A0A5K4FAF6_SCHMA Loading...

Peptidase_M28 domain-containing protein

AlphaFold DB , UniProt , Accession A0A5K4FAF6, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 553 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	30.6	Very low	31.8	Very low	239 Å²	239	173.6 Å²	173.6	100%	1.177	90%	0.899	S	S	*	*				0	137.8	0	-83.2	-177.6	164.1	0	0	108.1
2	S	34.8	Very low	31.7	Very low	131 Å²	131	173.2 Å²	173.2	92%	0.916	90%	0.897	S	S	*	*			trans	59.7	113.6	-171.7	74.5	0	0	0	0	114.8
3	G	35.1	Very low	31.7	Very low	70 Å²	70	174.3 Å²	174.3	72%	0.722	90%	0.896	S	S	*	*			cis	149	51.6	18.2	0	0	0	0	0	107.8	R5	G3-R5 PolarHBondContact O-N 3.1Å; G3-R5 VanDerWaalsContact O-N 3.1Å
4	V	34.2	Very low	31.8	Very low	144 Å²	144	172.4 Å²	172.4	87%	0.873	89%	0.888	S	S	*	*			trans	-79.8	90.6	178.3	-178.9	0	0	0	0	107.9	Q6	V4-Q6 PolarHBondContact O-N 3.35Å
5	R	32.6	Very low	32	Very low	242 Å²	242	170.3 Å²	170.3	91%	0.913	88%	0.879	S	S	*	*			trans	-74.8	104.1	176.6	-114.3	178.5	177.6	178.6	-0.6	109.5	G3 R7	G3-R5 PolarHBondContact O-N 3.1Å; G3-R5 VanDerWaalsContact O-N 3.1Å; R5-R7 PolarHBondContact O-N 3.23Å
6	Q	31.3	Very low	32.2	Very low	185 Å²	185	167.9 Å²	167.9	86%	0.864	87%	0.868	S	S	*	*			trans	-56.5	119.3	166.2	-71.8	176.4	-26.6	0	0	110.4	V4	V4-Q6 PolarHBondContact O-N 3.35Å
7	R	30.4	Very low	32.7	Very low	250 Å²	250	164 Å²	164	94%	0.943	86%	0.859	S	S	*	*			trans	-92.2	115.5	164.5	-90.3	-176.1	172.8	176.7	-1.2	108.8	R5	R5-R7 PolarHBondContact O-N 3.23Å
8	K	29.8	Very low	33.1	Very low	205 Å²	205	159.8 Å²	159.8	89%	0.891	85%	0.846	S	S	*	*	P	Polyproline II helix	trans	-61.6	142.2	172.3	-82.8	-179.8	172.1	-179.6	0	111.5
9	A	28.4	Very low	33.7	Very low	103 Å²	103	154.3 Å²	154.3	85%	0.851	83%	0.825	S	S	*	*	P	Polyproline II helix	trans	-59.9	126.6	175	0	0	0	0	0	111.5
10	K	31.7	Very low	34	Very low	199 Å²	199	154.2 Å²	154.2	87%	0.865	82%	0.819	S	S	*	*	P	Polyproline II helix	trans	-93.7	124.8	164	-93.6	-175.1	172.9	-175.1	0	108.2	L12	K10-L12 PolarHBondContact O-N 3.45Å
11	T	30.5	Very low	34.3	Very low	142 Å²	142	153.9 Å²	153.9	87%	0.871	81%	0.813	S	S	*	*	P	Polyproline II helix	trans	-54.1	120.7	174.8	-13.4	0	0	0	0	110.3	Q13	T11-Q13 PolarHBondContact O-N 3.49Å
12	L	31.1	Very low	34.8	Very low	168 Å²	168	144.7 Å²	144.7	88%	0.88	78%	0.78	S	S	*	*	P	Polyproline II helix	trans	-72.9	119.6	168.9	-90.9	120.9	0	0	0	108.2	K10	K10-L12 PolarHBondContact O-N 3.45Å
13	Q	31.6	Very low	35	Very low	188 Å²	188	143.6 Å²	143.6	88%	0.879	76%	0.763	S	S	*	*	P	Polyproline II helix	trans	-91.9	135.7	166.7	-124.7	172.5	-15.4	0	0	107.7	T11 D15	T11-Q13 PolarHBondContact O-N 3.49Å; Q13-D15 PolarHBondContact O-N 3.31Å
14	D	33.6	Very low	35.3	Very low	147 Å²	147	148.5 Å²	148.5	79%	0.786	77%	0.765	S	S	*	*			trans	-66.1	108	-172.8	-66.2	-52.7	0	0	0	113.1
15	D	34.3	Very low	35.4	Very low	141 Å²	141	150 Å²	150	75%	0.754	76%	0.756	S	S	*	*			trans	-117.2	71.4	164.4	-85.7	-28.5	0	0	0	109.6	Q13 S17	Q13-D15 PolarHBondContact O-N 3.31Å; D15-S17 VanDerWaalsContact C-N 3.26Å; D15-S17 PolarHBondContact O-N 3.24Å
16	N	36.1	Very low	35.8	Very low	132 Å²	132	141.6 Å²	141.6	71%	0.706	74%	0.738	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.2	22.2	-173.9	-119.9	-7.3	0	0	0	114.6
17	S	39.3	Very low	36.2	Very low	102 Å²	102	139.3 Å²	139.3	71%	0.713	73%	0.727	S	S	*	*	T	Hydrogen-bonded Turn	trans	-102.1	-13.8	-178.1	66.8	0	0	0	0	114.9	D15	D15-S17 VanDerWaalsContact C-N 3.26Å; D15-S17 PolarHBondContact O-N 3.24Å
18	S	41.2	Very low	36.5	Very low	89 Å²	89	130.3 Å²	130.3	62%	0.622	70%	0.702	S	S	*	*	S	Bend	trans	-91.4	-23	-179.8	62.4	0	0	0	0	114.2	H20 Q21	S18-H20 VanDerWaalsContact C-N 3.34Å; S18-H20 PolarHBondContact O-N 3.49Å; S18-Q21 PolarHBondContact O-N 3.39Å
19	A	43.4	Very low	36.9	Very low	55 Å²	55	127.9 Å²	127.9	46%	0.455	69%	0.694	S	S	.	*	H	α-helix	trans	-69.8	-27.4	-177.7	0	0	0	0	0	113.6
20	H	40.5	Very low	37.2	Very low	152 Å²	152	128 Å²	128	70%	0.704	69%	0.687	S	S	*	*	H	α-helix	trans	-78.9	-19.2	-179.4	-86.2	-30.8	0	0	0	114.8	S18	S18-H20 VanDerWaalsContact C-N 3.34Å; S18-H20 PolarHBondContact O-N 3.49Å
21	Q	40.4	Very low	37.3	Very low	147 Å²	147	122.2 Å²	122.2	69%	0.687	67%	0.672	S	S	*	*	H	α-helix	trans	-82.6	-30.6	172.4	-96.3	176.2	-21	0	0	112.7	S18 L23 K24	S18-Q21 PolarHBondContact O-N 3.39Å; Q21-L23 PolarHBondContact O-N 3.47Å; Q21-K24 PolarHBondContact O-N 3.48Å
22	G	40.7	Very low	37.5	Very low	47 Å²	47	124.3 Å²	124.3	49%	0.485	67%	0.669	S	S	.	*	H	α-helix	trans	-63.4	-39	175.7	0	0	0	0	0	113.6	K24 Y25 A26	G22-K24 PolarHBondContact O-N 3.22Å; G22-Y25 PolarHBondContact O-N 3.41Å; G22-A26 PolarHBondContact O-N 3.41Å
23	L	39.1	Very low	37.6	Very low	108 Å²	108	125.6 Å²	125.6	57%	0.565	66%	0.664	S	S	*	*	H	α-helix	trans	-68.5	-31.3	-179.1	-108.5	102.5	0	0	0	113.7	Q21 H27	Q21-L23 PolarHBondContact O-N 3.47Å; L23-H27 PolarHBondContact O-CD2 3.43Å; L23-H27 PolarHBondContact O-N 3.42Å
24	K	40.3	Very low	37.6	Very low	172 Å²	172	120.7 Å²	120.7	75%	0.748	65%	0.65	S	S	*	*	H	α-helix	trans	-72	-33.4	178.2	-85.7	-173.2	176.4	179.7	0	112.8	Q21 G22 S28	Q21-K24 PolarHBondContact O-N 3.48Å; G22-K24 PolarHBondContact O-N 3.22Å; K24-S28 PolarHBondContact O-N 3.21Å
25	Y	37.3	Very low	37.6	Very low	177 Å²	177	120.5 Å²	120.5	69%	0.694	65%	0.649	S	S	*	*	H	α-helix	trans	-73.9	-39	176.2	-84	-80.1	0	0	0	112.2	G22 H27 S28 E29	G22-Y25 PolarHBondContact O-N 3.41Å; Y25-H27 VanDerWaalsContact C-N 3.34Å; Y25-H27 PolarHBondContact O-N 3.44Å; Y25-S28 PolarHBondContact O-N 3.29Å; Y25-S28 VanDerWaalsContact O-N 3.11Å; Y25-S28 PolarHBondContact O-OG 3.11Å; Y25-E29 PolarHBondContact O-N 2.74Å
26	A	41.9	Very low	37.5	Very low	64 Å²	64	117.7 Å²	117.7	53%	0.529	64%	0.641	S	S	.	*	H	α-helix	trans	-62.9	-36.8	175.9	0	0	0	0	0	113	G22 S28 C30	G22-A26 PolarHBondContact O-N 3.41Å; A26-S28 VanDerWaalsContact C-N 3.31Å; A26-S28 PolarHBondContact O-N 3.43Å; A26-C30 PolarHBondContact O-N 2.93Å
27	H	38	Very low	37.4	Very low	137 Å²	137	117.8 Å²	117.8	63%	0.634	64%	0.641	S	S	*	*	H	α-helix	trans	-68.7	-27.4	174.8	-90.8	-69	0	0	0	113.6	L23 Y25	L23-H27 PolarHBondContact O-CD2 3.43Å; L23-H27 PolarHBondContact O-N 3.42Å; Y25-H27 VanDerWaalsContact C-N 3.34Å; Y25-H27 PolarHBondContact O-N 3.44Å
28	S	37.9	Very low	37.1	Very low	61 Å²	61	121.5 Å²	121.5	43%	0.427	65%	0.645	S	S	.	*	H	α-helix	trans	-76.4	-38.6	179.3	81.6	0	0	0	0	112.7	K24 Y25 A26 S31	K24-S28 PolarHBondContact O-N 3.21Å; Y25-S28 PolarHBondContact O-N 3.29Å; Y25-S28 VanDerWaalsContact O-N 3.11Å; Y25-S28 PolarHBondContact O-OG 3.11Å; A26-S28 VanDerWaalsContact C-N 3.31Å; A26-S28 PolarHBondContact O-N 3.43Å; S28-S31 PolarHBondContact O-N 3.24Å; S28-S31 PolarHBondContact O-OG 2.76Å
29	E	38.1	Very low	36.6	Very low	155 Å²	155	124.9 Å²	124.9	72%	0.724	65%	0.648	S	S	*	*	H	α-helix	trans	-74.5	-32.3	177.4	-79	-165	147.2	0	0	112.8	Y25 S31 K32	Y25-E29 PolarHBondContact O-N 2.74Å; E29-S31 PolarHBondContact O-N 3.37Å; E29-K32 PolarHBondContact O-N 2.78Å
30	C	33.3	Very low	36.1	Very low	104 Å²	104	127.5 Å²	127.5	70%	0.703	66%	0.658	S	S	*	*	H	α-helix	trans	-67.8	-18.3	177.7	-150.9	0	0	0	0	113	A26	A26-C30 PolarHBondContact O-N 2.93Å
31	S	34.6	Very low	35.8	Very low	79 Å²	79	126 Å²	126	55%	0.552	66%	0.655	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.4	-11.8	175.9	73.3	0	0	0	0	115	S28 E29	S28-S31 PolarHBondContact O-N 3.24Å; S28-S31 PolarHBondContact O-OG 2.76Å; E29-S31 PolarHBondContact O-N 3.37Å
32	K	35.2	Very low	35.6	Very low	185 Å²	185	126 Å²	126	80%	0.804	65%	0.649	S	S	*	*	T	Hydrogen-bonded Turn	trans	-89.8	-7.9	178.4	-86.4	-175.5	177.4	176.2	0	114.4	E29	E29-K32 PolarHBondContact O-N 2.78Å
33	Y	32.4	Very low	35.5	Very low	195 Å²	195	128.1 Å²	128.1	77%	0.765	65%	0.654	S	S	*	*	T	Hydrogen-bonded Turn	trans	-103.3	15.4	177.8	-96	-84	0	0	0	114.6	N35	Y33-N35 VanDerWaalsContact C-N 3.28Å; Y33-N35 PolarHBondContact O-N 2.83Å
34	S	32.6	Very low	35.5	Very low	86 Å²	86	129.3 Å²	129.3	60%	0.601	65%	0.652	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83	6.4	177.6	74.5	0	0	0	0	115.2
35	N	32.5	Very low	35.6	Very low	143 Å²	143	121.9 Å²	121.9	77%	0.765	62%	0.622	S	S	*	*	T	Hydrogen-bonded Turn	trans	-100	9.3	-177.9	-100.9	-22.5	0	0	0	115.4	Y33	Y33-N35 VanDerWaalsContact C-N 3.28Å; Y33-N35 PolarHBondContact O-N 2.83Å
36	S	32.8	Very low	35.6	Very low	82 Å²	82	116.7 Å²	116.7	57%	0.573	61%	0.606	S	S	*	*	S	Bend	trans	-97.2	-5.5	174.2	53	0	0	0	0	115.6	K38	S36-K38 VanDerWaalsContact C-N 3.25Å; S36-K38 PolarHBondContact O-N 2.91Å
37	D	33.4	Very low	35.8	Very low	133 Å²	133	120.3 Å²	120.3	71%	0.711	61%	0.61	S	S	*	*	G	3₁₀ helix	trans	-80.5	3.8	-176.7	-77.5	-14.6	0	0	0	115.2	F39	D37-F39 PolarHBondContact O-N 2.81Å; D37-F39 VanDerWaalsContact O-N 3.13Å
38	K	33.1	Very low	36.2	Very low	181 Å²	181	122 Å²	122	79%	0.787	61%	0.611	S	S	*	*	G	3₁₀ helix	trans	-72.7	1.4	175.6	-81.8	-172.3	177.5	178	0	115	S36	S36-K38 VanDerWaalsContact C-N 3.25Å; S36-K38 PolarHBondContact O-N 2.91Å
39	F	30.5	Very low	36.9	Very low	159 Å²	159	121.9 Å²	121.9	70%	0.697	61%	0.605	S	S	*	*	G	3₁₀ helix	trans	-93.5	-0.9	-178.7	-104	-82.9	0	0	0	116.1	D37	D37-F39 PolarHBondContact O-N 2.81Å; D37-F39 VanDerWaalsContact O-N 3.13Å
40	V	34.2	Very low	37.8	Very low	110 Å²	110	117.9 Å²	117.9	67%	0.667	59%	0.593	S	S	*	*	S	Bend	trans	-117.9	24.2	-173.3	-159.5	0	0	0	0	114.5	K526	V40-K526 PolarHBondContact O-NZ 3.47Å
41	D	34.6	Very low	39	Very low	120 Å²	120	114.5 Å²	114.5	64%	0.642	57%	0.571	S	S	*	*			trans	-102.1	29	173.4	-82.8	-21.9	0	0	0	113.8	K526	D41-K526 IonicContact OD1-NZ 2.78Å; D41-K526 PolarHBondContact OD1-NZ 3.28Å
42	R	35.3	Very low	40.4	Very low	147 Å²	147	113.9 Å²	113.9	56%	0.555	56%	0.564	S	S	*	*			trans	-87.6	130.5	-179.5	-76.1	-172.1	179.2	177.9	0.1	112.2	Y44	R42-Y44 HydrophobicContact CB-CD2 3.65Å; R42-Y44 HydrophobicContact CB-CE2 3.2Å; R42-Y44 WeakPolarHBondContact CD-OH 2.95Å; R42-Y44 HydrophobicContact CG-CE2 4.18Å; R42-Y44 PolarHBondContact NH1-OH 3.26Å; R42-Y44 WeakPolarHBondContact O-CD2 3.28Å; R42-Y44 PolarHBondContact O-N 3.19Å
43	P	37.6	Very low	41.9	Very low	92 Å²	92	108 Å²	108	60%	0.597	54%	0.541	S	S	*	.			trans	-80.8	57	-169.6	35.9	-37.5	0	0	0	112.1	S45 L46	P43-S45 VanDerWaalsContact C-N 3.3Å; P43-S45 PolarHBondContact O-N 3.09Å; P43-L46 PolarHBondContact O-N 2.83Å
44	Y	39.3	Very low	43.7	Very low	133 Å²	133	101.4 Å²	101.4	52%	0.522	53%	0.526	S	S	.	.	H	α-helix	trans	-66	-28.6	-176.3	-69.2	-70.3	0	0	0	112.9	R42 F47 W48	R42-Y44 HydrophobicContact CB-CD2 3.65Å; R42-Y44 HydrophobicContact CB-CE2 3.2Å; R42-Y44 WeakPolarHBondContact CD-OH 2.95Å; R42-Y44 HydrophobicContact CG-CE2 4.18Å; R42-Y44 PolarHBondContact NH1-OH 3.26Å; R42-Y44 WeakPolarHBondContact O-CD2 3.28Å; R42-Y44 PolarHBondContact O-N 3.19Å; Y44-F47 WeakPolarHBondContact O-CB 3.11Å; Y44-F47 PolarHBondContact O-N 3.05Å; Y44-W48 PolarHBondContact O-N 2.86Å
45	S	44.2	Very low	45.7	Very low	16 Å²	16	101.5 Å²	101.5	11%	0.112	52%	0.519	C	S	.	.	H	α-helix	trans	-70.6	-31.7	179.4	43	0	0	0	0	115.1	P43 F47 W48 L49 S523 F527	P43-S45 VanDerWaalsContact C-N 3.3Å; P43-S45 PolarHBondContact O-N 3.09Å; S45-F47 VanDerWaalsContact C-N 3.31Å; S45-W48 PolarHBondContact O-N 3.37Å; S45-L49 PolarHBondContact O-N 3.36Å; S45-S523 WeakPolarHBondContact CB-O 3.43Å; S45-S523 WeakPolarHBondContact CB-OG 3.36Å; S45-S523 PolarHBondContact OG-O 3.19Å; S45-S523 PolarHBondContact OG-OG 2.75Å; S45-F527 WeakPolarHBondContact OG-CD2 3.1Å
46	L	35.9	Very low	47.5	Very low	69 Å²	69	99.8 Å²	99.8	36%	0.361	51%	0.505	S	S	.	.	H	α-helix	trans	-59.7	-47.9	172	-112.4	152.8	0	0	0	110	P43 W48 C50 F527	P43-L46 PolarHBondContact O-N 2.83Å; L46-W48 VanDerWaalsContact C-N 3.34Å; L46-W48 PolarHBondContact O-N 2.67Å; L46-C50 WeakPolarHBondContact O-CB 3.48Å; L46-C50 PolarHBondContact O-N 3.46Å; L46-C50 PolarHBondContact O-SG 2.81Å; L46-C50 VanDerWaalsContact O-SG 3.34Å; L46-F527 HydrophobicContact CB-CD2 3.88Å; L46-F527 HydrophobicContact CB-CE2 3.75Å; L46-F527 HydrophobicContact CB-CG 4.39Å; L46-F527 HydrophobicContact CB-CZ 4.09Å; L46-F527 HydrophobicContact CD1-CD1 3.59Å; L46-F527 HydrophobicContact CD1-CD2 4.13Å; L46-F527 HydrophobicContact CD1-CE1 3.81Å; L46-F527 HydrophobicContact CD1-CE2 4.36Å; L46-F527 HydrophobicContact CD1-CG 3.77Å; L46-F527 HydrophobicContact CD1-CZ 4.2Å; L46-F527 HydrophobicContact CD2-CD1 4.07Å; L46-F527 HydrophobicContact CD2-CD2 4.43Å; L46-F527 HydrophobicContact CD2-CE1 3.37Å; L46-F527 HydrophobicContact CD2-CE2 3.83Å; L46-F527 HydrophobicContact CD2-CZ 3.22Å; L46-F527 HydrophobicContact CG-CD1 3.52Å; L46-F527 HydrophobicContact CG-CD2 3.49Å; L46-F527 VanDerWaalsContact CG-CD2 3.49Å; L46-F527 HydrophobicContact CG-CE1 3.33Å; L46-F527 HydrophobicContact CG-CE2 3.32Å; L46-F527 HydrophobicContact CG-CG 3.62Å; L46-F527 HydrophobicContact CG-CZ 3.22Å; L46-F527 VanDerWaalsContact N-CD2 3.33Å
47	F	45.6	Very low	49.3	Very low	140 Å²	140	99.4 Å²	99.4	61%	0.614	50%	0.496	S	S	*	.	H	α-helix	trans	-58.8	-48.2	175.7	-168.5	-99.7	0	0	0	110.4	Y44 S45 S51	Y44-F47 WeakPolarHBondContact O-CB 3.11Å; Y44-F47 PolarHBondContact O-N 3.05Å; S45-F47 VanDerWaalsContact C-N 3.31Å; F47-S51 WeakPolarHBondContact O-CA 3.27Å; F47-S51 WeakPolarHBondContact O-CB 3.42Å; F47-S51 PolarHBondContact O-N 3.07Å; F47-S51 PolarHBondContact O-OG 2.93Å
48	W	46.4	Very low	51.2	Low	172 Å²	172	95 Å²	95	65%	0.652	48%	0.479	S	S	*	.	H	α-helix	trans	-65.5	-45.6	179.5	-73.9	110.9	0	0	0	114.5	Y44 S45 L46 S51 V52	Y44-W48 PolarHBondContact O-N 2.86Å; S45-W48 PolarHBondContact O-N 3.37Å; L46-W48 VanDerWaalsContact C-N 3.34Å; L46-W48 PolarHBondContact O-N 2.67Å; W48-S51 PolarHBondContact O-N 3.09Å; W48-V52 WeakPolarHBondContact O-CB 3.44Å; W48-V52 WeakPolarHBondContact O-CG2 3.16Å; W48-V52 PolarHBondContact O-N 2.93Å
49	L	53.6	Low	53.1	Low	58 Å²	58	92.7 Å²	92.7	30%	0.304	47%	0.469	S	S	.	.	H	α-helix	trans	-68.4	-44.8	-179.8	-170.1	78.2	0	0	0	111	S45 S51 V52 I53 V506 F527	S45-L49 PolarHBondContact O-N 3.36Å; L49-S51 VanDerWaalsContact C-N 3.31Å; L49-S51 PolarHBondContact O-N 3.21Å; L49-V52 PolarHBondContact O-N 2.92Å; L49-I53 HydrophobicContact CD1-CD1 4.45Å; L49-I53 HydrophobicContact CD2-CD1 4.25Å; L49-I53 HydrophobicContact CG-CD1 3.89Å; L49-I53 HydrophobicContact CG-CG1 4.47Å; L49-I53 WeakPolarHBondContact O-CB 3.32Å; L49-I53 VanDerWaalsContact O-CG1 3.3Å; L49-I53 WeakPolarHBondContact O-CG1 3.34Å; L49-I53 PolarHBondContact O-N 3.41Å; L49-V506 HydrophobicContact CD1-CG1 4.2Å; L49-F527 HydrophobicContact CB-CE2 4.29Å; L49-F527 HydrophobicContact CD2-CE2 4.37Å; L49-F527 HydrophobicContact CD2-CZ 4.15Å
50	C	55.9	Low	54.9	Low	71 Å²	71	89 Å²	89	48%	0.48	45%	0.452	S	S	.	.	H	α-helix	trans	-63.2	-39.3	174.6	-69.8	0	0	0	0	111	L46 A54	L46-C50 WeakPolarHBondContact O-CB 3.48Å; L46-C50 PolarHBondContact O-N 3.46Å; L46-C50 PolarHBondContact O-SG 2.81Å; L46-C50 VanDerWaalsContact O-SG 3.34Å; C50-A54 WeakPolarHBondContact O-CA 3.33Å; C50-A54 WeakPolarHBondContact O-CB 3.44Å; C50-A54 PolarHBondContact O-N 2.79Å
51	S	58.8	Low	56.5	Low	33 Å²	33	88.8 Å²	88.8	23%	0.231	45%	0.446	C	S	.	.	H	α-helix	trans	-65.2	-43.7	173.9	-68.9	0	0	0	0	111.7	F47 W48 L49 A54 I55	F47-S51 WeakPolarHBondContact O-CA 3.27Å; F47-S51 WeakPolarHBondContact O-CB 3.42Å; F47-S51 PolarHBondContact O-N 3.07Å; F47-S51 PolarHBondContact O-OG 2.93Å; W48-S51 PolarHBondContact O-N 3.09Å; L49-S51 VanDerWaalsContact C-N 3.31Å; L49-S51 PolarHBondContact O-N 3.21Å; S51-A54 PolarHBondContact O-N 3.12Å; S51-I55 WeakPolarHBondContact O-CB 3.44Å; S51-I55 VanDerWaalsContact O-CD1 3.29Å; S51-I55 WeakPolarHBondContact O-CD1 3.37Å; S51-I55 WeakPolarHBondContact O-CG1 3.49Å; S51-I55 PolarHBondContact O-N 3.13Å
52	V	64.7	Low	58.2	Low	67 Å²	67	86.7 Å²	86.7	41%	0.406	44%	0.435	S	S	.	.	H	α-helix	trans	-65.6	-45.3	178.4	169.6	0	0	0	0	110.8	W48 L49 I55 F56	W48-V52 WeakPolarHBondContact O-CB 3.44Å; W48-V52 WeakPolarHBondContact O-CG2 3.16Å; W48-V52 PolarHBondContact O-N 2.93Å; L49-V52 PolarHBondContact O-N 2.92Å; V52-I55 PolarHBondContact O-N 3.34Å; V52-F56 HydrophobicContact CG1-CD2 3.87Å; V52-F56 HydrophobicContact CG1-CE2 4.18Å; V52-F56 WeakPolarHBondContact O-CB 3.31Å; V52-F56 WeakPolarHBondContact O-CD2 3.48Å; V52-F56 PolarHBondContact O-N 3.49Å
53	I	67.2	Low	59.7	Low	62 Å²	62	86.9 Å²	86.9	32%	0.318	44%	0.435	S	S	.	.	H	α-helix	trans	-64.2	-44.4	175.7	-67.4	170.7	0	0	0	110.3	L49 I55 F56 L57	L49-I53 HydrophobicContact CD1-CD1 4.45Å; L49-I53 HydrophobicContact CD2-CD1 4.25Å; L49-I53 HydrophobicContact CG-CD1 3.89Å; L49-I53 HydrophobicContact CG-CG1 4.47Å; L49-I53 WeakPolarHBondContact O-CB 3.32Å; L49-I53 VanDerWaalsContact O-CG1 3.3Å; L49-I53 WeakPolarHBondContact O-CG1 3.34Å; L49-I53 PolarHBondContact O-N 3.41Å; I53-I55 VanDerWaalsContact C-N 3.32Å; I53-I55 PolarHBondContact O-N 3.39Å; I53-F56 PolarHBondContact O-N 2.9Å; I53-L57 HydrophobicContact CG2-CD1 3.8Å; I53-L57 HydrophobicContact CG2-CG 4.19Å; I53-L57 WeakPolarHBondContact O-CB 3.06Å; I53-L57 VanDerWaalsContact O-CG 3.3Å; I53-L57 WeakPolarHBondContact O-CG 3.32Å; I53-L57 PolarHBondContact O-N 2.93Å
54	A	70.3	Confident	61.3	Low	55 Å²	55	85 Å²	85	46%	0.455	42%	0.42	S	S	.	.	H	α-helix	trans	-64.3	-37.9	177.2	0	0	0	0	0	111.7	C50 S51 A58	C50-A54 WeakPolarHBondContact O-CA 3.33Å; C50-A54 WeakPolarHBondContact O-CB 3.44Å; C50-A54 PolarHBondContact O-N 2.79Å; S51-A54 PolarHBondContact O-N 3.12Å; A54-A58 WeakPolarHBondContact O-CA 3.43Å; A54-A58 WeakPolarHBondContact O-CB 3.45Å; A54-A58 PolarHBondContact O-N 3.33Å
55	I	74.5	Confident	62.7	Low	89 Å²	89	82.5 Å²	82.5	46%	0.456	42%	0.416	S	S	.	.	H	α-helix	trans	-65.7	-46	173.8	-74	164	0	0	0	109.7	S51 V52 I53 A58 F59	S51-I55 WeakPolarHBondContact O-CB 3.44Å; S51-I55 VanDerWaalsContact O-CD1 3.29Å; S51-I55 WeakPolarHBondContact O-CD1 3.37Å; S51-I55 WeakPolarHBondContact O-CG1 3.49Å; S51-I55 PolarHBondContact O-N 3.13Å; V52-I55 PolarHBondContact O-N 3.34Å; I53-I55 VanDerWaalsContact C-N 3.32Å; I53-I55 PolarHBondContact O-N 3.39Å; I55-A58 PolarHBondContact O-N 3.45Å; I55-F59 HydrophobicContact CG2-CD2 3.47Å; I55-F59 VanDerWaalsContact CG2-CD2 3.47Å; I55-F59 HydrophobicContact CG2-CE2 3.38Å; I55-F59 WeakPolarHBondContact O-CB 3.47Å; I55-F59 WeakPolarHBondContact O-CD2 3.02Å; I55-F59 PolarHBondContact O-N 2.96Å
56	F	69.9	Low	63.7	Low	106 Å²	106	82.2 Å²	82.2	47%	0.465	41%	0.414	S	S	.	.	H	α-helix	trans	-61.5	-48.1	176.4	-102	-81.4	0	0	0	111.8	V52 I53 A58 F59 F60	V52-F56 HydrophobicContact CG1-CD2 3.87Å; V52-F56 HydrophobicContact CG1-CE2 4.18Å; V52-F56 WeakPolarHBondContact O-CB 3.31Å; V52-F56 WeakPolarHBondContact O-CD2 3.48Å; V52-F56 PolarHBondContact O-N 3.49Å; I53-F56 PolarHBondContact O-N 2.9Å; F56-A58 VanDerWaalsContact C-N 3.34Å; F56-F59 PolarHBondContact O-N 3.47Å; F56-F60 HydrophobicContact CD1-CD2 4.35Å; F56-F60 HydrophobicContact CD1-CE2 4.03Å; F56-F60 VanDerWaalsContact O-CD2 3.3Å; F56-F60 WeakPolarHBondContact O-CD2 3.47Å; F56-F60 PolarHBondContact O-N 3.33Å
57	L	71.4	Confident	65.1	Low	75 Å²	75	79.2 Å²	79.2	39%	0.393	40%	0.399	S	S	.	.	H	α-helix	trans	-63	-42.1	176.4	-72.3	174	0	0	0	111	I53 F60 I61	I53-L57 HydrophobicContact CG2-CD1 3.8Å; I53-L57 HydrophobicContact CG2-CG 4.19Å; I53-L57 WeakPolarHBondContact O-CB 3.06Å; I53-L57 VanDerWaalsContact O-CG 3.3Å; I53-L57 WeakPolarHBondContact O-CG 3.32Å; I53-L57 PolarHBondContact O-N 2.93Å; L57-F60 PolarHBondContact O-N 3.23Å; L57-I61 VanDerWaalsContact O-CB 3.3Å; L57-I61 WeakPolarHBondContact O-CB 3.16Å; L57-I61 WeakPolarHBondContact O-CD1 3.29Å; L57-I61 WeakPolarHBondContact O-CG1 3.29Å; L57-I61 PolarHBondContact O-N 3.38Å
58	A	72.7	Confident	66.7	Low	41 Å²	41	75.6 Å²	75.6	34%	0.339	39%	0.386	S	S	.	.	H	α-helix	trans	-61	-45.5	173.7	0	0	0	0	0	110.3	A54 I55 F56 F60 I61 I62	A54-A58 WeakPolarHBondContact O-CA 3.43Å; A54-A58 WeakPolarHBondContact O-CB 3.45Å; A54-A58 PolarHBondContact O-N 3.33Å; I55-A58 PolarHBondContact O-N 3.45Å; F56-A58 VanDerWaalsContact C-N 3.34Å; A58-F60 PolarHBondContact O-N 2.88Å; A58-I61 PolarHBondContact O-N 3.28Å; A58-I62 HydrophobicContact CB-CD1 4.11Å; A58-I62 WeakPolarHBondContact O-CA 3.32Å; A58-I62 WeakPolarHBondContact O-CB 3.39Å; A58-I62 VanDerWaalsContact O-CD1 3.28Å; A58-I62 WeakPolarHBondContact O-CD1 3.48Å; A58-I62 WeakPolarHBondContact O-CG1 3.33Å; A58-I62 PolarHBondContact O-N 3.04Å
59	F	71.9	Confident	68.6	Low	132 Å²	132	67.6 Å²	67.6	58%	0.579	36%	0.356	S	S	*	.	H	α-helix	trans	-61.6	-42.2	175.5	-86	-65.6	0	0	0	112.3	I55 F56 W63	I55-F59 HydrophobicContact CG2-CD2 3.47Å; I55-F59 VanDerWaalsContact CG2-CD2 3.47Å; I55-F59 HydrophobicContact CG2-CE2 3.38Å; I55-F59 WeakPolarHBondContact O-CB 3.47Å; I55-F59 WeakPolarHBondContact O-CD2 3.02Å; I55-F59 PolarHBondContact O-N 2.96Å; F56-F59 PolarHBondContact O-N 3.47Å; F59-W63 WeakPolarHBondContact O-CA 3.48Å; F59-W63 WeakPolarHBondContact O-CB 3.49Å; F59-W63 PolarHBondContact O-N 3.38Å
60	F	69	Low	70	Confident	81 Å²	81	70 Å²	70	36%	0.355	36%	0.361	S	S	.	.	H	α-helix	trans	-66.3	-46.3	177.3	-91.3	-74.2	0	0	0	112.3	F56 L57 A58 W63 D64 I497	F56-F60 HydrophobicContact CD1-CD2 4.35Å; F56-F60 HydrophobicContact CD1-CE2 4.03Å; F56-F60 VanDerWaalsContact O-CD2 3.3Å; F56-F60 WeakPolarHBondContact O-CD2 3.47Å; F56-F60 PolarHBondContact O-N 3.33Å; L57-F60 PolarHBondContact O-N 3.23Å; A58-F60 PolarHBondContact O-N 2.88Å; F60-W63 PolarHBondContact O-N 3.09Å; F60-D64 WeakPolarHBondContact O-CB 3.26Å; F60-D64 PolarHBondContact O-N 2.92Å; F60-I497 HydrophobicContact CE1-CD1 4.47Å; F60-I497 HydrophobicContact CE1-CG2 4.31Å; F60-I497 HydrophobicContact CZ-CG2 3.96Å
61	I	68.7	Low	71.2	Confident	105 Å²	105	71 Å²	71	54%	0.538	37%	0.367	S	S	.	.	H	α-helix	trans	-66.8	-46.9	179	-67.4	165.7	0	0	0	110.2	L57 A58 W63 D64 D65	L57-I61 VanDerWaalsContact O-CB 3.3Å; L57-I61 WeakPolarHBondContact O-CB 3.16Å; L57-I61 WeakPolarHBondContact O-CD1 3.29Å; L57-I61 WeakPolarHBondContact O-CG1 3.29Å; L57-I61 PolarHBondContact O-N 3.38Å; A58-I61 PolarHBondContact O-N 3.28Å; I61-W63 VanDerWaalsContact C-N 3.29Å; I61-W63 PolarHBondContact O-N 3.06Å; I61-D64 PolarHBondContact O-N 3.3Å; I61-D65 VanDerWaalsContact O-CB 3.27Å; I61-D65 WeakPolarHBondContact O-CB 3.43Å; I61-D65 PolarHBondContact O-N 2.98Å
62	I	69	Low	71.9	Confident	77 Å²	77	71 Å²	71	40%	0.395	37%	0.366	S	S	.	.	H	α-helix	trans	-63.4	-38.8	176.6	-66.5	164.3	0	0	0	109.8	A58 S66 F415	A58-I62 HydrophobicContact CB-CD1 4.11Å; A58-I62 WeakPolarHBondContact O-CA 3.32Å; A58-I62 WeakPolarHBondContact O-CB 3.39Å; A58-I62 VanDerWaalsContact O-CD1 3.28Å; A58-I62 WeakPolarHBondContact O-CD1 3.48Å; A58-I62 WeakPolarHBondContact O-CG1 3.33Å; A58-I62 PolarHBondContact O-N 3.04Å; I62-S66 WeakPolarHBondContact O-CA 3.25Å; I62-S66 WeakPolarHBondContact O-CB 3.39Å; I62-S66 PolarHBondContact O-N 3.39Å; I62-S66 PolarHBondContact O-OG 3.45Å; I62-F415 HydrophobicContact CG2-CD1 3.66Å; I62-F415 HydrophobicContact CG2-CE1 3.54Å
63	W	67.6	Low	71.9	Confident	150 Å²	150	73.7 Å²	73.7	57%	0.568	39%	0.388	S	S	*	.	H	α-helix	trans	-64.2	-50.1	176.2	-179.5	-94.7	0	0	0	111.1	F59 F60 I61 S66 S67 L289	F59-W63 WeakPolarHBondContact O-CA 3.48Å; F59-W63 WeakPolarHBondContact O-CB 3.49Å; F59-W63 PolarHBondContact O-N 3.38Å; F60-W63 PolarHBondContact O-N 3.09Å; I61-W63 VanDerWaalsContact C-N 3.29Å; I61-W63 PolarHBondContact O-N 3.06Å; W63-S66 WeakPolarHBondContact CA-OG 3.38Å; W63-S66 PolarHBondContact O-N 3.08Å; W63-S66 PolarHBondContact O-OG 3.11Å; W63-S67 WeakPolarHBondContact O-CB 3.44Å; W63-S67 PolarHBondContact O-N 2.97Å; W63-S67 PolarHBondContact O-OG 2.95Å; W63-L289 HydrophobicContact CH2-CD1 4.35Å
64	D	70.6	Confident	71.9	Confident	52 Å²	52	74.6 Å²	74.6	28%	0.278	39%	0.394	S	S	.	.	H	α-helix	trans	-61.4	-48.4	180	-168.8	46.1	0	0	0	111.6	F60 I61 S67 D68 K261	F60-D64 WeakPolarHBondContact O-CB 3.26Å; F60-D64 PolarHBondContact O-N 2.92Å; I61-D64 PolarHBondContact O-N 3.3Å; D64-S67 PolarHBondContact O-N 3.44Å; D64-S67 PolarHBondContact O-OG 2.92Å; D64-D68 PolarHBondContact O-N 3.47Å; D64-K261 PolarHBondContact O-NZ 3.39Å; D64-K261 IonicContact OD1-NZ 3.78Å; D64-K261 PolarHBondContact OD1-NZ 3.41Å; D64-K261 IonicContact OD2-NZ 3.87Å
65	D	68.1	Low	71.6	Confident	81 Å²	81	76.8 Å²	76.8	43%	0.433	41%	0.405	S	S	.	.	H	α-helix	trans	-65.6	-41.7	175.9	-172	58.5	0	0	0	111.6	I61 S67 D68 W70	I61-D65 VanDerWaalsContact O-CB 3.27Å; I61-D65 WeakPolarHBondContact O-CB 3.43Å; I61-D65 PolarHBondContact O-N 2.98Å; D65-S67 PolarHBondContact O-N 3.07Å; D65-D68 WeakPolarHBondContact O-CB 3.42Å; D65-D68 PolarHBondContact O-N 2.99Å; D65-D68 VanDerWaalsContact O-N 3.09Å; D65-W70 WeakPolarHBondContact O-CZ2 3.04Å; D65-W70 WeakPolarHBondContact OD2-CZ2 3.36Å
66	S	66.3	Low	71	Confident	11 Å²	11	74 Å²	74	8%	0.077	39%	0.394	C	S	.	.	H	α-helix	trans	-63.2	-29.3	177.4	75.8	0	0	0	0	111.5	I62 W63 D68 R262	I62-S66 WeakPolarHBondContact O-CA 3.25Å; I62-S66 WeakPolarHBondContact O-CB 3.39Å; I62-S66 PolarHBondContact O-N 3.39Å; I62-S66 PolarHBondContact O-OG 3.45Å; W63-S66 WeakPolarHBondContact CA-OG 3.38Å; W63-S66 PolarHBondContact O-N 3.08Å; W63-S66 PolarHBondContact O-OG 3.11Å; S66-D68 VanDerWaalsContact C-N 3.29Å; S66-R262 PolarHBondContact O-NH1 3.38Å; S66-R262 PolarHBondContact O-NH2 2.88Å
67	S	64.7	Low	71.1	Confident	5 Å²	5	69.1 Å²	69.1	4%	0.035	37%	0.373	C	S	.	.	H	α-helix	trans	-74.2	-17.9	179.2	70.7	0	0	0	0	113.3	W63 D64 D65 K261 R262	W63-S67 WeakPolarHBondContact O-CB 3.44Å; W63-S67 PolarHBondContact O-N 2.97Å; W63-S67 PolarHBondContact O-OG 2.95Å; D64-S67 PolarHBondContact O-N 3.44Å; D64-S67 PolarHBondContact O-OG 2.92Å; D65-S67 PolarHBondContact O-N 3.07Å; S67-K261 WeakPolarHBondContact O-CB 3.33Å; S67-K261 WeakPolarHBondContact OG-CD 3.38Å; S67-K261 WeakPolarHBondContact OG-CE 3.43Å; S67-K261 PolarHBondContact OG-NZ 3.21Å; S67-R262 WeakPolarHBondContact O-CG 3.34Å; S67-R262 PolarHBondContact O-NE 3.41Å
68	D	79.4	Confident	71.1	Confident	64 Å²	64	70.4 Å²	70.4	34%	0.342	39%	0.388	S	S	.	.	S	Bend	trans	-64.7	156.8	177.2	-82.3	-0.5	0	0	0	112.3	D64 D65 S66 W70 K261	D64-D68 PolarHBondContact O-N 3.47Å; D65-D68 WeakPolarHBondContact O-CB 3.42Å; D65-D68 PolarHBondContact O-N 2.99Å; D65-D68 VanDerWaalsContact O-N 3.09Å; S66-D68 VanDerWaalsContact C-N 3.29Å; D68-W70 PolarHBondContact O-NE1 3.45Å; D68-K261 VanDerWaalsContact OD1-CD 3.24Å; D68-K261 WeakPolarHBondContact OD1-CD 3.32Å; D68-K261 WeakPolarHBondContact OD1-CE 3.42Å; D68-K261 IonicContact OD1-NZ 3.27Å; D68-K261 PolarHBondContact OD1-NZ 2.95Å
69	C	86.7	Confident	71.5	Confident	5 Å²	5	71 Å²	71	3%	0.034	39%	0.39	C	S	.	.	P	Polyproline II helix	trans	-84.3	118.9	175.3	-52	0	0	0	0	108.2	K261 R345 C346 L349	C69-K261 VanDerWaalsContact SG-C 3.5Å; C69-K261 PolarHBondContact SG-O 3.25Å; C69-K261 VanDerWaalsContact SG-O 3.39Å; C69-R345 HydrophobicContact CB-CG 4.25Å; C69-R345 WeakPolarHBondContact O-CD 3.5Å; C69-R345 PolarHBondContact O-NH1 2.88Å; C69-C346 HydrophobicContact CB-CB 3.95Å; C69-C346 WeakPolarHBondContact CB-SG 3.3Å; C69-C346 WeakPolarHBondContact SG-CA 3.36Å; C69-C346 WeakPolarHBondContact SG-CB 3.38Å; C69-C346 CovalentContact SG-SG 2.03Å; C69-C346 PolarHBondContact SG-SG 3.37Å; C69-L349 HydrophobicContact CB-CD2 3.76Å
70	W	83.1	Confident	72.3	Confident	108 Å²	108	65 Å²	65	41%	0.409	36%	0.364	S	S	.	.	P	Polyproline II helix	trans	-89	153.4	174.8	-56.9	88.2	0	0	0	110.6	D65 D68 C72 Q287	D65-W70 WeakPolarHBondContact O-CZ2 3.04Å; D65-W70 WeakPolarHBondContact OD2-CZ2 3.36Å; D68-W70 PolarHBondContact O-NE1 3.45Å; W70-C72 PolarHBondContact O-N 3.26Å; W70-Q287 PolarHBondContact O-NE2 3.07Å
71	P	80	Confident	73.5	Confident	92 Å²	92	64.5 Å²	64.5	60%	0.597	37%	0.365	S	S	*	.	P	Polyproline II helix	trans	-56.9	131.2	176.5	-23.3	33.7	0	0	0	111.9
72	C	73.9	Confident	74.7	Confident	32 Å²	32	60 Å²	60	22%	0.216	34%	0.342	C	S	.	.	P	Polyproline II helix	trans	-91.5	120.7	168.8	-179.3	0	0	0	0	109.8	W70 C77	W70-C72 PolarHBondContact O-N 3.26Å; C72-C77 HydrophobicContact CB-CB 3.83Å; C72-C77 WeakPolarHBondContact CB-SG 3.13Å; C72-C77 WeakPolarHBondContact SG-CB 3.48Å; C72-C77 CovalentContact SG-SG 2.04Å; C72-C77 PolarHBondContact SG-SG 3.41Å
73	S	65.7	Low	76	Confident	124 Å²	124	61.4 Å²	61.4	87%	0.867	35%	0.354	S	S	*	.			trans	-98.6	-2.2	176.5	55.7	0	0	0	0	114.4
74	N	66	Low	77.3	Confident	82 Å²	82	55.7 Å²	55.7	44%	0.439	34%	0.337	S	S	.	.	S	Bend	trans	-68.8	150.6	-177.2	-97.2	-24.8	0	0	0	112.7	S76 C77	N74-S76 VanDerWaalsContact C-N 3.26Å; N74-S76 PolarHBondContact O-N 2.87Å; N74-C77 WeakPolarHBondContact O-CA 3.43Å; N74-C77 VanDerWaalsContact O-CB 3.24Å; N74-C77 WeakPolarHBondContact O-CB 3.39Å; N74-C77 PolarHBondContact O-N 2.81Å
75	S	64.9	Low	78.6	Confident	100 Å²	100	53.2 Å²	53.2	70%	0.699	32%	0.324	S	S	*	.	G	3₁₀ helix	trans	-61.4	-30.1	176.1	56	0	0	0	0	113.5	C77 S78	S75-C77 PolarHBondContact O-N 3.13Å; S75-S78 PolarHBondContact O-N 2.71Å; S75-S78 VanDerWaalsContact O-N 3.09Å; S75-S78 PolarHBondContact O-OG 3.25Å
76	S	61.8	Low	80	Confident	30 Å²	30	50.7 Å²	50.7	21%	0.21	31%	0.308	C	S	.	.	G	3₁₀ helix	trans	-62.9	-26.6	172.5	61.3	0	0	0	0	112.4	N74 S78 S79	N74-S76 VanDerWaalsContact C-N 3.26Å; N74-S76 PolarHBondContact O-N 2.87Å; S76-S78 VanDerWaalsContact C-N 3.32Å; S76-S79 PolarHBondContact O-OG 3.01Å
77	C	71.2	Confident	81.5	Confident	5 Å²	5	52.9 Å²	52.9	3%	0.034	32%	0.323	C	S	.	.	G	3₁₀ helix	trans	-78.8	-15.2	177.3	-61.3	0	0	0	0	112.9	C72 N74 S75 C352	C72-C77 HydrophobicContact CB-CB 3.83Å; C72-C77 WeakPolarHBondContact CB-SG 3.13Å; C72-C77 WeakPolarHBondContact SG-CB 3.48Å; C72-C77 CovalentContact SG-SG 2.04Å; C72-C77 PolarHBondContact SG-SG 3.41Å; N74-C77 WeakPolarHBondContact O-CA 3.43Å; N74-C77 VanDerWaalsContact O-CB 3.24Å; N74-C77 WeakPolarHBondContact O-CB 3.39Å; N74-C77 PolarHBondContact O-N 2.81Å; S75-C77 PolarHBondContact O-N 3.13Å; C77-C352 WeakPolarHBondContact CA-SG 3.02Å; C77-C352 HydrophobicContact CB-CB 4.3Å; C77-C352 WeakPolarHBondContact CB-SG 3.46Å; C77-C352 WeakPolarHBondContact SG-CB 3.5Å; C77-C352 PolarHBondContact SG-SG 3.44Å
78	S	71	Confident	83.1	Confident	101 Å²	101	53.2 Å²	53.2	71%	0.706	33%	0.325	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.3	-22.4	-179.2	65.4	0	0	0	0	113.8	S75 S76	S75-S78 PolarHBondContact O-N 2.71Å; S75-S78 VanDerWaalsContact O-N 3.09Å; S75-S78 PolarHBondContact O-OG 3.25Å; S76-S78 VanDerWaalsContact C-N 3.32Å
79	S	81.9	Confident	84	Confident	55 Å²	55	50.2 Å²	50.2	39%	0.385	31%	0.308	S	S	.	.	S	Bend	trans	-81.3	-14.6	176.8	57.1	0	0	0	0	113.9	S76	S76-S79 PolarHBondContact O-OG 3.01Å
80	F	89.5	Confident	84.6	Confident	4 Å²	4	52.5 Å²	52.5	2%	0.018	32%	0.32	C	S	.	.			trans	-86.4	110.9	-176.1	-170	-94.6	0	0	0	111.4	V82 V85 V201 E204 V205 I208 G351	F80-V82 PolarHBondContact O-N 3Å; F80-V85 HydrophobicContact CE1-CB 4.48Å; F80-V85 HydrophobicContact CE1-CG2 3.62Å; F80-V85 HydrophobicContact CE2-CG2 4.13Å; F80-V85 HydrophobicContact CZ-CB 4.4Å; F80-V85 HydrophobicContact CZ-CG1 4.44Å; F80-V85 HydrophobicContact CZ-CG2 3.32Å; F80-V201 HydrophobicContact CZ-CG1 4.48Å; F80-V201 HydrophobicContact CZ-CG2 4.31Å; F80-E204 HydrophobicContact CD2-CB 4.47Å; F80-E204 HydrophobicContact CD2-CG 3.59Å; F80-E204 HydrophobicContact CE2-CB 3.79Å; F80-E204 HydrophobicContact CE2-CG 3.37Å; F80-E204 HydrophobicContact CG-CG 4.28Å; F80-E204 HydrophobicContact CZ-CB 4.18Å; F80-E204 HydrophobicContact CZ-CG 3.91Å; F80-V205 HydrophobicContact CE2-CG2 4.38Å; F80-I208 HydrophobicContact CB-CD1 4.39Å; F80-I208 HydrophobicContact CD2-CD1 3.97Å; F80-G351 VanDerWaalsContact CE2-CA 3.46Å
81	D	93.6	Very high	85.3	Confident	71 Å²	71	50.7 Å²	50.7	38%	0.38	32%	0.318	S	S	.	.			trans	-83.8	95	-178.6	-170.3	-8.7	0	0	0	111.6	V83 S84 V85 E204	D81-V83 PolarHBondContact O-N 3.39Å; D81-V83 WeakPolarHBondContact OD1-CA 3.25Å; D81-V83 VanDerWaalsContact OD1-CB 3.31Å; D81-V83 WeakPolarHBondContact OD1-CB 3.28Å; D81-V83 PolarHBondContact OD1-N 2.89Å; D81-S84 PolarHBondContact O-N 3.42Å; D81-S84 PolarHBondContact OD1-N 2.7Å; D81-V85 VanDerWaalsContact O-CG2 3.23Å; D81-V85 WeakPolarHBondContact O-CG2 3.45Å; D81-V85 PolarHBondContact O-N 3.34Å; D81-V85 VanDerWaalsContact O-N 3.15Å; D81-E204 WeakPolarHBondContact CB-OE1 3.43Å; D81-E204 PolarHBondContact N-OE1 3.25Å
82	V	94	Very high	86.2	Confident	11 Å²	11	46.3 Å²	46.3	7%	0.067	29%	0.29	C	S	.	.	H	α-helix	trans	-62.3	-25.7	176.4	73.5	0	0	0	0	113.1	F80 R86 N344 L347 R348	F80-V82 PolarHBondContact O-N 3Å; V82-R86 VanDerWaalsContact O-CB 3.24Å; V82-R86 WeakPolarHBondContact O-CB 3.05Å; V82-R86 PolarHBondContact O-N 2.84Å; V82-N344 HydrophobicContact CG2-CB 4.13Å; V82-N344 WeakPolarHBondContact CG2-O 3.31Å; V82-L347 HydrophobicContact CG2-CB 4.1Å; V82-L347 HydrophobicContact CG2-CD2 3.98Å; V82-L347 HydrophobicContact CG2-CG 4.15Å; V82-R348 HydrophobicContact CB-CB 4.41Å; V82-R348 HydrophobicContact CG2-CB 4.22Å
83	V	95.6	Very high	87.3	Confident	106 Å²	106	45.2 Å²	45.2	64%	0.642	28%	0.282	S	S	*	.	H	α-helix	trans	-73.2	-43.4	179	-179.3	0	0	0	0	109.7	D81 R86 S87	D81-V83 PolarHBondContact O-N 3.39Å; D81-V83 WeakPolarHBondContact OD1-CA 3.25Å; D81-V83 VanDerWaalsContact OD1-CB 3.31Å; D81-V83 WeakPolarHBondContact OD1-CB 3.28Å; D81-V83 PolarHBondContact OD1-N 2.89Å; V83-R86 PolarHBondContact O-N 2.84Å; V83-S87 PolarHBondContact O-N 3.21Å
84	S	95.9	Very high	88.8	Confident	30 Å²	30	45.2 Å²	45.2	21%	0.21	27%	0.272	C	S	.	.	H	α-helix	trans	-59.4	-47.7	173.8	-164.8	0	0	0	0	111.4	D81 R86 S87 H88	D81-S84 PolarHBondContact O-N 3.42Å; D81-S84 PolarHBondContact OD1-N 2.7Å; S84-R86 VanDerWaalsContact C-N 3.34Å; S84-R86 PolarHBondContact O-N 3.39Å; S84-S87 WeakPolarHBondContact O-CA 3.22Å; S84-S87 WeakPolarHBondContact O-CB 3.48Å; S84-S87 PolarHBondContact O-N 2.94Å; S84-H88 PolarHBondContact O-CD2 2.87Å; S84-H88 VanDerWaalsContact O-CD2 3.24Å; S84-H88 PolarHBondContact O-N 3.45Å; S84-H88 PolarHBondContact OG-NE2 3.39Å
85	V	97.2	Very high	90.3	Very high	0 Å²	0	44.2 Å²	44.2	0%	0	27%	0.266	C	S	.	.	H	α-helix	trans	-60.9	-44.3	179.5	-178.4	0	0	0	0	111.1	F80 D81 S87 H88 L89 V201 E204 L347	F80-V85 HydrophobicContact CE1-CB 4.48Å; F80-V85 HydrophobicContact CE1-CG2 3.62Å; F80-V85 HydrophobicContact CE2-CG2 4.13Å; F80-V85 HydrophobicContact CZ-CB 4.4Å; F80-V85 HydrophobicContact CZ-CG1 4.44Å; F80-V85 HydrophobicContact CZ-CG2 3.32Å; D81-V85 VanDerWaalsContact O-CG2 3.23Å; D81-V85 WeakPolarHBondContact O-CG2 3.45Å; D81-V85 PolarHBondContact O-N 3.34Å; D81-V85 VanDerWaalsContact O-N 3.15Å; V85-S87 VanDerWaalsContact C-N 3.28Å; V85-S87 PolarHBondContact O-N 3.24Å; V85-H88 PolarHBondContact O-N 3.48Å; V85-L89 WeakPolarHBondContact O-CB 3.36Å; V85-L89 PolarHBondContact O-N 3.35Å; V85-V201 HydrophobicContact CG1-CG2 4.18Å; V85-E204 HydrophobicContact CG2-CB 3.41Å; V85-E204 VanDerWaalsContact CG2-CB 3.41Å; V85-E204 HydrophobicContact CG2-CG 3.63Å; V85-L347 HydrophobicContact CB-CD2 4.11Å; V85-L347 HydrophobicContact CB-CG 4.34Å; V85-L347 HydrophobicContact CG1-CD1 3.55Å; V85-L347 HydrophobicContact CG1-CD2 3.72Å; V85-L347 HydrophobicContact CG1-CG 3.68Å
86	R	97.7	Very high	91.7	Very high	29 Å²	29	40.8 Å²	40.8	11%	0.109	25%	0.246	C	C	.	.	H	α-helix	trans	-59.7	-39.9	174.3	179.4	60.8	58.2	-179.9	-0.9	111.5	V82 V83 S84 L89 I90 E339 I342 N344 L347	V82-R86 VanDerWaalsContact O-CB 3.24Å; V82-R86 WeakPolarHBondContact O-CB 3.05Å; V82-R86 PolarHBondContact O-N 2.84Å; V83-R86 PolarHBondContact O-N 2.84Å; S84-R86 VanDerWaalsContact C-N 3.34Å; S84-R86 PolarHBondContact O-N 3.39Å; R86-L89 PolarHBondContact O-N 2.96Å; R86-I90 HydrophobicContact CG-CD1 3.74Å; R86-I90 HydrophobicContact CG-CG1 4.39Å; R86-I90 WeakPolarHBondContact O-CB 3.4Å; R86-I90 VanDerWaalsContact O-CG1 3.29Å; R86-I90 WeakPolarHBondContact O-CG1 3.2Å; R86-I90 PolarHBondContact O-N 3.29Å; R86-E339 WeakPolarHBondContact CD-OE2 3.41Å; R86-E339 IonicContact CZ-OE2 3.8Å; R86-E339 IonicContact NE-OE2 3.53Å; R86-E339 PolarHBondContact NH1-O 3.19Å; R86-E339 IonicContact NH1-OE2 3.56Å; R86-E339 PolarHBondContact NH1-OE2 3.47Å; R86-I342 PolarHBondContact NH1-O 3.23Å; R86-I342 PolarHBondContact NH2-O 2.82Å; R86-N344 VanDerWaalsContact CZ-OD1 3.3Å; R86-N344 PolarHBondContact NE-OD1 3.16Å; R86-N344 PolarHBondContact NH2-OD1 3.46Å; R86-L347 HydrophobicContact CB-CD2 4.34Å
87	S	98.2	Very high	93.4	Very high	56 Å²	56	41.2 Å²	41.2	39%	0.392	25%	0.249	S	C	.	.	H	α-helix	trans	-65.1	-43.8	177.9	-170.1	0	0	0	0	112.2	V83 S84 V85 L89 N91	V83-S87 PolarHBondContact O-N 3.21Å; S84-S87 WeakPolarHBondContact O-CA 3.22Å; S84-S87 WeakPolarHBondContact O-CB 3.48Å; S84-S87 PolarHBondContact O-N 2.94Å; V85-S87 VanDerWaalsContact C-N 3.28Å; V85-S87 PolarHBondContact O-N 3.24Å; S87-L89 VanDerWaalsContact C-N 3.3Å; S87-L89 PolarHBondContact O-N 3.25Å; S87-N91 WeakPolarHBondContact O-CB 3.4Å; S87-N91 PolarHBondContact O-N 3.22Å; S87-N91 PolarHBondContact O-ND2 2.95Å
88	H	98.2	Very high	94.7	Very high	13 Å²	13	41 Å²	41	6%	0.06	25%	0.247	C	C	.	.	H	α-helix	trans	-57.4	-48	174.2	-63.9	-51.8	0	0	0	110.6	S84 V85 N91 V92 Y112 E116 F196 L203	S84-H88 PolarHBondContact O-CD2 2.87Å; S84-H88 VanDerWaalsContact O-CD2 3.24Å; S84-H88 PolarHBondContact O-N 3.45Å; S84-H88 PolarHBondContact OG-NE2 3.39Å; V85-H88 PolarHBondContact O-N 3.48Å; H88-N91 PolarHBondContact O-N 3.13Å; H88-V92 PolarHBondContact O-N 3Å; H88-Y112 AromaticContact ND1-CE1 3.94Å; H88-Y112 AromaticContact ND1-CZ 3.78Å; H88-Y112 PolarHBondContact ND1-OH 3.37Å; H88-E116 IonicContact CE1-OE2 3.46Å; H88-E116 PolarHBondContact CE1-OE2 3.23Å; H88-F196 WeakPolarHBondContact O-CE1 3.45Å; H88-L203 HydrophobicContact CB-CD1 4.26Å
89	L	98.1	Very high	96	Very high	0 Å²	0	38.1 Å²	38.1	0%	0	23%	0.226	C	C	.	.	H	α-helix	trans	-58.8	-53.3	-178.9	-175.3	58.1	0	0	0	111.4	V85 R86 S87 N91 V92 T93 A192 F196 V197 S200 E339 I342	V85-L89 WeakPolarHBondContact O-CB 3.36Å; V85-L89 PolarHBondContact O-N 3.35Å; R86-L89 PolarHBondContact O-N 2.96Å; S87-L89 VanDerWaalsContact C-N 3.3Å; S87-L89 PolarHBondContact O-N 3.25Å; L89-N91 PolarHBondContact O-N 3.42Å; L89-V92 PolarHBondContact O-N 3.3Å; L89-T93 HydrophobicContact CD1-CG2 3.76Å; L89-T93 HydrophobicContact CG-CG2 4.4Å; L89-T93 WeakPolarHBondContact O-CB 3.49Å; L89-T93 VanDerWaalsContact O-CG2 3.28Å; L89-T93 WeakPolarHBondContact O-CG2 3.04Å; L89-T93 PolarHBondContact O-N 3.03Å; L89-T93 PolarHBondContact O-OG1 3.1Å; L89-A192 HydrophobicContact CD1-CB 4.32Å; L89-F196 HydrophobicContact CD1-CB 4.35Å; L89-F196 HydrophobicContact CD1-CD1 3.93Å; L89-V197 HydrophobicContact CD1-CB 4.23Å; L89-V197 HydrophobicContact CD2-CB 4.41Å; L89-V197 HydrophobicContact CD2-CG2 4.36Å; L89-S200 WeakPolarHBondContact CA-OG 3.49Å; L89-S200 PolarHBondContact N-OG 3.03Å; L89-E339 HydrophobicContact CD1-CB 4.47Å; L89-E339 HydrophobicContact CD2-CB 3.71Å; L89-E339 HydrophobicContact CG-CB 3.61Å; L89-I342 HydrophobicContact CD2-CD1 3.89Å
90	I	98.3	Very high	96.6	Very high	53 Å²	53	36.9 Å²	36.9	27%	0.272	22%	0.219	S	C	.	.	H	α-helix	trans	-57.6	-48.9	178.7	-70.5	169	0	0	0	111.3	R86 V92 T93 N94 E339	R86-I90 HydrophobicContact CG-CD1 3.74Å; R86-I90 HydrophobicContact CG-CG1 4.39Å; R86-I90 WeakPolarHBondContact O-CB 3.4Å; R86-I90 VanDerWaalsContact O-CG1 3.29Å; R86-I90 WeakPolarHBondContact O-CG1 3.2Å; R86-I90 PolarHBondContact O-N 3.29Å; I90-V92 VanDerWaalsContact C-N 3.31Å; I90-V92 PolarHBondContact O-N 2.71Å; I90-T93 PolarHBondContact O-N 2.78Å; I90-T93 PolarHBondContact O-OG1 3.24Å; I90-N94 VanDerWaalsContact CG2-ND2 3.26Å; I90-N94 WeakPolarHBondContact CG2-ND2 3.31Å; I90-N94 WeakPolarHBondContact O-CB 3.5Å; I90-N94 PolarHBondContact O-N 2.86Å; I90-N94 PolarHBondContact O-ND2 3.42Å; I90-E339 VanDerWaalsContact CG1-CD 3.47Å; I90-E339 HydrophobicContact CG1-CG 3.76Å; I90-E339 VanDerWaalsContact CG1-OE2 3.32Å; I90-E339 WeakPolarHBondContact CG1-OE2 3.43Å
91	N	98.2	Very high	96.9	Very high	71 Å²	71	39.7 Å²	39.7	38%	0.38	25%	0.249	S	C	.	.	H	α-helix	trans	-59	-42.5	-174.1	-77.1	-21	0	0	0	112.3	S87 H88 L89 Y112	S87-N91 WeakPolarHBondContact O-CB 3.4Å; S87-N91 PolarHBondContact O-N 3.22Å; S87-N91 PolarHBondContact O-ND2 2.95Å; H88-N91 PolarHBondContact O-N 3.13Å; L89-N91 PolarHBondContact O-N 3.42Å; N91-Y112 HydrophobicContact CB-CE2 3.91Å; N91-Y112 PolarHBondContact ND2-OH 3.39Å
92	V	98.3	Very high	97.1	Very high	0 Å²	0	37.6 Å²	37.6	0%	0	24%	0.24	C	C	.	.	H	α-helix	trans	-84.3	-38.5	-178.6	179.8	0	0	0	0	112.2	H88 L89 I90 N94 M95 R98 A109 Y112 F196	H88-V92 PolarHBondContact O-N 3Å; L89-V92 PolarHBondContact O-N 3.3Å; I90-V92 VanDerWaalsContact C-N 3.31Å; I90-V92 PolarHBondContact O-N 2.71Å; V92-N94 PolarHBondContact O-N 3.37Å; V92-M95 HydrophobicContact CG1-SD 4.26Å; V92-M95 HydrophobicContact CG2-CE 4.25Å; V92-M95 VanDerWaalsContact O-CB 3.26Å; V92-M95 WeakPolarHBondContact O-CB 3.42Å; V92-M95 WeakPolarHBondContact O-CG 3.4Å; V92-M95 PolarHBondContact O-N 3.01Å; V92-M95 VanDerWaalsContact O-N 3.08Å; V92-R98 PolarHBondContact O-NH1 3.41Å; V92-A109 HydrophobicContact CG1-CB 4.15Å; V92-Y112 HydrophobicContact CG2-CD1 3.31Å; V92-Y112 HydrophobicContact CG2-CE1 3.69Å; V92-Y112 HydrophobicContact CG2-CG 3.81Å; V92-F196 HydrophobicContact CB-CD1 3.87Å; V92-F196 HydrophobicContact CB-CD2 4.17Å; V92-F196 HydrophobicContact CB-CE1 3.44Å; V92-F196 VanDerWaalsContact CB-CE1 3.44Å; V92-F196 HydrophobicContact CB-CE2 3.77Å; V92-F196 HydrophobicContact CB-CG 4.24Å; V92-F196 HydrophobicContact CB-CZ 3.4Å; V92-F196 VanDerWaalsContact CB-CZ 3.4Å; V92-F196 HydrophobicContact CG1-CD1 4.22Å; V92-F196 HydrophobicContact CG1-CD2 3.67Å; V92-F196 HydrophobicContact CG1-CE1 4.06Å; V92-F196 HydrophobicContact CG1-CE2 3.47Å; V92-F196 VanDerWaalsContact CG1-CE2 3.47Å; V92-F196 HydrophobicContact CG1-CG 4.07Å; V92-F196 HydrophobicContact CG1-CZ 3.7Å; V92-F196 HydrophobicContact CG2-CE1 3.63Å; V92-F196 HydrophobicContact CG2-CE2 3.84Å; V92-F196 HydrophobicContact CG2-CZ 3.23Å
93	T	97.6	Very high	97.3	Very high	9 Å²	9	43.6 Å²	43.6	6%	0.055	27%	0.27	C	S	.	.	H	α-helix	trans	-66.3	-28.3	177.6	59.4	0	0	0	0	112.7	L89 I90 M95 G96 A192	L89-T93 HydrophobicContact CD1-CG2 3.76Å; L89-T93 HydrophobicContact CG-CG2 4.4Å; L89-T93 WeakPolarHBondContact O-CB 3.49Å; L89-T93 VanDerWaalsContact O-CG2 3.28Å; L89-T93 WeakPolarHBondContact O-CG2 3.04Å; L89-T93 PolarHBondContact O-N 3.03Å; L89-T93 PolarHBondContact O-OG1 3.1Å; I90-T93 PolarHBondContact O-N 2.78Å; I90-T93 PolarHBondContact O-OG1 3.24Å; T93-M95 PolarHBondContact O-N 3.39Å; T93-G96 PolarHBondContact O-N 2.94Å; T93-A192 HydrophobicContact CG2-CB 3.69Å
94	N	97.5	Very high	97.4	Very high	123 Å²	123	39.6 Å²	39.6	66%	0.658	25%	0.248	S	C	*	.	T	Hydrogen-bonded Turn	trans	-68.6	-12.6	175.2	-77.8	-13.8	0	0	0	113.7	I90 V92 G96	I90-N94 VanDerWaalsContact CG2-ND2 3.26Å; I90-N94 WeakPolarHBondContact CG2-ND2 3.31Å; I90-N94 WeakPolarHBondContact O-CB 3.5Å; I90-N94 PolarHBondContact O-N 2.86Å; I90-N94 PolarHBondContact O-ND2 3.42Å; V92-N94 PolarHBondContact O-N 3.37Å; N94-G96 PolarHBondContact O-N 3.17Å
95	M	97.2	Very high	97.5	Very high	61 Å²	61	38.1 Å²	38.1	30%	0.3	24%	0.238	S	C	.	.	T	Hydrogen-bonded Turn	trans	-70.5	-11.1	169.6	-55.4	175.8	-177	0	0	111.9	V92 T93 A108 A109	V92-M95 HydrophobicContact CG1-SD 4.26Å; V92-M95 HydrophobicContact CG2-CE 4.25Å; V92-M95 VanDerWaalsContact O-CB 3.26Å; V92-M95 WeakPolarHBondContact O-CB 3.42Å; V92-M95 WeakPolarHBondContact O-CG 3.4Å; V92-M95 PolarHBondContact O-N 3.01Å; V92-M95 VanDerWaalsContact O-N 3.08Å; T93-M95 PolarHBondContact O-N 3.39Å; M95-A108 HydrophobicContact CE-CB 4.2Å; M95-A108 HydrophobicContact CG-CB 4.49Å; M95-A108 HydrophobicContact SD-CB 3.62Å; M95-A109 HydrophobicContact SD-CB 4.12Å
96	G	95.8	Very high	97.5	Very high	28 Å²	28	40.1 Å²	40.1	29%	0.289	25%	0.247	S	C	.	.			trans	80.3	-147.6	-176.8	0	0	0	0	0	111.7	T93 N94 R98	T93-G96 PolarHBondContact O-N 2.94Å; N94-G96 PolarHBondContact O-N 3.17Å; G96-R98 PolarHBondContact O-NH1 2.7Å
97	S	97.2	Very high	97.5	Very high	39 Å²	39	42.1 Å²	42.1	27%	0.273	26%	0.262	S	S	.	.			trans	-69.7	129.7	178.6	-172	0	0	0	0	111.5	A104 T185 A186 G188 S189	S97-A104 WeakPolarHBondContact O-CB 3.36Å; S97-T185 PolarHBondContact OG-OG1 2.98Å; S97-A186 PolarHBondContact OG-O 3.49Å; S97-G188 PolarHBondContact OG-N 2.98Å; S97-G188 VanDerWaalsContact OG-N 3.11Å; S97-S189 WeakPolarHBondContact CA-O 3.48Å; S97-S189 WeakPolarHBondContact CB-O 3.26Å; S97-S189 PolarHBondContact OG-O 2.93Å
98	R	98	Very high	97.5	Very high	0 Å²	0	41.1 Å²	41.1	0%	0	26%	0.258	C	S	.	.			trans	-120.7	55.5	-177.6	-54.1	173.7	-62.6	-73	2.8	110	V92 G96 A104 N105 Y183 D184 T185 P190 G191	V92-R98 PolarHBondContact O-NH1 3.41Å; G96-R98 PolarHBondContact O-NH1 2.7Å; R98-A104 HydrophobicContact CB-CB 4.45Å; R98-A104 HydrophobicContact CG-CB 3.97Å; R98-N105 HydrophobicContact CB-CB 3.98Å; R98-N105 WeakPolarHBondContact O-CB 3.47Å; R98-N105 PolarHBondContact O-OD1 3.41Å; R98-Y183 PolarHBondContact NE-O 2.96Å; R98-Y183 PolarHBondContact NH2-O 2.93Å; R98-D184 VanDerWaalsContact O-CA 3.28Å; R98-D184 WeakPolarHBondContact O-CA 2.96Å; R98-D184 VanDerWaalsContact O-CB 3.32Å; R98-D184 WeakPolarHBondContact O-CB 3.16Å; R98-T185 HydrophobicContact CB-CG2 4.09Å; R98-T185 PolarHBondContact N-OG1 2.78Å; R98-T185 PolarHBondContact O-N 3.41Å; R98-P190 VanDerWaalsContact CZ-O 3.3Å; R98-P190 PolarHBondContact NH1-O 3.38Å; R98-P190 PolarHBondContact NH2-O 3.48Å; R98-G191 PolarHBondContact NH2-O 3.31Å
99	T	97.5	Very high	97.5	Very high	42 Å²	42	40.5 Å²	40.5	26%	0.258	26%	0.255	S	S	.	.			trans	-60.2	145.5	172.1	57.7	0	0	0	0	110.4	G101 S102 N105 T185 P187	T99-G101 PolarHBondContact O-N 3.38Å; T99-S102 WeakPolarHBondContact O-CB 3.47Å; T99-S102 PolarHBondContact O-N 3.19Å; T99-S102 PolarHBondContact O-OG 3.43Å; T99-N105 WeakPolarHBondContact O-CB 3.22Å; T99-T185 WeakPolarHBondContact CA-O 3.45Å; T99-T185 WeakPolarHBondContact CG2-O 3.31Å; T99-P187 HydrophobicContact CG2-CB 4.11Å; T99-P187 HydrophobicContact CG2-CG 3.92Å
100	A	96.2	Very high	97.5	Very high	28 Å²	28	40.5 Å²	40.5	23%	0.231	26%	0.255	C	S	.	.	T	Hydrogen-bonded Turn	trans	-52.6	139.1	175.8	0	0	0	0	0	111.6	S102 A227 S230	A100-S102 VanDerWaalsContact C-N 3.28Å; A100-S102 PolarHBondContact O-N 2.68Å; A100-A227 HydrophobicContact CB-CB 3.73Å; A100-S230 VanDerWaalsContact CB-OG 3.26Å; A100-S230 WeakPolarHBondContact CB-OG 3Å
101	G	95.1	Very high	97.5	Very high	63 Å²	63	41.1 Å²	41.1	65%	0.649	26%	0.259	S	S	*	.	T	Hydrogen-bonded Turn	trans	80.9	-8.7	-174.6	0	0	0	0	0	115.9	T99 E106	T99-G101 PolarHBondContact O-N 3.38Å; G101-E106 PolarHBondContact N-OE1 3.05Å
102	S	97.2	Very high	97.5	Very high	28 Å²	28	39.3 Å²	39.3	20%	0.196	25%	0.247	C	C	.	.	S	Bend	trans	-76.6	155.5	172.7	70.3	0	0	0	0	112.1	T99 A100 A104 N105 E106	T99-S102 WeakPolarHBondContact O-CB 3.47Å; T99-S102 PolarHBondContact O-N 3.19Å; T99-S102 PolarHBondContact O-OG 3.43Å; A100-S102 VanDerWaalsContact C-N 3.28Å; A100-S102 PolarHBondContact O-N 2.68Å; S102-A104 PolarHBondContact O-N 2.61Å; S102-N105 PolarHBondContact O-N 3.16Å; S102-N105 WeakPolarHBondContact OG-CB 3.32Å; S102-N105 PolarHBondContact OG-N 3.21Å; S102-N105 VanDerWaalsContact OG-N 3.14Å; S102-E106 VanDerWaalsContact O-CB 3.31Å; S102-E106 WeakPolarHBondContact O-CB 3.3Å; S102-E106 VanDerWaalsContact O-CG 3.31Å; S102-E106 WeakPolarHBondContact O-CG 3.39Å; S102-E106 PolarHBondContact O-N 3.39Å
103	I	97.8	Very high	97.6	Very high	137 Å²	137	39.3 Å²	39.3	70%	0.703	25%	0.247	S	C	*	.	H	α-helix	trans	-60.5	-35.7	173.4	-63.3	174.4	0	0	0	111	N105 V107 A108	I103-N105 VanDerWaalsContact C-N 3.33Å; I103-N105 PolarHBondContact O-N 2.88Å; I103-V107 HydrophobicContact CG2-CB 4.15Å; I103-V107 HydrophobicContact CG2-CG2 4.24Å; I103-V107 WeakPolarHBondContact O-CA 3.21Å; I103-V107 WeakPolarHBondContact O-CB 3.45Å; I103-V107 PolarHBondContact O-N 2.94Å; I103-A108 PolarHBondContact O-N 3Å
104	A	97.9	Very high	97.6	Very high	21 Å²	21	41 Å²	41	17%	0.174	25%	0.252	C	S	.	.	I	π-helix	trans	-62.4	-40	178.6	0	0	0	0	0	112	S97 R98 S102 A109	S97-A104 WeakPolarHBondContact O-CB 3.36Å; R98-A104 HydrophobicContact CB-CB 4.45Å; R98-A104 HydrophobicContact CG-CB 3.97Å; S102-A104 PolarHBondContact O-N 2.61Å; A104-A109 WeakPolarHBondContact O-CB 3.38Å; A104-A109 PolarHBondContact O-N 2.84Å
105	N	98.2	Very high	97.6	Very high	0 Å²	0	39.5 Å²	39.5	0%	0	24%	0.244	C	C	.	.	I	π-helix	trans	-80.1	-51.4	176.9	-166.9	56.9	0	0	0	113.1	R98 T99 S102 I103 V107 A110 Y183 D184 G226	R98-N105 HydrophobicContact CB-CB 3.98Å; R98-N105 WeakPolarHBondContact O-CB 3.47Å; R98-N105 PolarHBondContact O-OD1 3.41Å; T99-N105 WeakPolarHBondContact O-CB 3.22Å; S102-N105 PolarHBondContact O-N 3.16Å; S102-N105 WeakPolarHBondContact OG-CB 3.32Å; S102-N105 PolarHBondContact OG-N 3.21Å; S102-N105 VanDerWaalsContact OG-N 3.14Å; I103-N105 VanDerWaalsContact C-N 3.33Å; I103-N105 PolarHBondContact O-N 2.88Å; N105-V107 PolarHBondContact O-N 3.38Å; N105-A110 PolarHBondContact O-N 2.85Å; N105-Y183 WeakPolarHBondContact OD1-CD2 3.43Å; N105-Y183 WeakPolarHBondContact OD1-CE2 3.42Å; N105-D184 WeakPolarHBondContact OD1-CA 3.43Å; N105-D184 WeakPolarHBondContact OD1-CB 3.4Å; N105-G226 PolarHBondContact ND2-O 2.8Å
106	E	97.4	Very high	97.7	Very high	42 Å²	42	39 Å²	39	20%	0.196	24%	0.241	C	C	.	.	I	π-helix	trans	-78.5	-21.6	-167.8	-62.3	-54	138	0	0	114	G101 S102 R156	G101-E106 PolarHBondContact N-OE1 3.05Å; S102-E106 VanDerWaalsContact O-CB 3.31Å; S102-E106 WeakPolarHBondContact O-CB 3.3Å; S102-E106 VanDerWaalsContact O-CG 3.31Å; S102-E106 WeakPolarHBondContact O-CG 3.39Å; S102-E106 PolarHBondContact O-N 3.39Å; E106-R156 PolarHBondContact O-NH1 2.92Å; E106-R156 PolarHBondContact O-NH2 2.97Å; E106-R156 IonicContact OE2-CZ 3.85Å; E106-R156 IonicContact OE2-NH1 2.73Å; E106-R156 PolarHBondContact OE2-NH1 3.15Å; E106-R156 IonicContact OE2-NH2 3.58Å
107	V	97.9	Very high	97.8	Very high	70 Å²	70	37.6 Å²	37.6	42%	0.424	23%	0.227	S	C	.	.	I	π-helix	trans	-120.9	-66.6	-177.5	-173.3	0	0	0	0	109.9	I103 N105 A110 D111	I103-V107 HydrophobicContact CG2-CB 4.15Å; I103-V107 HydrophobicContact CG2-CG2 4.24Å; I103-V107 WeakPolarHBondContact O-CA 3.21Å; I103-V107 WeakPolarHBondContact O-CB 3.45Å; I103-V107 PolarHBondContact O-N 2.94Å; N105-V107 PolarHBondContact O-N 3.38Å; V107-A110 PolarHBondContact O-N 3.34Å; V107-D111 WeakPolarHBondContact O-CB 3.46Å; V107-D111 PolarHBondContact O-N 2.79Å
108	A	98.4	Very high	97.8	Very high	36 Å²	36	41 Å²	41	30%	0.298	24%	0.237	S	C	.	.	I	π-helix	trans	-65	-52.9	-168.6	0	0	0	0	0	113.5	M95 I103 D111 Y112	M95-A108 HydrophobicContact CE-CB 4.2Å; M95-A108 HydrophobicContact CG-CB 4.49Å; M95-A108 HydrophobicContact SD-CB 3.62Å; I103-A108 PolarHBondContact O-N 3Å; A108-D111 PolarHBondContact O-N 3.04Å; A108-Y112 PolarHBondContact O-N 2.84Å
109	A	98.4	Very high	97.7	Very high	0 Å²	0	46 Å²	46	0%	0	26%	0.263	C	S	.	.	I	π-helix	trans	-68.8	-38.1	177.9	0	0	0	0	0	112	V92 M95 A104 Y112 L113 Y183	V92-A109 HydrophobicContact CG1-CB 4.15Å; M95-A109 HydrophobicContact SD-CB 4.12Å; A104-A109 WeakPolarHBondContact O-CB 3.38Å; A104-A109 PolarHBondContact O-N 2.84Å; A109-Y112 PolarHBondContact O-N 3.31Å; A109-L113 WeakPolarHBondContact O-CG 3.5Å; A109-L113 PolarHBondContact O-N 3.26Å; A109-Y183 HydrophobicContact CB-CD2 4.14Å; A109-Y183 HydrophobicContact CB-CE2 4.35Å
110	A	98.1	Very high	97.6	Very high	0 Å²	0	44.6 Å²	44.6	0%	0	25%	0.254	C	S	.	.	H	α-helix	trans	-62.2	-42.4	175.3	0	0	0	0	0	112.4	N105 V107 R114 F158	N105-A110 PolarHBondContact O-N 2.85Å; V107-A110 PolarHBondContact O-N 3.34Å; A110-R114 VanDerWaalsContact O-CB 3.23Å; A110-R114 WeakPolarHBondContact O-CB 3.4Å; A110-R114 PolarHBondContact O-N 3.38Å; A110-F158 HydrophobicContact CB-CE2 4.04Å; A110-F158 HydrophobicContact CB-CZ 4Å; A110-F158 WeakPolarHBondContact O-CZ 3.4Å
111	D	98.4	Very high	97.5	Very high	65 Å²	65	46.1 Å²	46.1	35%	0.348	26%	0.256	S	S	.	.	H	α-helix	trans	-65.9	-41.5	176.5	-70.6	-12.1	0	0	0	111.2	V107 A108 R114 N115	V107-D111 WeakPolarHBondContact O-CB 3.46Å; V107-D111 PolarHBondContact O-N 2.79Å; A108-D111 PolarHBondContact O-N 3.04Å; D111-R114 IonicContact OD1-CZ 2.98Å; D111-R114 IonicContact OD1-NH1 3.63Å; D111-R114 PolarHBondContact OD1-NH1 2.86Å; D111-R114 IonicContact OD1-NH2 3.25Å; D111-N115 WeakPolarHBondContact O-CB 3.4Å; D111-N115 PolarHBondContact O-N 3.37Å; D111-N115 PolarHBondContact O-ND2 2.85Å; D111-N115 VanDerWaalsContact O-ND2 3.15Å
112	Y	98.7	Very high	97.4	Very high	34 Å²	34	47.4 Å²	47.4	13%	0.133	26%	0.255	C	S	.	.	H	α-helix	trans	-58.6	-56.1	174.6	-173	-95.7	0	0	0	111.7	H88 N91 V92 A108 A109 R114 N115 E116	H88-Y112 AromaticContact ND1-CE1 3.94Å; H88-Y112 AromaticContact ND1-CZ 3.78Å; H88-Y112 PolarHBondContact ND1-OH 3.37Å; N91-Y112 HydrophobicContact CB-CE2 3.91Å; N91-Y112 PolarHBondContact ND2-OH 3.39Å; V92-Y112 HydrophobicContact CG2-CD1 3.31Å; V92-Y112 HydrophobicContact CG2-CE1 3.69Å; V92-Y112 HydrophobicContact CG2-CG 3.81Å; A108-Y112 PolarHBondContact O-N 2.84Å; A109-Y112 PolarHBondContact O-N 3.31Å; Y112-R114 VanDerWaalsContact C-N 3.34Å; Y112-R114 PolarHBondContact O-N 2.9Å; Y112-N115 PolarHBondContact O-N 3.22Å; Y112-E116 HydrophobicContact CD1-CG 4.25Å; Y112-E116 HydrophobicContact CE1-CG 3.82Å; Y112-E116 HydrophobicContact CE2-CG 4.45Å; Y112-E116 WeakPolarHBondContact O-CG 3.43Å; Y112-E116 PolarHBondContact O-N 3.1Å
113	L	98.6	Very high	96.7	Very high	0 Å²	0	48 Å²	48	0%	0	26%	0.258	C	S	.	.	H	α-helix	trans	-59.7	-43.6	179.5	-72.8	173.9	0	0	0	111.7	A109 N115 E116 L117 F158 Y183 F196 L203 F224	A109-L113 WeakPolarHBondContact O-CG 3.5Å; A109-L113 PolarHBondContact O-N 3.26Å; L113-N115 VanDerWaalsContact C-N 3.29Å; L113-N115 PolarHBondContact O-N 2.93Å; L113-E116 PolarHBondContact O-N 3.29Å; L113-L117 VanDerWaalsContact O-CB 3.28Å; L113-L117 WeakPolarHBondContact O-CB 3.46Å; L113-L117 WeakPolarHBondContact O-CG 3.39Å; L113-L117 PolarHBondContact O-N 2.84Å; L113-F158 HydrophobicContact CB-CD2 4.3Å; L113-F158 HydrophobicContact CB-CE2 4.31Å; L113-F158 HydrophobicContact CD1-CD2 4.31Å; L113-Y183 HydrophobicContact CD1-CD1 3.47Å; L113-Y183 VanDerWaalsContact CD1-CD1 3.47Å; L113-Y183 HydrophobicContact CD1-CD2 4.04Å; L113-Y183 HydrophobicContact CD1-CE1 3.88Å; L113-Y183 HydrophobicContact CD1-CE2 4.4Å; L113-Y183 HydrophobicContact CD1-CG 3.57Å; L113-F196 HydrophobicContact CD2-CE2 4.42Å; L113-F196 HydrophobicContact CD2-CZ 4.48Å; L113-L203 HydrophobicContact CD2-CD1 4.17Å; L113-L203 HydrophobicContact CD2-CD2 4.47Å; L113-F224 HydrophobicContact CD1-CB 4.23Å; L113-F224 HydrophobicContact CD2-CD1 4.04Å; L113-F224 HydrophobicContact CD2-CE1 4.39Å
114	R	98.4	Very high	95.5	Very high	43 Å²	43	41.8 Å²	41.8	16%	0.162	23%	0.227	C	C	.	.	H	α-helix	trans	-57.8	-43.2	177.8	-171.7	-174.6	-56.4	102.7	3.3	111.8	A110 D111 Y112 K118 E135 F158	A110-R114 VanDerWaalsContact O-CB 3.23Å; A110-R114 WeakPolarHBondContact O-CB 3.4Å; A110-R114 PolarHBondContact O-N 3.38Å; D111-R114 IonicContact OD1-CZ 2.98Å; D111-R114 IonicContact OD1-NH1 3.63Å; D111-R114 PolarHBondContact OD1-NH1 2.86Å; D111-R114 IonicContact OD1-NH2 3.25Å; Y112-R114 VanDerWaalsContact C-N 3.34Å; Y112-R114 PolarHBondContact O-N 2.9Å; R114-K118 HydrophobicContact CG-CD 4.28Å; R114-K118 WeakPolarHBondContact O-CB 3.49Å; R114-K118 VanDerWaalsContact O-CG 3.26Å; R114-K118 WeakPolarHBondContact O-CG 3.48Å; R114-K118 PolarHBondContact O-N 2.95Å; R114-E135 IonicContact CZ-OE2 3.53Å; R114-E135 IonicContact NE-OE2 3.5Å; R114-E135 PolarHBondContact NE-OE2 3.42Å; R114-E135 IonicContact NH2-OE1 2.64Å; R114-E135 PolarHBondContact NH2-OE1 3.44Å; R114-E135 VanDerWaalsContact NH2-OE1 3.14Å; R114-E135 IonicContact NH2-OE2 2.7Å; R114-E135 PolarHBondContact NH2-OE2 2.92Å; R114-E135 VanDerWaalsContact NH2-OE2 3.14Å; R114-F158 HydrophobicContact CB-CE1 3.9Å; R114-F158 HydrophobicContact CB-CZ 4.26Å; R114-F158 HydrophobicContact CG-CE1 4.3Å
115	N	98.3	Very high	93.9	Very high	93 Å²	93	47.8 Å²	47.8	50%	0.497	26%	0.256	S	S	.	.	H	α-helix	trans	-67.9	-48.1	-178.9	-68.9	-22	0	0	0	111.3	D111 Y112 L113 L117 K118 L119	D111-N115 WeakPolarHBondContact O-CB 3.4Å; D111-N115 PolarHBondContact O-N 3.37Å; D111-N115 PolarHBondContact O-ND2 2.85Å; D111-N115 VanDerWaalsContact O-ND2 3.15Å; Y112-N115 PolarHBondContact O-N 3.22Å; L113-N115 VanDerWaalsContact C-N 3.29Å; L113-N115 PolarHBondContact O-N 2.93Å; N115-L117 PolarHBondContact O-N 2.96Å; N115-K118 PolarHBondContact O-N 3.4Å; N115-L119 WeakPolarHBondContact O-CG 3.47Å; N115-L119 PolarHBondContact O-N 2.96Å; N115-L119 VanDerWaalsContact O-N 3.09Å
116	E	98	Very high	92.7	Very high	49 Å²	49	56.9 Å²	56.9	23%	0.229	30%	0.295	C	S	.	.	H	α-helix	trans	-61.7	-43.9	177.9	-65.2	-57.2	146.1	0	0	112	H88 Y112 L113 K118 L119 I120 L203	H88-E116 IonicContact CE1-OE2 3.46Å; H88-E116 PolarHBondContact CE1-OE2 3.23Å; Y112-E116 HydrophobicContact CD1-CG 4.25Å; Y112-E116 HydrophobicContact CE1-CG 3.82Å; Y112-E116 HydrophobicContact CE2-CG 4.45Å; Y112-E116 WeakPolarHBondContact O-CG 3.43Å; Y112-E116 PolarHBondContact O-N 3.1Å; L113-E116 PolarHBondContact O-N 3.29Å; E116-K118 PolarHBondContact O-N 3.36Å; E116-L119 WeakPolarHBondContact O-CB 3.41Å; E116-L119 PolarHBondContact O-N 2.65Å; E116-I120 WeakPolarHBondContact O-CG1 3.2Å; E116-I120 PolarHBondContact O-N 3.33Å; E116-I120 VanDerWaalsContact O-N 3.12Å; E116-L203 HydrophobicContact CB-CD2 4.18Å
117	L	98.2	Very high	91.7	Very high	0 Å²	0	56.9 Å²	56.9	0%	0	30%	0.298	C	S	.	.	H	α-helix	trans	-66.9	-36.8	179.6	-66.6	172.1	0	0	0	112.4	L113 N115 L119 I120 E121 L133 F158 L160 L203 F224	L113-L117 VanDerWaalsContact O-CB 3.28Å; L113-L117 WeakPolarHBondContact O-CB 3.46Å; L113-L117 WeakPolarHBondContact O-CG 3.39Å; L113-L117 PolarHBondContact O-N 2.84Å; N115-L117 PolarHBondContact O-N 2.96Å; L117-L119 VanDerWaalsContact C-N 3.34Å; L117-I120 PolarHBondContact O-N 3.48Å; L117-E121 WeakPolarHBondContact O-CB 3.38Å; L117-E121 PolarHBondContact O-N 3.44Å; L117-L133 HydrophobicContact CB-CD1 3.92Å; L117-L133 HydrophobicContact CB-CD2 3.92Å; L117-L133 HydrophobicContact CD1-CD1 3.84Å; L117-L133 HydrophobicContact CG-CD1 4.47Å; L117-F158 HydrophobicContact CD1-CB 3.6Å; L117-F158 HydrophobicContact CD1-CD1 4.33Å; L117-F158 HydrophobicContact CD1-CG 4.1Å; L117-L160 HydrophobicContact CD2-CB 4.3Å; L117-L160 HydrophobicContact CD2-CD2 3.93Å; L117-L203 HydrophobicContact CD2-CD2 3.8Å; L117-L203 HydrophobicContact CG-CD2 4.3Å; L117-F224 HydrophobicContact CD1-CD2 4.14Å; L117-F224 HydrophobicContact CD1-CE2 4.33Å; L117-F224 HydrophobicContact CD2-CD2 4.33Å; L117-F224 HydrophobicContact CD2-CE2 3.69Å; L117-F224 HydrophobicContact CD2-CZ 4.16Å
118	K	97.2	Very high	91.3	Very high	109 Å²	109	60.4 Å²	60.4	47%	0.474	30%	0.304	S	S	.	.	H	α-helix	trans	-65.2	-35.9	173.2	-79.8	-179.5	176.4	-176.2	0	112.6	R114 N115 E116 I120 E121 S122 L133	R114-K118 HydrophobicContact CG-CD 4.28Å; R114-K118 WeakPolarHBondContact O-CB 3.49Å; R114-K118 VanDerWaalsContact O-CG 3.26Å; R114-K118 WeakPolarHBondContact O-CG 3.48Å; R114-K118 PolarHBondContact O-N 2.95Å; N115-K118 PolarHBondContact O-N 3.4Å; E116-K118 PolarHBondContact O-N 3.36Å; K118-I120 VanDerWaalsContact C-N 3.34Å; K118-E121 PolarHBondContact O-N 2.97Å; K118-S122 WeakPolarHBondContact O-CB 3.44Å; K118-S122 PolarHBondContact O-N 3.29Å; K118-L133 HydrophobicContact CG-CD2 3.8Å
119	L	95.3	Very high	91	Very high	106 Å²	106	58.8 Å²	58.8	56%	0.555	29%	0.29	S	S	*	.	H	α-helix	trans	-62.5	-44.1	174	-69.8	173.2	0	0	0	110.7	N115 E116 L117 S122	N115-L119 WeakPolarHBondContact O-CG 3.47Å; N115-L119 PolarHBondContact O-N 2.96Å; N115-L119 VanDerWaalsContact O-N 3.09Å; E116-L119 WeakPolarHBondContact O-CB 3.41Å; E116-L119 PolarHBondContact O-N 2.65Å; L117-L119 VanDerWaalsContact C-N 3.34Å; L119-S122 PolarHBondContact O-N 3.33Å; L119-S122 PolarHBondContact O-OG 3.45Å
120	I	95.2	Very high	90.8	Very high	12 Å²	12	60.9 Å²	60.9	6%	0.062	30%	0.303	C	S	.	.	H	α-helix	trans	-64.9	-45.7	176.9	-62.8	167.5	0	0	0	110.9	E116 L117 K118 S122 V123 L160 F162 L203 C206 A210	E116-I120 WeakPolarHBondContact O-CG1 3.2Å; E116-I120 PolarHBondContact O-N 3.33Å; E116-I120 VanDerWaalsContact O-N 3.12Å; L117-I120 PolarHBondContact O-N 3.48Å; K118-I120 VanDerWaalsContact C-N 3.34Å; I120-S122 VanDerWaalsContact C-N 3.26Å; I120-S122 PolarHBondContact O-N 2.82Å; I120-V123 PolarHBondContact O-N 3.33Å; I120-L160 HydrophobicContact CB-CD2 4.4Å; I120-L160 HydrophobicContact CG2-CD2 3.86Å; I120-F162 HydrophobicContact CG2-CZ 4.2Å; I120-L203 HydrophobicContact CD1-CD2 4.34Å; I120-C206 HydrophobicContact CD1-CB 3.83Å; I120-C206 HydrophobicContact CG2-CB 4.16Å; I120-A210 HydrophobicContact CG2-CB 3.7Å
121	E	95.1	Very high	90.7	Very high	61 Å²	61	61.1 Å²	61.1	29%	0.285	30%	0.304	S	S	.	.	H	α-helix	trans	-57.1	-39.2	177.2	-175.2	-179.2	-139	0	0	112	L117 K118 V123 S124 L133	L117-E121 WeakPolarHBondContact O-CB 3.38Å; L117-E121 PolarHBondContact O-N 3.44Å; K118-E121 PolarHBondContact O-N 2.97Å; E121-V123 PolarHBondContact O-N 3.2Å; E121-S124 WeakPolarHBondContact O-CB 3.16Å; E121-S124 PolarHBondContact O-N 2.99Å; E121-L133 PolarHBondContact OE1-N 3.42Å
122	S	92.1	Very high	90.6	Very high	90 Å²	90	60.1 Å²	60.1	63%	0.629	30%	0.303	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.9	-18.3	-178	78.6	0	0	0	0	114.6	K118 L119 I120	K118-S122 WeakPolarHBondContact O-CB 3.44Å; K118-S122 PolarHBondContact O-N 3.29Å; L119-S122 PolarHBondContact O-N 3.33Å; L119-S122 PolarHBondContact O-OG 3.45Å; I120-S122 VanDerWaalsContact C-N 3.26Å; I120-S122 PolarHBondContact O-N 2.82Å
123	V	83.9	Confident	90.5	Very high	40 Å²	40	60.2 Å²	60.2	24%	0.242	31%	0.305	C	S	.	.	T	Hydrogen-bonded Turn	trans	-77.6	-24.4	178.8	-174.2	0	0	0	0	112.2	I120 E121 N125 K126 A210 T211	I120-V123 PolarHBondContact O-N 3.33Å; E121-V123 PolarHBondContact O-N 3.2Å; V123-N125 VanDerWaalsContact C-N 3.33Å; V123-N125 PolarHBondContact O-N 3.22Å; V123-N125 VanDerWaalsContact O-N 3.09Å; V123-K126 PolarHBondContact O-N 2.84Å; V123-A210 HydrophobicContact CB-CB 4.32Å; V123-A210 VanDerWaalsContact CG1-O 3.31Å; V123-A210 WeakPolarHBondContact CG1-O 3.27Å; V123-T211 HydrophobicContact CG1-CG2 3.99Å; V123-T211 HydrophobicContact CG2-CG2 4.35Å
124	S	71	Confident	90.5	Very high	7 Å²	7	62 Å²	62	5%	0.049	32%	0.315	C	S	.	.	G	3₁₀ helix	trans	-40.6	-49.4	-173	172.6	0	0	0	0	115.1	E121 K126 L129 V130 V131	E121-S124 WeakPolarHBondContact O-CB 3.16Å; E121-S124 PolarHBondContact O-N 2.99Å; S124-K126 VanDerWaalsContact C-N 3.29Å; S124-K126 PolarHBondContact O-N 3.47Å; S124-K126 VanDerWaalsContact O-N 3.13Å; S124-L129 CarbonylContact C-O 3.58Å; S124-L129 VanDerWaalsContact C-O 3.3Å; S124-L129 VanDerWaalsContact CA-O 3.26Å; S124-L129 WeakPolarHBondContact CA-O 3.32Å; S124-L129 PolarHBondContact OG-O 3.16Å; S124-V130 WeakPolarHBondContact OG-CA 3.3Å; S124-V131 PolarHBondContact OG-N 3.41Å
125	N	65.9	Low	90.4	Very high	147 Å²	147	62.8 Å²	62.8	79%	0.786	32%	0.32	S	S	*	.	G	3₁₀ helix	trans	-80.9	-1.9	-162.4	-73.1	-11.1	0	0	0	115.5	V123	V123-N125 VanDerWaalsContact C-N 3.33Å; V123-N125 PolarHBondContact O-N 3.22Å; V123-N125 VanDerWaalsContact O-N 3.09Å
126	K	72.3	Confident	90.4	Very high	190 Å²	190	59.2 Å²	59.2	83%	0.826	30%	0.301	S	S	*	.	G	3₁₀ helix	trans	-82.7	-24	-179.5	-67.1	-177.2	-178.2	175.8	0	113.7	V123 S124	V123-K126 PolarHBondContact O-N 2.84Å; S124-K126 VanDerWaalsContact C-N 3.29Å; S124-K126 PolarHBondContact O-N 3.47Å; S124-K126 VanDerWaalsContact O-N 3.13Å
127	T	76.5	Confident	90.3	Very high	43 Å²	43	62.1 Å²	62.1	26%	0.264	31%	0.309	S	S	.	.	T	Hydrogen-bonded Turn	trans	-128.1	12.2	-164.4	55.8	0	0	0	0	114.7	L129 R166	T127-L129 PolarHBondContact O-N 2.94Å; T127-R166 VanDerWaalsContact O-CD 3.22Å; T127-R166 WeakPolarHBondContact O-CD 3.28Å
128	R	89.6	Confident	90.2	Very high	144 Å²	144	62.5 Å²	62.5	54%	0.543	31%	0.312	S	S	.	.	T	Hydrogen-bonded Turn	trans	61.6	11.2	-171.6	-57.8	-179.6	61.7	-162.3	-6.2	114.6	L165 R166	R128-L165 HydrophobicContact CB-CB 4.28Å; R128-L165 PolarHBondContact NH2-O 3.41Å; R128-L165 WeakPolarHBondContact O-CB 3.03Å; R128-L165 WeakPolarHBondContact O-CG 3.15Å; R128-L165 PolarHBondContact O-N 2.75Å; R128-R166 HydrophobicContact CB-CG 3.95Å
129	L	92.5	Very high	90.1	Very high	1 Å²	1	58.9 Å²	58.9	1%	0.005	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.3	109.8	168.2	173.8	64	0	0	0	108	S124 T127 V131 F162 D164 L209 L216	S124-L129 CarbonylContact C-O 3.58Å; S124-L129 VanDerWaalsContact C-O 3.3Å; S124-L129 VanDerWaalsContact CA-O 3.26Å; S124-L129 WeakPolarHBondContact CA-O 3.32Å; S124-L129 PolarHBondContact OG-O 3.16Å; T127-L129 PolarHBondContact O-N 2.94Å; L129-V131 HydrophobicContact CD2-CG2 4.4Å; L129-V131 HydrophobicContact CG-CG2 4.17Å; L129-V131 PolarHBondContact O-N 2.99Å; L129-F162 HydrophobicContact CD1-CD1 4.35Å; L129-F162 HydrophobicContact CD2-CD1 4.17Å; L129-F162 HydrophobicContact CG-CD1 4.47Å; L129-D164 HydrophobicContact CD1-CB 3.88Å; L129-L209 WeakPolarHBondContact CD2-O 3.38Å; L129-L216 HydrophobicContact CD1-CD1 3.86Å
130	V	93.5	Very high	90	Very high	45 Å²	45	61 Å²	61	27%	0.273	31%	0.307	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.1	114.2	177.9	-178.1	0	0	0	0	108.9	S124 H163 L165	S124-V130 WeakPolarHBondContact OG-CA 3.3Å; V130-H163 WeakPolarHBondContact CA-O 3.45Å; V130-H163 HydrophobicContact CB-CB 4.41Å; V130-H163 PolarHBondContact N-O 3.05Å; V130-H163 PolarHBondContact O-N 3.29Å; V130-L165 HydrophobicContact CG2-CD1 3.81Å; V130-L165 HydrophobicContact CG2-CD2 4.42Å; V130-L165 HydrophobicContact CG2-CG 3.95Å
131	V	95.6	Very high	89.9	Confident	5 Å²	5	60.6 Å²	60.6	3%	0.03	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	127.8	169.6	-170.4	0	0	0	0	107.5	S124 L129 L160 R161 F162 A210	S124-V131 PolarHBondContact OG-N 3.41Å; L129-V131 HydrophobicContact CD2-CG2 4.4Å; L129-V131 HydrophobicContact CG-CG2 4.17Å; L129-V131 PolarHBondContact O-N 2.99Å; V131-L160 HydrophobicContact CG1-CD1 3.63Å; V131-L160 HydrophobicContact CG1-CD2 4.06Å; V131-L160 HydrophobicContact CG1-CG 3.77Å; V131-R161 CarbonylContact C-O 3.56Å; V131-R161 VanDerWaalsContact CA-O 3.32Å; V131-R161 WeakPolarHBondContact CA-O 3.15Å; V131-F162 HydrophobicContact CG1-CD1 4.49Å; V131-F162 HydrophobicContact CG1-CE1 4.2Å; V131-F162 HydrophobicContact CG1-CE2 4.34Å; V131-F162 HydrophobicContact CG1-CZ 4.11Å; V131-F162 HydrophobicContact CG2-CD1 3.74Å; V131-F162 HydrophobicContact CG2-CE1 3.7Å; V131-F162 HydrophobicContact CG2-CG 4.48Å; V131-F162 HydrophobicContact CG2-CZ 4.42Å; V131-A210 HydrophobicContact CG2-CB 4.48Å
132	S	95.9	Very high	89.7	Confident	44 Å²	44	58.5 Å²	58.5	31%	0.308	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	127.1	-179.2	-59	0	0	0	0	110.7	L160 R161 W244	S132-L160 WeakPolarHBondContact O-CA 3.24Å; S132-R161 PolarHBondContact N-O 2.85Å; S132-R161 PolarHBondContact O-N 2.77Å; S132-W244 WeakPolarHBondContact O-CH2 3.41Å
133	L	97.6	Very high	89.6	Confident	35 Å²	35	54.2 Å²	54.2	18%	0.183	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.5	133.1	174.3	176.5	60.2	0	0	0	110.4	L117 K118 E121 F158 A159 L160	L117-L133 HydrophobicContact CB-CD1 3.92Å; L117-L133 HydrophobicContact CB-CD2 3.92Å; L117-L133 HydrophobicContact CD1-CD1 3.84Å; L117-L133 HydrophobicContact CG-CD1 4.47Å; K118-L133 HydrophobicContact CG-CD2 3.8Å; E121-L133 PolarHBondContact OE1-N 3.42Å; L133-F158 HydrophobicContact CD1-CD1 4.49Å; L133-A159 WeakPolarHBondContact CA-O 3.44Å; L133-L160 HydrophobicContact CB-CD1 3.92Å; L133-L160 HydrophobicContact CD1-CD1 4.27Å
134	D	97.9	Very high	89.5	Confident	39 Å²	39	58.7 Å²	58.7	21%	0.209	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	125.3	168.4	-152.9	-8.6	0	0	0	110.1	A159 H242 K243 W244	D134-A159 PolarHBondContact N-O 3.39Å; D134-A159 PolarHBondContact O-N 3.24Å; D134-H242 IonicContact OD2-CE1 3.97Å; D134-H242 IonicContact OD2-NE2 2.81Å; D134-H242 PolarHBondContact OD2-NE2 3.04Å; D134-K243 WeakPolarHBondContact OD2-CE 3.23Å; D134-K243 IonicContact OD2-NZ 2.7Å; D134-K243 PolarHBondContact OD2-NZ 3.2Å; D134-W244 HydrophobicContact CB-CH2 3.78Å; D134-W244 HydrophobicContact CB-CZ2 4.25Å; D134-W244 HydrophobicContact CB-CZ3 4.09Å
135	E	97.7	Very high	89.9	Confident	59 Å²	59	58.5 Å²	58.5	28%	0.276	28%	0.279	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94	94	171.5	-176.4	174.9	160.7	0	0	107.9	R114 R137 R156 F158	R114-E135 IonicContact CZ-OE2 3.53Å; R114-E135 IonicContact NE-OE2 3.5Å; R114-E135 PolarHBondContact NE-OE2 3.42Å; R114-E135 IonicContact NH2-OE1 2.64Å; R114-E135 PolarHBondContact NH2-OE1 3.44Å; R114-E135 VanDerWaalsContact NH2-OE1 3.14Å; R114-E135 IonicContact NH2-OE2 2.7Å; R114-E135 PolarHBondContact NH2-OE2 2.92Å; R114-E135 VanDerWaalsContact NH2-OE2 3.14Å; E135-R137 IonicContact OE1-NH2 3.7Å; E135-R156 HydrophobicContact CG-CG 4.12Å; E135-R156 VanDerWaalsContact OE1-CD 3.31Å; E135-R156 WeakPolarHBondContact OE1-CD 3.5Å; E135-R156 IonicContact OE1-NE 3.91Å; E135-R156 PolarHBondContact OE1-NE 2.84Å; E135-F158 HydrophobicContact CB-CD1 4.09Å; E135-F158 HydrophobicContact CB-CE1 4.05Å; E135-F158 HydrophobicContact CG-CD1 3.98Å; E135-F158 HydrophobicContact CG-CE1 3.6Å; E135-F158 HydrophobicContact CG-CZ 4.18Å; E135-F158 WeakPolarHBondContact OE2-CE1 3.25Å
136	H	96.8	Very high	90.4	Very high	18 Å²	18	55.5 Å²	55.5	8%	0.083	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.4	126.9	-177.6	171.7	-136	0	0	0	110.8	R156 N157 A237 H242	H136-R156 WeakPolarHBondContact O-CA 3.14Å; H136-N157 HydrophobicContact CB-CB 4.22Å; H136-N157 PolarHBondContact N-O 2.86Å; H136-N157 PolarHBondContact O-N 3.4Å; H136-A237 PolarHBondContact CE1-O 2.82Å; H136-H242 AromaticContact CD2-CD2 3.83Å; H136-H242 AromaticContact CG-CD2 3.52Å; H136-H242 AromaticContact ND1-CD2 3.98Å
137	R	96.5	Very high	90.6	Very high	110 Å²	110	51.1 Å²	51.1	42%	0.415	26%	0.256	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	128.4	166.8	-70.4	179.3	176.4	-86.2	-4.6	109.7	E135 N154 V155	E135-R137 IonicContact OE1-NH2 3.7Å; R137-N154 WeakPolarHBondContact CD-OD1 3.2Å; R137-N154 PolarHBondContact NH1-OD1 3.27Å; R137-V155 WeakPolarHBondContact CA-O 3.19Å
138	S	95.8	Very high	90.8	Very high	7 Å²	7	53.6 Å²	53.6	5%	0.049	26%	0.264	C	S	.	.			trans	-72.4	149.3	-177.2	83.5	0	0	0	0	112.6	Y152 N153 N154 V155	S138-Y152 WeakPolarHBondContact OG-CD2 3.1Å; S138-Y152 WeakPolarHBondContact OG-CE2 3.19Å; S138-N153 PolarHBondContact O-OD1 3.48Å; S138-N154 WeakPolarHBondContact O-CA 3.29Å; S138-N154 PolarHBondContact O-N 3.43Å; S138-N154 PolarHBondContact OG-N 3Å; S138-N154 VanDerWaalsContact OG-N 3.16Å; S138-V155 PolarHBondContact N-O 3.37Å; S138-V155 WeakPolarHBondContact OG-CG2 3.21Å; S138-V155 PolarHBondContact OG-N 3.33Å; S138-V155 VanDerWaalsContact OG-N 3.13Å
139	G	95.1	Very high	90.6	Very high	34 Å²	34	52.2 Å²	52.2	35%	0.351	27%	0.272	S	S	.	.			trans	-76.3	-175	155.8	0	0	0	0	0	112
140	Y	94.2	Very high	90.4	Very high	149 Å²	149	53.2 Å²	53.2	58%	0.584	28%	0.279	S	S	*	.	S	Bend	trans	-66.9	133.6	174.1	175.5	-94.7	0	0	0	111.2	Y152 N153 L392	Y140-Y152 WeakPolarHBondContact CA-O 3.49Å; Y140-N153 PolarHBondContact N-OD1 2.9Å; Y140-L392 HydrophobicContact CE1-CD2 4.11Å
141	S	93	Very high	90.4	Very high	5 Å²	5	54.9 Å²	54.9	4%	0.035	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.7	165.4	168.5	-167.5	0	0	0	0	110.7	S151 Y152	S141-S151 WeakPolarHBondContact O-CA 3.48Å; S141-Y152 WeakPolarHBondContact CB-OH 3.44Å; S141-Y152 PolarHBondContact N-O 3.17Å; S141-Y152 PolarHBondContact O-N 3.35Å
142	S	90.5	Very high	90.3	Very high	16 Å²	16	55.2 Å²	55.2	11%	0.112	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.3	151.4	169.8	61.6	0	0	0	0	110.5	S150 L392 N395 S396	S142-S150 CarbonylContact C-O 3.56Å; S142-S150 WeakPolarHBondContact CA-O 3.44Å; S142-S150 WeakPolarHBondContact CB-O 3.37Å; S142-L392 WeakPolarHBondContact OG-CD2 3.2Å; S142-N395 CarbonylContact O-C 3.25Å; S142-N395 VanDerWaalsContact O-O 3.09Å; S142-S396 WeakPolarHBondContact O-CA 3.42Å
143	F	89.5	Confident	90.2	Very high	0 Å²	0	58 Å²	58	0%	0	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-159.8	164.7	-178.8	75.9	-73.6	0	0	0	111.5	A145 S150 Y152 M231 L232 L233 H236 I311 Y315 N395	F143-A145 HydrophobicContact CE2-CB 3.95Å; F143-S150 PolarHBondContact N-O 2.88Å; F143-S150 PolarHBondContact O-N 3.47Å; F143-Y152 HydrophobicContact CD1-CD1 4.16Å; F143-Y152 AromaticContact CD1-CE1 3.71Å; F143-Y152 HydrophobicContact CD1-CE1 3.71Å; F143-Y152 AromaticContact CE1-CD1 3.89Å; F143-Y152 HydrophobicContact CE1-CD1 3.89Å; F143-Y152 AromaticContact CE1-CE1 3.62Å; F143-Y152 HydrophobicContact CE1-CE1 3.62Å; F143-M231 WeakPolarHBondContact CZ-O 3.35Å; F143-L232 HydrophobicContact CZ-CB 4.38Å; F143-L232 WeakPolarHBondContact CZ-O 3.41Å; F143-L233 HydrophobicContact CE1-CD2 3.69Å; F143-L233 HydrophobicContact CZ-CD2 4.07Å; F143-H236 WeakPolarHBondContact CB-NE2 3.36Å; F143-H236 HydrophobicContact CD1-CB 4.18Å; F143-H236 AromaticContact CD1-CD2 4Å; F143-H236 AromaticContact CD1-CG 3.69Å; F143-H236 AromaticContact CD1-ND1 3.78Å; F143-H236 HydrophobicContact CD2-CB 4.37Å; F143-H236 AromaticContact CD2-CD2 3.65Å; F143-H236 AromaticContact CD2-CG 3.99Å; F143-H236 HydrophobicContact CE1-CB 3.86Å; F143-H236 AromaticContact CE1-CG 3.9Å; F143-H236 HydrophobicContact CE2-CB 4.08Å; F143-H236 HydrophobicContact CG-CB 4.41Å; F143-H236 AromaticContact CG-CD2 3.52Å; F143-H236 AromaticContact CG-CG 3.71Å; F143-H236 AromaticContact CG-NE2 3.78Å; F143-H236 HydrophobicContact CZ-CB 3.78Å; F143-I311 HydrophobicContact CD2-CD1 4.14Å; F143-I311 HydrophobicContact CE2-CD1 3.6Å; F143-Y315 HydrophobicContact CB-CE1 4.21Å; F143-Y315 HydrophobicContact CD2-CE2 4.02Å; F143-Y315 AromaticContact CD2-CZ 3.98Å; F143-N395 WeakPolarHBondContact CB-O 3.3Å
144	R	82.8	Confident	90.2	Very high	135 Å²	135	60.3 Å²	60.3	51%	0.509	32%	0.317	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.5	128.9	175.2	-172.4	179.6	174.2	179.5	1.9	111.2	L146 H148 R310 Y315 S396	R144-L146 PolarHBondContact NE-O 3.21Å; R144-H148 WeakPolarHBondContact CA-O 2.94Å; R144-H148 WeakPolarHBondContact CG-O 3.39Å; R144-R310 PolarHBondContact O-NH2 3.07Å; R144-Y315 PolarHBondContact N-OH 2.93Å; R144-Y315 PolarHBondContact O-OH 3.39Å; R144-S396 PolarHBondContact N-O 2.98Å; R144-S396 VanDerWaalsContact N-O 3.14Å
145	A	79	Confident	90.1	Very high	2 Å²	2	59.3 Å²	59.3	2%	0.017	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	123.3	167.1	0	0	0	0	0	109.8	F143 S147 H148 R310	F143-A145 HydrophobicContact CE2-CB 3.95Å; A145-S147 PolarHBondContact O-N 2.88Å; A145-H148 PolarHBondContact N-O 3.48Å; A145-H148 CarbonylContact O-C 3.36Å; A145-H148 WeakPolarHBondContact O-CA 3.35Å; A145-H148 WeakPolarHBondContact O-CB 3.39Å; A145-H148 PolarHBondContact O-N 3.17Å; A145-R310 VanDerWaalsContact CA-NH2 3.31Å
146	L	76.1	Confident	90.1	Very high	84 Å²	84	57.1 Å²	57.1	44%	0.44	30%	0.302	S	S	.	.	T	Hydrogen-bonded Turn	trans	49.4	-121.6	-172.2	-60.9	171.1	0	0	0	112.6	R144 D306	R144-L146 PolarHBondContact NE-O 3.21Å; L146-D306 HydrophobicContact CD1-CB 3.86Å; L146-D306 HydrophobicContact CD2-CB 3.9Å; L146-D306 HydrophobicContact CG-CB 3.73Å
147	S	77.2	Confident	90.1	Very high	99 Å²	99	56.3 Å²	56.3	69%	0.692	30%	0.298	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.6	-2	174	46.4	0	0	0	0	114.1	A145	A145-S147 PolarHBondContact O-N 2.88Å
148	H	80.1	Confident	90.3	Very high	94 Å²	94	51 Å²	51	44%	0.435	28%	0.278	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.5	141.8	-173.7	-61.4	-103.3	0	0	0	111	R144 A145 M231	R144-H148 WeakPolarHBondContact CA-O 2.94Å; R144-H148 WeakPolarHBondContact CG-O 3.39Å; A145-H148 PolarHBondContact N-O 3.48Å; A145-H148 CarbonylContact O-C 3.36Å; A145-H148 WeakPolarHBondContact O-CA 3.35Å; A145-H148 WeakPolarHBondContact O-CB 3.39Å; A145-H148 PolarHBondContact O-N 3.17Å; H148-M231 HydrophobicContact CB-SD 4.48Å
149	V	86	Confident	90.4	Very high	116 Å²	116	50.7 Å²	50.7	70%	0.703	28%	0.276	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-107.1	117.8	165.5	178.6	0	0	0	0	106.6
150	S	88.6	Confident	90.5	Very high	21 Å²	21	49.1 Å²	49.1	15%	0.147	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	142.1	-178.3	-63.4	0	0	0	0	109.5	S142 F143	S142-S150 CarbonylContact C-O 3.56Å; S142-S150 WeakPolarHBondContact CA-O 3.44Å; S142-S150 WeakPolarHBondContact CB-O 3.37Å; F143-S150 PolarHBondContact N-O 2.88Å; F143-S150 PolarHBondContact O-N 3.47Å
151	S	91.8	Very high	90.7	Very high	80 Å²	80	43.3 Å²	43.3	56%	0.559	24%	0.236	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-126	140.3	169.6	62	0	0	0	0	109.2	S141	S141-S151 WeakPolarHBondContact O-CA 3.48Å
152	Y	94.2	Very high	90.8	Very high	13 Å²	13	43.1 Å²	43.1	5%	0.051	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.8	163.5	-175.2	65.7	-97.6	0	0	0	111.3	S138 Y140 S141 F143 V155 L233 H236 A237 Q241	S138-Y152 WeakPolarHBondContact OG-CD2 3.1Å; S138-Y152 WeakPolarHBondContact OG-CE2 3.19Å; Y140-Y152 WeakPolarHBondContact CA-O 3.49Å; S141-Y152 WeakPolarHBondContact CB-OH 3.44Å; S141-Y152 PolarHBondContact N-O 3.17Å; S141-Y152 PolarHBondContact O-N 3.35Å; F143-Y152 HydrophobicContact CD1-CD1 4.16Å; F143-Y152 AromaticContact CD1-CE1 3.71Å; F143-Y152 HydrophobicContact CD1-CE1 3.71Å; F143-Y152 AromaticContact CE1-CD1 3.89Å; F143-Y152 HydrophobicContact CE1-CD1 3.89Å; F143-Y152 AromaticContact CE1-CE1 3.62Å; F143-Y152 HydrophobicContact CE1-CE1 3.62Å; Y152-V155 HydrophobicContact CD2-CG1 4.1Å; Y152-V155 HydrophobicContact CD2-CG2 3.75Å; Y152-V155 HydrophobicContact CE2-CG2 3.96Å; Y152-V155 HydrophobicContact CG-CG1 4.32Å; Y152-L233 HydrophobicContact CD1-CB 4.05Å; Y152-L233 HydrophobicContact CD1-CD2 3.91Å; Y152-L233 HydrophobicContact CD1-CG 4.47Å; Y152-L233 HydrophobicContact CG-CB 4.19Å; Y152-L233 HydrophobicContact CG-CD2 4.49Å; Y152-H236 HydrophobicContact CE1-CB 4.47Å; Y152-H236 AromaticContact CE1-ND1 3.6Å; Y152-H236 AromaticContact CZ-ND1 3.62Å; Y152-H236 PolarHBondContact OH-ND1 3.2Å; Y152-A237 HydrophobicContact CE2-CB 3.69Å; Y152-A237 WeakPolarHBondContact OH-CA 3.18Å; Y152-A237 PolarHBondContact OH-N 2.83Å; Y152-Q241 PolarHBondContact OH-NE2 3.09Å
153	N	95	Very high	91.1	Very high	102 Å²	102	43.9 Å²	43.9	55%	0.545	24%	0.236	S	C	.	.	S	Bend	trans	-152.5	150.2	170.3	-174.4	29.1	0	0	0	108.4	S138 Y140 V155	S138-N153 PolarHBondContact O-OD1 3.48Å; Y140-N153 PolarHBondContact N-OD1 2.9Å; N153-V155 VanDerWaalsContact C-N 3.25Å; N153-V155 PolarHBondContact O-N 3.13Å
154	N	95.9	Very high	91.3	Very high	83 Å²	83	43.9 Å²	43.9	44%	0.444	24%	0.236	S	C	.	.	S	Bend	trans	56.5	32.5	175.7	-167.7	36.9	0	0	0	114.6	R137 S138	R137-N154 WeakPolarHBondContact CD-OD1 3.2Å; R137-N154 PolarHBondContact NH1-OD1 3.27Å; S138-N154 WeakPolarHBondContact O-CA 3.29Å; S138-N154 PolarHBondContact O-N 3.43Å; S138-N154 PolarHBondContact OG-N 3Å; S138-N154 VanDerWaalsContact OG-N 3.16Å
155	V	96.5	Very high	91.8	Very high	18 Å²	18	39.7 Å²	39.7	11%	0.109	22%	0.224	C	C	.	.			trans	-76.6	146.6	168.9	-58.7	0	0	0	0	109.7	R137 S138 Y152 N153 A227 L233 A237	R137-V155 WeakPolarHBondContact CA-O 3.19Å; S138-V155 PolarHBondContact N-O 3.37Å; S138-V155 WeakPolarHBondContact OG-CG2 3.21Å; S138-V155 PolarHBondContact OG-N 3.33Å; S138-V155 VanDerWaalsContact OG-N 3.13Å; Y152-V155 HydrophobicContact CD2-CG1 4.1Å; Y152-V155 HydrophobicContact CD2-CG2 3.75Å; Y152-V155 HydrophobicContact CE2-CG2 3.96Å; Y152-V155 HydrophobicContact CG-CG1 4.32Å; N153-V155 VanDerWaalsContact C-N 3.25Å; N153-V155 PolarHBondContact O-N 3.13Å; V155-A227 HydrophobicContact CG1-CB 4.42Å; V155-L233 HydrophobicContact CG1-CB 4.16Å; V155-L233 HydrophobicContact CG1-CD1 4.31Å; V155-A237 HydrophobicContact CG2-CB 3.58Å
156	R	97.3	Very high	92.4	Very high	14 Å²	14	42.6 Å²	42.6	5%	0.053	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106	140	-171.5	-167.6	-171.2	-69.7	93	-7.6	112	E106 E135 H136 F158 G226 S234	E106-R156 PolarHBondContact O-NH1 2.92Å; E106-R156 PolarHBondContact O-NH2 2.97Å; E106-R156 IonicContact OE2-CZ 3.85Å; E106-R156 IonicContact OE2-NH1 2.73Å; E106-R156 PolarHBondContact OE2-NH1 3.15Å; E106-R156 IonicContact OE2-NH2 3.58Å; E135-R156 HydrophobicContact CG-CG 4.12Å; E135-R156 VanDerWaalsContact OE1-CD 3.31Å; E135-R156 WeakPolarHBondContact OE1-CD 3.5Å; E135-R156 IonicContact OE1-NE 3.91Å; E135-R156 PolarHBondContact OE1-NE 2.84Å; H136-R156 WeakPolarHBondContact O-CA 3.14Å; R156-F158 HydrophobicContact CG-CE2 4.3Å; R156-G226 PolarHBondContact O-N 2.88Å; R156-S234 PolarHBondContact O-OG 3.29Å
157	N	98.3	Very high	93.1	Very high	0 Å²	0	39 Å²	39	0%	0	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	151.1	163.3	-68.2	-82.1	0	0	0	110	H136 L223 F224 N225 S234	H136-N157 HydrophobicContact CB-CB 4.22Å; H136-N157 PolarHBondContact N-O 2.86Å; H136-N157 PolarHBondContact O-N 3.4Å; N157-L223 HydrophobicContact CB-CD1 3.77Å; N157-F224 WeakPolarHBondContact CA-O 3.1Å; N157-N225 VanDerWaalsContact OD1-CA 3.27Å; N157-N225 WeakPolarHBondContact OD1-CA 3.44Å; N157-N225 WeakPolarHBondContact OD1-CB 3.45Å; N157-S234 PolarHBondContact ND2-O 3.26Å; N157-S234 WeakPolarHBondContact OD1-CB 3.37Å; N157-S234 PolarHBondContact OD1-O 3.02Å
158	F	98.7	Very high	93.5	Very high	0 Å²	0	42.4 Å²	42.4	0%	0	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	128.3	161.2	-61.8	-89.1	0	0	0	109	A110 L113 R114 L117 L133 E135 R156 Y183 L223 F224	A110-F158 HydrophobicContact CB-CE2 4.04Å; A110-F158 HydrophobicContact CB-CZ 4Å; A110-F158 WeakPolarHBondContact O-CZ 3.4Å; L113-F158 HydrophobicContact CB-CD2 4.3Å; L113-F158 HydrophobicContact CB-CE2 4.31Å; L113-F158 HydrophobicContact CD1-CD2 4.31Å; R114-F158 HydrophobicContact CB-CE1 3.9Å; R114-F158 HydrophobicContact CB-CZ 4.26Å; R114-F158 HydrophobicContact CG-CE1 4.3Å; L117-F158 HydrophobicContact CD1-CB 3.6Å; L117-F158 HydrophobicContact CD1-CD1 4.33Å; L117-F158 HydrophobicContact CD1-CG 4.1Å; L133-F158 HydrophobicContact CD1-CD1 4.49Å; E135-F158 HydrophobicContact CB-CD1 4.09Å; E135-F158 HydrophobicContact CB-CE1 4.05Å; E135-F158 HydrophobicContact CG-CD1 3.98Å; E135-F158 HydrophobicContact CG-CE1 3.6Å; E135-F158 HydrophobicContact CG-CZ 4.18Å; E135-F158 WeakPolarHBondContact OE2-CE1 3.25Å; R156-F158 HydrophobicContact CG-CE2 4.3Å; F158-Y183 HydrophobicContact CD2-CE1 4.21Å; F158-Y183 HydrophobicContact CE2-CE1 4.48Å; F158-L223 WeakPolarHBondContact O-CA 3.35Å; F158-F224 HydrophobicContact CB-CB 4.26Å; F158-F224 PolarHBondContact N-O 3.4Å; F158-F224 PolarHBondContact O-N 3.17Å
159	A	98.6	Very high	93.7	Very high	0 Å²	0	39.2 Å²	39.2	0%	0	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	127.7	176.1	0	0	0	0	0	109.8	L133 D134 I221 F222 L223 F238 W244	L133-A159 WeakPolarHBondContact CA-O 3.44Å; D134-A159 PolarHBondContact N-O 3.39Å; D134-A159 PolarHBondContact O-N 3.24Å; A159-I221 HydrophobicContact CB-CG2 4.39Å; A159-F222 CarbonylContact C-O 3.46Å; A159-F222 WeakPolarHBondContact CA-O 3.41Å; A159-L223 HydrophobicContact CB-CD1 4.36Å; A159-F238 HydrophobicContact CB-CE2 3.84Å; A159-F238 HydrophobicContact CB-CZ 4.42Å; A159-W244 HydrophobicContact CB-CE3 3.94Å; A159-W244 HydrophobicContact CB-CZ3 3.7Å
160	L	98.1	Very high	93.5	Very high	0 Å²	0	33.9 Å²	33.9	0%	0	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	113.6	175	-166.4	72.6	0	0	0	109.1	L117 I120 V131 S132 L133 F162 C206 I221 F222	L117-L160 HydrophobicContact CD2-CB 4.3Å; L117-L160 HydrophobicContact CD2-CD2 3.93Å; I120-L160 HydrophobicContact CB-CD2 4.4Å; I120-L160 HydrophobicContact CG2-CD2 3.86Å; V131-L160 HydrophobicContact CG1-CD1 3.63Å; V131-L160 HydrophobicContact CG1-CD2 4.06Å; V131-L160 HydrophobicContact CG1-CG 3.77Å; S132-L160 WeakPolarHBondContact O-CA 3.24Å; L133-L160 HydrophobicContact CB-CD1 3.92Å; L133-L160 HydrophobicContact CD1-CD1 4.27Å; L160-F162 HydrophobicContact CD2-CE2 3.6Å; L160-F162 HydrophobicContact CD2-CZ 3.89Å; L160-F162 HydrophobicContact CG-CE2 3.96Å; L160-C206 HydrophobicContact CD2-CB 4.1Å; L160-I221 WeakPolarHBondContact O-CA 3.41Å; L160-F222 HydrophobicContact CB-CB 4.46Å; L160-F222 PolarHBondContact N-O 3.47Å; L160-F222 PolarHBondContact O-N 3.16Å
161	R	97.6	Very high	93.2	Very high	28 Å²	28	39.5 Å²	39.5	11%	0.106	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.3	131.2	179.8	-175.7	173.1	-176.8	158.8	3.3	110.8	V131 S132 K174 D219 L220 I221 W244 D247	V131-R161 CarbonylContact C-O 3.56Å; V131-R161 VanDerWaalsContact CA-O 3.32Å; V131-R161 WeakPolarHBondContact CA-O 3.15Å; S132-R161 PolarHBondContact N-O 2.85Å; S132-R161 PolarHBondContact O-N 2.77Å; R161-K174 PolarHBondContact NH2-O 3.06Å; R161-D219 IonicContact CZ-OD2 2.78Å; R161-D219 VanDerWaalsContact CZ-OD2 3.23Å; R161-D219 IonicContact NE-OD2 3.39Å; R161-D219 PolarHBondContact NE-OD2 2.91Å; R161-D219 IonicContact NH2-OD2 3.14Å; R161-D219 PolarHBondContact NH2-OD2 2.99Å; R161-L220 CarbonylContact C-O 3.53Å; R161-L220 VanDerWaalsContact CA-O 3.31Å; R161-L220 WeakPolarHBondContact CA-O 3.44Å; R161-I221 HydrophobicContact CB-CG1 4.16Å; R161-I221 HydrophobicContact CG-CG1 3.95Å; R161-W244 HydrophobicContact CB-CD2 4.36Å; R161-W244 HydrophobicContact CB-CE3 3.9Å; R161-W244 HydrophobicContact CB-CH2 3.63Å; R161-W244 HydrophobicContact CB-CZ2 4.07Å; R161-W244 HydrophobicContact CB-CZ3 3.53Å; R161-W244 VanDerWaalsContact NH1-CD1 3.27Å; R161-D247 IonicContact CZ-OD2 3.36Å; R161-D247 VanDerWaalsContact CZ-OD2 3.3Å; R161-D247 IonicContact NH1-OD2 3.21Å; R161-D247 PolarHBondContact NH1-OD2 2.93Å; R161-D247 IonicContact NH2-OD2 2.7Å; R161-D247 PolarHBondContact NH2-OD2 3.09Å
162	F	96.3	Very high	92.9	Very high	0 Å²	0	42.3 Å²	42.3	0%	0	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	122.1	170.9	-69.7	-105.3	0	0	0	109.2	I120 L129 V131 L160 C206 L209 A210 L216 D219 L220 F222	I120-F162 HydrophobicContact CG2-CZ 4.2Å; L129-F162 HydrophobicContact CD1-CD1 4.35Å; L129-F162 HydrophobicContact CD2-CD1 4.17Å; L129-F162 HydrophobicContact CG-CD1 4.47Å; V131-F162 HydrophobicContact CG1-CD1 4.49Å; V131-F162 HydrophobicContact CG1-CE1 4.2Å; V131-F162 HydrophobicContact CG1-CE2 4.34Å; V131-F162 HydrophobicContact CG1-CZ 4.11Å; V131-F162 HydrophobicContact CG2-CD1 3.74Å; V131-F162 HydrophobicContact CG2-CE1 3.7Å; V131-F162 HydrophobicContact CG2-CG 4.48Å; V131-F162 HydrophobicContact CG2-CZ 4.42Å; L160-F162 HydrophobicContact CD2-CE2 3.6Å; L160-F162 HydrophobicContact CD2-CZ 3.89Å; L160-F162 HydrophobicContact CG-CE2 3.96Å; F162-C206 HydrophobicContact CE2-CB 4.17Å; F162-C206 HydrophobicContact CZ-CB 3.89Å; F162-L209 HydrophobicContact CD1-CB 4.26Å; F162-L209 HydrophobicContact CE1-CB 3.87Å; F162-L209 HydrophobicContact CZ-CB 4.38Å; F162-A210 HydrophobicContact CE1-CB 3.94Å; F162-A210 HydrophobicContact CZ-CB 4.45Å; F162-L216 HydrophobicContact CB-CD1 3.67Å; F162-L216 HydrophobicContact CD1-CD1 4.42Å; F162-L216 HydrophobicContact CG-CD1 4.42Å; F162-D219 WeakPolarHBondContact O-CA 3.27Å; F162-L220 HydrophobicContact CB-CB 4.25Å; F162-L220 PolarHBondContact N-O 2.8Å; F162-L220 PolarHBondContact O-N 3.46Å; F162-L220 VanDerWaalsContact O-N 3.13Å; F162-F222 AromaticContact CD2-CD2 3.82Å; F162-F222 HydrophobicContact CD2-CD2 3.82Å; F162-F222 AromaticContact CD2-CE2 3.76Å; F162-F222 HydrophobicContact CD2-CE2 3.76Å; F162-F222 AromaticContact CE2-CD2 3.7Å; F162-F222 HydrophobicContact CE2-CD2 3.7Å; F162-F222 AromaticContact CE2-CE2 3.72Å; F162-F222 HydrophobicContact CE2-CE2 3.72Å
163	H	95.1	Very high	92.4	Very high	33 Å²	33	46.7 Å²	46.7	15%	0.153	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	120.1	178	179.3	75.6	0	0	0	109.7	V130 G170 E172 D219	V130-H163 WeakPolarHBondContact CA-O 3.45Å; V130-H163 HydrophobicContact CB-CB 4.41Å; V130-H163 PolarHBondContact N-O 3.05Å; V130-H163 PolarHBondContact O-N 3.29Å; H163-G170 PolarHBondContact NE2-O 2.9Å; H163-E172 PolarHBondContact CE1-O 3.5Å; H163-D219 IonicContact CE1-OD1 3.5Å; H163-D219 IonicContact CG-OD1 3.68Å; H163-D219 IonicContact CG-OD2 3.37Å; H163-D219 VanDerWaalsContact ND1-CG 3.33Å; H163-D219 IonicContact ND1-OD1 3.75Å; H163-D219 PolarHBondContact ND1-OD1 3.39Å; H163-D219 IonicContact ND1-OD2 3.46Å; H163-D219 PolarHBondContact ND1-OD2 3.34Å
164	D	94.3	Very high	91.9	Very high	0 Å²	0	42.3 Å²	42.3	0%	0	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	109.5	-171.7	-166.4	-17.7	0	0	0	112.5	L129 R166 A167 I215 L216	L129-D164 HydrophobicContact CD1-CB 3.88Å; D164-R166 PolarHBondContact O-N 2.92Å; D164-R166 WeakPolarHBondContact OD1-CB 3.08Å; D164-R166 VanDerWaalsContact OD1-CG 3.3Å; D164-R166 WeakPolarHBondContact OD1-CG 3.48Å; D164-R166 IonicContact OD1-CZ 3.88Å; D164-R166 PolarHBondContact OD1-N 3.28Å; D164-R166 IonicContact OD1-NE 2.93Å; D164-R166 PolarHBondContact OD1-NE 3.13Å; D164-R166 IonicContact OD1-NH2 3.32Å; D164-R166 IonicContact OD2-CZ 3.69Å; D164-R166 IonicContact OD2-NE 2.84Å; D164-R166 PolarHBondContact OD2-NE 3.14Å; D164-R166 IonicContact OD2-NH2 3.67Å; D164-R166 PolarHBondContact OD2-NH2 2.82Å; D164-A167 PolarHBondContact O-N 3.28Å; D164-I215 VanDerWaalsContact OD2-CA 3.27Å; D164-I215 WeakPolarHBondContact OD2-CA 3.29Å; D164-L216 HydrophobicContact CB-CB 3.85Å; D164-L216 HydrophobicContact CB-CG 4.38Å; D164-L216 WeakPolarHBondContact CB-O 3.21Å; D164-L216 PolarHBondContact OD2-N 3.23Å
165	L	93.1	Very high	91.9	Very high	47 Å²	47	40.7 Å²	40.7	25%	0.246	21%	0.213	C	C	.	.	T	Hydrogen-bonded Turn	trans	-72.9	-11.4	179.3	-53.3	176.1	0	0	0	112.9	R128 V130 G170	R128-L165 HydrophobicContact CB-CB 4.28Å; R128-L165 PolarHBondContact NH2-O 3.41Å; R128-L165 WeakPolarHBondContact O-CB 3.03Å; R128-L165 WeakPolarHBondContact O-CG 3.15Å; R128-L165 PolarHBondContact O-N 2.75Å; V130-L165 HydrophobicContact CG2-CD1 3.81Å; V130-L165 HydrophobicContact CG2-CD2 4.42Å; V130-L165 HydrophobicContact CG2-CG 3.95Å; L165-G170 WeakPolarHBondContact CD2-O 3.44Å
166	R	91.7	Very high	91.9	Very high	62 Å²	62	39.9 Å²	39.9	23%	0.234	21%	0.208	C	C	.	.	T	Hydrogen-bonded Turn	trans	-79.5	-27.6	177.9	-55.5	170.2	-71.8	-172.3	5.7	111.9	T127 R128 D164 F214	T127-R166 VanDerWaalsContact O-CD 3.22Å; T127-R166 WeakPolarHBondContact O-CD 3.28Å; R128-R166 HydrophobicContact CB-CG 3.95Å; D164-R166 PolarHBondContact O-N 2.92Å; D164-R166 WeakPolarHBondContact OD1-CB 3.08Å; D164-R166 VanDerWaalsContact OD1-CG 3.3Å; D164-R166 WeakPolarHBondContact OD1-CG 3.48Å; D164-R166 IonicContact OD1-CZ 3.88Å; D164-R166 PolarHBondContact OD1-N 3.28Å; D164-R166 IonicContact OD1-NE 2.93Å; D164-R166 PolarHBondContact OD1-NE 3.13Å; D164-R166 IonicContact OD1-NH2 3.32Å; D164-R166 IonicContact OD2-CZ 3.69Å; D164-R166 IonicContact OD2-NE 2.84Å; D164-R166 PolarHBondContact OD2-NE 3.14Å; D164-R166 IonicContact OD2-NH2 3.67Å; D164-R166 PolarHBondContact OD2-NH2 2.82Å; R166-F214 PolarHBondContact NH2-O 3.36Å
167	A	91.4	Very high	92	Very high	10 Å²	10	39.2 Å²	39.2	8%	0.083	21%	0.205	C	C	.	.	S	Bend	trans	-67.4	158.4	179.8	0	0	0	0	0	111.4	D164 G169 G170 K174 I215 L216	D164-A167 PolarHBondContact O-N 3.28Å; A167-G169 PolarHBondContact O-N 3.34Å; A167-G170 WeakPolarHBondContact O-CA 3.4Å; A167-G170 PolarHBondContact O-N 3.4Å; A167-K174 VanDerWaalsContact CB-NZ 3.3Å; A167-I215 HydrophobicContact CB-CG2 3.69Å; A167-L216 WeakPolarHBondContact CB-O 3.21Å
168	K	85.6	Confident	92	Very high	169 Å²	169	39.2 Å²	39.2	74%	0.735	21%	0.205	S	C	*	.	T	Hydrogen-bonded Turn	trans	-57.6	135.4	171.9	-173.3	-178.1	177.6	-171	0	109.4	G170 F217	K168-G170 PolarHBondContact O-N 3.25Å; K168-F217 HydrophobicContact CB-CE2 4.32Å
169	G	83.3	Confident	92	Very high	28 Å²	28	39.2 Å²	39.2	29%	0.289	21%	0.205	S	C	.	.	T	Hydrogen-bonded Turn	trans	65.7	18.1	-172.5	0	0	0	0	0	113.6	A167 N171 E172 K174	A167-G169 PolarHBondContact O-N 3.34Å; G169-N171 PolarHBondContact O-N 3.48Å; G169-N171 VanDerWaalsContact O-N 3.09Å; G169-E172 WeakPolarHBondContact O-CB 3.34Å; G169-E172 PolarHBondContact O-N 3.2Å; G169-K174 WeakPolarHBondContact O-CE 3.48Å
170	G	81.8	Confident	92	Very high	3 Å²	3	39.2 Å²	39.2	3%	0.031	21%	0.205	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.3	-15.6	-176.9	0	0	0	0	0	115	H163 L165 A167 K168	H163-G170 PolarHBondContact NE2-O 2.9Å; L165-G170 WeakPolarHBondContact CD2-O 3.44Å; A167-G170 WeakPolarHBondContact O-CA 3.4Å; A167-G170 PolarHBondContact O-N 3.4Å; K168-G170 PolarHBondContact O-N 3.25Å
171	N	82.4	Confident	92	Very high	140 Å²	140	39.2 Å²	39.2	75%	0.749	21%	0.205	S	C	*	.	T	Hydrogen-bonded Turn	trans	-90.8	-1.2	173.6	-65.4	-20	0	0	0	112.9	G169	G169-N171 PolarHBondContact O-N 3.48Å; G169-N171 VanDerWaalsContact O-N 3.09Å
172	E	86.5	Confident	92.1	Very high	138 Å²	138	37.9 Å²	37.9	65%	0.645	20%	0.2	S	C	*	.	S	Bend	trans	-99.9	157	-178.8	-60.2	171.3	-169.6	0	0	110.2	H163 G169 K174	H163-E172 PolarHBondContact CE1-O 3.5Å; G169-E172 WeakPolarHBondContact O-CB 3.34Å; G169-E172 PolarHBondContact O-N 3.2Å; E172-K174 PolarHBondContact O-N 3.31Å
173	S	82.1	Confident	92.2	Very high	106 Å²	106	37.9 Å²	37.9	74%	0.741	20%	0.2	S	C	*	.			trans	-67.4	128.9	171.1	-177	0	0	0	0	109.4
174	K	86.4	Confident	92.3	Very high	10 Å²	10	36.3 Å²	36.3	4%	0.043	19%	0.193	C	C	.	.			trans	-114	146.1	-176.9	-71.5	173.3	169.6	-166.6	0	111	R161 A167 G169 E172 F217 D219	R161-K174 PolarHBondContact NH2-O 3.06Å; A167-K174 VanDerWaalsContact CB-NZ 3.3Å; G169-K174 WeakPolarHBondContact O-CE 3.48Å; E172-K174 PolarHBondContact O-N 3.31Å; K174-F217 VanDerWaalsContact CD-O 3.26Å; K174-F217 WeakPolarHBondContact CD-O 3.23Å; K174-F217 VanDerWaalsContact CE-O 3.3Å; K174-F217 WeakPolarHBondContact CE-O 3.02Å; K174-F217 PolarHBondContact NZ-O 2.84Å; K174-D219 WeakPolarHBondContact CB-OD1 3.4Å
175	L	94.8	Very high	92.5	Very high	49 Å²	49	36.3 Å²	36.3	26%	0.257	19%	0.193	S	C	.	.			trans	-68.3	148.9	169.1	-58	172.3	0	0	0	110.3	D219 D247 V249 Q368	L175-D219 PolarHBondContact O-N 2.94Å; L175-D219 VanDerWaalsContact O-N 3.16Å; L175-D247 WeakPolarHBondContact CA-O 3.48Å; L175-V249 HydrophobicContact CB-CG1 3.94Å; L175-V249 HydrophobicContact CB-CG2 3.88Å; L175-V249 HydrophobicContact CD1-CG1 3.77Å; L175-V249 HydrophobicContact CD1-CG2 4.46Å; L175-V249 HydrophobicContact CD2-CG1 3.76Å; L175-V249 HydrophobicContact CG-CG1 4.01Å; L175-Q368 VanDerWaalsContact CD1-O 3.27Å; L175-Q368 WeakPolarHBondContact CD1-O 3.37Å; L175-Q368 PolarHBondContact O-NE2 3.13Å; L175-Q368 VanDerWaalsContact O-NE2 3.13Å
176	A	97.1	Very high	92.7	Very high	0 Å²	0	34.3 Å²	34.3	0%	0	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	144.2	-171.7	0	0	0	0	0	112.6	D219 I221 D247 I248 V249	A176-D219 CarbonylContact C-O 3.28Å; A176-D219 VanDerWaalsContact CA-O 3.28Å; A176-D219 WeakPolarHBondContact CA-O 3.21Å; A176-D219 HydrophobicContact CB-CB 3.83Å; A176-I221 HydrophobicContact CB-CD1 3.63Å; A176-I221 HydrophobicContact CB-CG1 3.97Å; A176-D247 HydrophobicContact CB-CB 4.39Å; A176-D247 PolarHBondContact N-O 2.71Å; A176-I248 HydrophobicContact CB-CG1 4.49Å; A176-I248 WeakPolarHBondContact O-CA 3.3Å; A176-V249 PolarHBondContact O-N 3.42Å; A176-V249 VanDerWaalsContact O-N 3.1Å
177	F	98.3	Very high	92.9	Very high	0 Å²	0	36.4 Å²	36.4	0%	0	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.1	129.5	164.2	-172.3	-90.1	0	0	0	110	I179 D219 L220 I221 A250 F251 M252 L277 F357 I361	F177-I179 HydrophobicContact CD1-CD1 3.74Å; F177-I179 HydrophobicContact CD1-CG1 4.12Å; F177-I179 HydrophobicContact CE1-CD1 4.15Å; F177-I179 HydrophobicContact CE1-CG1 4Å; F177-D219 PolarHBondContact N-O 3.14Å; F177-L220 HydrophobicContact CB-CD2 4.12Å; F177-L220 WeakPolarHBondContact O-CA 3.49Å; F177-I221 PolarHBondContact O-N 2.85Å; F177-A250 WeakPolarHBondContact CA-O 3.28Å; F177-A250 HydrophobicContact CD2-CB 3.63Å; F177-A250 HydrophobicContact CE2-CB 3.71Å; F177-F251 VanDerWaalsContact CZ-C 3.41Å; F177-M252 HydrophobicContact CE1-CB 3.85Å; F177-M252 HydrophobicContact CZ-CB 3.81Å; F177-L277 HydrophobicContact CD2-CD2 4.47Å; F177-L277 HydrophobicContact CE2-CD2 3.67Å; F177-F357 AromaticContact CE1-CE1 3.92Å; F177-F357 HydrophobicContact CE1-CE1 3.92Å; F177-F357 HydrophobicContact CE2-CE1 4.46Å; F177-F357 AromaticContact CZ-CE1 3.61Å; F177-F357 HydrophobicContact CZ-CE1 3.61Å; F177-F357 HydrophobicContact CZ-CZ 4.12Å; F177-I361 HydrophobicContact CB-CG2 3.7Å; F177-I361 HydrophobicContact CD1-CG2 3.98Å; F177-I361 HydrophobicContact CD2-CG2 3.53Å; F177-I361 HydrophobicContact CE2-CG2 4.13Å; F177-I361 HydrophobicContact CG-CG2 3.45Å; F177-I361 VanDerWaalsContact CG-CG2 3.45Å
178	L	98.7	Very high	93.1	Very high	0 Å²	0	38.2 Å²	38.2	0%	0	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.7	133	-179.6	174.1	70.8	0	0	0	111.3	I221 L223 F238 I248 A250 F251 M252 F312	L178-I221 CarbonylContact C-O 3.46Å; L178-I221 WeakPolarHBondContact CA-O 3.31Å; L178-I221 HydrophobicContact CD1-CB 4.19Å; L178-I221 HydrophobicContact CD1-CG2 3.83Å; L178-L223 HydrophobicContact CD1-CB 3.64Å; L178-L223 HydrophobicContact CD1-CD2 4.38Å; L178-F238 HydrophobicContact CD1-CE1 4.09Å; L178-F238 HydrophobicContact CD2-CE1 4.45Å; L178-I248 HydrophobicContact CB-CD1 4.15Å; L178-I248 HydrophobicContact CB-CG1 4.44Å; L178-I248 HydrophobicContact CB-CG2 3.71Å; L178-I248 HydrophobicContact CD1-CD1 4.23Å; L178-I248 HydrophobicContact CD2-CD1 4.13Å; L178-I248 HydrophobicContact CD2-CG2 4.47Å; L178-I248 HydrophobicContact CG-CD1 4.4Å; L178-A250 PolarHBondContact N-O 2.82Å; L178-F251 HydrophobicContact CB-CB 3.72Å; L178-F251 HydrophobicContact CD2-CB 4.01Å; L178-F251 HydrophobicContact CG-CB 4.13Å; L178-F251 CarbonylContact O-C 3.57Å; L178-F251 WeakPolarHBondContact O-CA 3.28Å; L178-F251 WeakPolarHBondContact O-CB 3.23Å; L178-M252 PolarHBondContact O-N 3.35Å; L178-F312 HydrophobicContact CD2-CD1 4Å; L178-F312 HydrophobicContact CD2-CD2 4.38Å; L178-F312 HydrophobicContact CD2-CE1 3.75Å; L178-F312 HydrophobicContact CD2-CE2 4.14Å; L178-F312 HydrophobicContact CD2-CG 4.33Å; L178-F312 HydrophobicContact CD2-CZ 3.84Å
179	I	98.8	Very high	93.7	Very high	0 Å²	0	30.2 Å²	30.2	0%	0	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	116.5	164.8	-56	86	0	0	0	106.8	F177 M202 L220 I221 F222 L223 M252 L254 V358	F177-I179 HydrophobicContact CD1-CD1 3.74Å; F177-I179 HydrophobicContact CD1-CG1 4.12Å; F177-I179 HydrophobicContact CE1-CD1 4.15Å; F177-I179 HydrophobicContact CE1-CG1 4Å; I179-M202 HydrophobicContact CG2-CE 4.17Å; I179-M202 HydrophobicContact CG2-CG 4.01Å; I179-M202 HydrophobicContact CG2-SD 3.94Å; I179-M202 WeakPolarHBondContact O-CE 3.22Å; I179-L220 HydrophobicContact CD1-CD2 4.44Å; I179-I221 PolarHBondContact N-O 3.2Å; I179-F222 HydrophobicContact CB-CD1 3.89Å; I179-F222 HydrophobicContact CB-CE1 4.13Å; I179-F222 HydrophobicContact CD1-CD1 4.22Å; I179-F222 HydrophobicContact CD1-CE1 3.9Å; I179-F222 HydrophobicContact CD1-CE2 4.34Å; I179-F222 HydrophobicContact CD1-CZ 3.97Å; I179-F222 HydrophobicContact CG1-CD1 4.34Å; I179-F222 HydrophobicContact CG1-CE1 4.1Å; I179-F222 HydrophobicContact CG2-CD1 4.29Å; I179-F222 HydrophobicContact CG2-CE1 4.46Å; I179-F222 CarbonylContact O-C 3.52Å; I179-F222 WeakPolarHBondContact O-CA 3.49Å; I179-L223 PolarHBondContact O-N 3.43Å; I179-M252 WeakPolarHBondContact CA-O 3.29Å; I179-L254 HydrophobicContact CG2-CD1 3.95Å; I179-L254 HydrophobicContact CG2-CG 4.5Å; I179-V358 HydrophobicContact CD1-CG2 4.1Å; I179-V358 HydrophobicContact CG1-CG2 3.98Å
180	S	98.7	Very high	94.4	Very high	0 Å²	0	29.8 Å²	29.8	0%	0	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	140.3	-175.4	-175.9	0	0	0	0	111.4	M252 L254 F312	S180-M252 PolarHBondContact N-O 2.99Å; S180-L254 PolarHBondContact O-N 3.41Å; S180-F312 WeakPolarHBondContact OG-CE2 3.02Å; S180-F312 WeakPolarHBondContact OG-CZ 3.35Å
181	C	98.7	Very high	95.1	Very high	0 Å²	0	29.7 Å²	29.7	0%	0	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.7	146.2	169.2	-176	0	0	0	0	109.5	A195 N198 C199 M202 L223 F224 N225 L254	C181-A195 PolarHBondContact SG-O 2.95Å; C181-N198 HydrophobicContact CB-CB 4.32Å; C181-N198 WeakPolarHBondContact SG-CB 3.18Å; C181-C199 PolarHBondContact SG-N 3.05Å; C181-C199 VanDerWaalsContact SG-N 3.41Å; C181-C199 PolarHBondContact SG-SG 3.45Å; C181-M202 HydrophobicContact CB-CE 4.33Å; C181-M202 HydrophobicContact CB-SD 3.35Å; C181-M202 WeakPolarHBondContact CB-SD 3.25Å; C181-L223 PolarHBondContact N-O 3.3Å; C181-F224 WeakPolarHBondContact O-CA 3.23Å; C181-N225 PolarHBondContact O-N 2.7Å; C181-N225 PolarHBondContact O-ND2 3.44Å; C181-L254 HydrophobicContact CB-CB 4.41Å
182	H	98.6	Very high	95.8	Very high	0 Å²	0	23 Å²	23	0%	0	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.4	153.3	173.5	77.6	100.5	0	0	0	112.2	D184 D194 A195 C199 N225 E228 E255	H182-D184 IonicContact CG-OD1 2.69Å; H182-D184 PolarHBondContact ND1-O 2.93Å; H182-D184 VanDerWaalsContact ND1-O 3.16Å; H182-D184 IonicContact ND1-OD1 3.94Å; H182-D184 PolarHBondContact ND1-OD1 3.47Å; H182-D194 IonicContact CE1-OD1 2.9Å; H182-D194 IonicContact NE2-OD1 3.14Å; H182-D194 PolarHBondContact NE2-OD1 2.74Å; H182-A195 VanDerWaalsContact CD2-CB 3.44Å; H182-A195 WeakPolarHBondContact CD2-CB 3.44Å; H182-A195 PolarHBondContact CE1-N 3.19Å; H182-A195 WeakPolarHBondContact NE2-CB 3.39Å; H182-A195 PolarHBondContact NE2-N 3.45Å; H182-C199 PolarHBondContact O-SG 2.77Å; H182-N225 CarbonylContact C-O 3.52Å; H182-N225 WeakPolarHBondContact CA-ND2 3.42Å; H182-N225 VanDerWaalsContact CA-O 3.22Å; H182-N225 WeakPolarHBondContact CA-O 3.36Å; H182-N225 VanDerWaalsContact CB-CG 3.44Å; H182-N225 WeakPolarHBondContact CB-ND2 3.37Å; H182-N225 WeakPolarHBondContact CB-OD1 3.35Å; H182-N225 PolarHBondContact N-ND2 3.33Å; H182-E228 HydrophobicContact CB-CB 3.34Å; H182-E228 HydrophobicContact CB-CG 4.03Å; H182-E228 VanDerWaalsContact CG-CB 3.44Å; H182-E255 IonicContact CD2-OE2 3.58Å; H182-E255 PolarHBondContact CD2-OE2 3.46Å; H182-E255 IonicContact NE2-OE2 2.73Å
183	Y	98.4	Very high	96.3	Very high	0 Å²	0	16.5 Å²	16.5	0%	0	12%	0.115	C	C	.	.			trans	-119.3	-12.2	179.6	69	-100.6	0	0	0	114	R98 N105 A109 L113 F158 F224 N225	R98-Y183 PolarHBondContact NE-O 2.96Å; R98-Y183 PolarHBondContact NH2-O 2.93Å; N105-Y183 WeakPolarHBondContact OD1-CD2 3.43Å; N105-Y183 WeakPolarHBondContact OD1-CE2 3.42Å; A109-Y183 HydrophobicContact CB-CD2 4.14Å; A109-Y183 HydrophobicContact CB-CE2 4.35Å; L113-Y183 HydrophobicContact CD1-CD1 3.47Å; L113-Y183 VanDerWaalsContact CD1-CD1 3.47Å; L113-Y183 HydrophobicContact CD1-CD2 4.04Å; L113-Y183 HydrophobicContact CD1-CE1 3.88Å; L113-Y183 HydrophobicContact CD1-CE2 4.4Å; L113-Y183 HydrophobicContact CD1-CG 3.57Å; F158-Y183 HydrophobicContact CD2-CE1 4.21Å; F158-Y183 HydrophobicContact CE2-CE1 4.48Å; Y183-F224 HydrophobicContact CD1-CB 4.07Å; Y183-N225 VanDerWaalsContact CD1-C 3.48Å; Y183-N225 WeakPolarHBondContact CD1-O 3.14Å; Y183-N225 VanDerWaalsContact CE1-C 3.42Å; Y183-N225 WeakPolarHBondContact CE1-O 3.48Å; Y183-N225 PolarHBondContact N-O 3.29Å
184	D	98.5	Very high	97	Very high	0 Å²	0	11.5 Å²	11.5	0%	0	8%	0.08	C	C	.	.			trans	-71.6	174.4	168.9	68.6	-55.1	0	0	0	111	R98 N105 H182 G226 A227 E228 E229	R98-D184 VanDerWaalsContact O-CA 3.28Å; R98-D184 WeakPolarHBondContact O-CA 2.96Å; R98-D184 VanDerWaalsContact O-CB 3.32Å; R98-D184 WeakPolarHBondContact O-CB 3.16Å; N105-D184 WeakPolarHBondContact OD1-CA 3.43Å; N105-D184 WeakPolarHBondContact OD1-CB 3.4Å; H182-D184 IonicContact CG-OD1 2.69Å; H182-D184 PolarHBondContact ND1-O 2.93Å; H182-D184 VanDerWaalsContact ND1-O 3.16Å; H182-D184 IonicContact ND1-OD1 3.94Å; H182-D184 PolarHBondContact ND1-OD1 3.47Å; D184-G226 WeakPolarHBondContact CB-O 2.94Å; D184-A227 PolarHBondContact OD1-N 2.66Å; D184-A227 WeakPolarHBondContact OD2-CA 3.05Å; D184-E228 PolarHBondContact OD1-N 2.85Å; D184-E228 PolarHBondContact OD2-N 3.04Å; D184-E228 VanDerWaalsContact OD2-N 3.11Å; D184-E229 WeakPolarHBondContact OD2-CB 3.46Å; D184-E229 PolarHBondContact OD2-N 3.23Å
185	T	98.2	Very high	97.5	Very high	1 Å²	1	11 Å²	11	1%	0.006	8%	0.078	C	C	.	.			trans	-139.7	153.8	-176.3	70.2	0	0	0	0	111.6	S97 R98 T99 S189 E229	S97-T185 PolarHBondContact OG-OG1 2.98Å; R98-T185 HydrophobicContact CB-CG2 4.09Å; R98-T185 PolarHBondContact N-OG1 2.78Å; R98-T185 PolarHBondContact O-N 3.41Å; T99-T185 WeakPolarHBondContact CA-O 3.45Å; T99-T185 WeakPolarHBondContact CG2-O 3.31Å; T185-S189 PolarHBondContact OG1-O 2.84Å; T185-E229 VanDerWaalsContact C-CG 3.49Å
186	A	96.7	Very high	97.7	Very high	4 Å²	4	8.7 Å²	8.7	3%	0.033	7%	0.065	C	C	.	.			trans	-54.9	153.7	161.9	0	0	0	0	0	112.8	S97 G188 S189 E229 H333	S97-A186 PolarHBondContact OG-O 3.49Å; A186-G188 PolarHBondContact O-N 2.73Å; A186-S189 PolarHBondContact O-N 3.41Å; A186-E229 WeakPolarHBondContact CB-OE1 3.44Å; A186-E229 VanDerWaalsContact N-CD 3.26Å; A186-E229 PolarHBondContact N-OE1 3.35Å; A186-H333 HydrophobicContact CB-CB 4.03Å; A186-H333 VanDerWaalsContact CB-CD2 3.44Å; A186-H333 WeakPolarHBondContact CB-CD2 3.43Å
187	P	96.3	Very high	97.7	Very high	106 Å²	106	8.7 Å²	8.7	69%	0.688	7%	0.065	S	C	*	.	T	Hydrogen-bonded Turn	trans	-56.8	127.2	177.4	-25	34.3	0	0	0	113.1	T99 S189	T99-P187 HydrophobicContact CG2-CB 4.11Å; T99-P187 HydrophobicContact CG2-CG 3.92Å; P187-S189 PolarHBondContact O-N 3.34Å
188	G	95.8	Very high	97.7	Very high	48 Å²	48	8.7 Å²	8.7	50%	0.495	7%	0.065	S	C	.	.	T	Hydrogen-bonded Turn	trans	79.4	-0.5	175.5	0	0	0	0	0	115.1	S97 A186 P335	S97-G188 PolarHBondContact OG-N 2.98Å; S97-G188 VanDerWaalsContact OG-N 3.11Å; A186-G188 PolarHBondContact O-N 2.73Å; G188-P335 WeakPolarHBondContact O-CG 3.43Å
189	S	97.4	Very high	97.7	Very high	2 Å²	2	8.7 Å²	8.7	1%	0.014	7%	0.065	C	C	.	.			trans	-99.3	145.1	174.6	-172.4	0	0	0	0	111.8	S97 T185 A186 P187 G191 T334	S97-S189 WeakPolarHBondContact CA-O 3.48Å; S97-S189 WeakPolarHBondContact CB-O 3.26Å; S97-S189 PolarHBondContact OG-O 2.93Å; T185-S189 PolarHBondContact OG1-O 2.84Å; A186-S189 PolarHBondContact O-N 3.41Å; P187-S189 PolarHBondContact O-N 3.34Å; S189-G191 PolarHBondContact OG-N 3.08Å; S189-T334 WeakPolarHBondContact CA-O 3.46Å; S189-T334 WeakPolarHBondContact CB-O 3.21Å; S189-T334 PolarHBondContact OG-O 2.94Å
190	P	97.5	Very high	97.7	Very high	19 Å²	19	8.7 Å²	8.7	12%	0.123	7%	0.065	C	C	.	.			trans	-71.6	-16.1	166.8	-5.5	21.3	0	0	0	113	R98 A192 T334 D337 T338	R98-P190 VanDerWaalsContact CZ-O 3.3Å; R98-P190 PolarHBondContact NH1-O 3.38Å; R98-P190 PolarHBondContact NH2-O 3.48Å; P190-A192 PolarHBondContact O-N 3.07Å; P190-T334 WeakPolarHBondContact CD-O 3.3Å; P190-D337 WeakPolarHBondContact CB-O 3.21Å; P190-D337 WeakPolarHBondContact CD-O 3.34Å; P190-D337 VanDerWaalsContact CG-O 3.27Å; P190-D337 WeakPolarHBondContact CG-O 3.21Å; P190-T338 HydrophobicContact CG-CG2 4.18Å
191	G	97.3	Very high	97.7	Very high	1 Å²	1	8.7 Å²	8.7	1%	0.01	7%	0.065	C	C	.	.			trans	54.6	48.6	-179.6	0	0	0	0	0	113.2	R98 S189 D194 F196 D337	R98-G191 PolarHBondContact NH2-O 3.31Å; S189-G191 PolarHBondContact OG-N 3.08Å; G191-D194 CarbonylContact C-O 3.54Å; G191-D194 WeakPolarHBondContact CA-O 2.98Å; G191-F196 VanDerWaalsContact O-CB 3.3Å; G191-F196 WeakPolarHBondContact O-CB 3.23Å; G191-F196 PolarHBondContact O-N 3.29Å; G191-D337 VanDerWaalsContact C-OD2 3.28Å; G191-D337 WeakPolarHBondContact CA-OD2 3.38Å
192	A	97.8	Very high	97.7	Very high	0 Å²	0	8.7 Å²	8.7	0%	0	7%	0.065	C	C	.	.	I	π-helix	trans	-72.7	-50.8	177.7	0	0	0	0	0	111	L89 T93 P190 V197 D337 T338 E339 I342	L89-A192 HydrophobicContact CD1-CB 4.32Å; T93-A192 HydrophobicContact CG2-CB 3.69Å; P190-A192 PolarHBondContact O-N 3.07Å; A192-V197 VanDerWaalsContact O-CB 3.23Å; A192-V197 WeakPolarHBondContact O-CB 3.27Å; A192-V197 WeakPolarHBondContact O-CG1 3.37Å; A192-V197 PolarHBondContact O-N 3.34Å; A192-D337 WeakPolarHBondContact CB-O 3.4Å; A192-D337 PolarHBondContact N-O 2.8Å; A192-D337 PolarHBondContact N-OD2 2.8Å; A192-T338 VanDerWaalsContact CB-C 3.43Å; A192-E339 HydrophobicContact CB-CB 4.39Å; A192-E339 VanDerWaalsContact CB-N 3.33Å; A192-I342 HydrophobicContact CB-CD1 4.26Å
193	S	96.1	Very high	97.7	Very high	0 Å²	0	8.8 Å²	8.8	0%	0	7%	0.066	C	C	.	.	I	π-helix	trans	-87.4	-24.5	177	64.9	0	0	0	0	113.5	A195 G256 G258 A259 D337	S193-A195 WeakPolarHBondContact O-CA 3.37Å; S193-G256 WeakPolarHBondContact O-CA 3.34Å; S193-G258 WeakPolarHBondContact CB-O 3.15Å; S193-G258 PolarHBondContact OG-O 2.91Å; S193-G258 VanDerWaalsContact OG-O 3.09Å; S193-A259 VanDerWaalsContact CB-CA 3.43Å; S193-A259 WeakPolarHBondContact OG-CA 3.29Å; S193-D337 VanDerWaalsContact CB-OD1 3.24Å; S193-D337 WeakPolarHBondContact CB-OD1 3.45Å; S193-D337 PolarHBondContact N-OD1 3.45Å; S193-D337 PolarHBondContact N-OD2 3.09Å; S193-D337 PolarHBondContact OG-OD1 3.27Å; S193-D337 PolarHBondContact OG-OD2 3.48Å
194	D	97	Very high	97.6	Very high	1 Å²	1	8.8 Å²	8.8	1%	0.005	7%	0.066	C	C	.	.	I	π-helix	trans	-115.2	90.4	175.4	-164.6	38.8	0	0	0	111.8	H182 G191 E229 G256 Y332 H333 D337	H182-D194 IonicContact CE1-OD1 2.9Å; H182-D194 IonicContact NE2-OD1 3.14Å; H182-D194 PolarHBondContact NE2-OD1 2.74Å; G191-D194 CarbonylContact C-O 3.54Å; G191-D194 WeakPolarHBondContact CA-O 2.98Å; D194-E229 VanDerWaalsContact OD2-OE1 3.08Å; D194-G256 WeakPolarHBondContact OD1-CA 3.37Å; D194-G256 PolarHBondContact OD1-N 2.93Å; D194-G256 VanDerWaalsContact OD1-N 3.16Å; D194-Y332 HydrophobicContact CB-CD2 4.22Å; D194-Y332 HydrophobicContact CB-CE2 3.99Å; D194-Y332 WeakPolarHBondContact OD2-CE2 3.43Å; D194-H333 IonicContact OD2-CD2 2.7Å; D194-H333 PolarHBondContact OD2-CD2 2.7Å; D194-H333 IonicContact OD2-NE2 3.07Å; D194-H333 PolarHBondContact OD2-NE2 3.13Å; D194-D337 PolarHBondContact N-OD2 2.82Å
195	A	97.3	Very high	97.5	Very high	0 Å²	0	8.8 Å²	8.8	0%	0	7%	0.066	C	C	.	.	I	π-helix	cis	-124.8	20.4	-11.8	0	0	0	0	0	112.5	C181 H182 S193 V197 N198 C199	C181-A195 PolarHBondContact SG-O 2.95Å; H182-A195 VanDerWaalsContact CD2-CB 3.44Å; H182-A195 WeakPolarHBondContact CD2-CB 3.44Å; H182-A195 PolarHBondContact CE1-N 3.19Å; H182-A195 WeakPolarHBondContact NE2-CB 3.39Å; H182-A195 PolarHBondContact NE2-N 3.45Å; S193-A195 WeakPolarHBondContact O-CA 3.37Å; A195-V197 PolarHBondContact O-N 3.41Å; A195-N198 WeakPolarHBondContact O-CB 3.29Å; A195-N198 PolarHBondContact O-N 3.47Å; A195-C199 PolarHBondContact O-N 2.78Å
196	F	98.4	Very high	97.5	Very high	0 Å²	0	8.7 Å²	8.7	0%	0	7%	0.066	C	C	.	.	I	π-helix	trans	-61.9	-22.9	-166.8	-161.2	-89.8	0	0	0	114.5	H88 L89 V92 L113 G191 N198 C199 S200	H88-F196 WeakPolarHBondContact O-CE1 3.45Å; L89-F196 HydrophobicContact CD1-CB 4.35Å; L89-F196 HydrophobicContact CD1-CD1 3.93Å; V92-F196 HydrophobicContact CB-CD1 3.87Å; V92-F196 HydrophobicContact CB-CD2 4.17Å; V92-F196 HydrophobicContact CB-CE1 3.44Å; V92-F196 VanDerWaalsContact CB-CE1 3.44Å; V92-F196 HydrophobicContact CB-CE2 3.77Å; V92-F196 HydrophobicContact CB-CG 4.24Å; V92-F196 HydrophobicContact CB-CZ 3.4Å; V92-F196 VanDerWaalsContact CB-CZ 3.4Å; V92-F196 HydrophobicContact CG1-CD1 4.22Å; V92-F196 HydrophobicContact CG1-CD2 3.67Å; V92-F196 HydrophobicContact CG1-CE1 4.06Å; V92-F196 HydrophobicContact CG1-CE2 3.47Å; V92-F196 VanDerWaalsContact CG1-CE2 3.47Å; V92-F196 HydrophobicContact CG1-CG 4.07Å; V92-F196 HydrophobicContact CG1-CZ 3.7Å; V92-F196 HydrophobicContact CG2-CE1 3.63Å; V92-F196 HydrophobicContact CG2-CE2 3.84Å; V92-F196 HydrophobicContact CG2-CZ 3.23Å; L113-F196 HydrophobicContact CD2-CE2 4.42Å; L113-F196 HydrophobicContact CD2-CZ 4.48Å; G191-F196 VanDerWaalsContact O-CB 3.3Å; G191-F196 WeakPolarHBondContact O-CB 3.23Å; G191-F196 PolarHBondContact O-N 3.29Å; F196-N198 VanDerWaalsContact C-N 3.25Å; F196-N198 PolarHBondContact O-N 2.78Å; F196-C199 HydrophobicContact CD2-CB 3.95Å; F196-C199 HydrophobicContact CE2-CB 3.93Å; F196-C199 HydrophobicContact CG-CB 4.3Å; F196-C199 HydrophobicContact CZ-CB 4.26Å; F196-C199 WeakPolarHBondContact O-CB 3.43Å; F196-C199 PolarHBondContact O-N 3.3Å; F196-S200 WeakPolarHBondContact CD1-OG 3.3Å; F196-S200 VanDerWaalsContact CE1-OG 3.27Å; F196-S200 WeakPolarHBondContact CE1-OG 3.35Å; F196-S200 PolarHBondContact O-N 3.27Å; F196-S200 PolarHBondContact O-OG 3.45Å
197	V	98.2	Very high	97.4	Very high	0 Å²	0	12.8 Å²	12.8	0%	0	8%	0.08	C	C	.	.	H	α-helix	trans	-55.4	-40.9	169.2	63.1	0	0	0	0	112.2	L89 A192 A195 S200 V201 Y325 I342 L347	L89-V197 HydrophobicContact CD1-CB 4.23Å; L89-V197 HydrophobicContact CD2-CB 4.41Å; L89-V197 HydrophobicContact CD2-CG2 4.36Å; A192-V197 VanDerWaalsContact O-CB 3.23Å; A192-V197 WeakPolarHBondContact O-CB 3.27Å; A192-V197 WeakPolarHBondContact O-CG1 3.37Å; A192-V197 PolarHBondContact O-N 3.34Å; A195-V197 PolarHBondContact O-N 3.41Å; V197-S200 WeakPolarHBondContact O-CB 3.4Å; V197-S200 PolarHBondContact O-N 3.3Å; V197-V201 WeakPolarHBondContact O-CG2 3.36Å; V197-V201 PolarHBondContact O-N 3.17Å; V197-Y325 HydrophobicContact CG1-CD2 3.96Å; V197-Y325 HydrophobicContact CG1-CE2 3.51Å; V197-Y325 HydrophobicContact CG2-CE2 4.39Å; V197-I342 HydrophobicContact CB-CD1 3.74Å; V197-I342 HydrophobicContact CG1-CD1 4.22Å; V197-I342 HydrophobicContact CG2-CD1 3.85Å; V197-I342 HydrophobicContact CG2-CG2 4.1Å; V197-L347 HydrophobicContact CG2-CD1 3.52Å
198	N	98.2	Very high	97.3	Very high	0 Å²	0	8.6 Å²	8.6	0%	0	5%	0.052	C	C	.	.	H	α-helix	trans	-74.7	-34.4	179.1	-69	-39	0	0	0	111	C181 A195 F196 S200 V201 M202 L254 E255 Y325	C181-N198 HydrophobicContact CB-CB 4.32Å; C181-N198 WeakPolarHBondContact SG-CB 3.18Å; A195-N198 WeakPolarHBondContact O-CB 3.29Å; A195-N198 PolarHBondContact O-N 3.47Å; F196-N198 VanDerWaalsContact C-N 3.25Å; F196-N198 PolarHBondContact O-N 2.78Å; N198-S200 VanDerWaalsContact C-N 3.3Å; N198-S200 PolarHBondContact O-N 2.84Å; N198-V201 PolarHBondContact O-N 3.36Å; N198-M202 WeakPolarHBondContact O-CB 3.27Å; N198-M202 VanDerWaalsContact O-CG 3.27Å; N198-M202 WeakPolarHBondContact O-CG 3.15Å; N198-M202 PolarHBondContact O-N 2.8Å; N198-L254 HydrophobicContact CB-CB 3.67Å; N198-L254 HydrophobicContact CB-CD1 4.07Å; N198-E255 PolarHBondContact ND2-N 2.8Å; N198-E255 PolarHBondContact ND2-O 2.8Å; N198-Y325 WeakPolarHBondContact OD1-CE2 3.12Å
199	C	98.7	Very high	97.2	Very high	0 Å²	0	6.5 Å²	6.5	0%	0	3%	0.029	C	C	.	.	H	α-helix	trans	-57.9	-44.1	167.1	-75.3	0	0	0	0	111.3	C181 H182 A195 F196 V201 M202 L203 F224	C181-C199 PolarHBondContact SG-N 3.05Å; C181-C199 VanDerWaalsContact SG-N 3.41Å; C181-C199 PolarHBondContact SG-SG 3.45Å; H182-C199 PolarHBondContact O-SG 2.77Å; A195-C199 PolarHBondContact O-N 2.78Å; F196-C199 HydrophobicContact CD2-CB 3.95Å; F196-C199 HydrophobicContact CE2-CB 3.93Å; F196-C199 HydrophobicContact CG-CB 4.3Å; F196-C199 HydrophobicContact CZ-CB 4.26Å; F196-C199 WeakPolarHBondContact O-CB 3.43Å; F196-C199 PolarHBondContact O-N 3.3Å; C199-V201 VanDerWaalsContact C-N 3.34Å; C199-V201 PolarHBondContact O-N 3.26Å; C199-M202 PolarHBondContact O-N 2.99Å; C199-L203 WeakPolarHBondContact O-CG 3.07Å; C199-L203 PolarHBondContact O-N 3.48Å; C199-F224 HydrophobicContact CB-CD1 4.04Å; C199-F224 HydrophobicContact CB-CE1 4.07Å
200	S	98.5	Very high	97	Very high	0 Å²	0	6.4 Å²	6.4	0%	0	3%	0.029	C	C	.	.	H	α-helix	trans	-64.8	-40	180	-56.9	0	0	0	0	111.6	L89 F196 V197 N198 E204	L89-S200 WeakPolarHBondContact CA-OG 3.49Å; L89-S200 PolarHBondContact N-OG 3.03Å; F196-S200 WeakPolarHBondContact CD1-OG 3.3Å; F196-S200 VanDerWaalsContact CE1-OG 3.27Å; F196-S200 WeakPolarHBondContact CE1-OG 3.35Å; F196-S200 PolarHBondContact O-N 3.27Å; F196-S200 PolarHBondContact O-OG 3.45Å; V197-S200 WeakPolarHBondContact O-CB 3.4Å; V197-S200 PolarHBondContact O-N 3.3Å; N198-S200 VanDerWaalsContact C-N 3.3Å; N198-S200 PolarHBondContact O-N 2.84Å; S200-E204 PolarHBondContact O-N 2.95Å
201	V	97.9	Very high	96.7	Very high	0 Å²	0	9.1 Å²	9.1	0%	0	5%	0.045	C	C	.	.	H	α-helix	trans	-63.4	-45.2	172.7	166.3	0	0	0	0	111	F80 V85 V197 N198 C199 L203 E204 V205 L347 I354	F80-V201 HydrophobicContact CZ-CG1 4.48Å; F80-V201 HydrophobicContact CZ-CG2 4.31Å; V85-V201 HydrophobicContact CG1-CG2 4.18Å; V197-V201 WeakPolarHBondContact O-CG2 3.36Å; V197-V201 PolarHBondContact O-N 3.17Å; N198-V201 PolarHBondContact O-N 3.36Å; C199-V201 VanDerWaalsContact C-N 3.34Å; C199-V201 PolarHBondContact O-N 3.26Å; V201-L203 PolarHBondContact O-N 2.96Å; V201-E204 PolarHBondContact O-N 3.06Å; V201-V205 HydrophobicContact CG1-CG2 4.29Å; V201-V205 VanDerWaalsContact O-CG2 3.32Å; V201-V205 WeakPolarHBondContact O-CG2 3.3Å; V201-V205 PolarHBondContact O-N 3.25Å; V201-L347 HydrophobicContact CG2-CD1 4.03Å; V201-I354 HydrophobicContact CG1-CB 4.16Å; V201-I354 HydrophobicContact CG1-CG1 4.25Å; V201-I354 HydrophobicContact CG1-CG2 4.37Å
202	M	98.5	Very high	96.2	Very high	0 Å²	0	10.1 Å²	10.1	0%	0	6%	0.055	C	C	.	.	H	α-helix	trans	-60.7	-43.1	178.1	-74.6	167.3	60.7	0	0	112.2	I179 C181 N198 C199 E204 V205 C206 F222 F224 L254	I179-M202 HydrophobicContact CG2-CE 4.17Å; I179-M202 HydrophobicContact CG2-CG 4.01Å; I179-M202 HydrophobicContact CG2-SD 3.94Å; I179-M202 WeakPolarHBondContact O-CE 3.22Å; C181-M202 HydrophobicContact CB-CE 4.33Å; C181-M202 HydrophobicContact CB-SD 3.35Å; C181-M202 WeakPolarHBondContact CB-SD 3.25Å; N198-M202 WeakPolarHBondContact O-CB 3.27Å; N198-M202 VanDerWaalsContact O-CG 3.27Å; N198-M202 WeakPolarHBondContact O-CG 3.15Å; N198-M202 PolarHBondContact O-N 2.8Å; C199-M202 PolarHBondContact O-N 2.99Å; M202-E204 VanDerWaalsContact C-N 3.33Å; M202-E204 PolarHBondContact O-N 3.26Å; M202-V205 PolarHBondContact O-N 3.24Å; M202-C206 WeakPolarHBondContact O-CB 3.41Å; M202-C206 PolarHBondContact O-N 3.42Å; M202-C206 PolarHBondContact O-SG 3.32Å; M202-F222 HydrophobicContact CB-CD1 4.18Å; M202-F222 HydrophobicContact CE-CB 3.89Å; M202-F222 HydrophobicContact CE-CD1 3.95Å; M202-F222 HydrophobicContact CE-CG 4.44Å; M202-F222 HydrophobicContact CG-CD1 4.16Å; M202-F224 HydrophobicContact CB-CE1 3.99Å; M202-F224 HydrophobicContact CB-CZ 3.84Å; M202-F224 HydrophobicContact CE-CD1 4.45Å; M202-F224 HydrophobicContact CE-CD2 4.47Å; M202-F224 HydrophobicContact CE-CE1 4.12Å; M202-F224 HydrophobicContact CE-CE2 4.11Å; M202-F224 HydrophobicContact CE-CZ 3.93Å; M202-L254 HydrophobicContact CG-CD1 4.2Å; M202-L254 HydrophobicContact SD-CD1 4.16Å
203	L	98.5	Very high	95.8	Very high	2 Å²	2	16.8 Å²	16.8	1%	0.01	9%	0.09	C	C	.	.	H	α-helix	trans	-57.1	-45.5	176.5	-72.6	171.7	0	0	0	111.8	H88 L113 E116 L117 I120 C199 V201 C206 R207 F224	H88-L203 HydrophobicContact CB-CD1 4.26Å; L113-L203 HydrophobicContact CD2-CD1 4.17Å; L113-L203 HydrophobicContact CD2-CD2 4.47Å; E116-L203 HydrophobicContact CB-CD2 4.18Å; L117-L203 HydrophobicContact CD2-CD2 3.8Å; L117-L203 HydrophobicContact CG-CD2 4.3Å; I120-L203 HydrophobicContact CD1-CD2 4.34Å; C199-L203 WeakPolarHBondContact O-CG 3.07Å; C199-L203 PolarHBondContact O-N 3.48Å; V201-L203 PolarHBondContact O-N 2.96Å; L203-C206 WeakPolarHBondContact O-CB 2.98Å; L203-C206 PolarHBondContact O-N 3.07Å; L203-R207 PolarHBondContact O-N 3.43Å; L203-F224 HydrophobicContact CD2-CE1 4.15Å; L203-F224 HydrophobicContact CD2-CZ 3.91Å; L203-F224 HydrophobicContact CG-CE1 4.06Å; L203-F224 HydrophobicContact CG-CZ 4.15Å
204	E	97.4	Very high	95.5	Very high	0 Å²	0	18.7 Å²	18.7	0%	0	10%	0.099	C	C	.	.	H	α-helix	trans	-69.1	-39.3	178.4	177.1	61	-174.5	0	0	112.4	F80 D81 V85 S200 V201 M202 C206 R207 I208	F80-E204 HydrophobicContact CD2-CB 4.47Å; F80-E204 HydrophobicContact CD2-CG 3.59Å; F80-E204 HydrophobicContact CE2-CB 3.79Å; F80-E204 HydrophobicContact CE2-CG 3.37Å; F80-E204 HydrophobicContact CG-CG 4.28Å; F80-E204 HydrophobicContact CZ-CB 4.18Å; F80-E204 HydrophobicContact CZ-CG 3.91Å; D81-E204 WeakPolarHBondContact CB-OE1 3.43Å; D81-E204 PolarHBondContact N-OE1 3.25Å; V85-E204 HydrophobicContact CG2-CB 3.41Å; V85-E204 VanDerWaalsContact CG2-CB 3.41Å; V85-E204 HydrophobicContact CG2-CG 3.63Å; S200-E204 PolarHBondContact O-N 2.95Å; V201-E204 PolarHBondContact O-N 3.06Å; M202-E204 VanDerWaalsContact C-N 3.33Å; M202-E204 PolarHBondContact O-N 3.26Å; E204-C206 VanDerWaalsContact C-N 3.35Å; E204-C206 PolarHBondContact O-N 3.01Å; E204-R207 WeakPolarHBondContact O-CB 3.43Å; E204-R207 PolarHBondContact O-N 2.91Å; E204-R207 IonicContact OE1-CZ 3.38Å; E204-R207 IonicContact OE1-NE 2.75Å; E204-R207 IonicContact OE1-NH2 2.98Å; E204-R207 PolarHBondContact OE1-NH2 2.9Å; E204-R207 IonicContact OE2-CZ 3.06Å; E204-R207 IonicContact OE2-NE 2.72Å; E204-R207 PolarHBondContact OE2-NE 3.26Å; E204-R207 IonicContact OE2-NH2 3.3Å; E204-I208 HydrophobicContact CG-CD1 4.07Å; E204-I208 VanDerWaalsContact O-CG1 3.29Å; E204-I208 WeakPolarHBondContact O-CG1 3.19Å; E204-I208 PolarHBondContact O-N 2.8Å
205	V	96.9	Very high	95.3	Very high	0 Å²	0	22.4 Å²	22.4	0%	0	12%	0.118	C	C	.	.	H	α-helix	trans	-59.7	-46.9	173	170	0	0	0	0	110.5	F80 V201 M202 R207 I208 L209 F222 I354 L355	F80-V205 HydrophobicContact CE2-CG2 4.38Å; V201-V205 HydrophobicContact CG1-CG2 4.29Å; V201-V205 VanDerWaalsContact O-CG2 3.32Å; V201-V205 WeakPolarHBondContact O-CG2 3.3Å; V201-V205 PolarHBondContact O-N 3.25Å; M202-V205 PolarHBondContact O-N 3.24Å; V205-R207 VanDerWaalsContact C-N 3.34Å; V205-R207 PolarHBondContact O-N 2.91Å; V205-I208 PolarHBondContact O-N 3.19Å; V205-L209 HydrophobicContact CG1-CD1 3.89Å; V205-L209 HydrophobicContact CG1-CG 4.35Å; V205-L209 VanDerWaalsContact O-CG 3.3Å; V205-L209 WeakPolarHBondContact O-CG 3.29Å; V205-L209 PolarHBondContact O-N 3.39Å; V205-F222 HydrophobicContact CG1-CE1 3.96Å; V205-F222 HydrophobicContact CG1-CZ 3.89Å; V205-I354 HydrophobicContact CG2-CG2 4.26Å; V205-L355 HydrophobicContact CG1-CD1 4.06Å; V205-L355 HydrophobicContact CG2-CB 4.12Å; V205-L355 HydrophobicContact CG2-CD1 4.49Å
206	C	96.7	Very high	95.1	Very high	0 Å²	0	22.5 Å²	22.5	0%	0	12%	0.118	C	C	.	.	H	α-helix	trans	-58	-44.4	175.7	-72.8	0	0	0	0	111.8	I120 L160 F162 M202 L203 E204 I208 L209 A210 F222	I120-C206 HydrophobicContact CD1-CB 3.83Å; I120-C206 HydrophobicContact CG2-CB 4.16Å; L160-C206 HydrophobicContact CD2-CB 4.1Å; F162-C206 HydrophobicContact CE2-CB 4.17Å; F162-C206 HydrophobicContact CZ-CB 3.89Å; M202-C206 WeakPolarHBondContact O-CB 3.41Å; M202-C206 PolarHBondContact O-N 3.42Å; M202-C206 PolarHBondContact O-SG 3.32Å; L203-C206 WeakPolarHBondContact O-CB 2.98Å; L203-C206 PolarHBondContact O-N 3.07Å; E204-C206 VanDerWaalsContact C-N 3.35Å; E204-C206 PolarHBondContact O-N 3.01Å; C206-I208 PolarHBondContact O-N 3.49Å; C206-L209 PolarHBondContact O-N 3.15Å; C206-A210 VanDerWaalsContact O-CB 3.29Å; C206-A210 WeakPolarHBondContact O-CB 3.4Å; C206-A210 PolarHBondContact O-N 3.2Å; C206-F222 VanDerWaalsContact SG-CD1 3.56Å; C206-F222 WeakPolarHBondContact SG-CD2 3.46Å; C206-F222 WeakPolarHBondContact SG-CG 3.43Å
207	R	95.1	Very high	95	Very high	90 Å²	90	24.7 Å²	24.7	34%	0.34	13%	0.128	S	C	.	.	H	α-helix	trans	-60.2	-45.4	176.5	-169.2	-163.5	66	72.3	0.6	111.8	L203 E204 V205 A210 T211	L203-R207 PolarHBondContact O-N 3.43Å; E204-R207 WeakPolarHBondContact O-CB 3.43Å; E204-R207 PolarHBondContact O-N 2.91Å; E204-R207 IonicContact OE1-CZ 3.38Å; E204-R207 IonicContact OE1-NE 2.75Å; E204-R207 IonicContact OE1-NH2 2.98Å; E204-R207 PolarHBondContact OE1-NH2 2.9Å; E204-R207 IonicContact OE2-CZ 3.06Å; E204-R207 IonicContact OE2-NE 2.72Å; E204-R207 PolarHBondContact OE2-NE 3.26Å; E204-R207 IonicContact OE2-NH2 3.3Å; V205-R207 VanDerWaalsContact C-N 3.34Å; V205-R207 PolarHBondContact O-N 2.91Å; R207-A210 PolarHBondContact O-N 3.36Å; R207-T211 WeakPolarHBondContact O-CB 3.31Å; R207-T211 WeakPolarHBondContact O-CG2 3.47Å; R207-T211 PolarHBondContact O-N 3.42Å; R207-T211 VanDerWaalsContact O-N 3.08Å; R207-T211 PolarHBondContact O-OG1 3.23Å
208	I	94	Very high	94.9	Very high	17 Å²	17	24.7 Å²	24.7	9%	0.087	13%	0.128	C	C	.	.	H	α-helix	trans	-64.2	-42.7	178.1	-67.2	166.1	0	0	0	111.1	F80 E204 V205 C206 G212 L355	F80-I208 HydrophobicContact CB-CD1 4.39Å; F80-I208 HydrophobicContact CD2-CD1 3.97Å; E204-I208 HydrophobicContact CG-CD1 4.07Å; E204-I208 VanDerWaalsContact O-CG1 3.29Å; E204-I208 WeakPolarHBondContact O-CG1 3.19Å; E204-I208 PolarHBondContact O-N 2.8Å; V205-I208 PolarHBondContact O-N 3.19Å; C206-I208 PolarHBondContact O-N 3.49Å; I208-G212 WeakPolarHBondContact O-CA 3.31Å; I208-G212 PolarHBondContact O-N 3.28Å; I208-L355 HydrophobicContact CB-CD1 4.48Å; I208-L355 HydrophobicContact CD1-CD2 3.89Å; I208-L355 HydrophobicContact CG2-CD1 4.08Å; I208-L355 HydrophobicContact CG2-CD2 4.1Å
209	L	94	Very high	94.8	Very high	4 Å²	4	24.7 Å²	24.7	2%	0.021	13%	0.128	C	C	.	.	H	α-helix	trans	-66.1	-44	178	-68.5	173.5	0	0	0	111.9	L129 F162 V205 C206 T211 G212 L216 L220 F222 L355 V358 Q359	L129-L209 WeakPolarHBondContact CD2-O 3.38Å; F162-L209 HydrophobicContact CD1-CB 4.26Å; F162-L209 HydrophobicContact CE1-CB 3.87Å; F162-L209 HydrophobicContact CZ-CB 4.38Å; V205-L209 HydrophobicContact CG1-CD1 3.89Å; V205-L209 HydrophobicContact CG1-CG 4.35Å; V205-L209 VanDerWaalsContact O-CG 3.3Å; V205-L209 WeakPolarHBondContact O-CG 3.29Å; V205-L209 PolarHBondContact O-N 3.39Å; C206-L209 PolarHBondContact O-N 3.15Å; L209-T211 VanDerWaalsContact C-N 3.34Å; L209-T211 PolarHBondContact O-N 2.9Å; L209-G212 PolarHBondContact O-N 3.03Å; L209-L216 HydrophobicContact CD2-CD2 4.31Å; L209-L220 HydrophobicContact CD1-CD1 3.76Å; L209-F222 HydrophobicContact CD1-CE2 4.04Å; L209-F222 HydrophobicContact CD1-CZ 3.78Å; L209-L355 HydrophobicContact CD2-CD1 4.49Å; L209-V358 HydrophobicContact CD1-CG1 3.9Å; L209-Q359 HydrophobicContact CD2-CG 4.45Å
210	A	93.2	Very high	94.8	Very high	1 Å²	1	24.7 Å²	24.7	1%	0.008	13%	0.128	C	C	.	.	H	α-helix	trans	-65.5	-35.4	-179.4	0	0	0	0	0	113	I120 V123 V131 F162 C206 R207	I120-A210 HydrophobicContact CG2-CB 3.7Å; V123-A210 HydrophobicContact CB-CB 4.32Å; V123-A210 VanDerWaalsContact CG1-O 3.31Å; V123-A210 WeakPolarHBondContact CG1-O 3.27Å; V131-A210 HydrophobicContact CG2-CB 4.48Å; F162-A210 HydrophobicContact CE1-CB 3.94Å; F162-A210 HydrophobicContact CZ-CB 4.45Å; C206-A210 VanDerWaalsContact O-CB 3.29Å; C206-A210 WeakPolarHBondContact O-CB 3.4Å; C206-A210 PolarHBondContact O-N 3.2Å; R207-A210 PolarHBondContact O-N 3.36Å
211	T	90.9	Very high	94.8	Very high	75 Å²	75	24.7 Å²	24.7	46%	0.46	13%	0.128	S	C	.	.	H	α-helix	trans	-93.5	-13.3	-178.5	56.7	0	0	0	0	113.8	V123 R207 L209	V123-T211 HydrophobicContact CG1-CG2 3.99Å; V123-T211 HydrophobicContact CG2-CG2 4.35Å; R207-T211 WeakPolarHBondContact O-CB 3.31Å; R207-T211 WeakPolarHBondContact O-CG2 3.47Å; R207-T211 PolarHBondContact O-N 3.42Å; R207-T211 VanDerWaalsContact O-N 3.08Å; R207-T211 PolarHBondContact O-OG1 3.23Å; L209-T211 VanDerWaalsContact C-N 3.34Å; L209-T211 PolarHBondContact O-N 2.9Å
212	G	88.1	Confident	94.8	Very high	22 Å²	22	24.7 Å²	24.7	23%	0.227	13%	0.128	C	C	.	.	S	Bend	trans	-82.3	170	-177.6	0	0	0	0	0	114.5	I208 L209	I208-G212 WeakPolarHBondContact O-CA 3.31Å; I208-G212 PolarHBondContact O-N 3.28Å; L209-G212 PolarHBondContact O-N 3.03Å
213	L	87.9	Confident	94.9	Very high	141 Å²	141	24.7 Å²	24.7	74%	0.738	13%	0.128	S	C	*	.			trans	-98.9	8.1	173.3	-61.3	178	0	0	0	112.7	I215	L213-I215 PolarHBondContact O-N 3.16Å
214	F	90	Very high	94.9	Very high	40 Å²	40	24.6 Å²	24.6	18%	0.175	13%	0.127	C	C	.	.			trans	-67.4	126.6	-180	-168.1	-85.2	0	0	0	109.9	R166 L216 Q359 A362 K363	R166-F214 PolarHBondContact NH2-O 3.36Å; F214-L216 HydrophobicContact CD1-CD2 3.67Å; F214-L216 HydrophobicContact CE1-CD2 4Å; F214-Q359 HydrophobicContact CD1-CG 4.33Å; F214-Q359 HydrophobicContact CD2-CG 4.09Å; F214-Q359 HydrophobicContact CE1-CB 4.04Å; F214-Q359 HydrophobicContact CE1-CG 4.04Å; F214-Q359 HydrophobicContact CE2-CB 3.73Å; F214-Q359 HydrophobicContact CE2-CG 3.74Å; F214-Q359 HydrophobicContact CG-CG 4.34Å; F214-Q359 HydrophobicContact CZ-CB 3.43Å; F214-Q359 VanDerWaalsContact CZ-CB 3.43Å; F214-Q359 HydrophobicContact CZ-CG 3.72Å; F214-Q359 WeakPolarHBondContact CZ-O 3.34Å; F214-A362 HydrophobicContact CE1-CB 4.21Å; F214-K363 HydrophobicContact CE1-CD 4.02Å; F214-K363 HydrophobicContact CE1-CG 3.77Å; F214-K363 HydrophobicContact CE2-CD 3.9Å; F214-K363 HydrophobicContact CZ-CD 3.33Å; F214-K363 HydrophobicContact CZ-CG 3.56Å
215	I	92.7	Very high	94.8	Very high	79 Å²	79	24.6 Å²	24.6	41%	0.405	13%	0.127	S	C	.	.			trans	-88.1	130.9	-178.9	-62.2	174.3	0	0	0	109.7	D164 A167 L213	D164-I215 VanDerWaalsContact OD2-CA 3.27Å; D164-I215 WeakPolarHBondContact OD2-CA 3.29Å; A167-I215 HydrophobicContact CB-CG2 3.69Å; L213-I215 PolarHBondContact O-N 3.16Å
216	L	94.4	Very high	94.9	Very high	2 Å²	2	24.6 Å²	24.6	1%	0.01	13%	0.128	C	C	.	.			trans	-101.1	113	179.9	-47.7	174.3	0	0	0	110.4	L129 F162 D164 A167 L209 F214 L220 A362	L129-L216 HydrophobicContact CD1-CD1 3.86Å; F162-L216 HydrophobicContact CB-CD1 3.67Å; F162-L216 HydrophobicContact CD1-CD1 4.42Å; F162-L216 HydrophobicContact CG-CD1 4.42Å; D164-L216 HydrophobicContact CB-CB 3.85Å; D164-L216 HydrophobicContact CB-CG 4.38Å; D164-L216 WeakPolarHBondContact CB-O 3.21Å; D164-L216 PolarHBondContact OD2-N 3.23Å; A167-L216 WeakPolarHBondContact CB-O 3.21Å; L209-L216 HydrophobicContact CD2-CD2 4.31Å; F214-L216 HydrophobicContact CD1-CD2 3.67Å; F214-L216 HydrophobicContact CE1-CD2 4Å; L216-L220 HydrophobicContact CD1-CD1 4.14Å; L216-L220 HydrophobicContact CD2-CD1 4.04Å; L216-A362 HydrophobicContact CB-CB 4.35Å; L216-A362 HydrophobicContact CD2-CB 3.47Å; L216-A362 VanDerWaalsContact CD2-CB 3.47Å; L216-A362 HydrophobicContact CG-CB 4.49Å
217	F	95	Very high	94.9	Very high	45 Å²	45	24.7 Å²	24.7	20%	0.197	13%	0.128	C	C	.	.	S	Bend	trans	-73.2	-43.8	172.6	-174.5	-100.3	0	0	0	111.3	K168 K174 A362 E365 Q368	K168-F217 HydrophobicContact CB-CE2 4.32Å; K174-F217 VanDerWaalsContact CD-O 3.26Å; K174-F217 WeakPolarHBondContact CD-O 3.23Å; K174-F217 VanDerWaalsContact CE-O 3.3Å; K174-F217 WeakPolarHBondContact CE-O 3.02Å; K174-F217 PolarHBondContact NZ-O 2.84Å; F217-A362 WeakPolarHBondContact CA-O 3.25Å; F217-A362 WeakPolarHBondContact CB-O 3.24Å; F217-A362 PolarHBondContact N-O 3.2Å; F217-E365 HydrophobicContact CD1-CB 4.22Å; F217-E365 HydrophobicContact CD1-CG 3.89Å; F217-E365 HydrophobicContact CD2-CG 4.43Å; F217-E365 HydrophobicContact CE1-CB 3.81Å; F217-E365 HydrophobicContact CE1-CG 3.72Å; F217-E365 HydrophobicContact CE2-CG 4.29Å; F217-E365 HydrophobicContact CG-CG 4.24Å; F217-E365 HydrophobicContact CZ-CB 4.3Å; F217-E365 HydrophobicContact CZ-CG 3.93Å; F217-Q368 HydrophobicContact CD1-CG 4.29Å; F217-Q368 HydrophobicContact CE1-CG 3.62Å; F217-Q368 HydrophobicContact CZ-CG 4.47Å
218	N	95.8	Very high	95	Very high	0 Å²	0	21.1 Å²	21.1	0%	0	12%	0.116	C	C	.	.	S	Bend	trans	-97.3	150.5	176	-53.9	-54.7	0	0	0	111.2	I361 A362 D364 I367 Q368	N218-I361 PolarHBondContact ND2-O 3.21Å; N218-A362 PolarHBondContact N-O 2.89Å; N218-D364 PolarHBondContact ND2-O 2.76Å; N218-I367 HydrophobicContact CB-CG2 4.49Å; N218-Q368 WeakPolarHBondContact OD1-CG 3.35Å; N218-Q368 PolarHBondContact OD1-NE2 2.73Å
219	D	96.9	Very high	95.1	Very high	0 Å²	0	22 Å²	22	0%	0	12%	0.119	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.3	147.2	171.5	-79	14.8	0	0	0	110.1	R161 F162 H163 K174 L175 A176 F177	R161-D219 IonicContact CZ-OD2 2.78Å; R161-D219 VanDerWaalsContact CZ-OD2 3.23Å; R161-D219 IonicContact NE-OD2 3.39Å; R161-D219 PolarHBondContact NE-OD2 2.91Å; R161-D219 IonicContact NH2-OD2 3.14Å; R161-D219 PolarHBondContact NH2-OD2 2.99Å; F162-D219 WeakPolarHBondContact O-CA 3.27Å; H163-D219 IonicContact CE1-OD1 3.5Å; H163-D219 IonicContact CG-OD1 3.68Å; H163-D219 IonicContact CG-OD2 3.37Å; H163-D219 VanDerWaalsContact ND1-CG 3.33Å; H163-D219 IonicContact ND1-OD1 3.75Å; H163-D219 PolarHBondContact ND1-OD1 3.39Å; H163-D219 IonicContact ND1-OD2 3.46Å; H163-D219 PolarHBondContact ND1-OD2 3.34Å; K174-D219 WeakPolarHBondContact CB-OD1 3.4Å; L175-D219 PolarHBondContact O-N 2.94Å; L175-D219 VanDerWaalsContact O-N 3.16Å; A176-D219 CarbonylContact C-O 3.28Å; A176-D219 VanDerWaalsContact CA-O 3.28Å; A176-D219 WeakPolarHBondContact CA-O 3.21Å; A176-D219 HydrophobicContact CB-CB 3.83Å; F177-D219 PolarHBondContact N-O 3.14Å
220	L	98.1	Very high	95.1	Very high	0 Å²	0	23.8 Å²	23.8	0%	0	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	135	172.5	-57.9	172.9	0	0	0	109	R161 F162 F177 I179 L209 L216 F222 V358 A362	R161-L220 CarbonylContact C-O 3.53Å; R161-L220 VanDerWaalsContact CA-O 3.31Å; R161-L220 WeakPolarHBondContact CA-O 3.44Å; F162-L220 HydrophobicContact CB-CB 4.25Å; F162-L220 PolarHBondContact N-O 2.8Å; F162-L220 PolarHBondContact O-N 3.46Å; F162-L220 VanDerWaalsContact O-N 3.13Å; F177-L220 HydrophobicContact CB-CD2 4.12Å; F177-L220 WeakPolarHBondContact O-CA 3.49Å; I179-L220 HydrophobicContact CD1-CD2 4.44Å; L209-L220 HydrophobicContact CD1-CD1 3.76Å; L216-L220 HydrophobicContact CD1-CD1 4.14Å; L216-L220 HydrophobicContact CD2-CD1 4.04Å; L220-F222 HydrophobicContact CB-CE2 3.94Å; L220-F222 HydrophobicContact CD1-CE2 4.32Å; L220-V358 HydrophobicContact CD1-CG1 3.38Å; L220-V358 HydrophobicContact CD2-CG1 4.11Å; L220-V358 HydrophobicContact CG-CG1 4.37Å; L220-A362 HydrophobicContact CD1-CB 4.11Å; L220-A362 HydrophobicContact CD2-CB 4.19Å; L220-A362 HydrophobicContact CG-CB 4.34Å
221	I	98.6	Very high	95	Very high	0 Å²	0	27.4 Å²	27.4	0%	0	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	123	172.2	-63.8	172	0	0	0	107.8	A159 L160 R161 A176 F177 L178 I179 F238 W244 I248	A159-I221 HydrophobicContact CB-CG2 4.39Å; L160-I221 WeakPolarHBondContact O-CA 3.41Å; R161-I221 HydrophobicContact CB-CG1 4.16Å; R161-I221 HydrophobicContact CG-CG1 3.95Å; A176-I221 HydrophobicContact CB-CD1 3.63Å; A176-I221 HydrophobicContact CB-CG1 3.97Å; F177-I221 PolarHBondContact O-N 2.85Å; L178-I221 CarbonylContact C-O 3.46Å; L178-I221 WeakPolarHBondContact CA-O 3.31Å; L178-I221 HydrophobicContact CD1-CB 4.19Å; L178-I221 HydrophobicContact CD1-CG2 3.83Å; I179-I221 PolarHBondContact N-O 3.2Å; I221-F238 HydrophobicContact CG2-CZ 4.17Å; I221-W244 HydrophobicContact CD1-CB 3.81Å; I221-W244 HydrophobicContact CD1-CE3 4.35Å; I221-W244 HydrophobicContact CD1-CG 4.45Å; I221-W244 HydrophobicContact CG2-CE3 4.42Å; I221-I248 HydrophobicContact CD1-CD1 4.31Å; I221-I248 HydrophobicContact CD1-CG1 4.02Å
222	F	98.8	Very high	95.2	Very high	0 Å²	0	24.1 Å²	24.1	0%	0	13%	0.129	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.8	119.8	171.7	-65.6	-98.4	0	0	0	108.7	A159 L160 F162 I179 M202 V205 C206 L209 L220 F224 V358	A159-F222 CarbonylContact C-O 3.46Å; A159-F222 WeakPolarHBondContact CA-O 3.41Å; L160-F222 HydrophobicContact CB-CB 4.46Å; L160-F222 PolarHBondContact N-O 3.47Å; L160-F222 PolarHBondContact O-N 3.16Å; F162-F222 AromaticContact CD2-CD2 3.82Å; F162-F222 HydrophobicContact CD2-CD2 3.82Å; F162-F222 AromaticContact CD2-CE2 3.76Å; F162-F222 HydrophobicContact CD2-CE2 3.76Å; F162-F222 AromaticContact CE2-CD2 3.7Å; F162-F222 HydrophobicContact CE2-CD2 3.7Å; F162-F222 AromaticContact CE2-CE2 3.72Å; F162-F222 HydrophobicContact CE2-CE2 3.72Å; I179-F222 HydrophobicContact CB-CD1 3.89Å; I179-F222 HydrophobicContact CB-CE1 4.13Å; I179-F222 HydrophobicContact CD1-CD1 4.22Å; I179-F222 HydrophobicContact CD1-CE1 3.9Å; I179-F222 HydrophobicContact CD1-CE2 4.34Å; I179-F222 HydrophobicContact CD1-CZ 3.97Å; I179-F222 HydrophobicContact CG1-CD1 4.34Å; I179-F222 HydrophobicContact CG1-CE1 4.1Å; I179-F222 HydrophobicContact CG2-CD1 4.29Å; I179-F222 HydrophobicContact CG2-CE1 4.46Å; I179-F222 CarbonylContact O-C 3.52Å; I179-F222 WeakPolarHBondContact O-CA 3.49Å; M202-F222 HydrophobicContact CB-CD1 4.18Å; M202-F222 HydrophobicContact CE-CB 3.89Å; M202-F222 HydrophobicContact CE-CD1 3.95Å; M202-F222 HydrophobicContact CE-CG 4.44Å; M202-F222 HydrophobicContact CG-CD1 4.16Å; V205-F222 HydrophobicContact CG1-CE1 3.96Å; V205-F222 HydrophobicContact CG1-CZ 3.89Å; C206-F222 VanDerWaalsContact SG-CD1 3.56Å; C206-F222 WeakPolarHBondContact SG-CD2 3.46Å; C206-F222 WeakPolarHBondContact SG-CG 3.43Å; L209-F222 HydrophobicContact CD1-CE2 4.04Å; L209-F222 HydrophobicContact CD1-CZ 3.78Å; L220-F222 HydrophobicContact CB-CE2 3.94Å; L220-F222 HydrophobicContact CD1-CE2 4.32Å; F222-F224 HydrophobicContact CB-CE2 4.06Å; F222-V358 HydrophobicContact CZ-CG1 4.18Å
223	L	98.9	Very high	95.6	Very high	0 Å²	0	24 Å²	24	0%	0	12%	0.124	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	121.1	-177.7	179.1	71.4	0	0	0	110.3	N157 F158 A159 L178 I179 C181 N225 F238 F312	N157-L223 HydrophobicContact CB-CD1 3.77Å; F158-L223 WeakPolarHBondContact O-CA 3.35Å; A159-L223 HydrophobicContact CB-CD1 4.36Å; L178-L223 HydrophobicContact CD1-CB 3.64Å; L178-L223 HydrophobicContact CD1-CD2 4.38Å; I179-L223 PolarHBondContact O-N 3.43Å; C181-L223 PolarHBondContact N-O 3.3Å; L223-N225 HydrophobicContact CG-CB 4.47Å; L223-F238 HydrophobicContact CD1-CB 4.21Å; L223-F238 HydrophobicContact CD1-CD1 4.05Å; L223-F238 HydrophobicContact CD1-CD2 3.44Å; L223-F238 VanDerWaalsContact CD1-CD2 3.44Å; L223-F238 HydrophobicContact CD1-CE1 4.25Å; L223-F238 HydrophobicContact CD1-CE2 3.7Å; L223-F238 HydrophobicContact CD1-CG 3.62Å; L223-F238 HydrophobicContact CD1-CZ 4.1Å; L223-F238 HydrophobicContact CD2-CB 4.07Å; L223-F238 HydrophobicContact CD2-CD1 3.55Å; L223-F238 HydrophobicContact CD2-CD2 4.43Å; L223-F238 HydrophobicContact CD2-CE1 4.04Å; L223-F238 HydrophobicContact CD2-CG 3.76Å; L223-F238 HydrophobicContact CG-CD1 4.4Å; L223-F238 HydrophobicContact CG-CG 4.36Å; L223-F312 HydrophobicContact CD2-CE1 4.21Å; L223-F312 HydrophobicContact CD2-CZ 3.82Å
224	F	98.8	Very high	96	Very high	0 Å²	0	17.3 Å²	17.3	0%	0	9%	0.088	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	106.3	171.7	-57.3	-98.3	0	0	0	107.6	L113 L117 N157 F158 C181 Y183 C199 M202 L203 F222	L113-F224 HydrophobicContact CD1-CB 4.23Å; L113-F224 HydrophobicContact CD2-CD1 4.04Å; L113-F224 HydrophobicContact CD2-CE1 4.39Å; L117-F224 HydrophobicContact CD1-CD2 4.14Å; L117-F224 HydrophobicContact CD1-CE2 4.33Å; L117-F224 HydrophobicContact CD2-CD2 4.33Å; L117-F224 HydrophobicContact CD2-CE2 3.69Å; L117-F224 HydrophobicContact CD2-CZ 4.16Å; N157-F224 WeakPolarHBondContact CA-O 3.1Å; F158-F224 HydrophobicContact CB-CB 4.26Å; F158-F224 PolarHBondContact N-O 3.4Å; F158-F224 PolarHBondContact O-N 3.17Å; C181-F224 WeakPolarHBondContact O-CA 3.23Å; Y183-F224 HydrophobicContact CD1-CB 4.07Å; C199-F224 HydrophobicContact CB-CD1 4.04Å; C199-F224 HydrophobicContact CB-CE1 4.07Å; M202-F224 HydrophobicContact CB-CE1 3.99Å; M202-F224 HydrophobicContact CB-CZ 3.84Å; M202-F224 HydrophobicContact CE-CD1 4.45Å; M202-F224 HydrophobicContact CE-CD2 4.47Å; M202-F224 HydrophobicContact CE-CE1 4.12Å; M202-F224 HydrophobicContact CE-CE2 4.11Å; M202-F224 HydrophobicContact CE-CZ 3.93Å; L203-F224 HydrophobicContact CD2-CE1 4.15Å; L203-F224 HydrophobicContact CD2-CZ 3.91Å; L203-F224 HydrophobicContact CG-CE1 4.06Å; L203-F224 HydrophobicContact CG-CZ 4.15Å; F222-F224 HydrophobicContact CB-CE2 4.06Å
225	N	96.9	Very high	96.3	Very high	0 Å²	0	15.4 Å²	15.4	0%	0	8%	0.08	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	141.4	-173.1	84.9	66.4	0	0	0	111.3	N157 C181 H182 Y183 L223 D308	N157-N225 VanDerWaalsContact OD1-CA 3.27Å; N157-N225 WeakPolarHBondContact OD1-CA 3.44Å; N157-N225 WeakPolarHBondContact OD1-CB 3.45Å; C181-N225 PolarHBondContact O-N 2.7Å; C181-N225 PolarHBondContact O-ND2 3.44Å; H182-N225 CarbonylContact C-O 3.52Å; H182-N225 WeakPolarHBondContact CA-ND2 3.42Å; H182-N225 VanDerWaalsContact CA-O 3.22Å; H182-N225 WeakPolarHBondContact CA-O 3.36Å; H182-N225 VanDerWaalsContact CB-CG 3.44Å; H182-N225 WeakPolarHBondContact CB-ND2 3.37Å; H182-N225 WeakPolarHBondContact CB-OD1 3.35Å; H182-N225 PolarHBondContact N-ND2 3.33Å; Y183-N225 VanDerWaalsContact CD1-C 3.48Å; Y183-N225 WeakPolarHBondContact CD1-O 3.14Å; Y183-N225 VanDerWaalsContact CE1-C 3.42Å; Y183-N225 WeakPolarHBondContact CE1-O 3.48Å; Y183-N225 PolarHBondContact N-O 3.29Å; L223-N225 HydrophobicContact CG-CB 4.47Å; N225-D308 PolarHBondContact ND2-OD2 3.19Å
226	G	97.8	Very high	96.5	Very high	1 Å²	1	11.7 Å²	11.7	1%	0.01	6%	0.061	C	C	.	.	S	Bend	trans	-109.4	15.1	-168.5	0	0	0	0	0	115.9	N105 R156 D184	N105-G226 PolarHBondContact ND2-O 2.8Å; R156-G226 PolarHBondContact O-N 2.88Å; D184-G226 WeakPolarHBondContact CB-O 2.94Å
227	A	97.5	Very high	96.6	Very high	2 Å²	2	11.6 Å²	11.6	2%	0.017	6%	0.06	C	C	.	.			trans	-158.4	45.7	-177.4	0	0	0	0	0	112.4	A100 V155 D184 L233 S234	A100-A227 HydrophobicContact CB-CB 3.73Å; V155-A227 HydrophobicContact CG1-CB 4.42Å; D184-A227 PolarHBondContact OD1-N 2.66Å; D184-A227 WeakPolarHBondContact OD2-CA 3.05Å; A227-L233 HydrophobicContact CB-CB 4.1Å; A227-L233 HydrophobicContact CB-CD1 4.42Å; A227-L233 PolarHBondContact O-N 2.77Å; A227-S234 WeakPolarHBondContact CB-OG 3.39Å; A227-S234 PolarHBondContact N-OG 2.83Å; A227-S234 VanDerWaalsContact N-OG 3.14Å
228	E	97	Very high	96.8	Very high	15 Å²	15	9.4 Å²	9.4	7%	0.07	5%	0.051	C	C	.	.	S	Bend	trans	-69.4	-47.3	171.7	-168.6	-74.7	161	0	0	109.8	H182 D184 S230 M231 L232	H182-E228 HydrophobicContact CB-CB 3.34Å; H182-E228 HydrophobicContact CB-CG 4.03Å; H182-E228 VanDerWaalsContact CG-CB 3.44Å; D184-E228 PolarHBondContact OD1-N 2.85Å; D184-E228 PolarHBondContact OD2-N 3.04Å; D184-E228 VanDerWaalsContact OD2-N 3.11Å; E228-S230 PolarHBondContact O-N 2.77Å; E228-M231 CarbonylContact O-C 3.57Å; E228-M231 PolarHBondContact O-N 3.26Å; E228-L232 HydrophobicContact CG-CD2 3.75Å; E228-L232 PolarHBondContact O-N 3.47Å; E228-L232 WeakPolarHBondContact OE1-CD2 3.34Å
229	E	95.9	Very high	96.8	Very high	35 Å²	35	10 Å²	10	16%	0.164	5%	0.054	C	C	.	.	T	Hydrogen-bonded Turn	trans	-71.6	-9.9	-171.3	-66	-89.2	-133.2	0	0	111.9	D184 T185 A186 D194 M231 H333	D184-E229 WeakPolarHBondContact OD2-CB 3.46Å; D184-E229 PolarHBondContact OD2-N 3.23Å; T185-E229 VanDerWaalsContact C-CG 3.49Å; A186-E229 WeakPolarHBondContact CB-OE1 3.44Å; A186-E229 VanDerWaalsContact N-CD 3.26Å; A186-E229 PolarHBondContact N-OE1 3.35Å; D194-E229 VanDerWaalsContact OD2-OE1 3.08Å; E229-M231 VanDerWaalsContact C-N 3.3Å; E229-H333 IonicContact OE1-CD2 3.7Å; E229-H333 IonicContact OE1-CE1 2.93Å; E229-H333 IonicContact OE1-NE2 2.71Å; E229-H333 PolarHBondContact OE1-NE2 2.77Å; E229-H333 IonicContact OE2-CE1 3.14Å; E229-H333 PolarHBondContact OE2-CE1 2.81Å; E229-H333 IonicContact OE2-NE2 2.94Å; E229-H333 PolarHBondContact OE2-NE2 3.45Å
230	S	93.1	Very high	96.8	Very high	42 Å²	42	12 Å²	12	29%	0.294	7%	0.066	S	C	.	.	T	Hydrogen-bonded Turn	trans	-94.3	33.1	171.2	-60	0	0	0	0	112.7	A100 E228 L233	A100-S230 VanDerWaalsContact CB-OG 3.26Å; A100-S230 WeakPolarHBondContact CB-OG 3Å; E228-S230 PolarHBondContact O-N 2.77Å; S230-L233 WeakPolarHBondContact O-CD1 3.28Å; S230-L233 VanDerWaalsContact O-CD2 3.28Å; S230-L233 WeakPolarHBondContact O-CD2 3.29Å; S230-L233 WeakPolarHBondContact O-CG 3.43Å
231	M	92.4	Very high	96.7	Very high	77 Å²	77	14.9 Å²	14.9	38%	0.379	8%	0.08	S	C	.	.	T	Hydrogen-bonded Turn	trans	75.1	47.8	-179.6	-53.3	-80.9	148.6	0	0	114.1	F143 H148 E228 E229 L233	F143-M231 WeakPolarHBondContact CZ-O 3.35Å; H148-M231 HydrophobicContact CB-SD 4.48Å; E228-M231 CarbonylContact O-C 3.57Å; E228-M231 PolarHBondContact O-N 3.26Å; E229-M231 VanDerWaalsContact C-N 3.3Å; M231-L233 PolarHBondContact O-N 3.08Å
232	L	94.8	Very high	96.6	Very high	5 Å²	5	15.5 Å²	15.5	3%	0.026	8%	0.082	C	C	.	.	S	Bend	trans	64.8	30.7	167.5	-40.3	178.2	0	0	0	114.4	F143 E228 S235 H236 D306 I311	F143-L232 HydrophobicContact CZ-CB 4.38Å; F143-L232 WeakPolarHBondContact CZ-O 3.41Å; E228-L232 HydrophobicContact CG-CD2 3.75Å; E228-L232 PolarHBondContact O-N 3.47Å; E228-L232 WeakPolarHBondContact OE1-CD2 3.34Å; L232-S235 PolarHBondContact O-OG 3.29Å; L232-S235 VanDerWaalsContact O-OG 3.11Å; L232-H236 WeakPolarHBondContact O-CB 3.03Å; L232-H236 PolarHBondContact O-N 3.37Å; L232-D306 HydrophobicContact CD1-CB 4Å; L232-D306 WeakPolarHBondContact CD1-OD2 3.5Å; L232-I311 HydrophobicContact CB-CD1 4.06Å; L232-I311 HydrophobicContact CB-CG1 3.68Å; L232-I311 HydrophobicContact CD1-CD1 3.94Å; L232-I311 HydrophobicContact CD1-CG1 3.75Å; L232-I311 HydrophobicContact CG-CG1 4.35Å
233	L	95.6	Very high	96.5	Very high	21 Å²	21	21.8 Å²	21.8	11%	0.11	11%	0.11	C	C	.	.	H	α-helix	trans	-69.1	-42.9	-168.7	-49.3	179.2	0	0	0	111.7	F143 Y152 V155 A227 S230 M231 H236 A237	F143-L233 HydrophobicContact CE1-CD2 3.69Å; F143-L233 HydrophobicContact CZ-CD2 4.07Å; Y152-L233 HydrophobicContact CD1-CB 4.05Å; Y152-L233 HydrophobicContact CD1-CD2 3.91Å; Y152-L233 HydrophobicContact CD1-CG 4.47Å; Y152-L233 HydrophobicContact CG-CB 4.19Å; Y152-L233 HydrophobicContact CG-CD2 4.49Å; V155-L233 HydrophobicContact CG1-CB 4.16Å; V155-L233 HydrophobicContact CG1-CD1 4.31Å; A227-L233 HydrophobicContact CB-CB 4.1Å; A227-L233 HydrophobicContact CB-CD1 4.42Å; A227-L233 PolarHBondContact O-N 2.77Å; S230-L233 WeakPolarHBondContact O-CD1 3.28Å; S230-L233 VanDerWaalsContact O-CD2 3.28Å; S230-L233 WeakPolarHBondContact O-CD2 3.29Å; S230-L233 WeakPolarHBondContact O-CG 3.43Å; M231-L233 PolarHBondContact O-N 3.08Å; L233-H236 PolarHBondContact O-N 3.29Å; L233-A237 WeakPolarHBondContact O-CB 3.46Å; L233-A237 PolarHBondContact O-N 3.22Å
234	S	96.6	Very high	96.5	Very high	0 Å²	0	23.2 Å²	23.2	0%	0	12%	0.115	C	C	.	.	H	α-helix	trans	-74.6	-37.4	-171.6	-74.5	0	0	0	0	112.7	R156 N157 A227 A237 F238	R156-S234 PolarHBondContact O-OG 3.29Å; N157-S234 PolarHBondContact ND2-O 3.26Å; N157-S234 WeakPolarHBondContact OD1-CB 3.37Å; N157-S234 PolarHBondContact OD1-O 3.02Å; A227-S234 WeakPolarHBondContact CB-OG 3.39Å; A227-S234 PolarHBondContact N-OG 2.83Å; A227-S234 VanDerWaalsContact N-OG 3.14Å; S234-A237 PolarHBondContact O-N 2.84Å; S234-F238 WeakPolarHBondContact O-CB 3.3Å; S234-F238 PolarHBondContact O-N 2.76Å
235	S	97.4	Very high	96.3	Very high	0 Å²	0	23.5 Å²	23.5	0%	0	12%	0.118	C	C	.	.	H	α-helix	trans	-64.5	-41.1	171.4	59.6	0	0	0	0	111.6	L232 F238 I239 D308	L232-S235 PolarHBondContact O-OG 3.29Å; L232-S235 VanDerWaalsContact O-OG 3.11Å; S235-F238 PolarHBondContact O-N 3.04Å; S235-I239 WeakPolarHBondContact O-CG2 3.48Å; S235-I239 PolarHBondContact O-N 3.08Å; S235-D308 WeakPolarHBondContact CB-OD1 3.48Å; S235-D308 WeakPolarHBondContact CB-OD2 3.12Å; S235-D308 VanDerWaalsContact OG-CG 3.26Å; S235-D308 PolarHBondContact OG-OD1 2.75Å
236	H	96.1	Very high	96.2	Very high	0 Å²	0	28.3 Å²	28.3	0%	0	15%	0.147	C	C	.	.	H	α-helix	trans	-63.3	-46	176.4	-178.2	-83	0	0	0	110.5	F143 Y152 L232 L233 F238 T240 I311 Y315 N395	F143-H236 WeakPolarHBondContact CB-NE2 3.36Å; F143-H236 HydrophobicContact CD1-CB 4.18Å; F143-H236 AromaticContact CD1-CD2 4Å; F143-H236 AromaticContact CD1-CG 3.69Å; F143-H236 AromaticContact CD1-ND1 3.78Å; F143-H236 HydrophobicContact CD2-CB 4.37Å; F143-H236 AromaticContact CD2-CD2 3.65Å; F143-H236 AromaticContact CD2-CG 3.99Å; F143-H236 HydrophobicContact CE1-CB 3.86Å; F143-H236 AromaticContact CE1-CG 3.9Å; F143-H236 HydrophobicContact CE2-CB 4.08Å; F143-H236 HydrophobicContact CG-CB 4.41Å; F143-H236 AromaticContact CG-CD2 3.52Å; F143-H236 AromaticContact CG-CG 3.71Å; F143-H236 AromaticContact CG-NE2 3.78Å; F143-H236 HydrophobicContact CZ-CB 3.78Å; Y152-H236 HydrophobicContact CE1-CB 4.47Å; Y152-H236 AromaticContact CE1-ND1 3.6Å; Y152-H236 AromaticContact CZ-ND1 3.62Å; Y152-H236 PolarHBondContact OH-ND1 3.2Å; L232-H236 WeakPolarHBondContact O-CB 3.03Å; L232-H236 PolarHBondContact O-N 3.37Å; L233-H236 PolarHBondContact O-N 3.29Å; H236-F238 VanDerWaalsContact C-N 3.35Å; H236-F238 PolarHBondContact O-N 2.69Å; H236-T240 WeakPolarHBondContact O-CB 3.27Å; H236-T240 WeakPolarHBondContact O-CG2 3.32Å; H236-T240 PolarHBondContact O-N 3.12Å; H236-T240 VanDerWaalsContact O-N 3.11Å; H236-T240 PolarHBondContact O-OG1 3.09Å; H236-I311 HydrophobicContact CB-CG2 3.77Å; H236-Y315 AromaticContact CD2-CD1 3.84Å; H236-Y315 AromaticContact CD2-CD2 3.76Å; H236-Y315 AromaticContact CD2-CE1 3.99Å; H236-Y315 AromaticContact CD2-CE2 3.9Å; H236-Y315 AromaticContact CD2-CG 3.71Å; H236-Y315 AromaticContact NE2-CD1 3.52Å; H236-Y315 AromaticContact NE2-CE1 3.64Å; H236-Y315 AromaticContact NE2-CG 3.88Å; H236-N395 PolarHBondContact NE2-O 3.24Å
237	A	96.7	Very high	96.1	Very high	0 Å²	0	29.7 Å²	29.7	0%	0	15%	0.154	C	C	.	.	H	α-helix	trans	-56.2	-49.1	174.2	0	0	0	0	0	111.9	H136 Y152 V155 L233 S234 Q241	H136-A237 PolarHBondContact CE1-O 2.82Å; Y152-A237 HydrophobicContact CE2-CB 3.69Å; Y152-A237 WeakPolarHBondContact OH-CA 3.18Å; Y152-A237 PolarHBondContact OH-N 2.83Å; V155-A237 HydrophobicContact CG2-CB 3.58Å; L233-A237 WeakPolarHBondContact O-CB 3.46Å; L233-A237 PolarHBondContact O-N 3.22Å; S234-A237 PolarHBondContact O-N 2.84Å; A237-Q241 WeakPolarHBondContact O-CB 3.47Å; A237-Q241 WeakPolarHBondContact O-CG 3.18Å; A237-Q241 PolarHBondContact O-N 3.25Å
238	F	98.3	Very high	96.2	Very high	0 Å²	0	29.6 Å²	29.6	0%	0	15%	0.154	C	C	.	.	H	α-helix	trans	-61.8	-54	-178.5	-179.2	-100.1	0	0	0	111.7	A159 L178 I221 L223 S234 S235 H236 T240 H242 I248 F312	A159-F238 HydrophobicContact CB-CE2 3.84Å; A159-F238 HydrophobicContact CB-CZ 4.42Å; L178-F238 HydrophobicContact CD1-CE1 4.09Å; L178-F238 HydrophobicContact CD2-CE1 4.45Å; I221-F238 HydrophobicContact CG2-CZ 4.17Å; L223-F238 HydrophobicContact CD1-CB 4.21Å; L223-F238 HydrophobicContact CD1-CD1 4.05Å; L223-F238 HydrophobicContact CD1-CD2 3.44Å; L223-F238 VanDerWaalsContact CD1-CD2 3.44Å; L223-F238 HydrophobicContact CD1-CE1 4.25Å; L223-F238 HydrophobicContact CD1-CE2 3.7Å; L223-F238 HydrophobicContact CD1-CG 3.62Å; L223-F238 HydrophobicContact CD1-CZ 4.1Å; L223-F238 HydrophobicContact CD2-CB 4.07Å; L223-F238 HydrophobicContact CD2-CD1 3.55Å; L223-F238 HydrophobicContact CD2-CD2 4.43Å; L223-F238 HydrophobicContact CD2-CE1 4.04Å; L223-F238 HydrophobicContact CD2-CG 3.76Å; L223-F238 HydrophobicContact CG-CD1 4.4Å; L223-F238 HydrophobicContact CG-CG 4.36Å; S234-F238 WeakPolarHBondContact O-CB 3.3Å; S234-F238 PolarHBondContact O-N 2.76Å; S235-F238 PolarHBondContact O-N 3.04Å; H236-F238 VanDerWaalsContact C-N 3.35Å; H236-F238 PolarHBondContact O-N 2.69Å; F238-T240 VanDerWaalsContact C-N 3.28Å; F238-T240 PolarHBondContact O-N 3.25Å; F238-H242 HydrophobicContact CD2-CB 3.62Å; F238-H242 AromaticContact CD2-CG 3.69Å; F238-H242 HydrophobicContact CE2-CB 3.79Å; F238-H242 AromaticContact CE2-CE1 3.92Å; F238-H242 AromaticContact CE2-CG 3.47Å; F238-H242 VanDerWaalsContact CE2-CG 3.47Å; F238-H242 AromaticContact CE2-ND1 3.34Å; F238-H242 VanDerWaalsContact CE2-ND1 3.34Å; F238-H242 WeakPolarHBondContact CE2-ND1 3.43Å; F238-H242 HydrophobicContact CG-CB 4.21Å; F238-H242 AromaticContact CZ-ND1 3.92Å; F238-H242 WeakPolarHBondContact O-CB 3.41Å; F238-H242 PolarHBondContact O-N 2.8Å; F238-I248 HydrophobicContact CE1-CD1 3.54Å; F238-I248 HydrophobicContact CZ-CD1 4.09Å; F238-F312 HydrophobicContact CD1-CE1 4.45Å
239	I	97.2	Very high	96.1	Very high	13 Å²	13	29.2 Å²	29.2	7%	0.067	15%	0.152	C	C	.	.	H	α-helix	trans	-70.2	-24.9	-172.1	-157.9	63.8	0	0	0	113.4	S235 A245 I248 I311 F312 G316 V318	S235-I239 WeakPolarHBondContact O-CG2 3.48Å; S235-I239 PolarHBondContact O-N 3.08Å; I239-A245 HydrophobicContact CD1-CB 4.18Å; I239-A245 WeakPolarHBondContact O-CB 3Å; I239-I248 HydrophobicContact CD1-CD1 4.41Å; I239-I311 HydrophobicContact CG2-CG2 3.92Å; I239-F312 HydrophobicContact CB-CD1 3.89Å; I239-F312 HydrophobicContact CB-CE1 4.19Å; I239-F312 HydrophobicContact CD1-CD1 3.92Å; I239-F312 HydrophobicContact CG1-CD1 3.92Å; I239-F312 HydrophobicContact CG2-CD1 4.49Å; I239-G316 VanDerWaalsContact CG1-CA 3.41Å; I239-V318 HydrophobicContact CD1-CG2 4.31Å
240	T	95.5	Very high	96.2	Very high	42 Å²	42	27.6 Å²	27.6	26%	0.258	15%	0.145	S	C	.	.	H	α-helix	trans	-96.5	-21.3	-178.7	61.3	0	0	0	0	114.4	H236 F238	H236-T240 WeakPolarHBondContact O-CB 3.27Å; H236-T240 WeakPolarHBondContact O-CG2 3.32Å; H236-T240 PolarHBondContact O-N 3.12Å; H236-T240 VanDerWaalsContact O-N 3.11Å; H236-T240 PolarHBondContact O-OG1 3.09Å; F238-T240 VanDerWaalsContact C-N 3.28Å; F238-T240 PolarHBondContact O-N 3.25Å
241	Q	96.7	Very high	96.4	Very high	60 Å²	60	25.6 Å²	25.6	28%	0.28	13%	0.131	S	C	.	.	H	α-helix	trans	-123.1	-24.7	-170.5	-49.2	178.6	16.4	0	0	113.7	Y152 A237	Y152-Q241 PolarHBondContact OH-NE2 3.09Å; A237-Q241 WeakPolarHBondContact O-CB 3.47Å; A237-Q241 WeakPolarHBondContact O-CG 3.18Å; A237-Q241 PolarHBondContact O-N 3.25Å
242	H	97.4	Very high	96.7	Very high	12 Å²	12	21.9 Å²	21.9	6%	0.056	11%	0.112	C	C	.	.			trans	-77.8	137.6	-172.8	-165.7	-102	0	0	0	112.3	D134 H136 F238 W244 A245	D134-H242 IonicContact OD2-CE1 3.97Å; D134-H242 IonicContact OD2-NE2 2.81Å; D134-H242 PolarHBondContact OD2-NE2 3.04Å; H136-H242 AromaticContact CD2-CD2 3.83Å; H136-H242 AromaticContact CG-CD2 3.52Å; H136-H242 AromaticContact ND1-CD2 3.98Å; F238-H242 HydrophobicContact CD2-CB 3.62Å; F238-H242 AromaticContact CD2-CG 3.69Å; F238-H242 HydrophobicContact CE2-CB 3.79Å; F238-H242 AromaticContact CE2-CE1 3.92Å; F238-H242 AromaticContact CE2-CG 3.47Å; F238-H242 VanDerWaalsContact CE2-CG 3.47Å; F238-H242 AromaticContact CE2-ND1 3.34Å; F238-H242 VanDerWaalsContact CE2-ND1 3.34Å; F238-H242 WeakPolarHBondContact CE2-ND1 3.43Å; F238-H242 HydrophobicContact CG-CB 4.21Å; F238-H242 AromaticContact CZ-ND1 3.92Å; F238-H242 WeakPolarHBondContact O-CB 3.41Å; F238-H242 PolarHBondContact O-N 2.8Å; H242-W244 AromaticContact CE1-CD2 3.49Å; H242-W244 VanDerWaalsContact CE1-CD2 3.49Å; H242-W244 AromaticContact CE1-CE3 3.59Å; H242-W244 AromaticContact CE1-CG 3.56Å; H242-W244 WeakPolarHBondContact ND1-CB 3.32Å; H242-W244 AromaticContact ND1-CG 3.8Å; H242-W244 PolarHBondContact ND1-N 3.2Å; H242-W244 VanDerWaalsContact ND1-N 3.14Å; H242-W244 PolarHBondContact O-N 3.18Å; H242-A245 WeakPolarHBondContact O-CB 3.39Å; H242-A245 PolarHBondContact O-N 2.96Å
243	K	96.4	Very high	96.9	Very high	133 Å²	133	21.7 Å²	21.7	58%	0.578	11%	0.111	S	C	*	.	G	3₁₀ helix	trans	-59.1	-29.5	-179.6	69.6	-169.7	175.3	-154	0	114	D134 T246	D134-K243 WeakPolarHBondContact OD2-CE 3.23Å; D134-K243 IonicContact OD2-NZ 2.7Å; D134-K243 PolarHBondContact OD2-NZ 3.2Å; K243-T246 PolarHBondContact O-OG1 2.93Å; K243-T246 VanDerWaalsContact O-OG1 3.13Å
244	W	97.5	Very high	97	Very high	29 Å²	29	20.7 Å²	20.7	11%	0.11	11%	0.106	C	C	.	.	G	3₁₀ helix	trans	-82.4	-10.5	177.3	-59.7	-21.6	0	0	0	113.6	S132 D134 A159 R161 I221 H242 T246 D247	S132-W244 WeakPolarHBondContact O-CH2 3.41Å; D134-W244 HydrophobicContact CB-CH2 3.78Å; D134-W244 HydrophobicContact CB-CZ2 4.25Å; D134-W244 HydrophobicContact CB-CZ3 4.09Å; A159-W244 HydrophobicContact CB-CE3 3.94Å; A159-W244 HydrophobicContact CB-CZ3 3.7Å; R161-W244 HydrophobicContact CB-CD2 4.36Å; R161-W244 HydrophobicContact CB-CE3 3.9Å; R161-W244 HydrophobicContact CB-CH2 3.63Å; R161-W244 HydrophobicContact CB-CZ2 4.07Å; R161-W244 HydrophobicContact CB-CZ3 3.53Å; R161-W244 VanDerWaalsContact NH1-CD1 3.27Å; I221-W244 HydrophobicContact CD1-CB 3.81Å; I221-W244 HydrophobicContact CD1-CE3 4.35Å; I221-W244 HydrophobicContact CD1-CG 4.45Å; I221-W244 HydrophobicContact CG2-CE3 4.42Å; H242-W244 AromaticContact CE1-CD2 3.49Å; H242-W244 VanDerWaalsContact CE1-CD2 3.49Å; H242-W244 AromaticContact CE1-CE3 3.59Å; H242-W244 AromaticContact CE1-CG 3.56Å; H242-W244 WeakPolarHBondContact ND1-CB 3.32Å; H242-W244 AromaticContact ND1-CG 3.8Å; H242-W244 PolarHBondContact ND1-N 3.2Å; H242-W244 VanDerWaalsContact ND1-N 3.14Å; H242-W244 PolarHBondContact O-N 3.18Å; W244-T246 PolarHBondContact O-N 3.21Å; W244-D247 PolarHBondContact O-N 2.79Å; W244-D247 VanDerWaalsContact O-N 3.13Å
245	A	96.5	Very high	97	Very high	6 Å²	6	20.9 Å²	20.9	5%	0.05	11%	0.107	C	C	.	.	G	3₁₀ helix	trans	-64.8	-23.7	-179	0	0	0	0	0	113.2	I239 H242 D247	I239-A245 HydrophobicContact CD1-CB 4.18Å; I239-A245 WeakPolarHBondContact O-CB 3Å; H242-A245 WeakPolarHBondContact O-CB 3.39Å; H242-A245 PolarHBondContact O-N 2.96Å; A245-D247 VanDerWaalsContact C-N 3.26Å; A245-D247 PolarHBondContact O-N 3.4Å
246	T	94.5	Very high	96.9	Very high	101 Å²	101	21.1 Å²	21.1	62%	0.62	11%	0.11	S	C	*	.	G	3₁₀ helix	trans	-66.8	-29.3	175.7	50.7	0	0	0	0	112.8	K243 W244	K243-T246 PolarHBondContact O-OG1 2.93Å; K243-T246 VanDerWaalsContact O-OG1 3.13Å; W244-T246 PolarHBondContact O-N 3.21Å
247	D	96	Very high	96.7	Very high	31 Å²	31	23 Å²	23	17%	0.166	13%	0.125	C	C	.	.	G	3₁₀ helix	trans	-86.8	-13	-173.4	-55.4	-5.2	0	0	0	111.7	R161 L175 A176 W244 A245 V249	R161-D247 IonicContact CZ-OD2 3.36Å; R161-D247 VanDerWaalsContact CZ-OD2 3.3Å; R161-D247 IonicContact NH1-OD2 3.21Å; R161-D247 PolarHBondContact NH1-OD2 2.93Å; R161-D247 IonicContact NH2-OD2 2.7Å; R161-D247 PolarHBondContact NH2-OD2 3.09Å; L175-D247 WeakPolarHBondContact CA-O 3.48Å; A176-D247 HydrophobicContact CB-CB 4.39Å; A176-D247 PolarHBondContact N-O 2.71Å; W244-D247 PolarHBondContact O-N 2.79Å; W244-D247 VanDerWaalsContact O-N 3.13Å; A245-D247 VanDerWaalsContact C-N 3.26Å; A245-D247 PolarHBondContact O-N 3.4Å; D247-V249 PolarHBondContact O-N 2.98Å
248	I	97.8	Very high	96.4	Very high	0 Å²	0	23 Å²	23	0%	0	13%	0.125	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.4	122.6	-174.4	-59.3	170.9	0	0	0	110.2	A176 L178 I221 F238 I239 V318 K372	A176-I248 HydrophobicContact CB-CG1 4.49Å; A176-I248 WeakPolarHBondContact O-CA 3.3Å; L178-I248 HydrophobicContact CB-CD1 4.15Å; L178-I248 HydrophobicContact CB-CG1 4.44Å; L178-I248 HydrophobicContact CB-CG2 3.71Å; L178-I248 HydrophobicContact CD1-CD1 4.23Å; L178-I248 HydrophobicContact CD2-CD1 4.13Å; L178-I248 HydrophobicContact CD2-CG2 4.47Å; L178-I248 HydrophobicContact CG-CD1 4.4Å; I221-I248 HydrophobicContact CD1-CD1 4.31Å; I221-I248 HydrophobicContact CD1-CG1 4.02Å; F238-I248 HydrophobicContact CE1-CD1 3.54Å; F238-I248 HydrophobicContact CZ-CD1 4.09Å; I239-I248 HydrophobicContact CD1-CD1 4.41Å; I248-V318 HydrophobicContact CG2-CG1 3.98Å; I248-V318 HydrophobicContact CG2-CG2 4.37Å; I248-K372 VanDerWaalsContact O-CE 3.28Å; I248-K372 WeakPolarHBondContact O-CE 3.24Å
249	V	96	Very high	95.9	Very high	7 Å²	7	23 Å²	23	4%	0.042	13%	0.125	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	-16.3	-177.5	-64.4	0	0	0	0	114.4	L175 A176 D247 V318 P319 I367 F370	L175-V249 HydrophobicContact CB-CG1 3.94Å; L175-V249 HydrophobicContact CB-CG2 3.88Å; L175-V249 HydrophobicContact CD1-CG1 3.77Å; L175-V249 HydrophobicContact CD1-CG2 4.46Å; L175-V249 HydrophobicContact CD2-CG1 3.76Å; L175-V249 HydrophobicContact CG-CG1 4.01Å; A176-V249 PolarHBondContact O-N 3.42Å; A176-V249 VanDerWaalsContact O-N 3.1Å; D247-V249 PolarHBondContact O-N 2.98Å; V249-V318 VanDerWaalsContact C-CG1 3.5Å; V249-P319 VanDerWaalsContact O-CD 3.32Å; V249-P319 WeakPolarHBondContact O-CD 3.29Å; V249-P319 WeakPolarHBondContact O-CG 3.32Å; V249-I367 HydrophobicContact CG2-CG2 3.83Å; V249-F370 HydrophobicContact CB-CB 3.91Å; V249-F370 HydrophobicContact CG2-CB 4.08Å
250	A	97.4	Very high	95.3	Very high	0 Å²	0	23.3 Å²	23.3	0%	0	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.3	160.8	168.5	0	0	0	0	0	110.5	F177 L178 L277 P319 F370	F177-A250 WeakPolarHBondContact CA-O 3.28Å; F177-A250 HydrophobicContact CD2-CB 3.63Å; F177-A250 HydrophobicContact CE2-CB 3.71Å; L178-A250 PolarHBondContact N-O 2.82Å; A250-L277 HydrophobicContact CB-CD1 4.08Å; A250-L277 HydrophobicContact CB-CD2 4.19Å; A250-P319 VanDerWaalsContact CA-O 3.23Å; A250-P319 WeakPolarHBondContact CA-O 3.42Å; A250-F370 HydrophobicContact CB-CD2 3.69Å; A250-F370 HydrophobicContact CB-CE2 3.72Å
251	F	98	Very high	95	Very high	0 Å²	0	22.6 Å²	22.6	0%	0	12%	0.123	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.2	164.4	177	73.3	-90.6	0	0	0	114.4	F177 L178 N253 Y309 F312 V318 P319 G320 L321	F177-F251 VanDerWaalsContact CZ-C 3.41Å; L178-F251 HydrophobicContact CB-CB 3.72Å; L178-F251 HydrophobicContact CD2-CB 4.01Å; L178-F251 HydrophobicContact CG-CB 4.13Å; L178-F251 CarbonylContact O-C 3.57Å; L178-F251 WeakPolarHBondContact O-CA 3.28Å; L178-F251 WeakPolarHBondContact O-CB 3.23Å; F251-N253 HydrophobicContact CD2-CB 4.15Å; F251-N253 HydrophobicContact CE2-CB 3.98Å; F251-Y309 AromaticContact CE2-CD2 3.56Å; F251-Y309 HydrophobicContact CE2-CD2 3.56Å; F251-Y309 HydrophobicContact CE2-CE2 4.43Å; F251-Y309 HydrophobicContact CE2-CG 4.23Å; F251-Y309 AromaticContact CZ-CD2 3.37Å; F251-Y309 HydrophobicContact CZ-CD2 3.37Å; F251-Y309 AromaticContact CZ-CE2 3.94Å; F251-Y309 HydrophobicContact CZ-CE2 3.94Å; F251-Y309 HydrophobicContact CZ-CG 4.07Å; F251-F312 HydrophobicContact CD1-CB 3.64Å; F251-F312 HydrophobicContact CD1-CG 4.34Å; F251-F312 HydrophobicContact CD2-CB 4.34Å; F251-F312 AromaticContact CD2-CD2 3.81Å; F251-F312 HydrophobicContact CD2-CD2 3.81Å; F251-F312 HydrophobicContact CD2-CG 4.41Å; F251-F312 HydrophobicContact CE1-CB 3.31Å; F251-F312 HydrophobicContact CE1-CG 4.32Å; F251-F312 HydrophobicContact CE2-CB 4.09Å; F251-F312 AromaticContact CE2-CD2 3.82Å; F251-F312 HydrophobicContact CE2-CD2 3.82Å; F251-F312 HydrophobicContact CE2-CG 4.42Å; F251-F312 HydrophobicContact CG-CB 4.15Å; F251-F312 HydrophobicContact CG-CD2 4.19Å; F251-F312 HydrophobicContact CG-CG 4.39Å; F251-F312 HydrophobicContact CZ-CB 3.58Å; F251-F312 HydrophobicContact CZ-CD2 4.19Å; F251-F312 HydrophobicContact CZ-CG 4.38Å; F251-V318 HydrophobicContact CD1-CB 3.89Å; F251-V318 HydrophobicContact CD1-CG1 3.71Å; F251-V318 HydrophobicContact CE1-CB 4.21Å; F251-V318 HydrophobicContact CE1-CG1 4.43Å; F251-V318 VanDerWaalsContact CE1-O 3.29Å; F251-V318 WeakPolarHBondContact CE1-O 3.13Å; F251-P319 VanDerWaalsContact CD1-O 3.32Å; F251-P319 WeakPolarHBondContact CD1-O 3.46Å; F251-P319 PolarHBondContact N-O 3.24Å; F251-P319 VanDerWaalsContact N-O 3.1Å; F251-G320 CarbonylContact O-C 3.58Å; F251-G320 WeakPolarHBondContact O-CA 3.07Å; F251-L321 PolarHBondContact O-N 2.92Å
252	M	98.4	Very high	94.7	Very high	0 Å²	0	20.3 Å²	20.3	0%	0	11%	0.112	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	122.6	163.4	174.1	176	-82.2	0	0	108	F177 L178 I179 S180 L254 F285 L321 L323 I354 F357	F177-M252 HydrophobicContact CE1-CB 3.85Å; F177-M252 HydrophobicContact CZ-CB 3.81Å; L178-M252 PolarHBondContact O-N 3.35Å; I179-M252 WeakPolarHBondContact CA-O 3.29Å; S180-M252 PolarHBondContact N-O 2.99Å; M252-L254 HydrophobicContact CG-CD2 3.82Å; M252-L254 HydrophobicContact CG-CG 4.32Å; M252-L254 HydrophobicContact SD-CD2 3.88Å; M252-F285 HydrophobicContact CE-CE2 4.31Å; M252-F285 HydrophobicContact CE-CZ 4.41Å; M252-L321 CarbonylContact C-O 3.3Å; M252-L321 WeakPolarHBondContact CA-O 3.31Å; M252-L321 HydrophobicContact CE-CD1 4.07Å; M252-L323 HydrophobicContact CE-CD1 3.84Å; M252-L323 HydrophobicContact CE-CD2 4.38Å; M252-L323 HydrophobicContact CG-CD1 3.84Å; M252-L323 HydrophobicContact SD-CD1 4.24Å; M252-I354 HydrophobicContact SD-CD1 3.62Å; M252-F357 HydrophobicContact CB-CE1 4.5Å; M252-F357 HydrophobicContact CE-CD1 3.35Å; M252-F357 HydrophobicContact CE-CD2 4.06Å; M252-F357 HydrophobicContact CE-CE1 3.25Å; M252-F357 HydrophobicContact CE-CE2 3.96Å; M252-F357 HydrophobicContact CE-CG 3.76Å; M252-F357 HydrophobicContact CE-CZ 3.57Å; M252-F357 HydrophobicContact SD-CD1 4.01Å; M252-F357 HydrophobicContact SD-CE1 4.11Å
253	N	98.5	Very high	94.5	Very high	0 Å²	0	20.1 Å²	20.1	0%	0	11%	0.111	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.5	136.1	173.1	-169.1	56	0	0	0	109.7	F251 E255 D308 Y309 L321 D322 L323	F251-N253 HydrophobicContact CD2-CB 4.15Å; F251-N253 HydrophobicContact CE2-CB 3.98Å; N253-E255 VanDerWaalsContact ND2-CG 3.26Å; N253-E255 WeakPolarHBondContact ND2-CG 3.49Å; N253-E255 PolarHBondContact ND2-OE1 2.98Å; N253-D308 WeakPolarHBondContact OD1-CB 3.05Å; N253-Y309 PolarHBondContact ND2-N 3.19Å; N253-L321 PolarHBondContact N-O 3.41Å; N253-D322 WeakPolarHBondContact CB-OD1 3.46Å; N253-D322 PolarHBondContact ND2-OD1 3.21Å; N253-L323 PolarHBondContact O-N 3.33Å
254	L	98.5	Very high	94.4	Very high	0 Å²	0	15 Å²	15	0%	0	9%	0.089	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	119.4	-175.4	-58.9	178.3	0	0	0	110.3	I179 S180 C181 N198 M202 M252 L263 L323 I354	I179-L254 HydrophobicContact CG2-CD1 3.95Å; I179-L254 HydrophobicContact CG2-CG 4.5Å; S180-L254 PolarHBondContact O-N 3.41Å; C181-L254 HydrophobicContact CB-CB 4.41Å; N198-L254 HydrophobicContact CB-CB 3.67Å; N198-L254 HydrophobicContact CB-CD1 4.07Å; M202-L254 HydrophobicContact CG-CD1 4.2Å; M202-L254 HydrophobicContact SD-CD1 4.16Å; M252-L254 HydrophobicContact CG-CD2 3.82Å; M252-L254 HydrophobicContact CG-CG 4.32Å; M252-L254 HydrophobicContact SD-CD2 3.88Å; L254-L263 HydrophobicContact CD2-CD1 4.48Å; L254-L323 WeakPolarHBondContact CA-O 3.45Å; L254-L323 HydrophobicContact CD2-CB 4.17Å; L254-I354 HydrophobicContact CD1-CD1 4.37Å; L254-I354 HydrophobicContact CD2-CD1 3.79Å
255	E	96.8	Very high	94.4	Very high	5 Å²	5	13.6 Å²	13.6	2%	0.023	8%	0.083	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	172.8	-168	-69.6	-63.8	169.8	0	0	113.4	H182 N198 N253 T307 L323 A324 Y325	H182-E255 IonicContact CD2-OE2 3.58Å; H182-E255 PolarHBondContact CD2-OE2 3.46Å; H182-E255 IonicContact NE2-OE2 2.73Å; N198-E255 PolarHBondContact ND2-N 2.8Å; N198-E255 PolarHBondContact ND2-O 2.8Å; N253-E255 VanDerWaalsContact ND2-CG 3.26Å; N253-E255 WeakPolarHBondContact ND2-CG 3.49Å; N253-E255 PolarHBondContact ND2-OE1 2.98Å; E255-T307 HydrophobicContact CG-CG2 4.03Å; E255-L323 PolarHBondContact N-O 2.86Å; E255-A324 HydrophobicContact CB-CB 3.89Å; E255-A324 VanDerWaalsContact O-CA 3.31Å; E255-A324 WeakPolarHBondContact O-CA 3.5Å; E255-Y325 PolarHBondContact O-N 2.68Å
256	G	94.7	Very high	94.2	Very high	5 Å²	5	13.5 Å²	13.5	5%	0.052	8%	0.082	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	141.5	167.8	0	0	0	0	0	112.5	S193 D194 Y332	S193-G256 WeakPolarHBondContact O-CA 3.34Å; D194-G256 WeakPolarHBondContact OD1-CA 3.37Å; D194-G256 PolarHBondContact OD1-N 2.93Å; D194-G256 VanDerWaalsContact OD1-N 3.16Å; G256-Y332 WeakPolarHBondContact O-CE2 3.42Å
257	A	92.4	Very high	94.1	Very high	40 Å²	40	9.1 Å²	9.1	33%	0.331	6%	0.055	S	C	.	.	S	Bend	trans	-140.2	18.7	166.4	0	0	0	0	0	110.5	Y325 G329 Y332	A257-Y325 CarbonylContact C-O 3.45Å; A257-Y325 VanDerWaalsContact C-O 3.27Å; A257-Y325 VanDerWaalsContact CA-O 3.3Å; A257-Y325 WeakPolarHBondContact CA-O 3.39Å; A257-Y325 PolarHBondContact N-O 3.14Å; A257-G329 WeakPolarHBondContact O-CA 3.03Å; A257-Y332 VanDerWaalsContact CA-CD2 3.47Å; A257-Y332 HydrophobicContact CB-CE2 4.5Å
258	G	90.2	Very high	94	Very high	0 Å²	0	7.7 Å²	7.7	0%	0	5%	0.047	C	C	.	.	S	Bend	trans	167.7	164.3	-171.6	0	0	0	0	0	110.1	S193 Y325 Q327	S193-G258 WeakPolarHBondContact CB-O 3.15Å; S193-G258 PolarHBondContact OG-O 2.91Å; S193-G258 VanDerWaalsContact OG-O 3.09Å; G258-Y325 PolarHBondContact N-O 2.72Å; G258-Y325 WeakPolarHBondContact O-CB 3.05Å; G258-Q327 CarbonylContact C-O 3.18Å; G258-Q327 VanDerWaalsContact C-O 3.25Å; G258-Q327 WeakPolarHBondContact CA-O 3.43Å
259	A	88.2	Confident	93.3	Very high	0 Å²	0	7.8 Å²	7.8	0%	0	5%	0.048	C	C	.	.	S	Bend	trans	-107.7	-2.7	-167.5	0	0	0	0	0	117.1	S193 Q327 V331 R341 I342	S193-A259 VanDerWaalsContact CB-CA 3.43Å; S193-A259 WeakPolarHBondContact OG-CA 3.29Å; A259-Q327 PolarHBondContact N-O 3.31Å; A259-V331 HydrophobicContact CB-CG2 3.44Å; A259-V331 VanDerWaalsContact CB-CG2 3.44Å; A259-R341 HydrophobicContact CB-CB 3.97Å; A259-I342 WeakPolarHBondContact O-CG1 3.42Å
260	A	83.1	Confident	92.8	Very high	19 Å²	19	7.6 Å²	7.6	16%	0.157	5%	0.047	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	163.7	-167	0	0	0	0	0	113.9	Q327 D328	A260-Q327 HydrophobicContact CB-CB 4.26Å; A260-Q327 HydrophobicContact CB-CG 4.16Å; A260-Q327 PolarHBondContact N-O 3.09Å; A260-D328 HydrophobicContact CB-CB 3.84Å
261	K	89.2	Confident	92.1	Very high	27 Å²	27	8.4 Å²	8.4	12%	0.117	6%	0.056	C	C	.	.	E	Extended strand (participates in β ladder)	trans	64.1	-138.7	165.5	-53.8	-156.7	-168	-159.7	0	113.8	D64 S67 D68 C69 Y325 Q327 C346	D64-K261 PolarHBondContact O-NZ 3.39Å; D64-K261 IonicContact OD1-NZ 3.78Å; D64-K261 PolarHBondContact OD1-NZ 3.41Å; D64-K261 IonicContact OD2-NZ 3.87Å; S67-K261 WeakPolarHBondContact O-CB 3.33Å; S67-K261 WeakPolarHBondContact OG-CD 3.38Å; S67-K261 WeakPolarHBondContact OG-CE 3.43Å; S67-K261 PolarHBondContact OG-NZ 3.21Å; D68-K261 VanDerWaalsContact OD1-CD 3.24Å; D68-K261 WeakPolarHBondContact OD1-CD 3.32Å; D68-K261 WeakPolarHBondContact OD1-CE 3.42Å; D68-K261 IonicContact OD1-NZ 3.27Å; D68-K261 PolarHBondContact OD1-NZ 2.95Å; C69-K261 VanDerWaalsContact SG-C 3.5Å; C69-K261 PolarHBondContact SG-O 3.25Å; C69-K261 VanDerWaalsContact SG-O 3.39Å; K261-Y325 WeakPolarHBondContact O-CE1 3.48Å; K261-Q327 HydrophobicContact CB-CB 4.15Å; K261-Q327 HydrophobicContact CB-CG 4.2Å; K261-Q327 HydrophobicContact CD-CG 3.72Å; K261-Q327 HydrophobicContact CG-CB 4.23Å; K261-Q327 HydrophobicContact CG-CG 3.75Å; K261-C346 VanDerWaalsContact CA-SG 3.55Å; K261-C346 WeakPolarHBondContact O-CB 3.17Å; K261-C346 PolarHBondContact O-SG 2.98Å
262	R	91.4	Very high	91.5	Very high	11 Å²	11	13.3 Å²	13.3	4%	0.042	9%	0.088	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.4	149.5	-168.8	-59.6	-179.4	-55.9	-163.8	4.3	111.5	S66 S67 F264 L289 L349 G416	S66-R262 PolarHBondContact O-NH1 3.38Å; S66-R262 PolarHBondContact O-NH2 2.88Å; S67-R262 WeakPolarHBondContact O-CG 3.34Å; S67-R262 PolarHBondContact O-NE 3.41Å; R262-F264 PolarHBondContact O-N 2.81Å; R262-L289 HydrophobicContact CB-CB 4.29Å; R262-L289 HydrophobicContact CB-CD2 4.03Å; R262-L349 HydrophobicContact CG-CD2 3.94Å; R262-G416 VanDerWaalsContact NH1-CA 3.31Å
263	L	93.9	Very high	91.2	Very high	8 Å²	8	13.8 Å²	13.8	4%	0.042	9%	0.091	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-62.2	125	169.5	-76.5	173.1	0	0	0	110.5	L254 L323 Y325 S350 I354	L254-L263 HydrophobicContact CD2-CD1 4.48Å; L263-L323 HydrophobicContact CB-CB 4.43Å; L263-L323 HydrophobicContact CB-CD2 4.34Å; L263-Y325 HydrophobicContact CD2-CD1 4.25Å; L263-Y325 HydrophobicContact CD2-CD2 3.52Å; L263-Y325 HydrophobicContact CD2-CE1 4.24Å; L263-Y325 HydrophobicContact CD2-CE2 3.48Å; L263-Y325 VanDerWaalsContact CD2-CE2 3.48Å; L263-Y325 HydrophobicContact CD2-CG 3.91Å; L263-Y325 HydrophobicContact CG-CD2 4.43Å; L263-Y325 HydrophobicContact CG-CE1 4.19Å; L263-Y325 HydrophobicContact CG-CE2 4.03Å; L263-S350 VanDerWaalsContact CD1-OG 3.29Å; L263-S350 WeakPolarHBondContact CD1-OG 3.34Å; L263-I354 HydrophobicContact CD1-CD1 4.31Å
264	F	94.5	Very high	90.9	Very high	25 Å²	25	13.9 Å²	13.9	11%	0.11	9%	0.092	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.9	121.6	174.8	171.1	-108.9	0	0	0	110	R262 S266 L289 L323 A324 I326	R262-F264 PolarHBondContact O-N 2.81Å; F264-S266 PolarHBondContact O-N 3Å; F264-S266 VanDerWaalsContact O-N 3.13Å; F264-L289 CarbonylContact C-O 3.6Å; F264-L289 VanDerWaalsContact CA-O 3.29Å; F264-L289 WeakPolarHBondContact CA-O 3.49Å; F264-L289 HydrophobicContact CB-CD2 4.19Å; F264-L289 HydrophobicContact CB-CG 4.21Å; F264-L289 HydrophobicContact CD2-CD1 4.43Å; F264-L289 HydrophobicContact CD2-CG 4.01Å; F264-L323 CarbonylContact O-C 3.54Å; F264-L323 VanDerWaalsContact O-CA 3.29Å; F264-L323 WeakPolarHBondContact O-CA 3.4Å; F264-A324 PolarHBondContact N-O 2.82Å; F264-A324 PolarHBondContact O-N 2.74Å; F264-I326 HydrophobicContact CB-CD1 3.76Å; F264-I326 HydrophobicContact CB-CG1 3.83Å; F264-I326 HydrophobicContact CB-CG2 4.09Å; F264-I326 HydrophobicContact CD1-CD1 3.88Å; F264-I326 HydrophobicContact CD1-CG2 4Å; F264-I326 HydrophobicContact CD2-CD1 4.17Å; F264-I326 HydrophobicContact CG-CD1 3.68Å; F264-I326 HydrophobicContact CG-CG1 4.3Å; F264-I326 HydrophobicContact CG-CG2 4.42Å
265	L	96.4	Very high	90.5	Very high	0 Å²	0	17.1 Å²	17.1	0%	0	11%	0.109	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.5	102.5	168.9	176.1	65	0	0	0	109.1	Q267 L278 Y281 L289 A290 S291 L321 L323 Y411	L265-Q267 WeakPolarHBondContact CD1-O 3.46Å; L265-L278 HydrophobicContact CD2-CD2 3.68Å; L265-Y281 HydrophobicContact CB-CE2 4.14Å; L265-Y281 HydrophobicContact CD2-CD1 4.03Å; L265-Y281 HydrophobicContact CD2-CD2 4.31Å; L265-Y281 HydrophobicContact CD2-CE1 4.07Å; L265-Y281 HydrophobicContact CD2-CE2 4.33Å; L265-Y281 HydrophobicContact CD2-CG 4.17Å; L265-L289 PolarHBondContact N-O 3.17Å; L265-A290 HydrophobicContact CB-CB 3.77Å; L265-A290 HydrophobicContact CD2-CB 4.06Å; L265-A290 HydrophobicContact CG-CB 4.37Å; L265-S291 PolarHBondContact O-N 3.43Å; L265-L321 HydrophobicContact CD1-CB 3.83Å; L265-L321 HydrophobicContact CD1-CD1 4.42Å; L265-L321 HydrophobicContact CD1-CD2 4.17Å; L265-L321 HydrophobicContact CD1-CG 4.35Å; L265-L323 HydrophobicContact CB-CG 4.4Å; L265-L323 HydrophobicContact CD1-CD1 3.88Å; L265-L323 HydrophobicContact CD1-CG 4.04Å; L265-Y411 HydrophobicContact CD2-CD2 4.17Å; L265-Y411 HydrophobicContact CD2-CE2 3.88Å; L265-Y411 HydrophobicContact CG-CE2 3.96Å
266	S	91.6	Very high	90.4	Very high	4 Å²	4	17.9 Å²	17.9	3%	0.028	11%	0.114	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.6	-41.5	-177.2	61.3	0	0	0	0	111.6	F264 G294 E295 D322 Y411	F264-S266 PolarHBondContact O-N 3Å; F264-S266 VanDerWaalsContact O-N 3.13Å; S266-G294 CarbonylContact O-C 3.27Å; S266-G294 VanDerWaalsContact O-C 3.28Å; S266-E295 VanDerWaalsContact O-CA 3.31Å; S266-E295 WeakPolarHBondContact O-CA 3.5Å; S266-E295 WeakPolarHBondContact O-CB 3.27Å; S266-E295 PolarHBondContact O-N 3.4Å; S266-D322 PolarHBondContact N-O 2.9Å; S266-D322 PolarHBondContact OG-O 3.21Å; S266-D322 PolarHBondContact OG-OD2 2.97Å; S266-Y411 PolarHBondContact O-OH 2.88Å
267	Q	93.7	Very high	90.5	Very high	9 Å²	9	17.7 Å²	17.7	4%	0.042	11%	0.112	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.7	144	-176	-48	-178.2	83.7	0	0	111.3	L265 E295 F298 Y309 L321 D322	L265-Q267 WeakPolarHBondContact CD1-O 3.46Å; Q267-E295 HydrophobicContact CB-CB 4.5Å; Q267-E295 HydrophobicContact CB-CG 4.08Å; Q267-E295 HydrophobicContact CG-CB 4.43Å; Q267-E295 HydrophobicContact CG-CG 4.2Å; Q267-F298 HydrophobicContact CG-CD2 3.9Å; Q267-F298 HydrophobicContact CG-CE2 4.44Å; Q267-F298 HydrophobicContact CG-CG 4.42Å; Q267-Y309 HydrophobicContact CB-CD1 4.26Å; Q267-Y309 HydrophobicContact CB-CD2 4.46Å; Q267-Y309 HydrophobicContact CB-CE1 3.79Å; Q267-Y309 HydrophobicContact CB-CE2 4.08Å; Q267-Y309 VanDerWaalsContact CD-CE1 3.42Å; Q267-Y309 HydrophobicContact CG-CD1 4.46Å; Q267-Y309 HydrophobicContact CG-CE1 4.2Å; Q267-L321 CarbonylContact O-C 3.51Å; Q267-L321 WeakPolarHBondContact O-CA 3.21Å; Q267-D322 HydrophobicContact CB-CB 3.76Å; Q267-D322 HydrophobicContact CG-CB 4.15Å; Q267-D322 PolarHBondContact N-O 2.94Å; Q267-D322 PolarHBondContact NE2-OD2 2.74Å; Q267-D322 PolarHBondContact O-N 3.33Å
268	S	92.4	Very high	90.7	Very high	1 Å²	1	15.8 Å²	15.8	1%	0.007	10%	0.096	C	C	.	.			trans	-124	-17.8	176.8	67.7	0	0	0	0	113.9	S274 E295 G320 Y411	S268-S274 VanDerWaalsContact O-CB 3.27Å; S268-S274 WeakPolarHBondContact O-CB 3.18Å; S268-S274 PolarHBondContact O-OG 2.9Å; S268-E295 PolarHBondContact N-OE2 3.25Å; S268-E295 PolarHBondContact OG-OE2 3.43Å; S268-G320 CarbonylContact C-O 3.58Å; S268-Y411 WeakPolarHBondContact OG-CE1 3.28Å
269	G	84.7	Confident	90.9	Very high	2 Å²	2	19.7 Å²	19.7	2%	0.021	11%	0.114	C	C	.	.			trans	76.2	177.3	176.5	0	0	0	0	0	114.5	S274 E295 Y309	G269-S274 PolarHBondContact O-OG 3.32Å; G269-E295 PolarHBondContact N-OE2 3.45Å; G269-Y309 WeakPolarHBondContact CA-OH 3.45Å; G269-Y309 PolarHBondContact N-OH 3.12Å; G269-Y309 VanDerWaalsContact N-OH 3.12Å
270	P	85.2	Confident	91.3	Very high	3 Å²	3	19.9 Å²	19.9	2%	0.019	12%	0.116	C	C	.	.	S	Bend	trans	-89.9	157.7	-176.6	36.7	-36.8	0	0	0	112.9	S274 L373 V401 T402 V407 R408	P270-S274 PolarHBondContact O-OG 3.34Å; P270-L373 HydrophobicContact CG-CD1 4.25Å; P270-L373 HydrophobicContact CG-CD2 4.13Å; P270-L373 WeakPolarHBondContact O-CD2 3.23Å; P270-V401 HydrophobicContact CG-CG1 4.27Å; P270-T402 VanDerWaalsContact CB-O 3.25Å; P270-T402 WeakPolarHBondContact CB-O 3.48Å; P270-T402 VanDerWaalsContact CG-O 3.23Å; P270-T402 WeakPolarHBondContact CG-O 3.4Å; P270-V407 HydrophobicContact CB-CG2 4Å; P270-R408 HydrophobicContact CB-CG 4.48Å
271	G	82.4	Confident	92	Very high	18 Å²	18	19 Å²	19	19%	0.186	11%	0.109	C	C	.	.	S	Bend	trans	96	170.2	163.6	0	0	0	0	0	114.8	S273 S274 V407	G271-S273 VanDerWaalsContact C-N 3.28Å; G271-S273 PolarHBondContact O-N 2.9Å; G271-S274 WeakPolarHBondContact O-CB 3.42Å; G271-S274 PolarHBondContact O-N 3.33Å; G271-S274 VanDerWaalsContact O-N 3.08Å; G271-V407 PolarHBondContact N-O 2.9Å
272	P	86.2	Confident	92.3	Very high	102 Å²	102	19.2 Å²	19.2	66%	0.662	12%	0.116	S	C	*	.	H	α-helix	trans	-66.3	-28.1	-169.2	26.2	-35.1	0	0	0	113.5	S274 D275	P272-S274 VanDerWaalsContact C-N 3.27Å; P272-S274 PolarHBondContact O-N 3.49Å; P272-D275 WeakPolarHBondContact O-CB 3.08Å; P272-D275 PolarHBondContact O-N 3.12Å
273	S	91.8	Very high	92.5	Very high	10 Å²	10	23.3 Å²	23.3	7%	0.07	14%	0.138	C	C	.	.	H	α-helix	trans	-62.2	-36.2	175	-55.7	0	0	0	0	111.7	G271 D275 V276 L277	G271-S273 VanDerWaalsContact C-N 3.28Å; G271-S273 PolarHBondContact O-N 2.9Å; S273-D275 PolarHBondContact O-N 2.84Å; S273-V276 PolarHBondContact O-N 2.9Å; S273-L277 WeakPolarHBondContact O-CG 2.96Å; S273-L277 PolarHBondContact O-N 3.35Å; S273-L277 VanDerWaalsContact O-N 3.12Å
274	S	91.2	Very high	92.5	Very high	2 Å²	2	23 Å²	23	1%	0.014	14%	0.136	C	C	.	.	H	α-helix	trans	-63.8	-30	177.5	-65.4	0	0	0	0	112.4	S268 G269 P270 G271 P272 L277 L278	S268-S274 VanDerWaalsContact O-CB 3.27Å; S268-S274 WeakPolarHBondContact O-CB 3.18Å; S268-S274 PolarHBondContact O-OG 2.9Å; G269-S274 PolarHBondContact O-OG 3.32Å; P270-S274 PolarHBondContact O-OG 3.34Å; G271-S274 WeakPolarHBondContact O-CB 3.42Å; G271-S274 PolarHBondContact O-N 3.33Å; G271-S274 VanDerWaalsContact O-N 3.08Å; P272-S274 VanDerWaalsContact C-N 3.27Å; P272-S274 PolarHBondContact O-N 3.49Å; S274-L277 PolarHBondContact O-N 2.86Å; S274-L278 WeakPolarHBondContact O-CB 3.43Å; S274-L278 WeakPolarHBondContact O-CG 3.28Å; S274-L278 PolarHBondContact O-N 3.44Å
275	D	91.1	Very high	92.5	Very high	68 Å²	68	22.1 Å²	22.1	36%	0.364	13%	0.133	S	C	.	.	H	α-helix	trans	-63.4	-44.7	176.2	-58.9	-17.1	0	0	0	111	P272 S273 L278 E279 N409	P272-D275 WeakPolarHBondContact O-CB 3.08Å; P272-D275 PolarHBondContact O-N 3.12Å; S273-D275 PolarHBondContact O-N 2.84Å; D275-L278 PolarHBondContact O-N 3.43Å; D275-E279 WeakPolarHBondContact O-CB 3.12Å; D275-E279 PolarHBondContact O-N 2.8Å; D275-N409 PolarHBondContact OD1-ND2 2.83Å
276	V	94.7	Very high	92.1	Very high	22 Å²	22	26 Å²	26	13%	0.133	15%	0.149	C	C	.	.	H	α-helix	trans	-66.1	-39.1	177.3	175.8	0	0	0	0	111	S273 E279 A280 R366 F370	S273-V276 PolarHBondContact O-N 2.9Å; V276-E279 PolarHBondContact O-N 3.1Å; V276-A280 WeakPolarHBondContact O-CB 3.26Å; V276-A280 PolarHBondContact O-N 3.01Å; V276-R366 HydrophobicContact CG1-CB 4.48Å; V276-F370 HydrophobicContact CB-CE1 4Å; V276-F370 HydrophobicContact CB-CZ 3.72Å; V276-F370 HydrophobicContact CG1-CE1 4Å; V276-F370 HydrophobicContact CG1-CZ 3.73Å; V276-F370 HydrophobicContact CG2-CE1 4.18Å; V276-F370 HydrophobicContact CG2-CZ 4.38Å
277	L	96.8	Very high	92.1	Very high	0 Å²	0	26.6 Å²	26.6	0%	0	15%	0.152	C	C	.	.	H	α-helix	trans	-66.3	-40.6	176.1	-63.6	-178.3	0	0	0	112.3	F177 A250 S273 S274 A280 Y281 L321 I361 F370	F177-L277 HydrophobicContact CD2-CD2 4.47Å; F177-L277 HydrophobicContact CE2-CD2 3.67Å; A250-L277 HydrophobicContact CB-CD1 4.08Å; A250-L277 HydrophobicContact CB-CD2 4.19Å; S273-L277 WeakPolarHBondContact O-CG 2.96Å; S273-L277 PolarHBondContact O-N 3.35Å; S273-L277 VanDerWaalsContact O-N 3.12Å; S274-L277 PolarHBondContact O-N 2.86Å; L277-A280 PolarHBondContact O-N 2.88Å; L277-Y281 WeakPolarHBondContact O-CB 3.36Å; L277-Y281 PolarHBondContact O-N 2.78Å; L277-L321 HydrophobicContact CB-CD1 4.18Å; L277-L321 HydrophobicContact CB-CD2 3.9Å; L277-L321 HydrophobicContact CB-CG 4.02Å; L277-L321 HydrophobicContact CD1-CD2 4.49Å; L277-L321 HydrophobicContact CD1-CG 4.35Å; L277-I361 HydrophobicContact CD2-CD1 3.8Å; L277-F370 HydrophobicContact CD2-CE2 4.04Å; L277-F370 HydrophobicContact CD2-CZ 4.42Å; L277-F370 HydrophobicContact CG-CE2 4.19Å
278	L	96	Very high	92	Very high	1 Å²	1	26.3 Å²	26.3	1%	0.005	15%	0.151	C	C	.	.	H	α-helix	trans	-65.5	-40	175.4	-76.9	170.4	0	0	0	111.7	L265 S274 D275 Y281 A282 N409 Y411 I421	L265-L278 HydrophobicContact CD2-CD2 3.68Å; S274-L278 WeakPolarHBondContact O-CB 3.43Å; S274-L278 WeakPolarHBondContact O-CG 3.28Å; S274-L278 PolarHBondContact O-N 3.44Å; D275-L278 PolarHBondContact O-N 3.43Å; L278-Y281 WeakPolarHBondContact O-CB 3.37Å; L278-Y281 PolarHBondContact O-N 3.39Å; L278-A282 WeakPolarHBondContact O-CB 3.42Å; L278-A282 PolarHBondContact O-N 3.33Å; L278-N409 HydrophobicContact CD1-CB 3.96Å; L278-Y411 HydrophobicContact CD1-CD1 4.02Å; L278-Y411 HydrophobicContact CD2-CD1 4.04Å; L278-Y411 HydrophobicContact CD2-CD2 4.32Å; L278-Y411 HydrophobicContact CD2-CE1 4.46Å; L278-Y411 HydrophobicContact CD2-CG 3.97Å; L278-I421 HydrophobicContact CB-CD1 3.8Å; L278-I421 HydrophobicContact CB-CG1 4.43Å; L278-I421 HydrophobicContact CB-CG2 4.48Å; L278-I421 HydrophobicContact CD1-CG2 4.29Å; L278-I421 WeakPolarHBondContact O-CD1 3.45Å
279	E	95.3	Very high	92	Very high	81 Å²	81	27.1 Å²	27.1	38%	0.379	16%	0.155	S	C	.	.	H	α-helix	trans	-61.3	-47.9	173.4	-170	-163.6	154.9	0	0	111.1	D275 V276 Y281 A282 N283 R366	D275-E279 WeakPolarHBondContact O-CB 3.12Å; D275-E279 PolarHBondContact O-N 2.8Å; V276-E279 PolarHBondContact O-N 3.1Å; E279-Y281 VanDerWaalsContact C-N 3.31Å; E279-Y281 PolarHBondContact O-N 2.93Å; E279-A282 PolarHBondContact O-N 3.27Å; E279-N283 WeakPolarHBondContact O-CB 3.34Å; E279-N283 PolarHBondContact O-N 3.35Å; E279-N283 PolarHBondContact O-ND2 3.34Å; E279-R366 IonicContact OE1-NH1 2.68Å; E279-R366 IonicContact OE1-NH2 3.18Å; E279-R366 IonicContact OE2-CZ 2.67Å; E279-R366 IonicContact OE2-NH1 2.8Å; E279-R366 PolarHBondContact OE2-NH1 3.44Å; E279-R366 IonicContact OE2-NH2 3.74Å; E279-R366 PolarHBondContact OE2-NH2 3.36Å
280	A	96.6	Very high	92.5	Very high	5 Å²	5	27.2 Å²	27.2	4%	0.041	16%	0.156	C	C	.	.	H	α-helix	trans	-59.9	-41.7	175.8	0	0	0	0	0	111.6	V276 L277 N283 A284 F357 I361	V276-A280 WeakPolarHBondContact O-CB 3.26Å; V276-A280 PolarHBondContact O-N 3.01Å; L277-A280 PolarHBondContact O-N 2.88Å; A280-N283 PolarHBondContact O-N 3.08Å; A280-A284 WeakPolarHBondContact O-CB 3.2Å; A280-A284 PolarHBondContact O-N 2.91Å; A280-F357 HydrophobicContact CB-CD2 4.24Å; A280-F357 HydrophobicContact CB-CE2 3.78Å; A280-I361 HydrophobicContact CB-CD1 3.66Å; A280-I361 HydrophobicContact CB-CG1 4.34Å
281	Y	97.3	Very high	92.9	Very high	0 Å²	0	28.3 Å²	28.3	0%	0	16%	0.163	C	C	.	.	H	α-helix	trans	-59.8	-50.5	175.1	175.3	-89.7	0	0	0	111.4	L265 L277 L278 E279 N283 A284 F285 P288 L289 A290 L321 L323 V419	L265-Y281 HydrophobicContact CB-CE2 4.14Å; L265-Y281 HydrophobicContact CD2-CD1 4.03Å; L265-Y281 HydrophobicContact CD2-CD2 4.31Å; L265-Y281 HydrophobicContact CD2-CE1 4.07Å; L265-Y281 HydrophobicContact CD2-CE2 4.33Å; L265-Y281 HydrophobicContact CD2-CG 4.17Å; L277-Y281 WeakPolarHBondContact O-CB 3.36Å; L277-Y281 PolarHBondContact O-N 2.78Å; L278-Y281 WeakPolarHBondContact O-CB 3.37Å; L278-Y281 PolarHBondContact O-N 3.39Å; E279-Y281 VanDerWaalsContact C-N 3.31Å; E279-Y281 PolarHBondContact O-N 2.93Å; Y281-N283 VanDerWaalsContact C-N 3.28Å; Y281-N283 PolarHBondContact O-N 3.05Å; Y281-A284 PolarHBondContact O-N 2.85Å; Y281-F285 HydrophobicContact CD2-CD1 4.13Å; Y281-F285 AromaticContact CD2-CD2 3.44Å; Y281-F285 HydrophobicContact CD2-CD2 3.44Å; Y281-F285 VanDerWaalsContact CD2-CD2 3.44Å; Y281-F285 HydrophobicContact CD2-CE1 4.15Å; Y281-F285 AromaticContact CD2-CE2 3.47Å; Y281-F285 HydrophobicContact CD2-CE2 3.47Å; Y281-F285 VanDerWaalsContact CD2-CE2 3.47Å; Y281-F285 AromaticContact CD2-CG 3.8Å; Y281-F285 HydrophobicContact CD2-CG 3.8Å; Y281-F285 AromaticContact CD2-CZ 3.85Å; Y281-F285 HydrophobicContact CD2-CZ 3.85Å; Y281-F285 HydrophobicContact CE2-CB 4.31Å; Y281-F285 AromaticContact CE2-CD1 3.38Å; Y281-F285 HydrophobicContact CE2-CD1 3.38Å; Y281-F285 AromaticContact CE2-CD2 3.6Å; Y281-F285 HydrophobicContact CE2-CD2 3.6Å; Y281-F285 AromaticContact CE2-CE1 3.43Å; Y281-F285 HydrophobicContact CE2-CE1 3.43Å; Y281-F285 VanDerWaalsContact CE2-CE1 3.43Å; Y281-F285 AromaticContact CE2-CE2 3.66Å; Y281-F285 HydrophobicContact CE2-CE2 3.66Å; Y281-F285 AromaticContact CE2-CG 3.48Å; Y281-F285 HydrophobicContact CE2-CG 3.48Å; Y281-F285 VanDerWaalsContact CE2-CG 3.48Å; Y281-F285 AromaticContact CE2-CZ 3.58Å; Y281-F285 HydrophobicContact CE2-CZ 3.58Å; Y281-F285 HydrophobicContact CG-CD2 4.11Å; Y281-F285 HydrophobicContact CG-CE2 4.48Å; Y281-F285 HydrophobicContact CG-CG 4.43Å; Y281-F285 AromaticContact CZ-CD1 3.74Å; Y281-F285 AromaticContact CZ-CG 3.86Å; Y281-F285 WeakPolarHBondContact O-CB 3.44Å; Y281-F285 PolarHBondContact O-N 3.13Å; Y281-P288 HydrophobicContact CE1-CB 3.7Å; Y281-L289 PolarHBondContact OH-N 2.92Å; Y281-L289 VanDerWaalsContact OH-N 3.14Å; Y281-L289 PolarHBondContact OH-O 3.29Å; Y281-L289 VanDerWaalsContact OH-O 3.12Å; Y281-A290 HydrophobicContact CE1-CB 4.04Å; Y281-L321 HydrophobicContact CD2-CD1 4.44Å; Y281-L323 HydrophobicContact CD2-CD2 4.42Å; Y281-L323 HydrophobicContact CE2-CD2 3.84Å; Y281-V419 HydrophobicContact CD1-CG2 4.06Å; Y281-V419 HydrophobicContact CE1-CG2 3.75Å
282	A	96	Very high	93.3	Very high	32 Å²	32	28.4 Å²	28.4	26%	0.264	16%	0.16	S	C	.	.	H	α-helix	trans	-61.3	-35.4	-179.3	0	0	0	0	0	112.7	L278 E279 V419 I421	L278-A282 WeakPolarHBondContact O-CB 3.42Å; L278-A282 PolarHBondContact O-N 3.33Å; E279-A282 PolarHBondContact O-N 3.27Å; A282-V419 HydrophobicContact CB-CB 4.08Å; A282-V419 HydrophobicContact CB-CG2 4.36Å; A282-I421 HydrophobicContact CB-CD1 3.96Å
283	N	94.8	Very high	93.5	Very high	97 Å²	97	28.9 Å²	28.9	52%	0.519	16%	0.157	S	C	.	.	H	α-helix	trans	-79.6	-32.7	178.1	-70.6	-31.6	0	0	0	113.1	E279 A280 Y281 L360	E279-N283 WeakPolarHBondContact O-CB 3.34Å; E279-N283 PolarHBondContact O-N 3.35Å; E279-N283 PolarHBondContact O-ND2 3.34Å; A280-N283 PolarHBondContact O-N 3.08Å; Y281-N283 VanDerWaalsContact C-N 3.28Å; Y281-N283 PolarHBondContact O-N 3.05Å; N283-L360 HydrophobicContact CB-CD1 4.08Å
284	A	94.3	Very high	93.4	Very high	0 Å²	0	28.8 Å²	28.8	0%	0	16%	0.157	C	C	.	.	H	α-helix	trans	-79.2	-54	-177.3	0	0	0	0	0	112.7	A280 Y281 K286 F357 L360	A280-A284 WeakPolarHBondContact O-CB 3.2Å; A280-A284 PolarHBondContact O-N 2.91Å; Y281-A284 PolarHBondContact O-N 2.85Å; A284-K286 WeakPolarHBondContact O-CE 3.43Å; A284-K286 PolarHBondContact O-N 2.84Å; A284-K286 PolarHBondContact O-NZ 3Å; A284-F357 VanDerWaalsContact CB-CA 3.4Å; A284-F357 HydrophobicContact CB-CB 3.61Å; A284-F357 HydrophobicContact CB-CD2 4.03Å; A284-F357 HydrophobicContact CB-CG 4.32Å; A284-L360 HydrophobicContact CB-CD1 3.85Å
285	F	93.6	Very high	93.3	Very high	7 Å²	7	28.7 Å²	28.7	3%	0.031	16%	0.156	C	C	.	.			trans	-73.4	117.5	-168.4	-82.8	-120	0	0	0	109.9	M252 Y281 Q287 P288 L323 N353 I354 F357	M252-F285 HydrophobicContact CE-CE2 4.31Å; M252-F285 HydrophobicContact CE-CZ 4.41Å; Y281-F285 HydrophobicContact CD2-CD1 4.13Å; Y281-F285 AromaticContact CD2-CD2 3.44Å; Y281-F285 HydrophobicContact CD2-CD2 3.44Å; Y281-F285 VanDerWaalsContact CD2-CD2 3.44Å; Y281-F285 HydrophobicContact CD2-CE1 4.15Å; Y281-F285 AromaticContact CD2-CE2 3.47Å; Y281-F285 HydrophobicContact CD2-CE2 3.47Å; Y281-F285 VanDerWaalsContact CD2-CE2 3.47Å; Y281-F285 AromaticContact CD2-CG 3.8Å; Y281-F285 HydrophobicContact CD2-CG 3.8Å; Y281-F285 AromaticContact CD2-CZ 3.85Å; Y281-F285 HydrophobicContact CD2-CZ 3.85Å; Y281-F285 HydrophobicContact CE2-CB 4.31Å; Y281-F285 AromaticContact CE2-CD1 3.38Å; Y281-F285 HydrophobicContact CE2-CD1 3.38Å; Y281-F285 AromaticContact CE2-CD2 3.6Å; Y281-F285 HydrophobicContact CE2-CD2 3.6Å; Y281-F285 AromaticContact CE2-CE1 3.43Å; Y281-F285 HydrophobicContact CE2-CE1 3.43Å; Y281-F285 VanDerWaalsContact CE2-CE1 3.43Å; Y281-F285 AromaticContact CE2-CE2 3.66Å; Y281-F285 HydrophobicContact CE2-CE2 3.66Å; Y281-F285 AromaticContact CE2-CG 3.48Å; Y281-F285 HydrophobicContact CE2-CG 3.48Å; Y281-F285 VanDerWaalsContact CE2-CG 3.48Å; Y281-F285 AromaticContact CE2-CZ 3.58Å; Y281-F285 HydrophobicContact CE2-CZ 3.58Å; Y281-F285 HydrophobicContact CG-CD2 4.11Å; Y281-F285 HydrophobicContact CG-CE2 4.48Å; Y281-F285 HydrophobicContact CG-CG 4.43Å; Y281-F285 AromaticContact CZ-CD1 3.74Å; Y281-F285 AromaticContact CZ-CG 3.86Å; Y281-F285 WeakPolarHBondContact O-CB 3.44Å; Y281-F285 PolarHBondContact O-N 3.13Å; F285-Q287 VanDerWaalsContact C-N 3.33Å; F285-P288 HydrophobicContact CB-CB 4.02Å; F285-P288 WeakPolarHBondContact O-CD 3.48Å; F285-L323 HydrophobicContact CE1-CD2 3.64Å; F285-L323 HydrophobicContact CE2-CD2 4.49Å; F285-L323 HydrophobicContact CZ-CD2 3.45Å; F285-L323 VanDerWaalsContact CZ-CD2 3.45Å; F285-N353 HydrophobicContact CD1-CB 3.67Å; F285-N353 WeakPolarHBondContact CD1-ND2 3.43Å; F285-N353 HydrophobicContact CD2-CB 4.13Å; F285-N353 HydrophobicContact CE1-CB 3.77Å; F285-N353 HydrophobicContact CE2-CB 4.22Å; F285-N353 HydrophobicContact CG-CB 3.85Å; F285-N353 HydrophobicContact CZ-CB 4.04Å; F285-I354 HydrophobicContact CZ-CD1 3.87Å; F285-F357 HydrophobicContact CD2-CB 4.43Å; F285-F357 HydrophobicContact CE2-CB 3.92Å; F285-F357 HydrophobicContact CE2-CD2 4.21Å; F285-F357 HydrophobicContact CE2-CG 4.2Å
286	K	89.5	Confident	93.2	Very high	81 Å²	81	27.4 Å²	27.4	35%	0.352	15%	0.15	S	C	.	.	S	Bend	trans	-75	-28.4	-177.6	-54.5	-52.3	173.4	-158.2	0	112.8	A284 N353	A284-K286 WeakPolarHBondContact O-CE 3.43Å; A284-K286 PolarHBondContact O-N 2.84Å; A284-K286 PolarHBondContact O-NZ 3Å; K286-N353 PolarHBondContact N-OD1 3.32Å
287	Q	90.2	Very high	92.8	Very high	18 Å²	18	30.1 Å²	30.1	8%	0.084	16%	0.163	C	C	.	.	S	Bend	trans	-132.1	75.9	174.5	-66.9	170.6	42.6	0	0	108.6	W70 F285 L349 G416	W70-Q287 PolarHBondContact O-NE2 3.07Å; F285-Q287 VanDerWaalsContact C-N 3.33Å; Q287-L349 HydrophobicContact CB-CD1 4.15Å; Q287-L349 HydrophobicContact CB-CD2 3.99Å; Q287-L349 HydrophobicContact CG-CD1 4.18Å; Q287-L349 HydrophobicContact CG-CD2 4.34Å; Q287-L349 VanDerWaalsContact OE1-CD2 3.25Å; Q287-G416 VanDerWaalsContact CA-O 3.28Å; Q287-G416 WeakPolarHBondContact CA-O 3.16Å
288	P	92.7	Very high	92.3	Very high	2 Å²	2	32.5 Å²	32.5	1%	0.013	17%	0.173	C	C	.	.			trans	-71.6	141.7	-175.5	30	-34.2	0	0	0	110.6	Y281 F285 G416 V419	Y281-P288 HydrophobicContact CE1-CB 3.7Å; F285-P288 HydrophobicContact CB-CB 4.02Å; F285-P288 WeakPolarHBondContact O-CD 3.48Å; P288-G416 WeakPolarHBondContact O-CA 3.35Å; P288-V419 HydrophobicContact CB-CG2 3.31Å; P288-V419 HydrophobicContact CG-CG2 3.55Å
289	L	92.7	Very high	91.7	Very high	18 Å²	18	34.8 Å²	34.8	9%	0.094	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.4	107.7	172.9	175.2	59	0	0	0	106.3	W63 R262 F264 L265 Y281	W63-L289 HydrophobicContact CH2-CD1 4.35Å; R262-L289 HydrophobicContact CB-CB 4.29Å; R262-L289 HydrophobicContact CB-CD2 4.03Å; F264-L289 CarbonylContact C-O 3.6Å; F264-L289 VanDerWaalsContact CA-O 3.29Å; F264-L289 WeakPolarHBondContact CA-O 3.49Å; F264-L289 HydrophobicContact CB-CD2 4.19Å; F264-L289 HydrophobicContact CB-CG 4.21Å; F264-L289 HydrophobicContact CD2-CD1 4.43Å; F264-L289 HydrophobicContact CD2-CG 4.01Å; L265-L289 PolarHBondContact N-O 3.17Å; Y281-L289 PolarHBondContact OH-N 2.92Å; Y281-L289 VanDerWaalsContact OH-N 3.14Å; Y281-L289 PolarHBondContact OH-O 3.29Å; Y281-L289 VanDerWaalsContact OH-O 3.12Å
290	A	94.3	Very high	91	Very high	5 Å²	5	38.2 Å²	38.2	4%	0.041	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.8	146.6	-171	0	0	0	0	0	110.3	L265 Y281 Y411 F412 G413	L265-A290 HydrophobicContact CB-CB 3.77Å; L265-A290 HydrophobicContact CD2-CB 4.06Å; L265-A290 HydrophobicContact CG-CB 4.37Å; Y281-A290 HydrophobicContact CE1-CB 4.04Å; A290-Y411 HydrophobicContact CB-CD2 3.92Å; A290-Y411 HydrophobicContact CB-CE2 4.22Å; A290-F412 CarbonylContact O-C 3.52Å; A290-F412 VanDerWaalsContact O-CA 3.29Å; A290-F412 WeakPolarHBondContact O-CA 3.46Å; A290-G413 PolarHBondContact O-N 2.98Å
291	S	93.4	Very high	90.2	Very high	25 Å²	25	40.7 Å²	40.7	18%	0.175	22%	0.224	C	C	.	.	B	Isolated β-bridge	trans	-160	131.6	169.4	-176.3	0	0	0	0	110.7	L265 L293 G294 Y411	L265-S291 PolarHBondContact O-N 3.43Å; S291-L293 PolarHBondContact O-N 2.99Å; S291-L293 VanDerWaalsContact O-N 3.08Å; S291-L293 WeakPolarHBondContact OG-CB 3.28Å; S291-L293 WeakPolarHBondContact OG-CG 3.47Å; S291-L293 PolarHBondContact OG-N 3.17Å; S291-G294 PolarHBondContact O-N 3.03Å; S291-Y411 VanDerWaalsContact C-CE2 3.5Å; S291-Y411 CarbonylContact C-O 3.59Å; S291-Y411 WeakPolarHBondContact CA-O 3.45Å
292	V	91.8	Very high	89.2	Confident	20 Å²	20	46.4 Å²	46.4	12%	0.121	25%	0.254	C	S	.	.	H	α-helix	trans	-58.5	-20.3	172.6	71.8	0	0	0	0	112.6	G294 E295 D296 V410 Y411	V292-G294 PolarHBondContact O-N 3.34Å; V292-E295 PolarHBondContact O-N 3.46Å; V292-D296 PolarHBondContact O-N 2.94Å; V292-V410 HydrophobicContact CG1-CG1 4.09Å; V292-Y411 HydrophobicContact CB-CD1 4.2Å; V292-Y411 HydrophobicContact CB-CE1 4.07Å; V292-Y411 HydrophobicContact CG2-CD1 4.47Å; V292-Y411 HydrophobicContact CG2-CE1 4.14Å; V292-Y411 PolarHBondContact N-O 3.24Å
293	L	90.1	Very high	88.4	Confident	113 Å²	113	47 Å²	47	59%	0.592	25%	0.254	S	S	*	.	H	α-helix	trans	-57.6	-34.2	174	-66.8	178.2	0	0	0	112	S291 E295 D296 L297	S291-L293 PolarHBondContact O-N 2.99Å; S291-L293 VanDerWaalsContact O-N 3.08Å; S291-L293 WeakPolarHBondContact OG-CB 3.28Å; S291-L293 WeakPolarHBondContact OG-CG 3.47Å; S291-L293 PolarHBondContact OG-N 3.17Å; L293-E295 VanDerWaalsContact C-N 3.34Å; L293-D296 PolarHBondContact O-N 3.48Å; L293-L297 WeakPolarHBondContact O-CB 3.46Å; L293-L297 WeakPolarHBondContact O-CG 3.48Å; L293-L297 PolarHBondContact O-N 3.5Å
294	G	88.9	Confident	87.7	Confident	7 Å²	7	48.6 Å²	48.6	7%	0.072	27%	0.269	C	S	.	.	H	α-helix	trans	-57.5	-51.5	173.9	0	0	0	0	0	110.6	S266 S291 V292 D296 L297 F298	S266-G294 CarbonylContact O-C 3.27Å; S266-G294 VanDerWaalsContact O-C 3.28Å; S291-G294 PolarHBondContact O-N 3.03Å; V292-G294 PolarHBondContact O-N 3.34Å; G294-D296 VanDerWaalsContact C-N 3.35Å; G294-D296 PolarHBondContact O-N 3.05Å; G294-L297 PolarHBondContact O-N 3.32Å; G294-F298 VanDerWaalsContact O-CD2 3.27Å; G294-F298 WeakPolarHBondContact O-CD2 3.23Å; G294-F298 PolarHBondContact O-N 3.11Å; G294-F298 VanDerWaalsContact O-N 3.07Å
295	E	90.1	Very high	87.2	Confident	1 Å²	1	50.5 Å²	50.5	1%	0.005	28%	0.283	C	S	.	.	H	α-helix	trans	-64.5	-41.5	-177.1	-162	179	135.6	0	0	111.6	S266 Q267 S268 G269 V292 L293 F298 Q299 R408	S266-E295 VanDerWaalsContact O-CA 3.31Å; S266-E295 WeakPolarHBondContact O-CA 3.5Å; S266-E295 WeakPolarHBondContact O-CB 3.27Å; S266-E295 PolarHBondContact O-N 3.4Å; Q267-E295 HydrophobicContact CB-CB 4.5Å; Q267-E295 HydrophobicContact CB-CG 4.08Å; Q267-E295 HydrophobicContact CG-CB 4.43Å; Q267-E295 HydrophobicContact CG-CG 4.2Å; S268-E295 PolarHBondContact N-OE2 3.25Å; S268-E295 PolarHBondContact OG-OE2 3.43Å; G269-E295 PolarHBondContact N-OE2 3.45Å; V292-E295 PolarHBondContact O-N 3.46Å; L293-E295 VanDerWaalsContact C-N 3.34Å; E295-F298 PolarHBondContact O-N 2.95Å; E295-Q299 WeakPolarHBondContact O-CB 3.39Å; E295-Q299 VanDerWaalsContact O-CG 3.31Å; E295-Q299 WeakPolarHBondContact O-CG 3.39Å; E295-Q299 PolarHBondContact O-N 3.11Å; E295-Q299 PolarHBondContact OE1-NE2 3.11Å; E295-R408 VanDerWaalsContact CD-NH1 3.32Å; E295-R408 WeakPolarHBondContact OE1-CD 3.36Å; E295-R408 IonicContact OE1-CZ 3.95Å; E295-R408 IonicContact OE1-NE 3.17Å; E295-R408 IonicContact OE1-NH1 3.57Å; E295-R408 PolarHBondContact OE1-NH1 3.29Å
296	D	88.9	Confident	86.9	Confident	41 Å²	41	51.3 Å²	51.3	22%	0.219	29%	0.288	C	S	.	.	H	α-helix	trans	-64.9	-42.6	177.5	-73.4	-17	0	0	0	111.4	V292 L293 G294 F298 Q299 F300 R408	V292-D296 PolarHBondContact O-N 2.94Å; L293-D296 PolarHBondContact O-N 3.48Å; G294-D296 VanDerWaalsContact C-N 3.35Å; G294-D296 PolarHBondContact O-N 3.05Å; D296-F298 VanDerWaalsContact C-N 3.34Å; D296-F298 PolarHBondContact O-N 3.05Å; D296-Q299 PolarHBondContact O-N 2.64Å; D296-F300 HydrophobicContact CB-CD2 4.21Å; D296-F300 HydrophobicContact CB-CE2 3.97Å; D296-F300 WeakPolarHBondContact O-CB 3.45Å; D296-F300 WeakPolarHBondContact O-CD2 3.27Å; D296-F300 WeakPolarHBondContact O-CG 3.42Å; D296-F300 PolarHBondContact O-N 3.43Å; D296-R408 IonicContact OD1-CZ 2.83Å; D296-R408 IonicContact OD1-NH1 3.69Å; D296-R408 PolarHBondContact OD1-NH1 3.32Å; D296-R408 IonicContact OD1-NH2 2.71Å; D296-R408 PolarHBondContact OD1-NH2 3.17Å
297	L	86.4	Confident	87.1	Confident	79 Å²	79	48 Å²	48	41%	0.414	27%	0.274	S	S	.	.	H	α-helix	trans	-61.4	-40.4	176.4	-70.4	172.4	0	0	0	112.3	L293 G294 G301 L302 V303	L293-L297 WeakPolarHBondContact O-CB 3.46Å; L293-L297 WeakPolarHBondContact O-CG 3.48Å; L293-L297 PolarHBondContact O-N 3.5Å; G294-L297 PolarHBondContact O-N 3.32Å; L297-G301 PolarHBondContact O-N 3.28Å; L297-L302 HydrophobicContact CD2-CB 4.15Å; L297-L302 HydrophobicContact CD2-CD1 3.76Å; L297-L302 PolarHBondContact O-N 2.99Å; L297-V303 HydrophobicContact CB-CG2 3.83Å
298	F	85.4	Confident	87.4	Confident	50 Å²	50	47.1 Å²	47.1	22%	0.219	27%	0.27	C	S	.	.	H	α-helix	trans	-63.6	-45.9	172.4	-86.1	-73.6	0	0	0	111.7	Q267 G294 E295 D296 F300 G301 V303	Q267-F298 HydrophobicContact CG-CD2 3.9Å; Q267-F298 HydrophobicContact CG-CE2 4.44Å; Q267-F298 HydrophobicContact CG-CG 4.42Å; G294-F298 VanDerWaalsContact O-CD2 3.27Å; G294-F298 WeakPolarHBondContact O-CD2 3.23Å; G294-F298 PolarHBondContact O-N 3.11Å; G294-F298 VanDerWaalsContact O-N 3.07Å; E295-F298 PolarHBondContact O-N 2.95Å; D296-F298 VanDerWaalsContact C-N 3.34Å; D296-F298 PolarHBondContact O-N 3.05Å; F298-F300 VanDerWaalsContact C-N 3.34Å; F298-F300 PolarHBondContact O-N 3.32Å; F298-G301 PolarHBondContact O-N 2.52Å; F298-V303 HydrophobicContact CD1-CB 4.1Å; F298-V303 HydrophobicContact CD1-CG1 4.36Å; F298-V303 HydrophobicContact CE1-CB 4.08Å; F298-V303 HydrophobicContact CE1-CG1 3.82Å; F298-V303 HydrophobicContact CZ-CB 4.45Å; F298-V303 HydrophobicContact CZ-CG1 4Å
299	Q	83.9	Confident	87.5	Confident	49 Å²	49	47 Å²	47	23%	0.229	27%	0.269	C	S	.	.	H	α-helix	trans	-66.9	-33.4	-179.2	-73.9	-175.5	14.3	0	0	113.5	E295 D296 G301 R403 R408	E295-Q299 WeakPolarHBondContact O-CB 3.39Å; E295-Q299 VanDerWaalsContact O-CG 3.31Å; E295-Q299 WeakPolarHBondContact O-CG 3.39Å; E295-Q299 PolarHBondContact O-N 3.11Å; E295-Q299 PolarHBondContact OE1-NE2 3.11Å; D296-Q299 PolarHBondContact O-N 2.64Å; Q299-G301 PolarHBondContact O-N 3.44Å; Q299-R403 PolarHBondContact OE1-O 3.34Å; Q299-R408 VanDerWaalsContact NE2-CZ 3.27Å
300	F	81.3	Confident	87.4	Confident	153 Å²	153	47.5 Å²	47.5	67%	0.671	27%	0.27	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.5	-7.9	173.6	-70	-55.8	0	0	0	113.2	D296 F298 L302	D296-F300 HydrophobicContact CB-CD2 4.21Å; D296-F300 HydrophobicContact CB-CE2 3.97Å; D296-F300 WeakPolarHBondContact O-CB 3.45Å; D296-F300 WeakPolarHBondContact O-CD2 3.27Å; D296-F300 WeakPolarHBondContact O-CG 3.42Å; D296-F300 PolarHBondContact O-N 3.43Å; F298-F300 VanDerWaalsContact C-N 3.34Å; F298-F300 PolarHBondContact O-N 3.32Å; F300-L302 HydrophobicContact CB-CD1 4.02Å; F300-L302 HydrophobicContact CB-CG 3.88Å; F300-L302 PolarHBondContact O-N 3.11Å
301	G	79.1	Confident	87.4	Confident	57 Å²	57	47.2 Å²	47.2	59%	0.588	27%	0.268	S	S	*	.	T	Hydrogen-bonded Turn	trans	68.5	25	-176.8	0	0	0	0	0	113.1	L297 F298 Q299	L297-G301 PolarHBondContact O-N 3.28Å; F298-G301 PolarHBondContact O-N 2.52Å; Q299-G301 PolarHBondContact O-N 3.44Å
302	L	75.8	Confident	87.4	Confident	120 Å²	120	46 Å²	46	63%	0.628	26%	0.26	S	S	*	.			trans	-84.2	-22.9	178.4	-65.6	176.5	0	0	0	112.1	L297 F300 P304	L297-L302 HydrophobicContact CD2-CB 4.15Å; L297-L302 HydrophobicContact CD2-CD1 3.76Å; L297-L302 PolarHBondContact O-N 2.99Å; F300-L302 HydrophobicContact CB-CD1 4.02Å; F300-L302 HydrophobicContact CB-CG 3.88Å; F300-L302 PolarHBondContact O-N 3.11Å; L302-P304 WeakPolarHBondContact O-CD 3.48Å
303	V	80.1	Confident	87.5	Confident	45 Å²	45	45.7 Å²	45.7	27%	0.273	26%	0.256	S	S	.	.	S	Bend	trans	-88.4	115.2	167.5	-173.8	0	0	0	0	107.6	L297 F298 S305	L297-V303 HydrophobicContact CB-CG2 3.83Å; F298-V303 HydrophobicContact CD1-CB 4.1Å; F298-V303 HydrophobicContact CD1-CG1 4.36Å; F298-V303 HydrophobicContact CE1-CB 4.08Å; F298-V303 HydrophobicContact CE1-CG1 3.82Å; F298-V303 HydrophobicContact CZ-CB 4.45Å; F298-V303 HydrophobicContact CZ-CG1 4Å; V303-S305 PolarHBondContact O-N 3.13Å
304	P	79.5	Confident	87.4	Confident	129 Å²	129	40.4 Å²	40.4	84%	0.838	23%	0.228	S	C	*	.			trans	-79.6	47.6	178.2	35.9	-37.1	0	0	0	111	L302	L302-P304 WeakPolarHBondContact O-CD 3.48Å
305	S	83.9	Confident	87.5	Confident	41 Å²	41	41.5 Å²	41.5	29%	0.287	23%	0.23	S	C	.	.			trans	-139.2	157.9	179.5	-175	0	0	0	0	109.7	V303	V303-S305 PolarHBondContact O-N 3.13Å
306	D	87.4	Confident	87.6	Confident	24 Å²	24	41.7 Å²	41.7	13%	0.128	23%	0.233	C	C	.	.			trans	-136.7	151.6	177.1	-160.9	14.7	0	0	0	106.8	L146 L232 R310	L146-D306 HydrophobicContact CD1-CB 3.86Å; L146-D306 HydrophobicContact CD2-CB 3.9Å; L146-D306 HydrophobicContact CG-CB 3.73Å; L232-D306 HydrophobicContact CD1-CB 4Å; L232-D306 WeakPolarHBondContact CD1-OD2 3.5Å; D306-R310 VanDerWaalsContact OD1-CB 3.27Å; D306-R310 WeakPolarHBondContact OD1-CB 3.43Å; D306-R310 VanDerWaalsContact OD1-CD 3.23Å; D306-R310 WeakPolarHBondContact OD1-CD 3.49Å; D306-R310 IonicContact OD1-NE 3.83Å; D306-R310 PolarHBondContact OD1-NE 2.79Å; D306-R310 IonicContact OD2-CZ 2.8Å; D306-R310 IonicContact OD2-NE 3.15Å; D306-R310 PolarHBondContact OD2-NE 2.95Å; D306-R310 IonicContact OD2-NH2 3.61Å; D306-R310 PolarHBondContact OD2-NH2 2.93Å
307	T	93.2	Very high	87.9	Confident	10 Å²	10	41.6 Å²	41.6	6%	0.061	23%	0.232	C	C	.	.			trans	-135.3	164.8	-177	62.5	0	0	0	0	110	E255 Y309 R310 D322	E255-T307 HydrophobicContact CG-CG2 4.03Å; T307-Y309 PolarHBondContact O-N 3.37Å; T307-Y309 WeakPolarHBondContact OG1-CB 3.4Å; T307-R310 PolarHBondContact O-N 2.95Å; T307-D322 PolarHBondContact OG1-OD2 3.11Å; T307-D322 VanDerWaalsContact OG1-OD2 3.05Å
308	D	95.6	Very high	88.2	Confident	0 Å²	0	37.8 Å²	37.8	0%	0	21%	0.212	C	C	.	.	H	α-helix	trans	-55	-25.9	175.8	-78.8	-17.6	0	0	0	113.2	N225 S235 N253 R310 I311 F312	N225-D308 PolarHBondContact ND2-OD2 3.19Å; S235-D308 WeakPolarHBondContact CB-OD1 3.48Å; S235-D308 WeakPolarHBondContact CB-OD2 3.12Å; S235-D308 VanDerWaalsContact OG-CG 3.26Å; S235-D308 PolarHBondContact OG-OD1 2.75Å; N253-D308 WeakPolarHBondContact OD1-CB 3.05Å; D308-R310 VanDerWaalsContact C-N 3.25Å; D308-R310 PolarHBondContact O-N 2.74Å; D308-I311 WeakPolarHBondContact O-CA 3.31Å; D308-I311 WeakPolarHBondContact O-CB 3.08Å; D308-I311 PolarHBondContact O-N 2.75Å; D308-F312 HydrophobicContact CB-CD2 4.4Å; D308-F312 HydrophobicContact CB-CE2 3.82Å; D308-F312 HydrophobicContact CB-CZ 4.42Å; D308-F312 WeakPolarHBondContact O-CD2 3.24Å; D308-F312 PolarHBondContact O-N 3.42Å
309	Y	95.1	Very high	88.6	Confident	1 Å²	1	35.5 Å²	35.5	0%	0.004	20%	0.202	C	C	.	.	H	α-helix	trans	-50.1	-44.4	170.6	165.1	-91.8	0	0	0	112.6	F251 N253 Q267 G269 T307 I311 F312 R313 G320 D322	F251-Y309 AromaticContact CE2-CD2 3.56Å; F251-Y309 HydrophobicContact CE2-CD2 3.56Å; F251-Y309 HydrophobicContact CE2-CE2 4.43Å; F251-Y309 HydrophobicContact CE2-CG 4.23Å; F251-Y309 AromaticContact CZ-CD2 3.37Å; F251-Y309 HydrophobicContact CZ-CD2 3.37Å; F251-Y309 AromaticContact CZ-CE2 3.94Å; F251-Y309 HydrophobicContact CZ-CE2 3.94Å; F251-Y309 HydrophobicContact CZ-CG 4.07Å; N253-Y309 PolarHBondContact ND2-N 3.19Å; Q267-Y309 HydrophobicContact CB-CD1 4.26Å; Q267-Y309 HydrophobicContact CB-CD2 4.46Å; Q267-Y309 HydrophobicContact CB-CE1 3.79Å; Q267-Y309 HydrophobicContact CB-CE2 4.08Å; Q267-Y309 VanDerWaalsContact CD-CE1 3.42Å; Q267-Y309 HydrophobicContact CG-CD1 4.46Å; Q267-Y309 HydrophobicContact CG-CE1 4.2Å; G269-Y309 WeakPolarHBondContact CA-OH 3.45Å; G269-Y309 PolarHBondContact N-OH 3.12Å; G269-Y309 VanDerWaalsContact N-OH 3.12Å; T307-Y309 PolarHBondContact O-N 3.37Å; T307-Y309 WeakPolarHBondContact OG1-CB 3.4Å; Y309-I311 VanDerWaalsContact C-N 3.27Å; Y309-I311 PolarHBondContact O-N 3.21Å; Y309-F312 PolarHBondContact O-N 3.35Å; Y309-R313 VanDerWaalsContact O-CB 3.29Å; Y309-R313 WeakPolarHBondContact O-CB 3.36Å; Y309-R313 PolarHBondContact O-N 3.14Å; Y309-G320 WeakPolarHBondContact CE2-O 3.37Å; Y309-D322 HydrophobicContact CD1-CB 4.49Å; Y309-D322 HydrophobicContact CD2-CB 3.76Å; Y309-D322 HydrophobicContact CG-CB 3.77Å
310	R	91.4	Very high	89.2	Confident	27 Å²	27	33.2 Å²	33.2	10%	0.102	19%	0.192	C	C	.	.	H	α-helix	trans	-64.3	-37.8	178.2	-174.1	-175.5	64.9	85.4	5.2	110.7	R144 A145 D306 T307 D308 R313 D314	R144-R310 PolarHBondContact O-NH2 3.07Å; A145-R310 VanDerWaalsContact CA-NH2 3.31Å; D306-R310 VanDerWaalsContact OD1-CB 3.27Å; D306-R310 WeakPolarHBondContact OD1-CB 3.43Å; D306-R310 VanDerWaalsContact OD1-CD 3.23Å; D306-R310 WeakPolarHBondContact OD1-CD 3.49Å; D306-R310 IonicContact OD1-NE 3.83Å; D306-R310 PolarHBondContact OD1-NE 2.79Å; D306-R310 IonicContact OD2-CZ 2.8Å; D306-R310 IonicContact OD2-NE 3.15Å; D306-R310 PolarHBondContact OD2-NE 2.95Å; D306-R310 IonicContact OD2-NH2 3.61Å; D306-R310 PolarHBondContact OD2-NH2 2.93Å; T307-R310 PolarHBondContact O-N 2.95Å; D308-R310 VanDerWaalsContact C-N 3.25Å; D308-R310 PolarHBondContact O-N 2.74Å; R310-R313 PolarHBondContact O-N 2.97Å; R310-D314 HydrophobicContact CG-CB 4.43Å; R310-D314 VanDerWaalsContact CG-OD2 3.27Å; R310-D314 WeakPolarHBondContact CG-OD2 3.44Å; R310-D314 VanDerWaalsContact O-CB 3.24Å; R310-D314 WeakPolarHBondContact O-CB 3.45Å; R310-D314 PolarHBondContact O-N 3.07Å
311	I	93.4	Very high	90	Very high	0 Å²	0	25.9 Å²	25.9	0%	0	16%	0.16	C	C	.	.	H	α-helix	trans	-65.2	-47.8	-178.1	-59.7	-57.3	0	0	0	111.2	F143 L232 H236 I239 D308 Y309 R313 Y315 G316	F143-I311 HydrophobicContact CD2-CD1 4.14Å; F143-I311 HydrophobicContact CE2-CD1 3.6Å; L232-I311 HydrophobicContact CB-CD1 4.06Å; L232-I311 HydrophobicContact CB-CG1 3.68Å; L232-I311 HydrophobicContact CD1-CD1 3.94Å; L232-I311 HydrophobicContact CD1-CG1 3.75Å; L232-I311 HydrophobicContact CG-CG1 4.35Å; H236-I311 HydrophobicContact CB-CG2 3.77Å; I239-I311 HydrophobicContact CG2-CG2 3.92Å; D308-I311 WeakPolarHBondContact O-CA 3.31Å; D308-I311 WeakPolarHBondContact O-CB 3.08Å; D308-I311 PolarHBondContact O-N 2.75Å; Y309-I311 VanDerWaalsContact C-N 3.27Å; Y309-I311 PolarHBondContact O-N 3.21Å; I311-R313 VanDerWaalsContact C-N 3.33Å; I311-R313 PolarHBondContact O-N 3.02Å; I311-Y315 HydrophobicContact CD1-CD2 4Å; I311-Y315 HydrophobicContact CD1-CE2 3.84Å; I311-Y315 HydrophobicContact CG2-CD2 4.2Å; I311-Y315 WeakPolarHBondContact O-CB 3.3Å; I311-Y315 PolarHBondContact O-N 2.94Å; I311-G316 PolarHBondContact O-N 3.33Å
312	F	95.1	Very high	90.8	Very high	0 Å²	0	23.2 Å²	23.2	0%	0	13%	0.132	C	C	.	.	H	α-helix	trans	-64	-39.3	176.3	-59.7	-49.5	0	0	0	112.3	L178 S180 L223 F238 I239 F251 D308 Y309 G316 L317 V318	L178-F312 HydrophobicContact CD2-CD1 4Å; L178-F312 HydrophobicContact CD2-CD2 4.38Å; L178-F312 HydrophobicContact CD2-CE1 3.75Å; L178-F312 HydrophobicContact CD2-CE2 4.14Å; L178-F312 HydrophobicContact CD2-CG 4.33Å; L178-F312 HydrophobicContact CD2-CZ 3.84Å; S180-F312 WeakPolarHBondContact OG-CE2 3.02Å; S180-F312 WeakPolarHBondContact OG-CZ 3.35Å; L223-F312 HydrophobicContact CD2-CE1 4.21Å; L223-F312 HydrophobicContact CD2-CZ 3.82Å; F238-F312 HydrophobicContact CD1-CE1 4.45Å; I239-F312 HydrophobicContact CB-CD1 3.89Å; I239-F312 HydrophobicContact CB-CE1 4.19Å; I239-F312 HydrophobicContact CD1-CD1 3.92Å; I239-F312 HydrophobicContact CG1-CD1 3.92Å; I239-F312 HydrophobicContact CG2-CD1 4.49Å; F251-F312 HydrophobicContact CD1-CB 3.64Å; F251-F312 HydrophobicContact CD1-CG 4.34Å; F251-F312 HydrophobicContact CD2-CB 4.34Å; F251-F312 AromaticContact CD2-CD2 3.81Å; F251-F312 HydrophobicContact CD2-CD2 3.81Å; F251-F312 HydrophobicContact CD2-CG 4.41Å; F251-F312 HydrophobicContact CE1-CB 3.31Å; F251-F312 HydrophobicContact CE1-CG 4.32Å; F251-F312 HydrophobicContact CE2-CB 4.09Å; F251-F312 AromaticContact CE2-CD2 3.82Å; F251-F312 HydrophobicContact CE2-CD2 3.82Å; F251-F312 HydrophobicContact CE2-CG 4.42Å; F251-F312 HydrophobicContact CG-CB 4.15Å; F251-F312 HydrophobicContact CG-CD2 4.19Å; F251-F312 HydrophobicContact CG-CG 4.39Å; F251-F312 HydrophobicContact CZ-CB 3.58Å; F251-F312 HydrophobicContact CZ-CD2 4.19Å; F251-F312 HydrophobicContact CZ-CG 4.38Å; D308-F312 HydrophobicContact CB-CD2 4.4Å; D308-F312 HydrophobicContact CB-CE2 3.82Å; D308-F312 HydrophobicContact CB-CZ 4.42Å; D308-F312 WeakPolarHBondContact O-CD2 3.24Å; D308-F312 PolarHBondContact O-N 3.42Å; Y309-F312 PolarHBondContact O-N 3.35Å; F312-G316 CarbonylContact O-C 3.53Å; F312-G316 WeakPolarHBondContact O-CA 3.26Å; F312-G316 PolarHBondContact O-N 3.02Å; F312-G316 VanDerWaalsContact O-N 3.17Å; F312-L317 PolarHBondContact O-N 3.28Å; F312-V318 PolarHBondContact O-N 2.9Å; F312-V318 VanDerWaalsContact O-N 3.08Å
313	R	92.6	Very high	91.9	Very high	13 Å²	13	17.5 Å²	17.5	5%	0.049	10%	0.102	C	C	.	.	H	α-helix	trans	-67.5	-50.2	177.5	-170.1	-168	69.5	-151.7	-8.4	112.7	Y309 R310 I311 L317 V318 L373	Y309-R313 VanDerWaalsContact O-CB 3.29Å; Y309-R313 WeakPolarHBondContact O-CB 3.36Å; Y309-R313 PolarHBondContact O-N 3.14Å; R310-R313 PolarHBondContact O-N 2.97Å; I311-R313 VanDerWaalsContact C-N 3.33Å; I311-R313 PolarHBondContact O-N 3.02Å; R313-L317 WeakPolarHBondContact O-CA 3.22Å; R313-L317 PolarHBondContact O-N 2.69Å; R313-V318 WeakPolarHBondContact CA-O 3.19Å; R313-L373 HydrophobicContact CG-CD1 3.6Å
314	D	89.1	Confident	92.6	Very high	2 Å²	2	15.9 Å²	15.9	1%	0.011	9%	0.093	C	C	.	.	H	α-helix	trans	-87.5	-40.8	-168.3	-69.6	1.6	0	0	0	112	R310 P398 P399 R403	R310-D314 HydrophobicContact CG-CB 4.43Å; R310-D314 VanDerWaalsContact CG-OD2 3.27Å; R310-D314 WeakPolarHBondContact CG-OD2 3.44Å; R310-D314 VanDerWaalsContact O-CB 3.24Å; R310-D314 WeakPolarHBondContact O-CB 3.45Å; R310-D314 PolarHBondContact O-N 3.07Å; D314-P398 HydrophobicContact CB-CB 3.78Å; D314-P399 VanDerWaalsContact O-CD 3.26Å; D314-P399 WeakPolarHBondContact O-CD 3.46Å; D314-P399 VanDerWaalsContact O-CG 3.23Å; D314-P399 WeakPolarHBondContact O-CG 3.19Å; D314-R403 IonicContact OD2-NH2 3.26Å; D314-R403 PolarHBondContact OD2-NH2 2.58Å; D314-R403 VanDerWaalsContact OD2-NH2 3.15Å
315	Y	90.6	Very high	93.3	Very high	29 Å²	29	9.8 Å²	9.8	11%	0.114	5%	0.054	C	C	.	.	T	Hydrogen-bonded Turn	trans	-94.3	-32.2	179.2	-64	-87.4	0	0	0	112.9	F143 R144 H236 I311 N395 P398	F143-Y315 HydrophobicContact CB-CE1 4.21Å; F143-Y315 HydrophobicContact CD2-CE2 4.02Å; F143-Y315 AromaticContact CD2-CZ 3.98Å; R144-Y315 PolarHBondContact N-OH 2.93Å; R144-Y315 PolarHBondContact O-OH 3.39Å; H236-Y315 AromaticContact CD2-CD1 3.84Å; H236-Y315 AromaticContact CD2-CD2 3.76Å; H236-Y315 AromaticContact CD2-CE1 3.99Å; H236-Y315 AromaticContact CD2-CE2 3.9Å; H236-Y315 AromaticContact CD2-CG 3.71Å; H236-Y315 AromaticContact NE2-CD1 3.52Å; H236-Y315 AromaticContact NE2-CE1 3.64Å; H236-Y315 AromaticContact NE2-CG 3.88Å; I311-Y315 HydrophobicContact CD1-CD2 4Å; I311-Y315 HydrophobicContact CD1-CE2 3.84Å; I311-Y315 HydrophobicContact CG2-CD2 4.2Å; I311-Y315 WeakPolarHBondContact O-CB 3.3Å; I311-Y315 PolarHBondContact O-N 2.94Å; Y315-N395 VanDerWaalsContact CE1-O 3.31Å; Y315-N395 WeakPolarHBondContact CE1-O 3.46Å; Y315-P398 HydrophobicContact CD1-CB 4.36Å; Y315-P398 HydrophobicContact CD2-CB 4.35Å; Y315-P398 HydrophobicContact CE1-CB 3.9Å; Y315-P398 HydrophobicContact CE1-CG 4.46Å; Y315-P398 HydrophobicContact CE2-CB 3.92Å; Y315-P398 HydrophobicContact CE2-CG 4.25Å; Y315-P398 VanDerWaalsContact OH-CD 3.29Å; Y315-P398 WeakPolarHBondContact OH-CD 3.27Å
316	G	92.8	Very high	93.6	Very high	6 Å²	6	11.4 Å²	11.4	6%	0.062	6%	0.058	C	C	.	.	S	Bend	trans	-84.9	-18.6	176	0	0	0	0	0	114.7	I239 I311 F312 V318 K372	I239-G316 VanDerWaalsContact CG1-CA 3.41Å; I311-G316 PolarHBondContact O-N 3.33Å; F312-G316 CarbonylContact O-C 3.53Å; F312-G316 WeakPolarHBondContact O-CA 3.26Å; F312-G316 PolarHBondContact O-N 3.02Å; F312-G316 VanDerWaalsContact O-N 3.17Å; G316-V318 VanDerWaalsContact O-CG2 3.31Å; G316-V318 WeakPolarHBondContact O-CG2 3.34Å; G316-V318 PolarHBondContact O-N 3.41Å; G316-K372 PolarHBondContact O-NZ 3.12Å
317	L	93.2	Very high	93.6	Very high	38 Å²	38	12.1 Å²	12.1	20%	0.199	6%	0.061	C	C	.	.			trans	53.1	37	-168.5	-59.5	177.2	0	0	0	111.9	F312 R313 K372 L373 P375 P399 V401	F312-L317 PolarHBondContact O-N 3.28Å; R313-L317 WeakPolarHBondContact O-CA 3.22Å; R313-L317 PolarHBondContact O-N 2.69Å; L317-K372 HydrophobicContact CB-CB 4.28Å; L317-K372 CarbonylContact O-C 3.41Å; L317-K372 VanDerWaalsContact O-CA 3.27Å; L317-K372 WeakPolarHBondContact O-CA 3.41Å; L317-K372 VanDerWaalsContact O-CB 3.23Å; L317-K372 WeakPolarHBondContact O-CB 3.46Å; L317-L373 HydrophobicContact CB-CB 4.37Å; L317-L373 PolarHBondContact O-N 3.34Å; L317-P375 HydrophobicContact CD1-CG 4.41Å; L317-P375 HydrophobicContact CD2-CB 4.47Å; L317-P399 HydrophobicContact CD2-CG 3.97Å; L317-V401 HydrophobicContact CD2-CG2 3.7Å
318	V	94.4	Very high	93.3	Very high	0 Å²	0	13.1 Å²	13.1	0%	0	7%	0.066	C	C	.	.			trans	-104.1	132.2	-177.1	-168.3	0	0	0	0	109.3	I239 I248 V249 F251 F312 R313 G316	I239-V318 HydrophobicContact CD1-CG2 4.31Å; I248-V318 HydrophobicContact CG2-CG1 3.98Å; I248-V318 HydrophobicContact CG2-CG2 4.37Å; V249-V318 VanDerWaalsContact C-CG1 3.5Å; F251-V318 HydrophobicContact CD1-CB 3.89Å; F251-V318 HydrophobicContact CD1-CG1 3.71Å; F251-V318 HydrophobicContact CE1-CB 4.21Å; F251-V318 HydrophobicContact CE1-CG1 4.43Å; F251-V318 VanDerWaalsContact CE1-O 3.29Å; F251-V318 WeakPolarHBondContact CE1-O 3.13Å; F312-V318 PolarHBondContact O-N 2.9Å; F312-V318 VanDerWaalsContact O-N 3.08Å; R313-V318 WeakPolarHBondContact CA-O 3.19Å; G316-V318 VanDerWaalsContact O-CG2 3.31Å; G316-V318 WeakPolarHBondContact O-CG2 3.34Å; G316-V318 PolarHBondContact O-N 3.41Å
319	P	94.2	Very high	92.9	Very high	1 Å²	1	13.7 Å²	13.7	1%	0.006	7%	0.072	C	C	.	.			trans	-72.1	150.6	167.3	29.4	-33.1	0	0	0	111	V249 A250 F251 L373	V249-P319 VanDerWaalsContact O-CD 3.32Å; V249-P319 WeakPolarHBondContact O-CD 3.29Å; V249-P319 WeakPolarHBondContact O-CG 3.32Å; A250-P319 VanDerWaalsContact CA-O 3.23Å; A250-P319 WeakPolarHBondContact CA-O 3.42Å; F251-P319 VanDerWaalsContact CD1-O 3.32Å; F251-P319 WeakPolarHBondContact CD1-O 3.46Å; F251-P319 PolarHBondContact N-O 3.24Å; F251-P319 VanDerWaalsContact N-O 3.1Å; P319-L373 HydrophobicContact CB-CD2 4.05Å; P319-L373 HydrophobicContact CB-CG 4.38Å
320	G	95.8	Very high	92.5	Very high	1 Å²	1	18.8 Å²	18.8	1%	0.01	9%	0.092	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-171.1	176.4	179.4	0	0	0	0	0	114.9	F251 S268 Y309	F251-G320 CarbonylContact O-C 3.58Å; F251-G320 WeakPolarHBondContact O-CA 3.07Å; S268-G320 CarbonylContact C-O 3.58Å; Y309-G320 WeakPolarHBondContact CE2-O 3.37Å
321	L	97.4	Very high	92.5	Very high	0 Å²	0	17.5 Å²	17.5	0%	0	9%	0.087	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	146.3	174.7	-55.8	-176.2	0	0	0	110.1	F251 M252 N253 L265 Q267 L277 Y281 L323 F357	F251-L321 PolarHBondContact O-N 2.92Å; M252-L321 CarbonylContact C-O 3.3Å; M252-L321 WeakPolarHBondContact CA-O 3.31Å; M252-L321 HydrophobicContact CE-CD1 4.07Å; N253-L321 PolarHBondContact N-O 3.41Å; L265-L321 HydrophobicContact CD1-CB 3.83Å; L265-L321 HydrophobicContact CD1-CD1 4.42Å; L265-L321 HydrophobicContact CD1-CD2 4.17Å; L265-L321 HydrophobicContact CD1-CG 4.35Å; Q267-L321 CarbonylContact O-C 3.51Å; Q267-L321 WeakPolarHBondContact O-CA 3.21Å; L277-L321 HydrophobicContact CB-CD1 4.18Å; L277-L321 HydrophobicContact CB-CD2 3.9Å; L277-L321 HydrophobicContact CB-CG 4.02Å; L277-L321 HydrophobicContact CD1-CD2 4.49Å; L277-L321 HydrophobicContact CD1-CG 4.35Å; Y281-L321 HydrophobicContact CD2-CD1 4.44Å; L321-L323 HydrophobicContact CB-CD1 3.75Å; L321-F357 HydrophobicContact CD1-CE2 3.99Å; L321-F357 HydrophobicContact CD1-CZ 3.87Å
322	D	96.9	Very high	92.4	Very high	1 Å²	1	20.8 Å²	20.8	1%	0.005	10%	0.1	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	119.5	174.2	-162.9	34.4	0	0	0	109.2	N253 S266 Q267 T307 Y309	N253-D322 WeakPolarHBondContact CB-OD1 3.46Å; N253-D322 PolarHBondContact ND2-OD1 3.21Å; S266-D322 PolarHBondContact N-O 2.9Å; S266-D322 PolarHBondContact OG-O 3.21Å; S266-D322 PolarHBondContact OG-OD2 2.97Å; Q267-D322 HydrophobicContact CB-CB 3.76Å; Q267-D322 HydrophobicContact CG-CB 4.15Å; Q267-D322 PolarHBondContact N-O 2.94Å; Q267-D322 PolarHBondContact NE2-OD2 2.74Å; Q267-D322 PolarHBondContact O-N 3.33Å; T307-D322 PolarHBondContact OG1-OD2 3.11Å; T307-D322 VanDerWaalsContact OG1-OD2 3.05Å; Y309-D322 HydrophobicContact CD1-CB 4.49Å; Y309-D322 HydrophobicContact CD2-CB 3.76Å; Y309-D322 HydrophobicContact CG-CB 3.77Å
323	L	97.7	Very high	92.4	Very high	0 Å²	0	24.2 Å²	24.2	0%	0	12%	0.115	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	130.7	-176.2	-67.7	82	0	0	0	109.8	M252 N253 L254 E255 L263 F264 L265 Y281 F285 L321	M252-L323 HydrophobicContact CE-CD1 3.84Å; M252-L323 HydrophobicContact CE-CD2 4.38Å; M252-L323 HydrophobicContact CG-CD1 3.84Å; M252-L323 HydrophobicContact SD-CD1 4.24Å; N253-L323 PolarHBondContact O-N 3.33Å; L254-L323 WeakPolarHBondContact CA-O 3.45Å; L254-L323 HydrophobicContact CD2-CB 4.17Å; E255-L323 PolarHBondContact N-O 2.86Å; L263-L323 HydrophobicContact CB-CB 4.43Å; L263-L323 HydrophobicContact CB-CD2 4.34Å; F264-L323 CarbonylContact O-C 3.54Å; F264-L323 VanDerWaalsContact O-CA 3.29Å; F264-L323 WeakPolarHBondContact O-CA 3.4Å; L265-L323 HydrophobicContact CB-CG 4.4Å; L265-L323 HydrophobicContact CD1-CD1 3.88Å; L265-L323 HydrophobicContact CD1-CG 4.04Å; Y281-L323 HydrophobicContact CD2-CD2 4.42Å; Y281-L323 HydrophobicContact CE2-CD2 3.84Å; F285-L323 HydrophobicContact CE1-CD2 3.64Å; F285-L323 HydrophobicContact CE2-CD2 4.49Å; F285-L323 HydrophobicContact CZ-CD2 3.45Å; F285-L323 VanDerWaalsContact CZ-CD2 3.45Å; L321-L323 HydrophobicContact CB-CD1 3.75Å
324	A	95.6	Very high	92.5	Very high	10 Å²	10	25.1 Å²	25.1	8%	0.083	12%	0.123	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.2	146.4	-179.4	0	0	0	0	0	112.5	E255 F264 I326	E255-A324 HydrophobicContact CB-CB 3.89Å; E255-A324 VanDerWaalsContact O-CA 3.31Å; E255-A324 WeakPolarHBondContact O-CA 3.5Å; F264-A324 PolarHBondContact N-O 2.82Å; F264-A324 PolarHBondContact O-N 2.74Å; A324-I326 HydrophobicContact CB-CG2 4.09Å; A324-I326 PolarHBondContact O-N 2.68Å
325	Y	94.2	Very high	92.8	Very high	2 Å²	2	29.1 Å²	29.1	1%	0.008	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.1	122.6	159.3	-70.8	-79.6	0	0	0	108.7	V197 N198 E255 A257 G258 K261 L263 S350	V197-Y325 HydrophobicContact CG1-CD2 3.96Å; V197-Y325 HydrophobicContact CG1-CE2 3.51Å; V197-Y325 HydrophobicContact CG2-CE2 4.39Å; N198-Y325 WeakPolarHBondContact OD1-CE2 3.12Å; E255-Y325 PolarHBondContact O-N 2.68Å; A257-Y325 CarbonylContact C-O 3.45Å; A257-Y325 VanDerWaalsContact C-O 3.27Å; A257-Y325 VanDerWaalsContact CA-O 3.3Å; A257-Y325 WeakPolarHBondContact CA-O 3.39Å; A257-Y325 PolarHBondContact N-O 3.14Å; G258-Y325 PolarHBondContact N-O 2.72Å; G258-Y325 WeakPolarHBondContact O-CB 3.05Å; K261-Y325 WeakPolarHBondContact O-CE1 3.48Å; L263-Y325 HydrophobicContact CD2-CD1 4.25Å; L263-Y325 HydrophobicContact CD2-CD2 3.52Å; L263-Y325 HydrophobicContact CD2-CE1 4.24Å; L263-Y325 HydrophobicContact CD2-CE2 3.48Å; L263-Y325 VanDerWaalsContact CD2-CE2 3.48Å; L263-Y325 HydrophobicContact CD2-CG 3.91Å; L263-Y325 HydrophobicContact CG-CD2 4.43Å; L263-Y325 HydrophobicContact CG-CE1 4.19Å; L263-Y325 HydrophobicContact CG-CE2 4.03Å; Y325-S350 VanDerWaalsContact OH-CB 3.26Å; Y325-S350 WeakPolarHBondContact OH-CB 3.43Å; Y325-S350 PolarHBondContact OH-OG 2.66Å
326	I	90.4	Very high	93	Very high	75 Å²	75	33.7 Å²	33.7	39%	0.385	17%	0.167	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.3	-4.6	-175.4	63.3	164.1	0	0	0	113.8	F264 A324	F264-I326 HydrophobicContact CB-CD1 3.76Å; F264-I326 HydrophobicContact CB-CG1 3.83Å; F264-I326 HydrophobicContact CB-CG2 4.09Å; F264-I326 HydrophobicContact CD1-CD1 3.88Å; F264-I326 HydrophobicContact CD1-CG2 4Å; F264-I326 HydrophobicContact CD2-CD1 4.17Å; F264-I326 HydrophobicContact CG-CD1 3.68Å; F264-I326 HydrophobicContact CG-CG1 4.3Å; F264-I326 HydrophobicContact CG-CG2 4.42Å; A324-I326 HydrophobicContact CB-CG2 4.09Å; A324-I326 PolarHBondContact O-N 2.68Å
327	Q	87.1	Confident	93.2	Very high	38 Å²	38	33.4 Å²	33.4	18%	0.178	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.3	145.7	-174.2	-173	50.6	61.6	0	0	110.4	G258 A259 A260 K261 H494	G258-Q327 CarbonylContact C-O 3.18Å; G258-Q327 VanDerWaalsContact C-O 3.25Å; G258-Q327 WeakPolarHBondContact CA-O 3.43Å; A259-Q327 PolarHBondContact N-O 3.31Å; A260-Q327 HydrophobicContact CB-CB 4.26Å; A260-Q327 HydrophobicContact CB-CG 4.16Å; A260-Q327 PolarHBondContact N-O 3.09Å; K261-Q327 HydrophobicContact CB-CB 4.15Å; K261-Q327 HydrophobicContact CB-CG 4.2Å; K261-Q327 HydrophobicContact CD-CG 3.72Å; K261-Q327 HydrophobicContact CG-CB 4.23Å; K261-Q327 HydrophobicContact CG-CG 3.75Å; Q327-H494 VanDerWaalsContact CD-CE1 3.47Å; Q327-H494 PolarHBondContact NE2-CE1 2.73Å; Q327-H494 PolarHBondContact NE2-NE2 2.92Å; Q327-H494 PolarHBondContact OE1-CE1 3.49Å
328	D	86.1	Confident	93.3	Very high	31 Å²	31	33.9 Å²	33.9	17%	0.166	17%	0.168	C	C	.	.	S	Bend	trans	61	44.1	-169.2	-169.6	25.1	0	0	0	111.6	A260 Y330 V331 R341	A260-D328 HydrophobicContact CB-CB 3.84Å; D328-Y330 PolarHBondContact O-N 2.95Å; D328-V331 WeakPolarHBondContact O-CG2 3.07Å; D328-V331 PolarHBondContact O-N 3.19Å; D328-R341 IonicContact OD1-NH1 2.88Å; D328-R341 PolarHBondContact OD1-NH1 3.21Å; D328-R341 IonicContact OD2-CZ 3.23Å; D328-R341 IonicContact OD2-NH1 2.76Å; D328-R341 PolarHBondContact OD2-NH1 2.86Å
329	G	87.6	Confident	93.4	Very high	12 Å²	12	35.9 Å²	35.9	12%	0.124	18%	0.178	C	C	.	.	G	3₁₀ helix	trans	-62.9	-6.2	178.8	0	0	0	0	0	114.4	A257 V331 Y332	A257-G329 WeakPolarHBondContact O-CA 3.03Å; G329-V331 PolarHBondContact O-N 2.9Å; G329-Y332 WeakPolarHBondContact O-CB 3.41Å; G329-Y332 PolarHBondContact O-N 2.59Å
330	Y	87.1	Confident	93.5	Very high	109 Å²	109	39.8 Å²	39.8	43%	0.427	21%	0.205	S	C	.	.	G	3₁₀ helix	trans	-61.6	-27.8	175.7	174.7	-99.5	0	0	0	112.2	D328 Y336	D328-Y330 PolarHBondContact O-N 2.95Å; Y330-Y336 HydrophobicContact CE1-CD2 4.23Å; Y330-Y336 HydrophobicContact CE1-CE2 4.49Å
331	V	90.5	Very high	93.3	Very high	0 Å²	0	44.4 Å²	44.4	0%	0	22%	0.222	C	C	.	.	G	3₁₀ helix	trans	-91.3	-13.8	-176.9	-49.4	0	0	0	0	113.7	A259 D328 G329 H333 T334 D337	A259-V331 HydrophobicContact CB-CG2 3.44Å; A259-V331 VanDerWaalsContact CB-CG2 3.44Å; D328-V331 WeakPolarHBondContact O-CG2 3.07Å; D328-V331 PolarHBondContact O-N 3.19Å; G329-V331 PolarHBondContact O-N 2.9Å; V331-H333 PolarHBondContact O-N 2.94Å; V331-T334 VanDerWaalsContact C-OG1 3.28Å; V331-T334 WeakPolarHBondContact CA-OG1 3.38Å; V331-T334 WeakPolarHBondContact O-CB 3.44Å; V331-T334 PolarHBondContact O-N 3.37Å; V331-T334 PolarHBondContact O-OG1 2.89Å; V331-D337 HydrophobicContact CG2-CB 4.24Å
332	Y	92.9	Very high	93.1	Very high	69 Å²	69	44.6 Å²	44.6	27%	0.271	22%	0.223	S	C	.	.	T	Hydrogen-bonded Turn	trans	-53.8	129.7	-178.9	-179.4	-116.2	0	0	0	111.2	D194 G256 A257 G329 T334	D194-Y332 HydrophobicContact CB-CD2 4.22Å; D194-Y332 HydrophobicContact CB-CE2 3.99Å; D194-Y332 WeakPolarHBondContact OD2-CE2 3.43Å; G256-Y332 WeakPolarHBondContact O-CE2 3.42Å; A257-Y332 VanDerWaalsContact CA-CD2 3.47Å; A257-Y332 HydrophobicContact CB-CE2 4.5Å; G329-Y332 WeakPolarHBondContact O-CB 3.41Å; G329-Y332 PolarHBondContact O-N 2.59Å; Y332-T334 VanDerWaalsContact O-CG2 3.3Å; Y332-T334 WeakPolarHBondContact O-CG2 3.35Å; Y332-T334 PolarHBondContact O-N 2.8Å; Y332-T334 VanDerWaalsContact O-N 3.16Å
333	H	94.8	Very high	92.9	Very high	71 Å²	71	47.2 Å²	47.2	33%	0.329	24%	0.242	S	C	.	.	T	Hydrogen-bonded Turn	trans	54.2	30.8	-176.7	-67.9	-169.5	0	0	0	114.2	A186 D194 E229 V331	A186-H333 HydrophobicContact CB-CB 4.03Å; A186-H333 VanDerWaalsContact CB-CD2 3.44Å; A186-H333 WeakPolarHBondContact CB-CD2 3.43Å; D194-H333 IonicContact OD2-CD2 2.7Å; D194-H333 PolarHBondContact OD2-CD2 2.7Å; D194-H333 IonicContact OD2-NE2 3.07Å; D194-H333 PolarHBondContact OD2-NE2 3.13Å; E229-H333 IonicContact OE1-CD2 3.7Å; E229-H333 IonicContact OE1-CE1 2.93Å; E229-H333 IonicContact OE1-NE2 2.71Å; E229-H333 PolarHBondContact OE1-NE2 2.77Å; E229-H333 IonicContact OE2-CE1 3.14Å; E229-H333 PolarHBondContact OE2-CE1 2.81Å; E229-H333 IonicContact OE2-NE2 2.94Å; E229-H333 PolarHBondContact OE2-NE2 3.45Å; V331-H333 PolarHBondContact O-N 2.94Å
334	T	95	Very high	92.7	Very high	32 Å²	32	51.5 Å²	51.5	20%	0.196	26%	0.264	C	S	.	.	S	Bend	trans	-122.9	166	175.6	78.6	0	0	0	0	111.8	S189 P190 V331 Y332 Y336 D337	S189-T334 WeakPolarHBondContact CA-O 3.46Å; S189-T334 WeakPolarHBondContact CB-O 3.21Å; S189-T334 PolarHBondContact OG-O 2.94Å; P190-T334 WeakPolarHBondContact CD-O 3.3Å; V331-T334 VanDerWaalsContact C-OG1 3.28Å; V331-T334 WeakPolarHBondContact CA-OG1 3.38Å; V331-T334 WeakPolarHBondContact O-CB 3.44Å; V331-T334 PolarHBondContact O-N 3.37Å; V331-T334 PolarHBondContact O-OG1 2.89Å; Y332-T334 VanDerWaalsContact O-CG2 3.3Å; Y332-T334 WeakPolarHBondContact O-CG2 3.35Å; Y332-T334 PolarHBondContact O-N 2.8Å; Y332-T334 VanDerWaalsContact O-N 3.16Å; T334-Y336 PolarHBondContact O-N 3.49Å; T334-Y336 WeakPolarHBondContact OG1-CB 3.38Å; T334-Y336 WeakPolarHBondContact OG1-CD2 3.38Å; T334-Y336 PolarHBondContact OG1-N 2.8Å; T334-Y336 VanDerWaalsContact OG1-N 3.08Å; T334-D337 PolarHBondContact O-N 2.97Å
335	P	95.8	Very high	92.5	Very high	86 Å²	86	57.6 Å²	57.6	56%	0.558	29%	0.285	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.3	-14.4	169.3	-25.2	34.8	0	0	0	114.6	G188	G188-P335 WeakPolarHBondContact O-CG 3.43Å
336	Y	94.4	Very high	92.4	Very high	126 Å²	126	58 Å²	58	49%	0.494	29%	0.288	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.3	-5	-178	-52.8	-64.3	0	0	0	113.9	Y330 T334 T338 R341	Y330-Y336 HydrophobicContact CE1-CD2 4.23Å; Y330-Y336 HydrophobicContact CE1-CE2 4.49Å; T334-Y336 PolarHBondContact O-N 3.49Å; T334-Y336 WeakPolarHBondContact OG1-CB 3.38Å; T334-Y336 WeakPolarHBondContact OG1-CD2 3.38Å; T334-Y336 PolarHBondContact OG1-N 2.8Å; T334-Y336 VanDerWaalsContact OG1-N 3.08Å; Y336-T338 PolarHBondContact O-N 2.95Å; Y336-R341 WeakPolarHBondContact O-CD 3.33Å; Y336-R341 PolarHBondContact O-NE 2.87Å
337	D	96.4	Very high	92.5	Very high	0 Å²	0	54.4 Å²	54.4	0%	0	27%	0.27	C	S	.	.			trans	-74.1	70.3	173.8	-175.6	27.6	0	0	0	110.9	P190 G191 A192 S193 D194 V331 T334	P190-D337 WeakPolarHBondContact CB-O 3.21Å; P190-D337 WeakPolarHBondContact CD-O 3.34Å; P190-D337 VanDerWaalsContact CG-O 3.27Å; P190-D337 WeakPolarHBondContact CG-O 3.21Å; G191-D337 VanDerWaalsContact C-OD2 3.28Å; G191-D337 WeakPolarHBondContact CA-OD2 3.38Å; A192-D337 WeakPolarHBondContact CB-O 3.4Å; A192-D337 PolarHBondContact N-O 2.8Å; A192-D337 PolarHBondContact N-OD2 2.8Å; S193-D337 VanDerWaalsContact CB-OD1 3.24Å; S193-D337 WeakPolarHBondContact CB-OD1 3.45Å; S193-D337 PolarHBondContact N-OD1 3.45Å; S193-D337 PolarHBondContact N-OD2 3.09Å; S193-D337 PolarHBondContact OG-OD1 3.27Å; S193-D337 PolarHBondContact OG-OD2 3.48Å; D194-D337 PolarHBondContact N-OD2 2.82Å; V331-D337 HydrophobicContact CG2-CB 4.24Å; T334-D337 PolarHBondContact O-N 2.97Å
338	T	96.3	Very high	92.8	Very high	48 Å²	48	57.7 Å²	57.7	29%	0.294	28%	0.28	S	S	.	.			trans	-105.8	148.7	-174.5	59.4	0	0	0	0	111	P190 A192 Y336 S340 R341	P190-T338 HydrophobicContact CG-CG2 4.18Å; A192-T338 VanDerWaalsContact CB-C 3.43Å; Y336-T338 PolarHBondContact O-N 2.95Å; T338-S340 PolarHBondContact O-N 3.07Å; T338-S340 PolarHBondContact OG1-OG 2.69Å; T338-S340 VanDerWaalsContact OG1-OG 3.12Å; T338-R341 WeakPolarHBondContact O-CB 3.26Å; T338-R341 PolarHBondContact O-N 2.8Å
339	E	95.9	Very high	93.1	Very high	42 Å²	42	56.4 Å²	56.4	20%	0.196	27%	0.274	C	S	.	.	G	3₁₀ helix	trans	-52.3	-35.2	-178.8	67.7	82.3	-139	0	0	113.9	R86 L89 I90 A192 R341 I342	R86-E339 WeakPolarHBondContact CD-OE2 3.41Å; R86-E339 IonicContact CZ-OE2 3.8Å; R86-E339 IonicContact NE-OE2 3.53Å; R86-E339 PolarHBondContact NH1-O 3.19Å; R86-E339 IonicContact NH1-OE2 3.56Å; R86-E339 PolarHBondContact NH1-OE2 3.47Å; L89-E339 HydrophobicContact CD1-CB 4.47Å; L89-E339 HydrophobicContact CD2-CB 3.71Å; L89-E339 HydrophobicContact CG-CB 3.61Å; I90-E339 VanDerWaalsContact CG1-CD 3.47Å; I90-E339 HydrophobicContact CG1-CG 3.76Å; I90-E339 VanDerWaalsContact CG1-OE2 3.32Å; I90-E339 WeakPolarHBondContact CG1-OE2 3.43Å; A192-E339 HydrophobicContact CB-CB 4.39Å; A192-E339 VanDerWaalsContact CB-N 3.33Å; E339-R341 PolarHBondContact O-N 3.22Å; E339-R341 VanDerWaalsContact O-N 3.11Å; E339-I342 PolarHBondContact O-N 3.13Å
340	S	94.8	Very high	93.4	Very high	83 Å²	83	56.1 Å²	56.1	58%	0.58	27%	0.27	S	S	*	.	G	3₁₀ helix	trans	-62	-19.7	-178.4	62.7	0	0	0	0	114.4	T338	T338-S340 PolarHBondContact O-N 3.07Å; T338-S340 PolarHBondContact OG1-OG 2.69Å; T338-S340 VanDerWaalsContact OG1-OG 3.12Å
341	R	92	Very high	93.7	Very high	98 Å²	98	51 Å²	51	37%	0.37	25%	0.249	S	C	.	.	G	3₁₀ helix	trans	-77.9	-22.3	176.4	-69.9	-166	170.3	-121.9	3.2	113.3	A259 D328 Y336 T338 E339 S343	A259-R341 HydrophobicContact CB-CB 3.97Å; D328-R341 IonicContact OD1-NH1 2.88Å; D328-R341 PolarHBondContact OD1-NH1 3.21Å; D328-R341 IonicContact OD2-CZ 3.23Å; D328-R341 IonicContact OD2-NH1 2.76Å; D328-R341 PolarHBondContact OD2-NH1 2.86Å; Y336-R341 WeakPolarHBondContact O-CD 3.33Å; Y336-R341 PolarHBondContact O-NE 2.87Å; T338-R341 WeakPolarHBondContact O-CB 3.26Å; T338-R341 PolarHBondContact O-N 2.8Å; E339-R341 PolarHBondContact O-N 3.22Å; E339-R341 VanDerWaalsContact O-N 3.11Å; R341-S343 PolarHBondContact O-N 2.99Å
342	I	94.5	Very high	93.9	Very high	3 Å²	3	51 Å²	51	2%	0.015	25%	0.25	C	C	.	.	S	Bend	trans	-84.8	116.3	175.5	-61	153.2	0	0	0	107.3	R86 L89 A192 V197 A259 E339 L347	R86-I342 PolarHBondContact NH1-O 3.23Å; R86-I342 PolarHBondContact NH2-O 2.82Å; L89-I342 HydrophobicContact CD2-CD1 3.89Å; A192-I342 HydrophobicContact CB-CD1 4.26Å; V197-I342 HydrophobicContact CB-CD1 3.74Å; V197-I342 HydrophobicContact CG1-CD1 4.22Å; V197-I342 HydrophobicContact CG2-CD1 3.85Å; V197-I342 HydrophobicContact CG2-CG2 4.1Å; A259-I342 WeakPolarHBondContact O-CG1 3.42Å; E339-I342 PolarHBondContact O-N 3.13Å; I342-L347 HydrophobicContact CG2-CB 4.38Å; I342-L347 HydrophobicContact CG2-CD1 4.47Å
343	S	93	Very high	94	Very high	57 Å²	57	48 Å²	48	40%	0.399	24%	0.239	S	C	.	.			trans	-72.4	146.8	178.8	80.4	0	0	0	0	112	R341 R345 C346 L347	R341-S343 PolarHBondContact O-N 2.99Å; S343-R345 PolarHBondContact O-N 3.09Å; S343-R345 VanDerWaalsContact O-N 3.16Å; S343-C346 PolarHBondContact O-N 3.33Å; S343-C346 VanDerWaalsContact O-N 3.13Å; S343-C346 WeakPolarHBondContact OG-CB 3.43Å; S343-C346 PolarHBondContact OG-N 2.7Å; S343-C346 VanDerWaalsContact OG-N 3.13Å; S343-C346 PolarHBondContact OG-SG 3.03Å; S343-L347 WeakPolarHBondContact O-CB 3.09Å; S343-L347 PolarHBondContact O-N 3.29Å
344	N	92.6	Very high	94	Very high	90 Å²	90	44.7 Å²	44.7	48%	0.481	22%	0.223	S	C	.	.	H	α-helix	trans	-57.5	-30.1	173.8	-76.1	-19.4	0	0	0	112.7	V82 R86 R348	V82-N344 HydrophobicContact CG2-CB 4.13Å; V82-N344 WeakPolarHBondContact CG2-O 3.31Å; R86-N344 VanDerWaalsContact CZ-OD1 3.3Å; R86-N344 PolarHBondContact NE-OD1 3.16Å; R86-N344 PolarHBondContact NH2-OD1 3.46Å; N344-R348 WeakPolarHBondContact O-CB 3.4Å; N344-R348 PolarHBondContact O-N 3.41Å
345	R	90.6	Very high	94.1	Very high	138 Å²	138	43.2 Å²	43.2	52%	0.521	21%	0.214	S	C	.	.	H	α-helix	trans	-67.3	-45.5	177.7	-167.4	-174	-70.4	178.9	-0.9	111.3	C69 S343 L349	C69-R345 HydrophobicContact CB-CG 4.25Å; C69-R345 WeakPolarHBondContact O-CD 3.5Å; C69-R345 PolarHBondContact O-NH1 2.88Å; S343-R345 PolarHBondContact O-N 3.09Å; S343-R345 VanDerWaalsContact O-N 3.16Å; R345-L349 WeakPolarHBondContact O-CB 3.49Å; R345-L349 PolarHBondContact O-N 2.94Å
346	C	92.2	Very high	94.1	Very high	9 Å²	9	39.6 Å²	39.6	6%	0.061	19%	0.191	C	C	.	.	H	α-helix	trans	-67.9	-38.2	175.8	-66.5	0	0	0	0	112.4	C69 K261 S343 L349 S350	C69-C346 HydrophobicContact CB-CB 3.95Å; C69-C346 WeakPolarHBondContact CB-SG 3.3Å; C69-C346 WeakPolarHBondContact SG-CA 3.36Å; C69-C346 WeakPolarHBondContact SG-CB 3.38Å; C69-C346 CovalentContact SG-SG 2.03Å; C69-C346 PolarHBondContact SG-SG 3.37Å; K261-C346 VanDerWaalsContact CA-SG 3.55Å; K261-C346 WeakPolarHBondContact O-CB 3.17Å; K261-C346 PolarHBondContact O-SG 2.98Å; S343-C346 PolarHBondContact O-N 3.33Å; S343-C346 VanDerWaalsContact O-N 3.13Å; S343-C346 WeakPolarHBondContact OG-CB 3.43Å; S343-C346 PolarHBondContact OG-N 2.7Å; S343-C346 VanDerWaalsContact OG-N 3.13Å; S343-C346 PolarHBondContact OG-SG 3.03Å; C346-L349 PolarHBondContact O-N 3.28Å; C346-S350 WeakPolarHBondContact O-CB 3.4Å; C346-S350 PolarHBondContact O-N 2.88Å
347	L	92.8	Very high	94.2	Very high	0 Å²	0	33.6 Å²	33.6	0%	0	17%	0.167	C	C	.	.	H	α-helix	trans	-60.4	-47.8	175.8	-169.5	59.3	0	0	0	111.5	V82 V85 R86 V197 V201 I342 S343 S350 G351	V82-L347 HydrophobicContact CG2-CB 4.1Å; V82-L347 HydrophobicContact CG2-CD2 3.98Å; V82-L347 HydrophobicContact CG2-CG 4.15Å; V85-L347 HydrophobicContact CB-CD2 4.11Å; V85-L347 HydrophobicContact CB-CG 4.34Å; V85-L347 HydrophobicContact CG1-CD1 3.55Å; V85-L347 HydrophobicContact CG1-CD2 3.72Å; V85-L347 HydrophobicContact CG1-CG 3.68Å; R86-L347 HydrophobicContact CB-CD2 4.34Å; V197-L347 HydrophobicContact CG2-CD1 3.52Å; V201-L347 HydrophobicContact CG2-CD1 4.03Å; I342-L347 HydrophobicContact CG2-CB 4.38Å; I342-L347 HydrophobicContact CG2-CD1 4.47Å; S343-L347 WeakPolarHBondContact O-CB 3.09Å; S343-L347 PolarHBondContact O-N 3.29Å; L347-S350 PolarHBondContact O-N 3.42Å; L347-G351 PolarHBondContact O-N 3.37Å
348	R	92.8	Very high	94.2	Very high	108 Å²	108	33.6 Å²	33.6	41%	0.408	17%	0.167	S	C	.	.	H	α-helix	trans	-59.8	-49.8	173.9	178.1	172.7	-76.9	156.1	-2.5	111.2	V82 N344 S350 G351 C352	V82-R348 HydrophobicContact CB-CB 4.41Å; V82-R348 HydrophobicContact CG2-CB 4.22Å; N344-R348 WeakPolarHBondContact O-CB 3.4Å; N344-R348 PolarHBondContact O-N 3.41Å; R348-S350 PolarHBondContact O-N 3.33Å; R348-G351 PolarHBondContact O-N 2.84Å; R348-C352 WeakPolarHBondContact O-CB 3.46Å; R348-C352 PolarHBondContact O-N 2.98Å; R348-C352 PolarHBondContact O-SG 3.43Å
349	L	92.6	Very high	94.2	Very high	4 Å²	4	33.4 Å²	33.4	2%	0.021	16%	0.163	C	C	.	.	H	α-helix	trans	-57.9	-47.1	-179.6	175.4	63.3	0	0	0	112.3	C69 R262 Q287 R345 C346 C352 N353	C69-L349 HydrophobicContact CB-CD2 3.76Å; R262-L349 HydrophobicContact CG-CD2 3.94Å; Q287-L349 HydrophobicContact CB-CD1 4.15Å; Q287-L349 HydrophobicContact CB-CD2 3.99Å; Q287-L349 HydrophobicContact CG-CD1 4.18Å; Q287-L349 HydrophobicContact CG-CD2 4.34Å; Q287-L349 VanDerWaalsContact OE1-CD2 3.25Å; R345-L349 WeakPolarHBondContact O-CB 3.49Å; R345-L349 PolarHBondContact O-N 2.94Å; C346-L349 PolarHBondContact O-N 3.28Å; L349-C352 PolarHBondContact O-N 2.91Å; L349-N353 WeakPolarHBondContact O-CB 3.28Å; L349-N353 VanDerWaalsContact O-CG 3.28Å; L349-N353 PolarHBondContact O-N 3.16Å; L349-N353 PolarHBondContact O-ND2 3.38Å
350	S	94.1	Very high	94.2	Very high	6 Å²	6	35 Å²	35	4%	0.042	17%	0.173	C	C	.	.	H	α-helix	trans	-57	-53	177.3	-175.8	0	0	0	0	110.7	L263 Y325 C346 L347 R348 C352 N353 I354	L263-S350 VanDerWaalsContact CD1-OG 3.29Å; L263-S350 WeakPolarHBondContact CD1-OG 3.34Å; Y325-S350 VanDerWaalsContact OH-CB 3.26Å; Y325-S350 WeakPolarHBondContact OH-CB 3.43Å; Y325-S350 PolarHBondContact OH-OG 2.66Å; C346-S350 WeakPolarHBondContact O-CB 3.4Å; C346-S350 PolarHBondContact O-N 2.88Å; L347-S350 PolarHBondContact O-N 3.42Å; R348-S350 PolarHBondContact O-N 3.33Å; S350-C352 VanDerWaalsContact C-N 3.31Å; S350-C352 PolarHBondContact O-N 3.25Å; S350-N353 PolarHBondContact O-N 3.32Å; S350-N353 VanDerWaalsContact O-N 3.15Å; S350-I354 WeakPolarHBondContact O-CG1 3.35Å; S350-I354 PolarHBondContact O-N 2.65Å
351	G	94.9	Very high	94.3	Very high	0 Å²	0	31.1 Å²	31.1	0%	0	15%	0.145	C	C	.	.	H	α-helix	trans	-57.9	-40.5	177.9	0	0	0	0	0	114.8	F80 L347 R348 L355	F80-G351 VanDerWaalsContact CE2-CA 3.46Å; L347-G351 PolarHBondContact O-N 3.37Å; R348-G351 PolarHBondContact O-N 2.84Å; G351-L355 VanDerWaalsContact O-CB 3.22Å; G351-L355 WeakPolarHBondContact O-CB 3.29Å; G351-L355 PolarHBondContact O-N 3.08Å
352	C	93.3	Very high	94.5	Very high	1 Å²	1	26.4 Å²	26.4	1%	0.007	13%	0.128	C	C	.	.	H	α-helix	trans	-68.5	-38.9	178.1	-61.9	0	0	0	0	112.5	C77 R348 L349 S350 S356	C77-C352 WeakPolarHBondContact CA-SG 3.02Å; C77-C352 HydrophobicContact CB-CB 4.3Å; C77-C352 WeakPolarHBondContact CB-SG 3.46Å; C77-C352 WeakPolarHBondContact SG-CB 3.5Å; C77-C352 PolarHBondContact SG-SG 3.44Å; R348-C352 WeakPolarHBondContact O-CB 3.46Å; R348-C352 PolarHBondContact O-N 2.98Å; R348-C352 PolarHBondContact O-SG 3.43Å; L349-C352 PolarHBondContact O-N 2.91Å; S350-C352 VanDerWaalsContact C-N 3.31Å; S350-C352 PolarHBondContact O-N 3.25Å; C352-S356 VanDerWaalsContact O-CB 3.26Å; C352-S356 WeakPolarHBondContact O-CB 3.4Å; C352-S356 PolarHBondContact O-N 3.37Å; C352-S356 PolarHBondContact O-OG 3Å
353	N	94.5	Very high	94.5	Very high	7 Å²	7	32 Å²	32	4%	0.037	15%	0.151	C	C	.	.	H	α-helix	trans	-65.3	-48.2	175.9	-74.2	-17.3	0	0	0	110.8	F285 K286 L349 S350 S356 F357	F285-N353 HydrophobicContact CD1-CB 3.67Å; F285-N353 WeakPolarHBondContact CD1-ND2 3.43Å; F285-N353 HydrophobicContact CD2-CB 4.13Å; F285-N353 HydrophobicContact CE1-CB 3.77Å; F285-N353 HydrophobicContact CE2-CB 4.22Å; F285-N353 HydrophobicContact CG-CB 3.85Å; F285-N353 HydrophobicContact CZ-CB 4.04Å; K286-N353 PolarHBondContact N-OD1 3.32Å; L349-N353 WeakPolarHBondContact O-CB 3.28Å; L349-N353 VanDerWaalsContact O-CG 3.28Å; L349-N353 PolarHBondContact O-N 3.16Å; L349-N353 PolarHBondContact O-ND2 3.38Å; S350-N353 PolarHBondContact O-N 3.32Å; S350-N353 VanDerWaalsContact O-N 3.15Å; N353-S356 PolarHBondContact O-N 2.93Å; N353-F357 WeakPolarHBondContact O-CB 2.98Å; N353-F357 PolarHBondContact O-N 3.06Å
354	I	96.6	Very high	94.6	Very high	0 Å²	0	30.4 Å²	30.4	0%	0	14%	0.139	C	C	.	.	H	α-helix	trans	-64	-45.9	179.1	-61.8	-62	0	0	0	110.9	V201 V205 M252 L254 L263 F285 S350 S356 F357 V358	V201-I354 HydrophobicContact CG1-CB 4.16Å; V201-I354 HydrophobicContact CG1-CG1 4.25Å; V201-I354 HydrophobicContact CG1-CG2 4.37Å; V205-I354 HydrophobicContact CG2-CG2 4.26Å; M252-I354 HydrophobicContact SD-CD1 3.62Å; L254-I354 HydrophobicContact CD1-CD1 4.37Å; L254-I354 HydrophobicContact CD2-CD1 3.79Å; L263-I354 HydrophobicContact CD1-CD1 4.31Å; F285-I354 HydrophobicContact CZ-CD1 3.87Å; S350-I354 WeakPolarHBondContact O-CG1 3.35Å; S350-I354 PolarHBondContact O-N 2.65Å; I354-S356 VanDerWaalsContact C-N 3.35Å; I354-S356 PolarHBondContact O-N 3.16Å; I354-F357 PolarHBondContact O-N 2.88Å; I354-V358 HydrophobicContact CG2-CG2 4.18Å; I354-V358 WeakPolarHBondContact O-CB 3.3Å; I354-V358 VanDerWaalsContact O-CG2 3.27Å; I354-V358 WeakPolarHBondContact O-CG2 3.36Å; I354-V358 PolarHBondContact O-N 3.11Å
355	L	96.1	Very high	94.6	Very high	1 Å²	1	32 Å²	32	1%	0.005	14%	0.143	C	C	.	.	H	α-helix	trans	-58.3	-47	175.6	-179.8	61.6	0	0	0	111.6	V205 I208 L209 G351 F357 V358 Q359	V205-L355 HydrophobicContact CG1-CD1 4.06Å; V205-L355 HydrophobicContact CG2-CB 4.12Å; V205-L355 HydrophobicContact CG2-CD1 4.49Å; I208-L355 HydrophobicContact CB-CD1 4.48Å; I208-L355 HydrophobicContact CD1-CD2 3.89Å; I208-L355 HydrophobicContact CG2-CD1 4.08Å; I208-L355 HydrophobicContact CG2-CD2 4.1Å; L209-L355 HydrophobicContact CD2-CD1 4.49Å; G351-L355 VanDerWaalsContact O-CB 3.22Å; G351-L355 WeakPolarHBondContact O-CB 3.29Å; G351-L355 PolarHBondContact O-N 3.08Å; L355-F357 VanDerWaalsContact C-N 3.31Å; L355-F357 PolarHBondContact O-N 3.34Å; L355-V358 PolarHBondContact O-N 2.98Å; L355-Q359 HydrophobicContact CD1-CG 4.28Å; L355-Q359 WeakPolarHBondContact O-CB 3.4Å; L355-Q359 VanDerWaalsContact O-CG 3.26Å; L355-Q359 WeakPolarHBondContact O-CG 3.42Å; L355-Q359 PolarHBondContact O-N 3.26Å
356	S	95	Very high	94.8	Very high	11 Å²	11	30.7 Å²	30.7	8%	0.077	14%	0.138	C	C	.	.	H	α-helix	trans	-62.8	-40.1	179.5	-59.2	0	0	0	0	111.4	C352 N353 I354 L360	C352-S356 VanDerWaalsContact O-CB 3.26Å; C352-S356 WeakPolarHBondContact O-CB 3.4Å; C352-S356 PolarHBondContact O-N 3.37Å; C352-S356 PolarHBondContact O-OG 3Å; N353-S356 PolarHBondContact O-N 2.93Å; I354-S356 VanDerWaalsContact C-N 3.35Å; I354-S356 PolarHBondContact O-N 3.16Å; S356-L360 WeakPolarHBondContact O-CG 3.35Å; S356-L360 PolarHBondContact O-N 3.18Å
357	F	97	Very high	94.9	Very high	0 Å²	0	30.2 Å²	30.2	0%	0	14%	0.135	C	C	.	.	H	α-helix	trans	-66.2	-50.5	177.9	179.6	-91.4	0	0	0	111.4	F177 M252 A280 A284 F285 L321 N353 I354 L355 Q359 L360 I361	F177-F357 AromaticContact CE1-CE1 3.92Å; F177-F357 HydrophobicContact CE1-CE1 3.92Å; F177-F357 HydrophobicContact CE2-CE1 4.46Å; F177-F357 AromaticContact CZ-CE1 3.61Å; F177-F357 HydrophobicContact CZ-CE1 3.61Å; F177-F357 HydrophobicContact CZ-CZ 4.12Å; M252-F357 HydrophobicContact CB-CE1 4.5Å; M252-F357 HydrophobicContact CE-CD1 3.35Å; M252-F357 HydrophobicContact CE-CD2 4.06Å; M252-F357 HydrophobicContact CE-CE1 3.25Å; M252-F357 HydrophobicContact CE-CE2 3.96Å; M252-F357 HydrophobicContact CE-CG 3.76Å; M252-F357 HydrophobicContact CE-CZ 3.57Å; M252-F357 HydrophobicContact SD-CD1 4.01Å; M252-F357 HydrophobicContact SD-CE1 4.11Å; A280-F357 HydrophobicContact CB-CD2 4.24Å; A280-F357 HydrophobicContact CB-CE2 3.78Å; A284-F357 VanDerWaalsContact CB-CA 3.4Å; A284-F357 HydrophobicContact CB-CB 3.61Å; A284-F357 HydrophobicContact CB-CD2 4.03Å; A284-F357 HydrophobicContact CB-CG 4.32Å; F285-F357 HydrophobicContact CD2-CB 4.43Å; F285-F357 HydrophobicContact CE2-CB 3.92Å; F285-F357 HydrophobicContact CE2-CD2 4.21Å; F285-F357 HydrophobicContact CE2-CG 4.2Å; L321-F357 HydrophobicContact CD1-CE2 3.99Å; L321-F357 HydrophobicContact CD1-CZ 3.87Å; N353-F357 WeakPolarHBondContact O-CB 2.98Å; N353-F357 PolarHBondContact O-N 3.06Å; I354-F357 PolarHBondContact O-N 2.88Å; L355-F357 VanDerWaalsContact C-N 3.31Å; L355-F357 PolarHBondContact O-N 3.34Å; F357-Q359 VanDerWaalsContact C-N 3.28Å; F357-Q359 PolarHBondContact O-N 3.14Å; F357-L360 PolarHBondContact O-N 2.95Å; F357-L360 VanDerWaalsContact O-N 3.12Å; F357-I361 HydrophobicContact CD1-CG1 3.96Å; F357-I361 HydrophobicContact CE1-CD1 4.26Å; F357-I361 HydrophobicContact CE1-CG1 3.51Å; F357-I361 HydrophobicContact CE2-CD1 4.34Å; F357-I361 HydrophobicContact CE2-CG1 4.15Å; F357-I361 HydrophobicContact CG-CG1 4.45Å; F357-I361 HydrophobicContact CZ-CD1 3.89Å; F357-I361 HydrophobicContact CZ-CG1 3.62Å; F357-I361 WeakPolarHBondContact O-CG1 3.48Å; F357-I361 PolarHBondContact O-N 3.16Å
358	V	97.2	Very high	94.9	Very high	0 Å²	0	33 Å²	33	0%	0	15%	0.148	C	C	.	.	H	α-helix	trans	-59.1	-41.1	178.3	169.9	0	0	0	0	110.9	I179 L209 L220 F222 I354 L355 I361 A362	I179-V358 HydrophobicContact CD1-CG2 4.1Å; I179-V358 HydrophobicContact CG1-CG2 3.98Å; L209-V358 HydrophobicContact CD1-CG1 3.9Å; L220-V358 HydrophobicContact CD1-CG1 3.38Å; L220-V358 HydrophobicContact CD2-CG1 4.11Å; L220-V358 HydrophobicContact CG-CG1 4.37Å; F222-V358 HydrophobicContact CZ-CG1 4.18Å; I354-V358 HydrophobicContact CG2-CG2 4.18Å; I354-V358 WeakPolarHBondContact O-CB 3.3Å; I354-V358 VanDerWaalsContact O-CG2 3.27Å; I354-V358 WeakPolarHBondContact O-CG2 3.36Å; I354-V358 PolarHBondContact O-N 3.11Å; L355-V358 PolarHBondContact O-N 2.98Å; V358-I361 PolarHBondContact O-N 3Å; V358-A362 WeakPolarHBondContact O-CB 3.42Å; V358-A362 PolarHBondContact O-N 3.13Å
359	Q	95.6	Very high	94.8	Very high	43 Å²	43	30.8 Å²	30.8	20%	0.201	16%	0.159	C	C	.	.	H	α-helix	trans	-62.9	-44.4	175.2	-78.7	178.4	-13.1	0	0	112.5	L209 F214 L355 F357 A362 K363	L209-Q359 HydrophobicContact CD2-CG 4.45Å; F214-Q359 HydrophobicContact CD1-CG 4.33Å; F214-Q359 HydrophobicContact CD2-CG 4.09Å; F214-Q359 HydrophobicContact CE1-CB 4.04Å; F214-Q359 HydrophobicContact CE1-CG 4.04Å; F214-Q359 HydrophobicContact CE2-CB 3.73Å; F214-Q359 HydrophobicContact CE2-CG 3.74Å; F214-Q359 HydrophobicContact CG-CG 4.34Å; F214-Q359 HydrophobicContact CZ-CB 3.43Å; F214-Q359 VanDerWaalsContact CZ-CB 3.43Å; F214-Q359 HydrophobicContact CZ-CG 3.72Å; F214-Q359 WeakPolarHBondContact CZ-O 3.34Å; L355-Q359 HydrophobicContact CD1-CG 4.28Å; L355-Q359 WeakPolarHBondContact O-CB 3.4Å; L355-Q359 VanDerWaalsContact O-CG 3.26Å; L355-Q359 WeakPolarHBondContact O-CG 3.42Å; L355-Q359 PolarHBondContact O-N 3.26Å; F357-Q359 VanDerWaalsContact C-N 3.28Å; F357-Q359 PolarHBondContact O-N 3.14Å; Q359-A362 PolarHBondContact O-N 3.11Å; Q359-K363 PolarHBondContact O-N 3.18Å
360	L	96.2	Very high	94.9	Very high	77 Å²	77	31.5 Å²	31.5	40%	0.403	16%	0.162	S	C	.	.	H	α-helix	trans	-62.4	-49.2	176.9	-78.8	171.7	0	0	0	111.2	N283 A284 S356 F357 A362 K363 D364	N283-L360 HydrophobicContact CB-CD1 4.08Å; A284-L360 HydrophobicContact CB-CD1 3.85Å; S356-L360 WeakPolarHBondContact O-CG 3.35Å; S356-L360 PolarHBondContact O-N 3.18Å; F357-L360 PolarHBondContact O-N 2.95Å; F357-L360 VanDerWaalsContact O-N 3.12Å; L360-A362 VanDerWaalsContact C-N 3.33Å; L360-A362 PolarHBondContact O-N 3.3Å; L360-K363 PolarHBondContact O-N 3.25Å; L360-K363 VanDerWaalsContact O-N 3.15Å; L360-D364 WeakPolarHBondContact O-CB 3.45Å; L360-D364 PolarHBondContact O-N 3.17Å; L360-D364 VanDerWaalsContact O-N 3.1Å
361	I	97.2	Very high	94.6	Very high	0 Å²	0	37.6 Å²	37.6	0%	0	19%	0.192	C	C	.	.	H	α-helix	trans	-60.3	-43	176.9	-68.8	-63.7	0	0	0	111.5	F177 N218 L277 A280 F357 V358 K363 D364 I367	F177-I361 HydrophobicContact CB-CG2 3.7Å; F177-I361 HydrophobicContact CD1-CG2 3.98Å; F177-I361 HydrophobicContact CD2-CG2 3.53Å; F177-I361 HydrophobicContact CE2-CG2 4.13Å; F177-I361 HydrophobicContact CG-CG2 3.45Å; F177-I361 VanDerWaalsContact CG-CG2 3.45Å; N218-I361 PolarHBondContact ND2-O 3.21Å; L277-I361 HydrophobicContact CD2-CD1 3.8Å; A280-I361 HydrophobicContact CB-CD1 3.66Å; A280-I361 HydrophobicContact CB-CG1 4.34Å; F357-I361 HydrophobicContact CD1-CG1 3.96Å; F357-I361 HydrophobicContact CE1-CD1 4.26Å; F357-I361 HydrophobicContact CE1-CG1 3.51Å; F357-I361 HydrophobicContact CE2-CD1 4.34Å; F357-I361 HydrophobicContact CE2-CG1 4.15Å; F357-I361 HydrophobicContact CG-CG1 4.45Å; F357-I361 HydrophobicContact CZ-CD1 3.89Å; F357-I361 HydrophobicContact CZ-CG1 3.62Å; F357-I361 WeakPolarHBondContact O-CG1 3.48Å; F357-I361 PolarHBondContact O-N 3.16Å; V358-I361 PolarHBondContact O-N 3Å; I361-K363 PolarHBondContact O-N 3.25Å; I361-D364 PolarHBondContact O-N 3.25Å; I361-I367 HydrophobicContact CD1-CD1 4.1Å; I361-I367 HydrophobicContact CG2-CD1 4.44Å; I361-I367 HydrophobicContact CG2-CG1 4.34Å
362	A	95.5	Very high	94.3	Very high	0 Å²	0	41.2 Å²	41.2	0%	0	21%	0.208	C	C	.	.	H	α-helix	trans	-62.9	-24.6	179.9	0	0	0	0	0	113.2	F214 L216 F217 N218 L220 V358 Q359 L360	F214-A362 HydrophobicContact CE1-CB 4.21Å; L216-A362 HydrophobicContact CB-CB 4.35Å; L216-A362 HydrophobicContact CD2-CB 3.47Å; L216-A362 VanDerWaalsContact CD2-CB 3.47Å; L216-A362 HydrophobicContact CG-CB 4.49Å; F217-A362 WeakPolarHBondContact CA-O 3.25Å; F217-A362 WeakPolarHBondContact CB-O 3.24Å; F217-A362 PolarHBondContact N-O 3.2Å; N218-A362 PolarHBondContact N-O 2.89Å; L220-A362 HydrophobicContact CD1-CB 4.11Å; L220-A362 HydrophobicContact CD2-CB 4.19Å; L220-A362 HydrophobicContact CG-CB 4.34Å; V358-A362 WeakPolarHBondContact O-CB 3.42Å; V358-A362 PolarHBondContact O-N 3.13Å; Q359-A362 PolarHBondContact O-N 3.11Å; L360-A362 VanDerWaalsContact C-N 3.33Å; L360-A362 PolarHBondContact O-N 3.3Å
363	K	94.9	Very high	94.1	Very high	119 Å²	119	42 Å²	42	52%	0.517	21%	0.212	S	C	.	.	H	α-helix	trans	-95.2	-14.7	177.4	-79.3	-178.4	171.9	168.9	0	114.3	F214 Q359 L360 I361 E365	F214-K363 HydrophobicContact CE1-CD 4.02Å; F214-K363 HydrophobicContact CE1-CG 3.77Å; F214-K363 HydrophobicContact CE2-CD 3.9Å; F214-K363 HydrophobicContact CZ-CD 3.33Å; F214-K363 HydrophobicContact CZ-CG 3.56Å; Q359-K363 PolarHBondContact O-N 3.18Å; L360-K363 PolarHBondContact O-N 3.25Å; L360-K363 VanDerWaalsContact O-N 3.15Å; I361-K363 PolarHBondContact O-N 3.25Å; K363-E365 PolarHBondContact O-N 3.1Å
364	D	95.2	Very high	93.5	Very high	25 Å²	25	46 Å²	46	13%	0.134	24%	0.237	C	C	.	.			trans	-79.6	106.8	-171.2	-166.8	-21.4	0	0	0	111.4	N218 L360 I361 R366 I367	N218-D364 PolarHBondContact ND2-O 2.76Å; L360-D364 WeakPolarHBondContact O-CB 3.45Å; L360-D364 PolarHBondContact O-N 3.17Å; L360-D364 VanDerWaalsContact O-N 3.1Å; I361-D364 PolarHBondContact O-N 3.25Å; D364-R366 PolarHBondContact O-N 3.42Å; D364-R366 VanDerWaalsContact O-N 3.14Å; D364-R366 WeakPolarHBondContact OD1-CB 3.45Å; D364-R366 VanDerWaalsContact OD1-CG 3.26Å; D364-R366 WeakPolarHBondContact OD1-CG 3.49Å; D364-R366 IonicContact OD1-CZ 3.13Å; D364-R366 PolarHBondContact OD1-N 2.89Å; D364-R366 IonicContact OD1-NE 3.42Å; D364-R366 PolarHBondContact OD1-NE 3.31Å; D364-R366 IonicContact OD1-NH2 3.82Å; D364-R366 IonicContact OD2-CZ 3.85Å; D364-R366 VanDerWaalsContact OD2-CZ 3.27Å; D364-R366 IonicContact OD2-NE 3.55Å; D364-R366 PolarHBondContact OD2-NE 2.86Å; D364-R366 VanDerWaalsContact OD2-NE 3.07Å; D364-R366 IonicContact OD2-NH2 2.75Å; D364-R366 PolarHBondContact OD2-NH2 3.47Å; D364-I367 HydrophobicContact CB-CG1 4.12Å; D364-I367 WeakPolarHBondContact O-CG1 3.21Å; D364-I367 PolarHBondContact O-N 3.23Å
365	E	92.9	Very high	92.7	Very high	124 Å²	124	47.7 Å²	47.7	58%	0.579	25%	0.248	S	C	*	.	G	3₁₀ helix	trans	-62.5	-22.1	-178.6	-57.1	-171.6	169.5	0	0	113	F217 K363 I367 Q368	F217-E365 HydrophobicContact CD1-CB 4.22Å; F217-E365 HydrophobicContact CD1-CG 3.89Å; F217-E365 HydrophobicContact CD2-CG 4.43Å; F217-E365 HydrophobicContact CE1-CB 3.81Å; F217-E365 HydrophobicContact CE1-CG 3.72Å; F217-E365 HydrophobicContact CE2-CG 4.29Å; F217-E365 HydrophobicContact CG-CG 4.24Å; F217-E365 HydrophobicContact CZ-CB 4.3Å; F217-E365 HydrophobicContact CZ-CG 3.93Å; K363-E365 PolarHBondContact O-N 3.1Å; E365-I367 PolarHBondContact O-N 3.18Å; E365-I367 VanDerWaalsContact O-N 3.17Å; E365-Q368 PolarHBondContact O-N 3.15Å
366	R	94.4	Very high	91.6	Very high	109 Å²	109	51.9 Å²	51.9	41%	0.411	27%	0.269	S	S	.	.	G	3₁₀ helix	trans	-61	-26.2	179.2	-60.8	176.5	-69.8	-179.6	-1.1	112.3	V276 E279 D364 Q368 G369 F370	V276-R366 HydrophobicContact CG1-CB 4.48Å; E279-R366 IonicContact OE1-NH1 2.68Å; E279-R366 IonicContact OE1-NH2 3.18Å; E279-R366 IonicContact OE2-CZ 2.67Å; E279-R366 IonicContact OE2-NH1 2.8Å; E279-R366 PolarHBondContact OE2-NH1 3.44Å; E279-R366 IonicContact OE2-NH2 3.74Å; E279-R366 PolarHBondContact OE2-NH2 3.36Å; D364-R366 PolarHBondContact O-N 3.42Å; D364-R366 VanDerWaalsContact O-N 3.14Å; D364-R366 WeakPolarHBondContact OD1-CB 3.45Å; D364-R366 VanDerWaalsContact OD1-CG 3.26Å; D364-R366 WeakPolarHBondContact OD1-CG 3.49Å; D364-R366 IonicContact OD1-CZ 3.13Å; D364-R366 PolarHBondContact OD1-N 2.89Å; D364-R366 IonicContact OD1-NE 3.42Å; D364-R366 PolarHBondContact OD1-NE 3.31Å; D364-R366 IonicContact OD1-NH2 3.82Å; D364-R366 IonicContact OD2-CZ 3.85Å; D364-R366 VanDerWaalsContact OD2-CZ 3.27Å; D364-R366 IonicContact OD2-NE 3.55Å; D364-R366 PolarHBondContact OD2-NE 2.86Å; D364-R366 VanDerWaalsContact OD2-NE 3.07Å; D364-R366 IonicContact OD2-NH2 2.75Å; D364-R366 PolarHBondContact OD2-NH2 3.47Å; R366-Q368 VanDerWaalsContact C-N 3.26Å; R366-Q368 PolarHBondContact O-N 2.76Å; R366-G369 WeakPolarHBondContact O-CA 3.23Å; R366-G369 PolarHBondContact O-N 3.18Å; R366-F370 VanDerWaalsContact O-CD1 3.23Å; R366-F370 WeakPolarHBondContact O-CD1 3.42Å
367	I	93.6	Very high	89.9	Confident	0 Å²	0	53.8 Å²	53.8	0%	0	28%	0.279	C	S	.	.	G	3₁₀ helix	trans	-60.8	-34.4	179.2	-56.9	-58.9	0	0	0	111.7	N218 V249 I361 D364 E365 G369 F370	N218-I367 HydrophobicContact CB-CG2 4.49Å; V249-I367 HydrophobicContact CG2-CG2 3.83Å; I361-I367 HydrophobicContact CD1-CD1 4.1Å; I361-I367 HydrophobicContact CG2-CD1 4.44Å; I361-I367 HydrophobicContact CG2-CG1 4.34Å; D364-I367 HydrophobicContact CB-CG1 4.12Å; D364-I367 WeakPolarHBondContact O-CG1 3.21Å; D364-I367 PolarHBondContact O-N 3.23Å; E365-I367 PolarHBondContact O-N 3.18Å; E365-I367 VanDerWaalsContact O-N 3.17Å; I367-G369 PolarHBondContact O-N 2.88Å; I367-F370 HydrophobicContact CD1-CD2 4.27Å; I367-F370 HydrophobicContact CD1-CE1 3.93Å; I367-F370 HydrophobicContact CD1-CE2 3.59Å; I367-F370 HydrophobicContact CD1-CZ 3.39Å; I367-F370 WeakPolarHBondContact O-CB 3.44Å; I367-F370 PolarHBondContact O-N 3.49Å; I367-F370 VanDerWaalsContact O-N 3.11Å
368	Q	92.2	Very high	87.7	Confident	59 Å²	59	61.3 Å²	61.3	28%	0.276	31%	0.313	S	S	.	.	G	3₁₀ helix	trans	-68.4	-15.7	176.6	-63.1	-60.2	-51.7	0	0	112.8	L175 F217 N218 E365 R366	L175-Q368 VanDerWaalsContact CD1-O 3.27Å; L175-Q368 WeakPolarHBondContact CD1-O 3.37Å; L175-Q368 PolarHBondContact O-NE2 3.13Å; L175-Q368 VanDerWaalsContact O-NE2 3.13Å; F217-Q368 HydrophobicContact CD1-CG 4.29Å; F217-Q368 HydrophobicContact CE1-CG 3.62Å; F217-Q368 HydrophobicContact CZ-CG 4.47Å; N218-Q368 WeakPolarHBondContact OD1-CG 3.35Å; N218-Q368 PolarHBondContact OD1-NE2 2.73Å; E365-Q368 PolarHBondContact O-N 3.15Å; R366-Q368 VanDerWaalsContact C-N 3.26Å; R366-Q368 PolarHBondContact O-N 2.76Å
369	G	92.5	Very high	85.3	Confident	60 Å²	60	63.9 Å²	63.9	62%	0.619	34%	0.335	S	S	*	.	G	3₁₀ helix	trans	-93.7	2.5	174.6	0	0	0	0	0	114.1	R366 I367	R366-G369 WeakPolarHBondContact O-CA 3.23Å; R366-G369 PolarHBondContact O-N 3.18Å; I367-G369 PolarHBondContact O-N 2.88Å
370	F	94	Very high	82.9	Confident	20 Å²	20	68.4 Å²	68.4	9%	0.088	36%	0.356	C	S	.	.			trans	-69	139.6	-178.4	-81.2	19.9	0	0	0	111.3	V249 A250 V276 L277 R366 I367	V249-F370 HydrophobicContact CB-CB 3.91Å; V249-F370 HydrophobicContact CG2-CB 4.08Å; A250-F370 HydrophobicContact CB-CD2 3.69Å; A250-F370 HydrophobicContact CB-CE2 3.72Å; V276-F370 HydrophobicContact CB-CE1 4Å; V276-F370 HydrophobicContact CB-CZ 3.72Å; V276-F370 HydrophobicContact CG1-CE1 4Å; V276-F370 HydrophobicContact CG1-CZ 3.73Å; V276-F370 HydrophobicContact CG2-CE1 4.18Å; V276-F370 HydrophobicContact CG2-CZ 4.38Å; L277-F370 HydrophobicContact CD2-CE2 4.04Å; L277-F370 HydrophobicContact CD2-CZ 4.42Å; L277-F370 HydrophobicContact CG-CE2 4.19Å; R366-F370 VanDerWaalsContact O-CD1 3.23Å; R366-F370 WeakPolarHBondContact O-CD1 3.42Å; I367-F370 HydrophobicContact CD1-CD2 4.27Å; I367-F370 HydrophobicContact CD1-CE1 3.93Å; I367-F370 HydrophobicContact CD1-CE2 3.59Å; I367-F370 HydrophobicContact CD1-CZ 3.39Å; I367-F370 WeakPolarHBondContact O-CB 3.44Å; I367-F370 PolarHBondContact O-N 3.49Å; I367-F370 VanDerWaalsContact O-N 3.11Å
371	I	87.2	Confident	80.5	Confident	133 Å²	133	67.5 Å²	67.5	68%	0.682	35%	0.354	S	S	*	.			trans	-110.5	138.5	177.6	-52.3	176.2	0	0	0	107.9
372	K	89.7	Confident	77.8	Confident	77 Å²	77	70.7 Å²	70.7	34%	0.335	37%	0.371	S	S	.	.	P	Polyproline II helix	trans	-59	149.5	170.6	-72.1	-162.6	174.8	-154.7	0	111	I248 G316 L317	I248-K372 VanDerWaalsContact O-CE 3.28Å; I248-K372 WeakPolarHBondContact O-CE 3.24Å; G316-K372 PolarHBondContact O-NZ 3.12Å; L317-K372 HydrophobicContact CB-CB 4.28Å; L317-K372 CarbonylContact O-C 3.41Å; L317-K372 VanDerWaalsContact O-CA 3.27Å; L317-K372 WeakPolarHBondContact O-CA 3.41Å; L317-K372 VanDerWaalsContact O-CB 3.23Å; L317-K372 WeakPolarHBondContact O-CB 3.46Å
373	L	89.5	Confident	75.1	Confident	17 Å²	17	76.2 Å²	76.2	9%	0.089	40%	0.399	C	S	.	.	P	Polyproline II helix	trans	-60.4	143.4	-179.1	-61.6	177.7	0	0	0	111.3	P270 R313 L317 P319 V401	P270-L373 HydrophobicContact CG-CD1 4.25Å; P270-L373 HydrophobicContact CG-CD2 4.13Å; P270-L373 WeakPolarHBondContact O-CD2 3.23Å; R313-L373 HydrophobicContact CG-CD1 3.6Å; L317-L373 HydrophobicContact CB-CB 4.37Å; L317-L373 PolarHBondContact O-N 3.34Å; P319-L373 HydrophobicContact CB-CD2 4.05Å; P319-L373 HydrophobicContact CB-CG 4.38Å; L373-V401 HydrophobicContact CB-CG1 3.91Å; L373-V401 HydrophobicContact CD1-CG1 3.8Å; L373-V401 HydrophobicContact CG-CG1 4.4Å
374	T	81.6	Confident	72.5	Confident	92 Å²	92	80 Å²	80	56%	0.564	41%	0.41	S	S	*	.	P	Polyproline II helix	trans	-86.4	125.2	177.3	46.8	0	0	0	0	110.3
375	P	79.4	Confident	70	Confident	35 Å²	35	80.4 Å²	80.4	23%	0.227	41%	0.414	C	S	.	.	B	Isolated β-bridge	trans	-71.8	137.1	173.9	29.7	-33.2	0	0	0	110.2	L317 N377 P399 L400	L317-P375 HydrophobicContact CD1-CG 4.41Å; L317-P375 HydrophobicContact CD2-CB 4.47Å; P375-N377 VanDerWaalsContact C-N 3.35Å; P375-P399 HydrophobicContact CB-CB 3.73Å; P375-P399 HydrophobicContact CB-CG 4.45Å; P375-L400 CarbonylContact C-O 3.6Å
376	I	71.7	Confident	67.3	Low	89 Å²	89	78.3 Å²	78.3	46%	0.456	41%	0.413	S	S	.	.	S	Bend	trans	-63.8	-41.1	176.3	-57.3	177.9	0	0	0	110.6	H378 L400 V401 T402	I376-H378 VanDerWaalsContact C-N 3.32Å; I376-H378 PolarHBondContact O-N 3.49Å; I376-L400 HydrophobicContact CB-CB 4.24Å; I376-L400 WeakPolarHBondContact CB-O 3.33Å; I376-L400 HydrophobicContact CD1-CB 4.26Å; I376-L400 WeakPolarHBondContact CG1-O 3.5Å; I376-L400 PolarHBondContact N-O 2.89Å; I376-V401 WeakPolarHBondContact CD1-O 3.34Å; I376-T402 HydrophobicContact CG1-CG2 3.89Å
377	N	61.2	Low	64.9	Low	51 Å²	51	77.2 Å²	77.2	27%	0.273	43%	0.427	S	S	.	.	S	Bend	trans	-81.9	80	-176.1	-72.6	13.5	0	0	0	110.5	P375 A379 T381	P375-N377 VanDerWaalsContact C-N 3.35Å; N377-A379 PolarHBondContact O-N 3.38Å; N377-T381 PolarHBondContact ND2-OG1 3.34Å
378	H	50.3	Low	62.4	Low	157 Å²	157	80.8 Å²	80.8	73%	0.727	45%	0.452	S	S	*	.			trans	-57.3	130.9	165.5	-82.3	-67.1	0	0	0	111	I376 E380	I376-H378 VanDerWaalsContact C-N 3.32Å; I376-H378 PolarHBondContact O-N 3.49Å; H378-E380 VanDerWaalsContact C-N 3.28Å; H378-E380 PolarHBondContact O-N 2.86Å
379	A	47.2	Very low	59.8	Low	55 Å²	55	81.4 Å²	81.4	46%	0.455	47%	0.474	S	S	.	.	S	Bend	trans	52.6	-49.2	163.4	0	0	0	0	0	119.5	N377 L382 L383	N377-A379 PolarHBondContact O-N 3.38Å; A379-L382 PolarHBondContact O-N 2.82Å; A379-L383 HydrophobicContact CB-CD1 4.32Å; A379-L383 WeakPolarHBondContact O-CB 3.22Å; A379-L383 WeakPolarHBondContact O-CG 3.02Å; A379-L383 PolarHBondContact O-N 2.03Å
380	E	44.4	Very low	57.3	Low	138 Å²	138	80.7 Å²	80.7	65%	0.645	46%	0.46	S	S	*	.	H	α-helix	trans	-71	-41.5	-168.5	-71.3	-170.3	160.3	0	0	113.8	H378 R384	H378-E380 VanDerWaalsContact C-N 3.28Å; H378-E380 PolarHBondContact O-N 2.86Å; E380-R384 WeakPolarHBondContact O-CG 3.43Å; E380-R384 PolarHBondContact O-N 2.98Å
381	T	45.7	Very low	54.8	Low	58 Å²	58	86.1 Å²	86.1	36%	0.356	50%	0.497	S	S	.	.	H	α-helix	trans	-67.8	-41.7	175.6	-44.3	0	0	0	0	110.4	N377 R384 V385	N377-T381 PolarHBondContact ND2-OG1 3.34Å; T381-R384 PolarHBondContact O-N 2.72Å; T381-V385 HydrophobicContact CG2-CG2 4.44Å; T381-V385 WeakPolarHBondContact O-CB 3.06Å; T381-V385 WeakPolarHBondContact O-CG2 3.27Å; T381-V385 PolarHBondContact O-N 3.1Å
382	L	40.5	Very low	52.7	Low	67 Å²	67	83.4 Å²	83.4	35%	0.351	48%	0.484	S	S	.	.	H	α-helix	trans	-66	-38	177.5	-69.3	173.6	0	0	0	112.3	A379 V385 S386	A379-L382 PolarHBondContact O-N 2.82Å; L382-V385 PolarHBondContact O-N 3.16Å; L382-S386 WeakPolarHBondContact O-CB 3.47Å; L382-S386 PolarHBondContact O-N 3.17Å; L382-S386 PolarHBondContact O-OG 3.46Å
383	L	39.8	Very low	50.4	Low	115 Å²	115	80.1 Å²	80.1	60%	0.602	47%	0.471	S	S	*	.	H	α-helix	trans	-67.2	-43.8	175.5	-79.7	167.8	0	0	0	111.4	A379 V385 S386 A387	A379-L383 HydrophobicContact CB-CD1 4.32Å; A379-L383 WeakPolarHBondContact O-CB 3.22Å; A379-L383 WeakPolarHBondContact O-CG 3.02Å; A379-L383 PolarHBondContact O-N 2.03Å; L383-V385 VanDerWaalsContact C-N 3.3Å; L383-V385 PolarHBondContact O-N 3.25Å; L383-S386 PolarHBondContact O-N 3.39Å; L383-A387 WeakPolarHBondContact O-CB 3.11Å; L383-A387 PolarHBondContact O-N 3.47Å
384	R	40	Very low	48.3	Very low	199 Å²	199	88.2 Å²	88.2	75%	0.751	50%	0.5	S	S	*	.	H	α-helix	trans	-64.9	-36.8	176	-72.9	-176.5	-173.7	-167.2	4.2	112.3	E380 T381	E380-R384 WeakPolarHBondContact O-CG 3.43Å; E380-R384 PolarHBondContact O-N 2.98Å; T381-R384 PolarHBondContact O-N 2.72Å
385	V	43.1	Very low	47	Very low	33 Å²	33	86.1 Å²	86.1	20%	0.2	49%	0.486	C	S	.	.	H	α-helix	trans	-73.3	-33	178	167.1	0	0	0	0	112	T381 L382 L383 S388 G393	T381-V385 HydrophobicContact CG2-CG2 4.44Å; T381-V385 WeakPolarHBondContact O-CB 3.06Å; T381-V385 WeakPolarHBondContact O-CG2 3.27Å; T381-V385 PolarHBondContact O-N 3.1Å; L382-V385 PolarHBondContact O-N 3.16Å; L383-V385 VanDerWaalsContact C-N 3.3Å; L383-V385 PolarHBondContact O-N 3.25Å; V385-S388 PolarHBondContact O-OG 2.8Å; V385-G393 WeakPolarHBondContact CG1-O 3.41Å
386	S	36.1	Very low	46	Very low	81 Å²	81	86.1 Å²	86.1	57%	0.566	49%	0.487	S	S	*	.	H	α-helix	trans	-81.9	-31.4	176.6	-58.8	0	0	0	0	112.3	L382 L383 S388 G389	L382-S386 WeakPolarHBondContact O-CB 3.47Å; L382-S386 PolarHBondContact O-N 3.17Å; L382-S386 PolarHBondContact O-OG 3.46Å; L383-S386 PolarHBondContact O-N 3.39Å; S386-S388 PolarHBondContact O-N 2.88Å; S386-G389 PolarHBondContact O-N 2.82Å
387	A	42.8	Very low	45.4	Very low	86 Å²	86	85.8 Å²	85.8	71%	0.711	49%	0.489	S	S	*	.	H	α-helix	trans	-66.9	-18.2	176.6	0	0	0	0	0	113.2	L383 G389	L383-A387 WeakPolarHBondContact O-CB 3.11Å; L383-A387 PolarHBondContact O-N 3.47Å; A387-G389 PolarHBondContact O-N 3.49Å
388	S	42.7	Very low	45.6	Very low	74 Å²	74	84.7 Å²	84.7	52%	0.517	49%	0.485	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.5	1.4	175	78.5	0	0	0	0	113.9	V385 S386 S390	V385-S388 PolarHBondContact O-OG 2.8Å; S386-S388 PolarHBondContact O-N 2.88Å; S388-S390 PolarHBondContact O-N 3.17Å; S388-S390 PolarHBondContact OG-OG 3.14Å
389	G	36.7	Very low	46.2	Very low	72 Å²	72	78.9 Å²	78.9	74%	0.742	46%	0.461	S	S	*	.			trans	59.9	5.6	169.3	0	0	0	0	0	115.7	S386 A387	S386-G389 PolarHBondContact O-N 2.82Å; A387-G389 PolarHBondContact O-N 3.49Å
390	S	39	Very low	47	Very low	46 Å²	46	80.2 Å²	80.2	32%	0.322	46%	0.46	S	S	.	.			trans	-99.1	133	179.3	70.2	0	0	0	0	108.9	S388 L392 G393	S388-S390 PolarHBondContact O-N 3.17Å; S388-S390 PolarHBondContact OG-OG 3.14Å; S390-L392 PolarHBondContact O-N 2.97Å; S390-G393 PolarHBondContact O-N 3.03Å; S390-G393 VanDerWaalsContact O-N 3.16Å
391	P	41.8	Very low	48.2	Very low	133 Å²	133	73.7 Å²	73.7	86%	0.864	43%	0.429	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.3	-11.3	173.9	-22.5	31.7	0	0	0	113.8	G393	P391-G393 PolarHBondContact O-N 3.44Å
392	L	43.5	Very low	49.1	Very low	77 Å²	77	73.1 Å²	73.1	40%	0.403	43%	0.426	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.6	-10	177.8	-76.4	147.1	0	0	0	114.4	Y140 S142 S390 S396	Y140-L392 HydrophobicContact CE1-CD2 4.11Å; S142-L392 WeakPolarHBondContact OG-CD2 3.2Å; S390-L392 PolarHBondContact O-N 2.97Å; L392-S396 WeakPolarHBondContact O-CB 3.48Å; L392-S396 PolarHBondContact O-OG 3.38Å
393	G	42.8	Very low	50.4	Low	7 Å²	7	74.8 Å²	74.8	7%	0.072	43%	0.427	C	S	.	.	H	α-helix	trans	-64.3	-63.4	-167.4	0	0	0	0	0	114.6	V385 S390 P391 N395 S396	V385-G393 WeakPolarHBondContact CG1-O 3.41Å; S390-G393 PolarHBondContact O-N 3.03Å; S390-G393 VanDerWaalsContact O-N 3.16Å; P391-G393 PolarHBondContact O-N 3.44Å; G393-N395 PolarHBondContact O-N 3.41Å; G393-S396 PolarHBondContact O-OG 3.46Å
394	R	45.2	Very low	51.9	Low	187 Å²	187	72 Å²	72	71%	0.706	42%	0.418	S	S	*	.	H	α-helix	trans	-68.9	-22.4	-167.7	-156.2	-177.7	-111.8	177.2	-3.2	113.6
395	N	54.4	Low	53.5	Low	49 Å²	49	64.1 Å²	64.1	26%	0.262	40%	0.395	S	S	.	.	H	α-helix	trans	-94.6	-17.1	-172.6	-64.1	4	0	0	0	113.4	S142 F143 H236 Y315 G393	S142-N395 CarbonylContact O-C 3.25Å; S142-N395 VanDerWaalsContact O-O 3.09Å; F143-N395 WeakPolarHBondContact CB-O 3.3Å; H236-N395 PolarHBondContact NE2-O 3.24Å; Y315-N395 VanDerWaalsContact CE1-O 3.31Å; Y315-N395 WeakPolarHBondContact CE1-O 3.46Å; G393-N395 PolarHBondContact O-N 3.41Å
396	S	58.3	Low	55.1	Low	35 Å²	35	66.4 Å²	66.4	25%	0.245	41%	0.409	C	S	.	.	H	α-helix	trans	-85.9	-33.6	-169.5	52.1	0	0	0	0	114.2	S142 R144 L392 G393	S142-S396 WeakPolarHBondContact O-CA 3.42Å; R144-S396 PolarHBondContact N-O 2.98Å; R144-S396 VanDerWaalsContact N-O 3.14Å; L392-S396 WeakPolarHBondContact O-CB 3.48Å; L392-S396 PolarHBondContact O-OG 3.38Å; G393-S396 PolarHBondContact O-OG 3.46Å
397	V	59.1	Low	57.3	Low	81 Å²	81	65.8 Å²	65.8	49%	0.491	40%	0.402	S	S	.	.	S	Bend	trans	-126.1	120.3	-177.5	-175.7	0	0	0	0	109.1
398	P	63.6	Low	59.3	Low	29 Å²	29	62.4 Å²	62.4	19%	0.188	37%	0.371	C	S	.	.	P	Polyproline II helix	trans	-68.6	142.2	-176.7	22.8	-23.5	0	0	0	110.2	D314 Y315 L400	D314-P398 HydrophobicContact CB-CB 3.78Å; Y315-P398 HydrophobicContact CD1-CB 4.36Å; Y315-P398 HydrophobicContact CD2-CB 4.35Å; Y315-P398 HydrophobicContact CE1-CB 3.9Å; Y315-P398 HydrophobicContact CE1-CG 4.46Å; Y315-P398 HydrophobicContact CE2-CB 3.92Å; Y315-P398 HydrophobicContact CE2-CG 4.25Å; Y315-P398 VanDerWaalsContact OH-CD 3.29Å; Y315-P398 WeakPolarHBondContact OH-CD 3.27Å; P398-L400 PolarHBondContact O-N 2.83Å
399	P	63	Low	61.6	Low	35 Å²	35	59.6 Å²	59.6	23%	0.227	35%	0.35	C	S	.	.	P	Polyproline II helix	trans	-61.3	138.4	165.7	28.1	-33.9	0	0	0	109.7	D314 L317 P375 V401	D314-P399 VanDerWaalsContact O-CD 3.26Å; D314-P399 WeakPolarHBondContact O-CD 3.46Å; D314-P399 VanDerWaalsContact O-CG 3.23Å; D314-P399 WeakPolarHBondContact O-CG 3.19Å; L317-P399 HydrophobicContact CD2-CG 3.97Å; P375-P399 HydrophobicContact CB-CB 3.73Å; P375-P399 HydrophobicContact CB-CG 4.45Å; P399-V401 PolarHBondContact O-N 3Å
400	L	65.2	Low	64.3	Low	83 Å²	83	56.7 Å²	56.7	44%	0.435	32%	0.318	S	S	.	.	P	Polyproline II helix	trans	-66.1	120.1	171.2	-80.7	152.1	0	0	0	108.4	P375 I376 P398	P375-L400 CarbonylContact C-O 3.6Å; I376-L400 HydrophobicContact CB-CB 4.24Å; I376-L400 WeakPolarHBondContact CB-O 3.33Å; I376-L400 HydrophobicContact CD1-CB 4.26Å; I376-L400 WeakPolarHBondContact CG1-O 3.5Å; I376-L400 PolarHBondContact N-O 2.89Å; P398-L400 PolarHBondContact O-N 2.83Å
401	V	69.4	Low	66.9	Low	1 Å²	1	54.5 Å²	54.5	1%	0.006	30%	0.303	C	S	.	.	B	Isolated β-bridge	trans	-94	151.5	173.6	-177.9	0	0	0	0	109.5	P270 L317 L373 I376 P399 R403	P270-V401 HydrophobicContact CG-CG1 4.27Å; L317-V401 HydrophobicContact CD2-CG2 3.7Å; L373-V401 HydrophobicContact CB-CG1 3.91Å; L373-V401 HydrophobicContact CD1-CG1 3.8Å; L373-V401 HydrophobicContact CG-CG1 4.4Å; I376-V401 WeakPolarHBondContact CD1-O 3.34Å; P399-V401 PolarHBondContact O-N 3Å; V401-R403 WeakPolarHBondContact O-CG 3.41Å; V401-R403 PolarHBondContact O-N 3.28Å
402	T	64.3	Low	69.3	Low	46 Å²	46	50.6 Å²	50.6	28%	0.282	27%	0.272	S	S	.	.			trans	-55.1	109.5	177.9	49.1	0	0	0	0	111.7	P270 I376	P270-T402 VanDerWaalsContact CB-O 3.25Å; P270-T402 WeakPolarHBondContact CB-O 3.48Å; P270-T402 VanDerWaalsContact CG-O 3.23Å; P270-T402 WeakPolarHBondContact CG-O 3.4Å; I376-T402 HydrophobicContact CG1-CG2 3.89Å
403	R	67.5	Low	71.5	Confident	101 Å²	101	47.9 Å²	47.9	38%	0.381	26%	0.262	S	S	.	.			trans	-102.6	6.1	177.4	-67.8	174.1	-170.8	-171	1.6	113.5	Q299 D314 V401 A405	Q299-R403 PolarHBondContact OE1-O 3.34Å; D314-R403 IonicContact OD2-NH2 3.26Å; D314-R403 PolarHBondContact OD2-NH2 2.58Å; D314-R403 VanDerWaalsContact OD2-NH2 3.15Å; V401-R403 WeakPolarHBondContact O-CG 3.41Å; V401-R403 PolarHBondContact O-N 3.28Å; R403-A405 PolarHBondContact O-N 2.92Å
404	S	71.6	Confident	73.6	Confident	58 Å²	58	50.2 Å²	50.2	41%	0.406	27%	0.273	S	S	.	.			trans	-61.6	132.3	-174.8	-175.8	0	0	0	0	111.1	T406 V407 R408	S404-T406 PolarHBondContact O-N 3.28Å; S404-T406 VanDerWaalsContact O-N 3.13Å; S404-T406 PolarHBondContact OG-N 2.9Å; S404-T406 PolarHBondContact OG-OG1 2.86Å; S404-V407 WeakPolarHBondContact O-CG2 3.32Å; S404-V407 PolarHBondContact O-N 3.35Å; S404-R408 PolarHBondContact O-NE 3.06Å
405	A	73.4	Confident	75.3	Confident	33 Å²	33	46.5 Å²	46.5	27%	0.273	26%	0.262	S	S	.	.	G	3₁₀ helix	trans	-56.8	-25.9	171.6	0	0	0	0	0	112.8	R403 V407 R408 W424	R403-A405 PolarHBondContact O-N 2.92Å; A405-V407 PolarHBondContact O-N 2.83Å; A405-R408 PolarHBondContact O-N 3.31Å; A405-W424 WeakPolarHBondContact O-CB 3.45Å; A405-W424 VanDerWaalsContact O-CD1 3.3Å
406	T	77.2	Confident	76.7	Confident	80 Å²	80	44.6 Å²	44.6	49%	0.491	25%	0.254	S	S	.	.	G	3₁₀ helix	trans	-67.8	-19.9	-176.6	62.7	0	0	0	0	114.4	S404 W424	S404-T406 PolarHBondContact O-N 3.28Å; S404-T406 VanDerWaalsContact O-N 3.13Å; S404-T406 PolarHBondContact OG-N 2.9Å; S404-T406 PolarHBondContact OG-OG1 2.86Å; T406-W424 HydrophobicContact CG2-CD2 4.49Å; T406-W424 HydrophobicContact CG2-CE3 4.03Å; T406-W424 HydrophobicContact CG2-CH2 3.76Å; T406-W424 HydrophobicContact CG2-CZ2 4.28Å; T406-W424 HydrophobicContact CG2-CZ3 3.66Å
407	V	81	Confident	77.9	Confident	69 Å²	69	47.6 Å²	47.6	42%	0.418	27%	0.271	S	S	.	.	G	3₁₀ helix	trans	-105.3	16.9	-179.1	-61.8	0	0	0	0	112.5	P270 G271 S404 A405	P270-V407 HydrophobicContact CB-CG2 4Å; G271-V407 PolarHBondContact N-O 2.9Å; S404-V407 WeakPolarHBondContact O-CG2 3.32Å; S404-V407 PolarHBondContact O-N 3.35Å; A405-V407 PolarHBondContact O-N 2.83Å
408	R	86	Confident	79.3	Confident	15 Å²	15	48.5 Å²	48.5	6%	0.057	27%	0.268	C	S	.	.	S	Bend	trans	-121.3	158.7	-176.4	-63	-172.4	-78.5	142.3	7.2	110.6	P270 E295 D296 Q299 S404 A405 W424	P270-R408 HydrophobicContact CB-CG 4.48Å; E295-R408 VanDerWaalsContact CD-NH1 3.32Å; E295-R408 WeakPolarHBondContact OE1-CD 3.36Å; E295-R408 IonicContact OE1-CZ 3.95Å; E295-R408 IonicContact OE1-NE 3.17Å; E295-R408 IonicContact OE1-NH1 3.57Å; E295-R408 PolarHBondContact OE1-NH1 3.29Å; D296-R408 IonicContact OD1-CZ 2.83Å; D296-R408 IonicContact OD1-NH1 3.69Å; D296-R408 PolarHBondContact OD1-NH1 3.32Å; D296-R408 IonicContact OD1-NH2 2.71Å; D296-R408 PolarHBondContact OD1-NH2 3.17Å; Q299-R408 VanDerWaalsContact NE2-CZ 3.27Å; S404-R408 PolarHBondContact O-NE 3.06Å; A405-R408 PolarHBondContact O-N 3.31Å; R408-W424 WeakPolarHBondContact O-CB 3.09Å; R408-W424 PolarHBondContact O-N 3.44Å
409	N	90.8	Very high	80.7	Confident	14 Å²	14	48.1 Å²	48.1	8%	0.075	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.8	147.7	165	-71.5	-33.3	0	0	0	110.8	D275 L278 I421 V422 P423	D275-N409 PolarHBondContact OD1-ND2 2.83Å; L278-N409 HydrophobicContact CD1-CB 3.96Å; N409-I421 HydrophobicContact CB-CG2 3.77Å; N409-V422 WeakPolarHBondContact CA-O 3.37Å; N409-P423 VanDerWaalsContact OD1-CA 3.28Å; N409-P423 WeakPolarHBondContact OD1-CA 3.43Å
410	V	92.4	Very high	82.2	Confident	12 Å²	12	49.2 Å²	49.2	7%	0.073	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.1	119.6	161.5	174.6	0	0	0	0	107	V292 F412 V422 W427	V292-V410 HydrophobicContact CG1-CG1 4.09Å; V410-F412 HydrophobicContact CG1-CD1 4.31Å; V410-F412 HydrophobicContact CG1-CE1 4.39Å; V410-V422 PolarHBondContact N-O 3.02Å; V410-V422 PolarHBondContact O-N 3.05Å; V410-W427 HydrophobicContact CB-CB 4.18Å; V410-W427 HydrophobicContact CB-CD2 4.44Å; V410-W427 HydrophobicContact CB-CG 4.04Å; V410-W427 HydrophobicContact CG1-CD2 3.95Å; V410-W427 HydrophobicContact CG1-CG 3.96Å; V410-W427 HydrophobicContact CG2-CB 3.89Å; V410-W427 HydrophobicContact CG2-CG 3.83Å
411	Y	93.7	Very high	83.6	Confident	0 Å²	0	47.8 Å²	47.8	0%	0	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	143.6	178.6	62	-88.4	0	0	0	111.7	L265 S266 S268 L278 A290 S291 V292 I420	L265-Y411 HydrophobicContact CD2-CD2 4.17Å; L265-Y411 HydrophobicContact CD2-CE2 3.88Å; L265-Y411 HydrophobicContact CG-CE2 3.96Å; S266-Y411 PolarHBondContact O-OH 2.88Å; S268-Y411 WeakPolarHBondContact OG-CE1 3.28Å; L278-Y411 HydrophobicContact CD1-CD1 4.02Å; L278-Y411 HydrophobicContact CD2-CD1 4.04Å; L278-Y411 HydrophobicContact CD2-CD2 4.32Å; L278-Y411 HydrophobicContact CD2-CE1 4.46Å; L278-Y411 HydrophobicContact CD2-CG 3.97Å; A290-Y411 HydrophobicContact CB-CD2 3.92Å; A290-Y411 HydrophobicContact CB-CE2 4.22Å; S291-Y411 VanDerWaalsContact C-CE2 3.5Å; S291-Y411 CarbonylContact C-O 3.59Å; S291-Y411 WeakPolarHBondContact CA-O 3.45Å; V292-Y411 HydrophobicContact CB-CD1 4.2Å; V292-Y411 HydrophobicContact CB-CE1 4.07Å; V292-Y411 HydrophobicContact CG2-CD1 4.47Å; V292-Y411 HydrophobicContact CG2-CE1 4.14Å; V292-Y411 PolarHBondContact N-O 3.24Å; Y411-I420 CarbonylContact C-O 3.55Å; Y411-I420 WeakPolarHBondContact CA-O 3.42Å
412	F	93.6	Very high	84.7	Confident	51 Å²	51	49 Å²	49	22%	0.224	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-157.9	142.8	171.7	53.9	-84.7	0	0	0	111.4	A290 V410 I420 W427	A290-F412 CarbonylContact O-C 3.52Å; A290-F412 VanDerWaalsContact O-CA 3.29Å; A290-F412 WeakPolarHBondContact O-CA 3.46Å; V410-F412 HydrophobicContact CG1-CD1 4.31Å; V410-F412 HydrophobicContact CG1-CE1 4.39Å; F412-I420 HydrophobicContact CD2-CB 4.46Å; F412-I420 HydrophobicContact CE1-CB 4.28Å; F412-I420 HydrophobicContact CE1-CG2 4.05Å; F412-I420 HydrophobicContact CE2-CB 4.07Å; F412-I420 HydrophobicContact CE2-CD1 3.75Å; F412-I420 HydrophobicContact CE2-CG1 4.35Å; F412-I420 HydrophobicContact CE2-CG2 4.46Å; F412-I420 HydrophobicContact CZ-CB 3.96Å; F412-I420 HydrophobicContact CZ-CD1 3.97Å; F412-I420 HydrophobicContact CZ-CG2 3.86Å; F412-I420 PolarHBondContact N-O 3.29Å; F412-I420 PolarHBondContact O-N 3.32Å; F412-W427 AromaticContact CE1-CH2 3.79Å; F412-W427 HydrophobicContact CE1-CH2 3.79Å; F412-W427 HydrophobicContact CE1-CZ2 4.38Å; F412-W427 AromaticContact CE1-CZ3 3.97Å; F412-W427 HydrophobicContact CE1-CZ3 3.97Å; F412-W427 AromaticContact CZ-CH2 3.93Å; F412-W427 HydrophobicContact CZ-CH2 3.93Å; F412-W427 HydrophobicContact CZ-CZ3 4.15Å
413	G	88.9	Confident	86	Confident	19 Å²	19	50.2 Å²	50.2	20%	0.196	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.3	143.7	173.4	0	0	0	0	0	111.6	A290 F418	A290-G413 PolarHBondContact O-N 2.98Å; G413-F418 CarbonylContact C-O 3.59Å; G413-F418 WeakPolarHBondContact CA-O 3.44Å
414	L	86.6	Confident	87.1	Confident	56 Å²	56	49 Å²	49	29%	0.293	27%	0.272	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	115.3	172	-153.6	82.5	0	0	0	110.4	G416 T417 F418	L414-G416 PolarHBondContact O-N 3.18Å; L414-T417 PolarHBondContact O-N 3.24Å; L414-F418 HydrophobicContact CB-CD2 3.69Å; L414-F418 HydrophobicContact CB-CE1 4.45Å; L414-F418 HydrophobicContact CB-CE2 3.34Å; L414-F418 HydrophobicContact CB-CG 4.42Å; L414-F418 HydrophobicContact CB-CZ 3.79Å; L414-F418 HydrophobicContact CD2-CD2 4.49Å; L414-F418 HydrophobicContact CD2-CE1 4.21Å; L414-F418 HydrophobicContact CD2-CE2 3.35Å; L414-F418 HydrophobicContact CD2-CZ 3.17Å; L414-F418 HydrophobicContact CG-CE2 3.92Å; L414-F418 HydrophobicContact CG-CZ 4.04Å; L414-F418 PolarHBondContact N-O 2.79Å
415	F	81.8	Confident	87.9	Confident	110 Å²	110	48.1 Å²	48.1	48%	0.482	27%	0.272	S	S	.	.	T	Hydrogen-bonded Turn	trans	47.7	29.5	176.4	-53.2	-63.8	0	0	0	114.7	I62 T417	I62-F415 HydrophobicContact CG2-CD1 3.66Å; I62-F415 HydrophobicContact CG2-CE1 3.54Å; F415-T417 PolarHBondContact O-N 2.85Å; F415-T417 PolarHBondContact O-OG1 3.41Å
416	G	82.6	Confident	88.9	Confident	8 Å²	8	50.3 Å²	50.3	8%	0.082	28%	0.283	C	S	.	.	T	Hydrogen-bonded Turn	trans	64.9	18.1	-177.1	0	0	0	0	0	115.3	R262 Q287 P288 L414	R262-G416 VanDerWaalsContact NH1-CA 3.31Å; Q287-G416 VanDerWaalsContact CA-O 3.28Å; Q287-G416 WeakPolarHBondContact CA-O 3.16Å; P288-G416 WeakPolarHBondContact O-CA 3.35Å; L414-G416 PolarHBondContact O-N 3.18Å
417	T	84.6	Confident	89.6	Confident	99 Å²	99	51.2 Å²	51.2	61%	0.607	28%	0.277	S	S	*	.	T	Hydrogen-bonded Turn	trans	-108.9	-40.7	-176.4	-51.8	0	0	0	0	111.9	L414 F415	L414-T417 PolarHBondContact O-N 3.24Å; F415-T417 PolarHBondContact O-N 2.85Å; F415-T417 PolarHBondContact O-OG1 3.41Å
418	F	88.4	Confident	90.1	Very high	100 Å²	100	52.3 Å²	52.3	44%	0.439	28%	0.276	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.3	158.3	-178.8	45.6	-91.6	0	0	0	111.4	G413 L414 I420	G413-F418 CarbonylContact C-O 3.59Å; G413-F418 WeakPolarHBondContact CA-O 3.44Å; L414-F418 HydrophobicContact CB-CD2 3.69Å; L414-F418 HydrophobicContact CB-CE1 4.45Å; L414-F418 HydrophobicContact CB-CE2 3.34Å; L414-F418 HydrophobicContact CB-CG 4.42Å; L414-F418 HydrophobicContact CB-CZ 3.79Å; L414-F418 HydrophobicContact CD2-CD2 4.49Å; L414-F418 HydrophobicContact CD2-CE1 4.21Å; L414-F418 HydrophobicContact CD2-CE2 3.35Å; L414-F418 HydrophobicContact CD2-CZ 3.17Å; L414-F418 HydrophobicContact CG-CE2 3.92Å; L414-F418 HydrophobicContact CG-CZ 4.04Å; L414-F418 PolarHBondContact N-O 2.79Å; F418-I420 HydrophobicContact CD2-CG1 4.17Å; F418-I420 HydrophobicContact CE2-CD1 4.28Å; F418-I420 HydrophobicContact CE2-CG1 4.35Å
419	V	93.1	Very high	90.5	Very high	21 Å²	21	55.5 Å²	55.5	13%	0.127	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	129.1	170.7	-172.2	0	0	0	0	108.1	Y281 A282 P288 I421	Y281-V419 HydrophobicContact CD1-CG2 4.06Å; Y281-V419 HydrophobicContact CE1-CG2 3.75Å; A282-V419 HydrophobicContact CB-CB 4.08Å; A282-V419 HydrophobicContact CB-CG2 4.36Å; P288-V419 HydrophobicContact CB-CG2 3.31Å; P288-V419 HydrophobicContact CG-CG2 3.55Å; V419-I421 HydrophobicContact CG1-CD1 4.46Å; V419-I421 HydrophobicContact CG1-CG1 3.88Å
420	I	93.7	Very high	90.7	Very high	57 Å²	57	58.2 Å²	58.2	29%	0.292	31%	0.314	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.4	126.9	168.2	-65.7	178.1	0	0	0	106.9	Y411 F412 F418 V422	Y411-I420 CarbonylContact C-O 3.55Å; Y411-I420 WeakPolarHBondContact CA-O 3.42Å; F412-I420 HydrophobicContact CD2-CB 4.46Å; F412-I420 HydrophobicContact CE1-CB 4.28Å; F412-I420 HydrophobicContact CE1-CG2 4.05Å; F412-I420 HydrophobicContact CE2-CB 4.07Å; F412-I420 HydrophobicContact CE2-CD1 3.75Å; F412-I420 HydrophobicContact CE2-CG1 4.35Å; F412-I420 HydrophobicContact CE2-CG2 4.46Å; F412-I420 HydrophobicContact CZ-CB 3.96Å; F412-I420 HydrophobicContact CZ-CD1 3.97Å; F412-I420 HydrophobicContact CZ-CG2 3.86Å; F412-I420 PolarHBondContact N-O 3.29Å; F412-I420 PolarHBondContact O-N 3.32Å; F418-I420 HydrophobicContact CD2-CG1 4.17Å; F418-I420 HydrophobicContact CE2-CD1 4.28Å; F418-I420 HydrophobicContact CE2-CG1 4.35Å; I420-V422 HydrophobicContact CG2-CG2 3.7Å
421	I	94.3	Very high	90.7	Very high	53 Å²	53	62.1 Å²	62.1	27%	0.272	34%	0.335	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	121.3	177.1	-56.5	162.3	0	0	0	107.1	L278 A282 N409 V419	L278-I421 HydrophobicContact CB-CD1 3.8Å; L278-I421 HydrophobicContact CB-CG1 4.43Å; L278-I421 HydrophobicContact CB-CG2 4.48Å; L278-I421 HydrophobicContact CD1-CG2 4.29Å; L278-I421 WeakPolarHBondContact O-CD1 3.45Å; A282-I421 HydrophobicContact CB-CD1 3.96Å; N409-I421 HydrophobicContact CB-CG2 3.77Å; V419-I421 HydrophobicContact CG1-CD1 4.46Å; V419-I421 HydrophobicContact CG1-CG1 3.88Å
422	V	93.3	Very high	90.7	Very high	27 Å²	27	67 Å²	67	16%	0.164	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.7	131.3	-175.7	-178.3	0	0	0	0	109.7	N409 V410 I420 W424 V426 W427	N409-V422 WeakPolarHBondContact CA-O 3.37Å; V410-V422 PolarHBondContact N-O 3.02Å; V410-V422 PolarHBondContact O-N 3.05Å; I420-V422 HydrophobicContact CG2-CG2 3.7Å; V422-W424 PolarHBondContact O-N 2.94Å; V422-V426 HydrophobicContact CG1-CB 3.81Å; V422-V426 HydrophobicContact CG1-CG1 3.78Å; V422-W427 HydrophobicContact CB-CE3 4.44Å; V422-W427 HydrophobicContact CG1-CB 4.09Å; V422-W427 HydrophobicContact CG1-CE3 4.39Å; V422-W427 HydrophobicContact CG2-CE3 4.48Å
423	P	91.5	Very high	90.9	Very high	71 Å²	71	69.7 Å²	69.7	46%	0.461	37%	0.373	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-56.2	137.8	172.5	-25.3	34.4	0	0	0	111.9	N409 G425 V426 W427	N409-P423 VanDerWaalsContact OD1-CA 3.28Å; N409-P423 WeakPolarHBondContact OD1-CA 3.43Å; P423-G425 PolarHBondContact O-N 3.47Å; P423-G425 VanDerWaalsContact O-N 3.14Å; P423-V426 HydrophobicContact CB-CG2 4.21Å; P423-V426 HydrophobicContact CG-CG2 4.42Å; P423-V426 WeakPolarHBondContact O-CB 3.33Å; P423-V426 PolarHBondContact O-N 3.35Å; P423-W427 PolarHBondContact O-N 2.67Å
424	W	89.7	Confident	91.1	Very high	75 Å²	75	73.2 Å²	73.2	28%	0.284	39%	0.387	S	S	.	.	H	α-helix	trans	-54.3	-39.5	-175.5	-179.3	95.8	0	0	0	113.6	A405 T406 R408 V422 V426 W427 K428	A405-W424 WeakPolarHBondContact O-CB 3.45Å; A405-W424 VanDerWaalsContact O-CD1 3.3Å; T406-W424 HydrophobicContact CG2-CD2 4.49Å; T406-W424 HydrophobicContact CG2-CE3 4.03Å; T406-W424 HydrophobicContact CG2-CH2 3.76Å; T406-W424 HydrophobicContact CG2-CZ2 4.28Å; T406-W424 HydrophobicContact CG2-CZ3 3.66Å; R408-W424 WeakPolarHBondContact O-CB 3.09Å; R408-W424 PolarHBondContact O-N 3.44Å; V422-W424 PolarHBondContact O-N 2.94Å; W424-V426 VanDerWaalsContact C-N 3.32Å; W424-V426 PolarHBondContact O-N 3.05Å; W424-W427 PolarHBondContact O-N 2.98Å; W424-K428 HydrophobicContact CE3-CB 4.4Å; W424-K428 HydrophobicContact CE3-CD 4.3Å; W424-K428 HydrophobicContact CH2-CD 3.2Å; W424-K428 HydrophobicContact CH2-CG 4.45Å; W424-K428 HydrophobicContact CZ2-CD 3.73Å; W424-K428 HydrophobicContact CZ3-CB 4.39Å; W424-K428 HydrophobicContact CZ3-CD 3.5Å; W424-K428 WeakPolarHBondContact O-CB 3.2Å; W424-K428 PolarHBondContact O-N 3.44Å
425	G	90.3	Very high	91.3	Very high	40 Å²	40	76.6 Å²	76.6	41%	0.412	40%	0.4	S	S	.	.	H	α-helix	trans	-62.4	-37.6	178.1	0	0	0	0	0	113.2	P423 T429	P423-G425 PolarHBondContact O-N 3.47Å; P423-G425 VanDerWaalsContact O-N 3.14Å; G425-T429 PolarHBondContact O-N 2.67Å; G425-T429 VanDerWaalsContact O-N 3.13Å; G425-T429 PolarHBondContact O-OG1 3.35Å
426	V	93.3	Very high	91.9	Very high	80 Å²	80	76.5 Å²	76.5	49%	0.485	40%	0.404	S	S	.	.	H	α-helix	trans	-68.9	-48	175	177.9	0	0	0	0	109.6	V422 P423 W424 K428 T429 V430	V422-V426 HydrophobicContact CG1-CB 3.81Å; V422-V426 HydrophobicContact CG1-CG1 3.78Å; P423-V426 HydrophobicContact CB-CG2 4.21Å; P423-V426 HydrophobicContact CG-CG2 4.42Å; P423-V426 WeakPolarHBondContact O-CB 3.33Å; P423-V426 PolarHBondContact O-N 3.35Å; W424-V426 VanDerWaalsContact C-N 3.32Å; W424-V426 PolarHBondContact O-N 3.05Å; V426-K428 VanDerWaalsContact C-N 3.32Å; V426-K428 PolarHBondContact O-N 3.37Å; V426-T429 WeakPolarHBondContact O-CB 3.11Å; V426-T429 PolarHBondContact O-N 3.14Å; V426-T429 VanDerWaalsContact O-N 3.09Å; V426-V430 WeakPolarHBondContact O-CG2 3.3Å; V426-V430 PolarHBondContact O-N 2.96Å
427	W	92.1	Very high	92.4	Very high	99 Å²	99	81.5 Å²	81.5	38%	0.375	42%	0.423	S	S	.	.	H	α-helix	trans	-60.1	-41.8	178.9	-172.7	-104.7	0	0	0	112.6	V410 F412 V422 P423 W424 T429 V430 N431	V410-W427 HydrophobicContact CB-CB 4.18Å; V410-W427 HydrophobicContact CB-CD2 4.44Å; V410-W427 HydrophobicContact CB-CG 4.04Å; V410-W427 HydrophobicContact CG1-CD2 3.95Å; V410-W427 HydrophobicContact CG1-CG 3.96Å; V410-W427 HydrophobicContact CG2-CB 3.89Å; V410-W427 HydrophobicContact CG2-CG 3.83Å; F412-W427 AromaticContact CE1-CH2 3.79Å; F412-W427 HydrophobicContact CE1-CH2 3.79Å; F412-W427 HydrophobicContact CE1-CZ2 4.38Å; F412-W427 AromaticContact CE1-CZ3 3.97Å; F412-W427 HydrophobicContact CE1-CZ3 3.97Å; F412-W427 AromaticContact CZ-CH2 3.93Å; F412-W427 HydrophobicContact CZ-CH2 3.93Å; F412-W427 HydrophobicContact CZ-CZ3 4.15Å; V422-W427 HydrophobicContact CB-CE3 4.44Å; V422-W427 HydrophobicContact CG1-CB 4.09Å; V422-W427 HydrophobicContact CG1-CE3 4.39Å; V422-W427 HydrophobicContact CG2-CE3 4.48Å; P423-W427 PolarHBondContact O-N 2.67Å; W424-W427 PolarHBondContact O-N 2.98Å; W427-T429 VanDerWaalsContact C-N 3.32Å; W427-T429 PolarHBondContact O-N 3.02Å; W427-V430 WeakPolarHBondContact O-CB 3.34Å; W427-V430 PolarHBondContact O-N 3.09Å; W427-N431 WeakPolarHBondContact O-CB 3.26Å; W427-N431 PolarHBondContact O-N 2.92Å
428	K	91.9	Very high	92.5	Very high	91 Å²	91	81.1 Å²	81.1	40%	0.396	42%	0.417	S	S	.	.	H	α-helix	trans	-60.8	-41.8	174.8	178.3	167.2	177.3	-179.5	0	111.8	W424 V426 N431 H432	W424-K428 HydrophobicContact CE3-CB 4.4Å; W424-K428 HydrophobicContact CE3-CD 4.3Å; W424-K428 HydrophobicContact CH2-CD 3.2Å; W424-K428 HydrophobicContact CH2-CG 4.45Å; W424-K428 HydrophobicContact CZ2-CD 3.73Å; W424-K428 HydrophobicContact CZ3-CB 4.39Å; W424-K428 HydrophobicContact CZ3-CD 3.5Å; W424-K428 WeakPolarHBondContact O-CB 3.2Å; W424-K428 PolarHBondContact O-N 3.44Å; V426-K428 VanDerWaalsContact C-N 3.32Å; V426-K428 PolarHBondContact O-N 3.37Å; K428-N431 PolarHBondContact O-N 3.39Å; K428-H432 WeakPolarHBondContact CE-NE2 3.16Å; K428-H432 WeakPolarHBondContact CG-NE2 3.34Å; K428-H432 PolarHBondContact O-CD2 3.25Å; K428-H432 PolarHBondContact O-N 2.9Å
429	T	94.8	Very high	92.3	Very high	82 Å²	82	79 Å²	79	50%	0.503	41%	0.414	S	S	.	.	H	α-helix	trans	-62.9	-45.3	175.7	-55.8	0	0	0	0	111	G425 V426 W427 N431 H432 L433	G425-T429 PolarHBondContact O-N 2.67Å; G425-T429 VanDerWaalsContact O-N 3.13Å; G425-T429 PolarHBondContact O-OG1 3.35Å; V426-T429 WeakPolarHBondContact O-CB 3.11Å; V426-T429 PolarHBondContact O-N 3.14Å; V426-T429 VanDerWaalsContact O-N 3.09Å; W427-T429 VanDerWaalsContact C-N 3.32Å; W427-T429 PolarHBondContact O-N 3.02Å; T429-N431 VanDerWaalsContact C-N 3.31Å; T429-N431 PolarHBondContact O-N 2.84Å; T429-H432 PolarHBondContact O-N 3.29Å; T429-L433 HydrophobicContact CG2-CD1 4.32Å; T429-L433 WeakPolarHBondContact O-CG 3.33Å; T429-L433 PolarHBondContact O-N 3.44Å
430	V	93.6	Very high	91.9	Very high	72 Å²	72	83.1 Å²	83.1	44%	0.436	43%	0.431	S	S	.	.	H	α-helix	trans	-57.6	-44.4	174.3	172.1	0	0	0	0	111	V426 W427 H432 L433 L434	V426-V430 WeakPolarHBondContact O-CG2 3.3Å; V426-V430 PolarHBondContact O-N 2.96Å; W427-V430 WeakPolarHBondContact O-CB 3.34Å; W427-V430 PolarHBondContact O-N 3.09Å; V430-H432 PolarHBondContact O-N 2.98Å; V430-L433 PolarHBondContact O-N 2.81Å; V430-L434 WeakPolarHBondContact O-CB 3.41Å; V430-L434 PolarHBondContact O-N 3.04Å
431	N	92.2	Very high	91.3	Very high	94 Å²	94	83.9 Å²	83.9	50%	0.503	44%	0.435	S	S	.	.	H	α-helix	trans	-63.7	-41.1	178.6	-166.6	30.7	0	0	0	112.2	W427 K428 T429 L434 F435	W427-N431 WeakPolarHBondContact O-CB 3.26Å; W427-N431 PolarHBondContact O-N 2.92Å; K428-N431 PolarHBondContact O-N 3.39Å; T429-N431 VanDerWaalsContact C-N 3.31Å; T429-N431 PolarHBondContact O-N 2.84Å; N431-L434 PolarHBondContact O-N 2.93Å; N431-F435 WeakPolarHBondContact O-CB 3.32Å; N431-F435 PolarHBondContact O-N 3.43Å
432	H	95.4	Very high	90.4	Very high	101 Å²	101	85.3 Å²	85.3	47%	0.468	44%	0.442	S	S	.	.	H	α-helix	trans	-63.9	-41.4	174.1	-71.6	-50.5	0	0	0	112.4	K428 T429 V430 F435 L436	K428-H432 WeakPolarHBondContact CE-NE2 3.16Å; K428-H432 WeakPolarHBondContact CG-NE2 3.34Å; K428-H432 PolarHBondContact O-CD2 3.25Å; K428-H432 PolarHBondContact O-N 2.9Å; T429-H432 PolarHBondContact O-N 3.29Å; V430-H432 PolarHBondContact O-N 2.98Å; H432-F435 PolarHBondContact O-N 2.74Å; H432-L436 WeakPolarHBondContact O-CG 3.26Å; H432-L436 PolarHBondContact O-N 3.45Å
433	L	96.2	Very high	89.5	Confident	108 Å²	108	90 Å²	90	57%	0.565	46%	0.46	S	S	*	.	H	α-helix	trans	-65	-40.1	175.6	-69.5	174.6	0	0	0	111.8	T429 V430 F435 L436 F437	T429-L433 HydrophobicContact CG2-CD1 4.32Å; T429-L433 WeakPolarHBondContact O-CG 3.33Å; T429-L433 PolarHBondContact O-N 3.44Å; V430-L433 PolarHBondContact O-N 2.81Å; L433-F435 VanDerWaalsContact C-N 3.35Å; L433-L436 PolarHBondContact O-N 3.44Å; L433-F437 VanDerWaalsContact O-CB 3.31Å; L433-F437 WeakPolarHBondContact O-CB 3.34Å; L433-F437 PolarHBondContact O-N 3.42Å
434	L	93.4	Very high	88.8	Confident	93 Å²	93	94.3 Å²	94.3	49%	0.487	47%	0.468	S	S	.	.	H	α-helix	trans	-62.3	-43.2	175.1	-177.8	65.6	0	0	0	111.3	V430 N431 F437 L438	V430-L434 WeakPolarHBondContact O-CB 3.41Å; V430-L434 PolarHBondContact O-N 3.04Å; N431-L434 PolarHBondContact O-N 2.93Å; L434-F437 WeakPolarHBondContact O-CB 3.43Å; L434-F437 PolarHBondContact O-N 2.99Å; L434-L438 HydrophobicContact CG-CD1 4.39Å; L434-L438 WeakPolarHBondContact O-CG 3.26Å; L434-L438 PolarHBondContact O-N 2.84Å
435	F	92.1	Very high	87.8	Confident	128 Å²	128	93.3 Å²	93.3	56%	0.561	48%	0.475	S	S	*	.	H	α-helix	trans	-61.1	-47.6	175	179.8	-98.3	0	0	0	111.8	N431 H432 L433 F437 L438 C439	N431-F435 WeakPolarHBondContact O-CB 3.32Å; N431-F435 PolarHBondContact O-N 3.43Å; H432-F435 PolarHBondContact O-N 2.74Å; L433-F435 VanDerWaalsContact C-N 3.35Å; F435-F437 VanDerWaalsContact C-N 3.29Å; F435-F437 PolarHBondContact O-N 2.95Å; F435-L438 PolarHBondContact O-N 3.15Å; F435-C439 PolarHBondContact O-N 3.43Å; F435-C439 PolarHBondContact O-SG 3.42Å; F435-C439 VanDerWaalsContact O-SG 3.37Å
436	L	93.8	Very high	86.6	Confident	107 Å²	107	95 Å²	95	56%	0.56	47%	0.469	S	S	*	.	H	α-helix	trans	-61.1	-38.3	175.7	-71.5	172.5	0	0	0	112.1	H432 L433 C439 F440	H432-L436 WeakPolarHBondContact O-CG 3.26Å; H432-L436 PolarHBondContact O-N 3.45Å; L433-L436 PolarHBondContact O-N 3.44Å; L436-C439 PolarHBondContact O-N 3.24Å; L436-F440 WeakPolarHBondContact O-CB 2.79Å; L436-F440 PolarHBondContact O-N 2.7Å
437	F	92.1	Very high	85.3	Confident	113 Å²	113	102.1 Å²	102.1	50%	0.496	49%	0.488	S	S	.	.	H	α-helix	trans	-65	-42.4	175.8	-179.8	-109.2	0	0	0	111.9	L433 L434 F435 F440 L441	L433-F437 VanDerWaalsContact O-CB 3.31Å; L433-F437 WeakPolarHBondContact O-CB 3.34Å; L433-F437 PolarHBondContact O-N 3.42Å; L434-F437 WeakPolarHBondContact O-CB 3.43Å; L434-F437 PolarHBondContact O-N 2.99Å; F435-F437 VanDerWaalsContact C-N 3.29Å; F435-F437 PolarHBondContact O-N 2.95Å; F437-F440 WeakPolarHBondContact O-CB 3.47Å; F437-F440 PolarHBondContact O-N 3.18Å; F437-L441 HydrophobicContact CD1-CD1 4.01Å; F437-L441 HydrophobicContact CD1-CG 4.39Å; F437-L441 HydrophobicContact CE1-CD1 3.51Å; F437-L441 HydrophobicContact CE1-CD2 4.5Å; F437-L441 HydrophobicContact CE1-CG 4.03Å; F437-L441 HydrophobicContact CE2-CD2 4.39Å; F437-L441 HydrophobicContact CE2-CG 4.38Å; F437-L441 HydrophobicContact CZ-CD1 3.9Å; F437-L441 HydrophobicContact CZ-CD2 4.04Å; F437-L441 HydrophobicContact CZ-CG 4.02Å; F437-L441 WeakPolarHBondContact O-CG 3.47Å; F437-L441 PolarHBondContact O-N 3.29Å
438	L	87.1	Confident	83.8	Confident	91 Å²	91	104.5 Å²	104.5	48%	0.476	51%	0.507	S	S	.	.	H	α-helix	trans	-62.1	-44	173.4	-73.6	165.7	0	0	0	111.5	L434 F435 F440 L441 I442	L434-L438 HydrophobicContact CG-CD1 4.39Å; L434-L438 WeakPolarHBondContact O-CG 3.26Å; L434-L438 PolarHBondContact O-N 2.84Å; F435-L438 PolarHBondContact O-N 3.15Å; L438-F440 VanDerWaalsContact C-N 3.31Å; L438-F440 PolarHBondContact O-N 2.73Å; L438-L441 PolarHBondContact O-N 2.93Å; L438-I442 WeakPolarHBondContact O-CG1 3.45Å; L438-I442 PolarHBondContact O-N 3.32Å
439	C	84.2	Confident	82.3	Confident	55 Å²	55	104.4 Å²	104.4	37%	0.372	51%	0.514	S	S	.	.	H	α-helix	trans	-59.4	-41.4	173.2	-67.7	0	0	0	0	112	F435 L436 I442 F443	F435-C439 PolarHBondContact O-N 3.43Å; F435-C439 PolarHBondContact O-SG 3.42Å; F435-C439 VanDerWaalsContact O-SG 3.37Å; L436-C439 PolarHBondContact O-N 3.24Å; C439-I442 PolarHBondContact O-N 3.42Å; C439-F443 WeakPolarHBondContact O-CB 3.27Å; C439-F443 PolarHBondContact O-N 3.33Å
440	F	85.1	Confident	80.6	Confident	109 Å²	109	111.3 Å²	111.3	48%	0.478	53%	0.532	S	S	.	.	H	α-helix	trans	-63.7	-43.2	175.5	170.8	-98.4	0	0	0	112.3	L436 F437 L438 I442 F443 R444	L436-F440 WeakPolarHBondContact O-CB 2.79Å; L436-F440 PolarHBondContact O-N 2.7Å; F437-F440 WeakPolarHBondContact O-CB 3.47Å; F437-F440 PolarHBondContact O-N 3.18Å; L438-F440 VanDerWaalsContact C-N 3.31Å; L438-F440 PolarHBondContact O-N 2.73Å; F440-I442 VanDerWaalsContact C-N 3.34Å; F440-I442 PolarHBondContact O-N 3.13Å; F440-F443 PolarHBondContact O-N 2.87Å; F440-R444 WeakPolarHBondContact O-CB 3.37Å; F440-R444 PolarHBondContact O-N 2.92Å
441	L	80.8	Confident	79.1	Confident	73 Å²	73	110.4 Å²	110.4	38%	0.382	53%	0.526	S	S	.	.	H	α-helix	trans	-61.3	-42.9	176.3	-73.9	179.8	0	0	0	111.6	F437 L438 F443 R444 A445	F437-L441 HydrophobicContact CD1-CD1 4.01Å; F437-L441 HydrophobicContact CD1-CG 4.39Å; F437-L441 HydrophobicContact CE1-CD1 3.51Å; F437-L441 HydrophobicContact CE1-CD2 4.5Å; F437-L441 HydrophobicContact CE1-CG 4.03Å; F437-L441 HydrophobicContact CE2-CD2 4.39Å; F437-L441 HydrophobicContact CE2-CG 4.38Å; F437-L441 HydrophobicContact CZ-CD1 3.9Å; F437-L441 HydrophobicContact CZ-CD2 4.04Å; F437-L441 HydrophobicContact CZ-CG 4.02Å; F437-L441 WeakPolarHBondContact O-CG 3.47Å; F437-L441 PolarHBondContact O-N 3.29Å; L438-L441 PolarHBondContact O-N 2.93Å; L441-F443 VanDerWaalsContact C-N 3.35Å; L441-R444 PolarHBondContact O-N 3.04Å; L441-A445 WeakPolarHBondContact O-CB 3.39Å; L441-A445 PolarHBondContact O-N 3.48Å
442	I	75.8	Confident	78	Confident	82 Å²	82	110.8 Å²	110.8	42%	0.421	52%	0.521	S	S	.	.	H	α-helix	trans	-60.3	-46.2	174.9	-69.1	167.9	0	0	0	110.4	L438 C439 F440 R444 A445 R446 F456	L438-I442 WeakPolarHBondContact O-CG1 3.45Å; L438-I442 PolarHBondContact O-N 3.32Å; C439-I442 PolarHBondContact O-N 3.42Å; F440-I442 VanDerWaalsContact C-N 3.34Å; F440-I442 PolarHBondContact O-N 3.13Å; I442-R444 VanDerWaalsContact C-N 3.35Å; I442-R444 PolarHBondContact O-N 3.43Å; I442-A445 PolarHBondContact O-N 2.85Å; I442-R446 PolarHBondContact O-N 3.31Å; I442-R446 VanDerWaalsContact O-N 3.09Å; I442-F456 HydrophobicContact CG2-CE1 4.21Å; I442-F456 HydrophobicContact CG2-CE2 3.75Å; I442-F456 HydrophobicContact CG2-CZ 3.37Å
443	F	75.3	Confident	76.8	Confident	125 Å²	125	112.8 Å²	112.8	55%	0.548	52%	0.524	S	S	.	.	H	α-helix	trans	-62.2	-40.8	177.5	-173.4	-95.5	0	0	0	112.3	C439 F440 L441 R446 R447	C439-F443 WeakPolarHBondContact O-CB 3.27Å; C439-F443 PolarHBondContact O-N 3.33Å; F440-F443 PolarHBondContact O-N 2.87Å; L441-F443 VanDerWaalsContact C-N 3.35Å; F443-R446 PolarHBondContact O-N 3.01Å; F443-R447 PolarHBondContact O-N 3.13Å
444	R	74.9	Confident	75.5	Confident	162 Å²	162	110.6 Å²	110.6	61%	0.611	52%	0.517	S	S	*	.	H	α-helix	trans	-67.8	-43.1	177.2	-172	-177.4	179.8	169.9	1.5	112	F440 L441 I442 R446 R447	F440-R444 WeakPolarHBondContact O-CB 3.37Å; F440-R444 PolarHBondContact O-N 2.92Å; L441-R444 PolarHBondContact O-N 3.04Å; I442-R444 VanDerWaalsContact C-N 3.35Å; I442-R444 PolarHBondContact O-N 3.43Å; R444-R446 PolarHBondContact O-N 2.91Å; R444-R447 WeakPolarHBondContact O-CB 3.26Å; R444-R447 PolarHBondContact O-N 2.76Å
445	A	70.2	Confident	74.4	Confident	54 Å²	54	107 Å²	107	45%	0.446	50%	0.503	S	S	.	.	H	α-helix	trans	-59.5	-37.9	177	0	0	0	0	0	111.4	L441 I442 R447 L448	L441-A445 WeakPolarHBondContact O-CB 3.39Å; L441-A445 PolarHBondContact O-N 3.48Å; I442-A445 PolarHBondContact O-N 2.85Å; A445-R447 VanDerWaalsContact C-N 3.31Å; A445-R447 PolarHBondContact O-N 2.88Å; A445-L448 WeakPolarHBondContact O-CB 3.32Å; A445-L448 PolarHBondContact O-N 2.88Å; A445-L448 VanDerWaalsContact O-N 3.11Å
446	R	65.5	Low	73.3	Confident	75 Å²	75	104 Å²	104	28%	0.283	49%	0.49	S	S	.	.	H	α-helix	trans	-62.8	-33.5	173.3	-176.5	-179.2	165.7	-143.2	-5.9	113.2	I442 F443 R444 L448 V449 V451	I442-R446 PolarHBondContact O-N 3.31Å; I442-R446 VanDerWaalsContact O-N 3.09Å; F443-R446 PolarHBondContact O-N 3.01Å; R444-R446 PolarHBondContact O-N 2.91Å; R446-L448 PolarHBondContact O-N 2.8Å; R446-L448 VanDerWaalsContact O-N 3.08Å; R446-V449 CarbonylContact O-C 3.37Å; R446-V449 PolarHBondContact O-N 2.86Å; R446-V451 PolarHBondContact NE-O 3.13Å; R446-V451 VanDerWaalsContact NE-O 3.07Å
447	R	64.4	Low	72.2	Confident	231 Å²	231	102.4 Å²	102.4	87%	0.872	48%	0.484	S	S	*	.	H	α-helix	trans	-63.1	-18.5	177.1	-156.7	-179.3	-177.2	-172.2	1.4	112.4	F443 R444 A445	F443-R447 PolarHBondContact O-N 3.13Å; R444-R447 WeakPolarHBondContact O-CB 3.26Å; R444-R447 PolarHBondContact O-N 2.76Å; A445-R447 VanDerWaalsContact C-N 3.31Å; A445-R447 PolarHBondContact O-N 2.88Å
448	L	61.9	Low	71.2	Confident	148 Å²	148	99 Å²	99	78%	0.775	48%	0.477	S	S	*	.	H	α-helix	trans	-88.5	-18.5	176.7	-60.3	167.3	0	0	0	113.3	A445 R446	A445-L448 WeakPolarHBondContact O-CB 3.32Å; A445-L448 PolarHBondContact O-N 2.88Å; A445-L448 VanDerWaalsContact O-N 3.11Å; R446-L448 PolarHBondContact O-N 2.8Å; R446-L448 VanDerWaalsContact O-N 3.08Å
449	V	59.9	Low	70.5	Confident	90 Å²	90	97.5 Å²	97.5	55%	0.545	48%	0.478	S	S	.	.	S	Bend	trans	-136.9	116.8	-176.5	-171.7	0	0	0	0	109.2	R446 V451	R446-V449 CarbonylContact O-C 3.37Å; R446-V449 PolarHBondContact O-N 2.86Å; V449-V451 VanDerWaalsContact C-N 3.31Å; V449-V451 HydrophobicContact CB-CG2 4.2Å; V449-V451 HydrophobicContact CG1-CG2 3.73Å; V449-V451 PolarHBondContact O-N 3.22Å
450	Y	59.4	Low	69.8	Low	227 Å²	227	98.9 Å²	98.9	89%	0.89	48%	0.481	S	S	*	.			trans	-69.1	84.9	-178.6	-161.8	-92.1	0	0	0	111
451	V	62	Low	69.4	Low	52 Å²	52	98.2 Å²	98.2	32%	0.315	48%	0.482	S	S	.	.			trans	-109.2	132.6	175.8	-172.1	0	0	0	0	108.6	R446 V449 F456	R446-V451 PolarHBondContact NE-O 3.13Å; R446-V451 VanDerWaalsContact NE-O 3.07Å; V449-V451 VanDerWaalsContact C-N 3.31Å; V449-V451 HydrophobicContact CB-CG2 4.2Å; V449-V451 HydrophobicContact CG1-CG2 3.73Å; V449-V451 PolarHBondContact O-N 3.22Å; V451-F456 HydrophobicContact CG1-CB 4.26Å
452	R	68	Low	69.2	Low	103 Å²	103	96.6 Å²	96.6	39%	0.389	48%	0.475	S	S	.	.			trans	-76.7	151.3	175.7	-50	173	172	-156.2	3.8	109	C454 G455 F456 D552 F553	R452-C454 PolarHBondContact O-N 3.44Å; R452-C454 VanDerWaalsContact O-N 3.13Å; R452-G455 PolarHBondContact O-N 3.32Å; R452-G455 VanDerWaalsContact O-N 3.12Å; R452-F456 PolarHBondContact O-N 2.97Å; R452-D552 WeakPolarHBondContact CD-O 3.26Å; R452-D552 IonicContact CZ-OD1 3.17Å; R452-D552 IonicContact CZ-OD2 3.15Å; R452-D552 IonicContact NE-OD1 3.65Å; R452-D552 VanDerWaalsContact NH1-C 3.32Å; R452-D552 PolarHBondContact NH1-O 3.09Å; R452-D552 IonicContact NH1-OD1 3.37Å; R452-D552 PolarHBondContact NH1-OD1 3.47Å; R452-D552 IonicContact NH1-OD2 2.74Å; R452-D552 PolarHBondContact NH1-OD2 2.68Å; R452-D552 IonicContact NH2-OD1 3.89Å; R452-D552 PolarHBondContact NH2-OD1 3.04Å; R452-D552 IonicContact NH2-OD2 3.28Å; R452-D552 PolarHBondContact NH2-OD2 3.02Å; R452-F553 WeakPolarHBondContact CA-O 3.4Å; R452-F553 WeakPolarHBondContact CB-O 3.45Å; R452-F553 WeakPolarHBondContact CG-O 3.5Å; R452-F553 PolarHBondContact N-O 3.38Å
453	W	70.4	Confident	69.2	Low	142 Å²	142	96.8 Å²	96.8	54%	0.538	47%	0.474	S	S	.	.	H	α-helix	trans	-53.1	-40.3	-174.1	-87.2	116.9	0	0	0	113.1	F456 V457	W453-F456 PolarHBondContact O-N 3.32Å; W453-V457 VanDerWaalsContact O-CG2 3.27Å; W453-V457 WeakPolarHBondContact O-CG2 3.34Å; W453-V457 PolarHBondContact O-N 3.23Å
454	C	70.3	Confident	69.5	Low	62 Å²	62	94.2 Å²	94.2	42%	0.419	47%	0.469	S	S	.	.	H	α-helix	trans	-71.3	-35.1	-177.3	-62.7	0	0	0	0	113.5	R452 F456 V457 A458 F553	R452-C454 PolarHBondContact O-N 3.44Å; R452-C454 VanDerWaalsContact O-N 3.13Å; C454-F456 VanDerWaalsContact C-N 3.35Å; C454-V457 PolarHBondContact O-N 2.88Å; C454-A458 WeakPolarHBondContact O-CB 3.36Å; C454-A458 PolarHBondContact O-N 2.86Å; C454-F553 HydrophobicContact CB-CB 4.47Å; C454-F553 HydrophobicContact CB-CD1 2.99Å; C454-F553 HydrophobicContact CB-CD2 3.99Å; C454-F553 HydrophobicContact CB-CE1 2.87Å; C454-F553 HydrophobicContact CB-CE2 3.91Å; C454-F553 HydrophobicContact CB-CG 3.56Å; C454-F553 HydrophobicContact CB-CZ 3.36Å; C454-F553 WeakPolarHBondContact SG-CE1 3.26Å
455	G	69.7	Low	69.8	Low	17 Å²	17	90.5 Å²	90.5	18%	0.175	46%	0.46	C	S	.	.	H	α-helix	trans	-64.9	-41.2	173.3	0	0	0	0	0	111.7	R452 A458 A459	R452-G455 PolarHBondContact O-N 3.32Å; R452-G455 VanDerWaalsContact O-N 3.12Å; G455-A458 PolarHBondContact O-N 2.88Å; G455-A459 WeakPolarHBondContact O-CB 3.48Å; G455-A459 PolarHBondContact O-N 2.84Å
456	F	68.9	Low	70.3	Confident	66 Å²	66	87.9 Å²	87.9	29%	0.289	44%	0.438	S	S	.	.	H	α-helix	trans	-62.1	-46.1	173.2	176.8	-98.2	0	0	0	112.4	I442 V451 R452 W453 C454 A458 A459 L460	I442-F456 HydrophobicContact CG2-CE1 4.21Å; I442-F456 HydrophobicContact CG2-CE2 3.75Å; I442-F456 HydrophobicContact CG2-CZ 3.37Å; V451-F456 HydrophobicContact CG1-CB 4.26Å; R452-F456 PolarHBondContact O-N 2.97Å; W453-F456 PolarHBondContact O-N 3.32Å; C454-F456 VanDerWaalsContact C-N 3.35Å; F456-A458 VanDerWaalsContact C-N 3.34Å; F456-A458 PolarHBondContact O-N 3.21Å; F456-A459 PolarHBondContact O-N 3.27Å; F456-L460 HydrophobicContact CE1-CD1 4.11Å; F456-L460 HydrophobicContact CZ-CD1 3.99Å; F456-L460 WeakPolarHBondContact O-CB 3.31Å; F456-L460 PolarHBondContact O-N 2.87Å
457	V	70.4	Confident	71	Confident	73 Å²	73	86.4 Å²	86.4	44%	0.442	44%	0.438	S	S	.	.	H	α-helix	trans	-62.5	-42.4	177.4	170.2	0	0	0	0	110.9	W453 C454 L460 L461	W453-V457 VanDerWaalsContact O-CG2 3.27Å; W453-V457 WeakPolarHBondContact O-CG2 3.34Å; W453-V457 PolarHBondContact O-N 3.23Å; C454-V457 PolarHBondContact O-N 2.88Å; V457-L460 PolarHBondContact O-N 3.36Å; V457-L461 HydrophobicContact CG1-CD1 4.05Å; V457-L461 HydrophobicContact CG1-CG 4.42Å; V457-L461 WeakPolarHBondContact O-CB 3.43Å; V457-L461 VanDerWaalsContact O-CG 3.31Å; V457-L461 WeakPolarHBondContact O-CG 3.44Å; V457-L461 PolarHBondContact O-N 2.91Å
458	A	71.8	Confident	72	Confident	42 Å²	42	80.4 Å²	80.4	35%	0.347	42%	0.422	S	S	.	.	H	α-helix	trans	-61.4	-46.1	176	0	0	0	0	0	111.7	C454 G455 F456 L460 L461 V462	C454-A458 WeakPolarHBondContact O-CB 3.36Å; C454-A458 PolarHBondContact O-N 2.86Å; G455-A458 PolarHBondContact O-N 2.88Å; F456-A458 VanDerWaalsContact C-N 3.34Å; F456-A458 PolarHBondContact O-N 3.21Å; A458-L460 VanDerWaalsContact C-N 3.34Å; A458-L460 PolarHBondContact O-N 3.03Å; A458-L461 PolarHBondContact O-N 3.04Å; A458-V462 WeakPolarHBondContact O-CG2 3.27Å; A458-V462 PolarHBondContact O-N 2.72Å
459	A	70.9	Confident	73.2	Confident	60 Å²	60	76.6 Å²	76.6	50%	0.496	40%	0.403	S	S	.	.	H	α-helix	trans	-61.6	-41.4	176.4	0	0	0	0	0	112.2	G455 F456 V462 Q463	G455-A459 WeakPolarHBondContact O-CB 3.48Å; G455-A459 PolarHBondContact O-N 2.84Å; F456-A459 PolarHBondContact O-N 3.27Å; A459-V462 PolarHBondContact O-N 3.11Å; A459-Q463 WeakPolarHBondContact O-CB 3.47Å; A459-Q463 PolarHBondContact O-N 3.03Å
460	L	71.5	Confident	74.3	Confident	84 Å²	84	72.5 Å²	72.5	44%	0.44	38%	0.378	S	S	.	.	H	α-helix	trans	-64.5	-42.8	176.5	-171.8	137.1	0	0	0	111.5	F456 V457 A458 Q463 V464	F456-L460 HydrophobicContact CE1-CD1 4.11Å; F456-L460 HydrophobicContact CZ-CD1 3.99Å; F456-L460 WeakPolarHBondContact O-CB 3.31Å; F456-L460 PolarHBondContact O-N 2.87Å; V457-L460 PolarHBondContact O-N 3.36Å; A458-L460 VanDerWaalsContact C-N 3.34Å; A458-L460 PolarHBondContact O-N 3.03Å; L460-Q463 PolarHBondContact O-N 3.12Å; L460-V464 HydrophobicContact CD2-CG2 4.31Å; L460-V464 VanDerWaalsContact O-CG2 3.29Å; L460-V464 WeakPolarHBondContact O-CG2 3.41Å; L460-V464 PolarHBondContact O-N 2.71Å
461	L	76.1	Confident	75.4	Confident	94 Å²	94	68.3 Å²	68.3	49%	0.492	37%	0.365	S	S	.	.	H	α-helix	trans	-62.2	-45.1	174.6	-73.6	172.1	0	0	0	111.8	V457 A458 Q463 V464 I465	V457-L461 HydrophobicContact CG1-CD1 4.05Å; V457-L461 HydrophobicContact CG1-CG 4.42Å; V457-L461 WeakPolarHBondContact O-CB 3.43Å; V457-L461 VanDerWaalsContact O-CG 3.31Å; V457-L461 WeakPolarHBondContact O-CG 3.44Å; V457-L461 PolarHBondContact O-N 2.91Å; A458-L461 PolarHBondContact O-N 3.04Å; L461-Q463 VanDerWaalsContact C-N 3.3Å; L461-Q463 PolarHBondContact O-N 2.91Å; L461-V464 PolarHBondContact O-N 2.87Å; L461-I465 WeakPolarHBondContact O-CB 3.47Å; L461-I465 VanDerWaalsContact O-CG1 3.26Å; L461-I465 WeakPolarHBondContact O-CG1 3.38Å; L461-I465 PolarHBondContact O-N 2.75Å
462	V	75.7	Confident	76.6	Confident	39 Å²	39	69.9 Å²	69.9	24%	0.236	37%	0.374	C	S	.	.	H	α-helix	trans	-58.1	-44	174.9	166.2	0	0	0	0	110.8	A458 A459 I465 T466 F517	A458-V462 WeakPolarHBondContact O-CG2 3.27Å; A458-V462 PolarHBondContact O-N 2.72Å; A459-V462 PolarHBondContact O-N 3.11Å; V462-I465 PolarHBondContact O-N 2.99Å; V462-T466 VanDerWaalsContact O-CB 3.29Å; V462-T466 WeakPolarHBondContact O-CB 3.33Å; V462-T466 PolarHBondContact O-N 3.48Å; V462-T466 PolarHBondContact O-OG1 3.08Å; V462-F517 HydrophobicContact CB-CE1 4.38Å; V462-F517 HydrophobicContact CG1-CD1 3.74Å; V462-F517 HydrophobicContact CG1-CD2 3.7Å; V462-F517 HydrophobicContact CG1-CE1 3.76Å; V462-F517 HydrophobicContact CG1-CE2 3.74Å; V462-F517 HydrophobicContact CG1-CG 3.71Å; V462-F517 HydrophobicContact CG1-CZ 3.77Å; V462-F517 HydrophobicContact CG2-CD1 4.12Å; V462-F517 HydrophobicContact CG2-CE1 3.94Å
463	Q	77.2	Confident	77.6	Confident	86 Å²	86	67.7 Å²	67.7	40%	0.402	37%	0.368	S	S	.	.	H	α-helix	trans	-65.5	-41.1	178.1	-172.1	61.6	24.2	0	0	112.4	A459 L460 L461 T466 T467	A459-Q463 WeakPolarHBondContact O-CB 3.47Å; A459-Q463 PolarHBondContact O-N 3.03Å; L460-Q463 PolarHBondContact O-N 3.12Å; L461-Q463 VanDerWaalsContact C-N 3.3Å; L461-Q463 PolarHBondContact O-N 2.91Å; Q463-T466 PolarHBondContact O-N 2.99Å; Q463-T467 WeakPolarHBondContact O-CB 3.07Å; Q463-T467 PolarHBondContact O-N 3.41Å; Q463-T467 PolarHBondContact O-OG1 3.37Å
464	V	80.6	Confident	78.2	Confident	72 Å²	72	62.1 Å²	62.1	44%	0.436	35%	0.35	S	S	.	.	H	α-helix	trans	-62.7	-49.8	175.5	169.5	0	0	0	0	110.5	L460 L461 T466 T467 L468	L460-V464 HydrophobicContact CD2-CG2 4.31Å; L460-V464 VanDerWaalsContact O-CG2 3.29Å; L460-V464 WeakPolarHBondContact O-CG2 3.41Å; L460-V464 PolarHBondContact O-N 2.71Å; L461-V464 PolarHBondContact O-N 2.87Å; V464-T466 VanDerWaalsContact C-N 3.33Å; V464-T466 PolarHBondContact O-N 2.88Å; V464-T467 PolarHBondContact O-N 3.14Å; V464-L468 HydrophobicContact CG1-CD1 4.02Å; V464-L468 HydrophobicContact CG1-CG 4.47Å; V464-L468 WeakPolarHBondContact O-CG 3.49Å; V464-L468 PolarHBondContact O-N 2.9Å
465	I	81	Confident	78.9	Confident	83 Å²	83	63.5 Å²	63.5	43%	0.426	36%	0.357	S	S	.	.	H	α-helix	trans	-58.4	-46.6	177.9	-68.9	165.6	0	0	0	110.5	L461 V462 T467 L468 L469	L461-I465 WeakPolarHBondContact O-CB 3.47Å; L461-I465 VanDerWaalsContact O-CG1 3.26Å; L461-I465 WeakPolarHBondContact O-CG1 3.38Å; L461-I465 PolarHBondContact O-N 2.75Å; V462-I465 PolarHBondContact O-N 2.99Å; I465-T467 VanDerWaalsContact C-N 3.31Å; I465-T467 PolarHBondContact O-N 3.27Å; I465-L468 PolarHBondContact O-N 3Å; I465-L469 HydrophobicContact CG2-CD1 3.93Å; I465-L469 HydrophobicContact CG2-CG 4.42Å; I465-L469 WeakPolarHBondContact O-CB 3.5Å; I465-L469 WeakPolarHBondContact O-CG 3.39Å; I465-L469 PolarHBondContact O-N 3.32Å
466	T	81	Confident	79.8	Confident	0 Å²	0	66.2 Å²	66.2	0%	0	37%	0.369	C	S	.	.	H	α-helix	trans	-59.4	-42.9	177.9	-59.2	0	0	0	0	111.7	V462 Q463 V464 G470 W508 F509 S512 F517	V462-T466 VanDerWaalsContact O-CB 3.29Å; V462-T466 WeakPolarHBondContact O-CB 3.33Å; V462-T466 PolarHBondContact O-N 3.48Å; V462-T466 PolarHBondContact O-OG1 3.08Å; Q463-T466 PolarHBondContact O-N 2.99Å; V464-T466 VanDerWaalsContact C-N 3.33Å; V464-T466 PolarHBondContact O-N 2.88Å; T466-G470 PolarHBondContact O-N 3.06Å; T466-W508 PolarHBondContact O-NE1 3.24Å; T466-F509 HydrophobicContact CG2-CD1 3.83Å; T466-F509 HydrophobicContact CG2-CE1 4Å; T466-S512 WeakPolarHBondContact CG2-OG 3.36Å; T466-F517 WeakPolarHBondContact OG1-CE2 3.41Å
467	T	81.2	Confident	80.5	Confident	43 Å²	43	64.3 Å²	64.3	26%	0.264	36%	0.362	S	S	.	.	H	α-helix	trans	-66.2	-45.2	-180	-56.7	0	0	0	0	111	Q463 V464 I465 G470 F471 F509	Q463-T467 WeakPolarHBondContact O-CB 3.07Å; Q463-T467 PolarHBondContact O-N 3.41Å; Q463-T467 PolarHBondContact O-OG1 3.37Å; V464-T467 PolarHBondContact O-N 3.14Å; I465-T467 VanDerWaalsContact C-N 3.31Å; I465-T467 PolarHBondContact O-N 3.27Å; T467-G470 PolarHBondContact O-N 3.31Å; T467-G470 VanDerWaalsContact O-N 3.15Å; T467-F471 HydrophobicContact CG2-CD2 4.16Å; T467-F471 HydrophobicContact CG2-CE2 3.79Å; T467-F471 VanDerWaalsContact O-CD2 3.25Å; T467-F471 WeakPolarHBondContact O-CD2 3.4Å; T467-F471 PolarHBondContact O-N 2.9Å; T467-F509 HydrophobicContact CG2-CZ 4.36Å
468	L	84.5	Confident	81.1	Confident	105 Å²	105	62.1 Å²	62.1	55%	0.55	35%	0.354	S	S	.	.	H	α-helix	trans	-61	-45.9	176.7	-70.6	173.4	0	0	0	112	V464 I465 G470 F471 V472	V464-L468 HydrophobicContact CG1-CD1 4.02Å; V464-L468 HydrophobicContact CG1-CG 4.47Å; V464-L468 WeakPolarHBondContact O-CG 3.49Å; V464-L468 PolarHBondContact O-N 2.9Å; I465-L468 PolarHBondContact O-N 3Å; L468-G470 VanDerWaalsContact C-N 3.26Å; L468-G470 PolarHBondContact O-N 3.45Å; L468-F471 WeakPolarHBondContact O-CB 3.28Å; L468-F471 PolarHBondContact O-N 3.32Å; L468-V472 WeakPolarHBondContact O-CG2 3.26Å; L468-V472 PolarHBondContact O-N 3.48Å
469	L	86.2	Confident	81.8	Confident	69 Å²	69	65.3 Å²	65.3	36%	0.361	37%	0.365	S	S	.	.	H	α-helix	trans	-65	-30.7	175.7	-70.3	173.8	0	0	0	112.2	I465 V472 F473 W508	I465-L469 HydrophobicContact CG2-CD1 3.93Å; I465-L469 HydrophobicContact CG2-CG 4.42Å; I465-L469 WeakPolarHBondContact O-CB 3.5Å; I465-L469 WeakPolarHBondContact O-CG 3.39Å; I465-L469 PolarHBondContact O-N 3.32Å; L469-V472 PolarHBondContact O-N 3.04Å; L469-F473 WeakPolarHBondContact O-CB 3.41Å; L469-F473 PolarHBondContact O-N 2.84Å; L469-W508 HydrophobicContact CB-CH2 3.8Å; L469-W508 HydrophobicContact CB-CZ2 3.19Å; L469-W508 HydrophobicContact CD1-CH2 4.37Å; L469-W508 HydrophobicContact CD1-CZ2 4.04Å; L469-W508 HydrophobicContact CG-CZ2 4.24Å
470	G	84.3	Confident	82.5	Confident	3 Å²	3	67 Å²	67	3%	0.031	36%	0.364	C	S	.	.	H	α-helix	trans	-65.9	-38.5	173.3	0	0	0	0	0	112.8	T466 T467 L468 F473 S474 W508	T466-G470 PolarHBondContact O-N 3.06Å; T467-G470 PolarHBondContact O-N 3.31Å; T467-G470 VanDerWaalsContact O-N 3.15Å; L468-G470 VanDerWaalsContact C-N 3.26Å; L468-G470 PolarHBondContact O-N 3.45Å; G470-F473 PolarHBondContact O-N 2.04Å; G470-S474 PolarHBondContact O-N 2.88Å; G470-S474 PolarHBondContact O-OG 3.22Å; G470-W508 VanDerWaalsContact CA-NE1 3.28Å; G470-W508 VanDerWaalsContact N-NE1 3.19Å
471	F	82.7	Confident	83.1	Confident	140 Å²	140	65.6 Å²	65.6	61%	0.614	35%	0.353	S	S	*	.	H	α-helix	trans	-63.3	-45.9	170.6	-79.1	-69.2	0	0	0	111.4	T467 L468 F473 S474 V475	T467-F471 HydrophobicContact CG2-CD2 4.16Å; T467-F471 HydrophobicContact CG2-CE2 3.79Å; T467-F471 VanDerWaalsContact O-CD2 3.25Å; T467-F471 WeakPolarHBondContact O-CD2 3.4Å; T467-F471 PolarHBondContact O-N 2.9Å; L468-F471 WeakPolarHBondContact O-CB 3.28Å; L468-F471 PolarHBondContact O-N 3.32Å; F471-F473 VanDerWaalsContact C-N 3.32Å; F471-F473 PolarHBondContact O-N 2.92Å; F471-S474 WeakPolarHBondContact O-CB 3.31Å; F471-S474 PolarHBondContact O-N 3.25Å; F471-S474 VanDerWaalsContact O-N 3.16Å; F471-V475 WeakPolarHBondContact O-CG2 3.33Å; F471-V475 PolarHBondContact O-N 3.3Å
472	V	87.1	Confident	83.5	Confident	84 Å²	84	65.5 Å²	65.5	51%	0.509	35%	0.35	S	S	.	.	H	α-helix	trans	-58.7	-44.5	176	174.6	0	0	0	0	111.1	L468 L469 S474 V475 V476	L468-V472 WeakPolarHBondContact O-CG2 3.26Å; L468-V472 PolarHBondContact O-N 3.48Å; L469-V472 PolarHBondContact O-N 3.04Å; V472-S474 VanDerWaalsContact C-N 3.32Å; V472-S474 PolarHBondContact O-N 3.4Å; V472-V475 PolarHBondContact O-N 3.3Å; V472-V476 HydrophobicContact CG1-CG2 4.44Å; V472-V476 WeakPolarHBondContact O-CG2 3.47Å; V472-V476 PolarHBondContact O-N 3.37Å
473	F	87.2	Confident	84	Confident	58 Å²	58	71 Å²	71	25%	0.254	37%	0.373	S	S	.	.	H	α-helix	trans	-58.9	-43.4	175.9	176.1	-107.1	0	0	0	112.1	L469 G470 F471 V475 V476 L477 P504 W507 W508	L469-F473 WeakPolarHBondContact O-CB 3.41Å; L469-F473 PolarHBondContact O-N 2.84Å; G470-F473 PolarHBondContact O-N 2.04Å; F471-F473 VanDerWaalsContact C-N 3.32Å; F471-F473 PolarHBondContact O-N 2.92Å; F473-V475 VanDerWaalsContact C-N 3.34Å; F473-V475 PolarHBondContact O-N 2.99Å; F473-V476 PolarHBondContact O-N 3.01Å; F473-L477 WeakPolarHBondContact O-CB 3.37Å; F473-L477 PolarHBondContact O-N 3.24Å; F473-P504 HydrophobicContact CE1-CB 3.6Å; F473-P504 WeakPolarHBondContact CE1-O 3.45Å; F473-P504 HydrophobicContact CZ-CB 4.28Å; F473-W507 HydrophobicContact CE1-CE3 4.38Å; F473-W507 HydrophobicContact CE2-CZ3 4.32Å; F473-W507 HydrophobicContact CZ-CE3 4.1Å; F473-W507 HydrophobicContact CZ-CZ3 4.1Å; F473-W508 HydrophobicContact CB-CD2 4.28Å; F473-W508 HydrophobicContact CB-CE3 3.94Å; F473-W508 HydrophobicContact CB-CZ3 4.4Å; F473-W508 HydrophobicContact CD1-CB 4.08Å; F473-W508 HydrophobicContact CD1-CE3 4.37Å; F473-W508 HydrophobicContact CD2-CE3 4.21Å; F473-W508 HydrophobicContact CE1-CB 4.43Å; F473-W508 HydrophobicContact CG-CD2 4.48Å; F473-W508 AromaticContact CG-CE3 3.92Å; F473-W508 HydrophobicContact CG-CE3 3.92Å
474	S	84.6	Confident	84.4	Confident	25 Å²	25	75 Å²	75	18%	0.175	39%	0.385	C	S	.	.	H	α-helix	trans	-64.1	-39	177.2	-55.7	0	0	0	0	111.9	G470 F471 V472 L477 G478 V505	G470-S474 PolarHBondContact O-N 2.88Å; G470-S474 PolarHBondContact O-OG 3.22Å; F471-S474 WeakPolarHBondContact O-CB 3.31Å; F471-S474 PolarHBondContact O-N 3.25Å; F471-S474 VanDerWaalsContact O-N 3.16Å; V472-S474 VanDerWaalsContact C-N 3.32Å; V472-S474 PolarHBondContact O-N 3.4Å; S474-L477 PolarHBondContact O-N 3.02Å; S474-G478 PolarHBondContact O-N 3.43Å; S474-V505 VanDerWaalsContact OG-CG2 3.25Å; S474-V505 WeakPolarHBondContact OG-CG2 3Å
475	V	84.9	Confident	84.5	Confident	91 Å²	91	74.1 Å²	74.1	55%	0.552	39%	0.391	S	S	*	.	H	α-helix	trans	-65.2	-46.3	174.8	171.4	0	0	0	0	111.1	F471 V472 F473 L477 G478 L479	F471-V475 WeakPolarHBondContact O-CG2 3.33Å; F471-V475 PolarHBondContact O-N 3.3Å; V472-V475 PolarHBondContact O-N 3.3Å; F473-V475 VanDerWaalsContact C-N 3.34Å; F473-V475 PolarHBondContact O-N 2.99Å; V475-L477 VanDerWaalsContact C-N 3.31Å; V475-L477 PolarHBondContact O-N 3.17Å; V475-G478 WeakPolarHBondContact O-CA 3.31Å; V475-G478 PolarHBondContact O-N 2.7Å; V475-G478 VanDerWaalsContact O-N 3.17Å; V475-L479 HydrophobicContact CG1-CD1 4.26Å; V475-L479 WeakPolarHBondContact O-CG 3.31Å; V475-L479 PolarHBondContact O-N 3.21Å
476	V	87.9	Confident	84.3	Confident	73 Å²	73	72.9 Å²	72.9	44%	0.442	39%	0.389	S	S	.	.	H	α-helix	trans	-59.6	-44	176.9	170.6	0	0	0	0	110.7	V472 F473 G478 L479 M480	V472-V476 HydrophobicContact CG1-CG2 4.44Å; V472-V476 WeakPolarHBondContact O-CG2 3.47Å; V472-V476 PolarHBondContact O-N 3.37Å; F473-V476 PolarHBondContact O-N 3.01Å; V476-G478 VanDerWaalsContact C-N 3.33Å; V476-G478 PolarHBondContact O-N 2.96Å; V476-L479 WeakPolarHBondContact O-CB 3.45Å; V476-L479 PolarHBondContact O-N 3.3Å; V476-L479 VanDerWaalsContact O-N 3.17Å; V476-M480 WeakPolarHBondContact O-CG 3.33Å; V476-M480 PolarHBondContact O-N 2.95Å
477	L	84.3	Confident	83.9	Confident	26 Å²	26	80.1 Å²	80.1	14%	0.136	42%	0.417	C	S	.	.	H	α-helix	trans	-63.2	-41.2	176.8	-173.6	64.3	0	0	0	111.7	F473 S474 V475 L479 M480 Y481 M500 P504	F473-L477 WeakPolarHBondContact O-CB 3.37Å; F473-L477 PolarHBondContact O-N 3.24Å; S474-L477 PolarHBondContact O-N 3.02Å; V475-L477 VanDerWaalsContact C-N 3.31Å; V475-L477 PolarHBondContact O-N 3.17Å; L477-L479 VanDerWaalsContact C-N 3.34Å; L477-L479 PolarHBondContact O-N 2.77Å; L477-M480 WeakPolarHBondContact O-CB 3.49Å; L477-M480 PolarHBondContact O-N 2.92Å; L477-Y481 HydrophobicContact CD1-CE1 4.32Å; L477-Y481 HydrophobicContact CD1-CE2 4.04Å; L477-Y481 HydrophobicContact CD2-CE2 3.92Å; L477-Y481 HydrophobicContact CG-CD2 4.18Å; L477-Y481 HydrophobicContact CG-CE2 3.48Å; L477-Y481 VanDerWaalsContact CG-CE2 3.48Å; L477-Y481 WeakPolarHBondContact O-CD2 3.19Å; L477-Y481 PolarHBondContact O-N 3.25Å; L477-M500 WeakPolarHBondContact CD2-O 3.24Å; L477-P504 HydrophobicContact CD2-CB 3.56Å; L477-P504 HydrophobicContact CD2-CG 3.5Å
478	G	83.5	Confident	83.4	Confident	27 Å²	27	83.4 Å²	83.4	28%	0.278	43%	0.43	S	S	.	.	H	α-helix	trans	-57.8	-43.1	171.2	0	0	0	0	0	113	S474 V475 V476 Y481 H482	S474-G478 PolarHBondContact O-N 3.43Å; V475-G478 WeakPolarHBondContact O-CA 3.31Å; V475-G478 PolarHBondContact O-N 2.7Å; V475-G478 VanDerWaalsContact O-N 3.17Å; V476-G478 VanDerWaalsContact C-N 3.33Å; V476-G478 PolarHBondContact O-N 2.96Å; G478-Y481 PolarHBondContact O-N 3.16Å; G478-H482 WeakPolarHBondContact O-CB 3.36Å; G478-H482 PolarHBondContact O-N 2.84Å
479	L	85.9	Confident	82.9	Confident	109 Å²	109	81 Å²	81	57%	0.571	42%	0.42	S	S	*	.	H	α-helix	trans	-66.2	-35.6	175.4	-69.1	172.8	0	0	0	112.2	V475 V476 L477 H482 H483	V475-L479 HydrophobicContact CG1-CD1 4.26Å; V475-L479 WeakPolarHBondContact O-CG 3.31Å; V475-L479 PolarHBondContact O-N 3.21Å; V476-L479 WeakPolarHBondContact O-CB 3.45Å; V476-L479 PolarHBondContact O-N 3.3Å; V476-L479 VanDerWaalsContact O-N 3.17Å; L477-L479 VanDerWaalsContact C-N 3.34Å; L477-L479 PolarHBondContact O-N 2.77Å; L479-H482 WeakPolarHBondContact O-CB 3.1Å; L479-H482 PolarHBondContact O-N 2.91Å; L479-H483 PolarHBondContact O-N 3.19Å
480	M	86.2	Confident	82.3	Confident	95 Å²	95	81.4 Å²	81.4	47%	0.468	42%	0.417	S	S	.	.	H	α-helix	trans	-63.8	-48.5	172.9	-70.5	179.7	68.2	0	0	111.1	V476 L477 H482 H483 Y484	V476-M480 WeakPolarHBondContact O-CG 3.33Å; V476-M480 PolarHBondContact O-N 2.95Å; L477-M480 WeakPolarHBondContact O-CB 3.49Å; L477-M480 PolarHBondContact O-N 2.92Å; M480-H482 PolarHBondContact O-N 3.49Å; M480-H483 WeakPolarHBondContact O-CB 3.17Å; M480-H483 PolarHBondContact O-N 3.38Å; M480-H483 VanDerWaalsContact O-N 3.07Å; M480-Y484 VanDerWaalsContact O-CD2 3.24Å; M480-Y484 WeakPolarHBondContact O-CD2 3.44Å; M480-Y484 PolarHBondContact O-N 2.84Å; M480-Y484 VanDerWaalsContact O-N 3.08Å
481	Y	83.9	Confident	81.6	Confident	56 Å²	56	85.3 Å²	85.3	22%	0.22	43%	0.431	C	S	.	.	H	α-helix	trans	-58.6	-38.4	174.8	-63.5	-45.1	0	0	0	112.1	L477 G478 Y484 G485 C486 M500	L477-Y481 HydrophobicContact CD1-CE1 4.32Å; L477-Y481 HydrophobicContact CD1-CE2 4.04Å; L477-Y481 HydrophobicContact CD2-CE2 3.92Å; L477-Y481 HydrophobicContact CG-CD2 4.18Å; L477-Y481 HydrophobicContact CG-CE2 3.48Å; L477-Y481 VanDerWaalsContact CG-CE2 3.48Å; L477-Y481 WeakPolarHBondContact O-CD2 3.19Å; L477-Y481 PolarHBondContact O-N 3.25Å; G478-Y481 PolarHBondContact O-N 3.16Å; Y481-Y484 PolarHBondContact O-N 3.27Å; Y481-G485 PolarHBondContact O-N 2.94Å; Y481-C486 CarbonylContact O-C 3.09Å; Y481-C486 PolarHBondContact O-N 3.33Å; Y481-M500 HydrophobicContact CD1-CE 4.07Å; Y481-M500 HydrophobicContact CD2-CE 3.19Å; Y481-M500 HydrophobicContact CE1-CE 4.31Å; Y481-M500 HydrophobicContact CE2-CB 3.7Å; Y481-M500 HydrophobicContact CE2-CE 3.45Å; Y481-M500 VanDerWaalsContact CE2-CE 3.45Å; Y481-M500 HydrophobicContact CE2-CG 3.87Å; Y481-M500 HydrophobicContact CG-CE 3.53Å; Y481-M500 WeakPolarHBondContact OH-CA 3.5Å
482	H	83	Confident	80.9	Confident	91 Å²	91	81.8 Å²	81.8	42%	0.421	42%	0.424	S	S	.	.	H	α-helix	trans	-61.5	-42.3	174.4	176.9	95.4	0	0	0	112.6	G478 L479 M480 G485 R487	G478-H482 WeakPolarHBondContact O-CB 3.36Å; G478-H482 PolarHBondContact O-N 2.84Å; L479-H482 WeakPolarHBondContact O-CB 3.1Å; L479-H482 PolarHBondContact O-N 2.91Å; M480-H482 PolarHBondContact O-N 3.49Å; H482-G485 PolarHBondContact O-N 3.41Å; H482-R487 HydrophobicContact CB-CG 4.45Å; H482-R487 PolarHBondContact CE1-NE 2.98Å; H482-R487 VanDerWaalsContact CE1-NE 3.3Å; H482-R487 PolarHBondContact CE1-NH1 3.4Å; H482-R487 PolarHBondContact CE1-NH2 2.83Å; H482-R487 PolarHBondContact ND1-NE 3.37Å; H482-R487 VanDerWaalsContact ND1-NE 3.17Å; H482-R487 PolarHBondContact NE2-NH2 3.27Å; H482-R487 PolarHBondContact O-NE 2.93Å
483	H	87.2	Confident	80.3	Confident	154 Å²	154	81.1 Å²	81.1	71%	0.713	42%	0.418	S	S	*	.	H	α-helix	trans	-65	-38.6	178.8	-172.8	68.6	0	0	0	112.4	L479 M480 G485	L479-H483 PolarHBondContact O-N 3.19Å; M480-H483 WeakPolarHBondContact O-CB 3.17Å; M480-H483 PolarHBondContact O-N 3.38Å; M480-H483 VanDerWaalsContact O-N 3.07Å; H483-G485 PolarHBondContact O-N 3.3Å
484	Y	86.2	Confident	79.6	Confident	170 Å²	170	81.7 Å²	81.7	67%	0.667	42%	0.421	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.7	4.7	177.4	-73.3	-72.4	0	0	0	114.5	M480 Y481 C486	M480-Y484 VanDerWaalsContact O-CD2 3.24Å; M480-Y484 WeakPolarHBondContact O-CD2 3.44Å; M480-Y484 PolarHBondContact O-N 2.84Å; M480-Y484 VanDerWaalsContact O-N 3.08Å; Y481-Y484 PolarHBondContact O-N 3.27Å; Y484-C486 PolarHBondContact O-N 2.94Å
485	G	81.1	Confident	79.2	Confident	55 Å²	55	88.3 Å²	88.3	57%	0.567	44%	0.443	S	S	*	.	T	Hydrogen-bonded Turn	trans	71.7	5.1	-178.5	0	0	0	0	0	114.3	Y481 H482 H483 R487	Y481-G485 PolarHBondContact O-N 2.94Å; H482-G485 PolarHBondContact O-N 3.41Å; H483-G485 PolarHBondContact O-N 3.3Å; G485-R487 PolarHBondContact O-N 3.48Å
486	C	76.6	Confident	79	Confident	56 Å²	56	86.4 Å²	86.4	38%	0.378	43%	0.43	S	S	.	.			trans	-81.4	42.4	173.4	-58.4	0	0	0	0	111.2	Y481 Y484 V489	Y481-C486 CarbonylContact O-C 3.09Å; Y481-C486 PolarHBondContact O-N 3.33Å; Y484-C486 PolarHBondContact O-N 2.94Å; C486-V489 HydrophobicContact CB-CG2 3.77Å; C486-V489 WeakPolarHBondContact O-CG2 3.41Å
487	R	73.9	Confident	78.5	Confident	153 Å²	153	84.7 Å²	84.7	58%	0.577	42%	0.418	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.6	134.4	178.1	-59.8	174.9	-169.1	-172.9	3.5	108.3	H482 G485 V489	H482-R487 HydrophobicContact CB-CG 4.45Å; H482-R487 PolarHBondContact CE1-NE 2.98Å; H482-R487 VanDerWaalsContact CE1-NE 3.3Å; H482-R487 PolarHBondContact CE1-NH1 3.4Å; H482-R487 PolarHBondContact CE1-NH2 2.83Å; H482-R487 PolarHBondContact ND1-NE 3.37Å; H482-R487 VanDerWaalsContact ND1-NE 3.17Å; H482-R487 PolarHBondContact NE2-NH2 3.27Å; H482-R487 PolarHBondContact O-NE 2.93Å; G485-R487 PolarHBondContact O-N 3.48Å; R487-V489 PolarHBondContact O-N 2.84Å
488	M	70.4	Confident	78.2	Confident	111 Å²	111	85.3 Å²	85.3	55%	0.547	42%	0.423	S	S	.	.	T	Hydrogen-bonded Turn	trans	52.7	28.8	171.5	-55	-172.1	173.5	0	0	114.2	W490 Y491	M488-W490 PolarHBondContact O-N 3.24Å; M488-W490 VanDerWaalsContact O-N 3.09Å; M488-Y491 HydrophobicContact CB-CD2 4.22Å; M488-Y491 HydrophobicContact CB-CG 4.2Å; M488-Y491 HydrophobicContact CG-CD2 4.45Å; M488-Y491 WeakPolarHBondContact O-CA 3.27Å; M488-Y491 WeakPolarHBondContact O-CB 3.22Å; M488-Y491 PolarHBondContact O-N 2.96Å; M488-Y491 HydrophobicContact SD-CD2 4.36Å; M488-Y491 HydrophobicContact SD-CE2 4.46Å; M488-Y491 HydrophobicContact SD-CG 4.47Å
489	V	73.1	Confident	78	Confident	56 Å²	56	86 Å²	86	34%	0.339	43%	0.429	S	S	.	.	H	α-helix	trans	-62.4	-21.3	173.7	-165.6	0	0	0	0	110.9	C486 R487 Y491 S492 N493 N496	C486-V489 HydrophobicContact CB-CG2 3.77Å; C486-V489 WeakPolarHBondContact O-CG2 3.41Å; R487-V489 PolarHBondContact O-N 2.84Å; V489-Y491 VanDerWaalsContact C-N 3.34Å; V489-S492 PolarHBondContact O-OG 3.37Å; V489-S492 VanDerWaalsContact O-OG 3.05Å; V489-N493 PolarHBondContact O-N 3.05Å; V489-N493 VanDerWaalsContact O-N 3.11Å; V489-N496 WeakPolarHBondContact CG1-ND2 3.45Å; V489-N496 PolarHBondContact O-ND2 3.28Å; V489-N496 VanDerWaalsContact O-ND2 3.11Å
490	W	74	Confident	77.5	Confident	77 Å²	77	81.7 Å²	81.7	29%	0.292	41%	0.406	S	S	.	.	H	α-helix	trans	-74.1	-18.2	170.5	58.9	-96.5	0	0	0	114.4	M488 N493 H494 N496 I497 M500 F501	M488-W490 PolarHBondContact O-N 3.24Å; M488-W490 VanDerWaalsContact O-N 3.09Å; W490-N493 WeakPolarHBondContact CA-O 3.11Å; W490-N493 CarbonylContact O-C 3.42Å; W490-N493 VanDerWaalsContact O-C 3.31Å; W490-H494 WeakPolarHBondContact O-CA 3.48Å; W490-H494 PolarHBondContact O-CD2 3.33Å; W490-H494 VanDerWaalsContact O-CD2 3.32Å; W490-H494 PolarHBondContact O-N 2.93Å; W490-N496 HydrophobicContact CB-CB 4.03Å; W490-I497 HydrophobicContact CB-CG1 3.69Å; W490-I497 HydrophobicContact CD2-CG1 4.35Å; W490-I497 HydrophobicContact CE3-CD1 4.06Å; W490-I497 HydrophobicContact CE3-CG1 4.22Å; W490-I497 HydrophobicContact CG-CG1 4.17Å; W490-M500 HydrophobicContact CB-SD 4.32Å; W490-F501 AromaticContact CD1-CE2 3.84Å; W490-F501 HydrophobicContact CG-CE2 4.41Å; W490-F501 AromaticContact NE1-CE2 3.9Å
491	Y	71.1	Confident	77.1	Confident	84 Å²	84	80 Å²	80	33%	0.329	40%	0.397	S	S	.	.	H	α-helix	trans	-68	-36.8	171.1	-107.1	-126.7	0	0	0	111.6	M488 V489	M488-Y491 HydrophobicContact CB-CD2 4.22Å; M488-Y491 HydrophobicContact CB-CG 4.2Å; M488-Y491 HydrophobicContact CG-CD2 4.45Å; M488-Y491 WeakPolarHBondContact O-CA 3.27Å; M488-Y491 WeakPolarHBondContact O-CB 3.22Å; M488-Y491 PolarHBondContact O-N 2.96Å; M488-Y491 HydrophobicContact SD-CD2 4.36Å; M488-Y491 HydrophobicContact SD-CE2 4.46Å; M488-Y491 HydrophobicContact SD-CG 4.47Å; V489-Y491 VanDerWaalsContact C-N 3.34Å
492	S	67.9	Low	76.8	Confident	66 Å²	66	79 Å²	79	46%	0.462	40%	0.396	S	S	.	.	H	α-helix	trans	-84	-35.8	177.3	61.2	0	0	0	0	112.3	V489	V489-S492 PolarHBondContact O-OG 3.37Å; V489-S492 VanDerWaalsContact O-OG 3.05Å
493	N	73.6	Confident	76.7	Confident	71 Å²	71	79.6 Å²	79.6	38%	0.38	40%	0.402	S	S	.	.			trans	-132.3	97.5	176.2	-176.4	-15.8	0	0	0	110.8	V489 W490 Y495 N496	V489-N493 PolarHBondContact O-N 3.05Å; V489-N493 VanDerWaalsContact O-N 3.11Å; W490-N493 WeakPolarHBondContact CA-O 3.11Å; W490-N493 CarbonylContact O-C 3.42Å; W490-N493 VanDerWaalsContact O-C 3.31Å; N493-Y495 PolarHBondContact O-N 3.4Å; N493-Y495 WeakPolarHBondContact OD1-CB 3.3Å; N493-Y495 VanDerWaalsContact OD1-CD2 3.28Å; N493-Y495 WeakPolarHBondContact OD1-CD2 3.42Å; N493-Y495 PolarHBondContact OD1-N 2.88Å; N493-N496 VanDerWaalsContact O-CB 3.25Å; N493-N496 WeakPolarHBondContact O-CB 3.44Å; N493-N496 PolarHBondContact O-N 3.38Å; N493-N496 PolarHBondContact O-ND2 3.47Å
494	H	72.7	Confident	76.5	Confident	70 Å²	70	73.2 Å²	73.2	32%	0.324	37%	0.374	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53.9	-29.7	-177	-75.9	-154	0	0	0	114.2	Q327 W490 N496 I497	Q327-H494 VanDerWaalsContact CD-CE1 3.47Å; Q327-H494 PolarHBondContact NE2-CE1 2.73Å; Q327-H494 PolarHBondContact NE2-NE2 2.92Å; Q327-H494 PolarHBondContact OE1-CE1 3.49Å; W490-H494 WeakPolarHBondContact O-CA 3.48Å; W490-H494 PolarHBondContact O-CD2 3.33Å; W490-H494 VanDerWaalsContact O-CD2 3.32Å; W490-H494 PolarHBondContact O-N 2.93Å; H494-N496 PolarHBondContact O-N 3.41Å; H494-I497 WeakPolarHBondContact O-CB 3.29Å; H494-I497 VanDerWaalsContact O-CG1 3.31Å; H494-I497 WeakPolarHBondContact O-CG1 3.46Å; H494-I497 PolarHBondContact O-N 3.34Å
495	Y	76.3	Confident	76.1	Confident	163 Å²	163	67.1 Å²	67.1	64%	0.639	35%	0.354	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.8	-21.4	179.1	-60.4	-73.7	0	0	0	112.6	N493 I497 V498	N493-Y495 PolarHBondContact O-N 3.4Å; N493-Y495 WeakPolarHBondContact OD1-CB 3.3Å; N493-Y495 VanDerWaalsContact OD1-CD2 3.28Å; N493-Y495 WeakPolarHBondContact OD1-CD2 3.42Å; N493-Y495 PolarHBondContact OD1-N 2.88Å; Y495-I497 PolarHBondContact O-N 2.92Å; Y495-V498 WeakPolarHBondContact O-CB 3.36Å; Y495-V498 PolarHBondContact O-N 3.33Å; Y495-V498 VanDerWaalsContact O-N 3.09Å
496	N	80	Confident	75.9	Confident	51 Å²	51	66.3 Å²	66.3	27%	0.273	34%	0.339	S	S	.	.	H	α-helix	trans	-61.8	-23.3	173.7	-69.1	-27.7	0	0	0	112.5	V489 W490 N493 H494 V498 G499 M500	V489-N496 WeakPolarHBondContact CG1-ND2 3.45Å; V489-N496 PolarHBondContact O-ND2 3.28Å; V489-N496 VanDerWaalsContact O-ND2 3.11Å; W490-N496 HydrophobicContact CB-CB 4.03Å; N493-N496 VanDerWaalsContact O-CB 3.25Å; N493-N496 WeakPolarHBondContact O-CB 3.44Å; N493-N496 PolarHBondContact O-N 3.38Å; N493-N496 PolarHBondContact O-ND2 3.47Å; H494-N496 PolarHBondContact O-N 3.41Å; N496-V498 PolarHBondContact O-N 3.46Å; N496-G499 PolarHBondContact O-N 3.38Å; N496-M500 HydrophobicContact CB-CG 4.45Å; N496-M500 HydrophobicContact CB-SD 3.96Å; N496-M500 WeakPolarHBondContact O-CB 3.23Å; N496-M500 WeakPolarHBondContact O-CG 3.32Å; N496-M500 PolarHBondContact O-N 3.46Å
497	I	78.7	Confident	76.1	Confident	37 Å²	37	70.1 Å²	70.1	19%	0.19	35%	0.345	C	S	.	.	H	α-helix	trans	-55.5	-39.1	173.8	-64.7	179.3	0	0	0	110.8	F60 W490 H494 Y495 F501 V502	F60-I497 HydrophobicContact CE1-CD1 4.47Å; F60-I497 HydrophobicContact CE1-CG2 4.31Å; F60-I497 HydrophobicContact CZ-CG2 3.96Å; W490-I497 HydrophobicContact CB-CG1 3.69Å; W490-I497 HydrophobicContact CD2-CG1 4.35Å; W490-I497 HydrophobicContact CE3-CD1 4.06Å; W490-I497 HydrophobicContact CE3-CG1 4.22Å; W490-I497 HydrophobicContact CG-CG1 4.17Å; H494-I497 WeakPolarHBondContact O-CB 3.29Å; H494-I497 VanDerWaalsContact O-CG1 3.31Å; H494-I497 WeakPolarHBondContact O-CG1 3.46Å; H494-I497 PolarHBondContact O-N 3.34Å; Y495-I497 PolarHBondContact O-N 2.92Å; I497-F501 HydrophobicContact CG2-CD2 4.27Å; I497-F501 PolarHBondContact O-N 3.22Å; I497-V502 PolarHBondContact O-N 2.95Å
498	V	78.2	Confident	76.5	Confident	40 Å²	40	64.1 Å²	64.1	24%	0.242	32%	0.322	C	S	.	.	I	π-helix	trans	-64.4	-48.9	-179.6	-178.7	0	0	0	0	110.3	Y495 N496 V502 L503	Y495-V498 WeakPolarHBondContact O-CB 3.36Å; Y495-V498 PolarHBondContact O-N 3.33Å; Y495-V498 VanDerWaalsContact O-N 3.09Å; N496-V498 PolarHBondContact O-N 3.46Å; V498-V502 HydrophobicContact CG1-CB 4.34Å; V498-V502 WeakPolarHBondContact O-CB 3.41Å; V498-V502 PolarHBondContact O-N 3.43Å; V498-L503 HydrophobicContact CG1-CG 4.48Å; V498-L503 PolarHBondContact O-N 3Å
499	G	77.3	Confident	76.8	Confident	40 Å²	40	61.8 Å²	61.8	41%	0.412	31%	0.309	S	S	.	.	I	π-helix	trans	-69	-37.5	179.2	0	0	0	0	0	113.7	N496 P504	N496-G499 PolarHBondContact O-N 3.38Å; G499-P504 WeakPolarHBondContact O-CD 3.5Å
500	M	77.3	Confident	76.8	Confident	19 Å²	19	61 Å²	61	9%	0.094	31%	0.305	C	S	.	.	I	π-helix	trans	-84.8	-31.4	-173.3	-68.5	176.9	74.3	0	0	113.8	L477 Y481 W490 N496 P504	L477-M500 WeakPolarHBondContact CD2-O 3.24Å; Y481-M500 HydrophobicContact CD1-CE 4.07Å; Y481-M500 HydrophobicContact CD2-CE 3.19Å; Y481-M500 HydrophobicContact CE1-CE 4.31Å; Y481-M500 HydrophobicContact CE2-CB 3.7Å; Y481-M500 HydrophobicContact CE2-CE 3.45Å; Y481-M500 VanDerWaalsContact CE2-CE 3.45Å; Y481-M500 HydrophobicContact CE2-CG 3.87Å; Y481-M500 HydrophobicContact CG-CE 3.53Å; Y481-M500 WeakPolarHBondContact OH-CA 3.5Å; W490-M500 HydrophobicContact CB-SD 4.32Å; N496-M500 HydrophobicContact CB-CG 4.45Å; N496-M500 HydrophobicContact CB-SD 3.96Å; N496-M500 WeakPolarHBondContact O-CB 3.23Å; N496-M500 WeakPolarHBondContact O-CG 3.32Å; N496-M500 PolarHBondContact O-N 3.46Å; M500-P504 WeakPolarHBondContact O-CG 3.5Å
501	F	77.7	Confident	76.9	Confident	61 Å²	61	61.3 Å²	61.3	27%	0.268	31%	0.306	S	S	.	.	I	π-helix	trans	-126.8	-45.5	-173.1	-59	-68.4	0	0	0	112.8	W490 I497 P504 V505	W490-F501 AromaticContact CD1-CE2 3.84Å; W490-F501 HydrophobicContact CG-CE2 4.41Å; W490-F501 AromaticContact NE1-CE2 3.9Å; I497-F501 HydrophobicContact CG2-CD2 4.27Å; I497-F501 PolarHBondContact O-N 3.22Å; F501-P504 WeakPolarHBondContact O-CD 3.27Å; F501-V505 VanDerWaalsContact O-CB 3.29Å; F501-V505 WeakPolarHBondContact O-CB 3.29Å; F501-V505 WeakPolarHBondContact O-CG2 3.32Å; F501-V505 PolarHBondContact O-N 2.78Å
502	V	77.6	Confident	77	Confident	34 Å²	34	57.3 Å²	57.3	21%	0.206	29%	0.29	C	S	.	.	I	π-helix	trans	-68.4	-53.4	-175.7	-178.2	0	0	0	0	111.6	I497 V498 V505 V506	I497-V502 PolarHBondContact O-N 2.95Å; V498-V502 HydrophobicContact CG1-CB 4.34Å; V498-V502 WeakPolarHBondContact O-CB 3.41Å; V498-V502 PolarHBondContact O-N 3.43Å; V502-V505 PolarHBondContact O-N 3.14Å; V502-V506 HydrophobicContact CG1-CG2 4.32Å; V502-V506 WeakPolarHBondContact O-CB 3.14Å; V502-V506 VanDerWaalsContact O-CG2 3.3Å; V502-V506 WeakPolarHBondContact O-CG2 3.46Å; V502-V506 PolarHBondContact O-N 3.05Å
503	L	79.8	Confident	77	Confident	104 Å²	104	56.3 Å²	56.3	55%	0.545	28%	0.278	S	S	.	.	H	α-helix	trans	-61.3	-44	-179.7	-65.8	178.7	0	0	0	112.5	V498 V505 V506 W507	V498-L503 HydrophobicContact CG1-CG 4.48Å; V498-L503 PolarHBondContact O-N 3Å; L503-V505 PolarHBondContact O-N 2.64Å; L503-V506 PolarHBondContact O-N 3.47Å; L503-W507 VanDerWaalsContact O-CB 3.3Å; L503-W507 WeakPolarHBondContact O-CB 3.21Å; L503-W507 PolarHBondContact O-N 2.96Å
504	P	82.2	Confident	76.5	Confident	19 Å²	19	54 Å²	54	12%	0.123	27%	0.267	C	S	.	.	H	α-helix	trans	-63.9	-38.6	176.2	-26.2	38.8	0	0	0	113.2	F473 L477 G499 M500 F501 W507 W508	F473-P504 HydrophobicContact CE1-CB 3.6Å; F473-P504 WeakPolarHBondContact CE1-O 3.45Å; F473-P504 HydrophobicContact CZ-CB 4.28Å; L477-P504 HydrophobicContact CD2-CB 3.56Å; L477-P504 HydrophobicContact CD2-CG 3.5Å; G499-P504 WeakPolarHBondContact O-CD 3.5Å; M500-P504 WeakPolarHBondContact O-CG 3.5Å; F501-P504 WeakPolarHBondContact O-CD 3.27Å; P504-W507 PolarHBondContact O-N 3.3Å; P504-W508 WeakPolarHBondContact O-CB 3.39Å; P504-W508 PolarHBondContact O-N 2.89Å
505	V	78.9	Confident	76.1	Confident	42 Å²	42	55.2 Å²	55.2	26%	0.255	27%	0.269	S	S	.	.	H	α-helix	trans	-66.5	-44.4	175.3	168.7	0	0	0	0	111.4	S474 F501 V502 L503 W507 W508 F509	S474-V505 VanDerWaalsContact OG-CG2 3.25Å; S474-V505 WeakPolarHBondContact OG-CG2 3Å; F501-V505 VanDerWaalsContact O-CB 3.29Å; F501-V505 WeakPolarHBondContact O-CB 3.29Å; F501-V505 WeakPolarHBondContact O-CG2 3.32Å; F501-V505 PolarHBondContact O-N 2.78Å; V502-V505 PolarHBondContact O-N 3.14Å; L503-V505 PolarHBondContact O-N 2.64Å; V505-W507 VanDerWaalsContact C-N 3.32Å; V505-W507 PolarHBondContact O-N 3.34Å; V505-W508 WeakPolarHBondContact O-CB 3.37Å; V505-W508 PolarHBondContact O-N 2.75Å; V505-F509 HydrophobicContact CG1-CD2 3.66Å; V505-F509 HydrophobicContact CG1-CE2 3.51Å; V505-F509 VanDerWaalsContact O-CD2 3.22Å; V505-F509 WeakPolarHBondContact O-CD2 3.2Å; V505-F509 PolarHBondContact O-N 2.89Å
506	V	77	Confident	75.6	Confident	39 Å²	39	51.4 Å²	51.4	24%	0.236	26%	0.259	C	S	.	.	H	α-helix	trans	-60.1	-45.5	174.7	170.5	0	0	0	0	110.2	L49 V502 L503 W508 F509 V510	L49-V506 HydrophobicContact CD1-CG1 4.2Å; V502-V506 HydrophobicContact CG1-CG2 4.32Å; V502-V506 WeakPolarHBondContact O-CB 3.14Å; V502-V506 VanDerWaalsContact O-CG2 3.3Å; V502-V506 WeakPolarHBondContact O-CG2 3.46Å; V502-V506 PolarHBondContact O-N 3.05Å; L503-V506 PolarHBondContact O-N 3.47Å; V506-W508 VanDerWaalsContact C-N 3.33Å; V506-W508 PolarHBondContact O-N 2.77Å; V506-F509 PolarHBondContact O-N 3.43Å; V506-V510 HydrophobicContact CG1-CG2 4.46Å; V506-V510 VanDerWaalsContact O-CG2 3.32Å; V506-V510 WeakPolarHBondContact O-CG2 3.28Å; V506-V510 PolarHBondContact O-N 3.42Å
507	W	80.4	Confident	75	Confident	136 Å²	136	52.3 Å²	52.3	52%	0.515	26%	0.261	S	S	.	.	H	α-helix	trans	-58.6	-44.4	175.3	179.6	88.3	0	0	0	111.6	F473 L503 P504 V505 V510 W511	F473-W507 HydrophobicContact CE1-CE3 4.38Å; F473-W507 HydrophobicContact CE2-CZ3 4.32Å; F473-W507 HydrophobicContact CZ-CE3 4.1Å; F473-W507 HydrophobicContact CZ-CZ3 4.1Å; L503-W507 VanDerWaalsContact O-CB 3.3Å; L503-W507 WeakPolarHBondContact O-CB 3.21Å; L503-W507 PolarHBondContact O-N 2.96Å; P504-W507 PolarHBondContact O-N 3.3Å; V505-W507 VanDerWaalsContact C-N 3.32Å; V505-W507 PolarHBondContact O-N 3.34Å; W507-V510 PolarHBondContact O-N 3.21Å; W507-W511 HydrophobicContact CD2-CB 4.39Å; W507-W511 HydrophobicContact CE3-CB 4.48Å; W507-W511 HydrophobicContact CH2-CB 4.31Å; W507-W511 HydrophobicContact CH2-CD2 4.26Å; W507-W511 AromaticContact CH2-CG 3.97Å; W507-W511 HydrophobicContact CH2-CG 3.97Å; W507-W511 HydrophobicContact CZ2-CB 4.22Å; W507-W511 AromaticContact CZ2-CD1 3.91Å; W507-W511 HydrophobicContact CZ2-CG 4.02Å; W507-W511 HydrophobicContact CZ3-CB 4.44Å; W507-W511 HydrophobicContact CZ3-CG 4.45Å; W507-W511 WeakPolarHBondContact O-CB 3.22Å; W507-W511 PolarHBondContact O-N 3.45Å
508	W	82.9	Confident	74.3	Confident	27 Å²	27	56.5 Å²	56.5	10%	0.102	28%	0.278	C	S	.	.	H	α-helix	trans	-58.4	-49.5	176.9	172.9	-93	0	0	0	112.1	T466 L469 G470 F473 P504 V505 V506 V510 W511 S512	T466-W508 PolarHBondContact O-NE1 3.24Å; L469-W508 HydrophobicContact CB-CH2 3.8Å; L469-W508 HydrophobicContact CB-CZ2 3.19Å; L469-W508 HydrophobicContact CD1-CH2 4.37Å; L469-W508 HydrophobicContact CD1-CZ2 4.04Å; L469-W508 HydrophobicContact CG-CZ2 4.24Å; G470-W508 VanDerWaalsContact CA-NE1 3.28Å; G470-W508 VanDerWaalsContact N-NE1 3.19Å; F473-W508 HydrophobicContact CB-CD2 4.28Å; F473-W508 HydrophobicContact CB-CE3 3.94Å; F473-W508 HydrophobicContact CB-CZ3 4.4Å; F473-W508 HydrophobicContact CD1-CB 4.08Å; F473-W508 HydrophobicContact CD1-CE3 4.37Å; F473-W508 HydrophobicContact CD2-CE3 4.21Å; F473-W508 HydrophobicContact CE1-CB 4.43Å; F473-W508 HydrophobicContact CG-CD2 4.48Å; F473-W508 AromaticContact CG-CE3 3.92Å; F473-W508 HydrophobicContact CG-CE3 3.92Å; P504-W508 WeakPolarHBondContact O-CB 3.39Å; P504-W508 PolarHBondContact O-N 2.89Å; V505-W508 WeakPolarHBondContact O-CB 3.37Å; V505-W508 PolarHBondContact O-N 2.75Å; V506-W508 VanDerWaalsContact C-N 3.33Å; V506-W508 PolarHBondContact O-N 2.77Å; W508-V510 VanDerWaalsContact C-N 3.33Å; W508-V510 PolarHBondContact O-N 3.47Å; W508-W511 HydrophobicContact CE3-CE3 4.31Å; W508-W511 HydrophobicContact CH2-CE3 4.43Å; W508-W511 AromaticContact CH2-CZ3 3.95Å; W508-W511 HydrophobicContact CH2-CZ3 3.95Å; W508-W511 HydrophobicContact CZ3-CE3 4.09Å; W508-W511 AromaticContact CZ3-CZ3 3.85Å; W508-W511 HydrophobicContact CZ3-CZ3 3.85Å; W508-W511 PolarHBondContact O-N 3.09Å; W508-S512 VanDerWaalsContact O-CB 3.28Å; W508-S512 WeakPolarHBondContact O-CB 3.3Å; W508-S512 PolarHBondContact O-N 3.02Å; W508-S512 PolarHBondContact O-OG 3.08Å
509	F	75.5	Confident	73.3	Confident	62 Å²	62	58.2 Å²	58.2	27%	0.272	29%	0.285	S	S	.	.	H	α-helix	trans	-65.1	-37.6	179.8	-79.8	-65.9	0	0	0	112.2	T466 T467 V505 V506 S512 Q513	T466-F509 HydrophobicContact CG2-CD1 3.83Å; T466-F509 HydrophobicContact CG2-CE1 4Å; T467-F509 HydrophobicContact CG2-CZ 4.36Å; V505-F509 HydrophobicContact CG1-CD2 3.66Å; V505-F509 HydrophobicContact CG1-CE2 3.51Å; V505-F509 VanDerWaalsContact O-CD2 3.22Å; V505-F509 WeakPolarHBondContact O-CD2 3.2Å; V505-F509 PolarHBondContact O-N 2.89Å; V506-F509 PolarHBondContact O-N 3.43Å; F509-S512 WeakPolarHBondContact CA-OG 3.42Å; F509-S512 PolarHBondContact O-OG 3.49Å; F509-Q513 WeakPolarHBondContact O-CB 3.23Å; F509-Q513 WeakPolarHBondContact O-CG 3.42Å; F509-Q513 PolarHBondContact O-N 2.84Å
510	V	73.1	Confident	71.9	Confident	39 Å²	39	62.6 Å²	62.6	24%	0.236	31%	0.306	C	S	.	.	H	α-helix	trans	-66.4	-48.5	174.1	171.5	0	0	0	0	110.8	V506 W507 W508 T514 V524	V506-V510 HydrophobicContact CG1-CG2 4.46Å; V506-V510 VanDerWaalsContact O-CG2 3.32Å; V506-V510 WeakPolarHBondContact O-CG2 3.28Å; V506-V510 PolarHBondContact O-N 3.42Å; W507-V510 PolarHBondContact O-N 3.21Å; W508-V510 VanDerWaalsContact C-N 3.33Å; W508-V510 PolarHBondContact O-N 3.47Å; V510-T514 VanDerWaalsContact O-CB 3.31Å; V510-T514 WeakPolarHBondContact O-CB 3.34Å; V510-T514 WeakPolarHBondContact O-CG2 3.31Å; V510-T514 PolarHBondContact O-N 2.88Å; V510-T514 PolarHBondContact O-OG1 3.49Å; V510-V524 HydrophobicContact CG1-CG1 3.76Å; V510-V524 HydrophobicContact CG2-CG1 4.15Å
511	W	77	Confident	70.5	Confident	84 Å²	84	69.8 Å²	69.8	32%	0.318	34%	0.339	S	S	.	.	H	α-helix	trans	-65.6	-45.9	-176.9	177.1	84.8	0	0	0	112.6	W507 W508 T514 Y515 L516	W507-W511 HydrophobicContact CD2-CB 4.39Å; W507-W511 HydrophobicContact CE3-CB 4.48Å; W507-W511 HydrophobicContact CH2-CB 4.31Å; W507-W511 HydrophobicContact CH2-CD2 4.26Å; W507-W511 AromaticContact CH2-CG 3.97Å; W507-W511 HydrophobicContact CH2-CG 3.97Å; W507-W511 HydrophobicContact CZ2-CB 4.22Å; W507-W511 AromaticContact CZ2-CD1 3.91Å; W507-W511 HydrophobicContact CZ2-CG 4.02Å; W507-W511 HydrophobicContact CZ3-CB 4.44Å; W507-W511 HydrophobicContact CZ3-CG 4.45Å; W507-W511 WeakPolarHBondContact O-CB 3.22Å; W507-W511 PolarHBondContact O-N 3.45Å; W508-W511 HydrophobicContact CE3-CE3 4.31Å; W508-W511 HydrophobicContact CH2-CE3 4.43Å; W508-W511 AromaticContact CH2-CZ3 3.95Å; W508-W511 HydrophobicContact CH2-CZ3 3.95Å; W508-W511 HydrophobicContact CZ3-CE3 4.09Å; W508-W511 AromaticContact CZ3-CZ3 3.85Å; W508-W511 HydrophobicContact CZ3-CZ3 3.85Å; W508-W511 PolarHBondContact O-N 3.09Å; W511-T514 PolarHBondContact O-N 3.34Å; W511-T514 PolarHBondContact O-OG1 2.96Å; W511-Y515 AromaticContact CD1-CD2 3.57Å; W511-Y515 HydrophobicContact CG-CD2 4.38Å; W511-Y515 AromaticContact NE1-CD2 3.94Å; W511-Y515 AromaticContact NE1-CG 3.92Å; W511-Y515 WeakPolarHBondContact O-CB 3.45Å; W511-Y515 PolarHBondContact O-N 2.7Å; W511-L516 HydrophobicContact CH2-CB 4.48Å; W511-L516 HydrophobicContact CH2-CD1 4.46Å; W511-L516 HydrophobicContact CZ3-CB 4.31Å; W511-L516 HydrophobicContact CZ3-CD2 4.47Å
512	S	72.6	Confident	69	Low	0 Å²	0	67.9 Å²	67.9	0%	0	34%	0.337	C	S	.	.	I	π-helix	trans	-62	-46.9	-179.4	51.8	0	0	0	0	112.4	T466 W508 F509 T514 L516 F517	T466-S512 WeakPolarHBondContact CG2-OG 3.36Å; W508-S512 VanDerWaalsContact O-CB 3.28Å; W508-S512 WeakPolarHBondContact O-CB 3.3Å; W508-S512 PolarHBondContact O-N 3.02Å; W508-S512 PolarHBondContact O-OG 3.08Å; F509-S512 WeakPolarHBondContact CA-OG 3.42Å; F509-S512 PolarHBondContact O-OG 3.49Å; S512-T514 PolarHBondContact O-N 2.92Å; S512-T514 VanDerWaalsContact O-N 3.13Å; S512-L516 VanDerWaalsContact O-CB 3.25Å; S512-L516 WeakPolarHBondContact O-CB 3.15Å; S512-L516 PolarHBondContact O-N 2.71Å; S512-F517 WeakPolarHBondContact O-CD2 3.46Å; S512-F517 PolarHBondContact O-N 2.9Å
513	Q	68.9	Low	67.5	Low	44 Å²	44	69.5 Å²	69.5	21%	0.206	35%	0.35	C	S	.	.	I	π-helix	trans	-63.9	-22.6	179.8	-67.2	-72.3	-25.9	0	0	112.7	F509 I519	F509-Q513 WeakPolarHBondContact O-CB 3.23Å; F509-Q513 WeakPolarHBondContact O-CG 3.42Å; F509-Q513 PolarHBondContact O-N 2.84Å; Q513-I519 PolarHBondContact O-N 3.2Å
514	T	61.5	Low	65.7	Low	23 Å²	23	66.6 Å²	66.6	14%	0.141	34%	0.337	C	S	.	.	I	π-helix	trans	-111.8	-44.5	-165.4	59.9	0	0	0	0	113.4	V510 W511 S512 K518 F525	V510-T514 VanDerWaalsContact O-CB 3.31Å; V510-T514 WeakPolarHBondContact O-CB 3.34Å; V510-T514 WeakPolarHBondContact O-CG2 3.31Å; V510-T514 PolarHBondContact O-N 2.88Å; V510-T514 PolarHBondContact O-OG1 3.49Å; W511-T514 PolarHBondContact O-N 3.34Å; W511-T514 PolarHBondContact O-OG1 2.96Å; S512-T514 PolarHBondContact O-N 2.92Å; S512-T514 VanDerWaalsContact O-N 3.13Å; T514-K518 WeakPolarHBondContact O-CA 3.29Å; T514-F525 HydrophobicContact CG2-CD2 3.28Å; T514-F525 HydrophobicContact CG2-CE2 3.19Å; T514-F525 HydrophobicContact CG2-CZ 4.42Å; T514-F525 WeakPolarHBondContact OG1-CE2 3.42Å
515	Y	64.5	Low	63.6	Low	95 Å²	95	68.4 Å²	68.4	37%	0.373	34%	0.343	S	S	.	.	I	π-helix	trans	-94.2	-41.8	177.4	-77.7	-83.1	0	0	0	112.4	W511 F525	W511-Y515 AromaticContact CD1-CD2 3.57Å; W511-Y515 HydrophobicContact CG-CD2 4.38Å; W511-Y515 AromaticContact NE1-CD2 3.94Å; W511-Y515 AromaticContact NE1-CG 3.92Å; W511-Y515 WeakPolarHBondContact O-CB 3.45Å; W511-Y515 PolarHBondContact O-N 2.7Å; Y515-F525 HydrophobicContact CE2-CZ 4.06Å
516	L	67.3	Low	61.8	Low	84 Å²	84	73.1 Å²	73.1	44%	0.44	36%	0.36	S	S	.	.	I	π-helix	trans	-77.5	-50.5	-174.5	-171.5	67.8	0	0	0	111.4	W511 S512	W511-L516 HydrophobicContact CH2-CB 4.48Å; W511-L516 HydrophobicContact CH2-CD1 4.46Å; W511-L516 HydrophobicContact CZ3-CB 4.31Å; W511-L516 HydrophobicContact CZ3-CD2 4.47Å; S512-L516 VanDerWaalsContact O-CB 3.25Å; S512-L516 WeakPolarHBondContact O-CB 3.15Å; S512-L516 PolarHBondContact O-N 2.71Å
517	F	66.9	Low	60	Low	69 Å²	69	73.3 Å²	73.3	30%	0.303	36%	0.357	S	S	.	.	S	Bend	trans	-94.8	-7.1	-179.3	-64.6	-70.9	0	0	0	114.2	V462 T466 S512 I519	V462-F517 HydrophobicContact CB-CE1 4.38Å; V462-F517 HydrophobicContact CG1-CD1 3.74Å; V462-F517 HydrophobicContact CG1-CD2 3.7Å; V462-F517 HydrophobicContact CG1-CE1 3.76Å; V462-F517 HydrophobicContact CG1-CE2 3.74Å; V462-F517 HydrophobicContact CG1-CG 3.71Å; V462-F517 HydrophobicContact CG1-CZ 3.77Å; V462-F517 HydrophobicContact CG2-CD1 4.12Å; V462-F517 HydrophobicContact CG2-CE1 3.94Å; T466-F517 WeakPolarHBondContact OG1-CE2 3.41Å; S512-F517 WeakPolarHBondContact O-CD2 3.46Å; S512-F517 PolarHBondContact O-N 2.9Å; F517-I519 HydrophobicContact CB-CG1 4.06Å; F517-I519 PolarHBondContact O-N 3.43Å; F517-I519 VanDerWaalsContact O-N 3.07Å
518	K	64.5	Low	58.1	Low	125 Å²	125	71.7 Å²	71.7	54%	0.543	36%	0.358	S	S	.	.			trans	43.1	43.7	178.6	-63.3	-175.3	-179.4	174.5	0	113.4	T514 P520	T514-K518 WeakPolarHBondContact O-CA 3.29Å; K518-P520 WeakPolarHBondContact O-CD 3.37Å
519	I	56.7	Low	56	Low	76 Å²	76	72.5 Å²	72.5	39%	0.39	38%	0.375	S	S	.	.			trans	-62.8	110.5	-178.7	-58.8	-179.7	0	0	0	107.7	Q513 F517 E521 G522	Q513-I519 PolarHBondContact O-N 3.2Å; F517-I519 HydrophobicContact CB-CG1 4.06Å; F517-I519 PolarHBondContact O-N 3.43Å; F517-I519 VanDerWaalsContact O-N 3.07Å; I519-E521 PolarHBondContact O-N 2.93Å; I519-G522 PolarHBondContact O-N 2.96Å
520	P	47.3	Very low	54.2	Low	132 Å²	132	72.7 Å²	72.7	86%	0.857	38%	0.378	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.8	-12.7	-163.7	-23.4	34.4	0	0	0	114.9	K518	K518-P520 WeakPolarHBondContact O-CD 3.37Å
521	E	48.2	Very low	52.7	Low	170 Å²	170	73.1 Å²	73.1	79%	0.794	38%	0.383	S	S	*	.	T	Hydrogen-bonded Turn	trans	-130.9	27.4	176	-59.1	-158.2	159.8	0	0	112.5	I519 S523	I519-E521 PolarHBondContact O-N 2.93Å; E521-S523 PolarHBondContact O-N 3.31Å
522	G	46.1	Very low	50.8	Low	22 Å²	22	74.8 Å²	74.8	23%	0.227	40%	0.398	C	S	.	.			trans	-54	114.2	174.5	0	0	0	0	0	110.5	I519 V524 F525	I519-G522 PolarHBondContact O-N 2.96Å; G522-V524 PolarHBondContact O-N 3.22Å; G522-F525 PolarHBondContact O-N 3.15Å
523	S	47.4	Very low	49.3	Very low	68 Å²	68	84.9 Å²	84.9	48%	0.476	44%	0.436	S	S	.	.	T	Hydrogen-bonded Turn	trans	-52.8	-15.7	-168.5	-167.8	0	0	0	0	115.5	S45 E521	S45-S523 WeakPolarHBondContact CB-O 3.43Å; S45-S523 WeakPolarHBondContact CB-OG 3.36Å; S45-S523 PolarHBondContact OG-O 3.19Å; S45-S523 PolarHBondContact OG-OG 2.75Å; E521-S523 PolarHBondContact O-N 3.31Å
524	V	41.3	Very low	47.7	Very low	43 Å²	43	87 Å²	87	26%	0.261	45%	0.445	S	S	.	.	H	α-helix	trans	-77.6	-19.5	-180	-173.9	0	0	0	0	113	V510 G522 F527	V510-V524 HydrophobicContact CG1-CG1 3.76Å; V510-V524 HydrophobicContact CG2-CG1 4.15Å; G522-V524 PolarHBondContact O-N 3.22Å; V524-F527 WeakPolarHBondContact O-CB 3.26Å
525	F	36.8	Very low	46.6	Very low	57 Å²	57	88.4 Å²	88.4	25%	0.25	46%	0.456	C	S	.	.	H	α-helix	trans	-92.9	-24.4	-176.8	-93.3	-99.6	0	0	0	115.6	T514 Y515 G522 F527 I530 S531	T514-F525 HydrophobicContact CG2-CD2 3.28Å; T514-F525 HydrophobicContact CG2-CE2 3.19Å; T514-F525 HydrophobicContact CG2-CZ 4.42Å; T514-F525 WeakPolarHBondContact OG1-CE2 3.42Å; Y515-F525 HydrophobicContact CE2-CZ 4.06Å; G522-F525 PolarHBondContact O-N 3.15Å; F525-F527 PolarHBondContact O-N 3.25Å; F525-I530 HydrophobicContact CE1-CG2 4.25Å; F525-S531 VanDerWaalsContact O-CB 3.3Å; F525-S531 WeakPolarHBondContact O-CB 3.06Å
526	K	41.1	Very low	45.2	Very low	141 Å²	141	93.4 Å²	93.4	61%	0.613	47%	0.474	S	S	*	.	H	α-helix	trans	-63.1	-26.7	164.8	-80	-167.5	-179.2	-173.4	0	111.6	V40 D41	V40-K526 PolarHBondContact O-NZ 3.47Å; D41-K526 IonicContact OD1-NZ 2.78Å; D41-K526 PolarHBondContact OD1-NZ 3.28Å
527	F	39.6	Very low	43.9	Very low	43 Å²	43	95.5 Å²	95.5	19%	0.189	48%	0.484	C	S	.	.	H	α-helix	trans	-73.4	-46.8	-168.6	173.3	-42.4	0	0	0	114.2	S45 L46 L49 V524 F525	S45-F527 WeakPolarHBondContact OG-CD2 3.1Å; L46-F527 HydrophobicContact CB-CD2 3.88Å; L46-F527 HydrophobicContact CB-CE2 3.75Å; L46-F527 HydrophobicContact CB-CG 4.39Å; L46-F527 HydrophobicContact CB-CZ 4.09Å; L46-F527 HydrophobicContact CD1-CD1 3.59Å; L46-F527 HydrophobicContact CD1-CD2 4.13Å; L46-F527 HydrophobicContact CD1-CE1 3.81Å; L46-F527 HydrophobicContact CD1-CE2 4.36Å; L46-F527 HydrophobicContact CD1-CG 3.77Å; L46-F527 HydrophobicContact CD1-CZ 4.2Å; L46-F527 HydrophobicContact CD2-CD1 4.07Å; L46-F527 HydrophobicContact CD2-CD2 4.43Å; L46-F527 HydrophobicContact CD2-CE1 3.37Å; L46-F527 HydrophobicContact CD2-CE2 3.83Å; L46-F527 HydrophobicContact CD2-CZ 3.22Å; L46-F527 HydrophobicContact CG-CD1 3.52Å; L46-F527 HydrophobicContact CG-CD2 3.49Å; L46-F527 VanDerWaalsContact CG-CD2 3.49Å; L46-F527 HydrophobicContact CG-CE1 3.33Å; L46-F527 HydrophobicContact CG-CE2 3.32Å; L46-F527 HydrophobicContact CG-CG 3.62Å; L46-F527 HydrophobicContact CG-CZ 3.22Å; L46-F527 VanDerWaalsContact N-CD2 3.33Å; L49-F527 HydrophobicContact CB-CE2 4.29Å; L49-F527 HydrophobicContact CD2-CE2 4.37Å; L49-F527 HydrophobicContact CD2-CZ 4.15Å; V524-F527 WeakPolarHBondContact O-CB 3.26Å; F525-F527 PolarHBondContact O-N 3.25Å
528	L	40.2	Very low	42.3	Very low	101 Å²	101	99.7 Å²	99.7	53%	0.529	50%	0.498	S	S	.	.	S	Bend	trans	-94.5	-0.8	-166.9	-84	163.2	0	0	0	114.9	I530	L528-I530 HydrophobicContact CB-CB 4.13Å; L528-I530 HydrophobicContact CB-CD1 3.7Å; L528-I530 HydrophobicContact CB-CG1 3.81Å; L528-I530 HydrophobicContact CD1-CD1 3.98Å; L528-I530 HydrophobicContact CG-CD1 4.28Å; L528-I530 PolarHBondContact O-N 3.24Å
529	G	39.8	Very low	40.7	Very low	45 Å²	45	101.7 Å²	101.7	46%	0.464	51%	0.509	S	S	.	.	S	Bend	trans	61.7	-3.9	-171	0	0	0	0	0	114.3	S531 N532	G529-S531 PolarHBondContact O-N 3.45Å; G529-N532 PolarHBondContact O-N 2.87Å; G529-N532 VanDerWaalsContact O-N 3.1Å
530	I	37.1	Very low	39.3	Very low	66 Å²	66	106.5 Å²	106.5	34%	0.338	53%	0.53	S	S	.	.	H	α-helix	trans	-63.8	-30.7	174.3	-69.4	174.8	0	0	0	110.1	F525 L528 N532 R533 F534	F525-I530 HydrophobicContact CE1-CG2 4.25Å; L528-I530 HydrophobicContact CB-CB 4.13Å; L528-I530 HydrophobicContact CB-CD1 3.7Å; L528-I530 HydrophobicContact CB-CG1 3.81Å; L528-I530 HydrophobicContact CD1-CD1 3.98Å; L528-I530 HydrophobicContact CG-CD1 4.28Å; L528-I530 PolarHBondContact O-N 3.24Å; I530-N532 PolarHBondContact O-N 2.99Å; I530-R533 PolarHBondContact O-N 2.92Å; I530-F534 HydrophobicContact CG2-CD2 3.31Å; I530-F534 HydrophobicContact CG2-CE2 3.62Å; I530-F534 HydrophobicContact CG2-CG 4.38Å; I530-F534 PolarHBondContact O-N 2.85Å
531	S	41.1	Very low	38.4	Very low	48 Å²	48	107.6 Å²	107.6	34%	0.336	53%	0.528	S	S	.	.	H	α-helix	trans	-47.4	-47.3	168.7	166	0	0	0	0	111	F525 G529 R533 F534 S535	F525-S531 VanDerWaalsContact O-CB 3.3Å; F525-S531 WeakPolarHBondContact O-CB 3.06Å; G529-S531 PolarHBondContact O-N 3.45Å; S531-R533 PolarHBondContact O-N 3.29Å; S531-F534 PolarHBondContact O-N 3.12Å; S531-S535 WeakPolarHBondContact O-CA 3.24Å; S531-S535 WeakPolarHBondContact O-CB 3.4Å; S531-S535 PolarHBondContact O-N 3.22Å; S531-S535 PolarHBondContact O-OG 3.09Å
532	N	38.2	Very low	37.8	Very low	119 Å²	119	103.7 Å²	103.7	64%	0.636	53%	0.525	S	S	*	.	H	α-helix	trans	-73.2	-23.3	-179.3	-77.7	-12.5	0	0	0	114.6	G529 I530 S535	G529-N532 PolarHBondContact O-N 2.87Å; G529-N532 VanDerWaalsContact O-N 3.1Å; I530-N532 PolarHBondContact O-N 2.99Å; N532-S535 WeakPolarHBondContact CA-OG 3.46Å; N532-S535 PolarHBondContact O-OG 3.47Å
533	R	40.1	Very low	37.1	Very low	212 Å²	212	109.4 Å²	109.4	80%	0.8	55%	0.55	S	S	*	.	H	α-helix	trans	-81.6	-34.8	173.9	-85.4	-160.6	-175.7	-162.3	4	112.4	I530 S531	I530-R533 PolarHBondContact O-N 2.92Å; S531-R533 PolarHBondContact O-N 3.29Å
534	F	35.4	Very low	36.4	Very low	88 Å²	88	112.4 Å²	112.4	39%	0.386	56%	0.561	S	S	.	*	H	α-helix	trans	-92.6	-21.6	179.5	-76.8	-91.3	0	0	0	113.2	I530 S531 R536 I537 W538	I530-F534 HydrophobicContact CG2-CD2 3.31Å; I530-F534 HydrophobicContact CG2-CE2 3.62Å; I530-F534 HydrophobicContact CG2-CG 4.38Å; I530-F534 PolarHBondContact O-N 2.85Å; S531-F534 PolarHBondContact O-N 3.12Å; F534-R536 PolarHBondContact O-N 3.46Å; F534-I537 HydrophobicContact CD1-CD1 3.87Å; F534-I537 HydrophobicContact CE1-CD1 4.29Å; F534-I537 WeakPolarHBondContact O-CA 3.31Å; F534-I537 WeakPolarHBondContact O-CB 3.44Å; F534-I537 PolarHBondContact O-N 2.82Å; F534-W538 PolarHBondContact O-N 3.03Å
535	S	38.8	Very low	35.8	Very low	53 Å²	53	120.4 Å²	120.4	37%	0.371	59%	0.588	S	S	.	*	T	Hydrogen-bonded Turn	trans	-63.9	-22.2	174.2	65.4	0	0	0	0	112.4	S531 N532 I537 W538 Q539	S531-S535 WeakPolarHBondContact O-CA 3.24Å; S531-S535 WeakPolarHBondContact O-CB 3.4Å; S531-S535 PolarHBondContact O-N 3.22Å; S531-S535 PolarHBondContact O-OG 3.09Å; N532-S535 WeakPolarHBondContact CA-OG 3.46Å; N532-S535 PolarHBondContact O-OG 3.47Å; S535-I537 VanDerWaalsContact C-N 3.25Å; S535-I537 PolarHBondContact O-N 2.97Å; S535-W538 CarbonylContact O-C 3.31Å; S535-W538 VanDerWaalsContact O-CA 3.32Å; S535-W538 WeakPolarHBondContact O-CA 3.43Å; S535-W538 PolarHBondContact O-N 3.36Å; S535-Q539 PolarHBondContact O-N 3.05Å
536	R	35	Very low	35.3	Very low	200 Å²	200	126 Å²	126	76%	0.755	61%	0.612	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67.7	-24.2	169.4	-69.3	-169.1	-156.8	174.9	4.2	113.6	F534 W538	F534-R536 PolarHBondContact O-N 3.46Å; R536-W538 VanDerWaalsContact C-N 3.28Å
537	I	39.7	Very low	34.8	Very low	127 Å²	127	129.1 Å²	129.1	65%	0.651	62%	0.622	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.7	-27.6	169.5	-56.3	179.4	0	0	0	109.6	F534 S535 Q539	F534-I537 HydrophobicContact CD1-CD1 3.87Å; F534-I537 HydrophobicContact CE1-CD1 4.29Å; F534-I537 WeakPolarHBondContact O-CA 3.31Å; F534-I537 WeakPolarHBondContact O-CB 3.44Å; F534-I537 PolarHBondContact O-N 2.82Å; S535-I537 VanDerWaalsContact C-N 3.25Å; S535-I537 PolarHBondContact O-N 2.97Å; I537-Q539 VanDerWaalsContact C-N 3.29Å; I537-Q539 PolarHBondContact O-N 3.48Å
538	W	33.4	Very low	34.2	Very low	158 Å²	158	129.9 Å²	129.9	60%	0.598	63%	0.632	S	S	*	*	T	Hydrogen-bonded Turn	trans	-93.1	44.1	174.3	-64.3	91.1	0	0	0	112.2	F534 S535 R536 H540	F534-W538 PolarHBondContact O-N 3.03Å; S535-W538 CarbonylContact O-C 3.31Å; S535-W538 VanDerWaalsContact O-CA 3.32Å; S535-W538 WeakPolarHBondContact O-CA 3.43Å; S535-W538 PolarHBondContact O-N 3.36Å; R536-W538 VanDerWaalsContact C-N 3.28Å; W538-H540 PolarHBondContact O-N 3.06Å
539	Q	30.6	Very low	33.6	Very low	166 Å²	166	131.3 Å²	131.3	78%	0.776	64%	0.639	S	S	*	*			trans	-64.4	104.5	161	-88.6	-172.9	-26.6	0	0	108	S535 I537 N541	S535-Q539 PolarHBondContact O-N 3.05Å; I537-Q539 VanDerWaalsContact C-N 3.29Å; I537-Q539 PolarHBondContact O-N 3.48Å; Q539-N541 PolarHBondContact O-N 3.06Å
540	H	29.3	Very low	33.1	Very low	178 Å²	178	137.4 Å²	137.4	82%	0.824	66%	0.656	S	S	*	*			trans	-40.7	102.3	161.5	-98.3	-72.1	0	0	0	109.9	W538 A542	W538-H540 PolarHBondContact O-N 3.06Å; H540-A542 PolarHBondContact O-N 3.19Å; H540-A542 VanDerWaalsContact O-N 3.09Å
541	N	28.2	Very low	32.7	Very low	154 Å²	154	137 Å²	137	82%	0.824	66%	0.656	S	S	*	*			trans	-66.4	101.3	141.6	-84.4	-19.7	0	0	0	104.6	Q539 L543	Q539-N541 PolarHBondContact O-N 3.06Å; N541-L543 PolarHBondContact O-N 3.44Å
542	A	35.3	Very low	32.2	Very low	88 Å²	88	140 Å²	140	73%	0.727	67%	0.669	S	S	*	*	S	Bend	trans	-65.5	84.1	168.5	0	0	0	0	0	107	H540	H540-A542 PolarHBondContact O-N 3.19Å; H540-A542 VanDerWaalsContact O-N 3.09Å
543	L	31.7	Very low	31.9	Very low	142 Å²	142	140.2 Å²	140.2	74%	0.743	66%	0.664	S	S	*	*	S	Bend	trans	-176.9	116.1	159.4	-94.8	151	0	0	0	106.9	N541	N541-L543 PolarHBondContact O-N 3.44Å
544	D	30.9	Very low	31.5	Very low	131 Å²	131	136.6 Å²	136.6	70%	0.701	66%	0.657	S	S	*	*			trans	58.6	93.7	158.6	-54.3	-27.4	0	0	0	117
545	Y	28.8	Very low	31.3	Very low	212 Å²	212	139.2 Å²	139.2	83%	0.831	67%	0.672	S	S	*	*				-165.5	96.7	117.5	-94.5	-70.6	0	0	0	108.2	Y547	Y545-Y547 PolarHBondContact O-N 3.2Å; Y545-Y547 VanDerWaalsContact O-N 3.09Å
546	F	27.9	Very low	30.8	Very low	175 Å²	175	143.9 Å²	143.9	77%	0.768	69%	0.689	S	S	*	*			trans	-45.9	107.6	158.9	-109.6	-109.3	0	0	0	109.8	S548	F546-S548 WeakPolarHBondContact CD1-OG 3.34Å; F546-S548 VanDerWaalsContact CE1-OG 3.28Å; F546-S548 WeakPolarHBondContact CE1-OG 3.44Å
547	Y	29.3	Very low	30.6	Very low	206 Å²	206	140.6 Å²	140.6	81%	0.808	69%	0.685	S	S	*	*			trans	-113.9	60.3	145	-74.4	-85	0	0	0	107.1	Y545 L549	Y545-Y547 PolarHBondContact O-N 3.2Å; Y545-Y547 VanDerWaalsContact O-N 3.09Å; Y547-L549 VanDerWaalsContact C-N 3.32Å; Y547-L549 PolarHBondContact O-N 3.15Å
548	S	27.5	Very low	30	Very low	58 Å²	58	141.5 Å²	141.5	41%	0.406	69%	0.687	S	S	.	*			trans	-74.4	99.7	148.9	69.1	0	0	0	0	105.5	F546 E550	F546-S548 WeakPolarHBondContact CD1-OG 3.34Å; F546-S548 VanDerWaalsContact CE1-OG 3.28Å; F546-S548 WeakPolarHBondContact CE1-OG 3.44Å; S548-E550 PolarHBondContact O-N 3.13Å
549	L	28.4	Very low	29.8	Very low	131 Å²	131	140.4 Å²	140.4	69%	0.686	69%	0.693	S	S	*	*			trans	-63.4	81.9	143.7	-99.1	88.4	0	0	0	105.5	Y547 T551	Y547-L549 VanDerWaalsContact C-N 3.32Å; Y547-L549 PolarHBondContact O-N 3.15Å; L549-T551 HydrophobicContact CD2-CG2 4.19Å; L549-T551 WeakPolarHBondContact CD2-OG1 3.48Å; L549-T551 HydrophobicContact CG-CG2 4.42Å; L549-T551 PolarHBondContact O-N 3.41Å
550	E	28.2	Very low	29.8	Very low	174 Å²	174	138.6 Å²	138.6	81%	0.813	69%	0.687	S	S	*	*			trans	-66.7	53.8	144.9	-79.6	-173.7	154.4	0	0	107.5	S548	S548-E550 PolarHBondContact O-N 3.13Å
551	T	29.7	Very low	29.8	Very low	56 Å²	56	135.5 Å²	135.5	34%	0.344	68%	0.676	S	S	.	*			trans	-95.1	102.9	147.9	56.8	0	0	0	0	102.5	L549 F553	L549-T551 HydrophobicContact CD2-CG2 4.19Å; L549-T551 WeakPolarHBondContact CD2-OG1 3.48Å; L549-T551 HydrophobicContact CG-CG2 4.42Å; L549-T551 PolarHBondContact O-N 3.41Å; T551-F553 VanDerWaalsContact CB-CD2 3.46Å; T551-F553 HydrophobicContact CG2-CD2 4.41Å; T551-F553 HydrophobicContact CG2-CE2 4.18Å; T551-F553 WeakPolarHBondContact O-CB 3.36Å; T551-F553 PolarHBondContact O-N 2.68Å; T551-F553 WeakPolarHBondContact OG1-CD2 3.32Å
552	D	30.3	Very low	29.9	Very low	113 Å²	113	134 Å²	134	60%	0.604	66%	0.664	S	S	*	*			trans	-57.7	77.8	173.5	-145.4	14.7	0	0	0	106.8	R452	R452-D552 WeakPolarHBondContact CD-O 3.26Å; R452-D552 IonicContact CZ-OD1 3.17Å; R452-D552 IonicContact CZ-OD2 3.15Å; R452-D552 IonicContact NE-OD1 3.65Å; R452-D552 VanDerWaalsContact NH1-C 3.32Å; R452-D552 PolarHBondContact NH1-O 3.09Å; R452-D552 IonicContact NH1-OD1 3.37Å; R452-D552 PolarHBondContact NH1-OD1 3.47Å; R452-D552 IonicContact NH1-OD2 2.74Å; R452-D552 PolarHBondContact NH1-OD2 2.68Å; R452-D552 IonicContact NH2-OD1 3.89Å; R452-D552 PolarHBondContact NH2-OD1 3.04Å; R452-D552 IonicContact NH2-OD2 3.28Å; R452-D552 PolarHBondContact NH2-OD2 3.02Å
553	F	31.1	Very low	29.4	Very low	122 Å²	122	138.2 Å²	138.2	54%	0.535	66%	0.658	S	S	.	*			trans	-130.9	0	-172.3	-79	-8.9	0	0	0	109.2	R452 C454 T551	R452-F553 WeakPolarHBondContact CA-O 3.4Å; R452-F553 WeakPolarHBondContact CB-O 3.45Å; R452-F553 WeakPolarHBondContact CG-O 3.5Å; R452-F553 PolarHBondContact N-O 3.38Å; C454-F553 HydrophobicContact CB-CB 4.47Å; C454-F553 HydrophobicContact CB-CD1 2.99Å; C454-F553 HydrophobicContact CB-CD2 3.99Å; C454-F553 HydrophobicContact CB-CE1 2.87Å; C454-F553 HydrophobicContact CB-CE2 3.91Å; C454-F553 HydrophobicContact CB-CG 3.56Å; C454-F553 HydrophobicContact CB-CZ 3.36Å; C454-F553 WeakPolarHBondContact SG-CE1 3.26Å; T551-F553 VanDerWaalsContact CB-CD2 3.46Å; T551-F553 HydrophobicContact CG2-CD2 4.41Å; T551-F553 HydrophobicContact CG2-CE2 4.18Å; T551-F553 WeakPolarHBondContact O-CB 3.36Å; T551-F553 PolarHBondContact O-N 2.68Å; T551-F553 WeakPolarHBondContact OG1-CD2 3.32Å

Retrieved 553 of 553 residues in 276.7 ms (Link to these results)

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