; F90-W304 AromaticContact CE2-NE1 3.55Å; F90-W304 AromaticContact CG-CZ2 3.68Å; F90-W304 HydrophobicContact CG-CZ2 3.68Å; F90-W304 HydrophobicContact CZ-CZ2 4.33Å; F90-Y331 HydrophobicContact CE2-CE2 4.1Å; F90-Y331 HydrophobicContact CZ-CD2 4.46Å; F90-Y331 AromaticContact CZ-CE2 3.8Å; F90-Y331 HydrophobicContact CZ-CE2 3.8Å
91	Q	92.6	Very high	90.4	Very high	3 Å²	3	23.6 Å²	23.6	1%	0.014	14%	0.135	C	C	.	.	H	α-helix	trans	-61.1	-41.4	178.6	-68.5	-59.7	8.9	0	0	111.8	V78 A87 I88 L95 F108 F138 H165 L167	V78-Q91 HydrophobicContact CG1-CB 3.75Å; V78-Q91 HydrophobicContact CG1-CG 4.01Å; A87-Q91 WeakPolarHBondContact O-CG 3.06Å; A87-Q91 PolarHBondContact O-N 2.84Å; I88-Q91 PolarHBondContact O-N 2.77Å; Q91-L95 WeakPolarHBondContact O-CB 3.19Å; Q91-L95 PolarHBondContact O-N 2.86Å; Q91-F108 HydrophobicContact CB-CE2 3.85Å; Q91-F108 HydrophobicContact CB-CZ 4.48Å; Q91-F138 VanDerWaalsContact NE2-CE1 3.28Å; Q91-F138 VanDerWaalsContact NE2-CZ 3.31Å; Q91-H165 PolarHBondContact NE2-O 3.06Å; Q91-L167 VanDerWaalsContact OE1-CB 3.23Å
92	Y	93.9	Very high	91.2	Very high	0 Å²	0	24.1 Å²	24.1	0%	0	14%	0.137	C	C	.	.	H	α-helix	trans	-59.5	-53.9	175.3	-177.6	-92.8	0	0	0	112.1	I88 I89 F90 L95 L96 F108 Y114 L117 A123 S125 F126 E183	I88-Y92 WeakPolarHBondContact O-CB 3.48Å; I88-Y92 PolarHBondContact O-N 3.4Å; I89-Y92 WeakPolarHBondContact O-CB 3.35Å; I89-Y92 PolarHBondContact O-N 2.89Å; F90-Y92 VanDerWaalsContact C-N 3.28Å; F90-Y92 PolarHBondContact O-N 2.78Å; Y92-L95 PolarHBondContact O-N 3.02Å; Y92-L96 HydrophobicContact CD1-CD1 3.94Å; Y92-L96 HydrophobicContact CE1-CD1 3.35Å; Y92-L96 HydrophobicContact CE1-CG 4.27Å; Y92-L96 WeakPolarHBondContact O-CG 3.19Å; Y92-L96 PolarHBondContact O-N 3.4Å; Y92-L96 VanDerWaalsContact O-N 3.09Å; Y92-F108 HydrophobicContact CD2-CD1 4.25Å; Y92-F108 HydrophobicContact CD2-CE1 4.17Å; Y92-Y114 HydrophobicContact CD2-CD2 4.33Å; Y92-Y114 HydrophobicContact CD2-CE2 4.44Å; Y92-Y114 HydrophobicContact CE2-CD2 4.04Å; Y92-Y114 AromaticContact CE2-CE2 3.7Å; Y92-Y114 HydrophobicContact CE2-CE2 3.7Å; Y92-L117 HydrophobicContact CD2-CD1 3.49Å; Y92-L117 VanDerWaalsContact CD2-CD1 3.49Å; Y92-L117 HydrophobicContact CE2-CD1 4.28Å; Y92-L117 HydrophobicContact CG-CD1 3.65Å; Y92-A123 HydrophobicContact CE1-CB 4.31Å; Y92-A123 HydrophobicContact CE2-CB 4.28Å; Y92-S125 PolarHBondContact OH-N 2.87Å; Y92-F126 HydrophobicContact CD2-CD2 4.02Å; Y92-F126 AromaticContact CD2-CE2 3.3Å; Y92-F126 HydrophobicContact CD2-CE2 3.3Å; Y92-F126 HydrophobicContact CD2-CZ 4.06Å; Y92-F126 AromaticContact CE2-CD2 3.51Å; Y92-F126 HydrophobicContact CE2-CD2 3.51Å; Y92-F126 AromaticContact CE2-CE2 3.13Å; Y92-F126 HydrophobicContact CE2-CE2 3.13Å; Y92-F126 AromaticContact CE2-CZ 3.87Å; Y92-F126 HydrophobicContact CE2-CZ 3.87Å; Y92-F126 HydrophobicContact CG-CE2 4.35Å; Y92-E183 PolarHBondContact OH-OE2 2.92Å
93	A	96	Very high	92.2	Very high	0 Å²	0	23.1 Å²	23.1	0%	0	13%	0.132	C	C	.	.	H	α-helix	trans	-64.8	-45.1	-177	0	0	0	0	0	111.7	I89 F90 L96 G97 F173 I180 W304	I89-A93 WeakPolarHBondContact O-CB 3.32Å; I89-A93 PolarHBondContact O-N 3.21Å; F90-A93 PolarHBondContact O-N 2.79Å; A93-L96 WeakPolarHBondContact O-CB 3.36Å; A93-L96 PolarHBondContact O-N 3.38Å; A93-G97 PolarHBondContact O-N 3.33Å; A93-F173 HydrophobicContact CB-CB 4.36Å; A93-F173 HydrophobicContact CB-CD1 3.61Å; A93-F173 HydrophobicContact CB-CD2 4.12Å; A93-F173 HydrophobicContact CB-CE1 3.78Å; A93-F173 HydrophobicContact CB-CE2 4.27Å; A93-F173 HydrophobicContact CB-CG 3.77Å; A93-F173 HydrophobicContact CB-CZ 4.1Å; A93-F173 WeakPolarHBondContact O-CB 3.45Å; A93-I180 HydrophobicContact CB-CD1 3.91Å; A93-I180 HydrophobicContact CB-CG1 4.32Å; A93-I180 HydrophobicContact CB-CG2 4.09Å; A93-W304 HydrophobicContact CB-CH2 3.75Å
94	A	95.7	Very high	93	Very high	0 Å²	0	16.6 Å²	16.6	0%	0	10%	0.097	C	C	.	.	H	α-helix	trans	-63.1	-42.5	177	0	0	0	0	0	111.8	F90 L96 G97 I98 L167 Y172 F173	F90-A94 WeakPolarHBondContact O-CB 3.15Å; F90-A94 PolarHBondContact O-N 2.76Å; A94-L96 VanDerWaalsContact C-N 3.29Å; A94-L96 PolarHBondContact O-N 2.92Å; A94-G97 PolarHBondContact O-N 3.39Å; A94-I98 HydrophobicContact CB-CD1 4.31Å; A94-I98 VanDerWaalsContact O-CB 3.3Å; A94-I98 WeakPolarHBondContact O-CB 3.37Å; A94-I98 WeakPolarHBondContact O-CG1 3.22Å; A94-I98 PolarHBondContact O-N 3.33Å; A94-L167 HydrophobicContact CB-CB 3.49Å; A94-L167 VanDerWaalsContact CB-CB 3.49Å; A94-L167 HydrophobicContact CB-CD1 3.59Å; A94-L167 HydrophobicContact CB-CG 4.18Å; A94-Y172 HydrophobicContact CB-CD2 3.94Å; A94-Y172 HydrophobicContact CB-CG 4.08Å; A94-F173 HydrophobicContact CB-CD1 4.3Å
95	L	94.4	Very high	93.2	Very high	0 Å²	0	21.7 Å²	21.7	0%	0	11%	0.114	C	C	.	.	H	α-helix	trans	-58.2	-42.3	175.1	176.4	61	0	0	0	111.6	I76 V78 Q91 Y92 S99 P106 F108 F126	I76-L95 HydrophobicContact CB-CD1 4Å; I76-L95 HydrophobicContact CG2-CD1 3.76Å; I76-L95 WeakPolarHBondContact O-CD1 3.4Å; V78-L95 HydrophobicContact CB-CB 4.45Å; V78-L95 HydrophobicContact CB-CD1 4.38Å; V78-L95 HydrophobicContact CB-CD2 4.4Å; V78-L95 HydrophobicContact CG2-CB 4.15Å; V78-L95 HydrophobicContact CG2-CD1 3.86Å; V78-L95 HydrophobicContact CG2-CG 4.45Å; Q91-L95 WeakPolarHBondContact O-CB 3.19Å; Q91-L95 PolarHBondContact O-N 2.86Å; Y92-L95 PolarHBondContact O-N 3.02Å; L95-S99 WeakPolarHBondContact CD1-OG 3.36Å; L95-S99 WeakPolarHBondContact O-CB 3.23Å; L95-S99 PolarHBondContact O-N 3.09Å; L95-S99 PolarHBondContact O-OG 2.94Å; L95-P106 HydrophobicContact CD1-CB 3.88Å; L95-P106 HydrophobicContact CD2-CB 3.93Å; L95-P106 HydrophobicContact CG-CB 3.67Å; L95-F108 HydrophobicContact CD2-CB 3.6Å; L95-F108 HydrophobicContact CD2-CD2 3.74Å; L95-F108 HydrophobicContact CD2-CG 4.08Å; L95-F126 HydrophobicContact CB-CZ 4.43Å; L95-F126 HydrophobicContact CD2-CE1 4.11Å; L95-F126 HydrophobicContact CD2-CE2 4.01Å; L95-F126 HydrophobicContact CD2-CZ 3.51Å; L95-F126 HydrophobicContact CG-CE1 4.41Å; L95-F126 HydrophobicContact CG-CZ 3.95Å
96	L	94.5	Very high	93.3	Very high	9 Å²	9	20.5 Å²	20.5	5%	0.047	11%	0.106	C	C	.	.	H	α-helix	trans	-63.4	-47.8	176.5	-71.4	178.5	0	0	0	112.4	Y92 A93 A94 S100 F126 I180	Y92-L96 HydrophobicContact CD1-CD1 3.94Å; Y92-L96 HydrophobicContact CE1-CD1 3.35Å; Y92-L96 HydrophobicContact CE1-CG 4.27Å; Y92-L96 WeakPolarHBondContact O-CG 3.19Å; Y92-L96 PolarHBondContact O-N 3.4Å; Y92-L96 VanDerWaalsContact O-N 3.09Å; A93-L96 WeakPolarHBondContact O-CB 3.36Å; A93-L96 PolarHBondContact O-N 3.38Å; A94-L96 VanDerWaalsContact C-N 3.29Å; A94-L96 PolarHBondContact O-N 2.92Å; L96-S100 WeakPolarHBondContact O-CB 3.43Å; L96-S100 PolarHBondContact O-N 3.21Å; L96-F126 HydrophobicContact CD2-CD1 4.33Å; L96-F126 HydrophobicContact CD2-CE1 3.39Å; L96-F126 HydrophobicContact CD2-CZ 3.68Å; L96-F126 HydrophobicContact CG-CE1 4.21Å; L96-F126 HydrophobicContact CG-CZ 3.99Å; L96-I180 HydrophobicContact CB-CD1 4.09Å; L96-I180 HydrophobicContact CD1-CD1 3.67Å
97	G	96.2	Very high	93.3	Very high	5 Å²	5	23.9 Å²	23.9	5%	0.052	12%	0.12	C	C	.	.	H	α-helix	trans	-65.9	-50.5	-179	0	0	0	0	0	112.5	A93 A94 S99 S100 L101 Y172	A93-G97 PolarHBondContact O-N 3.33Å; A94-G97 PolarHBondContact O-N 3.39Å; G97-S99 PolarHBondContact O-N 3.02Å; G97-S100 PolarHBondContact O-N 2.79Å; G97-L101 WeakPolarHBondContact O-CB 3.38Å; G97-L101 PolarHBondContact O-N 2.95Å; G97-Y172 CarbonylContact C-O 3.48Å; G97-Y172 WeakPolarHBondContact CA-O 3.22Å
98	I	95.8	Very high	93.2	Very high	0 Å²	0	24 Å²	24	0%	0	12%	0.12	C	C	.	.	H	α-helix	trans	-61.3	-45.7	178.4	-61.3	168.6	0	0	0	110.7	I76 A94 S100 L101 N102 L152 L155 I163 L167 Y172	I76-I98 HydrophobicContact CD1-CB 4.32Å; I76-I98 HydrophobicContact CD1-CG2 3.45Å; I76-I98 VanDerWaalsContact CD1-CG2 3.45Å; A94-I98 HydrophobicContact CB-CD1 4.31Å; A94-I98 VanDerWaalsContact O-CB 3.3Å; A94-I98 WeakPolarHBondContact O-CB 3.37Å; A94-I98 WeakPolarHBondContact O-CG1 3.22Å; A94-I98 PolarHBondContact O-N 3.33Å; I98-S100 VanDerWaalsContact C-N 3.33Å; I98-S100 PolarHBondContact O-N 2.98Å; I98-L101 PolarHBondContact O-N 3.23Å; I98-N102 WeakPolarHBondContact CG2-ND2 3.38Å; I98-N102 WeakPolarHBondContact O-CB 3.33Å; I98-N102 PolarHBondContact O-N 2.99Å; I98-N102 PolarHBondContact O-ND2 3.33Å; I98-L152 HydrophobicContact CD1-CB 4.3Å; I98-L152 HydrophobicContact CD1-CD1 4.38Å; I98-L152 VanDerWaalsContact CG2-O 3.31Å; I98-L152 WeakPolarHBondContact CG2-O 3.37Å; I98-L155 HydrophobicContact CG2-CD1 4.15Å; I98-I163 HydrophobicContact CD1-CD1 4.41Å; I98-L167 HydrophobicContact CD1-CD1 3.95Å; I98-L167 HydrophobicContact CD1-CD2 4.42Å; I98-Y172 HydrophobicContact CD1-CD1 3.66Å; I98-Y172 HydrophobicContact CD1-CE1 4.11Å; I98-Y172 HydrophobicContact CD1-CG 3.92Å; I98-Y172 HydrophobicContact CG1-CD1 3.71Å; I98-Y172 HydrophobicContact CG1-CE1 4.49Å; I98-Y172 HydrophobicContact CG1-CG 4.09Å
99	S	93.7	Very high	92.9	Very high	4 Å²	4	23.6 Å²	23.6	3%	0.028	12%	0.118	C	C	.	.	H	α-helix	trans	-65.2	-38.9	179.9	-61.4	0	0	0	0	112.1	L95 G97 N103 K104 P106	L95-S99 WeakPolarHBondContact CD1-OG 3.36Å; L95-S99 WeakPolarHBondContact O-CB 3.23Å; L95-S99 PolarHBondContact O-N 3.09Å; L95-S99 PolarHBondContact O-OG 2.94Å; G97-S99 PolarHBondContact O-N 3.02Å; S99-N103 PolarHBondContact O-N 3.15Å; S99-N103 VanDerWaalsContact O-N 3.1Å; S99-K104 WeakPolarHBondContact CB-O 3.47Å; S99-K104 PolarHBondContact O-N 3.06Å; S99-P106 WeakPolarHBondContact OG-CA 3.15Å; S99-P106 WeakPolarHBondContact OG-CB 3.35Å
100	S	93.1	Very high	92.3	Very high	61 Å²	61	24 Å²	24	43%	0.427	12%	0.121	S	C	.	.	H	α-helix	trans	-63.6	-48.7	175.9	-172.5	0	0	0	0	111.2	L96 G97 I98 N102 N103	L96-S100 WeakPolarHBondContact O-CB 3.43Å; L96-S100 PolarHBondContact O-N 3.21Å; G97-S100 PolarHBondContact O-N 2.79Å; I98-S100 VanDerWaalsContact C-N 3.33Å; I98-S100 PolarHBondContact O-N 2.98Å; S100-N102 VanDerWaalsContact C-N 3.3Å; S100-N102 PolarHBondContact O-N 3.28Å; S100-N103 PolarHBondContact O-N 3Å
101	L	94.4	Very high	91.7	Very high	90 Å²	90	25.3 Å²	25.3	47%	0.471	13%	0.132	S	C	.	.	H	α-helix	trans	-62.2	-38.5	-178.9	-174.2	63.4	0	0	0	112.1	G97 I98 L153	G97-L101 WeakPolarHBondContact O-CB 3.38Å; G97-L101 PolarHBondContact O-N 2.95Å; I98-L101 PolarHBondContact O-N 3.23Å; L101-L153 HydrophobicContact CD2-CB 3.68Å; L101-L153 HydrophobicContact CD2-CD1 4.38Å; L101-L153 HydrophobicContact CD2-CD2 3.78Å; L101-L153 HydrophobicContact CD2-CG 4.14Å; L101-L153 WeakPolarHBondContact CD2-O 3.41Å
102	N	93.9	Very high	91.4	Very high	16 Å²	16	30.6 Å²	30.6	9%	0.086	16%	0.161	C	C	.	.	T	Hydrogen-bonded Turn	trans	-90.3	1.8	-177.7	-70.6	-80.1	0	0	0	114.5	I76 I98 S100 K104 L152 L153 L155	I76-N102 HydrophobicContact CD1-CB 4.36Å; I98-N102 WeakPolarHBondContact CG2-ND2 3.38Å; I98-N102 WeakPolarHBondContact O-CB 3.33Å; I98-N102 PolarHBondContact O-N 2.99Å; I98-N102 PolarHBondContact O-ND2 3.33Å; S100-N102 VanDerWaalsContact C-N 3.3Å; S100-N102 PolarHBondContact O-N 3.28Å; N102-K104 VanDerWaalsContact C-N 3.25Å; N102-K104 HydrophobicContact CB-CD 4.06Å; N102-K104 HydrophobicContact CB-CG 3.96Å; N102-K104 WeakPolarHBondContact O-CG 3.4Å; N102-K104 PolarHBondContact O-N 3.16Å; N102-L152 PolarHBondContact ND2-O 3.24Å; N102-L153 PolarHBondContact OD1-O 3.01Å; N102-L155 WeakPolarHBondContact OD1-CB 2.84Å; N102-L155 PolarHBondContact OD1-N 3.24Å
103	N	91.9	Very high	91.1	Very high	60 Å²	60	30.8 Å²	30.8	32%	0.321	16%	0.163	S	C	.	.	T	Hydrogen-bonded Turn	trans	50.6	42.4	-171.7	-172.4	43.3	0	0	0	113.4	C73 S99 S100	C73-N103 PolarHBondContact N-O 2.8Å; S99-N103 PolarHBondContact O-N 3.15Å; S99-N103 VanDerWaalsContact O-N 3.1Å; S100-N103 PolarHBondContact O-N 3Å
104	K	91.7	Very high	90.7	Very high	4 Å²	4	31.3 Å²	31.3	2%	0.017	17%	0.165	C	C	.	.			trans	-110.8	157	-179.5	-66.4	-173.9	179.5	-82.4	0	111.3	C73 I76 S99 N102 P106 L155 K156 C157 R159	C73-K104 HydrophobicContact CB-CG 4.13Å; C73-K104 WeakPolarHBondContact O-CG 3.43Å; C73-K104 PolarHBondContact O-NZ 3.2Å; I76-K104 HydrophobicContact CD1-CB 4.01Å; I76-K104 HydrophobicContact CD1-CD 3.87Å; I76-K104 HydrophobicContact CD1-CG 4.42Å; I76-K104 HydrophobicContact CG1-CB 3.69Å; I76-K104 HydrophobicContact CG1-CD 3.49Å; I76-K104 VanDerWaalsContact CG1-CD 3.49Å; I76-K104 HydrophobicContact CG1-CG 4.17Å; S99-K104 WeakPolarHBondContact CB-O 3.47Å; S99-K104 PolarHBondContact O-N 3.06Å; N102-K104 VanDerWaalsContact C-N 3.25Å; N102-K104 HydrophobicContact CB-CD 4.06Å; N102-K104 HydrophobicContact CB-CG 3.96Å; N102-K104 WeakPolarHBondContact O-CG 3.4Å; N102-K104 PolarHBondContact O-N 3.16Å; K104-P106 WeakPolarHBondContact O-CD 3.22Å; K104-L155 HydrophobicContact CD-CB 4.46Å; K104-K156 WeakPolarHBondContact CE-O 3.12Å; K104-K156 PolarHBondContact NZ-O 2.76Å; K104-C157 PolarHBondContact NZ-O 3.49Å; K104-R159 PolarHBondContact NZ-O 2.87Å
105	R	89.8	Confident	90.3	Very high	138 Å²	138	37.1 Å²	37.1	52%	0.521	19%	0.192	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.9	122.9	173.6	-174.9	-179.1	-57.7	160.5	5.5	109.5	G74 A75 I76	G74-R105 PolarHBondContact O-N 2.88Å; A75-R105 CarbonylContact C-O 3.52Å; A75-R105 WeakPolarHBondContact CA-O 3.36Å; A75-R105 HydrophobicContact CB-CB 4.3Å; A75-R105 WeakPolarHBondContact CB-O 3.46Å; I76-R105 PolarHBondContact N-O 3.33Å
106	P	91.2	Very high	90	Very high	15 Å²	15	39.6 Å²	39.6	10%	0.097	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.9	137.3	172.9	29.3	-33.8	0	0	0	110.7	I76 L95 S99 K104 F126	I76-P106 CarbonylContact O-C 3.46Å; L95-P106 HydrophobicContact CD1-CB 3.88Å; L95-P106 HydrophobicContact CD2-CB 3.93Å; L95-P106 HydrophobicContact CG-CB 3.67Å; S99-P106 WeakPolarHBondContact OG-CA 3.15Å; S99-P106 WeakPolarHBondContact OG-CB 3.35Å; K104-P106 WeakPolarHBondContact O-CD 3.22Å; P106-F126 HydrophobicContact CB-CD1 3.91Å; P106-F126 HydrophobicContact CB-CE1 3.31Å; P106-F126 HydrophobicContact CB-CZ 4.12Å; P106-F126 HydrophobicContact CG-CD1 3.66Å; P106-F126 HydrophobicContact CG-CE1 3.41Å; P106-F126 VanDerWaalsContact CG-CE1 3.41Å
107	K	89.3	Confident	89.9	Confident	72 Å²	72	39.1 Å²	39.1	31%	0.313	20%	0.199	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	105.9	169	-71.8	-176	176	-168.9	0	108.4	A75 I76 E77 V78 N109 V130	A75-K107 HydrophobicContact CB-CD 3.91Å; A75-K107 HydrophobicContact CB-CG 4.08Å; I76-K107 PolarHBondContact O-N 2.9Å; E77-K107 WeakPolarHBondContact CA-O 3.49Å; E77-K107 HydrophobicContact CB-CB 4.15Å; E77-K107 HydrophobicContact CG-CB 4.14Å; V78-K107 PolarHBondContact N-O 3.34Å; V78-K107 VanDerWaalsContact N-O 3.12Å; K107-N109 PolarHBondContact O-N 3.29Å; K107-V130 HydrophobicContact CB-CG1 4.38Å; K107-V130 HydrophobicContact CG-CG1 4.18Å
108	F	88.4	Confident	89.5	Confident	6 Å²	6	43.5 Å²	43.5	3%	0.026	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.4	97.8	180	-166	-130.1	0	0	0	109.7	I88 Q91 Y92 L95 C110 Y114 L117 F126	I88-F108 HydrophobicContact CG2-CZ 4.32Å; Q91-F108 HydrophobicContact CB-CE2 3.85Å; Q91-F108 HydrophobicContact CB-CZ 4.48Å; Y92-F108 HydrophobicContact CD2-CD1 4.25Å; Y92-F108 HydrophobicContact CD2-CE1 4.17Å; L95-F108 HydrophobicContact CD2-CB 3.6Å; L95-F108 HydrophobicContact CD2-CD2 3.74Å; L95-F108 HydrophobicContact CD2-CG 4.08Å; F108-C110 HydrophobicContact CD1-CB 4.05Å; F108-C110 HydrophobicContact CD2-CB 4.46Å; F108-C110 HydrophobicContact CE1-CB 3.73Å; F108-C110 HydrophobicContact CE2-CB 4.18Å; F108-C110 HydrophobicContact CG-CB 4.4Å; F108-C110 HydrophobicContact CZ-CB 3.8Å; F108-C110 PolarHBondContact O-N 3.19Å; F108-Y114 AromaticContact CD1-CD2 3.9Å; F108-Y114 HydrophobicContact CD1-CD2 3.9Å; F108-Y114 HydrophobicContact CD1-CG 4.03Å; F108-Y114 HydrophobicContact CE1-CD2 4.23Å; F108-Y114 HydrophobicContact CE1-CG 4.46Å; F108-L117 HydrophobicContact CE1-CD1 3.96Å; F108-L117 HydrophobicContact CZ-CD1 4.33Å; F108-F126 HydrophobicContact CB-CD2 3.49Å; F108-F126 VanDerWaalsContact CB-CD2 3.49Å; F108-F126 HydrophobicContact CB-CE2 3.34Å; F108-F126 HydrophobicContact CB-CG 4.34Å; F108-F126 HydrophobicContact CB-CZ 4.12Å; F108-F126 HydrophobicContact CD1-CD2 4.11Å; F108-F126 AromaticContact CD1-CE2 3.92Å; F108-F126 HydrophobicContact CD1-CE2 3.92Å; F108-F126 HydrophobicContact CD2-CE2 4.3Å; F108-F126 HydrophobicContact CG-CD2 4.04Å; F108-F126 AromaticContact CG-CE2 3.61Å; F108-F126 HydrophobicContact CG-CE2 3.61Å
109	N	85.7	Confident	89.2	Confident	9 Å²	9	47 Å²	47	5%	0.048	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.9	66	-172.3	-160.5	-12.9	0	0	0	110.1	E77 V78 K107 M133 T135	E77-N109 HydrophobicContact CG-CB 3.95Å; E77-N109 PolarHBondContact OE1-ND2 3.41Å; V78-N109 WeakPolarHBondContact O-CB 3.49Å; V78-N109 PolarHBondContact O-N 3.23Å; K107-N109 PolarHBondContact O-N 3.29Å; N109-M133 PolarHBondContact OD1-O 2.95Å; N109-T135 WeakPolarHBondContact ND2-CG2 3.26Å; N109-T135 PolarHBondContact ND2-OG1 3.23Å; N109-T135 PolarHBondContact OD1-OG1 2.67Å
110	C	81.7	Confident	89	Confident	11 Å²	11	48.6 Å²	48.6	7%	0.074	25%	0.245	C	C	.	.			trans	-158.5	82.9	-171.7	-176.3	0	0	0	0	111.7	C80 F108 G113 Y114	C80-C110 HydrophobicContact CB-CB 3.49Å; C80-C110 VanDerWaalsContact CB-CB 3.49Å; C80-C110 WeakPolarHBondContact CB-SG 3.4Å; C80-C110 WeakPolarHBondContact SG-CB 3.47Å; C80-C110 CovalentContact SG-SG 1.98Å; C80-C110 PolarHBondContact SG-SG 2.86Å; F108-C110 HydrophobicContact CD1-CB 4.05Å; F108-C110 HydrophobicContact CD2-CB 4.46Å; F108-C110 HydrophobicContact CE1-CB 3.73Å; F108-C110 HydrophobicContact CE2-CB 4.18Å; F108-C110 HydrophobicContact CG-CB 4.4Å; F108-C110 HydrophobicContact CZ-CB 3.8Å; F108-C110 PolarHBondContact O-N 3.19Å; C110-G113 WeakPolarHBondContact SG-CA 3.31Å; C110-G113 PolarHBondContact SG-N 2.84Å; C110-Y114 WeakPolarHBondContact O-CB 3.27Å; C110-Y114 PolarHBondContact O-N 3.21Å
111	A	82.8	Confident	88.9	Confident	29 Å²	29	45.7 Å²	45.7	24%	0.24	23%	0.225	C	C	.	.	H	α-helix	trans	-55.3	-64.1	-178.2	0	0	0	0	0	112.2	G113 Y114 E115 V132	A111-G113 VanDerWaalsContact C-N 3.34Å; A111-G113 PolarHBondContact O-N 3.29Å; A111-Y114 PolarHBondContact O-N 3.21Å; A111-Y114 VanDerWaalsContact O-N 3.17Å; A111-E115 WeakPolarHBondContact O-CB 3.28Å; A111-E115 PolarHBondContact O-N 2.83Å; A111-V132 HydrophobicContact CB-CG1 3.07Å
112	D	85	Confident	88.7	Confident	113 Å²	113	47.4 Å²	47.4	60%	0.604	23%	0.225	S	C	*	.	H	α-helix	trans	-65.8	-41.2	-171.3	-50.1	-24.4	0	0	0	110.6	E115 W116	D112-E115 PolarHBondContact O-N 3.42Å; D112-W116 WeakPolarHBondContact O-CB 3.46Å; D112-W116 PolarHBondContact O-N 3.41Å
113	G	87.6	Confident	88.6	Confident	4 Å²	4	46.9 Å²	46.9	4%	0.041	22%	0.223	C	C	.	.	H	α-helix	trans	-69.1	-34.4	177.4	0	0	0	0	0	112.7	C110 A111 L117	C110-G113 WeakPolarHBondContact SG-CA 3.31Å; C110-G113 PolarHBondContact SG-N 2.84Å; A111-G113 VanDerWaalsContact C-N 3.34Å; A111-G113 PolarHBondContact O-N 3.29Å; G113-L117 WeakPolarHBondContact O-CB 3.38Å; G113-L117 VanDerWaalsContact O-CG 3.26Å; G113-L117 WeakPolarHBondContact O-CG 3.24Å; G113-L117 PolarHBondContact O-N 2.94Å
114	Y	87.8	Confident	88.4	Confident	11 Å²	11	47.5 Å²	47.5	4%	0.043	24%	0.237	C	C	.	.	H	α-helix	trans	-71.6	-40.6	174.2	-170	-128.4	0	0	0	112.4	Y92 F108 C110 A111 W116 L117 R118 F126	Y92-Y114 HydrophobicContact CD2-CD2 4.33Å; Y92-Y114 HydrophobicContact CD2-CE2 4.44Å; Y92-Y114 HydrophobicContact CE2-CD2 4.04Å; Y92-Y114 AromaticContact CE2-CE2 3.7Å; Y92-Y114 HydrophobicContact CE2-CE2 3.7Å; F108-Y114 AromaticContact CD1-CD2 3.9Å; F108-Y114 HydrophobicContact CD1-CD2 3.9Å; F108-Y114 HydrophobicContact CD1-CG 4.03Å; F108-Y114 HydrophobicContact CE1-CD2 4.23Å; F108-Y114 HydrophobicContact CE1-CG 4.46Å; C110-Y114 WeakPolarHBondContact O-CB 3.27Å; C110-Y114 PolarHBondContact O-N 3.21Å; A111-Y114 PolarHBondContact O-N 3.21Å; A111-Y114 VanDerWaalsContact O-N 3.17Å; Y114-W116 VanDerWaalsContact C-N 3.32Å; Y114-L117 HydrophobicContact CD2-CD1 4.45Å; Y114-L117 PolarHBondContact O-N 3.46Å; Y114-R118 HydrophobicContact CD2-CG 4.42Å; Y114-R118 HydrophobicContact CE1-CG 4.19Å; Y114-R118 HydrophobicContact CE2-CG 3.96Å; Y114-R118 WeakPolarHBondContact O-CB 3.35Å; Y114-R118 WeakPolarHBondContact O-CG 3.49Å; Y114-R118 PolarHBondContact O-N 2.89Å; Y114-F126 HydrophobicContact CD2-CD2 4.11Å; Y114-F126 HydrophobicContact CE1-CB 4.26Å; Y114-F126 HydrophobicContact CE2-CB 4.37Å; Y114-F126 AromaticContact CE2-CD2 3.8Å; Y114-F126 HydrophobicContact CE2-CD2 3.8Å; Y114-F126 PolarHBondContact OH-O 2.99Å
115	E	87.8	Confident	88.1	Confident	123 Å²	123	49.2 Å²	49.2	58%	0.575	25%	0.249	S	C	*	.	H	α-helix	trans	-62.1	-41.4	172.4	-176.2	162.8	-165.5	0	0	111.6	A111 D112 R118 S119	A111-E115 WeakPolarHBondContact O-CB 3.28Å; A111-E115 PolarHBondContact O-N 2.83Å; D112-E115 PolarHBondContact O-N 3.42Å; E115-R118 PolarHBondContact O-N 3.27Å; E115-S119 PolarHBondContact O-N 2.99Å; E115-S119 PolarHBondContact O-OG 3.17Å
116	W	88.6	Confident	87.6	Confident	51 Å²	51	43 Å²	43	19%	0.193	23%	0.226	C	C	.	.	H	α-helix	trans	-60.3	-46.7	172	-178.2	88.8	0	0	0	111.9	P85 I89 D112 Y114 R118 S119 H120 F121 T281	P85-W116 HydrophobicContact CB-CH2 3.61Å; P85-W116 HydrophobicContact CB-CZ2 3.73Å; P85-W116 HydrophobicContact CB-CZ3 4.1Å; P85-W116 HydrophobicContact CG-CZ2 4.29Å; I89-W116 HydrophobicContact CD1-CH2 4.22Å; I89-W116 HydrophobicContact CD1-CZ3 4.16Å; I89-W116 HydrophobicContact CG1-CZ3 4.01Å; D112-W116 WeakPolarHBondContact O-CB 3.46Å; D112-W116 PolarHBondContact O-N 3.41Å; Y114-W116 VanDerWaalsContact C-N 3.32Å; W116-R118 VanDerWaalsContact C-N 3.33Å; W116-R118 PolarHBondContact O-N 2.9Å; W116-S119 WeakPolarHBondContact CA-OG 3.47Å; W116-S119 PolarHBondContact O-N 3.48Å; W116-S119 PolarHBondContact O-OG 3Å; W116-H120 AromaticContact CD1-CE1 3.48Å; W116-H120 VanDerWaalsContact CD1-CE1 3.48Å; W116-H120 AromaticContact CD1-ND1 3.74Å; W116-H120 AromaticContact CD2-ND1 3.94Å; W116-H120 AromaticContact CE2-CE1 3.72Å; W116-H120 AromaticContact CE2-ND1 3.65Å; W116-H120 AromaticContact CG-ND1 3.97Å; W116-H120 AromaticContact NE1-CE1 3.18Å; W116-H120 PolarHBondContact NE1-CE1 3.07Å; W116-H120 AromaticContact NE1-ND1 3.55Å; W116-H120 AromaticContact NE1-NE2 3.78Å; W116-H120 PolarHBondContact O-N 3.23Å; W116-H120 PolarHBondContact O-ND1 3.06Å; W116-F121 AromaticContact CH2-CE2 3.82Å; W116-F121 HydrophobicContact CH2-CE2 3.82Å; W116-F121 HydrophobicContact CH2-CZ 4.24Å; W116-F121 AromaticContact CZ3-CE2 3.78Å; W116-F121 HydrophobicContact CZ3-CE2 3.78Å; W116-T281 HydrophobicContact CH2-CG2 3.95Å; W116-T281 HydrophobicContact CZ2-CG2 3.78Å
117	L	90.8	Very high	86.5	Confident	0 Å²	0	48.1 Å²	48.1	0%	0	25%	0.252	C	S	.	.	H	α-helix	trans	-58.7	-44.7	175.4	-77.2	169.2	0	0	0	111.5	I88 I89 Y92 F108 G113 Y114 S119 H120 F121 A123 L184	I88-L117 HydrophobicContact CG2-CD1 3.78Å; I88-L117 HydrophobicContact CG2-CD2 4.39Å; I88-L117 HydrophobicContact CG2-CG 3.87Å; I89-L117 HydrophobicContact CB-CD2 4.44Å; I89-L117 HydrophobicContact CG1-CD2 3.64Å; Y92-L117 HydrophobicContact CD2-CD1 3.49Å; Y92-L117 VanDerWaalsContact CD2-CD1 3.49Å; Y92-L117 HydrophobicContact CE2-CD1 4.28Å; Y92-L117 HydrophobicContact CG-CD1 3.65Å; F108-L117 HydrophobicContact CE1-CD1 3.96Å; F108-L117 HydrophobicContact CZ-CD1 4.33Å; G113-L117 WeakPolarHBondContact O-CB 3.38Å; G113-L117 VanDerWaalsContact O-CG 3.26Å; G113-L117 WeakPolarHBondContact O-CG 3.24Å; G113-L117 PolarHBondContact O-N 2.94Å; Y114-L117 HydrophobicContact CD2-CD1 4.45Å; Y114-L117 PolarHBondContact O-N 3.46Å; L117-S119 PolarHBondContact O-N 3.02Å; L117-H120 PolarHBondContact O-N 3.41Å; L117-F121 HydrophobicContact CD2-CD2 3.87Å; L117-F121 HydrophobicContact CD2-CE2 4.04Å; L117-F121 WeakPolarHBondContact O-CA 3.19Å; L117-F121 WeakPolarHBondContact O-CB 3.28Å; L117-F121 WeakPolarHBondContact O-CD2 3.21Å; L117-F121 PolarHBondContact O-N 2.62Å; L117-A123 HydrophobicContact CB-CB 4.16Å; L117-L184 HydrophobicContact CD2-CD2 4.41Å
118	R	89.3	Confident	84.8	Confident	96 Å²	96	48.2 Å²	48.2	36%	0.362	27%	0.266	S	S	.	.	H	α-helix	trans	-70.1	-28.7	179.5	-72.3	-167.5	-61.2	156.2	5.9	113.2	Y114 E115 W116 H120 A123 K187	Y114-R118 HydrophobicContact CD2-CG 4.42Å; Y114-R118 HydrophobicContact CE1-CG 4.19Å; Y114-R118 HydrophobicContact CE2-CG 3.96Å; Y114-R118 WeakPolarHBondContact O-CB 3.35Å; Y114-R118 WeakPolarHBondContact O-CG 3.49Å; Y114-R118 PolarHBondContact O-N 2.89Å; E115-R118 PolarHBondContact O-N 3.27Å; W116-R118 VanDerWaalsContact C-N 3.33Å; W116-R118 PolarHBondContact O-N 2.9Å; R118-H120 VanDerWaalsContact C-N 3.3Å; R118-A123 WeakPolarHBondContact CG-O 3.42Å; R118-K187 WeakPolarHBondContact O-CD 3.41Å; R118-K187 WeakPolarHBondContact O-CE 3.43Å; R118-K187 PolarHBondContact O-NZ 3.01Å
119	S	88.2	Confident	83	Confident	75 Å²	75	55 Å²	55	52%	0.524	30%	0.303	S	S	.	.	H	α-helix	trans	-74.5	-24.2	176	58.4	0	0	0	0	112.2	E115 W116 L117	E115-S119 PolarHBondContact O-N 2.99Å; E115-S119 PolarHBondContact O-OG 3.17Å; W116-S119 WeakPolarHBondContact CA-OG 3.47Å; W116-S119 PolarHBondContact O-N 3.48Å; W116-S119 PolarHBondContact O-OG 3Å; L117-S119 PolarHBondContact O-N 3.02Å
120	H	89.4	Confident	81.5	Confident	36 Å²	36	55.9 Å²	55.9	17%	0.167	31%	0.309	C	S	.	.	H	α-helix	trans	-102.2	-34.4	-176.8	-68.4	80.9	0	0	0	113.8	W116 L117 R118 P186 K187	W116-H120 AromaticContact CD1-CE1 3.48Å; W116-H120 VanDerWaalsContact CD1-CE1 3.48Å; W116-H120 AromaticContact CD1-ND1 3.74Å; W116-H120 AromaticContact CD2-ND1 3.94Å; W116-H120 AromaticContact CE2-CE1 3.72Å; W116-H120 AromaticContact CE2-ND1 3.65Å; W116-H120 AromaticContact CG-ND1 3.97Å; W116-H120 AromaticContact NE1-CE1 3.18Å; W116-H120 PolarHBondContact NE1-CE1 3.07Å; W116-H120 AromaticContact NE1-ND1 3.55Å; W116-H120 AromaticContact NE1-NE2 3.78Å; W116-H120 PolarHBondContact O-N 3.23Å; W116-H120 PolarHBondContact O-ND1 3.06Å; L117-H120 PolarHBondContact O-N 3.41Å; R118-H120 VanDerWaalsContact C-N 3.3Å; H120-P186 WeakPolarHBondContact O-CA 3.26Å; H120-K187 PolarHBondContact O-N 3Å
121	F	91.2	Very high	80	Confident	1 Å²	1	62.1 Å²	62.1	0%	0.004	34%	0.337	C	S	.	.	B	Isolated β-bridge	trans	-131.7	170.9	-169.2	-46.8	-70.7	0	0	0	112.9	I89 W116 L117 A123 E183 L184 A185 P186 K187 L285	I89-F121 HydrophobicContact CD1-CE2 4.31Å; I89-F121 HydrophobicContact CD1-CZ 4.41Å; W116-F121 AromaticContact CH2-CE2 3.82Å; W116-F121 HydrophobicContact CH2-CE2 3.82Å; W116-F121 HydrophobicContact CH2-CZ 4.24Å; W116-F121 AromaticContact CZ3-CE2 3.78Å; W116-F121 HydrophobicContact CZ3-CE2 3.78Å; L117-F121 HydrophobicContact CD2-CD2 3.87Å; L117-F121 HydrophobicContact CD2-CE2 4.04Å; L117-F121 WeakPolarHBondContact O-CA 3.19Å; L117-F121 WeakPolarHBondContact O-CB 3.28Å; L117-F121 WeakPolarHBondContact O-CD2 3.21Å; L117-F121 PolarHBondContact O-N 2.62Å; F121-A123 PolarHBondContact O-N 2.89Å; F121-A123 VanDerWaalsContact O-N 3.14Å; F121-E183 WeakPolarHBondContact CB-O 3.46Å; F121-L184 WeakPolarHBondContact CD1-O 3.39Å; F121-L184 HydrophobicContact CD2-CD2 4.38Å; F121-L184 HydrophobicContact CG-CD2 4.49Å; F121-A185 WeakPolarHBondContact CA-O 3.37Å; F121-P186 HydrophobicContact CD1-CG 4.5Å; F121-K187 WeakPolarHBondContact O-CD 3.37Å; F121-K187 WeakPolarHBondContact O-CE 3.39Å; F121-K187 WeakPolarHBondContact O-CG 3.5Å; F121-L285 HydrophobicContact CE1-CD1 3.73Å; F121-L285 HydrophobicContact CZ-CD1 3.54Å
122	R	91.6	Very high	78.6	Confident	126 Å²	126	63.3 Å²	63.3	48%	0.475	34%	0.341	S	S	.	.			trans	-77.9	21.4	175.2	-63.8	179.1	-174.2	-173.3	-7.2	113.5	A124 E183 A185 K187	R122-A124 PolarHBondContact O-N 2.94Å; R122-A124 VanDerWaalsContact O-N 3.08Å; R122-E183 CarbonylContact C-O 2.98Å; R122-E183 WeakPolarHBondContact CA-O 3.19Å; R122-E183 PolarHBondContact N-O 3.33Å; R122-E183 VanDerWaalsContact N-O 3.1Å; R122-A185 WeakPolarHBondContact CG-O 3.46Å; R122-A185 PolarHBondContact N-O 2.81Å; R122-K187 HydrophobicContact CG-CG 4.15Å
123	A	90.2	Very high	77.1	Confident	4 Å²	4	62.2 Å²	62.2	3%	0.033	33%	0.333	C	S	.	.			trans	-57.9	113.2	179.9	0	0	0	0	0	110	Y92 L117 R118 F121 E183	Y92-A123 HydrophobicContact CE1-CB 4.31Å; Y92-A123 HydrophobicContact CE2-CB 4.28Å; L117-A123 HydrophobicContact CB-CB 4.16Å; R118-A123 WeakPolarHBondContact CG-O 3.42Å; F121-A123 PolarHBondContact O-N 2.89Å; F121-A123 VanDerWaalsContact O-N 3.14Å; A123-E183 PolarHBondContact N-O 3.29Å
124	A	87.8	Confident	75.3	Confident	74 Å²	74	70.7 Å²	70.7	61%	0.612	37%	0.371	S	S	*	.			trans	-145.2	7.6	-171.7	0	0	0	0	0	113.1	R122 F126	R122-A124 PolarHBondContact O-N 2.94Å; R122-A124 VanDerWaalsContact O-N 3.08Å; A124-F126 PolarHBondContact O-N 2.62Å
125	S	86	Confident	73.8	Confident	39 Å²	39	72.6 Å²	72.6	27%	0.273	39%	0.385	S	S	.	.	S	Bend	trans	-72.6	-12.5	-178.1	-95	0	0	0	0	114.8	Y92 K179 E183	Y92-S125 PolarHBondContact OH-N 2.87Å; S125-K179 WeakPolarHBondContact OG-CE 3.23Å; S125-K179 PolarHBondContact OG-NZ 2.77Å; S125-E183 WeakPolarHBondContact CB-OE1 3.46Å; S125-E183 VanDerWaalsContact CB-OE2 3.27Å; S125-E183 WeakPolarHBondContact CB-OE2 3.33Å; S125-E183 PolarHBondContact N-OE2 3.46Å; S125-E183 PolarHBondContact OG-OE1 2.81Å; S125-E183 PolarHBondContact OG-OE2 2.9Å
126	F	79.9	Confident	72.5	Confident	9 Å²	9	73 Å²	73	4%	0.039	39%	0.387	C	S	.	.	S	Bend	trans	-108.7	127.4	175.6	-51.2	-39	0	0	0	108.9	Y92 L95 L96 P106 F108 Y114 A124	Y92-F126 HydrophobicContact CD2-CD2 4.02Å; Y92-F126 AromaticContact CD2-CE2 3.3Å; Y92-F126 HydrophobicContact CD2-CE2 3.3Å; Y92-F126 HydrophobicContact CD2-CZ 4.06Å; Y92-F126 AromaticContact CE2-CD2 3.51Å; Y92-F126 HydrophobicContact CE2-CD2 3.51Å; Y92-F126 AromaticContact CE2-CE2 3.13Å; Y92-F126 HydrophobicContact CE2-CE2 3.13Å; Y92-F126 AromaticContact CE2-CZ 3.87Å; Y92-F126 HydrophobicContact CE2-CZ 3.87Å; Y92-F126 HydrophobicContact CG-CE2 4.35Å; L95-F126 HydrophobicContact CB-CZ 4.43Å; L95-F126 HydrophobicContact CD2-CE1 4.11Å; L95-F126 HydrophobicContact CD2-CE2 4.01Å; L95-F126 HydrophobicContact CD2-CZ 3.51Å; L95-F126 HydrophobicContact CG-CE1 4.41Å; L95-F126 HydrophobicContact CG-CZ 3.95Å; L96-F126 HydrophobicContact CD2-CD1 4.33Å; L96-F126 HydrophobicContact CD2-CE1 3.39Å; L96-F126 HydrophobicContact CD2-CZ 3.68Å; L96-F126 HydrophobicContact CG-CE1 4.21Å; L96-F126 HydrophobicContact CG-CZ 3.99Å; P106-F126 HydrophobicContact CB-CD1 3.91Å; P106-F126 HydrophobicContact CB-CE1 3.31Å; P106-F126 HydrophobicContact CB-CZ 4.12Å; P106-F126 HydrophobicContact CG-CD1 3.66Å; P106-F126 HydrophobicContact CG-CE1 3.41Å; P106-F126 VanDerWaalsContact CG-CE1 3.41Å; F108-F126 HydrophobicContact CB-CD2 3.49Å; F108-F126 VanDerWaalsContact CB-CD2 3.49Å; F108-F126 HydrophobicContact CB-CE2 3.34Å; F108-F126 HydrophobicContact CB-CG 4.34Å; F108-F126 HydrophobicContact CB-CZ 4.12Å; F108-F126 HydrophobicContact CD1-CD2 4.11Å; F108-F126 AromaticContact CD1-CE2 3.92Å; F108-F126 HydrophobicContact CD1-CE2 3.92Å; F108-F126 HydrophobicContact CD2-CE2 4.3Å; F108-F126 HydrophobicContact CG-CD2 4.04Å; F108-F126 AromaticContact CG-CE2 3.61Å; F108-F126 HydrophobicContact CG-CE2 3.61Å; Y114-F126 HydrophobicContact CD2-CD2 4.11Å; Y114-F126 HydrophobicContact CE1-CB 4.26Å; Y114-F126 HydrophobicContact CE2-CB 4.37Å; Y114-F126 AromaticContact CE2-CD2 3.8Å; Y114-F126 HydrophobicContact CE2-CD2 3.8Å; Y114-F126 PolarHBondContact OH-O 2.99Å; A124-F126 PolarHBondContact O-N 2.62Å
127	D	67	Low	71.3	Confident	121 Å²	121	75.4 Å²	75.4	65%	0.647	40%	0.398	S	S	*	.			trans	-64	144.6	171	-63.7	-44.3	0	0	0	108.9	D129 V130	D127-D129 PolarHBondContact O-N 3.47Å; D127-V130 HydrophobicContact CB-CG2 4.22Å; D127-V130 WeakPolarHBondContact O-CB 3.13Å; D127-V130 WeakPolarHBondContact O-CG2 3.44Å; D127-V130 PolarHBondContact O-N 3.2Å
128	A	53.4	Low	70.3	Confident	74 Å²	74	76.4 Å²	76.4	61%	0.612	40%	0.402	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.1	-24.6	175.5	0	0	0	0	0	112.5	V130	A128-V130 VanDerWaalsContact C-N 3.34Å
129	D	50.5	Low	69.1	Low	148 Å²	148	75.1 Å²	75.1	79%	0.791	40%	0.403	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.4	-8.4	178.6	-62.6	-24	0	0	0	114.1	D127 Q131	D127-D129 PolarHBondContact O-N 3.47Å; D129-Q131 PolarHBondContact O-N 3.16Å
130	V	54.3	Low	67.8	Low	29 Å²	29	74 Å²	74	18%	0.176	39%	0.393	C	S	.	.	S	Bend	trans	-67.8	92	171.3	-179.7	0	0	0	0	106.6	K107 D127 A128 V132	K107-V130 HydrophobicContact CB-CG1 4.38Å; K107-V130 HydrophobicContact CG-CG1 4.18Å; D127-V130 HydrophobicContact CB-CG2 4.22Å; D127-V130 WeakPolarHBondContact O-CB 3.13Å; D127-V130 WeakPolarHBondContact O-CG2 3.44Å; D127-V130 PolarHBondContact O-N 3.2Å; A128-V130 VanDerWaalsContact C-N 3.34Å; V130-V132 VanDerWaalsContact C-N 3.34Å; V130-V132 PolarHBondContact O-N 1.98Å
131	Q	51.1	Low	66.5	Low	142 Å²	142	76.5 Å²	76.5	66%	0.664	42%	0.421	S	S	*	.			trans	-26.9	94.8	-178.7	-71	-178.2	-13.1	0	0	111.2	D129 M133	D129-Q131 PolarHBondContact O-N 3.16Å; Q131-M133 HydrophobicContact CB-CG 4.04Å; Q131-M133 PolarHBondContact O-N 2.9Å
132	V	53.3	Low	65.2	Low	54 Å²	54	85.1 Å²	85.1	33%	0.327	46%	0.458	S	S	.	.			trans	-69.3	85.7	165.7	174.6	0	0	0	0	104.4	A111 V130	A111-V132 HydrophobicContact CB-CG1 3.07Å; V130-V132 VanDerWaalsContact C-N 3.34Å; V130-V132 PolarHBondContact O-N 1.98Å
133	M	52.7	Low	64.2	Low	90 Å²	90	80.8 Å²	80.8	44%	0.443	45%	0.445	S	S	.	.			trans	-71.9	142.4	177.1	-61.4	-139.1	-42.6	0	0	108.3	N109 Q131 T135	N109-M133 PolarHBondContact OD1-O 2.95Å; Q131-M133 HydrophobicContact CB-CG 4.04Å; Q131-M133 PolarHBondContact O-N 2.9Å; M133-T135 HydrophobicContact CB-CG2 3.82Å; M133-T135 HydrophobicContact CE-CG2 3.96Å; M133-T135 PolarHBondContact O-N 3.06Å
134	H	51.4	Low	63.3	Low	181 Å²	181	86.8 Å²	86.8	84%	0.838	47%	0.472	S	S	*	.			trans	-70.7	110	163.3	-71.6	8.1	0	0	0	106.8
135	T	55	Low	62.6	Low	52 Å²	52	85.5 Å²	85.5	32%	0.319	46%	0.458	S	S	.	.			trans	-139.7	160.7	176.8	63.7	0	0	0	0	113.4	N109 M133 K137	N109-T135 WeakPolarHBondContact ND2-CG2 3.26Å; N109-T135 PolarHBondContact ND2-OG1 3.23Å; N109-T135 PolarHBondContact OD1-OG1 2.67Å; M133-T135 HydrophobicContact CB-CG2 3.82Å; M133-T135 HydrophobicContact CE-CG2 3.96Å; M133-T135 PolarHBondContact O-N 3.06Å; T135-K137 PolarHBondContact O-N 3.26Å
136	E	61.3	Low	62.2	Low	132 Å²	132	83.8 Å²	83.8	62%	0.617	45%	0.446	S	S	*	.			trans	-38	110.2	172.1	-164.1	176.6	-166.5	0	0	112.3	R164	E136-R164 IonicContact OE2-CZ 3.74Å; E136-R164 IonicContact OE2-NH1 2.76Å; E136-R164 PolarHBondContact OE2-NH1 3.16Å; E136-R164 IonicContact OE2-NH2 3.38Å; E136-R164 PolarHBondContact OE2-NH2 3.39Å
137	K	63.3	Low	62.4	Low	101 Å²	101	86.8 Å²	86.8	44%	0.439	46%	0.46	S	S	.	.			trans	-63.5	136.7	167.1	-63.2	-178.1	179.1	-177.8	0	107.9	L82 T135	L82-K137 HydrophobicContact CD2-CD 3.19Å; L82-K137 HydrophobicContact CD2-CG 4.45Å; L82-K137 HydrophobicContact CG-CB 4.14Å; L82-K137 HydrophobicContact CG-CD 3.66Å; T135-K137 PolarHBondContact O-N 3.26Å
138	F	69.6	Low	63.5	Low	20 Å²	20	82.9 Å²	82.9	9%	0.088	44%	0.437	C	S	.	.	B	Isolated β-bridge	trans	-81.6	142.9	173.5	78	-90.9	0	0	0	109.3	S79 C80 P81 Q91 P140	S79-F138 WeakPolarHBondContact O-CE1 3.37Å; C80-F138 VanDerWaalsContact C-CE1 3.4Å; C80-F138 WeakPolarHBondContact O-CD1 3.27Å; C80-F138 PolarHBondContact O-N 3.03Å; P81-F138 HydrophobicContact CB-CE1 3.94Å; P81-F138 HydrophobicContact CB-CE2 4.38Å; P81-F138 HydrophobicContact CB-CZ 3.68Å; P81-F138 HydrophobicContact CG-CE1 4.32Å; P81-F138 HydrophobicContact CG-CZ 4.24Å; Q91-F138 VanDerWaalsContact NE2-CE1 3.28Å; Q91-F138 VanDerWaalsContact NE2-CZ 3.31Å; F138-P140 HydrophobicContact CE2-CB 4.04Å; F138-P140 WeakPolarHBondContact O-CD 3.49Å
139	D	64.6	Low	65.4	Low	70 Å²	70	82.4 Å²	82.4	37%	0.374	42%	0.421	S	S	.	.			trans	-82.1	108.8	175	-178.3	-0.3	0	0	0	109.3	A141 K142	D139-A141 PolarHBondContact O-N 3.47Å; D139-A141 WeakPolarHBondContact OD1-CB 3.43Å; D139-A141 PolarHBondContact OD1-N 3.49Å; D139-K142 HydrophobicContact CB-CD 4.11Å; D139-K142 HydrophobicContact CB-CG 4.14Å; D139-K142 PolarHBondContact O-N 2.98Å; D139-K142 VanDerWaalsContact O-N 3.12Å; D139-K142 WeakPolarHBondContact OD2-CE 3.47Å
140	P	60.4	Low	67.5	Low	50 Å²	50	82.3 Å²	82.3	33%	0.325	42%	0.416	S	S	.	.	G	3₁₀ helix	trans	-63.9	-20.3	178.8	27.9	-34.4	0	0	0	112.6	F138 K142 D143	F138-P140 HydrophobicContact CE2-CB 4.04Å; F138-P140 WeakPolarHBondContact O-CD 3.49Å; P140-K142 PolarHBondContact O-N 3.29Å; P140-D143 PolarHBondContact O-N 3.38Å; P140-D143 VanDerWaalsContact O-O 3.08Å
141	A	62.9	Low	69.3	Low	89 Å²	89	84.6 Å²	84.6	74%	0.736	44%	0.438	S	S	*	.	G	3₁₀ helix	trans	-68.6	-19.4	176.6	0	0	0	0	0	112.8	D139	D139-A141 PolarHBondContact O-N 3.47Å; D139-A141 WeakPolarHBondContact OD1-CB 3.43Å; D139-A141 PolarHBondContact OD1-N 3.49Å
142	K	64	Low	71.4	Confident	182 Å²	182	78.7 Å²	78.7	79%	0.791	41%	0.411	S	S	*	.	G	3₁₀ helix	trans	-90.1	-10.4	178.3	-65	-178	-174.6	176.7	0	113.6	D139 P140	D139-K142 HydrophobicContact CB-CD 4.11Å; D139-K142 HydrophobicContact CB-CG 4.14Å; D139-K142 PolarHBondContact O-N 2.98Å; D139-K142 VanDerWaalsContact O-N 3.12Å; D139-K142 WeakPolarHBondContact OD2-CE 3.47Å; P140-K142 PolarHBondContact O-N 3.29Å
143	D	69.8	Low	73.4	Confident	36 Å²	36	78.5 Å²	78.5	19%	0.193	41%	0.408	C	S	.	.	S	Bend	trans	-111.1	136	179.6	-164.1	30	0	0	0	110.2	P140 C145 K149 H165 S166	P140-D143 PolarHBondContact O-N 3.38Å; P140-D143 VanDerWaalsContact O-O 3.08Å; D143-C145 PolarHBondContact O-N 2.97Å; D143-K149 IonicContact OD1-NZ 3.06Å; D143-H165 WeakPolarHBondContact OD2-CA 3.31Å; D143-H165 WeakPolarHBondContact OD2-CB 3.45Å; D143-S166 WeakPolarHBondContact OD2-CB 3.45Å; D143-S166 PolarHBondContact OD2-N 2.91Å
144	Q	71.2	Confident	75.4	Confident	130 Å²	130	80.9 Å²	80.9	61%	0.607	42%	0.422	S	S	*	.			trans	-65	125.2	176.8	-68.3	-178.9	0.3	0	0	107.8	C146 Q147	Q144-C146 PolarHBondContact O-N 3.32Å; Q144-Q147 HydrophobicContact CB-CG 4.17Å
145	C	73.1	Confident	77.3	Confident	47 Å²	47	74 Å²	74	32%	0.318	39%	0.392	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.4	144.6	-179.1	-170.8	0	0	0	0	110.3	D143 Q147	D143-C145 PolarHBondContact O-N 2.97Å; C145-Q147 PolarHBondContact O-N 3.15Å
146	C	76.6	Confident	79	Confident	3 Å²	3	79.6 Å²	79.6	2%	0.02	41%	0.412	C	S	.	.	T	Hydrogen-bonded Turn	trans	69.9	12	151.2	-45.8	0	0	0	0	113.8	Q144 F148 R168 W327 Y331	Q144-C146 PolarHBondContact O-N 3.32Å; C146-F148 PolarHBondContact O-N 3.2Å; C146-R168 WeakPolarHBondContact CA-O 3.43Å; C146-W327 HydrophobicContact CB-CB 4Å; C146-W327 HydrophobicContact CB-CD2 3.81Å; C146-W327 HydrophobicContact CB-CE3 3.65Å; C146-W327 HydrophobicContact CB-CG 3.99Å; C146-W327 HydrophobicContact CB-CZ3 4.37Å; C146-Y331 HydrophobicContact CB-CD2 4.01Å; C146-Y331 HydrophobicContact CB-CG 4.39Å
147	Q	84.4	Confident	80.2	Confident	71 Å²	71	76.5 Å²	76.5	33%	0.332	40%	0.404	S	S	.	.			trans	-75.5	122.6	174.9	-72.3	-166	-21.2	0	0	111.4	Q144 C145 K149	Q144-Q147 HydrophobicContact CB-CG 4.17Å; C145-Q147 PolarHBondContact O-N 3.15Å; Q147-K149 PolarHBondContact O-N 2.94Å
148	F	91.5	Very high	81.2	Confident	40 Å²	40	80.6 Å²	80.6	18%	0.175	43%	0.425	C	S	.	.			trans	-79.1	118.7	169.5	175.2	-112.9	0	0	0	110.6	C146 E150 L153 L171 Y172 F330	C146-F148 PolarHBondContact O-N 3.2Å; F148-E150 HydrophobicContact CD1-CB 4.46Å; F148-E150 HydrophobicContact CE1-CB 3.77Å; F148-E150 HydrophobicContact CE1-CG 4.16Å; F148-E150 HydrophobicContact CZ-CB 4.24Å; F148-E150 HydrophobicContact CZ-CG 4.45Å; F148-L153 HydrophobicContact CE2-CD1 4.21Å; F148-L153 HydrophobicContact CE2-CD2 4.29Å; F148-L153 HydrophobicContact CE2-CG 4.21Å; F148-L153 HydrophobicContact CZ-CD1 3.61Å; F148-L153 HydrophobicContact CZ-CD2 4.47Å; F148-L153 HydrophobicContact CZ-CG 3.92Å; F148-L171 HydrophobicContact CB-CD1 4.42Å; F148-L171 HydrophobicContact CD1-CD1 3.81Å; F148-L171 HydrophobicContact CD2-CB 3.83Å; F148-L171 HydrophobicContact CD2-CD1 4.07Å; F148-L171 HydrophobicContact CE1-CD1 4.01Å; F148-L171 HydrophobicContact CE2-CB 3.68Å; F148-L171 HydrophobicContact CE2-CD1 4.26Å; F148-L171 HydrophobicContact CG-CB 4.45Å; F148-L171 HydrophobicContact CG-CD1 3.84Å; F148-L171 HydrophobicContact CZ-CB 4.18Å; F148-L171 HydrophobicContact CZ-CD1 4.23Å; F148-Y172 HydrophobicContact CD2-CD1 4.13Å; F148-Y172 AromaticContact CD2-CE1 3.61Å; F148-Y172 HydrophobicContact CD2-CE1 3.61Å; F148-Y172 HydrophobicContact CD2-CE2 4.2Å; F148-Y172 AromaticContact CD2-CZ 3.67Å; F148-Y172 AromaticContact CE2-CD1 3.79Å; F148-Y172 HydrophobicContact CE2-CD1 3.79Å; F148-Y172 AromaticContact CE2-CE1 3.5Å; F148-Y172 HydrophobicContact CE2-CE1 3.5Å; F148-Y172 VanDerWaalsContact CE2-CE1 3.5Å; F148-F330 HydrophobicContact CB-CB 3.69Å; F148-F330 HydrophobicContact CB-CD1 3.64Å; F148-F330 HydrophobicContact CB-CD2 3.79Å; F148-F330 HydrophobicContact CB-CE1 4.23Å; F148-F330 HydrophobicContact CB-CE2 4.38Å; F148-F330 HydrophobicContact CB-CG 3.4Å; F148-F330 HydrophobicContact CD1-CD1 4.09Å; F148-F330 HydrophobicContact CD1-CE1 4.11Å; F148-F330 HydrophobicContact CG-CD1 4.16Å; F148-F330 HydrophobicContact CG-CG 4.38Å
149	K	92.7	Very high	81.9	Confident	64 Å²	64	88.8 Å²	88.8	28%	0.278	46%	0.455	S	S	.	.			trans	-99.1	94	174.4	-58.8	-179.9	-175.1	177.2	0	109.3	D143 Q147 A151 L152 H165 Y172	D143-K149 IonicContact OD1-NZ 3.06Å; Q147-K149 PolarHBondContact O-N 2.94Å; K149-A151 PolarHBondContact O-N 2.48Å; K149-L152 HydrophobicContact CB-CD1 4.1Å; K149-L152 HydrophobicContact CB-CG 4.05Å; K149-L152 WeakPolarHBondContact O-CB 2.9Å; K149-L152 PolarHBondContact O-N 3.16Å; K149-H165 PolarHBondContact NZ-CD2 3.44Å; K149-H165 VanDerWaalsContact NZ-CG 3.34Å; K149-Y172 WeakPolarHBondContact CA-OH 3.31Å; K149-Y172 WeakPolarHBondContact CB-OH 3.08Å; K149-Y172 PolarHBondContact N-OH 2.9Å; K149-Y172 PolarHBondContact O-OH 3.24Å
150	E	93.8	Very high	83.2	Confident	145 Å²	145	89.1 Å²	89.1	68%	0.678	46%	0.462	S	S	*	.	G	3₁₀ helix	trans	-55.5	-34.1	-178.7	-171.4	-178.9	-177.8	0	0	112.9	F148 L152 L153	F148-E150 HydrophobicContact CD1-CB 4.46Å; F148-E150 HydrophobicContact CE1-CB 3.77Å; F148-E150 HydrophobicContact CE1-CG 4.16Å; F148-E150 HydrophobicContact CZ-CB 4.24Å; F148-E150 HydrophobicContact CZ-CG 4.45Å; E150-L152 PolarHBondContact O-N 2.93Å; E150-L153 VanDerWaalsContact O-CB 3.3Å; E150-L153 WeakPolarHBondContact O-CB 3.26Å; E150-L153 PolarHBondContact O-N 3.46Å
151	A	93.9	Very high	84.6	Confident	78 Å²	78	87.7 Å²	87.7	65%	0.645	46%	0.455	S	S	*	.	G	3₁₀ helix	trans	-56.4	-22.6	177.4	0	0	0	0	0	114	K149 L153 N154	K149-A151 PolarHBondContact O-N 2.48Å; A151-L153 VanDerWaalsContact C-N 3.25Å; A151-L153 PolarHBondContact O-N 3.39Å; A151-N154 CarbonylContact O-C 3.59Å; A151-N154 PolarHBondContact O-N 3.38Å
152	L	94.7	Very high	85.9	Confident	17 Å²	17	88.3 Å²	88.3	9%	0.089	45%	0.445	C	S	.	.	G	3₁₀ helix	trans	-72.1	-20.1	175.2	-59.7	-177.2	0	0	0	112.6	I98 N102 K149 E150 N154 L155 I163 L167 Y172	I98-L152 HydrophobicContact CD1-CB 4.3Å; I98-L152 HydrophobicContact CD1-CD1 4.38Å; I98-L152 VanDerWaalsContact CG2-O 3.31Å; I98-L152 WeakPolarHBondContact CG2-O 3.37Å; N102-L152 PolarHBondContact ND2-O 3.24Å; K149-L152 HydrophobicContact CB-CD1 4.1Å; K149-L152 HydrophobicContact CB-CG 4.05Å; K149-L152 WeakPolarHBondContact O-CB 2.9Å; K149-L152 PolarHBondContact O-N 3.16Å; E150-L152 PolarHBondContact O-N 2.93Å; L152-N154 PolarHBondContact O-N 2.53Å; L152-L155 HydrophobicContact CD2-CD2 4.25Å; L152-I163 HydrophobicContact CD1-CD1 4.23Å; L152-I163 HydrophobicContact CD1-CG2 4.33Å; L152-I163 HydrophobicContact CD2-CD1 4.01Å; L152-I163 HydrophobicContact CD2-CG1 4.25Å; L152-L167 HydrophobicContact CD1-CD2 3.66Å; L152-Y172 HydrophobicContact CB-CE1 4.03Å; L152-Y172 HydrophobicContact CD1-CE1 4.13Å
153	L	94.1	Very high	87.1	Confident	51 Å²	51	79.8 Å²	79.8	27%	0.267	41%	0.408	S	S	.	.	G	3₁₀ helix	trans	-74.1	-16.2	175.8	-60.3	-164.6	0	0	0	113.1	L101 N102 F148 E150 A151 Y172	L101-L153 HydrophobicContact CD2-CB 3.68Å; L101-L153 HydrophobicContact CD2-CD1 4.38Å; L101-L153 HydrophobicContact CD2-CD2 3.78Å; L101-L153 HydrophobicContact CD2-CG 4.14Å; L101-L153 WeakPolarHBondContact CD2-O 3.41Å; N102-L153 PolarHBondContact OD1-O 3.01Å; F148-L153 HydrophobicContact CE2-CD1 4.21Å; F148-L153 HydrophobicContact CE2-CD2 4.29Å; F148-L153 HydrophobicContact CE2-CG 4.21Å; F148-L153 HydrophobicContact CZ-CD1 3.61Å; F148-L153 HydrophobicContact CZ-CD2 4.47Å; F148-L153 HydrophobicContact CZ-CG 3.92Å; E150-L153 VanDerWaalsContact O-CB 3.3Å; E150-L153 WeakPolarHBondContact O-CB 3.26Å; E150-L153 PolarHBondContact O-N 3.46Å; A151-L153 VanDerWaalsContact C-N 3.25Å; A151-L153 PolarHBondContact O-N 3.39Å; L153-Y172 HydrophobicContact CD2-CD1 3.88Å; L153-Y172 HydrophobicContact CD2-CE1 4.37Å
154	N	94.3	Very high	87.8	Confident	139 Å²	139	84.3 Å²	84.3	74%	0.743	42%	0.422	S	S	*	.	S	Bend	trans	-137.1	75.3	-178	-171.8	12.7	0	0	0	111.8	A151 L152	A151-N154 CarbonylContact O-C 3.59Å; A151-N154 PolarHBondContact O-N 3.38Å; L152-N154 PolarHBondContact O-N 2.53Å
155	L	93.1	Very high	88.5	Confident	36 Å²	36	80 Å²	80	19%	0.188	40%	0.402	C	S	.	.			trans	-90.7	132.7	177.6	-61.1	172.4	0	0	0	110.7	I76 I98 N102 K104 L152 C157 A161	I76-L155 HydrophobicContact CD1-CD1 3.59Å; I76-L155 HydrophobicContact CG1-CD1 4.07Å; I98-L155 HydrophobicContact CG2-CD1 4.15Å; N102-L155 WeakPolarHBondContact OD1-CB 2.84Å; N102-L155 PolarHBondContact OD1-N 3.24Å; K104-L155 HydrophobicContact CD-CB 4.46Å; L152-L155 HydrophobicContact CD2-CD2 4.25Å; L155-C157 PolarHBondContact O-N 2.75Å; L155-A161 HydrophobicContact CD1-CB 3.9Å; L155-A161 HydrophobicContact CD2-CB 4.5Å
156	K	90.1	Very high	89.2	Confident	171 Å²	171	78.2 Å²	78.2	74%	0.743	39%	0.39	S	S	*	.			trans	-55.3	132.1	178.5	-63.3	-175.1	178.1	-175.5	0	111.8	K104 E158	K104-K156 WeakPolarHBondContact CE-O 3.12Å; K104-K156 PolarHBondContact NZ-O 2.76Å; K156-E158 PolarHBondContact O-N 2.93Å
157	C	86.4	Confident	89.9	Confident	66 Å²	66	78.1 Å²	78.1	45%	0.446	39%	0.389	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.5	-43.8	-175.3	174.3	0	0	0	0	113.2	C73 K104 L155 R159	C73-C157 CarbonylContact C-O 3.18Å; C73-C157 HydrophobicContact CB-CB 3.68Å; C73-C157 WeakPolarHBondContact CB-O 3.47Å; C73-C157 WeakPolarHBondContact CB-SG 3.42Å; C73-C157 WeakPolarHBondContact SG-CB 3.28Å; C73-C157 CovalentContact SG-SG 2.03Å; C73-C157 PolarHBondContact SG-SG 2.96Å; K104-C157 PolarHBondContact NZ-O 3.49Å; L155-C157 PolarHBondContact O-N 2.75Å; C157-R159 VanDerWaalsContact C-N 3.29Å; C157-R159 PolarHBondContact O-N 3.4Å; C157-R159 VanDerWaalsContact O-N 3.16Å
158	E	83.3	Confident	90.3	Very high	188 Å²	188	76.7 Å²	76.7	88%	0.879	38%	0.381	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.4	-16.5	-168.3	-63.8	167.7	-174.7	0	0	115.5	K156	K156-E158 PolarHBondContact O-N 2.93Å
159	R	85.5	Confident	90.4	Very high	191 Å²	191	74.8 Å²	74.8	72%	0.721	37%	0.372	S	S	*	.	S	Bend	trans	-115.2	137.3	-173.7	-63.9	-174.3	-177.6	-176.8	-1.1	111.5	K104 C157	K104-R159 PolarHBondContact NZ-O 2.87Å; C157-R159 VanDerWaalsContact C-N 3.29Å; C157-R159 PolarHBondContact O-N 3.4Å; C157-R159 VanDerWaalsContact O-N 3.16Å
160	S	90.5	Very high	90.5	Very high	77 Å²	77	72 Å²	72	54%	0.538	36%	0.361	S	S	.	.			trans	-68.5	144.1	163.4	-62	0	0	0	0	109.4	A75	A75-S160 PolarHBondContact N-OG 3.32Å; A75-S160 VanDerWaalsContact N-OG 3.13Å; A75-S160 CarbonylContact O-C 3.54Å; A75-S160 WeakPolarHBondContact O-CA 3.4Å; A75-S160 WeakPolarHBondContact O-CB 3Å
161	A	91.2	Very high	90.6	Very high	20 Å²	20	67 Å²	67	17%	0.165	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	137.6	178	0	0	0	0	0	109.7	A75 I76 E77 L155	A75-A161 PolarHBondContact O-N 3Å; I76-A161 CarbonylContact C-O 3.58Å; I76-A161 WeakPolarHBondContact CA-O 3.26Å; E77-A161 PolarHBondContact N-O 3.16Å; L155-A161 HydrophobicContact CD1-CB 3.9Å; L155-A161 HydrophobicContact CD2-CB 4.5Å
162	I	89.9	Confident	90.8	Very high	102 Å²	102	63.5 Å²	63.5	52%	0.523	31%	0.308	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113	122	170.9	-56	175.4	0	0	0	106.7	E77 R164	E77-I162 HydrophobicContact CB-CG1 4.37Å; I162-R164 HydrophobicContact CG2-CG 4.12Å
163	I	89.2	Confident	90.9	Very high	3 Å²	3	62.8 Å²	62.8	2%	0.015	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	112.2	-174.5	-62.8	179.8	0	0	0	107.4	I76 E77 V78 I98 L152 H165 L167	I76-I163 HydrophobicContact CG2-CD1 3.5Å; I76-I163 VanDerWaalsContact CG2-CD1 3.5Å; I76-I163 HydrophobicContact CG2-CG1 4.18Å; E77-I163 PolarHBondContact O-N 2.9Å; V78-I163 HydrophobicContact CG2-CB 3.99Å; V78-I163 HydrophobicContact CG2-CD1 4.31Å; V78-I163 HydrophobicContact CG2-CG2 4.23Å; I98-I163 HydrophobicContact CD1-CD1 4.41Å; L152-I163 HydrophobicContact CD1-CD1 4.23Å; L152-I163 HydrophobicContact CD1-CG2 4.33Å; L152-I163 HydrophobicContact CD2-CD1 4.01Å; L152-I163 HydrophobicContact CD2-CG1 4.25Å; I163-H165 WeakPolarHBondContact CG2-CE1 3.27Å; I163-H165 WeakPolarHBondContact CG2-ND1 3.47Å; I163-L167 HydrophobicContact CG2-CD1 4.04Å; I163-L167 HydrophobicContact CG2-CD2 3.79Å; I163-L167 HydrophobicContact CG2-CG 4.14Å
164	R	85.2	Confident	90.9	Very high	131 Å²	131	64.1 Å²	64.1	49%	0.494	31%	0.309	S	S	.	.			trans	-117.2	57.2	-179.3	-64.7	-175.5	176.6	-160.2	-7.4	110.6	E136 I162	E136-R164 IonicContact OE2-CZ 3.74Å; E136-R164 IonicContact OE2-NH1 2.76Å; E136-R164 PolarHBondContact OE2-NH1 3.16Å; E136-R164 IonicContact OE2-NH2 3.38Å; E136-R164 PolarHBondContact OE2-NH2 3.39Å; I162-R164 HydrophobicContact CG2-CG 4.12Å
165	H	84.9	Confident	90.9	Very high	41 Å²	41	63.3 Å²	63.3	19%	0.19	31%	0.305	C	S	.	.	S	Bend	trans	-146.8	158.4	-179.3	6.7	90.7	0	0	0	110.4	Q91 D143 K149 I163 L167	Q91-H165 PolarHBondContact NE2-O 3.06Å; D143-H165 WeakPolarHBondContact OD2-CA 3.31Å; D143-H165 WeakPolarHBondContact OD2-CB 3.45Å; K149-H165 PolarHBondContact NZ-CD2 3.44Å; K149-H165 VanDerWaalsContact NZ-CG 3.34Å; I163-H165 WeakPolarHBondContact CG2-CE1 3.27Å; I163-H165 WeakPolarHBondContact CG2-ND1 3.47Å; H165-L167 PolarHBondContact O-N 2.89Å
166	S	87.4	Confident	91	Very high	9 Å²	9	64.1 Å²	64.1	6%	0.063	31%	0.308	C	S	.	.			trans	-59.2	114.7	167.8	-172.8	0	0	0	0	110.2	D143 R168	D143-S166 WeakPolarHBondContact OD2-CB 3.45Å; D143-S166 PolarHBondContact OD2-N 2.91Å; S166-R168 VanDerWaalsContact C-N 3.3Å; S166-R168 PolarHBondContact O-N 2.82Å; S166-R168 WeakPolarHBondContact OG-CG 2.88Å
167	L	92.4	Very high	91.1	Very high	0 Å²	0	58.9 Å²	58.9	0%	0	28%	0.283	C	S	.	.			trans	-97.7	39	174.1	-57.9	-179.2	0	0	0	111.8	V78 Q91 A94 I98 L152 I163 H165 S169 Y172	V78-L167 HydrophobicContact CG1-CD1 4.28Å; V78-L167 HydrophobicContact CG2-CD1 3.84Å; Q91-L167 VanDerWaalsContact OE1-CB 3.23Å; A94-L167 HydrophobicContact CB-CB 3.49Å; A94-L167 VanDerWaalsContact CB-CB 3.49Å; A94-L167 HydrophobicContact CB-CD1 3.59Å; A94-L167 HydrophobicContact CB-CG 4.18Å; I98-L167 HydrophobicContact CD1-CD1 3.95Å; I98-L167 HydrophobicContact CD1-CD2 4.42Å; L152-L167 HydrophobicContact CD1-CD2 3.66Å; I163-L167 HydrophobicContact CG2-CD1 4.04Å; I163-L167 HydrophobicContact CG2-CD2 3.79Å; I163-L167 HydrophobicContact CG2-CG 4.14Å; H165-L167 PolarHBondContact O-N 2.89Å; L167-S169 PolarHBondContact O-N 3.16Å; L167-Y172 HydrophobicContact CB-CD2 4.06Å; L167-Y172 HydrophobicContact CB-CE2 4.05Å; L167-Y172 HydrophobicContact CD2-CD2 4.38Å; L167-Y172 HydrophobicContact CD2-CE2 3.78Å
168	R	91.8	Very high	91.5	Very high	41 Å²	41	60.8 Å²	60.8	16%	0.155	29%	0.285	C	S	.	.			trans	-76.6	64.1	179	-71.1	-176.6	-179.7	175.1	5.4	111.2	D84 F90 C146 S166 Y331	D84-R168 IonicContact OD2-CZ 3.91Å; D84-R168 IonicContact OD2-NH2 2.8Å; D84-R168 PolarHBondContact OD2-NH2 2.79Å; F90-R168 HydrophobicContact CB-CG 4.18Å; F90-R168 HydrophobicContact CD1-CB 4.44Å; F90-R168 HydrophobicContact CD2-CB 4.39Å; F90-R168 HydrophobicContact CD2-CG 3.83Å; F90-R168 HydrophobicContact CE2-CG 4.32Å; F90-R168 HydrophobicContact CG-CB 4.32Å; F90-R168 HydrophobicContact CG-CG 3.96Å; C146-R168 WeakPolarHBondContact CA-O 3.43Å; S166-R168 VanDerWaalsContact C-N 3.3Å; S166-R168 PolarHBondContact O-N 2.82Å; S166-R168 WeakPolarHBondContact OG-CG 2.88Å; R168-Y331 HydrophobicContact CB-CD2 4.3Å; R168-Y331 HydrophobicContact CB-CE2 4.09Å; R168-Y331 WeakPolarHBondContact O-CD2 3.22Å
169	S	93.9	Very high	92	Very high	0 Å²	0	54.8 Å²	54.8	0%	0	26%	0.256	C	S	.	.			trans	-144.2	133.2	171.8	174.9	0	0	0	0	110	L167 L171 F173 F330	L167-S169 PolarHBondContact O-N 3.16Å; S169-L171 PolarHBondContact O-N 3.06Å; S169-L171 PolarHBondContact OG-N 2.89Å; S169-F173 VanDerWaalsContact O-CE1 3.24Å; S169-F173 WeakPolarHBondContact O-CE1 3.45Å; S169-F330 VanDerWaalsContact CA-O 3.27Å; S169-F330 WeakPolarHBondContact CA-O 3.22Å; S169-F330 WeakPolarHBondContact CB-O 3.24Å; S169-F330 PolarHBondContact OG-O 3.45Å
170	F	95.3	Very high	92.5	Very high	7 Å²	7	45.7 Å²	45.7	3%	0.031	22%	0.222	C	C	.	.	G	3₁₀ helix	trans	-70.7	-22.6	179.2	77.3	-86.2	0	0	0	112.7	Y172 F173 Q174 W303 F330 P333	F170-Y172 PolarHBondContact O-N 2.78Å; F170-Y172 VanDerWaalsContact O-N 3.16Å; F170-F173 HydrophobicContact CB-CE2 4.15Å; F170-F173 HydrophobicContact CB-CZ 4.06Å; F170-F173 CarbonylContact O-C 3.48Å; F170-F173 PolarHBondContact O-N 3.35Å; F170-Q174 HydrophobicContact CD2-CB 4.14Å; F170-Q174 HydrophobicContact CE2-CB 4.46Å; F170-Q174 PolarHBondContact O-N 2.92Å; F170-W303 HydrophobicContact CB-CH2 3.79Å; F170-W303 HydrophobicContact CB-CZ2 3.8Å; F170-F330 WeakPolarHBondContact CD1-O 3.4Å; F170-F330 PolarHBondContact N-O 3.43Å; F170-P333 HydrophobicContact CD1-CG 4.05Å; F170-P333 HydrophobicContact CD2-CG 4.34Å; F170-P333 HydrophobicContact CE1-CB 4.47Å; F170-P333 HydrophobicContact CE1-CG 4.32Å; F170-P333 HydrophobicContact CE2-CB 4.49Å; F170-P333 HydrophobicContact CG-CG 4.07Å; F170-P333 HydrophobicContact CZ-CB 4.39Å
171	L	96.1	Very high	92.6	Very high	38 Å²	38	43.9 Å²	43.9	20%	0.199	20%	0.204	C	C	.	.	G	3₁₀ helix	trans	-58.8	-28.7	-179.8	-64.4	-177.7	0	0	0	112.5	F148 S169 F173 Q174 F330	F148-L171 HydrophobicContact CB-CD1 4.42Å; F148-L171 HydrophobicContact CD1-CD1 3.81Å; F148-L171 HydrophobicContact CD2-CB 3.83Å; F148-L171 HydrophobicContact CD2-CD1 4.07Å; F148-L171 HydrophobicContact CE1-CD1 4.01Å; F148-L171 HydrophobicContact CE2-CB 3.68Å; F148-L171 HydrophobicContact CE2-CD1 4.26Å; F148-L171 HydrophobicContact CG-CB 4.45Å; F148-L171 HydrophobicContact CG-CD1 3.84Å; F148-L171 HydrophobicContact CZ-CB 4.18Å; F148-L171 HydrophobicContact CZ-CD1 4.23Å; S169-L171 PolarHBondContact O-N 3.06Å; S169-L171 PolarHBondContact OG-N 2.89Å; L171-F173 PolarHBondContact O-N 3.09Å; L171-Q174 VanDerWaalsContact CD2-OE1 3.24Å; L171-F330 HydrophobicContact CD1-CD1 3.57Å; L171-F330 HydrophobicContact CD1-CE1 4.3Å; L171-F330 HydrophobicContact CD1-CG 4.48Å
172	Y	97.1	Very high	92.6	Very high	6 Å²	6	50.3 Å²	50.3	2%	0.024	22%	0.224	C	C	.	.	G	3₁₀ helix	trans	-63.9	-23.5	176.2	-68.6	-49.9	0	0	0	114.1	A94 G97 I98 F148 K149 L152 L153 L167 F170	A94-Y172 HydrophobicContact CB-CD2 3.94Å; A94-Y172 HydrophobicContact CB-CG 4.08Å; G97-Y172 CarbonylContact C-O 3.48Å; G97-Y172 WeakPolarHBondContact CA-O 3.22Å; I98-Y172 HydrophobicContact CD1-CD1 3.66Å; I98-Y172 HydrophobicContact CD1-CE1 4.11Å; I98-Y172 HydrophobicContact CD1-CG 3.92Å; I98-Y172 HydrophobicContact CG1-CD1 3.71Å; I98-Y172 HydrophobicContact CG1-CE1 4.49Å; I98-Y172 HydrophobicContact CG1-CG 4.09Å; F148-Y172 HydrophobicContact CD2-CD1 4.13Å; F148-Y172 AromaticContact CD2-CE1 3.61Å; F148-Y172 HydrophobicContact CD2-CE1 3.61Å; F148-Y172 HydrophobicContact CD2-CE2 4.2Å; F148-Y172 AromaticContact CD2-CZ 3.67Å; F148-Y172 AromaticContact CE2-CD1 3.79Å; F148-Y172 HydrophobicContact CE2-CD1 3.79Å; F148-Y172 AromaticContact CE2-CE1 3.5Å; F148-Y172 HydrophobicContact CE2-CE1 3.5Å; F148-Y172 VanDerWaalsContact CE2-CE1 3.5Å; K149-Y172 WeakPolarHBondContact CA-OH 3.31Å; K149-Y172 WeakPolarHBondContact CB-OH 3.08Å; K149-Y172 PolarHBondContact N-OH 2.9Å; K149-Y172 PolarHBondContact O-OH 3.24Å; L152-Y172 HydrophobicContact CB-CE1 4.03Å; L152-Y172 HydrophobicContact CD1-CE1 4.13Å; L153-Y172 HydrophobicContact CD2-CD1 3.88Å; L153-Y172 HydrophobicContact CD2-CE1 4.37Å; L167-Y172 HydrophobicContact CB-CD2 4.06Å; L167-Y172 HydrophobicContact CB-CE2 4.05Å; L167-Y172 HydrophobicContact CD2-CD2 4.38Å; L167-Y172 HydrophobicContact CD2-CE2 3.78Å; F170-Y172 PolarHBondContact O-N 2.78Å; F170-Y172 VanDerWaalsContact O-N 3.16Å
173	F	96.4	Very high	92.7	Very high	2 Å²	2	46.2 Å²	46.2	1%	0.009	20%	0.202	C	C	.	.	T	Hydrogen-bonded Turn	trans	-136.9	12	-171.8	56.6	-98.8	0	0	0	114.2	F90 A93 A94 S169 F170 L171 D175 Q176 R177 I180 W303 W304 Y307	F90-F173 AromaticContact CD1-CE1 3.99Å; F90-F173 HydrophobicContact CD1-CE1 3.99Å; F90-F173 HydrophobicContact CD1-CZ 4.14Å; F90-F173 HydrophobicContact CE1-CE1 4.35Å; F90-F173 HydrophobicContact CE1-CZ 4.14Å; A93-F173 HydrophobicContact CB-CB 4.36Å; A93-F173 HydrophobicContact CB-CD1 3.61Å; A93-F173 HydrophobicContact CB-CD2 4.12Å; A93-F173 HydrophobicContact CB-CE1 3.78Å; A93-F173 HydrophobicContact CB-CE2 4.27Å; A93-F173 HydrophobicContact CB-CG 3.77Å; A93-F173 HydrophobicContact CB-CZ 4.1Å; A93-F173 WeakPolarHBondContact O-CB 3.45Å; A94-F173 HydrophobicContact CB-CD1 4.3Å; S169-F173 VanDerWaalsContact O-CE1 3.24Å; S169-F173 WeakPolarHBondContact O-CE1 3.45Å; F170-F173 HydrophobicContact CB-CE2 4.15Å; F170-F173 HydrophobicContact CB-CZ 4.06Å; F170-F173 CarbonylContact O-C 3.48Å; F170-F173 PolarHBondContact O-N 3.35Å; L171-F173 PolarHBondContact O-N 3.09Å; F173-D175 VanDerWaalsContact C-N 3.29Å; F173-D175 PolarHBondContact O-N 2.94Å; F173-Q176 CarbonylContact O-C 3.59Å; F173-Q176 WeakPolarHBondContact O-CA 3.38Å; F173-Q176 PolarHBondContact O-N 3.39Å; F173-R177 PolarHBondContact O-N 3.33Å; F173-I180 HydrophobicContact CB-CG1 4.15Å; F173-I180 HydrophobicContact CD2-CG1 4.2Å; F173-I180 HydrophobicContact CG-CG1 4.46Å; F173-W303 HydrophobicContact CE2-CH2 4.23Å; F173-W303 AromaticContact CZ-CH2 3.88Å; F173-W303 HydrophobicContact CZ-CH2 3.88Å; F173-W303 HydrophobicContact CZ-CZ3 4.2Å; F173-W304 HydrophobicContact CE1-CH2 4.33Å; F173-W304 AromaticContact CE2-CH2 4Å; F173-W304 HydrophobicContact CE2-CH2 4Å; F173-W304 HydrophobicContact CE2-CZ3 4.45Å; F173-W304 AromaticContact CZ-CH2 3.61Å; F173-W304 HydrophobicContact CZ-CH2 3.61Å; F173-W304 HydrophobicContact CZ-CZ2 4.22Å; F173-W304 HydrophobicContact CZ-CZ3 4.44Å; F173-Y307 HydrophobicContact CD2-CE2 4.43Å; F173-Y307 AromaticContact CD2-CZ 3.96Å; F173-Y307 WeakPolarHBondContact CD2-OH 3.39Å; F173-Y307 HydrophobicContact CE2-CD2 4.45Å; F173-Y307 HydrophobicContact CE2-CE1 4.15Å; F173-Y307 AromaticContact CE2-CE2 3.75Å; F173-Y307 HydrophobicContact CE2-CE2 3.75Å; F173-Y307 AromaticContact CE2-CZ 3.57Å
174	Q	95.3	Very high	92.9	Very high	79 Å²	79	46.2 Å²	46.2	37%	0.369	20%	0.202	S	C	.	.	G	3₁₀ helix	trans	-58.5	-40.1	-179.7	70.4	176.1	15.8	0	0	112.4	F170 L171 Q176 R177	F170-Q174 HydrophobicContact CD2-CB 4.14Å; F170-Q174 HydrophobicContact CE2-CB 4.46Å; F170-Q174 PolarHBondContact O-N 2.92Å; L171-Q174 VanDerWaalsContact CD2-OE1 3.24Å; Q174-Q176 PolarHBondContact O-N 2.96Å; Q174-Q176 VanDerWaalsContact O-N 3.16Å; Q174-R177 VanDerWaalsContact O-CB 3.23Å; Q174-R177 WeakPolarHBondContact O-CB 3.39Å; Q174-R177 PolarHBondContact O-N 2.96Å
175	D	94.1	Very high	93	Very high	121 Å²	121	40.9 Å²	40.9	65%	0.647	19%	0.187	S	C	*	.	G	3₁₀ helix	trans	-71.9	-12.1	-179.6	-61.6	-22.9	0	0	0	112.3	F173	F173-D175 VanDerWaalsContact C-N 3.29Å; F173-D175 PolarHBondContact O-N 2.94Å
176	Q	94	Very high	93.1	Very high	54 Å²	54	39.2 Å²	39.2	25%	0.252	18%	0.179	S	C	.	.	G	3₁₀ helix	trans	-109.1	16.1	176.4	-62.5	-63.6	-49.9	0	0	111.5	F173 Q174 E178 K179 I180	F173-Q176 CarbonylContact O-C 3.59Å; F173-Q176 WeakPolarHBondContact O-CA 3.38Å; F173-Q176 PolarHBondContact O-N 3.39Å; Q174-Q176 PolarHBondContact O-N 2.96Å; Q174-Q176 VanDerWaalsContact O-N 3.16Å; Q176-E178 VanDerWaalsContact C-N 3.32Å; Q176-E178 PolarHBondContact O-N 3.48Å; Q176-E178 VanDerWaalsContact O-N 3.16Å; Q176-K179 HydrophobicContact CB-CB 4.42Å; Q176-K179 WeakPolarHBondContact O-CA 3.4Å; Q176-K179 WeakPolarHBondContact O-CB 3.37Å; Q176-K179 PolarHBondContact O-N 3.3Å; Q176-I180 HydrophobicContact CB-CG1 4.29Å; Q176-I180 WeakPolarHBondContact O-CG1 3.38Å; Q176-I180 PolarHBondContact O-N 3.25Å
177	R	94	Very high	92.8	Very high	61 Å²	61	43.9 Å²	43.9	23%	0.23	20%	0.198	C	C	.	.	H	α-helix	trans	-45.8	-51.5	-173.9	178.8	-179.3	-68.8	-155.9	-4.5	113.4	F173 Q174 K179 I180 R181 Y307 E335	F173-R177 PolarHBondContact O-N 3.33Å; Q174-R177 VanDerWaalsContact O-CB 3.23Å; Q174-R177 WeakPolarHBondContact O-CB 3.39Å; Q174-R177 PolarHBondContact O-N 2.96Å; R177-K179 PolarHBondContact O-N 3.47Å; R177-I180 PolarHBondContact O-N 3.11Å; R177-R181 WeakPolarHBondContact O-CG 3.42Å; R177-R181 PolarHBondContact O-N 3.22Å; R177-Y307 WeakPolarHBondContact CA-OH 3.23Å; R177-E335 IonicContact CZ-OE1 3.32Å; R177-E335 VanDerWaalsContact CZ-OE1 3.28Å; R177-E335 IonicContact NH1-OE1 3.53Å; R177-E335 PolarHBondContact NH1-OE1 3.03Å; R177-E335 IonicContact NH2-OE1 3.28Å; R177-E335 PolarHBondContact NH2-OE1 2.95Å
178	E	93.4	Very high	91.6	Very high	105 Å²	105	49 Å²	49	49%	0.491	23%	0.226	S	C	.	.	H	α-helix	trans	-67.6	-33.7	-179.4	-67.1	-52.9	120.8	0	0	113.3	Q176 R181 R182	Q176-E178 VanDerWaalsContact C-N 3.32Å; Q176-E178 PolarHBondContact O-N 3.48Å; Q176-E178 VanDerWaalsContact O-N 3.16Å; E178-R181 IonicContact OE1-NH1 2.62Å; E178-R181 PolarHBondContact OE1-NH1 3.36Å; E178-R182 WeakPolarHBondContact O-CG 3.32Å; E178-R182 PolarHBondContact O-N 3.41Å; E178-R182 VanDerWaalsContact O-N 3.14Å; E178-R182 PolarHBondContact O-NH1 3.38Å
179	K	94.5	Very high	90.3	Very high	62 Å²	62	49 Å²	49	27%	0.27	23%	0.229	S	C	.	.	H	α-helix	trans	-67.4	-48	173.5	-179.8	179.2	172.5	-179.5	0	110.5	S125 Q176 R177 R181 R182 E183	S125-K179 WeakPolarHBondContact OG-CE 3.23Å; S125-K179 PolarHBondContact OG-NZ 2.77Å; Q176-K179 HydrophobicContact CB-CB 4.42Å; Q176-K179 WeakPolarHBondContact O-CA 3.4Å; Q176-K179 WeakPolarHBondContact O-CB 3.37Å; Q176-K179 PolarHBondContact O-N 3.3Å; R177-K179 PolarHBondContact O-N 3.47Å; K179-R181 VanDerWaalsContact C-N 3.32Å; K179-R181 PolarHBondContact O-N 3Å; K179-R182 PolarHBondContact O-N 2.97Å; K179-R182 VanDerWaalsContact O-N 3.16Å; K179-E183 WeakPolarHBondContact CE-OE1 3.29Å; K179-E183 IonicContact NZ-OE1 2.68Å; K179-E183 WeakPolarHBondContact O-CG 3.48Å; K179-E183 PolarHBondContact O-N 3.46Å
180	I	95.2	Very high	88.6	Confident	1 Å²	1	55.9 Å²	55.9	1%	0.005	27%	0.265	C	S	.	.	H	α-helix	trans	-58.4	-44.4	177.9	-63.1	-53.3	0	0	0	110.7	A93 L96 F173 Q176 R177 R182 E183 L184 W304 Y307	A93-I180 HydrophobicContact CB-CD1 3.91Å; A93-I180 HydrophobicContact CB-CG1 4.32Å; A93-I180 HydrophobicContact CB-CG2 4.09Å; L96-I180 HydrophobicContact CB-CD1 4.09Å; L96-I180 HydrophobicContact CD1-CD1 3.67Å; F173-I180 HydrophobicContact CB-CG1 4.15Å; F173-I180 HydrophobicContact CD2-CG1 4.2Å; F173-I180 HydrophobicContact CG-CG1 4.46Å; Q176-I180 HydrophobicContact CB-CG1 4.29Å; Q176-I180 WeakPolarHBondContact O-CG1 3.38Å; Q176-I180 PolarHBondContact O-N 3.25Å; R177-I180 PolarHBondContact O-N 3.11Å; I180-R182 PolarHBondContact O-N 2.87Å; I180-E183 PolarHBondContact O-N 2.91Å; I180-L184 HydrophobicContact CG2-CD1 3.56Å; I180-L184 HydrophobicContact CG2-CG 4.15Å; I180-L184 WeakPolarHBondContact O-CB 3.48Å; I180-L184 WeakPolarHBondContact O-CG 3.49Å; I180-L184 PolarHBondContact O-N 3.36Å; I180-W304 HydrophobicContact CG2-CZ3 4.2Å; I180-Y307 HydrophobicContact CB-CE1 4.41Å; I180-Y307 HydrophobicContact CG2-CE1 3.85Å
181	R	93	Very high	86.6	Confident	38 Å²	38	61.8 Å²	61.8	14%	0.143	30%	0.297	C	S	.	.	H	α-helix	trans	-60	-41.9	175.9	-76.2	175.7	172.3	171	-9.1	113.2	R177 E178 K179 A185 Y307 L308 N310	R177-R181 WeakPolarHBondContact O-CG 3.42Å; R177-R181 PolarHBondContact O-N 3.22Å; E178-R181 IonicContact OE1-NH1 2.62Å; E178-R181 PolarHBondContact OE1-NH1 3.36Å; K179-R181 VanDerWaalsContact C-N 3.32Å; K179-R181 PolarHBondContact O-N 3Å; R181-A185 PolarHBondContact O-N 3.49Å; R181-Y307 HydrophobicContact CG-CE1 4.37Å; R181-Y307 PolarHBondContact NE-O 2.86Å; R181-Y307 PolarHBondContact NH2-O 2.83Å; R181-Y307 VanDerWaalsContact NH2-O 3.16Å; R181-L308 HydrophobicContact CG-CD2 4.19Å; R181-N310 VanDerWaalsContact CZ-OD1 3.22Å; R181-N310 PolarHBondContact NH1-OD1 3.05Å; R181-N310 PolarHBondContact NH2-OD1 3.47Å
182	R	91.6	Very high	84.9	Confident	155 Å²	155	65 Å²	65	59%	0.585	31%	0.311	S	S	*	.	H	α-helix	trans	-65.3	-39.6	176.3	-74.4	-170.8	-59.2	-91.5	4.6	112.6	E178 K179 I180 A185	E178-R182 WeakPolarHBondContact O-CG 3.32Å; E178-R182 PolarHBondContact O-N 3.41Å; E178-R182 VanDerWaalsContact O-N 3.14Å; E178-R182 PolarHBondContact O-NH1 3.38Å; K179-R182 PolarHBondContact O-N 2.97Å; K179-R182 VanDerWaalsContact O-N 3.16Å; I180-R182 PolarHBondContact O-N 2.87Å; R182-A185 WeakPolarHBondContact O-CB 3.46Å; R182-A185 PolarHBondContact O-N 3.17Å
183	E	92.6	Very high	83.6	Confident	17 Å²	17	65.1 Å²	65.1	8%	0.079	31%	0.313	C	S	.	.	H	α-helix	trans	-74.5	-34.4	180	-71	-164.6	-134.6	0	0	113	Y92 F121 R122 A123 S125 K179 I180 A185	Y92-E183 PolarHBondContact OH-OE2 2.92Å; F121-E183 WeakPolarHBondContact CB-O 3.46Å; R122-E183 CarbonylContact C-O 2.98Å; R122-E183 WeakPolarHBondContact CA-O 3.19Å; R122-E183 PolarHBondContact N-O 3.33Å; R122-E183 VanDerWaalsContact N-O 3.1Å; A123-E183 PolarHBondContact N-O 3.29Å; S125-E183 WeakPolarHBondContact CB-OE1 3.46Å; S125-E183 VanDerWaalsContact CB-OE2 3.27Å; S125-E183 WeakPolarHBondContact CB-OE2 3.33Å; S125-E183 PolarHBondContact N-OE2 3.46Å; S125-E183 PolarHBondContact OG-OE1 2.81Å; S125-E183 PolarHBondContact OG-OE2 2.9Å; K179-E183 WeakPolarHBondContact CE-OE1 3.29Å; K179-E183 IonicContact NZ-OE1 2.68Å; K179-E183 WeakPolarHBondContact O-CG 3.48Å; K179-E183 PolarHBondContact O-N 3.46Å; I180-E183 PolarHBondContact O-N 2.91Å; E183-A185 VanDerWaalsContact C-N 3.25Å; E183-A185 PolarHBondContact O-N 2.87Å
184	L	92.2	Very high	81.8	Confident	2 Å²	2	67.9 Å²	67.9	1%	0.01	33%	0.326	C	S	.	.	T	Hydrogen-bonded Turn	trans	-87.4	7	175.5	-60.8	-178.7	0	0	0	113	I89 L117 F121 I180 P186 W304 L308	I89-L184 HydrophobicContact CG2-CD1 3.42Å; I89-L184 VanDerWaalsContact CG2-CD1 3.42Å; I89-L184 HydrophobicContact CG2-CD2 3.75Å; I89-L184 HydrophobicContact CG2-CG 4.24Å; L117-L184 HydrophobicContact CD2-CD2 4.41Å; F121-L184 WeakPolarHBondContact CD1-O 3.39Å; F121-L184 HydrophobicContact CD2-CD2 4.38Å; F121-L184 HydrophobicContact CG-CD2 4.49Å; I180-L184 HydrophobicContact CG2-CD1 3.56Å; I180-L184 HydrophobicContact CG2-CG 4.15Å; I180-L184 WeakPolarHBondContact O-CB 3.48Å; I180-L184 WeakPolarHBondContact O-CG 3.49Å; I180-L184 PolarHBondContact O-N 3.36Å; L184-P186 WeakPolarHBondContact O-CD 3.2Å; L184-W304 HydrophobicContact CD1-CE3 3.6Å; L184-W304 HydrophobicContact CD1-CH2 4.13Å; L184-W304 HydrophobicContact CD1-CZ3 3.32Å; L184-L308 HydrophobicContact CB-CD1 4.33Å; L184-L308 HydrophobicContact CB-CD2 3.83Å; L184-L308 HydrophobicContact CD1-CD2 4.38Å
185	A	88.6	Confident	79.8	Confident	20 Å²	20	64.9 Å²	64.9	17%	0.165	31%	0.313	C	S	.	.	S	Bend	trans	-64.2	130.9	169.2	0	0	0	0	0	109.2	F121 R122 R181 R182 E183	F121-A185 WeakPolarHBondContact CA-O 3.37Å; R122-A185 WeakPolarHBondContact CG-O 3.46Å; R122-A185 PolarHBondContact N-O 2.81Å; R181-A185 PolarHBondContact O-N 3.49Å; R182-A185 WeakPolarHBondContact O-CB 3.46Å; R182-A185 PolarHBondContact O-N 3.17Å; E183-A185 VanDerWaalsContact C-N 3.25Å; E183-A185 PolarHBondContact O-N 2.87Å
186	P	85.5	Confident	77.9	Confident	6 Å²	6	70.8 Å²	70.8	4%	0.039	33%	0.326	C	S	.	.	B	Isolated β-bridge	trans	-58.3	142.3	176.5	-28.1	37.6	0	0	0	112	H120 F121 L184 N188 L189 C286	H120-P186 WeakPolarHBondContact O-CA 3.26Å; F121-P186 HydrophobicContact CD1-CG 4.5Å; L184-P186 WeakPolarHBondContact O-CD 3.2Å; P186-N188 PolarHBondContact O-N 3.2Å; P186-L189 HydrophobicContact CB-CD2 4.17Å; P186-L189 HydrophobicContact CG-CD2 4.42Å; P186-L189 WeakPolarHBondContact O-CG 3.35Å; P186-C286 HydrophobicContact CB-CB 4.11Å; P186-C286 HydrophobicContact CG-CB 3.62Å
187	K	80.8	Confident	75.9	Confident	106 Å²	106	72.3 Å²	72.3	46%	0.461	34%	0.336	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.6	-39.5	179.3	-83.3	178.6	167.7	178.8	0	112.7	R118 H120 F121 R122 L189	R118-K187 WeakPolarHBondContact O-CD 3.41Å; R118-K187 WeakPolarHBondContact O-CE 3.43Å; R118-K187 PolarHBondContact O-NZ 3.01Å; H120-K187 PolarHBondContact O-N 3Å; F121-K187 WeakPolarHBondContact O-CD 3.37Å; F121-K187 WeakPolarHBondContact O-CE 3.39Å; F121-K187 WeakPolarHBondContact O-CG 3.5Å; R122-K187 HydrophobicContact CG-CG 4.15Å; K187-L189 PolarHBondContact O-N 3.14Å
188	N	69	Low	73.4	Confident	107 Å²	107	77 Å²	77	57%	0.572	36%	0.36	S	S	*	.	T	Hydrogen-bonded Turn	trans	-100.2	56.5	-171.7	-63.9	-24.6	0	0	0	112.9	P186 N190	P186-N188 PolarHBondContact O-N 3.2Å; N188-N190 VanDerWaalsContact C-N 3.27Å; N188-N190 PolarHBondContact O-N 3.23Å
189	L	63.2	Low	71	Confident	43 Å²	43	76 Å²	76	23%	0.225	36%	0.364	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60.6	-32.2	-177.6	-68.4	-179	0	0	0	114.4	P186 K187 C286 R290	P186-L189 HydrophobicContact CB-CD2 4.17Å; P186-L189 HydrophobicContact CG-CD2 4.42Å; P186-L189 WeakPolarHBondContact O-CG 3.35Å; K187-L189 PolarHBondContact O-N 3.14Å; L189-C286 VanDerWaalsContact CD2-SG 3.52Å; L189-R290 PolarHBondContact O-NH2 3.41Å; L189-R290 VanDerWaalsContact O-NH2 3.15Å
190	N	57.6	Low	68.7	Low	143 Å²	143	73.3 Å²	73.3	77%	0.765	35%	0.353	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.5	-29.3	-163.7	-68.9	-1	0	0	0	113.7	N188	N188-N190 VanDerWaalsContact C-N 3.27Å; N188-N190 PolarHBondContact O-N 3.23Å
191	N	54.8	Low	66.1	Low	132 Å²	132	74.9 Å²	74.9	71%	0.706	36%	0.363	S	S	*	.	T	Hydrogen-bonded Turn	trans	-118.5	-15.9	-170.8	-66.2	-2.5	0	0	0	114.7
192	H	60.3	Low	63.7	Low	106 Å²	106	75.1 Å²	75.1	49%	0.491	37%	0.373	S	S	.	.	S	Bend	trans	-127.7	-3.4	-167.6	-65.1	-6.7	0	0	0	114.7	Q194 V283	H192-Q194 PolarHBondContact O-N 3.4Å; H192-V283 HydrophobicContact CB-CG2 4.12Å; H192-V283 VanDerWaalsContact O-CG1 3.26Å; H192-V283 WeakPolarHBondContact O-CG1 3.47Å
193	C	68.8	Low	61.2	Low	8 Å²	8	71.3 Å²	71.3	5%	0.054	37%	0.367	C	S	.	.	S	Bend	trans	-86.4	14.1	174.9	-54.5	0	0	0	0	112.5	C286 I287	C193-C286 HydrophobicContact CB-CB 3.75Å; C193-C286 WeakPolarHBondContact CB-SG 3.41Å; C193-C286 WeakPolarHBondContact SG-CB 3.48Å; C193-C286 CovalentContact SG-SG 2Å; C193-C286 PolarHBondContact SG-SG 3.39Å; C193-I287 WeakPolarHBondContact O-CG1 3.26Å
194	Q	60.3	Low	58.8	Low	60 Å²	60	77.7 Å²	77.7	28%	0.28	40%	0.402	S	S	.	.	S	Bend	trans	-103.9	127.8	170.1	-67.5	-169.2	-3.7	0	0	107.9	H192 A202	H192-Q194 PolarHBondContact O-N 3.4Å; Q194-A202 HydrophobicContact CG-CB 4.31Å; Q194-A202 PolarHBondContact NE2-O 3.4Å
195	P	53.3	Low	56.2	Low	15 Å²	15	85.5 Å²	85.5	10%	0.097	44%	0.436	C	S	.	.			trans	-34.8	137.7	158	-43.5	49.5	0	0	0	114.1	N197 L200 E276 I287	P195-N197 PolarHBondContact O-N 2.97Å; P195-L200 HydrophobicContact CB-CB 3.37Å; P195-L200 HydrophobicContact CB-CD1 3.79Å; P195-L200 HydrophobicContact CB-CG 4.22Å; P195-L200 HydrophobicContact CG-CB 3.48Å; P195-L200 VanDerWaalsContact CG-CB 3.48Å; P195-L200 HydrophobicContact CG-CD1 3.64Å; P195-L200 HydrophobicContact CG-CG 4.15Å; P195-E276 VanDerWaalsContact CA-OE2 3.28Å; P195-E276 WeakPolarHBondContact CA-OE2 3.27Å; P195-E276 WeakPolarHBondContact CB-OE1 3.35Å; P195-E276 WeakPolarHBondContact CB-OE2 3.43Å; P195-E276 WeakPolarHBondContact CG-OE2 3.29Å; P195-I287 HydrophobicContact CG-CD1 4.39Å
196	R	53.8	Low	54.2	Low	246 Å²	246	86.4 Å²	86.4	93%	0.928	44%	0.436	S	S	*	.	S	Bend	trans	-69	-24.1	174.3	-78.3	-175.1	-177.6	173.7	0.4	112.1	H198	R196-H198 PolarHBondContact O-N 3.44Å
197	N	51.3	Low	52.4	Low	85 Å²	85	90.3 Å²	90.3	46%	0.455	47%	0.469	S	S	.	.	S	Bend	trans	-73	120	172.3	-68.2	-36.5	0	0	0	108.8	P195 S199 L200 E276	P195-N197 PolarHBondContact O-N 2.97Å; N197-S199 WeakPolarHBondContact CB-OG 3.26Å; N197-S199 PolarHBondContact O-N 3.29Å; N197-L200 PolarHBondContact O-N 3.07Å; N197-E276 WeakPolarHBondContact CB-OE1 3.36Å; N197-E276 PolarHBondContact ND2-OE1 3.48Å
198	H	41.8	Very low	50.8	Low	161 Å²	161	92.4 Å²	92.4	75%	0.745	48%	0.481	S	S	*	.	G	3₁₀ helix	trans	-53.8	-10.9	170.5	-70.3	-73.5	0	0	0	113.8	R196 L200 T201	R196-H198 PolarHBondContact O-N 3.44Å; H198-L200 PolarHBondContact O-N 3.22Å; H198-T201 PolarHBondContact O-OG1 2.69Å
199	S	43	Very low	50.3	Low	82 Å²	82	91.4 Å²	91.4	57%	0.573	48%	0.475	S	S	*	.	G	3₁₀ helix	trans	-71.6	-7.2	171.1	63.4	0	0	0	0	114.4	N197	N197-S199 WeakPolarHBondContact CB-OG 3.26Å; N197-S199 PolarHBondContact O-N 3.29Å
200	L	46.6	Very low	51.1	Low	6 Å²	6	96.8 Å²	96.8	3%	0.031	50%	0.504	C	S	.	.	G	3₁₀ helix	trans	-133.4	14.3	180	-75.9	166.1	0	0	0	111.8	P195 N197 H198 A202 I255 E276	P195-L200 HydrophobicContact CB-CB 3.37Å; P195-L200 HydrophobicContact CB-CD1 3.79Å; P195-L200 HydrophobicContact CB-CG 4.22Å; P195-L200 HydrophobicContact CG-CB 3.48Å; P195-L200 VanDerWaalsContact CG-CB 3.48Å; P195-L200 HydrophobicContact CG-CD1 3.64Å; P195-L200 HydrophobicContact CG-CG 4.15Å; N197-L200 PolarHBondContact O-N 3.07Å; H198-L200 PolarHBondContact O-N 3.22Å; L200-A202 PolarHBondContact O-N 3.11Å; L200-I255 HydrophobicContact CD1-CD1 4.29Å; L200-I255 HydrophobicContact CD1-CG1 4.44Å; L200-I255 HydrophobicContact CD1-CG2 3.99Å; L200-I255 HydrophobicContact CD2-CD1 3.45Å; L200-I255 VanDerWaalsContact CD2-CD1 3.45Å; L200-I255 HydrophobicContact CD2-CG1 4.1Å; L200-E276 HydrophobicContact CD1-CG 4.28Å
201	T	40.5	Very low	52.4	Low	34 Å²	34	91 Å²	91	21%	0.209	48%	0.475	C	S	.	.			trans	-61.9	102.4	175.4	39.3	0	0	0	0	109.2	H198 T203	H198-T201 PolarHBondContact O-OG1 2.69Å; T201-T203 PolarHBondContact O-N 3.26Å
202	A	41.3	Very low	54.2	Low	44 Å²	44	86.2 Å²	86.2	36%	0.364	45%	0.45	S	S	.	.			trans	-69	45.5	169.4	0	0	0	0	0	111.8	Q194 L200	Q194-A202 HydrophobicContact CG-CB 4.31Å; Q194-A202 PolarHBondContact NE2-O 3.4Å; L200-A202 PolarHBondContact O-N 3.11Å
203	T	40.1	Very low	55.6	Low	75 Å²	75	84.5 Å²	84.5	46%	0.46	44%	0.439	S	S	.	.	S	Bend	trans	-106.7	89.9	168	53.2	0	0	0	0	106.8	T201 K205	T201-T203 PolarHBondContact O-N 3.26Å; T203-K205 PolarHBondContact O-N 3.32Å
204	D	41.1	Very low	56.8	Low	151 Å²	151	84.1 Å²	84.1	81%	0.807	44%	0.437	S	S	*	.	S	Bend	trans	57.2	-18.8	161	-54.8	-33.2	0	0	0	119.7
205	K	38.8	Very low	58.4	Low	165 Å²	165	81.2 Å²	81.2	72%	0.717	42%	0.423	S	S	*	.	S	Bend	trans	-89.8	-10.9	177.4	-73	-165.7	173.9	-170.4	0	114.7	T203 E208	T203-K205 PolarHBondContact O-N 3.32Å; K205-E208 WeakPolarHBondContact O-CB 3.43Å
206	E	45.6	Very low	60.2	Low	39 Å²	39	80.6 Å²	80.6	18%	0.182	42%	0.419	C	S	.	.	S	Bend	trans	-98.6	-10	173.7	-76.6	-163.9	141.8	0	0	113	E208 D209 R213 R253	E206-E208 PolarHBondContact O-N 3.37Å; E206-D209 PolarHBondContact O-N 3.46Å; E206-D209 VanDerWaalsContact O-O 3.08Å; E206-R213 IonicContact OE2-NH1 3.06Å; E206-R253 IonicContact OE1-NH1 3.92Å
207	A	47.9	Very low	62	Low	88 Å²	88	69.1 Å²	69.1	73%	0.727	38%	0.376	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.1	-11.4	159.9	0	0	0	0	0	111.7
208	E	48.1	Very low	63.6	Low	151 Å²	151	65.3 Å²	65.3	71%	0.706	36%	0.355	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.4	-23.2	173.5	-95.7	173.3	163.8	0	0	113.7	K205 E206	K205-E208 WeakPolarHBondContact O-CB 3.43Å; E206-E208 PolarHBondContact O-N 3.37Å
209	D	58.6	Low	65.3	Low	85 Å²	85	59.4 Å²	59.4	46%	0.455	33%	0.332	S	S	.	.	S	Bend	trans	-107.7	104.2	173.8	-87.7	-23	0	0	0	108.5	E206 C211 R253	E206-D209 PolarHBondContact O-N 3.46Å; E206-D209 VanDerWaalsContact O-O 3.08Å; D209-C211 PolarHBondContact O-N 3.41Å; D209-R253 IonicContact OD2-CZ 3.23Å; D209-R253 IonicContact OD2-NH1 2.82Å; D209-R253 IonicContact OD2-NH2 2.67Å; D209-R253 PolarHBondContact OD2-NH2 2.68Å
210	D	78.6	Confident	66.5	Low	156 Å²	156	58.4 Å²	58.4	83%	0.834	32%	0.315	S	S	*	.			trans	-62.8	30.9	178	-79.8	-32.3	0	0	0	114.4
211	C	87	Confident	67	Low	22 Å²	22	64.7 Å²	64.7	15%	0.149	34%	0.338	C	S	.	.	P	Polyproline II helix	trans	-80.6	126.1	-178.6	-58.6	0	0	0	0	112.1	D209 R213 C251 R253	D209-C211 PolarHBondContact O-N 3.41Å; C211-R213 PolarHBondContact O-N 2.86Å; C211-C251 CarbonylContact C-O 3.41Å; C211-C251 WeakPolarHBondContact CA-O 3.44Å; C211-C251 HydrophobicContact CB-CB 3.71Å; C211-C251 WeakPolarHBondContact CB-SG 3.49Å; C211-C251 WeakPolarHBondContact SG-CB 3.46Å; C211-C251 CovalentContact SG-SG 2.02Å; C211-C251 PolarHBondContact SG-SG 3.5Å; C211-R253 HydrophobicContact CB-CG 4.06Å
212	V	90.7	Very high	68.2	Low	31 Å²	31	69.7 Å²	69.7	19%	0.188	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.6	129.7	171	-176.9	0	0	0	0	109.7	I214 C251 T252 R253 S292	V212-I214 HydrophobicContact CG1-CD1 3.95Å; V212-C251 PolarHBondContact N-O 3.35Å; V212-T252 CarbonylContact O-C 3.14Å; V212-T252 WeakPolarHBondContact O-CA 3.42Å; V212-R253 PolarHBondContact O-N 2.96Å; V212-S292 VanDerWaalsContact CG1-CB 3.49Å
213	R	90.7	Very high	69.3	Low	70 Å²	70	73.4 Å²	73.4	26%	0.264	38%	0.38	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.3	124.4	178.2	-62.1	-176.8	-61.5	-163.5	-1	111.1	E206 C211 I255 M291 S292	E206-R213 IonicContact OE2-NH1 3.06Å; C211-R213 PolarHBondContact O-N 2.86Å; R213-I255 HydrophobicContact CB-CD1 4.2Å; R213-I255 HydrophobicContact CG-CD1 4.24Å; R213-M291 HydrophobicContact CB-SD 3.69Å; R213-S292 PolarHBondContact O-N 2.87Å
214	I	93.8	Very high	70.7	Confident	0 Å²	0	72.1 Å²	72.1	0%	0	37%	0.373	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	120.1	177	-54.3	-56.7	0	0	0	108.4	V212 F243 T252 R253 F254 I255 G293 I295	V212-I214 HydrophobicContact CG1-CD1 3.95Å; I214-F243 HydrophobicContact CD1-CD1 3.57Å; I214-F243 HydrophobicContact CD1-CE1 3.65Å; I214-F243 HydrophobicContact CD1-CG 4.08Å; I214-F243 HydrophobicContact CD1-CZ 4.2Å; I214-F243 HydrophobicContact CG1-CB 4.39Å; I214-F243 HydrophobicContact CG1-CD1 4.07Å; I214-F243 HydrophobicContact CG1-CD2 4.45Å; I214-F243 HydrophobicContact CG1-CE1 4.47Å; I214-F243 HydrophobicContact CG1-CG 4.07Å; I214-F243 HydrophobicContact CG2-CD2 3.62Å; I214-F243 HydrophobicContact CG2-CE1 4.48Å; I214-F243 HydrophobicContact CG2-CE2 3.57Å; I214-F243 HydrophobicContact CG2-CG 4.11Å; I214-F243 HydrophobicContact CG2-CZ 4.04Å; I214-T252 HydrophobicContact CG1-CG2 3.62Å; I214-R253 PolarHBondContact N-O 3.25Å; I214-F254 HydrophobicContact CB-CD1 3.78Å; I214-F254 HydrophobicContact CB-CE1 3.92Å; I214-F254 HydrophobicContact CG1-CD1 4.47Å; I214-F254 HydrophobicContact CG1-CE1 4.17Å; I214-F254 HydrophobicContact CG2-CD1 3.83Å; I214-F254 HydrophobicContact CG2-CE1 3.86Å; I214-F254 CarbonylContact O-C 3.58Å; I214-F254 WeakPolarHBondContact O-CA 3.2Å; I214-I255 PolarHBondContact O-N 2.99Å; I214-G293 WeakPolarHBondContact CA-O 3.29Å; I214-I295 HydrophobicContact CG2-CD1 4.42Å; I214-I295 HydrophobicContact CG2-CG1 4.27Å
215	G	93.5	Very high	72.5	Confident	0 Å²	0	69.2 Å²	69.2	0%	0	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.7	145	176.2	0	0	0	0	0	111.7	I255 G293 L294 I295	G215-I255 CarbonylContact C-O 3.4Å; G215-I255 WeakPolarHBondContact CA-O 3.41Å; G215-G293 PolarHBondContact N-O 3.06Å; G215-L294 VanDerWaalsContact CA-CD2 3.45Å; G215-L294 CarbonylContact O-C 3.55Å; G215-L294 VanDerWaalsContact O-CA 3.27Å; G215-L294 WeakPolarHBondContact O-CA 3.46Å; G215-I295 PolarHBondContact O-N 3.49Å
216	I	92.4	Very high	74.3	Confident	1 Å²	1	68.4 Å²	68.4	1%	0.005	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	122.1	171.1	-61	159.1	0	0	0	106.8	M218 L236 F254 I255 G256 I257 I273 I295	I216-M218 HydrophobicContact CG2-CG 4.2Å; I216-M218 HydrophobicContact CG2-SD 4.35Å; I216-L236 HydrophobicContact CD1-CD1 4.02Å; I216-L236 HydrophobicContact CG1-CD1 4.26Å; I216-L236 HydrophobicContact CG2-CD1 4.08Å; I216-F254 HydrophobicContact CD1-CB 3.99Å; I216-F254 HydrophobicContact CD1-CD1 4.31Å; I216-I255 PolarHBondContact N-O 3.43Å; I216-G256 WeakPolarHBondContact O-CA 3.19Å; I216-I257 PolarHBondContact O-N 3.23Å; I216-I273 HydrophobicContact CD1-CD1 3.84Å; I216-I273 HydrophobicContact CD1-CG1 4.24Å; I216-I273 HydrophobicContact CD1-CG2 3.94Å; I216-I295 WeakPolarHBondContact CA-O 3.37Å; I216-I295 HydrophobicContact CG1-CB 4.1Å; I216-I295 HydrophobicContact CG1-CD1 4Å; I216-I295 HydrophobicContact CG1-CG1 4.38Å
217	Y	90.9	Very high	76	Confident	6 Å²	6	69.6 Å²	69.6	2%	0.024	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.9	98.3	176.3	-174.8	-144.3	0	0	0	111.4	P219 I257 K284 L288 I295 I296 S297 L301 S302 A305	Y217-P219 HydrophobicContact CD2-CG 4.38Å; Y217-P219 HydrophobicContact CE1-CG 4.49Å; Y217-P219 HydrophobicContact CE2-CB 4.14Å; Y217-P219 HydrophobicContact CE2-CG 3.86Å; Y217-I257 VanDerWaalsContact CD2-O 3.29Å; Y217-I257 WeakPolarHBondContact CD2-O 3.32Å; Y217-K284 HydrophobicContact CE2-CD 4.18Å; Y217-L288 HydrophobicContact CD1-CD1 3.4Å; Y217-L288 HydrophobicContact CD2-CD1 4.45Å; Y217-L288 HydrophobicContact CE1-CD1 4.12Å; Y217-L288 HydrophobicContact CG-CD1 3.61Å; Y217-I295 PolarHBondContact N-O 3.17Å; Y217-I296 WeakPolarHBondContact O-CA 3.4Å; Y217-S297 PolarHBondContact O-N 3.19Å; Y217-L301 HydrophobicContact CE1-CB 3.87Å; Y217-S302 WeakPolarHBondContact O-CB 3.22Å; Y217-A305 HydrophobicContact CD1-CB 4.15Å
218	M	84.4	Confident	77.4	Confident	4 Å²	4	67.7 Å²	67.7	2%	0.02	35%	0.346	C	S	.	.			trans	-130.7	72.8	-175.1	-57.8	-174.2	71.6	0	0	110.2	I216 E232 F235 Y263 I295	I216-M218 HydrophobicContact CG2-CG 4.2Å; I216-M218 HydrophobicContact CG2-SD 4.35Å; M218-E232 WeakPolarHBondContact CB-OE1 3.18Å; M218-E232 HydrophobicContact CE-CG 3.59Å; M218-E232 VanDerWaalsContact CE-OE1 3.27Å; M218-E232 WeakPolarHBondContact CE-OE1 3.4Å; M218-E232 HydrophobicContact SD-CG 4.33Å; M218-F235 HydrophobicContact CE-CD1 3.59Å; M218-F235 HydrophobicContact CE-CE1 3.46Å; M218-F235 VanDerWaalsContact CE-CE1 3.46Å; M218-F235 HydrophobicContact SD-CD1 4.14Å; M218-F235 HydrophobicContact SD-CE1 3.77Å; M218-Y263 HydrophobicContact CB-CE2 4.17Å; M218-Y263 WeakPolarHBondContact O-CE2 3.48Å; M218-I295 HydrophobicContact SD-CG2 4.21Å
219	P	77.4	Confident	78.9	Confident	38 Å²	38	62.3 Å²	62.3	25%	0.247	32%	0.323	C	S	.	.			trans	-72	133.3	177.1	29.6	-33.4	0	0	0	110.7	Y217	Y217-P219 HydrophobicContact CD2-CG 4.38Å; Y217-P219 HydrophobicContact CE1-CG 4.49Å; Y217-P219 HydrophobicContact CE2-CB 4.14Å; Y217-P219 HydrophobicContact CE2-CG 3.86Å
220	W	67.6	Low	80	Confident	60 Å²	60	63.9 Å²	63.9	23%	0.227	33%	0.328	C	S	.	.			trans	-81.9	137.5	169.5	-80.6	99.5	0	0	0	111.1	P224 N228 E232 Y263	W220-P224 HydrophobicContact CD2-CB 3.98Å; W220-P224 HydrophobicContact CD2-CG 4.4Å; W220-P224 HydrophobicContact CE3-CB 4.25Å; W220-P224 HydrophobicContact CG-CG 4.46Å; W220-P224 HydrophobicContact CH2-CB 4.41Å; W220-P224 HydrophobicContact CZ2-CB 4.06Å; W220-P224 HydrophobicContact CZ3-CB 4.46Å; W220-N228 HydrophobicContact CH2-CB 3.55Å; W220-N228 HydrophobicContact CZ2-CB 4.11Å; W220-N228 HydrophobicContact CZ3-CB 4.11Å; W220-E232 VanDerWaalsContact CE2-OE2 3.25Å; W220-E232 HydrophobicContact CZ2-CB 4.22Å; W220-E232 HydrophobicContact CZ2-CG 4.49Å; W220-E232 WeakPolarHBondContact CZ2-OE2 3.32Å; W220-E232 PolarHBondContact NE1-OE2 2.98Å; W220-Y263 AromaticContact CD1-CD2 3.8Å; W220-Y263 AromaticContact NE1-CE2 3.91Å
221	R	58.9	Low	80.2	Confident	138 Å²	138	60.2 Å²	60.2	52%	0.521	31%	0.307	S	S	.	.	S	Bend	trans	-85.2	-25	169.4	-70.7	-169.7	-179.3	137.7	10.6	113.4	E299	R221-E299 IonicContact CZ-OE2 3.2Å; R221-E299 IonicContact NE-OE2 3.67Å; R221-E299 IonicContact NH1-OE2 3.57Å; R221-E299 PolarHBondContact NH1-OE2 3.5Å; R221-E299 IonicContact NH2-OE2 3.65Å; R221-E299 PolarHBondContact NH2-OE2 2.95Å
222	H	63.9	Low	80	Confident	139 Å²	139	59.4 Å²	59.4	64%	0.644	30%	0.301	S	S	*	.	S	Bend	trans	-135.1	152.5	-176.1	-57.1	-55.9	0	0	0	109.5	P224	H222-P224 WeakPolarHBondContact O-CD 2.72Å; H222-P224 VanDerWaalsContact O-N 3.11Å
223	P	65.2	Low	79.7	Confident	123 Å²	123	59.2 Å²	59.2	80%	0.799	30%	0.302	S	S	*	.	P	Polyproline II helix	trans	-51.9	120.8	171.5	-22	32	0	0	0	109.2
224	P	70.5	Confident	79.5	Confident	48 Å²	48	61.4 Å²	61.4	31%	0.312	32%	0.315	S	S	.	.	P	Polyproline II helix	trans	-68.5	140.7	-178.5	28.5	-34.2	0	0	0	109.5	W220 H222 N228 V229	W220-P224 HydrophobicContact CD2-CB 3.98Å; W220-P224 HydrophobicContact CD2-CG 4.4Å; W220-P224 HydrophobicContact CE3-CB 4.25Å; W220-P224 HydrophobicContact CG-CG 4.46Å; W220-P224 HydrophobicContact CH2-CB 4.41Å; W220-P224 HydrophobicContact CZ2-CB 4.06Å; W220-P224 HydrophobicContact CZ3-CB 4.46Å; H222-P224 WeakPolarHBondContact O-CD 2.72Å; H222-P224 VanDerWaalsContact O-N 3.11Å; P224-N228 HydrophobicContact CB-CB 4.06Å; P224-V229 HydrophobicContact CB-CG2 3.77Å; P224-V229 HydrophobicContact CG-CG2 3.9Å
225	N	77.7	Confident	79.4	Confident	89 Å²	89	61.6 Å²	61.6	48%	0.476	32%	0.316	S	S	.	.	P	Polyproline II helix	trans	-80.4	168	163	68.1	30.1	0	0	0	109.5	S227 N228 V229	N225-S227 VanDerWaalsContact C-N 3.26Å; N225-S227 PolarHBondContact O-N 3.49Å; N225-S227 WeakPolarHBondContact OD1-CB 3.33Å; N225-S227 PolarHBondContact OD1-N 3.14Å; N225-N228 WeakPolarHBondContact O-CB 3.35Å; N225-N228 PolarHBondContact O-N 3.48Å; N225-N228 VanDerWaalsContact O-N 3.14Å; N225-N228 WeakPolarHBondContact OD1-CB 3.42Å; N225-N228 PolarHBondContact OD1-N 2.98Å; N225-N228 PolarHBondContact OD1-OD1 3.23Å; N225-V229 WeakPolarHBondContact O-CG2 3.45Å; N225-V229 PolarHBondContact O-N 2.95Å; N225-V229 VanDerWaalsContact O-N 3.12Å
226	E	77.6	Confident	79.2	Confident	148 Å²	148	61.6 Å²	61.6	69%	0.692	32%	0.316	S	S	*	.	H	α-helix	trans	-57.9	-37.3	-177	-170.5	177.9	176.4	0	0	113.2	V229 Q230	E226-V229 WeakPolarHBondContact O-CB 3.44Å; E226-V229 PolarHBondContact O-N 3.27Å; E226-Q230 WeakPolarHBondContact O-CG 3.39Å; E226-Q230 PolarHBondContact O-N 3.1Å
227	S	79.9	Confident	79.1	Confident	64 Å²	64	62.3 Å²	62.3	45%	0.448	32%	0.324	S	S	.	.	H	α-helix	trans	-64.2	-42.9	177.5	179.1	0	0	0	0	112.2	N225 V229 Q230 M231	N225-S227 VanDerWaalsContact C-N 3.26Å; N225-S227 PolarHBondContact O-N 3.49Å; N225-S227 WeakPolarHBondContact OD1-CB 3.33Å; N225-S227 PolarHBondContact OD1-N 3.14Å; S227-V229 VanDerWaalsContact C-N 3.31Å; S227-V229 PolarHBondContact O-N 3.06Å; S227-Q230 PolarHBondContact O-N 3.08Å; S227-M231 WeakPolarHBondContact O-CG 3.41Å; S227-M231 PolarHBondContact O-N 3.26Å
228	N	78.9	Confident	79.2	Confident	49 Å²	49	66.6 Å²	66.6	26%	0.262	34%	0.343	S	S	.	.	H	α-helix	trans	-60.2	-42.2	175.5	-73.8	-4.5	0	0	0	111.3	W220 P224 N225 E232	W220-N228 HydrophobicContact CH2-CB 3.55Å; W220-N228 HydrophobicContact CZ2-CB 4.11Å; W220-N228 HydrophobicContact CZ3-CB 4.11Å; P224-N228 HydrophobicContact CB-CB 4.06Å; N225-N228 WeakPolarHBondContact O-CB 3.35Å; N225-N228 PolarHBondContact O-N 3.48Å; N225-N228 VanDerWaalsContact O-N 3.14Å; N225-N228 WeakPolarHBondContact OD1-CB 3.42Å; N225-N228 PolarHBondContact OD1-N 2.98Å; N225-N228 PolarHBondContact OD1-OD1 3.23Å; N228-E232 VanDerWaalsContact O-CB 3.32Å; N228-E232 WeakPolarHBondContact O-CB 3.49Å; N228-E232 PolarHBondContact O-N 3.29Å
229	V	78.6	Confident	79.7	Confident	37 Å²	37	66.4 Å²	66.4	22%	0.224	34%	0.342	C	S	.	.	H	α-helix	trans	-62.1	-47.2	176.7	176.9	0	0	0	0	110.9	P224 N225 E226 S227 E232 A233 N267	P224-V229 HydrophobicContact CB-CG2 3.77Å; P224-V229 HydrophobicContact CG-CG2 3.9Å; N225-V229 WeakPolarHBondContact O-CG2 3.45Å; N225-V229 PolarHBondContact O-N 2.95Å; N225-V229 VanDerWaalsContact O-N 3.12Å; E226-V229 WeakPolarHBondContact O-CB 3.44Å; E226-V229 PolarHBondContact O-N 3.27Å; S227-V229 VanDerWaalsContact C-N 3.31Å; S227-V229 PolarHBondContact O-N 3.06Å; V229-E232 PolarHBondContact O-N 3.41Å; V229-A233 WeakPolarHBondContact O-CB 3.44Å; V229-A233 PolarHBondContact O-N 3.48Å; V229-N267 WeakPolarHBondContact CG1-OD1 3.23Å
230	Q	81.8	Confident	80.4	Confident	119 Å²	119	64.7 Å²	64.7	56%	0.556	33%	0.331	S	S	*	.	H	α-helix	trans	-65.3	-44.2	-179.3	-71.1	178	2.8	0	0	112.7	E226 S227 E232 A233 H234	E226-Q230 WeakPolarHBondContact O-CG 3.39Å; E226-Q230 PolarHBondContact O-N 3.1Å; S227-Q230 PolarHBondContact O-N 3.08Å; Q230-E232 VanDerWaalsContact C-N 3.33Å; Q230-E232 PolarHBondContact O-N 3.02Å; Q230-A233 PolarHBondContact O-N 2.93Å; Q230-H234 WeakPolarHBondContact O-CB 3.49Å; Q230-H234 PolarHBondContact O-N 3.49Å
231	M	83.7	Confident	81.6	Confident	78 Å²	78	65.9 Å²	65.9	38%	0.384	34%	0.341	S	S	.	.	H	α-helix	trans	-61.8	-42.5	177.4	-73	-172.6	-67.2	0	0	111.7	S227 H234 F235 F318	S227-M231 WeakPolarHBondContact O-CG 3.41Å; S227-M231 PolarHBondContact O-N 3.26Å; M231-H234 PolarHBondContact O-N 3.4Å; M231-F235 PolarHBondContact O-N 3.07Å; M231-F318 HydrophobicContact CB-CD1 4.29Å; M231-F318 HydrophobicContact CB-CE1 4.33Å
232	E	81.7	Confident	83.3	Confident	5 Å²	5	62 Å²	62	2%	0.023	33%	0.329	C	S	.	.	H	α-helix	trans	-67	-45	177.8	-172.7	179.2	-146.8	0	0	112.1	M218 W220 N228 V229 Q230 H234 F235 L236 Y263 N267	M218-E232 WeakPolarHBondContact CB-OE1 3.18Å; M218-E232 HydrophobicContact CE-CG 3.59Å; M218-E232 VanDerWaalsContact CE-OE1 3.27Å; M218-E232 WeakPolarHBondContact CE-OE1 3.4Å; M218-E232 HydrophobicContact SD-CG 4.33Å; W220-E232 VanDerWaalsContact CE2-OE2 3.25Å; W220-E232 HydrophobicContact CZ2-CB 4.22Å; W220-E232 HydrophobicContact CZ2-CG 4.49Å; W220-E232 WeakPolarHBondContact CZ2-OE2 3.32Å; W220-E232 PolarHBondContact NE1-OE2 2.98Å; N228-E232 VanDerWaalsContact O-CB 3.32Å; N228-E232 WeakPolarHBondContact O-CB 3.49Å; N228-E232 PolarHBondContact O-N 3.29Å; V229-E232 PolarHBondContact O-N 3.41Å; Q230-E232 VanDerWaalsContact C-N 3.33Å; Q230-E232 PolarHBondContact O-N 3.02Å; E232-H234 VanDerWaalsContact C-N 3.28Å; E232-H234 PolarHBondContact O-N 3.42Å; E232-F235 PolarHBondContact O-N 2.83Å; E232-L236 WeakPolarHBondContact O-CB 3.32Å; E232-L236 PolarHBondContact O-N 2.89Å; E232-Y263 WeakPolarHBondContact OE1-CE2 3.49Å; E232-Y263 PolarHBondContact OE1-OH 2.97Å; E232-N267 PolarHBondContact OE2-ND2 3.38Å
233	A	84.3	Confident	84.8	Confident	27 Å²	27	55.4 Å²	55.4	22%	0.223	30%	0.298	C	S	.	.	H	α-helix	trans	-60	-40.6	176.7	0	0	0	0	0	111.7	V229 Q230 L236 G237	V229-A233 WeakPolarHBondContact O-CB 3.44Å; V229-A233 PolarHBondContact O-N 3.48Å; Q230-A233 PolarHBondContact O-N 2.93Å; A233-L236 PolarHBondContact O-N 3.24Å; A233-G237 PolarHBondContact O-N 3.47Å
234	H	87.6	Confident	86.1	Confident	116 Å²	116	54.5 Å²	54.5	54%	0.537	28%	0.279	S	S	.	.	H	α-helix	trans	-65.2	-44.5	175.5	175	-109.1	0	0	0	112.3	Q230 M231 E232 G237 K238	Q230-H234 WeakPolarHBondContact O-CB 3.49Å; Q230-H234 PolarHBondContact O-N 3.49Å; M231-H234 PolarHBondContact O-N 3.4Å; E232-H234 VanDerWaalsContact C-N 3.28Å; E232-H234 PolarHBondContact O-N 3.42Å; H234-G237 PolarHBondContact O-N 3.14Å; H234-K238 WeakPolarHBondContact CE1-CE 3.36Å; H234-K238 PolarHBondContact CE1-NZ 3.45Å; H234-K238 WeakPolarHBondContact NE2-CE 3.44Å; H234-K238 PolarHBondContact O-N 3.04Å; H234-K238 VanDerWaalsContact O-N 3.14Å
235	F	90.1	Very high	87.2	Confident	4 Å²	4	57.5 Å²	57.5	2%	0.018	30%	0.297	C	S	.	.	H	α-helix	trans	-60	-47.4	172.7	159.5	-104.7	0	0	0	111.7	M218 M231 E232 G237 K238 A239 I295 P316 F318 I339	M218-F235 HydrophobicContact CE-CD1 3.59Å; M218-F235 HydrophobicContact CE-CE1 3.46Å; M218-F235 VanDerWaalsContact CE-CE1 3.46Å; M218-F235 HydrophobicContact SD-CD1 4.14Å; M218-F235 HydrophobicContact SD-CE1 3.77Å; M231-F235 PolarHBondContact O-N 3.07Å; E232-F235 PolarHBondContact O-N 2.83Å; F235-G237 VanDerWaalsContact C-N 3.31Å; F235-G237 PolarHBondContact O-N 3.19Å; F235-K238 PolarHBondContact O-N 3.39Å; F235-A239 HydrophobicContact CE2-CB 4.19Å; F235-A239 HydrophobicContact CZ-CB 4.23Å; F235-A239 WeakPolarHBondContact O-CB 3.34Å; F235-A239 PolarHBondContact O-N 2.86Å; F235-I295 HydrophobicContact CE1-CG2 3.53Å; F235-I295 HydrophobicContact CZ-CG2 3.68Å; F235-P316 HydrophobicContact CB-CB 4.19Å; F235-P316 HydrophobicContact CD1-CB 3.97Å; F235-P316 HydrophobicContact CD1-CG 4.21Å; F235-P316 HydrophobicContact CD2-CB 3.46Å; F235-P316 VanDerWaalsContact CD2-CB 3.46Å; F235-P316 HydrophobicContact CD2-CG 4.36Å; F235-P316 HydrophobicContact CE1-CB 4.18Å; F235-P316 HydrophobicContact CE1-CG 4.1Å; F235-P316 VanDerWaalsContact CE2-CA 3.41Å; F235-P316 HydrophobicContact CE2-CB 3.7Å; F235-P316 HydrophobicContact CE2-CG 4.26Å; F235-P316 VanDerWaalsContact CE2-N 3.3Å; F235-P316 HydrophobicContact CG-CB 3.59Å; F235-P316 HydrophobicContact CG-CG 4.32Å; F235-P316 HydrophobicContact CZ-CB 4.06Å; F235-P316 HydrophobicContact CZ-CG 4.13Å; F235-F318 HydrophobicContact CB-CE1 3.82Å; F235-F318 HydrophobicContact CG-CE1 4.35Å; F235-I339 HydrophobicContact CD2-CB 3.95Å; F235-I339 HydrophobicContact CD2-CG2 3.98Å; F235-I339 HydrophobicContact CE2-CB 3.9Å; F235-I339 HydrophobicContact CE2-CG2 4.35Å
236	L	89.6	Confident	88.1	Confident	0 Å²	0	59 Å²	59	0%	0	30%	0.296	C	S	.	.	H	α-helix	trans	-61.6	-41.5	-177.7	-177.8	58.3	0	0	0	111.1	I216 E232 A233 A239 I240 L268 F270 I273 I295	I216-L236 HydrophobicContact CD1-CD1 4.02Å; I216-L236 HydrophobicContact CG1-CD1 4.26Å; I216-L236 HydrophobicContact CG2-CD1 4.08Å; E232-L236 WeakPolarHBondContact O-CB 3.32Å; E232-L236 PolarHBondContact O-N 2.89Å; A233-L236 PolarHBondContact O-N 3.24Å; L236-A239 PolarHBondContact O-N 3.38Å; L236-I240 HydrophobicContact CD1-CD1 3.98Å; L236-I240 HydrophobicContact CD1-CG1 4.2Å; L236-I240 HydrophobicContact CG-CD1 3.88Å; L236-I240 WeakPolarHBondContact O-CB 3.36Å; L236-I240 VanDerWaalsContact O-CG1 3.26Å; L236-I240 WeakPolarHBondContact O-CG1 3.28Å; L236-I240 PolarHBondContact O-N 3.25Å; L236-L268 HydrophobicContact CD2-CD2 3.53Å; L236-F270 HydrophobicContact CB-CE2 4.35Å; L236-F270 HydrophobicContact CD2-CD2 4.01Å; L236-F270 HydrophobicContact CD2-CE2 3.74Å; L236-F270 HydrophobicContact CG-CD2 4.4Å; L236-F270 HydrophobicContact CG-CE2 3.99Å; L236-I273 HydrophobicContact CD2-CD1 4.44Å; L236-I295 HydrophobicContact CD1-CD1 4.05Å; L236-I295 HydrophobicContact CD1-CG2 4.02Å
237	G	90.8	Very high	88.7	Confident	16 Å²	16	53.6 Å²	53.6	17%	0.165	27%	0.271	C	S	.	.	H	α-helix	trans	-57.3	-51.5	172.9	0	0	0	0	0	112.3	A233 H234 F235 A239 I240 D241	A233-G237 PolarHBondContact O-N 3.47Å; H234-G237 PolarHBondContact O-N 3.14Å; F235-G237 VanDerWaalsContact C-N 3.31Å; F235-G237 PolarHBondContact O-N 3.19Å; G237-A239 VanDerWaalsContact C-N 3.33Å; G237-A239 PolarHBondContact O-N 3.12Å; G237-I240 PolarHBondContact O-N 3.41Å; G237-D241 PolarHBondContact O-N 3.41Å
238	K	92.7	Very high	89	Confident	96 Å²	96	57.7 Å²	57.7	42%	0.417	29%	0.288	S	S	.	.	H	α-helix	trans	-60.8	-39.8	176.9	-73.9	-177.9	168.5	-176.3	0	113	H234 F235 D241 H242 I339	H234-K238 WeakPolarHBondContact CE1-CE 3.36Å; H234-K238 PolarHBondContact CE1-NZ 3.45Å; H234-K238 WeakPolarHBondContact NE2-CE 3.44Å; H234-K238 PolarHBondContact O-N 3.04Å; H234-K238 VanDerWaalsContact O-N 3.14Å; F235-K238 PolarHBondContact O-N 3.39Å; K238-D241 PolarHBondContact O-N 3.25Å; K238-H242 WeakPolarHBondContact O-CB 3.34Å; K238-H242 PolarHBondContact O-N 2.86Å; K238-I339 HydrophobicContact CB-CG2 3.43Å; K238-I339 VanDerWaalsContact CB-CG2 3.43Å; K238-I339 HydrophobicContact CD-CG2 3.88Å; K238-I339 HydrophobicContact CG-CG2 4.34Å
239	A	94.1	Very high	89	Confident	0 Å²	0	59 Å²	59	0%	0	31%	0.313	C	S	.	.	H	α-helix	trans	-68.7	-40.1	-179.9	0	0	0	0	0	112	F235 L236 G237 H242 F243 I295 L314 I339	F235-A239 HydrophobicContact CE2-CB 4.19Å; F235-A239 HydrophobicContact CZ-CB 4.23Å; F235-A239 WeakPolarHBondContact O-CB 3.34Å; F235-A239 PolarHBondContact O-N 2.86Å; L236-A239 PolarHBondContact O-N 3.38Å; G237-A239 VanDerWaalsContact C-N 3.33Å; G237-A239 PolarHBondContact O-N 3.12Å; A239-H242 PolarHBondContact O-N 3.05Å; A239-F243 WeakPolarHBondContact O-CD2 3.4Å; A239-F243 PolarHBondContact O-N 3.39Å; A239-F243 VanDerWaalsContact O-N 3.14Å; A239-I295 HydrophobicContact CB-CD1 3.69Å; A239-I295 HydrophobicContact CB-CG1 3.96Å; A239-I295 HydrophobicContact CB-CG2 3.84Å; A239-L314 HydrophobicContact CB-CB 4.4Å; A239-L314 HydrophobicContact CB-CD1 3.86Å; A239-L314 WeakPolarHBondContact O-CD1 2.99Å; A239-I339 HydrophobicContact CB-CD1 4.14Å
240	I	92.9	Very high	89.4	Confident	3 Å²	3	60.7 Å²	60.7	2%	0.015	33%	0.327	C	S	.	.	H	α-helix	trans	-62.7	-47	172.9	-73.4	167.8	0	0	0	110.5	L236 G237 H242 F243 R244 F254 F270 I273 I295	L236-I240 HydrophobicContact CD1-CD1 3.98Å; L236-I240 HydrophobicContact CD1-CG1 4.2Å; L236-I240 HydrophobicContact CG-CD1 3.88Å; L236-I240 WeakPolarHBondContact O-CB 3.36Å; L236-I240 VanDerWaalsContact O-CG1 3.26Å; L236-I240 WeakPolarHBondContact O-CG1 3.28Å; L236-I240 PolarHBondContact O-N 3.25Å; G237-I240 PolarHBondContact O-N 3.41Å; I240-H242 VanDerWaalsContact C-N 3.33Å; I240-H242 PolarHBondContact O-N 2.91Å; I240-F243 PolarHBondContact O-N 2.98Å; I240-R244 HydrophobicContact CG2-CG 4.44Å; I240-R244 VanDerWaalsContact CG2-CZ 3.49Å; I240-R244 WeakPolarHBondContact O-CG 3.43Å; I240-R244 PolarHBondContact O-N 3.21Å; I240-F254 HydrophobicContact CB-CE1 4.23Å; I240-F254 HydrophobicContact CB-CZ 4.25Å; I240-F254 HydrophobicContact CG1-CD1 4.02Å; I240-F254 HydrophobicContact CG1-CE1 3.89Å; I240-F254 HydrophobicContact CG1-CZ 4.32Å; I240-F254 HydrophobicContact CG2-CE1 4.23Å; I240-F254 HydrophobicContact CG2-CE2 3.98Å; I240-F254 HydrophobicContact CG2-CZ 3.78Å; I240-F270 HydrophobicContact CD1-CB 4.48Å; I240-F270 HydrophobicContact CD1-CD2 4.29Å; I240-F270 HydrophobicContact CD1-CG 4.24Å; I240-I273 HydrophobicContact CD1-CD1 3.71Å; I240-I273 HydrophobicContact CD1-CG1 4.38Å; I240-I295 HydrophobicContact CG1-CD1 4.01Å
241	D	93	Very high	89.8	Confident	84 Å²	84	57.9 Å²	57.9	45%	0.449	32%	0.32	S	S	.	.	H	α-helix	trans	-64.3	-38.6	179	-72	-18.1	0	0	0	111.6	G237 K238 F243 R244 T245	G237-D241 PolarHBondContact O-N 3.41Å; K238-D241 PolarHBondContact O-N 3.25Å; D241-F243 VanDerWaalsContact C-N 3.34Å; D241-F243 PolarHBondContact O-N 3.19Å; D241-R244 PolarHBondContact O-N 3.45Å; D241-R244 IonicContact OD1-NH1 3.54Å; D241-R244 PolarHBondContact OD1-NH1 3.36Å; D241-T245 WeakPolarHBondContact O-CB 2.97Å; D241-T245 PolarHBondContact O-N 3.35Å; D241-T245 PolarHBondContact O-OG1 3.29Å; D241-T245 VanDerWaalsContact O-OG1 3.13Å
242	H	95.3	Very high	90.1	Very high	57 Å²	57	55.4 Å²	55.4	26%	0.264	31%	0.309	S	S	.	.	H	α-helix	trans	-55.4	-48.1	172.1	-178.7	97.7	0	0	0	111.7	K238 A239 I240 T245 Y246 R312 L314 I339	K238-H242 WeakPolarHBondContact O-CB 3.34Å; K238-H242 PolarHBondContact O-N 2.86Å; A239-H242 PolarHBondContact O-N 3.05Å; I240-H242 VanDerWaalsContact C-N 3.33Å; I240-H242 PolarHBondContact O-N 2.91Å; H242-T245 PolarHBondContact O-N 2.86Å; H242-Y246 VanDerWaalsContact O-CB 3.22Å; H242-Y246 WeakPolarHBondContact O-CB 3.17Å; H242-Y246 PolarHBondContact O-N 3.3Å; H242-R312 PolarHBondContact NE2-NH1 2.94Å; H242-L314 HydrophobicContact CB-CD1 3.99Å; H242-I339 HydrophobicContact CB-CD1 3.9Å
243	F	95	Very high	90.5	Very high	0 Å²	0	58.7 Å²	58.7	0%	0	32%	0.321	C	S	.	.	H	α-helix	trans	-66.7	-39.6	177.9	-84.2	-64.4	0	0	0	112.7	I214 A239 I240 D241 Y246 H247 F254 I295 R312 L314	I214-F243 HydrophobicContact CD1-CD1 3.57Å; I214-F243 HydrophobicContact CD1-CE1 3.65Å; I214-F243 HydrophobicContact CD1-CG 4.08Å; I214-F243 HydrophobicContact CD1-CZ 4.2Å; I214-F243 HydrophobicContact CG1-CB 4.39Å; I214-F243 HydrophobicContact CG1-CD1 4.07Å; I214-F243 HydrophobicContact CG1-CD2 4.45Å; I214-F243 HydrophobicContact CG1-CE1 4.47Å; I214-F243 HydrophobicContact CG1-CG 4.07Å; I214-F243 HydrophobicContact CG2-CD2 3.62Å; I214-F243 HydrophobicContact CG2-CE1 4.48Å; I214-F243 HydrophobicContact CG2-CE2 3.57Å; I214-F243 HydrophobicContact CG2-CG 4.11Å; I214-F243 HydrophobicContact CG2-CZ 4.04Å; A239-F243 WeakPolarHBondContact O-CD2 3.4Å; A239-F243 PolarHBondContact O-N 3.39Å; A239-F243 VanDerWaalsContact O-N 3.14Å; I240-F243 PolarHBondContact O-N 2.98Å; D241-F243 VanDerWaalsContact C-N 3.34Å; D241-F243 PolarHBondContact O-N 3.19Å; F243-Y246 PolarHBondContact O-N 3.12Å; F243-H247 AromaticContact CD1-NE2 3.95Å; F243-H247 WeakPolarHBondContact O-CB 3.32Å; F243-H247 PolarHBondContact O-CD2 3.18Å; F243-H247 PolarHBondContact O-N 3.44Å; F243-F254 HydrophobicContact CB-CE1 3.99Å; F243-F254 HydrophobicContact CB-CZ 3.96Å; F243-F254 HydrophobicContact CD2-CE1 4.34Å; F243-F254 HydrophobicContact CG-CE1 4.49Å; F243-I295 HydrophobicContact CD2-CD1 4.06Å; F243-I295 HydrophobicContact CD2-CG1 3.98Å; F243-I295 HydrophobicContact CE2-CD1 4.24Å; F243-I295 HydrophobicContact CE2-CG1 3.64Å; F243-R312 HydrophobicContact CE1-CB 3.99Å; F243-R312 HydrophobicContact CE1-CG 3.98Å; F243-R312 HydrophobicContact CZ-CB 4.36Å; F243-R312 HydrophobicContact CZ-CG 4.22Å; F243-R312 WeakPolarHBondContact CZ-O 3.14Å; F243-L314 HydrophobicContact CD2-CD1 3.41Å; F243-L314 VanDerWaalsContact CD2-CD1 3.41Å; F243-L314 HydrophobicContact CD2-CG 4.26Å; F243-L314 HydrophobicContact CE2-CB 4.44Å; F243-L314 HydrophobicContact CE2-CD1 3.18Å; F243-L314 HydrophobicContact CE2-CG 3.52Å; F243-L314 HydrophobicContact CG-CD1 4.3Å; F243-L314 HydrophobicContact CZ-CD1 3.9Å; F243-L314 HydrophobicContact CZ-CG 3.84Å
244	R	92.6	Very high	90.9	Very high	105 Å²	105	57.6 Å²	57.6	40%	0.396	31%	0.311	S	S	.	.	H	α-helix	trans	-60.5	-45.8	175.8	-73.7	172.8	173.4	163.2	-3.1	111.8	I240 D241 N248 F254	I240-R244 HydrophobicContact CG2-CG 4.44Å; I240-R244 VanDerWaalsContact CG2-CZ 3.49Å; I240-R244 WeakPolarHBondContact O-CG 3.43Å; I240-R244 PolarHBondContact O-N 3.21Å; D241-R244 PolarHBondContact O-N 3.45Å; D241-R244 IonicContact OD1-NH1 3.54Å; D241-R244 PolarHBondContact OD1-NH1 3.36Å; R244-N248 PolarHBondContact O-N 2.86Å; R244-F254 HydrophobicContact CG-CE2 4.38Å; R244-F254 HydrophobicContact CG-CZ 4.34Å
245	T	94.2	Very high	91	Very high	111 Å²	111	52.2 Å²	52.2	68%	0.681	29%	0.286	S	S	*	.	H	α-helix	trans	-65.4	-44.8	176.1	-60	0	0	0	0	111	D241 H242 H247 N248	D241-T245 WeakPolarHBondContact O-CB 2.97Å; D241-T245 PolarHBondContact O-N 3.35Å; D241-T245 PolarHBondContact O-OG1 3.29Å; D241-T245 VanDerWaalsContact O-OG1 3.13Å; H242-T245 PolarHBondContact O-N 2.86Å; T245-H247 VanDerWaalsContact C-N 3.3Å; T245-H247 PolarHBondContact O-N 3.02Å; T245-N248 PolarHBondContact O-N 3.29Å
246	Y	94.7	Very high	90.9	Very high	120 Å²	120	52 Å²	52	47%	0.471	29%	0.285	S	S	.	.	H	α-helix	trans	-61.1	-38.3	-179.5	178.8	-115.6	0	0	0	113	H242 F243 N248 R312	H242-Y246 VanDerWaalsContact O-CB 3.22Å; H242-Y246 WeakPolarHBondContact O-CB 3.17Å; H242-Y246 PolarHBondContact O-N 3.3Å; F243-Y246 PolarHBondContact O-N 3.12Å; Y246-N248 VanDerWaalsContact C-N 3.32Å; Y246-R312 VanDerWaalsContact CD2-CZ 3.43Å; Y246-R312 VanDerWaalsContact CG-NH1 3.31Å; Y246-R312 PolarHBondContact OH-NH2 2.94Å
247	H	91.1	Very high	90.8	Very high	34 Å²	34	52.1 Å²	52.1	16%	0.157	29%	0.286	C	S	.	.	T	Hydrogen-bonded Turn	trans	-86.2	1.1	177.1	-69.9	-60.8	0	0	0	113.9	F243 T245 G249 S250	F243-H247 AromaticContact CD1-NE2 3.95Å; F243-H247 WeakPolarHBondContact O-CB 3.32Å; F243-H247 PolarHBondContact O-CD2 3.18Å; F243-H247 PolarHBondContact O-N 3.44Å; T245-H247 VanDerWaalsContact C-N 3.3Å; T245-H247 PolarHBondContact O-N 3.02Å; H247-G249 VanDerWaalsContact C-N 3.3Å; H247-G249 PolarHBondContact O-N 2.77Å; H247-G249 VanDerWaalsContact O-N 3.07Å; H247-S250 VanDerWaalsContact O-CB 3.31Å; H247-S250 WeakPolarHBondContact O-CB 3.45Å; H247-S250 PolarHBondContact O-N 2.8Å; H247-S250 PolarHBondContact O-OG 3.23Å; H247-S250 VanDerWaalsContact O-OG 3.14Å
248	N	87.3	Confident	90.5	Very high	150 Å²	150	51.5 Å²	51.5	80%	0.802	28%	0.279	S	S	*	.	T	Hydrogen-bonded Turn	trans	42.8	47.7	168.6	-164.7	33.1	0	0	0	115.1	R244 T245 Y246	R244-N248 PolarHBondContact O-N 2.86Å; T245-N248 PolarHBondContact O-N 3.29Å; Y246-N248 VanDerWaalsContact C-N 3.32Å
249	G	78.4	Confident	89.6	Confident	77 Å²	77	49.3 Å²	49.3	79%	0.794	27%	0.272	S	S	*	.	T	Hydrogen-bonded Turn	trans	87.7	-3.7	178.3	0	0	0	0	0	115.9	H247	H247-G249 VanDerWaalsContact C-N 3.3Å; H247-G249 PolarHBondContact O-N 2.77Å; H247-G249 VanDerWaalsContact O-N 3.07Å
250	S	86.3	Confident	88.1	Confident	72 Å²	72	53.2 Å²	53.2	50%	0.503	30%	0.304	S	S	.	.	S	Bend	trans	-59.2	145.7	165.6	-59.3	0	0	0	0	110.2	H247 T252	H247-S250 VanDerWaalsContact O-CB 3.31Å; H247-S250 WeakPolarHBondContact O-CB 3.45Å; H247-S250 PolarHBondContact O-N 2.8Å; H247-S250 PolarHBondContact O-OG 3.23Å; H247-S250 VanDerWaalsContact O-OG 3.14Å; S250-T252 PolarHBondContact O-N 2.81Å; S250-T252 PolarHBondContact O-OG1 3.32Å
251	C	90.1	Very high	86.2	Confident	61 Å²	61	61 Å²	61	41%	0.412	34%	0.342	S	S	.	.			trans	-56.4	127.3	176.4	-179.5	0	0	0	0	109.8	C211 V212	C211-C251 CarbonylContact C-O 3.41Å; C211-C251 WeakPolarHBondContact CA-O 3.44Å; C211-C251 HydrophobicContact CB-CB 3.71Å; C211-C251 WeakPolarHBondContact CB-SG 3.49Å; C211-C251 WeakPolarHBondContact SG-CB 3.46Å; C211-C251 CovalentContact SG-SG 2.02Å; C211-C251 PolarHBondContact SG-SG 3.5Å; V212-C251 PolarHBondContact N-O 3.35Å
252	T	90.5	Very high	84.2	Confident	25 Å²	25	60.9 Å²	60.9	15%	0.153	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	124.8	-179.6	-56.5	0	0	0	0	108.9	V212 I214 S250 F254	V212-T252 CarbonylContact O-C 3.14Å; V212-T252 WeakPolarHBondContact O-CA 3.42Å; I214-T252 HydrophobicContact CG1-CG2 3.62Å; S250-T252 PolarHBondContact O-N 2.81Å; S250-T252 PolarHBondContact O-OG1 3.32Å; T252-F254 HydrophobicContact CG2-CD2 4.37Å; T252-F254 HydrophobicContact CG2-CE1 4.38Å; T252-F254 HydrophobicContact CG2-CE2 3.72Å; T252-F254 HydrophobicContact CG2-CZ 3.73Å
253	R	90.5	Very high	82.4	Confident	74 Å²	74	58.9 Å²	58.9	28%	0.279	34%	0.335	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	127.2	177.3	-72	-178.8	176.7	141.9	9	109.8	E206 D209 C211 V212 I214	E206-R253 IonicContact OE1-NH1 3.92Å; D209-R253 IonicContact OD2-CZ 3.23Å; D209-R253 IonicContact OD2-NH1 2.82Å; D209-R253 IonicContact OD2-NH2 2.67Å; D209-R253 PolarHBondContact OD2-NH2 2.68Å; C211-R253 HydrophobicContact CB-CG 4.06Å; V212-R253 PolarHBondContact O-N 2.96Å; I214-R253 PolarHBondContact N-O 3.25Å
254	F	91.3	Very high	80.3	Confident	5 Å²	5	62.4 Å²	62.4	2%	0.022	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.4	128.8	176.7	-64.8	-88.6	0	0	0	109.6	I214 I216 I240 F243 R244 T252 I273 S274 I295	I214-F254 HydrophobicContact CB-CD1 3.78Å; I214-F254 HydrophobicContact CB-CE1 3.92Å; I214-F254 HydrophobicContact CG1-CD1 4.47Å; I214-F254 HydrophobicContact CG1-CE1 4.17Å; I214-F254 HydrophobicContact CG2-CD1 3.83Å; I214-F254 HydrophobicContact CG2-CE1 3.86Å; I214-F254 CarbonylContact O-C 3.58Å; I214-F254 WeakPolarHBondContact O-CA 3.2Å; I216-F254 HydrophobicContact CD1-CB 3.99Å; I216-F254 HydrophobicContact CD1-CD1 4.31Å; I240-F254 HydrophobicContact CB-CE1 4.23Å; I240-F254 HydrophobicContact CB-CZ 4.25Å; I240-F254 HydrophobicContact CG1-CD1 4.02Å; I240-F254 HydrophobicContact CG1-CE1 3.89Å; I240-F254 HydrophobicContact CG1-CZ 4.32Å; I240-F254 HydrophobicContact CG2-CE1 4.23Å; I240-F254 HydrophobicContact CG2-CE2 3.98Å; I240-F254 HydrophobicContact CG2-CZ 3.78Å; F243-F254 HydrophobicContact CB-CE1 3.99Å; F243-F254 HydrophobicContact CB-CZ 3.96Å; F243-F254 HydrophobicContact CD2-CE1 4.34Å; F243-F254 HydrophobicContact CG-CE1 4.49Å; R244-F254 HydrophobicContact CG-CE2 4.38Å; R244-F254 HydrophobicContact CG-CZ 4.34Å; T252-F254 HydrophobicContact CG2-CD2 4.37Å; T252-F254 HydrophobicContact CG2-CE1 4.38Å; T252-F254 HydrophobicContact CG2-CE2 3.72Å; T252-F254 HydrophobicContact CG2-CZ 3.73Å; F254-I273 HydrophobicContact CB-CB 4.43Å; F254-I273 HydrophobicContact CB-CG1 3.93Å; F254-I273 HydrophobicContact CB-CG2 4.44Å; F254-I273 WeakPolarHBondContact O-CA 3.37Å; F254-S274 PolarHBondContact O-N 2.89Å; F254-S274 PolarHBondContact O-OG 2.83Å; F254-I295 HydrophobicContact CD1-CD1 4.41Å; F254-I295 HydrophobicContact CE1-CD1 4.34Å
255	I	90.1	Very high	78.2	Confident	2 Å²	2	61.3 Å²	61.3	1%	0.01	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	104.6	-175.4	-54.2	165.3	0	0	0	108.5	L200 R213 I214 G215 I216 I257 S274 M291	L200-I255 HydrophobicContact CD1-CD1 4.29Å; L200-I255 HydrophobicContact CD1-CG1 4.44Å; L200-I255 HydrophobicContact CD1-CG2 3.99Å; L200-I255 HydrophobicContact CD2-CD1 3.45Å; L200-I255 VanDerWaalsContact CD2-CD1 3.45Å; L200-I255 HydrophobicContact CD2-CG1 4.1Å; R213-I255 HydrophobicContact CB-CD1 4.2Å; R213-I255 HydrophobicContact CG-CD1 4.24Å; I214-I255 PolarHBondContact O-N 2.99Å; G215-I255 CarbonylContact C-O 3.4Å; G215-I255 WeakPolarHBondContact CA-O 3.41Å; I216-I255 PolarHBondContact N-O 3.43Å; I255-I257 HydrophobicContact CG2-CD1 3.91Å; I255-S274 CarbonylContact C-O 3.56Å; I255-S274 WeakPolarHBondContact CA-O 3.13Å; I255-M291 HydrophobicContact CB-CE 4.26Å; I255-M291 HydrophobicContact CD1-CE 3.71Å; I255-M291 HydrophobicContact CD1-SD 4.11Å; I255-M291 HydrophobicContact CG2-CE 4.4Å
256	G	89	Confident	76.2	Confident	0 Å²	0	63.6 Å²	63.6	0%	0	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76	121.9	172.1	0	0	0	0	0	111.8	I216 S274 V275 E276	I216-G256 WeakPolarHBondContact O-CA 3.19Å; G256-S274 PolarHBondContact N-O 2.93Å; G256-V275 CarbonylContact O-C 3.47Å; G256-V275 WeakPolarHBondContact O-CA 3.36Å; G256-E276 PolarHBondContact O-N 3.39Å
257	I	87.6	Confident	74.4	Confident	2 Å²	2	58.7 Å²	58.7	1%	0.01	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.4	127.3	171.3	-55.5	-56.3	0	0	0	108.1	I216 Y217 I255 E276 I278 K284 I287 L288	I216-I257 PolarHBondContact O-N 3.23Å; Y217-I257 VanDerWaalsContact CD2-O 3.29Å; Y217-I257 WeakPolarHBondContact CD2-O 3.32Å; I255-I257 HydrophobicContact CG2-CD1 3.91Å; I257-E276 HydrophobicContact CD1-CB 4.02Å; I257-E276 HydrophobicContact CD1-CG 4.42Å; I257-I278 HydrophobicContact CD1-CD1 3.92Å; I257-I278 HydrophobicContact CG2-CB 4.32Å; I257-I278 HydrophobicContact CG2-CD1 4.07Å; I257-I278 HydrophobicContact CG2-CG1 4.28Å; I257-K284 HydrophobicContact CG2-CB 4.25Å; I257-K284 HydrophobicContact CG2-CD 4.46Å; I257-K284 HydrophobicContact CG2-CG 3.84Å; I257-I287 HydrophobicContact CD1-CG2 4.01Å; I257-I287 HydrophobicContact CG1-CG2 4.4Å; I257-L288 HydrophobicContact CB-CD2 4.24Å; I257-L288 HydrophobicContact CG1-CD2 3.72Å; I257-L288 HydrophobicContact CG1-CG 4.12Å
258	T	83.5	Confident	73	Confident	4 Å²	4	57.4 Å²	57.4	3%	0.025	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.4	163.8	-172.6	64.8	0	0	0	0	111.5	Y263 T264 L268 V275 E276 I278	T258-Y263 HydrophobicContact CG2-CD1 3.59Å; T258-Y263 HydrophobicContact CG2-CG 4.17Å; T258-T264 HydrophobicContact CG2-CG2 3.96Å; T258-L268 HydrophobicContact CG2-CD1 4.4Å; T258-V275 HydrophobicContact CG2-CG1 3.82Å; T258-E276 PolarHBondContact N-O 3.27Å; T258-E276 PolarHBondContact OG1-O 3.1Å; T258-E276 VanDerWaalsContact OG1-O 3.05Å; T258-I278 PolarHBondContact O-N 2.99Å
259	D	75.2	Confident	71.8	Confident	49 Å²	49	57.4 Å²	57.4	26%	0.262	34%	0.344	S	S	.	.			trans	-82.4	157.6	154.9	58.8	43.8	0	0	0	110.1	M261 T262	D259-M261 PolarHBondContact O-N 3.45Å; D259-M261 PolarHBondContact OD1-N 3.38Å; D259-T262 PolarHBondContact OD1-OG1 3.42Å
260	A	61.3	Low	71.1	Confident	82 Å²	82	57.2 Å²	57.2	68%	0.678	32%	0.321	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.7	-5.8	-173.4	0	0	0	0	0	115.4	S277	A260-S277 WeakPolarHBondContact CA-OG 3.43Å; A260-S277 VanDerWaalsContact CB-OG 3.27Å; A260-S277 WeakPolarHBondContact CB-OG 3.43Å; A260-S277 PolarHBondContact N-OG 2.99Å
261	M	52.6	Low	69.9	Low	166 Å²	166	57.3 Å²	57.3	82%	0.818	33%	0.327	S	S	*	.	T	Hydrogen-bonded Turn	trans	-123.9	-8	-153.6	-77.5	-91.5	-71	0	0	116.5	D259	D259-M261 PolarHBondContact O-N 3.45Å; D259-M261 PolarHBondContact OD1-N 3.38Å
262	T	52.1	Low	69.2	Low	82 Å²	82	60.4 Å²	60.4	50%	0.503	34%	0.339	S	S	.	.	T	Hydrogen-bonded Turn	trans	-142.4	-26.2	-175.2	53.7	0	0	0	0	118.2	D259	D259-T262 PolarHBondContact OD1-OG1 3.42Å
263	Y	56.3	Low	69	Low	15 Å²	15	60.3 Å²	60.3	6%	0.059	34%	0.338	C	S	.	.	S	Bend	trans	-101.5	-23.9	-156.2	-163.5	-110.4	0	0	0	116.8	M218 W220 E232 T258 S265 L268	M218-Y263 HydrophobicContact CB-CE2 4.17Å; M218-Y263 WeakPolarHBondContact O-CE2 3.48Å; W220-Y263 AromaticContact CD1-CD2 3.8Å; W220-Y263 AromaticContact NE1-CE2 3.91Å; E232-Y263 WeakPolarHBondContact OE1-CE2 3.49Å; E232-Y263 PolarHBondContact OE1-OH 2.97Å; T258-Y263 HydrophobicContact CG2-CD1 3.59Å; T258-Y263 HydrophobicContact CG2-CG 4.17Å; Y263-S265 PolarHBondContact O-N 3.32Å; Y263-L268 HydrophobicContact CD1-CD1 3.63Å; Y263-L268 HydrophobicContact CD1-CG 3.96Å; Y263-L268 HydrophobicContact CE1-CD1 3.58Å; Y263-L268 HydrophobicContact CE1-CD2 3.75Å; Y263-L268 HydrophobicContact CE1-CG 3.59Å
264	T	51.6	Low	68.7	Low	75 Å²	75	58.9 Å²	58.9	46%	0.46	34%	0.339	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.3	-21.9	-150.2	54.8	0	0	0	0	117.1	T258 V275	T258-T264 HydrophobicContact CG2-CG2 3.96Å; T264-V275 HydrophobicContact CG2-CG1 3.44Å; T264-V275 VanDerWaalsContact CG2-CG1 3.44Å
265	S	48.3	Very low	68.4	Low	81 Å²	81	60.9 Å²	60.9	57%	0.566	35%	0.351	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.5	-34.1	-168.7	56.6	0	0	0	0	115.8	Y263	Y263-S265 PolarHBondContact O-N 3.32Å
266	H	53.3	Low	68.1	Low	160 Å²	160	61.2 Å²	61.2	74%	0.741	35%	0.353	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.5	-34.5	-166.3	-65.4	-43.2	0	0	0	114.9
267	N	56.7	Low	67.8	Low	16 Å²	16	64.6 Å²	64.6	9%	0.086	38%	0.377	C	S	.	.	S	Bend	trans	-108.8	-18.1	-170.9	-73.3	-12.7	0	0	0	114.9	V229 E232 F270	V229-N267 WeakPolarHBondContact CG1-OD1 3.23Å; E232-N267 PolarHBondContact OE2-ND2 3.38Å; N267-F270 WeakPolarHBondContact O-CD2 3.13Å; N267-F270 WeakPolarHBondContact O-CE2 3.49Å
268	L	62.1	Low	67.7	Low	7 Å²	7	65.3 Å²	65.3	4%	0.037	38%	0.38	C	S	.	.			trans	-97.1	9.8	-178.4	-65	-172.9	0	0	0	113.8	L236 T258 Y263 F270 I273 V275	L236-L268 HydrophobicContact CD2-CD2 3.53Å; T258-L268 HydrophobicContact CG2-CD1 4.4Å; Y263-L268 HydrophobicContact CD1-CD1 3.63Å; Y263-L268 HydrophobicContact CD1-CG 3.96Å; Y263-L268 HydrophobicContact CE1-CD1 3.58Å; Y263-L268 HydrophobicContact CE1-CD2 3.75Å; Y263-L268 HydrophobicContact CE1-CG 3.59Å; L268-F270 PolarHBondContact O-N 2.96Å; L268-I273 HydrophobicContact CD2-CD1 3.9Å; L268-I273 HydrophobicContact CD2-CG2 4.32Å; L268-V275 HydrophobicContact CB-CG2 3.9Å; L268-V275 HydrophobicContact CD1-CB 4.26Å; L268-V275 HydrophobicContact CD1-CG1 3.75Å; L268-V275 HydrophobicContact CD1-CG2 3.45Å; L268-V275 VanDerWaalsContact CD1-CG2 3.45Å; L268-V275 HydrophobicContact CG-CG2 4.34Å
269	N	61.5	Low	67.7	Low	151 Å²	151	69.7 Å²	69.7	81%	0.807	42%	0.417	S	S	*	.			trans	-75	31.8	174.3	-157.7	15.5	0	0	0	112.8
270	F	63.9	Low	68.1	Low	72 Å²	72	69.4 Å²	69.4	32%	0.316	42%	0.419	S	S	.	.	S	Bend	trans	-79.1	137.9	165.9	-68.1	-83.3	0	0	0	108.3	L236 I240 N267 L268 N272 I273	L236-F270 HydrophobicContact CB-CE2 4.35Å; L236-F270 HydrophobicContact CD2-CD2 4.01Å; L236-F270 HydrophobicContact CD2-CE2 3.74Å; L236-F270 HydrophobicContact CG-CD2 4.4Å; L236-F270 HydrophobicContact CG-CE2 3.99Å; I240-F270 HydrophobicContact CD1-CB 4.48Å; I240-F270 HydrophobicContact CD1-CD2 4.29Å; I240-F270 HydrophobicContact CD1-CG 4.24Å; N267-F270 WeakPolarHBondContact O-CD2 3.13Å; N267-F270 WeakPolarHBondContact O-CE2 3.49Å; L268-F270 PolarHBondContact O-N 2.96Å; F270-N272 PolarHBondContact O-N 2.8Å; F270-I273 HydrophobicContact CB-CD1 3.66Å; F270-I273 HydrophobicContact CB-CG1 4.06Å; F270-I273 HydrophobicContact CD2-CD1 3.87Å; F270-I273 HydrophobicContact CG-CD1 4.16Å; F270-I273 PolarHBondContact O-N 3.42Å
271	A	61.6	Low	69.2	Low	75 Å²	75	66.6 Å²	66.6	62%	0.62	39%	0.393	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.3	127.1	171.3	0	0	0	0	0	109.8
272	N	74.7	Confident	70.8	Confident	126 Å²	126	59.7 Å²	59.7	67%	0.674	36%	0.361	S	S	*	.	T	Hydrogen-bonded Turn	trans	81.8	23.9	174.7	-46.3	-29.4	0	0	0	117.6	F270	F270-N272 PolarHBondContact O-N 2.8Å
273	I	85.3	Confident	72.4	Confident	23 Å²	23	57.2 Å²	57.2	12%	0.118	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.8	117.9	164	-53	179.2	0	0	0	109.5	I216 L236 I240 F254 L268 F270 V275	I216-I273 HydrophobicContact CD1-CD1 3.84Å; I216-I273 HydrophobicContact CD1-CG1 4.24Å; I216-I273 HydrophobicContact CD1-CG2 3.94Å; L236-I273 HydrophobicContact CD2-CD1 4.44Å; I240-I273 HydrophobicContact CD1-CD1 3.71Å; I240-I273 HydrophobicContact CD1-CG1 4.38Å; F254-I273 HydrophobicContact CB-CB 4.43Å; F254-I273 HydrophobicContact CB-CG1 3.93Å; F254-I273 HydrophobicContact CB-CG2 4.44Å; F254-I273 WeakPolarHBondContact O-CA 3.37Å; L268-I273 HydrophobicContact CD2-CD1 3.9Å; L268-I273 HydrophobicContact CD2-CG2 4.32Å; F270-I273 HydrophobicContact CB-CD1 3.66Å; F270-I273 HydrophobicContact CB-CG1 4.06Å; F270-I273 HydrophobicContact CD2-CD1 3.87Å; F270-I273 HydrophobicContact CG-CD1 4.16Å; F270-I273 PolarHBondContact O-N 3.42Å; I273-V275 HydrophobicContact CG2-CG2 4.13Å
274	S	85.9	Confident	74	Confident	43 Å²	43	57.3 Å²	57.3	30%	0.301	35%	0.347	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.3	138	165.3	61.4	0	0	0	0	109.3	F254 I255 G256	F254-S274 PolarHBondContact O-N 2.89Å; F254-S274 PolarHBondContact O-OG 2.83Å; I255-S274 CarbonylContact C-O 3.56Å; I255-S274 WeakPolarHBondContact CA-O 3.13Å; G256-S274 PolarHBondContact N-O 2.93Å
275	V	84	Confident	75.8	Confident	48 Å²	48	53.8 Å²	53.8	29%	0.291	33%	0.325	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	129.8	-175.9	-170.4	0	0	0	0	110.3	G256 T258 T264 L268 I273	G256-V275 CarbonylContact O-C 3.47Å; G256-V275 WeakPolarHBondContact O-CA 3.36Å; T258-V275 HydrophobicContact CG2-CG1 3.82Å; T264-V275 HydrophobicContact CG2-CG1 3.44Å; T264-V275 VanDerWaalsContact CG2-CG1 3.44Å; L268-V275 HydrophobicContact CB-CG2 3.9Å; L268-V275 HydrophobicContact CD1-CB 4.26Å; L268-V275 HydrophobicContact CD1-CG1 3.75Å; L268-V275 HydrophobicContact CD1-CG2 3.45Å; L268-V275 VanDerWaalsContact CD1-CG2 3.45Å; L268-V275 HydrophobicContact CG-CG2 4.34Å; I273-V275 HydrophobicContact CG2-CG2 4.13Å
276	E	82.8	Confident	77.7	Confident	8 Å²	8	50 Å²	50	4%	0.037	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	131	179.2	-53.9	-139.4	134.9	0	0	111.1	P195 N197 L200 G256 I257 T258 I278	P195-E276 VanDerWaalsContact CA-OE2 3.28Å; P195-E276 WeakPolarHBondContact CA-OE2 3.27Å; P195-E276 WeakPolarHBondContact CB-OE1 3.35Å; P195-E276 WeakPolarHBondContact CB-OE2 3.43Å; P195-E276 WeakPolarHBondContact CG-OE2 3.29Å; N197-E276 WeakPolarHBondContact CB-OE1 3.36Å; N197-E276 PolarHBondContact ND2-OE1 3.48Å; L200-E276 HydrophobicContact CD1-CG 4.28Å; G256-E276 PolarHBondContact O-N 3.39Å; I257-E276 HydrophobicContact CD1-CB 4.02Å; I257-E276 HydrophobicContact CD1-CG 4.42Å; T258-E276 PolarHBondContact N-O 3.27Å; T258-E276 PolarHBondContact OG1-O 3.1Å; T258-E276 VanDerWaalsContact OG1-O 3.05Å; E276-I278 HydrophobicContact CB-CD1 4.41Å; E276-I278 HydrophobicContact CB-CG1 4.2Å
277	S	84.1	Confident	79.4	Confident	72 Å²	72	42.6 Å²	42.6	50%	0.503	26%	0.264	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.2	118.3	168.2	176.6	0	0	0	0	109.5	A260	A260-S277 WeakPolarHBondContact CA-OG 3.43Å; A260-S277 VanDerWaalsContact CB-OG 3.27Å; A260-S277 WeakPolarHBondContact CB-OG 3.43Å; A260-S277 PolarHBondContact N-OG 2.99Å
278	I	85.5	Confident	81.1	Confident	16 Å²	16	41.8 Å²	41.8	8%	0.082	26%	0.26	C	S	.	.			trans	-126.1	122.1	-178.9	-57	-170	0	0	0	107.7	I257 T258 E276 V283 K284 I287	I257-I278 HydrophobicContact CD1-CD1 3.92Å; I257-I278 HydrophobicContact CG2-CB 4.32Å; I257-I278 HydrophobicContact CG2-CD1 4.07Å; I257-I278 HydrophobicContact CG2-CG1 4.28Å; T258-I278 PolarHBondContact O-N 2.99Å; E276-I278 HydrophobicContact CB-CD1 4.41Å; E276-I278 HydrophobicContact CB-CG1 4.2Å; I278-V283 HydrophobicContact CD1-CG1 4.33Å; I278-V283 HydrophobicContact CG2-CB 3.86Å; I278-V283 HydrophobicContact CG2-CG1 3.61Å; I278-K284 HydrophobicContact CB-CG 3.91Å; I278-K284 HydrophobicContact CG2-CG 3.73Å; I278-K284 WeakPolarHBondContact O-CE 3.35Å; I278-K284 PolarHBondContact O-NZ 3.2Å; I278-I287 HydrophobicContact CD1-CD1 3.26Å
279	A	82.2	Confident	82.4	Confident	97 Å²	97	43 Å²	43	80%	0.802	27%	0.269	S	S	*	.			trans	-79.2	-43	179.3	0	0	0	0	0	112.2	T281	A279-T281 PolarHBondContact O-N 3.33Å
280	S	84.8	Confident	83.6	Confident	43 Å²	43	40.8 Å²	40.8	30%	0.301	25%	0.249	S	C	.	.			trans	-76	125.6	-171.8	171.2	0	0	0	0	113.1	S282 V283 K284	S280-S282 PolarHBondContact O-N 2.9Å; S280-S282 PolarHBondContact OG-N 2.84Å; S280-S282 PolarHBondContact OG-OG 3.44Å; S280-S282 VanDerWaalsContact OG-OG 3.05Å; S280-V283 PolarHBondContact O-N 3.14Å; S280-V283 PolarHBondContact OG-N 3.39Å; S280-K284 WeakPolarHBondContact O-CG 3.46Å; S280-K284 PolarHBondContact O-N 3.49Å
281	T	84.6	Confident	84.9	Confident	23 Å²	23	37.9 Å²	37.9	14%	0.141	24%	0.237	C	C	.	.	H	α-helix	trans	-59	-42.9	175.9	-63.4	0	0	0	0	113	W116 A279 V283 K284 L285 L301	W116-T281 HydrophobicContact CH2-CG2 3.95Å; W116-T281 HydrophobicContact CZ2-CG2 3.78Å; A279-T281 PolarHBondContact O-N 3.33Å; T281-V283 VanDerWaalsContact C-N 3.29Å; T281-V283 PolarHBondContact O-N 2.95Å; T281-K284 PolarHBondContact O-N 3.33Å; T281-L285 HydrophobicContact CG2-CD1 4.04Å; T281-L285 WeakPolarHBondContact O-CG 3.41Å; T281-L285 PolarHBondContact O-N 3.13Å; T281-L301 HydrophobicContact CG2-CD1 3.57Å; T281-L301 HydrophobicContact CG2-CD2 3.7Å; T281-L301 HydrophobicContact CG2-CG 4.28Å
282	S	85.5	Confident	86.4	Confident	21 Å²	21	37.6 Å²	37.6	15%	0.147	23%	0.23	C	C	.	.	H	α-helix	trans	-65.8	-35.5	179.3	52.7	0	0	0	0	111.6	S280 C286	S280-S282 PolarHBondContact O-N 2.9Å; S280-S282 PolarHBondContact OG-N 2.84Å; S280-S282 PolarHBondContact OG-OG 3.44Å; S280-S282 VanDerWaalsContact OG-OG 3.05Å; S282-C286 VanDerWaalsContact O-CB 3.25Å; S282-C286 WeakPolarHBondContact O-CB 3.17Å; S282-C286 PolarHBondContact O-N 2.97Å
283	V	86.4	Confident	87.4	Confident	29 Å²	29	31.6 Å²	31.6	18%	0.176	20%	0.198	C	C	.	.	H	α-helix	trans	-69.8	-45.7	176.3	176.4	0	0	0	0	111	H192 I278 S280 T281 L285 C286 I287	H192-V283 HydrophobicContact CB-CG2 4.12Å; H192-V283 VanDerWaalsContact O-CG1 3.26Å; H192-V283 WeakPolarHBondContact O-CG1 3.47Å; I278-V283 HydrophobicContact CD1-CG1 4.33Å; I278-V283 HydrophobicContact CG2-CB 3.86Å; I278-V283 HydrophobicContact CG2-CG1 3.61Å; S280-V283 PolarHBondContact O-N 3.14Å; S280-V283 PolarHBondContact OG-N 3.39Å; T281-V283 VanDerWaalsContact C-N 3.29Å; T281-V283 PolarHBondContact O-N 2.95Å; V283-L285 PolarHBondContact O-N 2.88Å; V283-C286 PolarHBondContact O-N 2.93Å; V283-I287 HydrophobicContact CG1-CD1 3.71Å; V283-I287 WeakPolarHBondContact O-CG1 3.47Å; V283-I287 PolarHBondContact O-N 3.18Å
284	K	88.4	Confident	87.9	Confident	17 Å²	17	30.5 Å²	30.5	7%	0.074	19%	0.192	C	C	.	.	H	α-helix	trans	-53.1	-55	174.3	-70.4	179.9	-173.6	179.3	0	110.9	Y217 I257 I278 S280 T281 C286 I287 L288	Y217-K284 HydrophobicContact CE2-CD 4.18Å; I257-K284 HydrophobicContact CG2-CB 4.25Å; I257-K284 HydrophobicContact CG2-CD 4.46Å; I257-K284 HydrophobicContact CG2-CG 3.84Å; I278-K284 HydrophobicContact CB-CG 3.91Å; I278-K284 HydrophobicContact CG2-CG 3.73Å; I278-K284 WeakPolarHBondContact O-CE 3.35Å; I278-K284 PolarHBondContact O-NZ 3.2Å; S280-K284 WeakPolarHBondContact O-CG 3.46Å; S280-K284 PolarHBondContact O-N 3.49Å; T281-K284 PolarHBondContact O-N 3.33Å; K284-C286 VanDerWaalsContact C-N 3.29Å; K284-C286 PolarHBondContact O-N 3.12Å; K284-I287 PolarHBondContact O-N 3.46Å; K284-L288 WeakPolarHBondContact O-CB 3.5Å; K284-L288 WeakPolarHBondContact O-CD1 3.41Å; K284-L288 VanDerWaalsContact O-CG 3.23Å; K284-L288 WeakPolarHBondContact O-CG 3.41Å; K284-L288 PolarHBondContact O-N 3.44Å
285	L	90	Very high	88.4	Confident	2 Å²	2	28.4 Å²	28.4	1%	0.01	18%	0.178	C	C	.	.	H	α-helix	trans	-63.5	-36.5	-178.9	-70.9	174.8	0	0	0	111.8	F121 T281 V283 S289 L301 W304 A305	F121-L285 HydrophobicContact CE1-CD1 3.73Å; F121-L285 HydrophobicContact CZ-CD1 3.54Å; T281-L285 HydrophobicContact CG2-CD1 4.04Å; T281-L285 WeakPolarHBondContact O-CG 3.41Å; T281-L285 PolarHBondContact O-N 3.13Å; V283-L285 PolarHBondContact O-N 2.88Å; L285-S289 WeakPolarHBondContact O-CB 3.41Å; L285-S289 PolarHBondContact O-N 2.98Å; L285-S289 PolarHBondContact O-OG 3.22Å; L285-S289 VanDerWaalsContact O-OG 3.1Å; L285-L301 HydrophobicContact CD1-CD2 4.3Å; L285-W304 HydrophobicContact CD2-CB 4.15Å; L285-A305 HydrophobicContact CD2-CB 3.81Å
286	C	88.6	Confident	88.7	Confident	0 Å²	0	26.1 Å²	26.1	0%	0	16%	0.164	C	C	.	.	H	α-helix	trans	-64.3	-43.2	177.5	-159.7	0	0	0	0	113.4	P186 L189 C193 S282 V283 K284 S289 R290	P186-C286 HydrophobicContact CB-CB 4.11Å; P186-C286 HydrophobicContact CG-CB 3.62Å; L189-C286 VanDerWaalsContact CD2-SG 3.52Å; C193-C286 HydrophobicContact CB-CB 3.75Å; C193-C286 WeakPolarHBondContact CB-SG 3.41Å; C193-C286 WeakPolarHBondContact SG-CB 3.48Å; C193-C286 CovalentContact SG-SG 2Å; C193-C286 PolarHBondContact SG-SG 3.39Å; S282-C286 VanDerWaalsContact O-CB 3.25Å; S282-C286 WeakPolarHBondContact O-CB 3.17Å; S282-C286 PolarHBondContact O-N 2.97Å; V283-C286 PolarHBondContact O-N 2.93Å; K284-C286 VanDerWaalsContact C-N 3.29Å; K284-C286 PolarHBondContact O-N 3.12Å; C286-S289 PolarHBondContact O-OG 2.96Å; C286-R290 WeakPolarHBondContact O-CG 3.15Å
287	I	89.2	Confident	88.8	Confident	5 Å²	5	26.1 Å²	26.1	3%	0.026	17%	0.165	C	C	.	.	H	α-helix	trans	-67.5	-49.1	179.3	-72.3	163.9	0	0	0	109.1	C193 P195 I257 I278 V283 K284 S289 R290 M291	C193-I287 WeakPolarHBondContact O-CG1 3.26Å; P195-I287 HydrophobicContact CG-CD1 4.39Å; I257-I287 HydrophobicContact CD1-CG2 4.01Å; I257-I287 HydrophobicContact CG1-CG2 4.4Å; I278-I287 HydrophobicContact CD1-CD1 3.26Å; V283-I287 HydrophobicContact CG1-CD1 3.71Å; V283-I287 WeakPolarHBondContact O-CG1 3.47Å; V283-I287 PolarHBondContact O-N 3.18Å; K284-I287 PolarHBondContact O-N 3.46Å; I287-S289 VanDerWaalsContact C-N 3.32Å; I287-S289 PolarHBondContact O-N 3.36Å; I287-R290 PolarHBondContact O-N 2.93Å; I287-R290 VanDerWaalsContact O-N 3.14Å; I287-M291 HydrophobicContact CG2-CE 3.52Å
288	L	91.9	Very high	88.6	Confident	0 Å²	0	22.7 Å²	22.7	0%	0	14%	0.141	C	C	.	.	H	α-helix	trans	-64.9	-34.4	-179.2	-65.6	166.1	0	0	0	112.4	Y217 I257 K284 R290 M291 L294 A305 S309	Y217-L288 HydrophobicContact CD1-CD1 3.4Å; Y217-L288 HydrophobicContact CD2-CD1 4.45Å; Y217-L288 HydrophobicContact CE1-CD1 4.12Å; Y217-L288 HydrophobicContact CG-CD1 3.61Å; I257-L288 HydrophobicContact CB-CD2 4.24Å; I257-L288 HydrophobicContact CG1-CD2 3.72Å; I257-L288 HydrophobicContact CG1-CG 4.12Å; K284-L288 WeakPolarHBondContact O-CB 3.5Å; K284-L288 WeakPolarHBondContact O-CD1 3.41Å; K284-L288 VanDerWaalsContact O-CG 3.23Å; K284-L288 WeakPolarHBondContact O-CG 3.41Å; K284-L288 PolarHBondContact O-N 3.44Å; L288-R290 PolarHBondContact O-N 3.2Å; L288-R290 VanDerWaalsContact O-N 3.12Å; L288-M291 WeakPolarHBondContact O-CB 3.27Å; L288-M291 WeakPolarHBondContact O-CG 3.42Å; L288-M291 PolarHBondContact O-N 3.14Å; L288-L294 HydrophobicContact CB-CD1 4.14Å; L288-L294 HydrophobicContact CB-CD2 4.18Å; L288-L294 HydrophobicContact CD2-CD2 3.62Å; L288-A305 HydrophobicContact CB-CB 3.83Å; L288-A305 HydrophobicContact CD1-CB 3.61Å; L288-A305 HydrophobicContact CG-CB 4.33Å; L288-S309 VanDerWaalsContact O-CB 3.29Å; L288-S309 WeakPolarHBondContact O-CB 3.25Å
289	S	89.4	Confident	88.4	Confident	31 Å²	31	25 Å²	25	22%	0.217	15%	0.151	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68	-8.6	177.5	69.4	0	0	0	0	114	L285 C286 I287	L285-S289 WeakPolarHBondContact O-CB 3.41Å; L285-S289 PolarHBondContact O-N 2.98Å; L285-S289 PolarHBondContact O-OG 3.22Å; L285-S289 VanDerWaalsContact O-OG 3.1Å; C286-S289 PolarHBondContact O-OG 2.96Å; I287-S289 VanDerWaalsContact C-N 3.32Å; I287-S289 PolarHBondContact O-N 3.36Å
290	R	88	Confident	88.5	Confident	106 Å²	106	20.9 Å²	20.9	40%	0.4	12%	0.118	S	C	.	.	T	Hydrogen-bonded Turn	trans	-104.1	3.1	178.2	-68.1	177	171.2	-175.7	0.1	113.1	L189 C286 I287 L288	L189-R290 PolarHBondContact O-NH2 3.41Å; L189-R290 VanDerWaalsContact O-NH2 3.15Å; C286-R290 WeakPolarHBondContact O-CG 3.15Å; I287-R290 PolarHBondContact O-N 2.93Å; I287-R290 VanDerWaalsContact O-N 3.14Å; L288-R290 PolarHBondContact O-N 3.2Å; L288-R290 VanDerWaalsContact O-N 3.12Å
291	M	91.1	Very high	88.8	Confident	10 Å²	10	20 Å²	20	5%	0.049	11%	0.11	C	C	.	.	S	Bend	trans	-83.8	146.3	179	-57.9	-61.9	178.5	0	0	110.7	R213 I255 I287 L288 G293 L294	R213-M291 HydrophobicContact CB-SD 3.69Å; I255-M291 HydrophobicContact CB-CE 4.26Å; I255-M291 HydrophobicContact CD1-CE 3.71Å; I255-M291 HydrophobicContact CD1-SD 4.11Å; I255-M291 HydrophobicContact CG2-CE 4.4Å; I287-M291 HydrophobicContact CG2-CE 3.52Å; L288-M291 WeakPolarHBondContact O-CB 3.27Å; L288-M291 WeakPolarHBondContact O-CG 3.42Å; L288-M291 PolarHBondContact O-N 3.14Å; M291-G293 WeakPolarHBondContact CB-O 3.49Å; M291-G293 PolarHBondContact O-N 3.34Å; M291-L294 HydrophobicContact CB-CD2 3.73Å; M291-L294 HydrophobicContact CB-CG 4.39Å; M291-L294 HydrophobicContact CG-CD2 3.85Å
292	S	92.6	Very high	89.1	Confident	69 Å²	69	18.9 Å²	18.9	48%	0.483	10%	0.104	S	C	.	.	S	Bend	trans	-75.3	-17.5	177.7	-55.9	0	0	0	0	112.7	V212 R213 G311 R312	V212-S292 VanDerWaalsContact CG1-CB 3.49Å; R213-S292 PolarHBondContact O-N 2.87Å; S292-G311 WeakPolarHBondContact O-CA 3.05Å; S292-R312 PolarHBondContact O-N 3.07Å; S292-R312 VanDerWaalsContact O-N 3.12Å
293	G	95.4	Very high	89.4	Confident	0 Å²	0	17.9 Å²	17.9	0%	0	10%	0.097	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-160	161.3	170.9	0	0	0	0	0	111.3	I214 G215 M291 R312	I214-G293 WeakPolarHBondContact CA-O 3.29Å; G215-G293 PolarHBondContact N-O 3.06Å; M291-G293 WeakPolarHBondContact CB-O 3.49Å; M291-G293 PolarHBondContact O-N 3.34Å; G293-R312 CarbonylContact C-O 3.55Å; G293-R312 WeakPolarHBondContact CA-O 3.45Å
294	L	96.4	Very high	89.8	Confident	0 Å²	0	16.6 Å²	16.6	0%	0	9%	0.088	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.9	139.1	179.1	-66.2	-179.8	0	0	0	111.9	G215 L288 M291 I296 A305 S309 R312 I313 L314	G215-L294 VanDerWaalsContact CA-CD2 3.45Å; G215-L294 CarbonylContact O-C 3.55Å; G215-L294 VanDerWaalsContact O-CA 3.27Å; G215-L294 WeakPolarHBondContact O-CA 3.46Å; L288-L294 HydrophobicContact CB-CD1 4.14Å; L288-L294 HydrophobicContact CB-CD2 4.18Å; L288-L294 HydrophobicContact CD2-CD2 3.62Å; M291-L294 HydrophobicContact CB-CD2 3.73Å; M291-L294 HydrophobicContact CB-CG 4.39Å; M291-L294 HydrophobicContact CG-CD2 3.85Å; L294-I296 HydrophobicContact CB-CG2 3.9Å; L294-A305 VanDerWaalsContact CD1-C 3.44Å; L294-A305 HydrophobicContact CD1-CB 3.98Å; L294-A305 WeakPolarHBondContact CD1-O 3.41Å; L294-S309 WeakPolarHBondContact CD1-OG 3.5Å; L294-R312 PolarHBondContact N-O 3.14Å; L294-I313 HydrophobicContact CB-CD1 3.98Å; L294-I313 HydrophobicContact CG-CD1 4.4Å; L294-I313 WeakPolarHBondContact O-CA 3.36Å; L294-L314 PolarHBondContact O-N 3.4Å
295	I	94.7	Very high	90	Very high	0 Å²	0	15.8 Å²	15.8	0%	0	9%	0.085	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	118.2	164.4	-56.1	174.7	0	0	0	106.4	I214 G215 I216 Y217 M218 F235 L236 A239 I240 F243 F254 L314	I214-I295 HydrophobicContact CG2-CD1 4.42Å; I214-I295 HydrophobicContact CG2-CG1 4.27Å; G215-I295 PolarHBondContact O-N 3.49Å; I216-I295 WeakPolarHBondContact CA-O 3.37Å; I216-I295 HydrophobicContact CG1-CB 4.1Å; I216-I295 HydrophobicContact CG1-CD1 4Å; I216-I295 HydrophobicContact CG1-CG1 4.38Å; Y217-I295 PolarHBondContact N-O 3.17Å; M218-I295 HydrophobicContact SD-CG2 4.21Å; F235-I295 HydrophobicContact CE1-CG2 3.53Å; F235-I295 HydrophobicContact CZ-CG2 3.68Å; L236-I295 HydrophobicContact CD1-CD1 4.05Å; L236-I295 HydrophobicContact CD1-CG2 4.02Å; A239-I295 HydrophobicContact CB-CD1 3.69Å; A239-I295 HydrophobicContact CB-CG1 3.96Å; A239-I295 HydrophobicContact CB-CG2 3.84Å; I240-I295 HydrophobicContact CG1-CD1 4.01Å; F243-I295 HydrophobicContact CD2-CD1 4.06Å; F243-I295 HydrophobicContact CD2-CG1 3.98Å; F243-I295 HydrophobicContact CE2-CD1 4.24Å; F243-I295 HydrophobicContact CE2-CG1 3.64Å; F254-I295 HydrophobicContact CD1-CD1 4.41Å; F254-I295 HydrophobicContact CE1-CD1 4.34Å; I295-L314 HydrophobicContact CG1-CD1 4.44Å
296	I	92.4	Very high	90.2	Very high	0 Å²	0	15.8 Å²	15.8	0%	0	9%	0.085	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	158	-172.2	63.3	163.9	0	0	0	112.1	Y217 L294 G298 A306 I313 L314 P316 W336	Y217-I296 WeakPolarHBondContact O-CA 3.4Å; L294-I296 HydrophobicContact CB-CG2 3.9Å; I296-G298 PolarHBondContact O-N 3.2Å; I296-A306 HydrophobicContact CD1-CB 3.73Å; I296-A306 HydrophobicContact CG2-CB 4.24Å; I296-I313 HydrophobicContact CD1-CG2 3.84Å; I296-I313 HydrophobicContact CG1-CG2 4.01Å; I296-L314 WeakPolarHBondContact CG1-O 2.95Å; I296-L314 PolarHBondContact N-O 3.47Å; I296-P316 VanDerWaalsContact O-CD 3.23Å; I296-P316 WeakPolarHBondContact O-CD 3.33Å; I296-W336 HydrophobicContact CD1-CE3 4.3Å; I296-W336 HydrophobicContact CD1-CZ3 3.95Å
297	S	83.5	Confident	90.6	Very high	8 Å²	8	16 Å²	16	6%	0.056	9%	0.086	C	C	.	.			trans	-78.2	3	165.6	62.2	0	0	0	0	113	Y217 E299 S302 F319	Y217-S297 PolarHBondContact O-N 3.19Å; S297-E299 PolarHBondContact O-N 3.48Å; S297-S302 PolarHBondContact OG-OG 2.83Å; S297-F319 VanDerWaalsContact C-CE2 3.43Å; S297-F319 WeakPolarHBondContact O-CD2 3.31Å; S297-F319 WeakPolarHBondContact O-CE2 3.27Å; S297-F319 VanDerWaalsContact O-CZ 3.32Å; S297-F319 WeakPolarHBondContact O-CZ 3.11Å
298	G	81.1	Confident	90.8	Very high	0 Å²	0	16.7 Å²	16.7	0%	0	9%	0.09	C	C	.	.	S	Bend	trans	73.5	-14.6	177.4	0	0	0	0	0	115.4	I296 S302 Y331 F332	I296-G298 PolarHBondContact O-N 3.2Å; G298-S302 PolarHBondContact N-OG 2.97Å; G298-Y331 VanDerWaalsContact O-CE1 3.26Å; G298-Y331 WeakPolarHBondContact O-CE1 3Å; G298-Y331 PolarHBondContact O-OH 3.01Å; G298-F332 WeakPolarHBondContact O-CE1 3.39Å
299	E	79.9	Confident	90.7	Very high	63 Å²	63	17.2 Å²	17.2	29%	0.294	9%	0.094	S	C	.	.	S	Bend	trans	-113.6	158.9	-175.7	-62.9	-163.1	161.8	0	0	114.4	R221 S297 L301 S302	R221-E299 IonicContact CZ-OE2 3.2Å; R221-E299 IonicContact NE-OE2 3.67Å; R221-E299 IonicContact NH1-OE2 3.57Å; R221-E299 PolarHBondContact NH1-OE2 3.5Å; R221-E299 IonicContact NH2-OE2 3.65Å; R221-E299 PolarHBondContact NH2-OE2 2.95Å; S297-E299 PolarHBondContact O-N 3.48Å; E299-L301 PolarHBondContact O-N 3.23Å; E299-S302 PolarHBondContact N-OG 3.45Å; E299-S302 VanDerWaalsContact N-OG 3.16Å; E299-S302 WeakPolarHBondContact O-CB 3.47Å; E299-S302 PolarHBondContact O-N 3.49Å; E299-S302 VanDerWaalsContact O-N 3.11Å; E299-S302 PolarHBondContact O-OG 3.32Å
300	G	85.7	Confident	90.5	Very high	11 Å²	11	21 Å²	21	11%	0.113	11%	0.112	C	C	.	.	T	Hydrogen-bonded Turn	trans	61.1	-132.2	169.3	0	0	0	0	0	112.4	A86 S302 W303	A86-G300 WeakPolarHBondContact CB-O 2.78Å; G300-S302 PolarHBondContact O-N 3.49Å; G300-W303 PolarHBondContact O-N 3.38Å
301	L	89.6	Confident	90.7	Very high	25 Å²	25	17.2 Å²	17.2	13%	0.131	11%	0.105	C	C	.	.	H	α-helix	trans	-69.8	-18.5	179.8	-70.5	171.3	0	0	0	112.9	P85 A86 I89 Y217 T281 L285 E299 W304 A305	P85-L301 HydrophobicContact CB-CD2 4.21Å; A86-L301 HydrophobicContact CB-CD2 4.46Å; I89-L301 HydrophobicContact CD1-CD2 4.08Å; Y217-L301 HydrophobicContact CE1-CB 3.87Å; T281-L301 HydrophobicContact CG2-CD1 3.57Å; T281-L301 HydrophobicContact CG2-CD2 3.7Å; T281-L301 HydrophobicContact CG2-CG 4.28Å; L285-L301 HydrophobicContact CD1-CD2 4.3Å; E299-L301 PolarHBondContact O-N 3.23Å; L301-W304 PolarHBondContact O-N 2.93Å; L301-A305 PolarHBondContact O-N 3.05Å
302	S	90.6	Very high	91	Very high	0 Å²	0	20.3 Å²	20.3	0%	0	12%	0.116	C	C	.	.	H	α-helix	trans	-68.9	-36.7	176.9	79.4	0	0	0	0	111.7	Y217 S297 G298 E299 G300 W304 A305 A306	Y217-S302 WeakPolarHBondContact O-CB 3.22Å; S297-S302 PolarHBondContact OG-OG 2.83Å; G298-S302 PolarHBondContact N-OG 2.97Å; E299-S302 PolarHBondContact N-OG 3.45Å; E299-S302 VanDerWaalsContact N-OG 3.16Å; E299-S302 WeakPolarHBondContact O-CB 3.47Å; E299-S302 PolarHBondContact O-N 3.49Å; E299-S302 VanDerWaalsContact O-N 3.11Å; E299-S302 PolarHBondContact O-OG 3.32Å; G300-S302 PolarHBondContact O-N 3.49Å; S302-W304 VanDerWaalsContact C-N 3.35Å; S302-W304 PolarHBondContact O-N 3.49Å; S302-A305 WeakPolarHBondContact O-CB 2.69Å; S302-A305 PolarHBondContact O-N 2.85Å; S302-A306 PolarHBondContact O-N 2.72Å
303	W	93.3	Very high	91.2	Very high	0 Å²	0	17.1 Å²	17.1	0%	0	9%	0.094	C	C	.	.	H	α-helix	trans	-58.8	-46.4	172	-167.7	101	0	0	0	111.5	F90 F170 F173 G300 A305 A306 Y307 Y331 P333 W336	F90-W303 HydrophobicContact CE1-CD2 4.25Å; F90-W303 AromaticContact CE1-CE3 4Å; F90-W303 HydrophobicContact CE1-CE3 4Å; F90-W303 AromaticContact CE1-CH2 3.8Å; F90-W303 HydrophobicContact CE1-CH2 3.8Å; F90-W303 HydrophobicContact CE1-CZ2 4.02Å; F90-W303 AromaticContact CE1-CZ3 3.77Å; F90-W303 HydrophobicContact CE1-CZ3 3.77Å; F90-W303 HydrophobicContact CE2-CD2 4.12Å; F90-W303 AromaticContact CE2-CE3 4Å; F90-W303 HydrophobicContact CE2-CE3 4Å; F90-W303 HydrophobicContact CE2-CG 4.42Å; F90-W303 AromaticContact CZ-CD2 3.41Å; F90-W303 HydrophobicContact CZ-CD2 3.41Å; F90-W303 VanDerWaalsContact CZ-CD2 3.41Å; F90-W303 AromaticContact CZ-CE2 3.66Å; F90-W303 AromaticContact CZ-CE3 3.39Å; F90-W303 HydrophobicContact CZ-CE3 3.39Å; F90-W303 HydrophobicContact CZ-CG 4.01Å; F90-W303 AromaticContact CZ-CH2 3.96Å; F90-W303 HydrophobicContact CZ-CH2 3.96Å; F90-W303 AromaticContact CZ-CZ2 3.95Å; F90-W303 HydrophobicContact CZ-CZ2 3.95Å; F90-W303 AromaticContact CZ-CZ3 3.68Å; F90-W303 HydrophobicContact CZ-CZ3 3.68Å; F170-W303 HydrophobicContact CB-CH2 3.79Å; F170-W303 HydrophobicContact CB-CZ2 3.8Å; F173-W303 HydrophobicContact CE2-CH2 4.23Å; F173-W303 AromaticContact CZ-CH2 3.88Å; F173-W303 HydrophobicContact CZ-CH2 3.88Å; F173-W303 HydrophobicContact CZ-CZ3 4.2Å; G300-W303 PolarHBondContact O-N 3.38Å; W303-A305 PolarHBondContact O-N 2.98Å; W303-A306 WeakPolarHBondContact O-CB 3.45Å; W303-A306 PolarHBondContact O-N 2.79Å; W303-Y307 AromaticContact CH2-CD2 3.49Å; W303-Y307 HydrophobicContact CH2-CD2 3.49Å; W303-Y307 VanDerWaalsContact CH2-CD2 3.49Å; W303-Y307 HydrophobicContact CH2-CE2 4.15Å; W303-Y307 AromaticContact CH2-CG 3.94Å; W303-Y307 HydrophobicContact CH2-CG 3.94Å; W303-Y307 HydrophobicContact CZ2-CD2 4.35Å; W303-Y307 AromaticContact CZ3-CD2 3.8Å; W303-Y307 HydrophobicContact CZ3-CD2 3.8Å; W303-Y307 AromaticContact CZ3-CG 3.72Å; W303-Y307 HydrophobicContact CZ3-CG 3.72Å; W303-Y307 PolarHBondContact O-N 3.2Å; W303-Y331 AromaticContact CD1-CD1 3.98Å; W303-Y331 AromaticContact CD1-CE1 3.45Å; W303-Y331 VanDerWaalsContact CD1-CE1 3.45Å; W303-Y331 AromaticContact CD1-CZ 3.59Å; W303-Y331 HydrophobicContact CG-CE1 4.41Å; W303-Y331 WeakPolarHBondContact CZ2-O 3.05Å; W303-Y331 AromaticContact NE1-CE1 3.92Å; W303-Y331 PolarHBondContact NE1-O 3.33Å; W303-P333 HydrophobicContact CZ2-CG 4.45Å; W303-W336 AromaticContact CD1-CH2 3.91Å; W303-W336 AromaticContact CD1-CZ3 3.66Å; W303-W336 AromaticContact CD2-CH2 3.9Å; W303-W336 HydrophobicContact CD2-CH2 3.9Å; W303-W336 HydrophobicContact CD2-CZ3 4.43Å; W303-W336 AromaticContact CE2-CH2 3.65Å; W303-W336 HydrophobicContact CG-CH2 4.04Å; W303-W336 HydrophobicContact CG-CZ3 4.17Å; W303-W336 HydrophobicContact CZ2-CH2 4.14Å; W303-W336 AromaticContact NE1-CH2 3.68Å; W303-W336 AromaticContact NE1-CZ3 3.59Å
304	W	94.1	Very high	91.3	Very high	1 Å²	1	17.1 Å²	17.1	0%	0.004	9%	0.094	C	C	.	.	H	α-helix	trans	-67.9	-34.9	177.9	-77	105.3	0	0	0	113	A86 I89 F90 A93 F173 I180 L184 L285 L301 S302 A306 Y307 L308	A86-W304 PolarHBondContact O-NE1 3.48Å; I89-W304 HydrophobicContact CB-CD2 4.01Å; I89-W304 HydrophobicContact CB-CG 4.37Å; I89-W304 HydrophobicContact CB-CZ2 3.9Å; I89-W304 HydrophobicContact CD1-CD2 4.42Å; I89-W304 HydrophobicContact CD1-CG 4.03Å; I89-W304 HydrophobicContact CG2-CD2 3.41Å; I89-W304 VanDerWaalsContact CG2-CD2 3.41Å; I89-W304 HydrophobicContact CG2-CE3 3.62Å; I89-W304 HydrophobicContact CG2-CG 4.15Å; I89-W304 HydrophobicContact CG2-CH2 3.61Å; I89-W304 HydrophobicContact CG2-CZ2 3.41Å; I89-W304 VanDerWaalsContact CG2-CZ2 3.41Å; I89-W304 HydrophobicContact CG2-CZ3 3.7Å; F90-W304 HydrophobicContact CB-CZ2 4.21Å; F90-W304 AromaticContact CD1-CZ2 3.71Å; F90-W304 HydrophobicContact CD1-CZ2 3.71Å; F90-W304 AromaticContact CD2-CE2 3.96Å; F90-W304 AromaticContact CD2-CZ2 3.97Å; F90-W304 HydrophobicContact CD2-CZ2 3.97Å; F90-W304 AromaticContact CD2-NE1 3.4Å; F90-W304 HydrophobicContact CE1-CZ2 4.05Å; F90-W304 HydrophobicContact CE2-CZ2 4.28Å; F90-W304 AromaticContact CE2-NE1 3.55Å; F90-W304 AromaticContact CG-CZ2 3.68Å; F90-W304 HydrophobicContact CG-CZ2 3.68Å; F90-W304 HydrophobicContact CZ-CZ2 4.33Å; A93-W304 HydrophobicContact CB-CH2 3.75Å; F173-W304 HydrophobicContact CE1-CH2 4.33Å; F173-W304 AromaticContact CE2-CH2 4Å; F173-W304 HydrophobicContact CE2-CH2 4Å; F173-W304 HydrophobicContact CE2-CZ3 4.45Å; F173-W304 AromaticContact CZ-CH2 3.61Å; F173-W304 HydrophobicContact CZ-CH2 3.61Å; F173-W304 HydrophobicContact CZ-CZ2 4.22Å; F173-W304 HydrophobicContact CZ-CZ3 4.44Å; I180-W304 HydrophobicContact CG2-CZ3 4.2Å; L184-W304 HydrophobicContact CD1-CE3 3.6Å; L184-W304 HydrophobicContact CD1-CH2 4.13Å; L184-W304 HydrophobicContact CD1-CZ3 3.32Å; L285-W304 HydrophobicContact CD2-CB 4.15Å; L301-W304 PolarHBondContact O-N 2.93Å; S302-W304 VanDerWaalsContact C-N 3.35Å; S302-W304 PolarHBondContact O-N 3.49Å; W304-A306 VanDerWaalsContact C-N 3.32Å; W304-A306 PolarHBondContact O-N 3.14Å; W304-Y307 HydrophobicContact CE3-CD1 4.08Å; W304-Y307 HydrophobicContact CE3-CG 4.43Å; W304-Y307 AromaticContact CZ3-CD1 3.78Å; W304-Y307 HydrophobicContact CZ3-CD1 3.78Å; W304-Y307 HydrophobicContact CZ3-CE1 4.2Å; W304-Y307 HydrophobicContact CZ3-CG 4.29Å; W304-Y307 PolarHBondContact O-N 2Å; W304-L308 WeakPolarHBondContact O-CB 3.39Å; W304-L308 WeakPolarHBondContact O-CG 3.47Å; W304-L308 PolarHBondContact O-N 2.85Å
305	A	93.2	Very high	91.1	Very high	0 Å²	0	17.6 Å²	17.6	0%	0	10%	0.096	C	C	.	.	H	α-helix	trans	-58.4	-46.4	172.2	0	0	0	0	0	111.3	Y217 L285 L288 L294 L301 S302 W303 L308 S309	Y217-A305 HydrophobicContact CD1-CB 4.15Å; L285-A305 HydrophobicContact CD2-CB 3.81Å; L288-A305 HydrophobicContact CB-CB 3.83Å; L288-A305 HydrophobicContact CD1-CB 3.61Å; L288-A305 HydrophobicContact CG-CB 4.33Å; L294-A305 VanDerWaalsContact CD1-C 3.44Å; L294-A305 HydrophobicContact CD1-CB 3.98Å; L294-A305 WeakPolarHBondContact CD1-O 3.41Å; L301-A305 PolarHBondContact O-N 3.05Å; S302-A305 WeakPolarHBondContact O-CB 2.69Å; S302-A305 PolarHBondContact O-N 2.85Å; W303-A305 PolarHBondContact O-N 2.98Å; A305-L308 PolarHBondContact O-N 2.84Å; A305-S309 PolarHBondContact O-N 3.35Å
306	A	94.7	Very high	90.9	Very high	2 Å²	2	17.6 Å²	17.6	2%	0.017	10%	0.096	C	C	.	.	H	α-helix	trans	-63.2	-45.1	175.8	0	0	0	0	0	113.9	I296 S302 W303 W304 L308 S309 I313 W336	I296-A306 HydrophobicContact CD1-CB 3.73Å; I296-A306 HydrophobicContact CG2-CB 4.24Å; S302-A306 PolarHBondContact O-N 2.72Å; W303-A306 WeakPolarHBondContact O-CB 3.45Å; W303-A306 PolarHBondContact O-N 2.79Å; W304-A306 VanDerWaalsContact C-N 3.32Å; W304-A306 PolarHBondContact O-N 3.14Å; A306-L308 PolarHBondContact O-N 3.47Å; A306-S309 PolarHBondContact O-N 3.19Å; A306-S309 PolarHBondContact O-OG 2.81Å; A306-I313 HydrophobicContact CB-CB 4.34Å; A306-I313 HydrophobicContact CB-CD1 3.76Å; A306-I313 HydrophobicContact CB-CG1 3.91Å; A306-I313 HydrophobicContact CB-CG2 3.5Å; A306-W336 HydrophobicContact CB-CH2 3.54Å; A306-W336 HydrophobicContact CB-CZ2 3.61Å; A306-W336 HydrophobicContact CB-CZ3 4.02Å
307	Y	95.2	Very high	90.7	Very high	4 Å²	4	19.9 Å²	19.9	2%	0.016	11%	0.111	C	C	.	.	H	α-helix	trans	-60	-37.1	178.1	-172.6	-94.7	0	0	0	112.5	F173 R177 I180 R181 W303 W304	F173-Y307 HydrophobicContact CD2-CE2 4.43Å; F173-Y307 AromaticContact CD2-CZ 3.96Å; F173-Y307 WeakPolarHBondContact CD2-OH 3.39Å; F173-Y307 HydrophobicContact CE2-CD2 4.45Å; F173-Y307 HydrophobicContact CE2-CE1 4.15Å; F173-Y307 AromaticContact CE2-CE2 3.75Å; F173-Y307 HydrophobicContact CE2-CE2 3.75Å; F173-Y307 AromaticContact CE2-CZ 3.57Å; R177-Y307 WeakPolarHBondContact CA-OH 3.23Å; I180-Y307 HydrophobicContact CB-CE1 4.41Å; I180-Y307 HydrophobicContact CG2-CE1 3.85Å; R181-Y307 HydrophobicContact CG-CE1 4.37Å; R181-Y307 PolarHBondContact NE-O 2.86Å; R181-Y307 PolarHBondContact NH2-O 2.83Å; R181-Y307 VanDerWaalsContact NH2-O 3.16Å; W303-Y307 AromaticContact CH2-CD2 3.49Å; W303-Y307 HydrophobicContact CH2-CD2 3.49Å; W303-Y307 VanDerWaalsContact CH2-CD2 3.49Å; W303-Y307 HydrophobicContact CH2-CE2 4.15Å; W303-Y307 AromaticContact CH2-CG 3.94Å; W303-Y307 HydrophobicContact CH2-CG 3.94Å; W303-Y307 HydrophobicContact CZ2-CD2 4.35Å; W303-Y307 AromaticContact CZ3-CD2 3.8Å; W303-Y307 HydrophobicContact CZ3-CD2 3.8Å; W303-Y307 AromaticContact CZ3-CG 3.72Å; W303-Y307 HydrophobicContact CZ3-CG 3.72Å; W303-Y307 PolarHBondContact O-N 3.2Å; W304-Y307 HydrophobicContact CE3-CD1 4.08Å; W304-Y307 HydrophobicContact CE3-CG 4.43Å; W304-Y307 AromaticContact CZ3-CD1 3.78Å; W304-Y307 HydrophobicContact CZ3-CD1 3.78Å; W304-Y307 HydrophobicContact CZ3-CE1 4.2Å; W304-Y307 HydrophobicContact CZ3-CG 4.29Å; W304-Y307 PolarHBondContact O-N 2Å
308	L	93.4	Very high	90.7	Very high	20 Å²	20	22.6 Å²	22.6	11%	0.105	12%	0.123	C	C	.	.	H	α-helix	trans	-83.3	-27.1	-177.9	-64.3	175.4	0	0	0	114.3	R181 L184 W304 A305 A306 N310	R181-L308 HydrophobicContact CG-CD2 4.19Å; L184-L308 HydrophobicContact CB-CD1 4.33Å; L184-L308 HydrophobicContact CB-CD2 3.83Å; L184-L308 HydrophobicContact CD1-CD2 4.38Å; W304-L308 WeakPolarHBondContact O-CB 3.39Å; W304-L308 WeakPolarHBondContact O-CG 3.47Å; W304-L308 PolarHBondContact O-N 2.85Å; A305-L308 PolarHBondContact O-N 2.84Å; A306-L308 PolarHBondContact O-N 3.47Å; L308-N310 VanDerWaalsContact C-N 3.31Å; L308-N310 PolarHBondContact O-N 2.88Å
309	S	90.4	Very high	90.3	Very high	12 Å²	12	25.4 Å²	25.4	8%	0.084	14%	0.135	C	C	.	.	H	α-helix	trans	-71.6	-22.1	-176.7	69.8	0	0	0	0	114.5	L288 L294 A305 A306 G311 I313	L288-S309 VanDerWaalsContact O-CB 3.29Å; L288-S309 WeakPolarHBondContact O-CB 3.25Å; L294-S309 WeakPolarHBondContact CD1-OG 3.5Å; A305-S309 PolarHBondContact O-N 3.35Å; A306-S309 PolarHBondContact O-N 3.19Å; A306-S309 PolarHBondContact O-OG 2.81Å; S309-G311 PolarHBondContact O-N 3.19Å; S309-I313 WeakPolarHBondContact OG-CD1 3.44Å
310	N	85.5	Confident	90	Very high	111 Å²	111	22.4 Å²	22.4	59%	0.594	12%	0.121	S	C	*	.			trans	52.4	17.8	-176.1	-162.3	52.8	0	0	0	114	R181 L308	R181-N310 VanDerWaalsContact CZ-OD1 3.22Å; R181-N310 PolarHBondContact NH1-OD1 3.05Å; R181-N310 PolarHBondContact NH2-OD1 3.47Å; L308-N310 VanDerWaalsContact C-N 3.31Å; L308-N310 PolarHBondContact O-N 2.88Å
311	G	92.7	Very high	89.3	Confident	26 Å²	26	24.8 Å²	24.8	27%	0.268	13%	0.134	S	C	.	.	S	Bend	trans	-95.8	-170.4	178.6	0	0	0	0	0	112.1	S292 S309	S292-G311 WeakPolarHBondContact O-CA 3.05Å; S309-G311 PolarHBondContact O-N 3.19Å
312	R	96.7	Very high	88.3	Confident	75 Å²	75	30.9 Å²	30.9	28%	0.283	16%	0.162	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.1	128.3	171.4	177	169.7	-68.6	-152.4	-1.4	110.1	H242 F243 Y246 S292 G293 L294 L314 I337	H242-R312 PolarHBondContact NE2-NH1 2.94Å; F243-R312 HydrophobicContact CE1-CB 3.99Å; F243-R312 HydrophobicContact CE1-CG 3.98Å; F243-R312 HydrophobicContact CZ-CB 4.36Å; F243-R312 HydrophobicContact CZ-CG 4.22Å; F243-R312 WeakPolarHBondContact CZ-O 3.14Å; Y246-R312 VanDerWaalsContact CD2-CZ 3.43Å; Y246-R312 VanDerWaalsContact CG-NH1 3.31Å; Y246-R312 PolarHBondContact OH-NH2 2.94Å; S292-R312 PolarHBondContact O-N 3.07Å; S292-R312 VanDerWaalsContact O-N 3.12Å; G293-R312 CarbonylContact C-O 3.55Å; G293-R312 WeakPolarHBondContact CA-O 3.45Å; L294-R312 PolarHBondContact N-O 3.14Å; R312-L314 HydrophobicContact CG-CD2 4.42Å; R312-I337 HydrophobicContact CG-CD1 4.13Å
313	I	97.3	Very high	87.5	Confident	1 Å²	1	38.5 Å²	38.5	1%	0.005	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	129.9	-173.7	-48.1	-55.7	0	0	0	110.1	L294 I296 A306 S309 W336 I337	L294-I313 HydrophobicContact CB-CD1 3.98Å; L294-I313 HydrophobicContact CG-CD1 4.4Å; L294-I313 WeakPolarHBondContact O-CA 3.36Å; I296-I313 HydrophobicContact CD1-CG2 3.84Å; I296-I313 HydrophobicContact CG1-CG2 4.01Å; A306-I313 HydrophobicContact CB-CB 4.34Å; A306-I313 HydrophobicContact CB-CD1 3.76Å; A306-I313 HydrophobicContact CB-CG1 3.91Å; A306-I313 HydrophobicContact CB-CG2 3.5Å; S309-I313 WeakPolarHBondContact OG-CD1 3.44Å; I313-W336 HydrophobicContact CB-CB 4.13Å; I313-W336 HydrophobicContact CB-CD2 3.9Å; I313-W336 HydrophobicContact CB-CG 3.64Å; I313-W336 HydrophobicContact CG1-CD2 4.16Å; I313-W336 HydrophobicContact CG1-CG 4.06Å; I313-W336 HydrophobicContact CG2-CB 4.44Å; I313-W336 HydrophobicContact CG2-CD2 3.75Å; I313-W336 HydrophobicContact CG2-CE3 3.93Å; I313-W336 HydrophobicContact CG2-CG 3.97Å; I313-I337 PolarHBondContact O-N 3.22Å
314	L	96.7	Very high	86.6	Confident	0 Å²	0	45 Å²	45	0%	0	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	132.4	174.3	-50.1	-177.1	0	0	0	109.9	A239 H242 F243 L294 I295 I296 R312 I337 I339	A239-L314 HydrophobicContact CB-CB 4.4Å; A239-L314 HydrophobicContact CB-CD1 3.86Å; A239-L314 WeakPolarHBondContact O-CD1 2.99Å; H242-L314 HydrophobicContact CB-CD1 3.99Å; F243-L314 HydrophobicContact CD2-CD1 3.41Å; F243-L314 VanDerWaalsContact CD2-CD1 3.41Å; F243-L314 HydrophobicContact CD2-CG 4.26Å; F243-L314 HydrophobicContact CE2-CB 4.44Å; F243-L314 HydrophobicContact CE2-CD1 3.18Å; F243-L314 HydrophobicContact CE2-CG 3.52Å; F243-L314 HydrophobicContact CG-CD1 4.3Å; F243-L314 HydrophobicContact CZ-CD1 3.9Å; F243-L314 HydrophobicContact CZ-CG 3.84Å; L294-L314 PolarHBondContact O-N 3.4Å; I295-L314 HydrophobicContact CG1-CD1 4.44Å; I296-L314 WeakPolarHBondContact CG1-O 2.95Å; I296-L314 PolarHBondContact N-O 3.47Å; R312-L314 HydrophobicContact CG-CD2 4.42Å; L314-I337 VanDerWaalsContact CA-O 3.32Å; L314-I337 WeakPolarHBondContact CA-O 3.46Å; L314-I337 HydrophobicContact CD2-CB 3.64Å; L314-I337 HydrophobicContact CD2-CD1 3.98Å; L314-I337 HydrophobicContact CD2-CG1 4.29Å; L314-I337 HydrophobicContact CD2-CG2 4.06Å; L314-I339 HydrophobicContact CB-CD1 4.19Å; L314-I339 HydrophobicContact CD1-CD1 3.68Å; L314-I339 HydrophobicContact CD2-CD1 4.05Å; L314-I339 HydrophobicContact CG-CD1 4.18Å
315	Y	93.7	Very high	85.8	Confident	11 Å²	11	45.8 Å²	45.8	4%	0.043	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.5	153.4	176.3	69.3	-84	0	0	0	110.7	K328 F332 W336 I337 Q338 I339	Y315-K328 VanDerWaalsContact OH-CE 3.28Å; Y315-K328 WeakPolarHBondContact OH-CE 3.44Å; Y315-F332 HydrophobicContact CD1-CD1 4.42Å; Y315-F332 HydrophobicContact CD2-CD1 4.27Å; Y315-F332 HydrophobicContact CD2-CD2 4.38Å; Y315-F332 HydrophobicContact CD2-CE1 4.05Å; Y315-F332 HydrophobicContact CD2-CE2 4.15Å; Y315-F332 HydrophobicContact CD2-CG 4.42Å; Y315-F332 AromaticContact CD2-CZ 3.98Å; Y315-F332 HydrophobicContact CD2-CZ 3.98Å; Y315-F332 HydrophobicContact CE1-CB 4.29Å; Y315-F332 HydrophobicContact CE1-CD1 4.4Å; Y315-F332 HydrophobicContact CE1-CG 4.28Å; Y315-F332 HydrophobicContact CE2-CD1 4.25Å; Y315-F332 AromaticContact CE2-CD2 3.76Å; Y315-F332 HydrophobicContact CE2-CD2 3.76Å; Y315-F332 HydrophobicContact CE2-CE1 4.35Å; Y315-F332 AromaticContact CE2-CE2 3.86Å; Y315-F332 HydrophobicContact CE2-CE2 3.86Å; Y315-F332 AromaticContact CE2-CG 3.94Å; Y315-F332 HydrophobicContact CE2-CG 3.94Å; Y315-F332 HydrophobicContact CE2-CZ 4.16Å; Y315-F332 HydrophobicContact CG-CD1 4.35Å; Y315-F332 HydrophobicContact CG-CE1 4.26Å; Y315-F332 AromaticContact CZ-CG 3.86Å; Y315-W336 HydrophobicContact CD1-CB 4.03Å; Y315-W336 HydrophobicContact CE1-CB 3.8Å; Y315-I337 WeakPolarHBondContact CD1-O 3.35Å; Y315-I337 PolarHBondContact N-O 3.22Å; Y315-Q338 HydrophobicContact CD2-CB 4.49Å; Y315-Q338 HydrophobicContact CD2-CG 4.13Å; Y315-Q338 HydrophobicContact CE1-CB 4.1Å; Y315-Q338 HydrophobicContact CE2-CB 3.86Å; Y315-Q338 HydrophobicContact CE2-CG 3.63Å; Y315-Q338 CarbonylContact O-C 3.37Å; Y315-Q338 VanDerWaalsContact O-CA 3.31Å; Y315-Q338 WeakPolarHBondContact O-CA 3.4Å; Y315-I339 PolarHBondContact O-N 3.28Å
316	P	90.3	Very high	85.3	Confident	0 Å²	0	50.4 Å²	50.4	0%	0	28%	0.275	C	S	.	.			trans	-80.5	149.3	-171.5	24.6	-26.8	0	0	0	113.1	F235 I296 F318 F319	F235-P316 HydrophobicContact CB-CB 4.19Å; F235-P316 HydrophobicContact CD1-CB 3.97Å; F235-P316 HydrophobicContact CD1-CG 4.21Å; F235-P316 HydrophobicContact CD2-CB 3.46Å; F235-P316 VanDerWaalsContact CD2-CB 3.46Å; F235-P316 HydrophobicContact CD2-CG 4.36Å; F235-P316 HydrophobicContact CE1-CB 4.18Å; F235-P316 HydrophobicContact CE1-CG 4.1Å; F235-P316 VanDerWaalsContact CE2-CA 3.41Å; F235-P316 HydrophobicContact CE2-CB 3.7Å; F235-P316 HydrophobicContact CE2-CG 4.26Å; F235-P316 VanDerWaalsContact CE2-N 3.3Å; F235-P316 HydrophobicContact CG-CB 3.59Å; F235-P316 HydrophobicContact CG-CG 4.32Å; F235-P316 HydrophobicContact CZ-CB 4.06Å; F235-P316 HydrophobicContact CZ-CG 4.13Å; I296-P316 VanDerWaalsContact O-CD 3.23Å; I296-P316 WeakPolarHBondContact O-CD 3.33Å; P316-F318 VanDerWaalsContact C-N 3.33Å; P316-F318 HydrophobicContact CB-CD1 3.65Å; P316-F318 HydrophobicContact CB-CD2 4.25Å; P316-F318 HydrophobicContact CB-CE1 3.29Å; P316-F318 HydrophobicContact CB-CE2 3.92Å; P316-F318 HydrophobicContact CB-CG 4.12Å; P316-F318 HydrophobicContact CB-CZ 3.44Å; P316-F318 VanDerWaalsContact CB-CZ 3.44Å; P316-F318 HydrophobicContact CG-CD1 4.47Å; P316-F318 HydrophobicContact CG-CD2 4.31Å; P316-F318 HydrophobicContact CG-CE1 3.91Å; P316-F318 HydrophobicContact CG-CE2 3.7Å; P316-F318 HydrophobicContact CG-CZ 3.47Å; P316-F318 VanDerWaalsContact CG-CZ 3.47Å; P316-F318 PolarHBondContact O-N 3.05Å; P316-F319 HydrophobicContact CB-CD2 4.42Å; P316-F319 HydrophobicContact CG-CD2 3.28Å; P316-F319 HydrophobicContact CG-CE2 3.22Å; P316-F319 HydrophobicContact CG-CG 4.44Å; P316-F319 HydrophobicContact CG-CZ 4.42Å
317	S	88.1	Confident	84.8	Confident	47 Å²	47	53 Å²	53	33%	0.329	28%	0.284	S	S	.	.	G	3₁₀ helix	trans	-63.9	-33.4	174.1	47	0	0	0	0	113.9	F319 C320 I339	S317-F319 VanDerWaalsContact C-N 3.26Å; S317-F319 PolarHBondContact O-N 2.78Å; S317-C320 CarbonylContact O-C 3.57Å; S317-C320 PolarHBondContact O-N 3.33Å; S317-C320 VanDerWaalsContact O-O 3.11Å; S317-I339 VanDerWaalsContact CB-O 3.24Å; S317-I339 WeakPolarHBondContact CB-O 3.39Å; S317-I339 PolarHBondContact N-O 2.94Å; S317-I339 PolarHBondContact OG-O 2.67Å
318	F	82.8	Confident	84.4	Confident	66 Å²	66	54.9 Å²	54.9	29%	0.289	29%	0.292	S	S	.	.	G	3₁₀ helix	trans	-70.4	-13.6	-174.9	57.5	-109.1	0	0	0	115.1	M231 F235 P316 C320	M231-F318 HydrophobicContact CB-CD1 4.29Å; M231-F318 HydrophobicContact CB-CE1 4.33Å; F235-F318 HydrophobicContact CB-CE1 3.82Å; F235-F318 HydrophobicContact CG-CE1 4.35Å; P316-F318 VanDerWaalsContact C-N 3.33Å; P316-F318 HydrophobicContact CB-CD1 3.65Å; P316-F318 HydrophobicContact CB-CD2 4.25Å; P316-F318 HydrophobicContact CB-CE1 3.29Å; P316-F318 HydrophobicContact CB-CE2 3.92Å; P316-F318 HydrophobicContact CB-CG 4.12Å; P316-F318 HydrophobicContact CB-CZ 3.44Å; P316-F318 VanDerWaalsContact CB-CZ 3.44Å; P316-F318 HydrophobicContact CG-CD1 4.47Å; P316-F318 HydrophobicContact CG-CD2 4.31Å; P316-F318 HydrophobicContact CG-CE1 3.91Å; P316-F318 HydrophobicContact CG-CE2 3.7Å; P316-F318 HydrophobicContact CG-CZ 3.47Å; P316-F318 VanDerWaalsContact CG-CZ 3.47Å; P316-F318 PolarHBondContact O-N 3.05Å; F318-C320 VanDerWaalsContact C-N 3.3Å
319	F	72.3	Confident	84.3	Confident	59 Å²	59	60.3 Å²	60.3	26%	0.259	32%	0.317	S	S	.	.	G	3₁₀ helix	trans	-73	-27.3	169.5	-74.2	-57.2	0	0	0	112.5	S297 P316 S317	S297-F319 VanDerWaalsContact C-CE2 3.43Å; S297-F319 WeakPolarHBondContact O-CD2 3.31Å; S297-F319 WeakPolarHBondContact O-CE2 3.27Å; S297-F319 VanDerWaalsContact O-CZ 3.32Å; S297-F319 WeakPolarHBondContact O-CZ 3.11Å; P316-F319 HydrophobicContact CB-CD2 4.42Å; P316-F319 HydrophobicContact CG-CD2 3.28Å; P316-F319 HydrophobicContact CG-CE2 3.22Å; P316-F319 HydrophobicContact CG-CG 4.44Å; P316-F319 HydrophobicContact CG-CZ 4.42Å; S317-F319 VanDerWaalsContact C-N 3.26Å; S317-F319 PolarHBondContact O-N 2.78Å
320	C	73.4	Confident	84.3	Confident	0 Å²	0	62.1 Å²	62.1	0%	0	32%	0.323	C	S	.	.	S	Bend	trans	-149.4	86.9	177.3	-90.5	0	0	0	0	111.2	S317 F318 E322 C325 W327 K328 Q338	S317-C320 CarbonylContact O-C 3.57Å; S317-C320 PolarHBondContact O-N 3.33Å; S317-C320 VanDerWaalsContact O-O 3.11Å; F318-C320 VanDerWaalsContact C-N 3.3Å; C320-E322 PolarHBondContact O-N 2.87Å; C320-C325 WeakPolarHBondContact CA-SG 3.08Å; C320-C325 HydrophobicContact CB-CB 3.47Å; C320-C325 VanDerWaalsContact CB-CB 3.47Å; C320-C325 WeakPolarHBondContact CB-SG 3.28Å; C320-C325 WeakPolarHBondContact SG-CB 3.36Å; C320-C325 CovalentContact SG-SG 2.02Å; C320-C325 PolarHBondContact SG-SG 3.45Å; C320-W327 WeakPolarHBondContact SG-CH2 3.26Å; C320-W327 WeakPolarHBondContact SG-CZ2 3.41Å; C320-K328 HydrophobicContact CB-CD 4.45Å; C320-Q338 PolarHBondContact O-NE2 3.32Å
321	P	71.5	Confident	84.6	Confident	60 Å²	60	57.1 Å²	57.1	39%	0.39	30%	0.296	S	S	.	.			trans	-53.4	137.7	160.7	-23.7	36.3	0	0	0	109	D323 L324	P321-D323 PolarHBondContact O-N 3.29Å; P321-L324 HydrophobicContact CB-CB 4.41Å; P321-L324 HydrophobicContact CB-CD1 4.12Å; P321-L324 HydrophobicContact CB-CG 4.28Å; P321-L324 HydrophobicContact CG-CD1 4.02Å; P321-L324 PolarHBondContact O-N 2.92Å
322	E	68.7	Low	84.7	Confident	154 Å²	154	56.2 Å²	56.2	72%	0.72	29%	0.285	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.1	-33.6	-170.4	-63.5	-171.3	151.8	0	0	112.8	C320	C320-E322 PolarHBondContact O-N 2.87Å
323	D	74.5	Confident	84.5	Confident	160 Å²	160	52.7 Å²	52.7	86%	0.856	27%	0.272	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.3	-9.8	-178.2	-57	-40.3	0	0	0	114.7	P321	P321-D323 PolarHBondContact O-N 3.29Å
324	L	73.2	Confident	84.4	Confident	137 Å²	137	58.1 Å²	58.1	72%	0.717	31%	0.307	S	S	*	.	T	Hydrogen-bonded Turn	trans	-111.8	-12.5	-170.5	-64	-178.9	0	0	0	114.4	P321	P321-L324 HydrophobicContact CB-CB 4.41Å; P321-L324 HydrophobicContact CB-CD1 4.12Å; P321-L324 HydrophobicContact CB-CG 4.28Å; P321-L324 HydrophobicContact CG-CD1 4.02Å; P321-L324 PolarHBondContact O-N 2.92Å
325	C	78.3	Confident	84.3	Confident	16 Å²	16	62.5 Å²	62.5	11%	0.108	33%	0.328	C	S	.	.			trans	-124.7	83.2	-173.6	-74.4	0	0	0	0	113.6	C320 W327 K328	C320-C325 WeakPolarHBondContact CA-SG 3.08Å; C320-C325 HydrophobicContact CB-CB 3.47Å; C320-C325 VanDerWaalsContact CB-CB 3.47Å; C320-C325 WeakPolarHBondContact CB-SG 3.28Å; C320-C325 WeakPolarHBondContact SG-CB 3.36Å; C320-C325 CovalentContact SG-SG 2.02Å; C320-C325 PolarHBondContact SG-SG 3.45Å; C325-W327 HydrophobicContact CB-CD2 4.47Å; C325-W327 HydrophobicContact CB-CZ2 4.45Å; C325-W327 PolarHBondContact O-N 3.15Å; C325-W327 VanDerWaalsContact SG-CZ2 3.54Å; C325-K328 HydrophobicContact CB-CB 4.15Å; C325-K328 WeakPolarHBondContact O-CB 3.33Å; C325-K328 PolarHBondContact O-N 3.2Å
326	S	81.3	Confident	84.4	Confident	98 Å²	98	62.9 Å²	62.9	69%	0.685	33%	0.329	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.5	-13.2	170.9	59.6	0	0	0	0	113.9
327	W	85	Confident	84.6	Confident	55 Å²	55	65.4 Å²	65.4	21%	0.208	34%	0.342	C	S	.	.	T	Hydrogen-bonded Turn	trans	-94.8	-4.1	-179.8	54.7	-96.3	0	0	0	114.4	C146 C320 C325 E329 F330 Y331 F332	C146-W327 HydrophobicContact CB-CB 4Å; C146-W327 HydrophobicContact CB-CD2 3.81Å; C146-W327 HydrophobicContact CB-CE3 3.65Å; C146-W327 HydrophobicContact CB-CG 3.99Å; C146-W327 HydrophobicContact CB-CZ3 4.37Å; C320-W327 WeakPolarHBondContact SG-CH2 3.26Å; C320-W327 WeakPolarHBondContact SG-CZ2 3.41Å; C325-W327 HydrophobicContact CB-CD2 4.47Å; C325-W327 HydrophobicContact CB-CZ2 4.45Å; C325-W327 PolarHBondContact O-N 3.15Å; C325-W327 VanDerWaalsContact SG-CZ2 3.54Å; W327-E329 VanDerWaalsContact C-N 3.33Å; W327-E329 PolarHBondContact O-N 3.4Å; W327-F330 PolarHBondContact O-N 2.02Å; W327-Y331 HydrophobicContact CE3-CD1 4.34Å; W327-Y331 HydrophobicContact CE3-CG 4.03Å; W327-Y331 AromaticContact CZ3-CD1 3.66Å; W327-Y331 HydrophobicContact CZ3-CD1 3.66Å; W327-Y331 HydrophobicContact CZ3-CE1 4.37Å; W327-Y331 AromaticContact CZ3-CG 3.8Å; W327-Y331 HydrophobicContact CZ3-CG 3.8Å; W327-Y331 PolarHBondContact O-N 2.69Å; W327-Y331 VanDerWaalsContact O-N 3.14Å; W327-F332 HydrophobicContact CZ3-CE2 4.12Å
328	K	87.7	Confident	84.9	Confident	45 Å²	45	65.3 Å²	65.3	20%	0.196	34%	0.336	C	S	.	.	H	α-helix	trans	-54.7	-47.2	-174.9	-180	-175	171.2	-172.4	0	112.1	Y315 C320 C325 F330 Y331 F332	Y315-K328 VanDerWaalsContact OH-CE 3.28Å; Y315-K328 WeakPolarHBondContact OH-CE 3.44Å; C320-K328 HydrophobicContact CB-CD 4.45Å; C325-K328 HydrophobicContact CB-CB 4.15Å; C325-K328 WeakPolarHBondContact O-CB 3.33Å; C325-K328 PolarHBondContact O-N 3.2Å; K328-F330 PolarHBondContact O-N 2.96Å; K328-Y331 PolarHBondContact O-N 3.06Å; K328-F332 HydrophobicContact CG-CD2 4.08Å; K328-F332 PolarHBondContact O-N 2.9Å
329	E	89.5	Confident	85.3	Confident	134 Å²	134	64.1 Å²	64.1	63%	0.626	33%	0.332	S	S	*	.	H	α-helix	trans	-65.2	-21.6	-178.9	60.7	177.2	-171.2	0	0	113.9	W327	W327-E329 VanDerWaalsContact C-N 3.33Å; W327-E329 PolarHBondContact O-N 3.4Å
330	F	91.6	Very high	85.9	Confident	49 Å²	49	64.4 Å²	64.4	22%	0.215	34%	0.336	C	S	.	.	H	α-helix	trans	-92.3	-22.2	178.9	-54.3	-42.6	0	0	0	112.9	F148 S169 F170 L171 W327 K328	F148-F330 HydrophobicContact CB-CB 3.69Å; F148-F330 HydrophobicContact CB-CD1 3.64Å; F148-F330 HydrophobicContact CB-CD2 3.79Å; F148-F330 HydrophobicContact CB-CE1 4.23Å; F148-F330 HydrophobicContact CB-CE2 4.38Å; F148-F330 HydrophobicContact CB-CG 3.4Å; F148-F330 HydrophobicContact CD1-CD1 4.09Å; F148-F330 HydrophobicContact CD1-CE1 4.11Å; F148-F330 HydrophobicContact CG-CD1 4.16Å; F148-F330 HydrophobicContact CG-CG 4.38Å; S169-F330 VanDerWaalsContact CA-O 3.27Å; S169-F330 WeakPolarHBondContact CA-O 3.22Å; S169-F330 WeakPolarHBondContact CB-O 3.24Å; S169-F330 PolarHBondContact OG-O 3.45Å; F170-F330 WeakPolarHBondContact CD1-O 3.4Å; F170-F330 PolarHBondContact N-O 3.43Å; L171-F330 HydrophobicContact CD1-CD1 3.57Å; L171-F330 HydrophobicContact CD1-CE1 4.3Å; L171-F330 HydrophobicContact CD1-CG 4.48Å; W327-F330 PolarHBondContact O-N 2.02Å; K328-F330 PolarHBondContact O-N 2.96Å
331	Y	92.3	Very high	86.6	Confident	6 Å²	6	67.7 Å²	67.7	2%	0.024	35%	0.354	C	S	.	.	H	α-helix	trans	-98.7	-45.4	-174.5	-170.9	-106.9	0	0	0	112.1	F90 C146 R168 G298 W303 W327 K328	F90-Y331 HydrophobicContact CE2-CE2 4.1Å; F90-Y331 HydrophobicContact CZ-CD2 4.46Å; F90-Y331 AromaticContact CZ-CE2 3.8Å; F90-Y331 HydrophobicContact CZ-CE2 3.8Å; C146-Y331 HydrophobicContact CB-CD2 4.01Å; C146-Y331 HydrophobicContact CB-CG 4.39Å; R168-Y331 HydrophobicContact CB-CD2 4.3Å; R168-Y331 HydrophobicContact CB-CE2 4.09Å; R168-Y331 WeakPolarHBondContact O-CD2 3.22Å; G298-Y331 VanDerWaalsContact O-CE1 3.26Å; G298-Y331 WeakPolarHBondContact O-CE1 3Å; G298-Y331 PolarHBondContact O-OH 3.01Å; W303-Y331 AromaticContact CD1-CD1 3.98Å; W303-Y331 AromaticContact CD1-CE1 3.45Å; W303-Y331 VanDerWaalsContact CD1-CE1 3.45Å; W303-Y331 AromaticContact CD1-CZ 3.59Å; W303-Y331 HydrophobicContact CG-CE1 4.41Å; W303-Y331 WeakPolarHBondContact CZ2-O 3.05Å; W303-Y331 AromaticContact NE1-CE1 3.92Å; W303-Y331 PolarHBondContact NE1-O 3.33Å; W327-Y331 HydrophobicContact CE3-CD1 4.34Å; W327-Y331 HydrophobicContact CE3-CG 4.03Å; W327-Y331 AromaticContact CZ3-CD1 3.66Å; W327-Y331 HydrophobicContact CZ3-CD1 3.66Å; W327-Y331 HydrophobicContact CZ3-CE1 4.37Å; W327-Y331 AromaticContact CZ3-CG 3.8Å; W327-Y331 HydrophobicContact CZ3-CG 3.8Å; W327-Y331 PolarHBondContact O-N 2.69Å; W327-Y331 VanDerWaalsContact O-N 3.14Å; K328-Y331 PolarHBondContact O-N 3.06Å
332	F	93	Very high	87.4	Confident	7 Å²	7	68.2 Å²	68.2	3%	0.031	35%	0.352	C	S	.	.	S	Bend	trans	-99.8	123.5	179.4	-62.9	-67.7	0	0	0	110.5	G298 Y315 W327 K328 W336	G298-F332 WeakPolarHBondContact O-CE1 3.39Å; Y315-F332 HydrophobicContact CD1-CD1 4.42Å; Y315-F332 HydrophobicContact CD2-CD1 4.27Å; Y315-F332 HydrophobicContact CD2-CD2 4.38Å; Y315-F332 HydrophobicContact CD2-CE1 4.05Å; Y315-F332 HydrophobicContact CD2-CE2 4.15Å; Y315-F332 HydrophobicContact CD2-CG 4.42Å; Y315-F332 AromaticContact CD2-CZ 3.98Å; Y315-F332 HydrophobicContact CD2-CZ 3.98Å; Y315-F332 HydrophobicContact CE1-CB 4.29Å; Y315-F332 HydrophobicContact CE1-CD1 4.4Å; Y315-F332 HydrophobicContact CE1-CG 4.28Å; Y315-F332 HydrophobicContact CE2-CD1 4.25Å; Y315-F332 AromaticContact CE2-CD2 3.76Å; Y315-F332 HydrophobicContact CE2-CD2 3.76Å; Y315-F332 HydrophobicContact CE2-CE1 4.35Å; Y315-F332 AromaticContact CE2-CE2 3.86Å; Y315-F332 HydrophobicContact CE2-CE2 3.86Å; Y315-F332 AromaticContact CE2-CG 3.94Å; Y315-F332 HydrophobicContact CE2-CG 3.94Å; Y315-F332 HydrophobicContact CE2-CZ 4.16Å; Y315-F332 HydrophobicContact CG-CD1 4.35Å; Y315-F332 HydrophobicContact CG-CE1 4.26Å; Y315-F332 AromaticContact CZ-CG 3.86Å; W327-F332 HydrophobicContact CZ3-CE2 4.12Å; K328-F332 HydrophobicContact CG-CD2 4.08Å; K328-F332 PolarHBondContact O-N 2.9Å; F332-W336 HydrophobicContact CB-CE3 4.47Å; F332-W336 AromaticContact CD1-CE3 3.73Å; F332-W336 HydrophobicContact CD1-CE3 3.73Å; F332-W336 AromaticContact CD1-CZ3 3.81Å; F332-W336 HydrophobicContact CD1-CZ3 3.81Å; F332-W336 HydrophobicContact CE1-CZ3 4.42Å
333	P	94.4	Very high	88.5	Confident	2 Å²	2	63.1 Å²	63.1	1%	0.013	33%	0.33	C	S	.	.			trans	-54.5	140.5	171.3	-26.9	34.9	0	0	0	112.1	F170 W303 E335 W336	F170-P333 HydrophobicContact CD1-CG 4.05Å; F170-P333 HydrophobicContact CD2-CG 4.34Å; F170-P333 HydrophobicContact CE1-CB 4.47Å; F170-P333 HydrophobicContact CE1-CG 4.32Å; F170-P333 HydrophobicContact CE2-CB 4.49Å; F170-P333 HydrophobicContact CG-CG 4.07Å; F170-P333 HydrophobicContact CZ-CB 4.39Å; W303-P333 HydrophobicContact CZ2-CG 4.45Å; P333-E335 VanDerWaalsContact CB-CD 3.49Å; P333-E335 HydrophobicContact CB-CG 4.26Å; P333-E335 WeakPolarHBondContact CB-OE2 3.36Å; P333-E335 PolarHBondContact O-N 2.86Å; P333-E335 VanDerWaalsContact O-N 3.15Å; P333-W336 HydrophobicContact CB-CD2 4.38Å; P333-W336 HydrophobicContact CB-CG 4.33Å; P333-W336 HydrophobicContact CG-CD2 4.12Å; P333-W336 HydrophobicContact CG-CH2 4.34Å; P333-W336 HydrophobicContact CG-CZ2 3.8Å; P333-W336 WeakPolarHBondContact O-CB 3.43Å; P333-W336 PolarHBondContact O-N 2.8Å
334	P	94	Very high	89.4	Confident	114 Å²	114	57.1 Å²	57.1	74%	0.74	30%	0.297	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.4	-20.4	-175	26.4	-36	0	0	0	113.5	W336	P334-W336 PolarHBondContact O-N 2.68Å
335	E	94.9	Very high	90.5	Very high	92 Å²	92	51.7 Å²	51.7	43%	0.43	27%	0.269	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.7	-9.6	174.5	64.7	-94.6	-139.6	0	0	114.1	R177 P333	R177-E335 IonicContact CZ-OE1 3.32Å; R177-E335 VanDerWaalsContact CZ-OE1 3.28Å; R177-E335 IonicContact NH1-OE1 3.53Å; R177-E335 PolarHBondContact NH1-OE1 3.03Å; R177-E335 IonicContact NH2-OE1 3.28Å; R177-E335 PolarHBondContact NH2-OE1 2.95Å; P333-E335 VanDerWaalsContact CB-CD 3.49Å; P333-E335 HydrophobicContact CB-CG 4.26Å; P333-E335 WeakPolarHBondContact CB-OE2 3.36Å; P333-E335 PolarHBondContact O-N 2.86Å; P333-E335 VanDerWaalsContact O-N 3.15Å
336	W	95.7	Very high	91.4	Very high	19 Å²	19	54.3 Å²	54.3	7%	0.072	28%	0.281	C	S	.	.	S	Bend	trans	-86.5	143.9	176.6	-62.1	2.8	0	0	0	110.8	I296 W303 A306 I313 Y315 F332 P333 P334	I296-W336 HydrophobicContact CD1-CE3 4.3Å; I296-W336 HydrophobicContact CD1-CZ3 3.95Å; W303-W336 AromaticContact CD1-CH2 3.91Å; W303-W336 AromaticContact CD1-CZ3 3.66Å; W303-W336 AromaticContact CD2-CH2 3.9Å; W303-W336 HydrophobicContact CD2-CH2 3.9Å; W303-W336 HydrophobicContact CD2-CZ3 4.43Å; W303-W336 AromaticContact CE2-CH2 3.65Å; W303-W336 HydrophobicContact CG-CH2 4.04Å; W303-W336 HydrophobicContact CG-CZ3 4.17Å; W303-W336 HydrophobicContact CZ2-CH2 4.14Å; W303-W336 AromaticContact NE1-CH2 3.68Å; W303-W336 AromaticContact NE1-CZ3 3.59Å; A306-W336 HydrophobicContact CB-CH2 3.54Å; A306-W336 HydrophobicContact CB-CZ2 3.61Å; A306-W336 HydrophobicContact CB-CZ3 4.02Å; I313-W336 HydrophobicContact CB-CB 4.13Å; I313-W336 HydrophobicContact CB-CD2 3.9Å; I313-W336 HydrophobicContact CB-CG 3.64Å; I313-W336 HydrophobicContact CG1-CD2 4.16Å; I313-W336 HydrophobicContact CG1-CG 4.06Å; I313-W336 HydrophobicContact CG2-CB 4.44Å; I313-W336 HydrophobicContact CG2-CD2 3.75Å; I313-W336 HydrophobicContact CG2-CE3 3.93Å; I313-W336 HydrophobicContact CG2-CG 3.97Å; Y315-W336 HydrophobicContact CD1-CB 4.03Å; Y315-W336 HydrophobicContact CE1-CB 3.8Å; F332-W336 HydrophobicContact CB-CE3 4.47Å; F332-W336 AromaticContact CD1-CE3 3.73Å; F332-W336 HydrophobicContact CD1-CE3 3.73Å; F332-W336 AromaticContact CD1-CZ3 3.81Å; F332-W336 HydrophobicContact CD1-CZ3 3.81Å; F332-W336 HydrophobicContact CE1-CZ3 4.42Å; P333-W336 HydrophobicContact CB-CD2 4.38Å; P333-W336 HydrophobicContact CB-CG 4.33Å; P333-W336 HydrophobicContact CG-CD2 4.12Å; P333-W336 HydrophobicContact CG-CH2 4.34Å; P333-W336 HydrophobicContact CG-CZ2 3.8Å; P333-W336 WeakPolarHBondContact O-CB 3.43Å; P333-W336 PolarHBondContact O-N 2.8Å; P334-W336 PolarHBondContact O-N 2.68Å
337	I	95.6	Very high	92.1	Very high	54 Å²	54	50.9 Å²	50.9	28%	0.277	25%	0.25	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.9	124.9	-172.4	-55.2	169.3	0	0	0	109.2	R312 I313 L314 Y315 I339	R312-I337 HydrophobicContact CG-CD1 4.13Å; I313-I337 PolarHBondContact O-N 3.22Å; L314-I337 VanDerWaalsContact CA-O 3.32Å; L314-I337 WeakPolarHBondContact CA-O 3.46Å; L314-I337 HydrophobicContact CD2-CB 3.64Å; L314-I337 HydrophobicContact CD2-CD1 3.98Å; L314-I337 HydrophobicContact CD2-CG1 4.29Å; L314-I337 HydrophobicContact CD2-CG2 4.06Å; Y315-I337 WeakPolarHBondContact CD1-O 3.35Å; Y315-I337 PolarHBondContact N-O 3.22Å; I337-I339 HydrophobicContact CG2-CG1 4.36Å
338	Q	93.6	Very high	92.7	Very high	44 Å²	44	50.6 Å²	50.6	21%	0.206	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.4	139.1	171.8	-164	178.7	41.2	0	0	110.2	Y315 C320	Y315-Q338 HydrophobicContact CD2-CB 4.49Å; Y315-Q338 HydrophobicContact CD2-CG 4.13Å; Y315-Q338 HydrophobicContact CE1-CB 4.1Å; Y315-Q338 HydrophobicContact CE2-CB 3.86Å; Y315-Q338 HydrophobicContact CE2-CG 3.63Å; Y315-Q338 CarbonylContact O-C 3.37Å; Y315-Q338 VanDerWaalsContact O-CA 3.31Å; Y315-Q338 WeakPolarHBondContact O-CA 3.4Å; C320-Q338 PolarHBondContact O-NE2 3.32Å
339	I	90.6	Very high	93.2	Very high	41 Å²	41	51.1 Å²	51.1	21%	0.21	26%	0.258	C	S	.	.			trans	-124.1	0	179.6	-67.8	-172.9	0	0	0	113.2	F235 K238 A239 H242 L314 Y315 S317 I337	F235-I339 HydrophobicContact CD2-CB 3.95Å; F235-I339 HydrophobicContact CD2-CG2 3.98Å; F235-I339 HydrophobicContact CE2-CB 3.9Å; F235-I339 HydrophobicContact CE2-CG2 4.35Å; K238-I339 HydrophobicContact CB-CG2 3.43Å; K238-I339 VanDerWaalsContact CB-CG2 3.43Å; K238-I339 HydrophobicContact CD-CG2 3.88Å; K238-I339 HydrophobicContact CG-CG2 4.34Å; A239-I339 HydrophobicContact CB-CD1 4.14Å; H242-I339 HydrophobicContact CB-CD1 3.9Å; L314-I339 HydrophobicContact CB-CD1 4.19Å; L314-I339 HydrophobicContact CD1-CD1 3.68Å; L314-I339 HydrophobicContact CD2-CD1 4.05Å; L314-I339 HydrophobicContact CG-CD1 4.18Å; Y315-I339 PolarHBondContact O-N 3.28Å; S317-I339 VanDerWaalsContact CB-O 3.24Å; S317-I339 WeakPolarHBondContact CB-O 3.39Å; S317-I339 PolarHBondContact N-O 2.94Å; S317-I339 PolarHBondContact OG-O 2.67Å; I337-I339 HydrophobicContact CG2-CG1 4.36Å

Retrieved 339 of 339 residues in 902.9 ms (Link to these results)

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