A0A087Y9K4_POEFO Loading...

Protein disulfide-isomerase-like

AlphaFold DB , UniProt , Accession A0A087Y9K4, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 517 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	35.2	Very low	32.9	Very low	232 Å²	232	153.2 Å²	153.2	100%	1.143	86%	0.861	S	S	*	*				0	109.8	0	-78.7	-180	-86.1	0	0	109.5
2	K	35.2	Very low	33.1	Very low	202 Å²	202	155.3 Å²	155.3	88%	0.878	86%	0.863	S	S	*	*			trans	50.1	125.3	136.7	-70.3	-179.8	178.3	178.9	0	118.1
3	K	33.6	Very low	33.4	Very low	195 Å²	195	159.4 Å²	159.4	85%	0.848	87%	0.867	S	S	*	*			cis	-158.1	137.6	16.7	-73.8	169.9	172.5	179.1	0	105.5
4	L	34.9	Very low	33.6	Very low	184 Å²	184	156.3 Å²	156.3	96%	0.963	86%	0.861	S	S	*	*				47.8	117.1	67.1	-145.3	79.2	0	0	0	117.6
5	G	30.6	Very low	33.7	Very low	71 Å²	71	156.8 Å²	156.8	73%	0.732	86%	0.861	S	S	*	*			trans	145.8	76.5	163	0	0	0	0	0	112.9
6	L	32.1	Very low	33.8	Very low	160 Å²	160	154.2 Å²	154.2	84%	0.838	86%	0.856	S	S	*	*				81.2	139.5	87.4	-150.7	84.2	0	0	0	114.7
7	L	29.5	Very low	33.9	Very low	143 Å²	143	151.6 Å²	151.6	75%	0.749	84%	0.844	S	S	*	*			trans	92.6	126.4	169.5	-59.2	130.8	0	0	0	114.6
8	L	29.3	Very low	34	Very low	146 Å²	146	148.6 Å²	148.6	76%	0.764	84%	0.835	S	S	*	*			cis	-162.5	143.8	14.5	-119.4	151.6	0	0	0	109.5
9	L	34.6	Very low	34	Very low	171 Å²	171	144.9 Å²	144.9	90%	0.895	83%	0.826	S	S	*	*			trans	-49.2	138.1	166	-84.8	90.5	0	0	0	112.2
10	G	31.9	Very low	33.9	Very low	83 Å²	83	140.1 Å²	140.1	86%	0.856	81%	0.805	S	S	*	*			trans	163.9	46	165.7	0	0	0	0	0	116.4
11	A	34.7	Very low	33.7	Very low	98 Å²	98	136.3 Å²	136.3	81%	0.81	79%	0.79	S	S	*	*			trans	-154.7	74.8	171.7	0	0	0	0	0	111.7
12	M	35.2	Very low	33.7	Very low	178 Å²	178	132.4 Å²	132.4	88%	0.877	77%	0.774	S	S	*	*	S	Bend	trans	-163.8	59.2	165.5	-109.5	-73.9	-91.2	0	0	110
13	F	37.6	Very low	33.6	Very low	209 Å²	209	125.5 Å²	125.5	92%	0.917	76%	0.755	S	S	*	*	S	Bend	trans	-164.1	65.7	164.9	-133.7	-87.8	0	0	0	111.6
14	C	35.9	Very low	33.5	Very low	116 Å²	116	123.3 Å²	123.3	78%	0.784	75%	0.748	S	S	*	*			trans	-160.5	44.2	167.7	-138.9	0	0	0	0	114.4
15	L	34.6	Very low	33.5	Very low	164 Å²	164	121.9 Å²	121.9	86%	0.859	74%	0.74	S	S	*	*	S	Bend	trans	-117.6	11.5	176.4	-96	157	0	0	0	114.6
16	C	35.3	Very low	33.9	Very low	115 Å²	115	124 Å²	124	78%	0.777	73%	0.734	S	S	*	*	S	Bend	trans	-123.5	17.2	179.6	-67	0	0	0	0	115
17	V	35.9	Very low	34.3	Very low	110 Å²	110	123.7 Å²	123.7	67%	0.667	73%	0.733	S	S	*	*	S	Bend	trans	-109.4	-15.2	-178.3	-174.9	0	0	0	0	113.7
18	S	36.4	Very low	34.7	Very low	97 Å²	97	125.2 Å²	125.2	68%	0.678	74%	0.736	S	S	*	*	H	α-helix	trans	-89	-18.4	178.9	47.7	0	0	0	0	114.9
19	A	33.8	Very low	35.2	Very low	80 Å²	80	121.1 Å²	121.1	66%	0.661	73%	0.729	S	S	*	*	H	α-helix	trans	-86.2	-22.2	175	0	0	0	0	0	113.1
20	A	31.4	Very low	35.8	Very low	48 Å²	48	120.2 Å²	120.2	40%	0.397	73%	0.725	S	S	.	*	H	α-helix	trans	-82	-28.4	178.4	0	0	0	0	0	112.5	D22 A23 Q24	A20-D22 PolarHBondContact O-N 3.49Å; A20-A23 PolarHBondContact O-N 2.93Å; A20-Q24 VanDerWaalsContact O-CB 3.3Å; A20-Q24 WeakPolarHBondContact O-CB 3.3Å; A20-Q24 PolarHBondContact O-N 3.26Å
21	A	30.8	Very low	37.2	Very low	61 Å²	61	120.2 Å²	120.2	50%	0.504	71%	0.708	S	S	.	*	H	α-helix	trans	-69.8	-32.2	-178.2	0	0	0	0	0	113.6
22	D	33.9	Very low	39.5	Very low	149 Å²	149	120.9 Å²	120.9	80%	0.797	70%	0.703	S	S	*	*	H	α-helix	trans	-80.9	-19.8	173.7	-86.6	-22	0	0	0	112.9	A20	A20-D22 PolarHBondContact O-N 3.49Å
23	A	33.3	Very low	42.1	Very low	58 Å²	58	113.1 Å²	113.1	48%	0.479	66%	0.664	S	S	.	*	H	α-helix	trans	-90.6	-20.5	176.2	0	0	0	0	0	113.5	A20	A20-A23 PolarHBondContact O-N 2.93Å
24	Q	31.2	Very low	44.8	Very low	149 Å²	149	106.6 Å²	106.6	70%	0.696	64%	0.643	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.1	-9.3	-175.5	-148.9	93	-17.4	0	0	114.3	A20	A20-Q24 VanDerWaalsContact O-CB 3.3Å; A20-Q24 WeakPolarHBondContact O-CB 3.3Å; A20-Q24 PolarHBondContact O-N 3.26Å
25	L	35.8	Very low	47.5	Very low	154 Å²	154	105.7 Å²	105.7	81%	0.806	63%	0.628	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90.9	-4.6	175	-84.6	164.7	0	0	0	113.9
26	D	38.7	Very low	50.3	Low	114 Å²	114	104.1 Å²	104.1	61%	0.61	61%	0.614	S	S	*	*	S	Bend	trans	-101.5	10.2	-178.1	-128.2	12.4	0	0	0	112.7	R52	D26-R52 IonicContact OD1-NH1 3.65Å; D26-R52 IonicContact OD1-NH2 3.91Å; D26-R52 PolarHBondContact OD1-NH2 3.36Å; D26-R52 IonicContact OD2-NH1 3.22Å
27	L	39.7	Very low	52.9	Low	154 Å²	154	104.5 Å²	104.5	81%	0.806	60%	0.604	S	S	*	*			trans	-125.8	40.3	-177.9	-92.9	156.9	0	0	0	113.3
28	Q	39.3	Very low	55.5	Low	176 Å²	176	99.7 Å²	99.7	82%	0.822	58%	0.577	S	S	*	*	S	Bend	trans	-111.1	135.8	159.9	-80	-169.5	-11.5	0	0	109.8
29	G	38.9	Very low	58.4	Low	59 Å²	59	95.7 Å²	95.7	61%	0.608	55%	0.548	S	S	*	.			trans	-52.4	171	-161.5	0	0	0	0	0	116.5	T31	G29-T31 PolarHBondContact O-N 3.35Å; G29-T31 PolarHBondContact O-OG1 2.77Å
30	D	47.5	Very low	61.4	Low	153 Å²	153	92.1 Å²	92.1	82%	0.818	52%	0.518	S	S	*	.			trans	-41.7	68.2	171.6	-162.7	15.3	0	0	0	113.6	T32	D30-T32 PolarHBondContact O-N 3.45Å
31	T	61.4	Low	64.5	Low	82 Å²	82	92.4 Å²	92.4	50%	0.503	51%	0.511	S	S	.	.			trans	-86.6	101.9	175.6	33	0	0	0	0	105.6	G29 I33 R49	G29-T31 PolarHBondContact O-N 3.35Å; G29-T31 PolarHBondContact O-OG1 2.77Å; T31-I33 PolarHBondContact O-N 3.12Å; T31-R49 PolarHBondContact O-NH2 2.95Å; T31-R49 PolarHBondContact OG1-NH1 3.39Å; T31-R49 PolarHBondContact OG1-NH2 3.15Å
32	T	82.6	Confident	67.6	Low	112 Å²	112	89.7 Å²	89.7	69%	0.687	49%	0.488	S	S	*	.	P	Polyproline II helix	trans	-46.7	129.9	171.7	42.3	0	0	0	0	109.3	D30	D30-T32 PolarHBondContact O-N 3.45Å
33	I	90.1	Very high	70.5	Confident	15 Å²	15	87.6 Å²	87.6	8%	0.077	47%	0.473	C	S	.	.	P	Polyproline II helix	trans	-65.5	130	176.3	-61.6	178.8	0	0	0	106.5	T31 E35 L40 L42 A50	T31-I33 PolarHBondContact O-N 3.12Å; I33-E35 PolarHBondContact O-N 2.95Å; I33-L40 HydrophobicContact CB-CD2 4.28Å; I33-L40 HydrophobicContact CG2-CB 4.18Å; I33-L40 HydrophobicContact CG2-CD1 4.49Å; I33-L40 HydrophobicContact CG2-CD2 4.14Å; I33-L42 HydrophobicContact CG2-CD2 3.81Å; I33-A50 HydrophobicContact CD1-CB 3.71Å
34	P	93.8	Very high	73.4	Confident	73 Å²	73	92.5 Å²	92.5	47%	0.474	48%	0.484	S	S	.	.	P	Polyproline II helix	trans	-55.7	135.2	-178.5	-23.2	32.2	0	0	0	110.7	Q41	P34-Q41 HydrophobicContact CB-CB 4.27Å; P34-Q41 PolarHBondContact O-N 2.89Å
35	E	93.1	Very high	76.3	Confident	97 Å²	97	89.1 Å²	89.1	45%	0.453	49%	0.488	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	135.3	-176.2	-171.6	166.5	161.1	0	0	109.3	I33 G38 I39 L40 K89	I33-E35 PolarHBondContact O-N 2.95Å; E35-G38 WeakPolarHBondContact OE1-CA 3.42Å; E35-I39 WeakPolarHBondContact CA-O 3.38Å; E35-L40 HydrophobicContact CB-CD2 4.24Å; E35-L40 HydrophobicContact CG-CD2 4.26Å; E35-L40 WeakPolarHBondContact OE2-CD2 3.47Å; E35-K89 IonicContact OE1-NZ 3.36Å; E35-K89 PolarHBondContact OE1-NZ 3.3Å; E35-K89 IonicContact OE2-NZ 2.67Å; E35-K89 PolarHBondContact OE2-NZ 2.62Å
36	K	92.6	Very high	79.2	Confident	131 Å²	131	82.3 Å²	82.3	57%	0.57	45%	0.453	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-128.5	122.3	176.2	-176.5	178	178.4	-178.7	0	108	G38 I39 Q41	K36-G38 PolarHBondContact O-N 3.13Å; K36-I39 PolarHBondContact N-O 3.3Å; K36-I39 WeakPolarHBondContact O-CB 3.48Å; K36-I39 PolarHBondContact O-N 3.1Å; K36-Q41 HydrophobicContact CB-CG 4.45Å
37	E	91	Very high	81.8	Confident	122 Å²	122	77.2 Å²	77.2	57%	0.57	43%	0.426	S	S	*	.	T	Hydrogen-bonded Turn	trans	51	40.3	178.8	-58.3	171.2	151.1	0	0	113.3	I39 K77	E37-I39 VanDerWaalsContact C-N 3.32Å; E37-I39 PolarHBondContact O-N 3.01Å; E37-K77 IonicContact OE1-NZ 3.06Å; E37-K77 PolarHBondContact OE1-NZ 3.36Å; E37-K77 WeakPolarHBondContact OE2-CE 3.44Å; E37-K77 IonicContact OE2-NZ 2.65Å; E37-K77 PolarHBondContact OE2-NZ 3.16Å
38	G	90.8	Very high	84.4	Confident	10 Å²	10	76.7 Å²	76.7	10%	0.103	42%	0.417	C	S	.	.	T	Hydrogen-bonded Turn	trans	87.1	-4.1	179.5	0	0	0	0	0	115.5	E35 K36 Q84 K89	E35-G38 WeakPolarHBondContact OE1-CA 3.42Å; K36-G38 PolarHBondContact O-N 3.13Å; G38-Q84 PolarHBondContact O-NE2 2.91Å; G38-K89 PolarHBondContact O-NZ 2.86Å
39	I	96.6	Very high	87	Confident	12 Å²	12	72.5 Å²	72.5	6%	0.062	39%	0.393	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	123.3	-172.5	-53.8	175	0	0	0	110.7	E35 K36 E37 Q41 F76 K77 A80 P90 V92	E35-I39 WeakPolarHBondContact CA-O 3.38Å; K36-I39 PolarHBondContact N-O 3.3Å; K36-I39 WeakPolarHBondContact O-CB 3.48Å; K36-I39 PolarHBondContact O-N 3.1Å; E37-I39 VanDerWaalsContact C-N 3.32Å; E37-I39 PolarHBondContact O-N 3.01Å; I39-Q41 PolarHBondContact O-NE2 3.49Å; I39-F76 HydrophobicContact CD1-CE1 4.48Å; I39-F76 HydrophobicContact CG2-CE1 4.2Å; I39-K77 HydrophobicContact CD1-CG 4.5Å; I39-A80 HydrophobicContact CD1-CB 3.72Å; I39-A80 HydrophobicContact CG1-CB 3.64Å; I39-P90 HydrophobicContact CG1-CB 4.39Å; I39-V92 HydrophobicContact CG2-CB 4.35Å; I39-V92 HydrophobicContact CG2-CG1 3.76Å; I39-V92 HydrophobicContact CG2-CG2 4.02Å
40	L	96.9	Very high	89.7	Confident	5 Å²	5	69.7 Å²	69.7	3%	0.026	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.8	134.6	177	-59.1	-177.2	0	0	0	111.3	I33 E35 L42 L57 K89 P90 A91 V92	I33-L40 HydrophobicContact CB-CD2 4.28Å; I33-L40 HydrophobicContact CG2-CB 4.18Å; I33-L40 HydrophobicContact CG2-CD1 4.49Å; I33-L40 HydrophobicContact CG2-CD2 4.14Å; E35-L40 HydrophobicContact CB-CD2 4.24Å; E35-L40 HydrophobicContact CG-CD2 4.26Å; E35-L40 WeakPolarHBondContact OE2-CD2 3.47Å; L40-L42 HydrophobicContact CB-CD2 3.94Å; L40-L42 HydrophobicContact CB-CG 4.28Å; L40-L42 HydrophobicContact CD1-CD2 4.4Å; L40-L57 HydrophobicContact CD1-CD1 4.16Å; L40-K89 HydrophobicContact CD1-CG 3.66Å; L40-K89 HydrophobicContact CG-CD 4.39Å; L40-K89 HydrophobicContact CG-CG 3.97Å; L40-P90 PolarHBondContact N-O 2.6Å; L40-A91 HydrophobicContact CB-CB 3.92Å; L40-A91 CarbonylContact O-C 3.52Å; L40-A91 VanDerWaalsContact O-CA 3.27Å; L40-A91 WeakPolarHBondContact O-CA 3.31Å; L40-V92 PolarHBondContact O-N 2.93Å
41	Q	96.2	Very high	92	Very high	55 Å²	55	62.9 Å²	62.9	26%	0.257	33%	0.328	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.5	104.4	172.1	-51.2	-57.9	-60.2	0	0	108.2	P34 K36 I39 N46 V92	P34-Q41 HydrophobicContact CB-CB 4.27Å; P34-Q41 PolarHBondContact O-N 2.89Å; K36-Q41 HydrophobicContact CB-CG 4.45Å; I39-Q41 PolarHBondContact O-NE2 3.49Å; Q41-N46 PolarHBondContact O-ND2 3.23Å; Q41-N46 VanDerWaalsContact O-ND2 3.09Å; Q41-V92 VanDerWaalsContact OE1-CG2 3.26Å
42	L	96.3	Very high	93.5	Very high	4 Å²	4	66.7 Å²	66.7	2%	0.021	33%	0.333	C	S	.	.			trans	-98.9	139.2	-174.8	-58.7	-174.8	0	0	0	111.6	I33 L40 N46 F47 A50 L57 V59 A91 V92 I93	I33-L42 HydrophobicContact CG2-CD2 3.81Å; L40-L42 HydrophobicContact CB-CD2 3.94Å; L40-L42 HydrophobicContact CB-CG 4.28Å; L40-L42 HydrophobicContact CD1-CD2 4.4Å; L42-N46 VanDerWaalsContact CA-OD1 3.28Å; L42-N46 WeakPolarHBondContact CA-OD1 3.31Å; L42-F47 HydrophobicContact CB-CD2 4.43Å; L42-F47 HydrophobicContact CD1-CD2 3.8Å; L42-F47 HydrophobicContact CD1-CE2 4.21Å; L42-A50 HydrophobicContact CD1-CB 4.15Å; L42-A50 HydrophobicContact CD2-CB 3.63Å; L42-L57 HydrophobicContact CD1-CD2 4.02Å; L42-V59 HydrophobicContact CD1-CG2 4.22Å; L42-A91 HydrophobicContact CD1-CB 3.44Å; L42-A91 VanDerWaalsContact CD1-CB 3.44Å; L42-A91 HydrophobicContact CG-CB 3.8Å; L42-V92 PolarHBondContact N-O 3.12Å; L42-I93 HydrophobicContact CB-CD1 4.11Å; L42-I93 HydrophobicContact CB-CG1 3.62Å
43	E	95.1	Very high	94.1	Very high	105 Å²	105	67.6 Å²	67.6	49%	0.491	33%	0.328	S	S	.	.			trans	-138.6	168.2	179	-64	177.6	-173.3	0	0	108.8	G45 N46 F47 E98	E43-G45 PolarHBondContact O-N 2.61Å; E43-N46 PolarHBondContact N-OD1 3.36Å; E43-N46 PolarHBondContact O-N 3.02Å; E43-N46 PolarHBondContact O-OD1 3.27Å; E43-N46 VanDerWaalsContact O-OD1 3.06Å; E43-F47 WeakPolarHBondContact O-CB 3.48Å; E43-F47 PolarHBondContact O-N 3.47Å; E43-E98 HydrophobicContact CB-CG 4.48Å; E43-E98 HydrophobicContact CG-CG 4.47Å
44	K	93.3	Very high	94.4	Very high	161 Å²	161	68.7 Å²	68.7	70%	0.7	33%	0.332	S	S	*	.	T	Hydrogen-bonded Turn	trans	-49.2	-37.8	178.4	-176.1	-177.1	175.6	-171	0	113.4	E98 L101	K44-E98 WeakPolarHBondContact CB-OE2 3.39Å; K44-E98 PolarHBondContact N-OE2 2.85Å; K44-L101 HydrophobicContact CB-CB 4.5Å
45	G	93.5	Very high	94.4	Very high	77 Å²	77	71.7 Å²	71.7	79%	0.794	34%	0.338	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.4	-25.1	-177.5	0	0	0	0	0	114.9	E43	E43-G45 PolarHBondContact O-N 2.61Å
46	N	95.1	Very high	94.6	Very high	12 Å²	12	69.4 Å²	69.4	6%	0.064	33%	0.327	C	S	.	.	T	Hydrogen-bonded Turn	trans	-120.5	-11.8	-171.4	70.2	21.3	0	0	0	114.3	Q41 L42 E43 K48 R49 A50	Q41-N46 PolarHBondContact O-ND2 3.23Å; Q41-N46 VanDerWaalsContact O-ND2 3.09Å; L42-N46 VanDerWaalsContact CA-OD1 3.28Å; L42-N46 WeakPolarHBondContact CA-OD1 3.31Å; E43-N46 PolarHBondContact N-OD1 3.36Å; E43-N46 PolarHBondContact O-N 3.02Å; E43-N46 PolarHBondContact O-OD1 3.27Å; E43-N46 VanDerWaalsContact O-OD1 3.06Å; N46-K48 PolarHBondContact O-N 2.99Å; N46-R49 WeakPolarHBondContact O-CA 3.36Å; N46-R49 WeakPolarHBondContact O-CB 3.48Å; N46-R49 PolarHBondContact O-N 3.26Å; N46-A50 PolarHBondContact O-N 3.37Å
47	F	95.2	Very high	94.8	Very high	7 Å²	7	63.2 Å²	63.2	3%	0.031	30%	0.3	C	S	.	.	H	α-helix	trans	-56.1	-48.5	-176.1	-177.6	-111.6	0	0	0	113.5	L42 E43 R49 A50 L51 V59 I93 L101 L105 Y116 V121	L42-F47 HydrophobicContact CB-CD2 4.43Å; L42-F47 HydrophobicContact CD1-CD2 3.8Å; L42-F47 HydrophobicContact CD1-CE2 4.21Å; E43-F47 WeakPolarHBondContact O-CB 3.48Å; E43-F47 PolarHBondContact O-N 3.47Å; F47-R49 PolarHBondContact O-N 3.13Å; F47-A50 WeakPolarHBondContact O-CB 3.36Å; F47-A50 PolarHBondContact O-N 3.31Å; F47-L51 HydrophobicContact CD1-CD1 3.74Å; F47-L51 HydrophobicContact CE1-CD1 3.38Å; F47-L51 HydrophobicContact CE1-CG 4.31Å; F47-L51 HydrophobicContact CE2-CD1 4.4Å; F47-L51 HydrophobicContact CG-CD1 4.4Å; F47-L51 HydrophobicContact CZ-CD1 3.75Å; F47-L51 HydrophobicContact CZ-CD2 4.39Å; F47-L51 HydrophobicContact CZ-CG 4.23Å; F47-L51 WeakPolarHBondContact O-CG 3.45Å; F47-L51 PolarHBondContact O-N 3.05Å; F47-L51 VanDerWaalsContact O-N 3.08Å; F47-V59 HydrophobicContact CE2-CG2 4.31Å; F47-I93 HydrophobicContact CD2-CD1 3.82Å; F47-I93 HydrophobicContact CE2-CD1 3.93Å; F47-L101 HydrophobicContact CB-CD2 4.18Å; F47-L101 HydrophobicContact CD1-CD1 4.18Å; F47-L101 HydrophobicContact CG-CD2 4.3Å; F47-L105 HydrophobicContact CD1-CD1 4.46Å; F47-L105 HydrophobicContact CE1-CD1 3.82Å; F47-L105 HydrophobicContact CE1-CD2 4.11Å; F47-L105 HydrophobicContact CE2-CD1 4.47Å; F47-L105 HydrophobicContact CZ-CD1 3.85Å; F47-Y116 HydrophobicContact CZ-CE1 4.13Å; F47-Y116 HydrophobicContact CZ-CE2 4.21Å; F47-Y116 AromaticContact CZ-CZ 3.96Å; F47-V121 HydrophobicContact CE1-CG1 4.16Å
48	K	93.6	Very high	95.1	Very high	143 Å²	143	57.4 Å²	57.4	62%	0.622	27%	0.273	S	S	*	.	H	α-helix	trans	-62.1	-30.1	176.9	-72.6	-172.8	177.5	-176.1	0	112.9	N46 R52	N46-K48 PolarHBondContact O-N 2.99Å; K48-R52 WeakPolarHBondContact O-CG 3.44Å; K48-R52 PolarHBondContact O-N 3.03Å; K48-R52 PolarHBondContact O-NE 2.76Å
49	R	94.1	Very high	95.5	Very high	88 Å²	88	57 Å²	57	33%	0.332	27%	0.268	S	S	.	.	H	α-helix	trans	-73.9	-41.2	177.3	-175.6	169.2	64.6	-154.8	9.6	110.6	T31 N46 F47 L51 R52 K53	T31-R49 PolarHBondContact O-NH2 2.95Å; T31-R49 PolarHBondContact OG1-NH1 3.39Å; T31-R49 PolarHBondContact OG1-NH2 3.15Å; N46-R49 WeakPolarHBondContact O-CA 3.36Å; N46-R49 WeakPolarHBondContact O-CB 3.48Å; N46-R49 PolarHBondContact O-N 3.26Å; F47-R49 PolarHBondContact O-N 3.13Å; R49-L51 VanDerWaalsContact C-N 3.34Å; R49-L51 PolarHBondContact O-N 3.13Å; R49-R52 PolarHBondContact O-N 3.08Å; R49-K53 WeakPolarHBondContact O-CB 3.44Å; R49-K53 PolarHBondContact O-N 3.28Å
50	A	95.7	Very high	95.4	Very high	0 Å²	0	56.6 Å²	56.6	0%	0	27%	0.266	C	S	.	.	H	α-helix	trans	-57.9	-46.8	174.1	0	0	0	0	0	111.7	I33 L42 N46 F47 R52 K53 H54 L57	I33-A50 HydrophobicContact CD1-CB 3.71Å; L42-A50 HydrophobicContact CD1-CB 4.15Å; L42-A50 HydrophobicContact CD2-CB 3.63Å; N46-A50 PolarHBondContact O-N 3.37Å; F47-A50 WeakPolarHBondContact O-CB 3.36Å; F47-A50 PolarHBondContact O-N 3.31Å; A50-R52 VanDerWaalsContact C-N 3.33Å; A50-R52 PolarHBondContact O-N 3.43Å; A50-K53 PolarHBondContact O-N 3.4Å; A50-K53 VanDerWaalsContact O-N 3.15Å; A50-H54 PolarHBondContact O-CD2 3.12Å; A50-H54 PolarHBondContact O-N 3.03Å; A50-L57 HydrophobicContact CB-CD1 4.36Å; A50-L57 HydrophobicContact CB-CD2 3.84Å
51	L	95	Very high	95.3	Very high	9 Å²	9	56.6 Å²	56.6	5%	0.047	27%	0.266	C	S	.	.	H	α-helix	trans	-60.8	-36.9	177.7	-73.9	165.8	0	0	0	113.7	F47 R49 L57 Y116 V121	F47-L51 HydrophobicContact CD1-CD1 3.74Å; F47-L51 HydrophobicContact CE1-CD1 3.38Å; F47-L51 HydrophobicContact CE1-CG 4.31Å; F47-L51 HydrophobicContact CE2-CD1 4.4Å; F47-L51 HydrophobicContact CG-CD1 4.4Å; F47-L51 HydrophobicContact CZ-CD1 3.75Å; F47-L51 HydrophobicContact CZ-CD2 4.39Å; F47-L51 HydrophobicContact CZ-CG 4.23Å; F47-L51 WeakPolarHBondContact O-CG 3.45Å; F47-L51 PolarHBondContact O-N 3.05Å; F47-L51 VanDerWaalsContact O-N 3.08Å; R49-L51 VanDerWaalsContact C-N 3.34Å; R49-L51 PolarHBondContact O-N 3.13Å; L51-L57 HydrophobicContact CD2-CD2 3.86Å; L51-L57 HydrophobicContact CG-CD2 4.07Å; L51-Y116 VanDerWaalsContact CD2-CB 3.47Å; L51-Y116 HydrophobicContact CD2-CD1 3.96Å; L51-Y116 HydrophobicContact CD2-CG 3.76Å; L51-V121 HydrophobicContact CD1-CG2 3.32Å
52	R	94.1	Very high	94.9	Very high	162 Å²	162	56.8 Å²	56.8	61%	0.611	27%	0.265	S	S	*	.	H	α-helix	trans	-70.7	-35.2	175.4	-75.3	-176.5	-82	176.9	-4.3	112.1	D26 K48 R49 A50	D26-R52 IonicContact OD1-NH1 3.65Å; D26-R52 IonicContact OD1-NH2 3.91Å; D26-R52 PolarHBondContact OD1-NH2 3.36Å; D26-R52 IonicContact OD2-NH1 3.22Å; K48-R52 WeakPolarHBondContact O-CG 3.44Å; K48-R52 PolarHBondContact O-N 3.03Å; K48-R52 PolarHBondContact O-NE 2.76Å; R49-R52 PolarHBondContact O-N 3.08Å; A50-R52 VanDerWaalsContact C-N 3.33Å; A50-R52 PolarHBondContact O-N 3.43Å
53	K	94.9	Very high	94.3	Very high	132 Å²	132	59.2 Å²	59.2	57%	0.574	28%	0.28	S	S	*	.	H	α-helix	trans	-82.1	-33.9	-174.4	-173.1	172.4	-178.1	172.4	0	113.2	R49 A50	R49-K53 WeakPolarHBondContact O-CB 3.44Å; R49-K53 PolarHBondContact O-N 3.28Å; A50-K53 PolarHBondContact O-N 3.4Å; A50-K53 VanDerWaalsContact O-N 3.15Å
54	H	95.5	Very high	92.9	Very high	38 Å²	38	56.6 Å²	56.6	18%	0.176	27%	0.272	C	S	.	.			trans	-116.6	119.8	-173.7	-61.2	-74.8	0	0	0	110.9	A50 Q56 L57 K89	A50-H54 PolarHBondContact O-CD2 3.12Å; A50-H54 PolarHBondContact O-N 3.03Å; H54-Q56 VanDerWaalsContact C-N 3.29Å; H54-Q56 PolarHBondContact O-N 3.32Å; H54-L57 HydrophobicContact CB-CB 4.43Å; H54-L57 HydrophobicContact CB-CD1 4.25Å; H54-K89 HydrophobicContact CB-CB 4.1Å
55	K	94.1	Very high	91.8	Very high	135 Å²	135	56.3 Å²	56.3	59%	0.587	28%	0.277	S	S	*	.	S	Bend	trans	-64.3	-34.2	177.4	-70.9	179.3	177.2	178.6	0	112.6	E87 L117 S118	K55-E87 WeakPolarHBondContact CD-OE1 3.48Å; K55-L117 CarbonylContact O-C 3.44Å; K55-L117 WeakPolarHBondContact O-CA 3.47Å; K55-S118 PolarHBondContact O-N 3.06Å
56	Q	96.7	Very high	90.7	Very high	50 Å²	50	55.8 Å²	55.8	23%	0.234	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	103.7	177.6	-58.4	-164.9	50.3	0	0	108.2	H54 E87 V88 K89 L115 L117	H54-Q56 VanDerWaalsContact C-N 3.29Å; H54-Q56 PolarHBondContact O-N 3.32Å; Q56-E87 HydrophobicContact CG-CG 4.4Å; Q56-E87 PolarHBondContact NE2-OE2 3.28Å; Q56-V88 HydrophobicContact CB-CB 4.46Å; Q56-V88 HydrophobicContact CB-CG2 4.09Å; Q56-K89 PolarHBondContact O-N 3.42Å; Q56-L115 HydrophobicContact CB-CD1 4.24Å; Q56-L117 HydrophobicContact CB-CD2 4.42Å; Q56-L117 HydrophobicContact CG-CD2 3.9Å
57	L	97.6	Very high	89.6	Confident	0 Å²	0	60.3 Å²	60.3	0%	0	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	108.9	-177.9	-173.9	72.5	0	0	0	109.6	L40 L42 A50 L51 H54 V59 K89 A91 Y116	L40-L57 HydrophobicContact CD1-CD1 4.16Å; L42-L57 HydrophobicContact CD1-CD2 4.02Å; A50-L57 HydrophobicContact CB-CD1 4.36Å; A50-L57 HydrophobicContact CB-CD2 3.84Å; L51-L57 HydrophobicContact CD2-CD2 3.86Å; L51-L57 HydrophobicContact CG-CD2 4.07Å; H54-L57 HydrophobicContact CB-CB 4.43Å; H54-L57 HydrophobicContact CB-CD1 4.25Å; L57-V59 HydrophobicContact CD2-CG2 3.92Å; L57-V59 HydrophobicContact CG-CG2 3.78Å; L57-K89 HydrophobicContact CD1-CB 4.25Å; L57-K89 HydrophobicContact CD1-CG 4.44Å; L57-A91 HydrophobicContact CD1-CB 4.07Å; L57-Y116 PolarHBondContact N-O 2.76Å; L57-Y116 PolarHBondContact O-N 3.38Å
58	L	97.8	Very high	88.5	Confident	1 Å²	1	62.4 Å²	62.4	1%	0.005	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.6	112.3	179	-175.5	73.7	0	0	0	109.6	F76 L83 V88 K89 P90 A91 I113 R114 L115 I136 W139 L140	L58-F76 HydrophobicContact CD2-CD2 4.45Å; L58-F76 HydrophobicContact CD2-CE2 3.63Å; L58-F76 HydrophobicContact CD2-CZ 4.25Å; L58-F76 HydrophobicContact CG-CE2 3.81Å; L58-F76 HydrophobicContact CG-CZ 4.33Å; L58-L83 HydrophobicContact CD2-CD1 4.12Å; L58-V88 HydrophobicContact CB-CG1 3.72Å; L58-K89 PolarHBondContact N-O 3.01Å; L58-P90 CarbonylContact O-C 3.53Å; L58-P90 WeakPolarHBondContact O-CA 3.33Å; L58-A91 PolarHBondContact O-N 3.07Å; L58-I113 HydrophobicContact CD1-CG2 3.66Å; L58-I113 HydrophobicContact CG-CG2 4.13Å; L58-R114 CarbonylContact C-O 3.55Å; L58-L115 HydrophobicContact CB-CD1 4.27Å; L58-L115 HydrophobicContact CD1-CB 4.09Å; L58-L115 HydrophobicContact CD1-CD1 4.41Å; L58-I136 HydrophobicContact CD2-CG2 3.93Å; L58-W139 HydrophobicContact CD1-CZ3 3.79Å; L58-L140 HydrophobicContact CD1-CD2 4.4Å; L58-L140 HydrophobicContact CD2-CD1 4.3Å
59	V	97.4	Very high	87.9	Confident	0 Å²	0	56.2 Å²	56.2	0%	0	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	123.4	-171.4	-171.7	0	0	0	0	110.6	L42 F47 L57 F61 A91 I93 I113 R114 Y116	L42-V59 HydrophobicContact CD1-CG2 4.22Å; F47-V59 HydrophobicContact CE2-CG2 4.31Å; L57-V59 HydrophobicContact CD2-CG2 3.92Å; L57-V59 HydrophobicContact CG-CG2 3.78Å; V59-F61 HydrophobicContact CB-CE2 4Å; V59-F61 HydrophobicContact CB-CZ 4.38Å; V59-F61 HydrophobicContact CG1-CD2 4.24Å; V59-F61 HydrophobicContact CG1-CE1 4.36Å; V59-F61 HydrophobicContact CG1-CE2 3.73Å; V59-F61 HydrophobicContact CG1-CZ 3.8Å; V59-A91 CarbonylContact C-O 3.54Å; V59-A91 WeakPolarHBondContact CA-O 3.48Å; V59-A91 HydrophobicContact CG2-CB 4.16Å; V59-I93 HydrophobicContact CG1-CD1 3.73Å; V59-I93 HydrophobicContact CG1-CG1 3.88Å; V59-I113 WeakPolarHBondContact O-CA 3.36Å; V59-R114 PolarHBondContact N-O 3.49Å; V59-R114 PolarHBondContact O-N 3.15Å; V59-Y116 HydrophobicContact CB-CD2 4.29Å; V59-Y116 HydrophobicContact CB-CE2 3.98Å; V59-Y116 HydrophobicContact CG2-CD2 3.66Å; V59-Y116 HydrophobicContact CG2-CE2 3.75Å
60	H	95.8	Very high	87.3	Confident	4 Å²	4	57.4 Å²	57.4	2%	0.019	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.6	115	170	178.2	-150	0	0	0	111.2	Y62 F76 A91 V92 I93 I113	H60-Y62 WeakPolarHBondContact CE1-CB 3.38Å; H60-Y62 PolarHBondContact O-N 2.9Å; H60-F76 HydrophobicContact CB-CD1 3.92Å; H60-F76 HydrophobicContact CB-CD2 3.7Å; H60-F76 HydrophobicContact CB-CE1 3.91Å; H60-F76 HydrophobicContact CB-CE2 3.66Å; H60-F76 HydrophobicContact CB-CG 3.81Å; H60-F76 HydrophobicContact CB-CZ 3.77Å; H60-A91 PolarHBondContact N-O 3.31Å; H60-V92 HydrophobicContact CB-CG1 4.18Å; H60-V92 CarbonylContact O-C 3.52Å; H60-V92 WeakPolarHBondContact O-CA 3.25Å; H60-I93 PolarHBondContact O-N 2.79Å; H60-I113 HydrophobicContact CB-CG1 3.98Å
61	F	94	Very high	86.9	Confident	6 Å²	6	60.5 Å²	60.5	3%	0.026	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.1	91.5	173.3	-63.5	-90.1	0	0	0	109.1	V59 I93 V95 L105 A107 S112 R114 Y116	V59-F61 HydrophobicContact CB-CE2 4Å; V59-F61 HydrophobicContact CB-CZ 4.38Å; V59-F61 HydrophobicContact CG1-CD2 4.24Å; V59-F61 HydrophobicContact CG1-CE1 4.36Å; V59-F61 HydrophobicContact CG1-CE2 3.73Å; V59-F61 HydrophobicContact CG1-CZ 3.8Å; F61-I93 WeakPolarHBondContact CA-O 3.4Å; F61-I93 HydrophobicContact CD1-CB 3.92Å; F61-I93 HydrophobicContact CD1-CD1 4.16Å; F61-I93 HydrophobicContact CD1-CG2 4.08Å; F61-I93 HydrophobicContact CE1-CB 4.15Å; F61-I93 HydrophobicContact CE1-CD1 3.48Å; F61-I93 VanDerWaalsContact CE1-CD1 3.48Å; F61-I93 HydrophobicContact CE1-CG1 4.32Å; F61-I93 HydrophobicContact CE1-CG2 4.32Å; F61-I93 HydrophobicContact CZ-CD1 3.95Å; F61-V95 HydrophobicContact CB-CG2 3.77Å; F61-V95 HydrophobicContact CD1-CG2 4.47Å; F61-L105 HydrophobicContact CE1-CD1 3.76Å; F61-L105 HydrophobicContact CZ-CD1 3.83Å; F61-A107 HydrophobicContact CB-CB 4.25Å; F61-A107 HydrophobicContact CD1-CB 3.37Å; F61-A107 HydrophobicContact CD2-CB 4.02Å; F61-A107 HydrophobicContact CE1-CB 3.57Å; F61-A107 HydrophobicContact CE2-CB 4.22Å; F61-A107 HydrophobicContact CG-CB 3.61Å; F61-A107 HydrophobicContact CZ-CB 4.01Å; F61-S112 WeakPolarHBondContact CB-O 3.35Å; F61-S112 WeakPolarHBondContact CD2-O 3.48Å; F61-S112 PolarHBondContact N-O 2.97Å; F61-S112 WeakPolarHBondContact O-CB 3.33Å; F61-R114 HydrophobicContact CD2-CG 4.32Å; F61-R114 HydrophobicContact CE2-CB 4.17Å; F61-R114 HydrophobicContact CE2-CG 4.03Å; F61-Y116 HydrophobicContact CE2-CE2 4.21Å; F61-Y116 HydrophobicContact CZ-CE2 4.27Å; F61-Y116 WeakPolarHBondContact CZ-OH 3.27Å
62	Y	88.3	Confident	86.6	Confident	59 Å²	59	60.2 Å²	60.2	23%	0.231	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.1	152.6	-170	78.6	-88.2	0	0	0	112.7	H60 P64 V92 I93 D94 V95	H60-Y62 WeakPolarHBondContact CE1-CB 3.38Å; H60-Y62 PolarHBondContact O-N 2.9Å; Y62-P64 HydrophobicContact CD2-CB 4.35Å; Y62-P64 HydrophobicContact CE2-CB 4.17Å; Y62-P64 HydrophobicContact CE2-CG 4.26Å; Y62-V92 HydrophobicContact CD1-CB 3.98Å; Y62-V92 HydrophobicContact CD1-CG1 4.34Å; Y62-V92 HydrophobicContact CE1-CB 3.93Å; Y62-V92 HydrophobicContact CE1-CG2 4.27Å; Y62-I93 WeakPolarHBondContact CD1-O 3.46Å; Y62-I93 PolarHBondContact N-O 3.3Å; Y62-D94 HydrophobicContact CE1-CB 3.89Å; Y62-D94 HydrophobicContact CE2-CB 4.3Å; Y62-D94 WeakPolarHBondContact OH-CB 3.44Å; Y62-D94 PolarHBondContact OH-OD2 3.18Å; Y62-V95 PolarHBondContact O-N 2.91Å; Y62-V95 VanDerWaalsContact O-N 3.09Å
63	T	83.3	Confident	86.5	Confident	54 Å²	54	54.2 Å²	54.2	33%	0.331	28%	0.282	S	S	.	.			trans	-125.4	115.8	168.8	53.1	0	0	0	0	108.6	L65 V95 T96	T63-L65 PolarHBondContact O-N 3.09Å; T63-V95 HydrophobicContact CG2-CB 3.96Å; T63-V95 HydrophobicContact CG2-CG1 4.36Å; T63-T96 HydrophobicContact CG2-CG2 4.44Å
64	P	67	Low	86.3	Confident	50 Å²	50	51 Å²	51	33%	0.325	28%	0.28	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.8	13.8	-167.3	29.2	-34.7	0	0	0	115.4	Y62 H70	Y62-P64 HydrophobicContact CD2-CB 4.35Å; Y62-P64 HydrophobicContact CE2-CB 4.17Å; Y62-P64 HydrophobicContact CE2-CG 4.26Å; P64-H70 PolarHBondContact O-NE2 3.29Å
65	L	69.8	Low	86.2	Confident	156 Å²	156	49.7 Å²	49.7	82%	0.817	28%	0.276	S	S	*	.	T	Hydrogen-bonded Turn	trans	-118	-2	-168.7	-65.7	172.8	0	0	0	114.7	T63	T63-L65 PolarHBondContact O-N 3.09Å
66	T	69.7	Low	86.3	Confident	65 Å²	65	43.4 Å²	43.4	40%	0.399	25%	0.248	S	C	.	.	S	Bend	trans	-110.8	144.3	-179	64	0	0	0	0	110.9	E68 G69 H70	T66-E68 VanDerWaalsContact C-N 3.28Å; T66-E68 PolarHBondContact O-N 2.71Å; T66-G69 WeakPolarHBondContact O-CA 3.3Å; T66-G69 PolarHBondContact O-N 3.05Å; T66-G69 VanDerWaalsContact O-N 3.09Å; T66-G69 WeakPolarHBondContact OG1-CA 3.46Å; T66-G69 PolarHBondContact OG1-N 2.98Å; T66-H70 PolarHBondContact O-N 3.43Å
67	S	71.6	Confident	86.3	Confident	107 Å²	107	45.9 Å²	45.9	75%	0.748	26%	0.258	S	S	*	.	H	α-helix	trans	-57.8	-42.4	177.3	51.3	0	0	0	0	111.9	H70 R71	S67-H70 PolarHBondContact O-N 2.91Å; S67-R71 PolarHBondContact O-N 2.84Å; S67-R71 VanDerWaalsContact O-N 3.12Å
68	E	73.2	Confident	86.2	Confident	52 Å²	52	47.9 Å²	47.9	24%	0.243	28%	0.275	C	S	.	.	H	α-helix	trans	-64.3	-41.3	174.5	-171.1	65.7	-174.6	0	0	111.5	T66 H70 R71 V72 V129	T66-E68 VanDerWaalsContact C-N 3.28Å; T66-E68 PolarHBondContact O-N 2.71Å; E68-H70 VanDerWaalsContact C-N 3.32Å; E68-H70 PolarHBondContact O-N 3.01Å; E68-R71 WeakPolarHBondContact O-CB 3.13Å; E68-R71 PolarHBondContact O-N 3.34Å; E68-R71 IonicContact OE1-CZ 2.7Å; E68-R71 IonicContact OE1-NE 3.12Å; E68-R71 PolarHBondContact OE1-NE 3.31Å; E68-R71 IonicContact OE1-NH2 2.93Å; E68-R71 PolarHBondContact OE1-NH2 3.19Å; E68-R71 IonicContact OE2-CZ 3.53Å; E68-R71 IonicContact OE2-NE 3.67Å; E68-R71 PolarHBondContact OE2-NE 3.04Å; E68-R71 IonicContact OE2-NH2 3.42Å; E68-V72 WeakPolarHBondContact O-CG2 3.21Å; E68-V72 PolarHBondContact O-N 2.93Å; E68-V129 WeakPolarHBondContact OE1-CG1 3.35Å
69	G	79.6	Confident	86.2	Confident	12 Å²	12	47.9 Å²	47.9	12%	0.124	28%	0.276	C	S	.	.	H	α-helix	trans	-59.8	-40.6	175.3	0	0	0	0	0	112.5	T66 A73	T66-G69 WeakPolarHBondContact O-CA 3.3Å; T66-G69 PolarHBondContact O-N 3.05Å; T66-G69 VanDerWaalsContact O-N 3.09Å; T66-G69 WeakPolarHBondContact OG1-CA 3.46Å; T66-G69 PolarHBondContact OG1-N 2.98Å; G69-A73 WeakPolarHBondContact O-CB 3.24Å; G69-A73 PolarHBondContact O-N 3.1Å
70	H	83.5	Confident	86.1	Confident	114 Å²	114	47.9 Å²	47.9	53%	0.528	28%	0.276	S	S	.	.	H	α-helix	trans	-64.1	-44.1	173.9	-71.1	158.7	0	0	0	112.6	P64 T66 S67 E68 A73 A74	P64-H70 PolarHBondContact O-NE2 3.29Å; T66-H70 PolarHBondContact O-N 3.43Å; S67-H70 PolarHBondContact O-N 2.91Å; E68-H70 VanDerWaalsContact C-N 3.32Å; E68-H70 PolarHBondContact O-N 3.01Å; H70-A73 PolarHBondContact O-N 3.06Å; H70-A74 WeakPolarHBondContact O-CB 3.22Å; H70-A74 PolarHBondContact O-N 3.28Å
71	R	86.2	Confident	86.1	Confident	64 Å²	64	50.8 Å²	50.8	24%	0.242	30%	0.3	C	S	.	.	H	α-helix	trans	-60.3	-49.4	178.5	-168.9	-173.8	68.6	68.9	1.2	111.2	S67 E68 A74 A75 P130 Q131	S67-R71 PolarHBondContact O-N 2.84Å; S67-R71 VanDerWaalsContact O-N 3.12Å; E68-R71 WeakPolarHBondContact O-CB 3.13Å; E68-R71 PolarHBondContact O-N 3.34Å; E68-R71 IonicContact OE1-CZ 2.7Å; E68-R71 IonicContact OE1-NE 3.12Å; E68-R71 PolarHBondContact OE1-NE 3.31Å; E68-R71 IonicContact OE1-NH2 2.93Å; E68-R71 PolarHBondContact OE1-NH2 3.19Å; E68-R71 IonicContact OE2-CZ 3.53Å; E68-R71 IonicContact OE2-NE 3.67Å; E68-R71 PolarHBondContact OE2-NE 3.04Å; E68-R71 IonicContact OE2-NH2 3.42Å; R71-A74 PolarHBondContact O-N 2.84Å; R71-A75 PolarHBondContact O-N 2.69Å; R71-P130 VanDerWaalsContact CZ-O 3.28Å; R71-P130 PolarHBondContact NH1-O 3.04Å; R71-P130 PolarHBondContact NH2-O 3.37Å; R71-Q131 PolarHBondContact NH1-O 2.99Å; R71-Q131 VanDerWaalsContact NH1-O 3.09Å
72	V	89.3	Confident	86.3	Confident	4 Å²	4	57.4 Å²	57.4	2%	0.024	33%	0.331	C	S	.	.	H	α-helix	trans	-65.7	-39.8	178.4	176.7	0	0	0	0	111.3	E68 A74 A75 F76 I113 V129 P130	E68-V72 WeakPolarHBondContact O-CG2 3.21Å; E68-V72 PolarHBondContact O-N 2.93Å; V72-A74 PolarHBondContact O-N 3Å; V72-A75 PolarHBondContact O-N 2.86Å; V72-F76 VanDerWaalsContact O-CB 3.31Å; V72-F76 WeakPolarHBondContact O-CB 3.37Å; V72-F76 PolarHBondContact O-N 2.95Å; V72-I113 HydrophobicContact CG1-CD1 3.69Å; V72-I113 HydrophobicContact CG1-CG1 4.32Å; V72-V129 HydrophobicContact CG2-CG1 4.24Å; V72-P130 HydrophobicContact CG1-CG 4Å; V72-P130 HydrophobicContact CG2-CG 4.44Å
73	A	90.9	Very high	86.6	Confident	35 Å²	35	55.4 Å²	55.4	29%	0.289	32%	0.324	S	S	.	.	H	α-helix	trans	-62	-41.7	175.6	0	0	0	0	0	112.4	G69 H70 F76 K77	G69-A73 WeakPolarHBondContact O-CB 3.24Å; G69-A73 PolarHBondContact O-N 3.1Å; H70-A73 PolarHBondContact O-N 3.06Å; A73-F76 PolarHBondContact O-N 2.95Å; A73-K77 WeakPolarHBondContact O-CB 3.19Å; A73-K77 PolarHBondContact O-N 3.45Å
74	A	92	Very high	87	Confident	65 Å²	65	57.3 Å²	57.3	54%	0.537	33%	0.33	S	S	.	.	H	α-helix	trans	-64.4	-46.5	175.9	0	0	0	0	0	111.6	H70 R71 V72 F76 K77 A78	H70-A74 WeakPolarHBondContact O-CB 3.22Å; H70-A74 PolarHBondContact O-N 3.28Å; R71-A74 PolarHBondContact O-N 2.84Å; V72-A74 PolarHBondContact O-N 3Å; A74-F76 VanDerWaalsContact C-N 3.34Å; A74-F76 PolarHBondContact O-N 3.33Å; A74-K77 PolarHBondContact O-N 2.86Å; A74-A78 PolarHBondContact O-N 3.23Å
75	A	93.3	Very high	88.1	Confident	10 Å²	10	59.2 Å²	59.2	8%	0.083	36%	0.358	C	S	.	.	H	α-helix	trans	-58.6	-44.6	175	0	0	0	0	0	112	R71 V72 A78 A79 S133 I136	R71-A75 PolarHBondContact O-N 2.69Å; V72-A75 PolarHBondContact O-N 2.86Å; A75-A78 PolarHBondContact O-N 3.05Å; A75-A79 PolarHBondContact O-N 2.97Å; A75-S133 WeakPolarHBondContact O-CB 3.46Å; A75-I136 HydrophobicContact CB-CD1 4.48Å
76	F	95.9	Very high	89.2	Confident	3 Å²	3	54.4 Å²	54.4	1%	0.013	34%	0.337	C	S	.	.	H	α-helix	trans	-63.3	-45.2	178	-172.7	-93.3	0	0	0	112.4	I39 L58 H60 V72 A73 A74 A78 A79 A80 P90 A91 V92 I113 I136	I39-F76 HydrophobicContact CD1-CE1 4.48Å; I39-F76 HydrophobicContact CG2-CE1 4.2Å; L58-F76 HydrophobicContact CD2-CD2 4.45Å; L58-F76 HydrophobicContact CD2-CE2 3.63Å; L58-F76 HydrophobicContact CD2-CZ 4.25Å; L58-F76 HydrophobicContact CG-CE2 3.81Å; L58-F76 HydrophobicContact CG-CZ 4.33Å; H60-F76 HydrophobicContact CB-CD1 3.92Å; H60-F76 HydrophobicContact CB-CD2 3.7Å; H60-F76 HydrophobicContact CB-CE1 3.91Å; H60-F76 HydrophobicContact CB-CE2 3.66Å; H60-F76 HydrophobicContact CB-CG 3.81Å; H60-F76 HydrophobicContact CB-CZ 3.77Å; V72-F76 VanDerWaalsContact O-CB 3.31Å; V72-F76 WeakPolarHBondContact O-CB 3.37Å; V72-F76 PolarHBondContact O-N 2.95Å; A73-F76 PolarHBondContact O-N 2.95Å; A74-F76 VanDerWaalsContact C-N 3.34Å; A74-F76 PolarHBondContact O-N 3.33Å; F76-A78 VanDerWaalsContact C-N 3.33Å; F76-A78 PolarHBondContact O-N 2.85Å; F76-A79 PolarHBondContact O-N 2.76Å; F76-A80 WeakPolarHBondContact O-CB 3.28Å; F76-A80 PolarHBondContact O-N 2.82Å; F76-P90 HydrophobicContact CE1-CB 4.22Å; F76-P90 HydrophobicContact CZ-CB 4.11Å; F76-A91 WeakPolarHBondContact CZ-O 3.27Å; F76-V92 HydrophobicContact CD1-CG1 4.25Å; F76-V92 HydrophobicContact CE1-CG1 3.94Å; F76-I113 HydrophobicContact CB-CD1 4.47Å; F76-I113 HydrophobicContact CD2-CD1 3.8Å; F76-I113 HydrophobicContact CD2-CG1 4.04Å; F76-I113 HydrophobicContact CD2-CG2 4.37Å; F76-I113 HydrophobicContact CE2-CG1 4.46Å; F76-I113 HydrophobicContact CE2-CG2 4.17Å; F76-I136 HydrophobicContact CB-CD1 4.25Å; F76-I136 HydrophobicContact CD2-CD1 4.22Å
77	K	95.6	Very high	90.3	Very high	102 Å²	102	56.6 Å²	56.6	44%	0.443	34%	0.343	S	S	.	.	H	α-helix	trans	-61	-43.1	177.7	176.9	172.5	168.2	164.4	0	111.5	E37 I39 A73 A74 A80 A81	E37-K77 IonicContact OE1-NZ 3.06Å; E37-K77 PolarHBondContact OE1-NZ 3.36Å; E37-K77 WeakPolarHBondContact OE2-CE 3.44Å; E37-K77 IonicContact OE2-NZ 2.65Å; E37-K77 PolarHBondContact OE2-NZ 3.16Å; I39-K77 HydrophobicContact CD1-CG 4.5Å; A73-K77 WeakPolarHBondContact O-CB 3.19Å; A73-K77 PolarHBondContact O-N 3.45Å; A74-K77 PolarHBondContact O-N 2.86Å; K77-A80 PolarHBondContact O-N 2.86Å; K77-A81 PolarHBondContact O-N 3.22Å
78	A	96.4	Very high	91.5	Very high	43 Å²	43	52.1 Å²	52.1	36%	0.355	31%	0.311	S	S	.	.	H	α-helix	trans	-64.9	-42.6	176.1	0	0	0	0	0	112.1	A74 A75 F76 A80 A81 E82	A74-A78 PolarHBondContact O-N 3.23Å; A75-A78 PolarHBondContact O-N 3.05Å; F76-A78 VanDerWaalsContact C-N 3.33Å; F76-A78 PolarHBondContact O-N 2.85Å; A78-A80 VanDerWaalsContact C-N 3.34Å; A78-A80 PolarHBondContact O-N 3.27Å; A78-A81 WeakPolarHBondContact O-CB 3.48Å; A78-A81 PolarHBondContact O-N 2.98Å; A78-E82 PolarHBondContact O-N 3.3Å
79	A	96.8	Very high	92.6	Very high	1 Å²	1	51.3 Å²	51.3	1%	0.008	31%	0.307	C	S	.	.	H	α-helix	trans	-63.6	-39.1	174.2	0	0	0	0	0	112.3	A75 F76 A81 E82 L83 I136 L137	A75-A79 PolarHBondContact O-N 2.97Å; F76-A79 PolarHBondContact O-N 2.76Å; A79-A81 PolarHBondContact O-N 3.42Å; A79-E82 PolarHBondContact O-N 2.7Å; A79-E82 VanDerWaalsContact O-N 3.15Å; A79-L83 VanDerWaalsContact O-CG 3.29Å; A79-L83 WeakPolarHBondContact O-CG 3.37Å; A79-L83 PolarHBondContact O-N 3.44Å; A79-I136 HydrophobicContact CB-CB 3.93Å; A79-I136 HydrophobicContact CB-CD1 3.92Å; A79-I136 HydrophobicContact CB-CG1 4.49Å; A79-I136 HydrophobicContact CB-CG2 4.03Å; A79-L137 HydrophobicContact CB-CD2 4.35Å; A79-L137 HydrophobicContact CB-CG 4.39Å
80	A	96.7	Very high	93.5	Very high	0 Å²	0	50.8 Å²	50.8	0%	0	30%	0.301	C	S	.	.	H	α-helix	trans	-63.8	-29.5	177.7	0	0	0	0	0	113.2	I39 F76 K77 A78 Q84 P90	I39-A80 HydrophobicContact CD1-CB 3.72Å; I39-A80 HydrophobicContact CG1-CB 3.64Å; F76-A80 WeakPolarHBondContact O-CB 3.28Å; F76-A80 PolarHBondContact O-N 2.82Å; K77-A80 PolarHBondContact O-N 2.86Å; A78-A80 VanDerWaalsContact C-N 3.34Å; A78-A80 PolarHBondContact O-N 3.27Å; A80-Q84 PolarHBondContact O-NE2 2.91Å; A80-P90 HydrophobicContact CB-CB 3.65Å; A80-P90 HydrophobicContact CB-CG 3.72Å
81	A	96.4	Very high	94.2	Very high	65 Å²	65	45.4 Å²	45.4	54%	0.537	28%	0.276	S	S	.	.	H	α-helix	trans	-68.5	-39.2	173.4	0	0	0	0	0	111.9	K77 A78 A79 L83 Q84	K77-A81 PolarHBondContact O-N 3.22Å; A78-A81 WeakPolarHBondContact O-CB 3.48Å; A78-A81 PolarHBondContact O-N 2.98Å; A79-A81 PolarHBondContact O-N 3.42Å; A81-L83 VanDerWaalsContact C-N 3.34Å; A81-Q84 VanDerWaalsContact O-CG 3.27Å; A81-Q84 WeakPolarHBondContact O-CG 3.39Å
82	E	96.4	Very high	94.7	Very high	144 Å²	144	43 Å²	43	67%	0.673	27%	0.269	S	S	*	.	H	α-helix	trans	-72.1	-27.4	176	-63.2	-75.8	178.1	0	0	112.3	A78 A79 Q84 L137	A78-E82 PolarHBondContact O-N 3.3Å; A79-E82 PolarHBondContact O-N 2.7Å; A79-E82 VanDerWaalsContact O-N 3.15Å; E82-Q84 VanDerWaalsContact C-N 3.28Å; E82-Q84 PolarHBondContact O-N 2.84Å; E82-L137 HydrophobicContact CB-CD1 3.87Å; E82-L137 HydrophobicContact CB-CD2 4.21Å; E82-L137 HydrophobicContact CG-CD1 4.01Å
83	L	95.5	Very high	94.9	Very high	17 Å²	17	42.8 Å²	42.8	9%	0.089	27%	0.268	C	S	.	.	T	Hydrogen-bonded Turn	trans	-82	0.7	178.9	-69	171.3	0	0	0	114	L58 A79 A81 G85 S86 V88 P90 L137 L140	L58-L83 HydrophobicContact CD2-CD1 4.12Å; A79-L83 VanDerWaalsContact O-CG 3.29Å; A79-L83 WeakPolarHBondContact O-CG 3.37Å; A79-L83 PolarHBondContact O-N 3.44Å; A81-L83 VanDerWaalsContact C-N 3.34Å; L83-G85 PolarHBondContact O-N 3.13Å; L83-S86 VanDerWaalsContact O-CB 3.3Å; L83-S86 WeakPolarHBondContact O-CB 3.26Å; L83-S86 PolarHBondContact O-N 3.36Å; L83-S86 PolarHBondContact O-OG 3.35Å; L83-V88 HydrophobicContact CD1-CG1 4.17Å; L83-V88 HydrophobicContact CD2-CB 4.33Å; L83-P90 HydrophobicContact CB-CG 4.12Å; L83-P90 HydrophobicContact CD1-CG 4.21Å; L83-L137 HydrophobicContact CD1-CD2 4.38Å; L83-L137 HydrophobicContact CD2-CD2 3.78Å; L83-L137 HydrophobicContact CG-CD2 3.81Å; L83-L140 HydrophobicContact CD1-CD1 3.77Å; L83-L140 HydrophobicContact CD2-CD1 3.89Å; L83-L140 HydrophobicContact CG-CD1 4.45Å
84	Q	92.4	Very high	95	Very high	95 Å²	95	42.5 Å²	42.5	44%	0.444	26%	0.261	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.3	127	178.5	-68.1	-56.4	-54.3	0	0	110.8	G38 A80 A81 E82 S86	G38-Q84 PolarHBondContact O-NE2 2.91Å; A80-Q84 PolarHBondContact O-NE2 2.91Å; A81-Q84 VanDerWaalsContact O-CG 3.27Å; A81-Q84 WeakPolarHBondContact O-CG 3.39Å; E82-Q84 VanDerWaalsContact C-N 3.28Å; E82-Q84 PolarHBondContact O-N 2.84Å; Q84-S86 VanDerWaalsContact C-N 3.27Å; Q84-S86 PolarHBondContact O-N 3.16Å
85	G	88.4	Confident	94.9	Very high	89 Å²	89	40.2 Å²	40.2	92%	0.918	24%	0.24	S	C	*	.	T	Hydrogen-bonded Turn	trans	80.7	-3.1	-177	0	0	0	0	0	115.3	L83	L83-G85 PolarHBondContact O-N 3.13Å
86	S	93.1	Very high	94.7	Very high	55 Å²	55	42.7 Å²	42.7	39%	0.385	26%	0.255	S	S	.	.	S	Bend	trans	-78.1	167.8	171.7	80.6	0	0	0	0	112.3	L83 Q84 V88	L83-S86 VanDerWaalsContact O-CB 3.3Å; L83-S86 WeakPolarHBondContact O-CB 3.26Å; L83-S86 PolarHBondContact O-N 3.36Å; L83-S86 PolarHBondContact O-OG 3.35Å; Q84-S86 VanDerWaalsContact C-N 3.27Å; Q84-S86 PolarHBondContact O-N 3.16Å; S86-V88 PolarHBondContact O-N 3.16Å; S86-V88 PolarHBondContact OG-N 3.24Å; S86-V88 PolarHBondContact OG-O 2.91Å
87	E	93	Very high	94.5	Very high	112 Å²	112	46.9 Å²	46.9	52%	0.523	28%	0.281	S	S	.	.	S	Bend	trans	-68.2	-24	173	-167.2	179.9	-162.3	0	0	112.3	K55 Q56 K89	K55-E87 WeakPolarHBondContact CD-OE1 3.48Å; Q56-E87 HydrophobicContact CG-CG 4.4Å; Q56-E87 PolarHBondContact NE2-OE2 3.28Å; E87-K89 PolarHBondContact O-N 3.41Å
88	V	96.6	Very high	94.4	Very high	13 Å²	13	43.7 Å²	43.7	8%	0.079	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.4	110.7	178.6	-177	0	0	0	0	109.1	Q56 L58 L83 S86 P90 L115 L140	Q56-V88 HydrophobicContact CB-CB 4.46Å; Q56-V88 HydrophobicContact CB-CG2 4.09Å; L58-V88 HydrophobicContact CB-CG1 3.72Å; L83-V88 HydrophobicContact CD1-CG1 4.17Å; L83-V88 HydrophobicContact CD2-CB 4.33Å; S86-V88 PolarHBondContact O-N 3.16Å; S86-V88 PolarHBondContact OG-N 3.24Å; S86-V88 PolarHBondContact OG-O 2.91Å; V88-P90 WeakPolarHBondContact O-CD 3.4Å; V88-L115 HydrophobicContact CG1-CD1 4.37Å; V88-L140 HydrophobicContact CG1-CD1 4.15Å; V88-L140 HydrophobicContact CG1-CD2 4.32Å; V88-L140 HydrophobicContact CG2-CD2 4.42Å
89	K	97.5	Very high	94.1	Very high	34 Å²	34	48.9 Å²	48.9	15%	0.148	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.4	118.6	176.5	-171	62.1	175.9	171.1	0	110.8	E35 G38 L40 H54 Q56 L57 L58 E87	E35-K89 IonicContact OE1-NZ 3.36Å; E35-K89 PolarHBondContact OE1-NZ 3.3Å; E35-K89 IonicContact OE2-NZ 2.67Å; E35-K89 PolarHBondContact OE2-NZ 2.62Å; G38-K89 PolarHBondContact O-NZ 2.86Å; L40-K89 HydrophobicContact CD1-CG 3.66Å; L40-K89 HydrophobicContact CG-CD 4.39Å; L40-K89 HydrophobicContact CG-CG 3.97Å; H54-K89 HydrophobicContact CB-CB 4.1Å; Q56-K89 PolarHBondContact O-N 3.42Å; L57-K89 HydrophobicContact CD1-CB 4.25Å; L57-K89 HydrophobicContact CD1-CG 4.44Å; L58-K89 PolarHBondContact N-O 3.01Å; E87-K89 PolarHBondContact O-N 3.41Å
90	P	97.9	Very high	93.9	Very high	2 Å²	2	51.5 Å²	51.5	1%	0.013	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.9	144.5	175.5	-16	32.4	0	0	0	112.2	I39 L40 L58 F76 A80 L83 V88	I39-P90 HydrophobicContact CG1-CB 4.39Å; L40-P90 PolarHBondContact N-O 2.6Å; L58-P90 CarbonylContact O-C 3.53Å; L58-P90 WeakPolarHBondContact O-CA 3.33Å; F76-P90 HydrophobicContact CE1-CB 4.22Å; F76-P90 HydrophobicContact CZ-CB 4.11Å; A80-P90 HydrophobicContact CB-CB 3.65Å; A80-P90 HydrophobicContact CB-CG 3.72Å; L83-P90 HydrophobicContact CB-CG 4.12Å; L83-P90 HydrophobicContact CD1-CG 4.21Å; V88-P90 WeakPolarHBondContact O-CD 3.4Å
91	A	97.6	Very high	93.7	Very high	0 Å²	0	52.2 Å²	52.2	0%	0	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.8	155.8	-179.1	0	0	0	0	0	111.6	L40 L42 L57 L58 V59 H60 F76	L40-A91 HydrophobicContact CB-CB 3.92Å; L40-A91 CarbonylContact O-C 3.52Å; L40-A91 VanDerWaalsContact O-CA 3.27Å; L40-A91 WeakPolarHBondContact O-CA 3.31Å; L42-A91 HydrophobicContact CD1-CB 3.44Å; L42-A91 VanDerWaalsContact CD1-CB 3.44Å; L42-A91 HydrophobicContact CG-CB 3.8Å; L57-A91 HydrophobicContact CD1-CB 4.07Å; L58-A91 PolarHBondContact O-N 3.07Å; V59-A91 CarbonylContact C-O 3.54Å; V59-A91 WeakPolarHBondContact CA-O 3.48Å; V59-A91 HydrophobicContact CG2-CB 4.16Å; H60-A91 PolarHBondContact N-O 3.31Å; F76-A91 WeakPolarHBondContact CZ-O 3.27Å
92	V	96.4	Very high	93.4	Very high	14 Å²	14	49.1 Å²	49.1	9%	0.085	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	148.6	175	-69.9	0	0	0	0	111.2	I39 L40 Q41 L42 H60 Y62 F76	I39-V92 HydrophobicContact CG2-CB 4.35Å; I39-V92 HydrophobicContact CG2-CG1 3.76Å; I39-V92 HydrophobicContact CG2-CG2 4.02Å; L40-V92 PolarHBondContact O-N 2.93Å; Q41-V92 VanDerWaalsContact OE1-CG2 3.26Å; L42-V92 PolarHBondContact N-O 3.12Å; H60-V92 HydrophobicContact CB-CG1 4.18Å; H60-V92 CarbonylContact O-C 3.52Å; H60-V92 WeakPolarHBondContact O-CA 3.25Å; Y62-V92 HydrophobicContact CD1-CB 3.98Å; Y62-V92 HydrophobicContact CD1-CG1 4.34Å; Y62-V92 HydrophobicContact CE1-CB 3.93Å; Y62-V92 HydrophobicContact CE1-CG2 4.27Å; F76-V92 HydrophobicContact CD1-CG1 4.25Å; F76-V92 HydrophobicContact CE1-CG1 3.94Å
93	I	95.1	Very high	93.2	Very high	0 Å²	0	50.1 Å²	50.1	0%	0	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	123.7	168.8	-66.8	174.7	0	0	0	107.2	L42 F47 V59 H60 F61 Y62 V95 E98 L101	L42-I93 HydrophobicContact CB-CD1 4.11Å; L42-I93 HydrophobicContact CB-CG1 3.62Å; F47-I93 HydrophobicContact CD2-CD1 3.82Å; F47-I93 HydrophobicContact CE2-CD1 3.93Å; V59-I93 HydrophobicContact CG1-CD1 3.73Å; V59-I93 HydrophobicContact CG1-CG1 3.88Å; H60-I93 PolarHBondContact O-N 2.79Å; F61-I93 WeakPolarHBondContact CA-O 3.4Å; F61-I93 HydrophobicContact CD1-CB 3.92Å; F61-I93 HydrophobicContact CD1-CD1 4.16Å; F61-I93 HydrophobicContact CD1-CG2 4.08Å; F61-I93 HydrophobicContact CE1-CB 4.15Å; F61-I93 HydrophobicContact CE1-CD1 3.48Å; F61-I93 VanDerWaalsContact CE1-CD1 3.48Å; F61-I93 HydrophobicContact CE1-CG1 4.32Å; F61-I93 HydrophobicContact CE1-CG2 4.32Å; F61-I93 HydrophobicContact CZ-CD1 3.95Å; Y62-I93 WeakPolarHBondContact CD1-O 3.46Å; Y62-I93 PolarHBondContact N-O 3.3Å; I93-V95 PolarHBondContact O-N 2.93Å; I93-E98 HydrophobicContact CG2-CB 3.9Å; I93-E98 HydrophobicContact CG2-CG 4.29Å; I93-L101 HydrophobicContact CD1-CD2 3.85Å; I93-L101 HydrophobicContact CG2-CD2 4.47Å
94	D	91.9	Very high	92.9	Very high	28 Å²	28	56.7 Å²	56.7	15%	0.15	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.3	111.2	171.4	-171.8	-31.8	0	0	0	109.4	Y62 T96 T97 E98	Y62-D94 HydrophobicContact CE1-CB 3.89Å; Y62-D94 HydrophobicContact CE2-CB 4.3Å; Y62-D94 WeakPolarHBondContact OH-CB 3.44Å; Y62-D94 PolarHBondContact OH-OD2 3.18Å; D94-T96 PolarHBondContact O-N 2.67Å; D94-T96 WeakPolarHBondContact OD1-CA 3.06Å; D94-T96 VanDerWaalsContact OD1-CB 3.3Å; D94-T96 WeakPolarHBondContact OD1-CB 3.42Å; D94-T96 PolarHBondContact OD1-N 3.09Å; D94-T96 PolarHBondContact OD1-OG1 2.92Å; D94-T97 HydrophobicContact CB-CG2 4.45Å; D94-T97 WeakPolarHBondContact CB-OG1 3.44Å; D94-T97 PolarHBondContact O-N 2.81Å; D94-T97 PolarHBondContact O-OG1 3.35Å; D94-T97 VanDerWaalsContact O-OG1 3.13Å; D94-T97 PolarHBondContact OD1-N 2.93Å; D94-E98 WeakPolarHBondContact O-CB 3.33Å; D94-E98 PolarHBondContact O-N 3.29Å
95	V	91.2	Very high	92.9	Very high	17 Å²	17	53 Å²	53	10%	0.103	30%	0.3	C	S	.	.	T	Hydrogen-bonded Turn	trans	-67.9	-23.9	-176.9	176.8	0	0	0	0	111.6	F61 Y62 T63 I93 A102	F61-V95 HydrophobicContact CB-CG2 3.77Å; F61-V95 HydrophobicContact CD1-CG2 4.47Å; Y62-V95 PolarHBondContact O-N 2.91Å; Y62-V95 VanDerWaalsContact O-N 3.09Å; T63-V95 HydrophobicContact CG2-CB 3.96Å; T63-V95 HydrophobicContact CG2-CG1 4.36Å; I93-V95 PolarHBondContact O-N 2.93Å; V95-A102 HydrophobicContact CB-CB 4.4Å; V95-A102 HydrophobicContact CG1-CB 3.8Å; V95-A102 HydrophobicContact CG2-CB 4.31Å
96	T	88.1	Confident	92.9	Very high	62 Å²	62	56.3 Å²	56.3	38%	0.38	29%	0.292	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.3	-32	-178.3	72.8	0	0	0	0	112.2	T63 D94 K99	T63-T96 HydrophobicContact CG2-CG2 4.44Å; D94-T96 PolarHBondContact O-N 2.67Å; D94-T96 WeakPolarHBondContact OD1-CA 3.06Å; D94-T96 VanDerWaalsContact OD1-CB 3.3Å; D94-T96 WeakPolarHBondContact OD1-CB 3.42Å; D94-T96 PolarHBondContact OD1-N 3.09Å; D94-T96 PolarHBondContact OD1-OG1 2.92Å; T96-K99 WeakPolarHBondContact O-CE 3.19Å
97	T	91.4	Very high	92.6	Very high	92 Å²	92	53.9 Å²	53.9	56%	0.564	28%	0.275	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.4	-45.7	175.9	61.5	0	0	0	0	111.2	D94 K99	D94-T97 HydrophobicContact CB-CG2 4.45Å; D94-T97 WeakPolarHBondContact CB-OG1 3.44Å; D94-T97 PolarHBondContact O-N 2.81Å; D94-T97 PolarHBondContact O-OG1 3.35Å; D94-T97 VanDerWaalsContact O-OG1 3.13Å; D94-T97 PolarHBondContact OD1-N 2.93Å; T97-K99 VanDerWaalsContact C-N 3.33Å; T97-K99 PolarHBondContact O-N 2.97Å
98	E	93.1	Very high	91.8	Very high	35 Å²	35	52.7 Å²	52.7	16%	0.164	28%	0.279	C	S	.	.			trans	-92.6	42.4	-173.4	-67.6	-63.1	135.1	0	0	113.6	E43 K44 I93 D94 G100 L101 A102	E43-E98 HydrophobicContact CB-CG 4.48Å; E43-E98 HydrophobicContact CG-CG 4.47Å; K44-E98 WeakPolarHBondContact CB-OE2 3.39Å; K44-E98 PolarHBondContact N-OE2 2.85Å; I93-E98 HydrophobicContact CG2-CB 3.9Å; I93-E98 HydrophobicContact CG2-CG 4.29Å; D94-E98 WeakPolarHBondContact O-CB 3.33Å; D94-E98 PolarHBondContact O-N 3.29Å; E98-G100 VanDerWaalsContact C-N 3.25Å; E98-G100 PolarHBondContact O-N 3.34Å; E98-G100 VanDerWaalsContact O-N 3.1Å; E98-L101 HydrophobicContact CB-CB 4.28Å; E98-L101 PolarHBondContact O-N 2.7Å; E98-A102 PolarHBondContact O-N 2.9Å
99	K	91.1	Very high	90.8	Very high	152 Å²	152	54.2 Å²	54.2	66%	0.661	30%	0.297	S	S	*	.	H	α-helix	trans	-52.1	-40.3	-173.9	-64.1	-177.5	-177.5	178.9	0	113.8	T96 T97 K103	T96-K99 WeakPolarHBondContact O-CE 3.19Å; T97-K99 VanDerWaalsContact C-N 3.33Å; T97-K99 PolarHBondContact O-N 2.97Å; K99-K103 VanDerWaalsContact O-CB 3.26Å; K99-K103 WeakPolarHBondContact O-CB 2.93Å; K99-K103 PolarHBondContact O-N 2.87Å
100	G	92	Very high	89.7	Confident	56 Å²	56	59.3 Å²	59.3	58%	0.577	32%	0.321	S	S	*	.	H	α-helix	trans	-68.1	-39.9	-179.8	0	0	0	0	0	113.2	E98 K104	E98-G100 VanDerWaalsContact C-N 3.25Å; E98-G100 PolarHBondContact O-N 3.34Å; E98-G100 VanDerWaalsContact O-N 3.1Å; G100-K104 WeakPolarHBondContact O-CB 3.18Å; G100-K104 PolarHBondContact O-N 2.76Å; G100-K104 VanDerWaalsContact O-N 3.13Å
101	L	91.9	Very high	88.8	Confident	14 Å²	14	60.6 Å²	60.6	7%	0.073	33%	0.33	C	S	.	.	H	α-helix	trans	-70.2	-47.7	175.9	179.5	62.5	0	0	0	110.4	K44 F47 I93 E98 K103 K104 L105	K44-L101 HydrophobicContact CB-CB 4.5Å; F47-L101 HydrophobicContact CB-CD2 4.18Å; F47-L101 HydrophobicContact CD1-CD1 4.18Å; F47-L101 HydrophobicContact CG-CD2 4.3Å; I93-L101 HydrophobicContact CD1-CD2 3.85Å; I93-L101 HydrophobicContact CG2-CD2 4.47Å; E98-L101 HydrophobicContact CB-CB 4.28Å; E98-L101 PolarHBondContact O-N 2.7Å; L101-K103 VanDerWaalsContact C-N 3.31Å; L101-K103 PolarHBondContact O-N 2.9Å; L101-K104 PolarHBondContact O-N 2.93Å; L101-K104 VanDerWaalsContact O-N 3.13Å; L101-L105 HydrophobicContact CD1-CD1 3.81Å; L101-L105 HydrophobicContact CD1-CG 4.13Å; L101-L105 HydrophobicContact CG-CD1 3.9Å; L101-L105 HydrophobicContact CG-CG 4.5Å; L101-L105 WeakPolarHBondContact O-CG 3.37Å; L101-L105 PolarHBondContact O-N 2.77Å
102	A	91.1	Very high	88.4	Confident	0 Å²	0	61.8 Å²	61.8	0%	0	34%	0.338	C	S	.	.	H	α-helix	trans	-58.1	-43.1	177.8	0	0	0	0	0	111.9	V95 E98 L105 H106 A107	V95-A102 HydrophobicContact CB-CB 4.4Å; V95-A102 HydrophobicContact CG1-CB 3.8Å; V95-A102 HydrophobicContact CG2-CB 4.31Å; E98-A102 PolarHBondContact O-N 2.9Å; A102-L105 CarbonylContact O-C 3.55Å; A102-L105 PolarHBondContact O-N 3.18Å; A102-H106 PolarHBondContact O-N 3.01Å; A102-A107 PolarHBondContact O-N 3.01Å
103	K	91.3	Very high	88.3	Confident	165 Å²	165	61.2 Å²	61.2	72%	0.717	34%	0.335	S	S	*	.	H	α-helix	trans	-61.6	-45.3	174.8	-175.3	176.7	-179	178.5	0	112	K99 L101 L105 H106	K99-K103 VanDerWaalsContact O-CB 3.26Å; K99-K103 WeakPolarHBondContact O-CB 2.93Å; K99-K103 PolarHBondContact O-N 2.87Å; L101-K103 VanDerWaalsContact C-N 3.31Å; L101-K103 PolarHBondContact O-N 2.9Å; K103-L105 VanDerWaalsContact C-N 3.25Å; K103-L105 PolarHBondContact O-N 3.42Å; K103-H106 PolarHBondContact O-N 2.77Å; K103-H106 VanDerWaalsContact O-N 3.12Å
104	K	90.8	Very high	88.4	Confident	155 Å²	155	62.3 Å²	62.3	67%	0.674	34%	0.339	S	S	*	.	H	α-helix	trans	-62.4	-34.1	178.7	-177.3	175.5	179.7	175.7	0	112.4	G100 L101 H106	G100-K104 WeakPolarHBondContact O-CB 3.18Å; G100-K104 PolarHBondContact O-N 2.76Å; G100-K104 VanDerWaalsContact O-N 3.13Å; L101-K104 PolarHBondContact O-N 2.93Å; L101-K104 VanDerWaalsContact O-N 3.13Å; K104-H106 VanDerWaalsContact C-N 3.35Å
105	L	90.8	Very high	88.6	Confident	18 Å²	18	61.1 Å²	61.1	9%	0.094	33%	0.333	C	S	.	.	T	Hydrogen-bonded Turn	trans	-89.1	-0.2	178.2	-61.5	176.9	0	0	0	112.7	F47 F61 L101 A102 K103 A107 R114 V121	F47-L105 HydrophobicContact CD1-CD1 4.46Å; F47-L105 HydrophobicContact CE1-CD1 3.82Å; F47-L105 HydrophobicContact CE1-CD2 4.11Å; F47-L105 HydrophobicContact CE2-CD1 4.47Å; F47-L105 HydrophobicContact CZ-CD1 3.85Å; F61-L105 HydrophobicContact CE1-CD1 3.76Å; F61-L105 HydrophobicContact CZ-CD1 3.83Å; L101-L105 HydrophobicContact CD1-CD1 3.81Å; L101-L105 HydrophobicContact CD1-CG 4.13Å; L101-L105 HydrophobicContact CG-CD1 3.9Å; L101-L105 HydrophobicContact CG-CG 4.5Å; L101-L105 WeakPolarHBondContact O-CG 3.37Å; L101-L105 PolarHBondContact O-N 2.77Å; A102-L105 CarbonylContact O-C 3.55Å; A102-L105 PolarHBondContact O-N 3.18Å; K103-L105 VanDerWaalsContact C-N 3.25Å; K103-L105 PolarHBondContact O-N 3.42Å; L105-A107 HydrophobicContact CB-CB 4.1Å; L105-A107 PolarHBondContact O-N 3.27Å; L105-R114 PolarHBondContact O-NH1 3.42Å; L105-V121 HydrophobicContact CD2-CG1 3.38Å
106	H	88.4	Confident	88.8	Confident	159 Å²	159	60.4 Å²	60.4	74%	0.736	33%	0.328	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.1	40.4	-171.6	-56.8	-80.1	0	0	0	112.7	A102 K103 K104 R114	A102-H106 PolarHBondContact O-N 3.01Å; K103-H106 PolarHBondContact O-N 2.77Å; K103-H106 VanDerWaalsContact O-N 3.12Å; K104-H106 VanDerWaalsContact C-N 3.35Å; H106-R114 PolarHBondContact O-NH2 3.4Å
107	A	86.4	Confident	89.1	Confident	3 Å²	3	61 Å²	61	3%	0.025	33%	0.329	C	S	.	.			trans	-106.9	26.8	-171.1	0	0	0	0	0	114	F61 A102 L105	F61-A107 HydrophobicContact CB-CB 4.25Å; F61-A107 HydrophobicContact CD1-CB 3.37Å; F61-A107 HydrophobicContact CD2-CB 4.02Å; F61-A107 HydrophobicContact CE1-CB 3.57Å; F61-A107 HydrophobicContact CE2-CB 4.22Å; F61-A107 HydrophobicContact CG-CB 3.61Å; F61-A107 HydrophobicContact CZ-CB 4.01Å; A102-A107 PolarHBondContact O-N 3.01Å; L105-A107 HydrophobicContact CB-CB 4.1Å; L105-A107 PolarHBondContact O-N 3.27Å
108	S	77.1	Confident	89.1	Confident	88 Å²	88	61.6 Å²	61.6	62%	0.615	34%	0.336	S	S	*	.	S	Bend	trans	-91.4	-3	178.2	-56	0	0	0	0	114
109	G	75.9	Confident	88.8	Confident	45 Å²	45	61.1 Å²	61.1	46%	0.464	34%	0.341	S	S	.	.	S	Bend	trans	-129.3	-174.9	-179.2	0	0	0	0	0	112.4
110	Q	74.1	Confident	88.8	Confident	140 Å²	140	56.8 Å²	56.8	65%	0.654	33%	0.325	S	S	*	.	S	Bend	trans	-74.5	150.4	172.3	-72.1	-173.3	-14.9	0	0	111.3	V129	Q110-V129 HydrophobicContact CG-CG2 4.27Å
111	P	79.3	Confident	88.7	Confident	30 Å²	30	56.8 Å²	56.8	20%	0.195	31%	0.314	C	S	.	.			cis	-75.5	144.1	-9.2	24.5	-26.4	0	0	0	113	L126 C127	P111-L126 HydrophobicContact CG-CB 3.65Å; P111-L126 HydrophobicContact CG-CD1 4.03Å; P111-L126 HydrophobicContact CG-CD2 4.23Å; P111-L126 HydrophobicContact CG-CG 4.17Å; P111-C127 WeakPolarHBondContact CB-O 3.43Å
112	S	88.9	Confident	88.6	Confident	25 Å²	25	61.4 Å²	61.4	18%	0.175	34%	0.343	C	S	.	.			trans	-85.9	-12.4	-175.9	59.2	0	0	0	0	114.1	F61	F61-S112 WeakPolarHBondContact CB-O 3.35Å; F61-S112 WeakPolarHBondContact CD2-O 3.48Å; F61-S112 PolarHBondContact N-O 2.97Å; F61-S112 WeakPolarHBondContact O-CB 3.33Å
113	I	95	Very high	88.5	Confident	2 Å²	2	67.2 Å²	67.2	1%	0.01	37%	0.374	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	132.8	178.7	-63.4	163.7	0	0	0	109.3	L58 V59 H60 V72 F76 C127 P130 I136	L58-I113 HydrophobicContact CD1-CG2 3.66Å; L58-I113 HydrophobicContact CG-CG2 4.13Å; V59-I113 WeakPolarHBondContact O-CA 3.36Å; H60-I113 HydrophobicContact CB-CG1 3.98Å; V72-I113 HydrophobicContact CG1-CD1 3.69Å; V72-I113 HydrophobicContact CG1-CG1 4.32Å; F76-I113 HydrophobicContact CB-CD1 4.47Å; F76-I113 HydrophobicContact CD2-CD1 3.8Å; F76-I113 HydrophobicContact CD2-CG1 4.04Å; F76-I113 HydrophobicContact CD2-CG2 4.37Å; F76-I113 HydrophobicContact CE2-CG1 4.46Å; F76-I113 HydrophobicContact CE2-CG2 4.17Å; I113-C127 HydrophobicContact CB-CB 3.82Å; I113-C127 HydrophobicContact CG2-CB 3.73Å; I113-C127 WeakPolarHBondContact O-CB 3.39Å; I113-C127 PolarHBondContact O-N 2.99Å; I113-P130 HydrophobicContact CD1-CG 3.8Å; I113-I136 HydrophobicContact CD1-CD1 4Å
114	R	96.1	Very high	88.6	Confident	22 Å²	22	60.5 Å²	60.5	8%	0.083	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.2	139.8	-177.4	-58.8	-172.7	-173.8	-179.3	-3.7	111.4	L58 V59 F61 L105 H106 Y116 P124 A125 L126	L58-R114 CarbonylContact C-O 3.55Å; V59-R114 PolarHBondContact N-O 3.49Å; V59-R114 PolarHBondContact O-N 3.15Å; F61-R114 HydrophobicContact CD2-CG 4.32Å; F61-R114 HydrophobicContact CE2-CB 4.17Å; F61-R114 HydrophobicContact CE2-CG 4.03Å; L105-R114 PolarHBondContact O-NH1 3.42Å; H106-R114 PolarHBondContact O-NH2 3.4Å; R114-Y116 HydrophobicContact CB-CD2 4.44Å; R114-Y116 HydrophobicContact CB-CE2 3.81Å; R114-P124 HydrophobicContact CB-CB 4.14Å; R114-A125 CarbonylContact C-O 3.53Å; R114-A125 WeakPolarHBondContact CA-O 3Å; R114-L126 HydrophobicContact CG-CD2 3.84Å
115	L	96.6	Very high	88.7	Confident	4 Å²	4	53.7 Å²	53.7	2%	0.021	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	119.8	171.1	177	69.9	0	0	0	109.5	Q56 L58 V88 L117 P124 A125 W139 L140	Q56-L115 HydrophobicContact CB-CD1 4.24Å; L58-L115 HydrophobicContact CB-CD1 4.27Å; L58-L115 HydrophobicContact CD1-CB 4.09Å; L58-L115 HydrophobicContact CD1-CD1 4.41Å; V88-L115 HydrophobicContact CG1-CD1 4.37Å; L115-L117 HydrophobicContact CD1-CD2 4.41Å; L115-L117 HydrophobicContact CD2-CD2 3.88Å; L115-L117 HydrophobicContact CD2-CG 4.36Å; L115-L117 HydrophobicContact CG-CD2 3.93Å; L115-L117 HydrophobicContact CG-CG 4.27Å; L115-P124 WeakPolarHBondContact O-CA 3.35Å; L115-A125 HydrophobicContact CB-CB 4.12Å; L115-A125 PolarHBondContact N-O 3.14Å; L115-A125 PolarHBondContact O-N 3.23Å; L115-W139 HydrophobicContact CB-CH2 3.48Å; L115-W139 VanDerWaalsContact CB-CH2 3.48Å; L115-W139 HydrophobicContact CB-CZ3 3.82Å; L115-W139 HydrophobicContact CD2-CH2 4.26Å; L115-W139 HydrophobicContact CD2-CZ3 4.3Å; L115-L140 HydrophobicContact CD1-CD2 4.35Å; L115-L140 HydrophobicContact CD2-CD2 3.93Å
116	Y	96.1	Very high	88.8	Confident	1 Å²	1	56.6 Å²	56.6	0%	0.004	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.4	127	173.3	-63.8	-95.7	0	0	0	108.8	F47 L51 L57 V59 F61 R114 D120 V121 P124	F47-Y116 HydrophobicContact CZ-CE1 4.13Å; F47-Y116 HydrophobicContact CZ-CE2 4.21Å; F47-Y116 AromaticContact CZ-CZ 3.96Å; L51-Y116 VanDerWaalsContact CD2-CB 3.47Å; L51-Y116 HydrophobicContact CD2-CD1 3.96Å; L51-Y116 HydrophobicContact CD2-CG 3.76Å; L57-Y116 PolarHBondContact N-O 2.76Å; L57-Y116 PolarHBondContact O-N 3.38Å; V59-Y116 HydrophobicContact CB-CD2 4.29Å; V59-Y116 HydrophobicContact CB-CE2 3.98Å; V59-Y116 HydrophobicContact CG2-CD2 3.66Å; V59-Y116 HydrophobicContact CG2-CE2 3.75Å; F61-Y116 HydrophobicContact CE2-CE2 4.21Å; F61-Y116 HydrophobicContact CZ-CE2 4.27Å; F61-Y116 WeakPolarHBondContact CZ-OH 3.27Å; R114-Y116 HydrophobicContact CB-CD2 4.44Å; R114-Y116 HydrophobicContact CB-CE2 3.81Å; Y116-D120 WeakPolarHBondContact CD1-O 3.47Å; Y116-V121 HydrophobicContact CE1-CG1 4.24Å; Y116-P124 HydrophobicContact CD1-CB 3.88Å; Y116-P124 HydrophobicContact CE1-CB 3.68Å; Y116-P124 HydrophobicContact CE1-CG 4.02Å; Y116-P124 HydrophobicContact CE2-CB 4.38Å; Y116-P124 HydrophobicContact CG-CB 4.31Å
117	L	94	Very high	89	Confident	75 Å²	75	49.1 Å²	49.1	39%	0.393	30%	0.3	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110	127.6	-177.7	-65.4	176.3	0	0	0	110	K55 Q56 L115 G119 D120	K55-L117 CarbonylContact O-C 3.44Å; K55-L117 WeakPolarHBondContact O-CA 3.47Å; Q56-L117 HydrophobicContact CB-CD2 4.42Å; Q56-L117 HydrophobicContact CG-CD2 3.9Å; L115-L117 HydrophobicContact CD1-CD2 4.41Å; L115-L117 HydrophobicContact CD2-CD2 3.88Å; L115-L117 HydrophobicContact CD2-CG 4.36Å; L115-L117 HydrophobicContact CG-CD2 3.93Å; L115-L117 HydrophobicContact CG-CG 4.27Å; L117-G119 PolarHBondContact O-N 3.33Å; L117-D120 WeakPolarHBondContact O-CB 3.33Å; L117-D120 PolarHBondContact O-N 3.35Å
118	S	90.7	Very high	89.1	Confident	104 Å²	104	50.4 Å²	50.4	73%	0.727	31%	0.309	S	S	*	.	T	Hydrogen-bonded Turn	trans	48.3	35.5	176.8	-57.5	0	0	0	0	114.1	K55 D120	K55-S118 PolarHBondContact O-N 3.06Å; S118-D120 VanDerWaalsContact C-N 3.33Å; S118-D120 PolarHBondContact O-N 2.88Å
119	G	87.6	Confident	89.6	Confident	26 Å²	26	48 Å²	48	27%	0.268	29%	0.29	S	S	.	.	T	Hydrogen-bonded Turn	trans	76.9	7.2	179.1	0	0	0	0	0	116	L117 V121	L117-G119 PolarHBondContact O-N 3.33Å; G119-V121 WeakPolarHBondContact O-CG2 3.49Å; G119-V121 PolarHBondContact O-N 2.87Å; G119-V121 VanDerWaalsContact O-N 3.12Å
120	D	90.9	Very high	90.2	Very high	60 Å²	60	46 Å²	46	32%	0.321	27%	0.269	S	S	.	.			trans	-70.2	105.4	174.2	-175.5	-0.4	0	0	0	110.7	Y116 L117 S118 T122 N123	Y116-D120 WeakPolarHBondContact CD1-O 3.47Å; L117-D120 WeakPolarHBondContact O-CB 3.33Å; L117-D120 PolarHBondContact O-N 3.35Å; S118-D120 VanDerWaalsContact C-N 3.33Å; S118-D120 PolarHBondContact O-N 2.88Å; D120-T122 WeakPolarHBondContact OD1-CA 3.32Å; D120-T122 WeakPolarHBondContact OD1-CB 3.41Å; D120-T122 PolarHBondContact OD1-N 2.81Å; D120-T122 PolarHBondContact OD1-OG1 3.4Å; D120-N123 PolarHBondContact OD1-N 3.26Å; D120-N123 VanDerWaalsContact OD1-N 3.16Å; D120-N123 WeakPolarHBondContact OD2-CB 3.45Å; D120-N123 PolarHBondContact OD2-ND2 3.13Å
121	V	90.7	Very high	90.8	Very high	56 Å²	56	43.6 Å²	43.6	34%	0.339	26%	0.258	S	S	.	.	S	Bend	trans	-84	-17.9	177.7	-169.6	0	0	0	0	112.3	F47 L51 L105 Y116 G119	F47-V121 HydrophobicContact CE1-CG1 4.16Å; L51-V121 HydrophobicContact CD1-CG2 3.32Å; L105-V121 HydrophobicContact CD2-CG1 3.38Å; Y116-V121 HydrophobicContact CE1-CG1 4.24Å; G119-V121 WeakPolarHBondContact O-CG2 3.49Å; G119-V121 PolarHBondContact O-N 2.87Å; G119-V121 VanDerWaalsContact O-N 3.12Å
122	T	88.3	Confident	91.4	Very high	111 Å²	111	44.4 Å²	44.4	68%	0.681	26%	0.264	S	S	*	.	S	Bend	trans	-83.6	-38.2	-172.6	62	0	0	0	0	112.2	D120 P124	D120-T122 WeakPolarHBondContact OD1-CA 3.32Å; D120-T122 WeakPolarHBondContact OD1-CB 3.41Å; D120-T122 PolarHBondContact OD1-N 2.81Å; D120-T122 PolarHBondContact OD1-OG1 3.4Å; T122-P124 WeakPolarHBondContact O-CD 3.41Å
123	N	89.1	Confident	91.7	Very high	123 Å²	123	45 Å²	45	66%	0.658	27%	0.268	S	S	*	.	S	Bend	trans	-122.8	62.4	-177.9	-51.7	-57.3	0	0	0	112.3	D120	D120-N123 PolarHBondContact OD1-N 3.26Å; D120-N123 VanDerWaalsContact OD1-N 3.16Å; D120-N123 WeakPolarHBondContact OD2-CB 3.45Å; D120-N123 PolarHBondContact OD2-ND2 3.13Å
124	P	93.4	Very high	91.6	Very high	24 Å²	24	47.4 Å²	47.4	16%	0.156	29%	0.288	C	S	.	.	P	Polyproline II helix	trans	-66.5	142.7	174.6	29.2	-33.5	0	0	0	110.9	R114 L115 Y116 T122 L126	R114-P124 HydrophobicContact CB-CB 4.14Å; L115-P124 WeakPolarHBondContact O-CA 3.35Å; Y116-P124 HydrophobicContact CD1-CB 3.88Å; Y116-P124 HydrophobicContact CE1-CB 3.68Å; Y116-P124 HydrophobicContact CE1-CG 4.02Å; Y116-P124 HydrophobicContact CE2-CB 4.38Å; Y116-P124 HydrophobicContact CG-CB 4.31Å; T122-P124 WeakPolarHBondContact O-CD 3.41Å; P124-L126 HydrophobicContact CG-CD2 4.46Å; P124-L126 PolarHBondContact O-N 3.3Å
125	A	92.8	Very high	91.5	Very high	11 Å²	11	46.4 Å²	46.4	9%	0.091	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.2	124.6	169.7	0	0	0	0	0	110	R114 L115 W139 R143	R114-A125 CarbonylContact C-O 3.53Å; R114-A125 WeakPolarHBondContact CA-O 3Å; L115-A125 HydrophobicContact CB-CB 4.12Å; L115-A125 PolarHBondContact N-O 3.14Å; L115-A125 PolarHBondContact O-N 3.23Å; A125-W139 HydrophobicContact CB-CH2 4.1Å; A125-W139 HydrophobicContact CB-CZ2 3.99Å; A125-R143 VanDerWaalsContact CB-NH2 3.33Å
126	L	93.2	Very high	91.5	Very high	79 Å²	79	46.2 Å²	46.2	41%	0.414	28%	0.284	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.2	121.2	-176.8	-60.8	-172.9	0	0	0	109.8	P111 R114 P124 W139	P111-L126 HydrophobicContact CG-CB 3.65Å; P111-L126 HydrophobicContact CG-CD1 4.03Å; P111-L126 HydrophobicContact CG-CD2 4.23Å; P111-L126 HydrophobicContact CG-CG 4.17Å; R114-L126 HydrophobicContact CG-CD2 3.84Å; P124-L126 HydrophobicContact CG-CD2 4.46Å; P124-L126 PolarHBondContact O-N 3.3Å; L126-W139 WeakPolarHBondContact O-CZ2 3.29Å
127	C	92.6	Very high	91.4	Very high	2 Å²	2	48 Å²	48	1%	0.014	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.6	125.5	175.1	-179.5	0	0	0	0	108.9	P111 I113 W139	P111-C127 WeakPolarHBondContact CB-O 3.43Å; I113-C127 HydrophobicContact CB-CB 3.82Å; I113-C127 HydrophobicContact CG2-CB 3.73Å; I113-C127 WeakPolarHBondContact O-CB 3.39Å; I113-C127 PolarHBondContact O-N 2.99Å; C127-W139 HydrophobicContact CB-CD2 4.01Å; C127-W139 HydrophobicContact CB-CE3 4.01Å; C127-W139 HydrophobicContact CB-CH2 3.86Å; C127-W139 HydrophobicContact CB-CZ2 3.88Å; C127-W139 HydrophobicContact CB-CZ3 3.95Å
128	P	89.4	Confident	91.4	Very high	31 Å²	31	46.1 Å²	46.1	20%	0.201	29%	0.285	C	S	.	.	P	Polyproline II helix	trans	-51.8	155.3	168.9	-24	33.5	0	0	0	111	P130 W139 D186	P128-P130 WeakPolarHBondContact O-CD 3.23Å; P128-W139 VanDerWaalsContact CD-CD1 3.47Å; P128-D186 VanDerWaalsContact CG-O 3.27Å; P128-D186 WeakPolarHBondContact CG-O 3.02Å
129	V	87.9	Confident	91.6	Very high	38 Å²	38	41.1 Å²	41.1	23%	0.23	25%	0.25	C	S	.	.			trans	-60.1	108.7	-179.4	-179.9	0	0	0	0	108.8	E68 V72 Q110	E68-V129 WeakPolarHBondContact OE1-CG1 3.35Å; V72-V129 HydrophobicContact CG2-CG1 4.24Å; Q110-V129 HydrophobicContact CG-CG2 4.27Å
130	P	88.5	Confident	91.9	Very high	2 Å²	2	40.7 Å²	40.7	1%	0.013	24%	0.242	C	C	.	.			trans	-73.9	139.9	-168.4	29.8	-35.2	0	0	0	110.2	R71 V72 I113 P128 I136	R71-P130 VanDerWaalsContact CZ-O 3.28Å; R71-P130 PolarHBondContact NH1-O 3.04Å; R71-P130 PolarHBondContact NH2-O 3.37Å; V72-P130 HydrophobicContact CG1-CG 4Å; V72-P130 HydrophobicContact CG2-CG 4.44Å; I113-P130 HydrophobicContact CD1-CG 3.8Å; P128-P130 WeakPolarHBondContact O-CD 3.23Å; P130-I136 HydrophobicContact CB-CD1 4.2Å; P130-I136 HydrophobicContact CB-CG1 3.62Å; P130-I136 HydrophobicContact CG-CD1 4.09Å; P130-I136 HydrophobicContact CG-CG1 3.98Å
131	Q	85.6	Confident	92	Very high	89 Å²	89	43.4 Å²	43.4	42%	0.416	25%	0.252	S	S	.	.	S	Bend	trans	-81.6	-26.5	171.6	-61.2	-55.4	-39.4	0	0	112.6	R71 S135 D189	R71-Q131 PolarHBondContact NH1-O 2.99Å; R71-Q131 VanDerWaalsContact NH1-O 3.09Å; Q131-S135 PolarHBondContact N-OG 3.47Å; Q131-D189 WeakPolarHBondContact CG-OD2 3.35Å
132	S	91.6	Very high	92	Very high	47 Å²	47	41.9 Å²	41.9	33%	0.329	24%	0.24	S	C	.	.	S	Bend	trans	-152.2	176.4	-176.4	70.3	0	0	0	0	111.9	A134 S135	S132-A134 VanDerWaalsContact C-N 3.3Å; S132-A134 PolarHBondContact OG-N 3.16Å; S132-S135 PolarHBondContact N-OG 2.93Å; S132-S135 WeakPolarHBondContact O-CB 3.02Å; S132-S135 PolarHBondContact O-N 3.38Å; S132-S135 PolarHBondContact O-OG 3.44Å; S132-S135 PolarHBondContact OG-N 2.93Å; S132-S135 PolarHBondContact OG-OG 2.73Å
133	S	94.9	Very high	92	Very high	37 Å²	37	41.6 Å²	41.6	26%	0.259	23%	0.227	S	C	.	.	H	α-helix	trans	-63.4	-37.5	169.1	50.2	0	0	0	0	112.1	A75 S135 I136 L137	A75-S133 WeakPolarHBondContact O-CB 3.46Å; S133-S135 PolarHBondContact O-N 3.42Å; S133-I136 WeakPolarHBondContact O-CB 3.37Å; S133-I136 PolarHBondContact O-N 2.9Å; S133-I136 VanDerWaalsContact O-N 3.09Å; S133-L137 WeakPolarHBondContact O-CG 3.46Å; S133-L137 PolarHBondContact O-N 2.81Å; S133-L137 VanDerWaalsContact O-N 3.14Å
134	A	94.5	Very high	91.9	Very high	53 Å²	53	39.9 Å²	39.9	44%	0.438	23%	0.23	S	C	.	.	H	α-helix	trans	-58.8	-37.4	176.4	0	0	0	0	0	111.4	S132 I136 L137 T138	S132-A134 VanDerWaalsContact C-N 3.3Å; S132-A134 PolarHBondContact OG-N 3.16Å; A134-I136 VanDerWaalsContact C-N 3.28Å; A134-I136 PolarHBondContact O-N 3.49Å; A134-L137 PolarHBondContact O-N 3.16Å; A134-T138 WeakPolarHBondContact O-CB 3.3Å; A134-T138 PolarHBondContact O-N 2.87Å; A134-T138 PolarHBondContact O-OG1 3.34Å; A134-T138 VanDerWaalsContact O-OG1 3.11Å
135	S	93.4	Very high	91	Very high	2 Å²	2	41.6 Å²	41.6	1%	0.014	25%	0.252	C	S	.	.	H	α-helix	trans	-56	-42.5	175.1	-36.8	0	0	0	0	112	Q131 S132 S133 W139 P188 D189	Q131-S135 PolarHBondContact N-OG 3.47Å; S132-S135 PolarHBondContact N-OG 2.93Å; S132-S135 WeakPolarHBondContact O-CB 3.02Å; S132-S135 PolarHBondContact O-N 3.38Å; S132-S135 PolarHBondContact O-OG 3.44Å; S132-S135 PolarHBondContact OG-N 2.93Å; S132-S135 PolarHBondContact OG-OG 2.73Å; S133-S135 PolarHBondContact O-N 3.42Å; S135-W139 VanDerWaalsContact O-CB 3.23Å; S135-W139 WeakPolarHBondContact O-CB 3.43Å; S135-W139 PolarHBondContact O-N 2.82Å; S135-P188 VanDerWaalsContact O-CB 3.22Å; S135-P188 WeakPolarHBondContact O-CB 3.38Å; S135-D189 WeakPolarHBondContact CB-OD1 3.34Å; S135-D189 PolarHBondContact OG-OD1 3.23Å
136	I	95.9	Very high	90.1	Very high	0 Å²	0	45.9 Å²	45.9	0%	0	28%	0.277	C	S	.	.	H	α-helix	trans	-69	-44.2	179.5	-58.8	171.7	0	0	0	110.2	L58 A75 F76 A79 I113 P130 S133 A134 W139 L140	L58-I136 HydrophobicContact CD2-CG2 3.93Å; A75-I136 HydrophobicContact CB-CD1 4.48Å; F76-I136 HydrophobicContact CB-CD1 4.25Å; F76-I136 HydrophobicContact CD2-CD1 4.22Å; A79-I136 HydrophobicContact CB-CB 3.93Å; A79-I136 HydrophobicContact CB-CD1 3.92Å; A79-I136 HydrophobicContact CB-CG1 4.49Å; A79-I136 HydrophobicContact CB-CG2 4.03Å; I113-I136 HydrophobicContact CD1-CD1 4Å; P130-I136 HydrophobicContact CB-CD1 4.2Å; P130-I136 HydrophobicContact CB-CG1 3.62Å; P130-I136 HydrophobicContact CG-CD1 4.09Å; P130-I136 HydrophobicContact CG-CG1 3.98Å; S133-I136 WeakPolarHBondContact O-CB 3.37Å; S133-I136 PolarHBondContact O-N 2.9Å; S133-I136 VanDerWaalsContact O-N 3.09Å; A134-I136 VanDerWaalsContact C-N 3.28Å; A134-I136 PolarHBondContact O-N 3.49Å; I136-W139 PolarHBondContact O-N 2.93Å; I136-L140 HydrophobicContact CG2-CD1 4.33Å; I136-L140 WeakPolarHBondContact O-CG 3.37Å; I136-L140 PolarHBondContact O-N 3.07Å
137	L	95.1	Very high	89.5	Confident	37 Å²	37	42.5 Å²	42.5	19%	0.194	26%	0.26	C	S	.	.	H	α-helix	trans	-65.8	-45.9	-179.6	-62.5	174.6	0	0	0	111.4	A79 E82 L83 S133 A134 W139 L140 Q141	A79-L137 HydrophobicContact CB-CD2 4.35Å; A79-L137 HydrophobicContact CB-CG 4.39Å; E82-L137 HydrophobicContact CB-CD1 3.87Å; E82-L137 HydrophobicContact CB-CD2 4.21Å; E82-L137 HydrophobicContact CG-CD1 4.01Å; L83-L137 HydrophobicContact CD1-CD2 4.38Å; L83-L137 HydrophobicContact CD2-CD2 3.78Å; L83-L137 HydrophobicContact CG-CD2 3.81Å; S133-L137 WeakPolarHBondContact O-CG 3.46Å; S133-L137 PolarHBondContact O-N 2.81Å; S133-L137 VanDerWaalsContact O-N 3.14Å; A134-L137 PolarHBondContact O-N 3.16Å; L137-W139 VanDerWaalsContact C-N 3.35Å; L137-W139 PolarHBondContact O-N 2.84Å; L137-L140 PolarHBondContact O-N 2.8Å; L137-Q141 WeakPolarHBondContact O-CB 3.27Å; L137-Q141 VanDerWaalsContact O-CG 3.26Å; L137-Q141 WeakPolarHBondContact O-CG 3.41Å; L137-Q141 PolarHBondContact O-N 3.44Å
138	T	93.5	Very high	88.9	Confident	36 Å²	36	43.1 Å²	43.1	22%	0.221	27%	0.265	C	S	.	.	H	α-helix	trans	-61.2	-43.4	174.7	-62	0	0	0	0	111	A134 L140 Q141 R142 P188	A134-T138 WeakPolarHBondContact O-CB 3.3Å; A134-T138 PolarHBondContact O-N 2.87Å; A134-T138 PolarHBondContact O-OG1 3.34Å; A134-T138 VanDerWaalsContact O-OG1 3.11Å; T138-L140 VanDerWaalsContact C-N 3.33Å; T138-L140 PolarHBondContact O-N 2.82Å; T138-Q141 PolarHBondContact O-N 3.31Å; T138-R142 HydrophobicContact CG2-CG 4.18Å; T138-R142 WeakPolarHBondContact O-CB 3.49Å; T138-R142 VanDerWaalsContact O-CG 3.3Å; T138-R142 WeakPolarHBondContact O-CG 3.41Å; T138-R142 PolarHBondContact O-N 2.94Å; T138-P188 HydrophobicContact CG2-CB 4.39Å
139	W	95.3	Very high	88.7	Confident	0 Å²	0	47.2 Å²	47.2	0%	0	29%	0.286	C	S	.	.	H	α-helix	trans	-57	-45.8	174.5	177.2	80.1	0	0	0	112.1	L58 L115 A125 L126 C127 P128 S135 I136 L137 R143 I185 P188	L58-W139 HydrophobicContact CD1-CZ3 3.79Å; L115-W139 HydrophobicContact CB-CH2 3.48Å; L115-W139 VanDerWaalsContact CB-CH2 3.48Å; L115-W139 HydrophobicContact CB-CZ3 3.82Å; L115-W139 HydrophobicContact CD2-CH2 4.26Å; L115-W139 HydrophobicContact CD2-CZ3 4.3Å; A125-W139 HydrophobicContact CB-CH2 4.1Å; A125-W139 HydrophobicContact CB-CZ2 3.99Å; L126-W139 WeakPolarHBondContact O-CZ2 3.29Å; C127-W139 HydrophobicContact CB-CD2 4.01Å; C127-W139 HydrophobicContact CB-CE3 4.01Å; C127-W139 HydrophobicContact CB-CH2 3.86Å; C127-W139 HydrophobicContact CB-CZ2 3.88Å; C127-W139 HydrophobicContact CB-CZ3 3.95Å; P128-W139 VanDerWaalsContact CD-CD1 3.47Å; S135-W139 VanDerWaalsContact O-CB 3.23Å; S135-W139 WeakPolarHBondContact O-CB 3.43Å; S135-W139 PolarHBondContact O-N 2.82Å; I136-W139 PolarHBondContact O-N 2.93Å; L137-W139 VanDerWaalsContact C-N 3.35Å; L137-W139 PolarHBondContact O-N 2.84Å; W139-R143 VanDerWaalsContact CE2-CD 3.5Å; W139-R143 VanDerWaalsContact O-CG 3.31Å; W139-R143 WeakPolarHBondContact O-CG 3.32Å; W139-R143 PolarHBondContact O-N 2.81Å; W139-I185 VanDerWaalsContact CD1-O 3.24Å; W139-P188 HydrophobicContact CB-CB 3.99Å; W139-P188 HydrophobicContact CB-CG 4.38Å
140	L	94.4	Very high	88.4	Confident	17 Å²	17	51.5 Å²	51.5	9%	0.089	31%	0.306	C	S	.	.	H	α-helix	trans	-63	-46.2	176	-71.2	170.4	0	0	0	112.2	L58 L83 V88 L115 I136 L137 T138 R143 A144	L58-L140 HydrophobicContact CD1-CD2 4.4Å; L58-L140 HydrophobicContact CD2-CD1 4.3Å; L83-L140 HydrophobicContact CD1-CD1 3.77Å; L83-L140 HydrophobicContact CD2-CD1 3.89Å; L83-L140 HydrophobicContact CG-CD1 4.45Å; V88-L140 HydrophobicContact CG1-CD1 4.15Å; V88-L140 HydrophobicContact CG1-CD2 4.32Å; V88-L140 HydrophobicContact CG2-CD2 4.42Å; L115-L140 HydrophobicContact CD1-CD2 4.35Å; L115-L140 HydrophobicContact CD2-CD2 3.93Å; I136-L140 HydrophobicContact CG2-CD1 4.33Å; I136-L140 WeakPolarHBondContact O-CG 3.37Å; I136-L140 PolarHBondContact O-N 3.07Å; L137-L140 PolarHBondContact O-N 2.8Å; T138-L140 VanDerWaalsContact C-N 3.33Å; T138-L140 PolarHBondContact O-N 2.82Å; L140-R143 PolarHBondContact O-N 2.68Å; L140-A144 PolarHBondContact O-N 2.78Å
141	Q	91.5	Very high	88.1	Confident	117 Å²	117	51.9 Å²	51.9	55%	0.547	31%	0.308	S	S	.	.	H	α-helix	trans	-60.5	-46.4	179.4	-73.9	168.4	-15.7	0	0	111.9	L137 T138 R143 A144 G145	L137-Q141 WeakPolarHBondContact O-CB 3.27Å; L137-Q141 VanDerWaalsContact O-CG 3.26Å; L137-Q141 WeakPolarHBondContact O-CG 3.41Å; L137-Q141 PolarHBondContact O-N 3.44Å; T138-Q141 PolarHBondContact O-N 3.31Å; Q141-R143 VanDerWaalsContact C-N 3.29Å; Q141-R143 PolarHBondContact O-N 2.85Å; Q141-A144 WeakPolarHBondContact O-CB 3.27Å; Q141-A144 PolarHBondContact O-N 3.17Å; Q141-G145 PolarHBondContact O-N 3.17Å
142	R	91	Very high	87.8	Confident	23 Å²	23	51 Å²	51	9%	0.087	32%	0.316	C	S	.	.	H	α-helix	trans	-62.2	-37.4	179.6	-70	-170.3	170	153.3	6.5	112.3	T138 A144 T146 S147 A184 I185 L187 V190	T138-R142 HydrophobicContact CG2-CG 4.18Å; T138-R142 WeakPolarHBondContact O-CB 3.49Å; T138-R142 VanDerWaalsContact O-CG 3.3Å; T138-R142 WeakPolarHBondContact O-CG 3.41Å; T138-R142 PolarHBondContact O-N 2.94Å; R142-A144 VanDerWaalsContact C-N 3.33Å; R142-T146 WeakPolarHBondContact CA-O 3.16Å; R142-S147 PolarHBondContact NE-O 3.18Å; R142-S147 VanDerWaalsContact NE-O 3.16Å; R142-S147 PolarHBondContact O-OG 2.8Å; R142-A184 VanDerWaalsContact CD-O 3.29Å; R142-A184 WeakPolarHBondContact CD-O 3.32Å; R142-A184 PolarHBondContact NH1-O 3.11Å; R142-I185 HydrophobicContact CB-CG1 3.82Å; R142-L187 PolarHBondContact NH1-O 3.18Å; R142-V190 PolarHBondContact NH1-O 2.92Å; R142-V190 PolarHBondContact NH2-O 2.97Å
143	R	88.8	Confident	87.2	Confident	105 Å²	105	51.2 Å²	51.2	40%	0.396	31%	0.314	S	S	.	.	H	α-helix	trans	-71.2	-26.1	174.5	-69	-172.6	74.9	91.2	10.9	113.7	A125 W139 L140 Q141 I185	A125-R143 VanDerWaalsContact CB-NH2 3.33Å; W139-R143 VanDerWaalsContact CE2-CD 3.5Å; W139-R143 VanDerWaalsContact O-CG 3.31Å; W139-R143 WeakPolarHBondContact O-CG 3.32Å; W139-R143 PolarHBondContact O-N 2.81Å; L140-R143 PolarHBondContact O-N 2.68Å; Q141-R143 VanDerWaalsContact C-N 3.29Å; Q141-R143 PolarHBondContact O-N 2.85Å; R143-I185 HydrophobicContact CG-CD1 4.26Å; R143-I185 HydrophobicContact CG-CG1 4.26Å; R143-I185 HydrophobicContact CG-CG2 3.65Å
144	A	86.1	Confident	86.5	Confident	88 Å²	88	50.6 Å²	50.6	73%	0.727	31%	0.307	S	S	*	.	H	α-helix	trans	-78.5	-25.7	179	0	0	0	0	0	113	L140 Q141 R142	L140-A144 PolarHBondContact O-N 2.78Å; Q141-A144 WeakPolarHBondContact O-CB 3.27Å; Q141-A144 PolarHBondContact O-N 3.17Å; R142-A144 VanDerWaalsContact C-N 3.33Å
145	G	75.8	Confident	85.9	Confident	60 Å²	60	51.7 Å²	51.7	62%	0.619	31%	0.312	S	S	*	.	T	Hydrogen-bonded Turn	trans	165.8	-30.5	169.1	0	0	0	0	0	117.3	Q141	Q141-G145 PolarHBondContact O-N 3.17Å
146	T	73.4	Confident	85.3	Confident	101 Å²	101	55.5 Å²	55.5	62%	0.62	33%	0.329	S	S	*	.			trans	-102.7	90.7	-176.2	52.1	0	0	0	0	110.8	R142	R142-T146 WeakPolarHBondContact CA-O 3.16Å
147	S	79.7	Confident	84.6	Confident	8 Å²	8	55.6 Å²	55.6	6%	0.056	33%	0.33	C	S	.	.	S	Bend	trans	-84.1	-23.4	-177.3	-76.3	0	0	0	0	114.4	R142 A184	R142-S147 PolarHBondContact NE-O 3.18Å; R142-S147 VanDerWaalsContact NE-O 3.16Å; R142-S147 PolarHBondContact O-OG 2.8Å; S147-A184 WeakPolarHBondContact O-CB 3.41Å
148	A	80.8	Confident	84.1	Confident	14 Å²	14	58.4 Å²	58.4	12%	0.116	34%	0.342	C	S	.	.	S	Bend	trans	-148.4	150.2	173.3	0	0	0	0	0	110.4	F180 Y181 F192 L194	A148-F180 HydrophobicContact CB-CE1 3.9Å; A148-Y181 HydrophobicContact CB-CD1 4.22Å; A148-Y181 HydrophobicContact CB-CE1 3.81Å; A148-F192 WeakPolarHBondContact CA-O 3.5Å; A148-F192 HydrophobicContact CB-CB 3.85Å; A148-L194 HydrophobicContact CB-CG 4.19Å
149	D	84.1	Confident	83.7	Confident	118 Å²	118	60.5 Å²	60.5	63%	0.631	36%	0.363	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-80.1	143.6	176	-61.5	-40.4	0	0	0	110.4	F192 A193 L194	D149-F192 PolarHBondContact N-O 3.16Å; D149-F192 VanDerWaalsContact N-O 3.16Å; D149-A193 CarbonylContact O-C 3.59Å; D149-A193 WeakPolarHBondContact O-CA 3.46Å; D149-A193 WeakPolarHBondContact O-CB 3.15Å; D149-L194 PolarHBondContact O-N 3.29Å
150	L	83.3	Confident	83.1	Confident	127 Å²	127	62 Å²	62	67%	0.665	37%	0.37	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-85.2	116.4	173.2	-176.5	67.7	0	0	0	109.2	L194	L150-L194 HydrophobicContact CD1-CB 4.32Å
151	I	82.3	Confident	82.7	Confident	11 Å²	11	66.3 Å²	66.3	6%	0.056	39%	0.394	C	S	.	.	P	Polyproline II helix	trans	-89.8	116.5	171.6	-69.8	176.5	0	0	0	108.3	D153 Q156 L157 I160 I164 A193 L194 T195	I151-D153 WeakPolarHBondContact CG2-O 3.47Å; I151-Q156 HydrophobicContact CG2-CB 4.07Å; I151-L157 HydrophobicContact CD1-CB 4.37Å; I151-L157 HydrophobicContact CD1-CD1 3.96Å; I151-L157 HydrophobicContact CG2-CB 4.42Å; I151-I160 HydrophobicContact CD1-CD1 4.47Å; I151-I164 HydrophobicContact CD1-CD1 4.02Å; I151-A193 HydrophobicContact CD1-CB 3.32Å; I151-A193 HydrophobicContact CG1-CB 3.7Å; I151-L194 PolarHBondContact N-O 3.35Å; I151-T195 PolarHBondContact O-OG1 3.42Å
152	A	79.5	Confident	82.5	Confident	70 Å²	70	64.9 Å²	64.9	58%	0.579	39%	0.39	S	S	*	.			trans	-86	-23.2	-175.8	0	0	0	0	0	113.5
153	D	78.4	Confident	82.5	Confident	52 Å²	52	65.4 Å²	65.4	28%	0.278	39%	0.394	S	S	.	.	S	Bend	trans	-150.5	155.9	-175.8	66.4	76.2	0	0	0	112	I151 S155 Q156 D197	I151-D153 WeakPolarHBondContact CG2-O 3.47Å; D153-S155 PolarHBondContact O-N 3.45Å; D153-S155 WeakPolarHBondContact OD1-CA 3.36Å; D153-S155 VanDerWaalsContact OD1-CB 3.28Å; D153-S155 WeakPolarHBondContact OD1-CB 3.43Å; D153-S155 PolarHBondContact OD1-N 3.01Å; D153-S155 PolarHBondContact OD1-OG 2.96Å; D153-Q156 PolarHBondContact O-N 3.48Å; D153-Q156 PolarHBondContact OD1-N 3.49Å; D153-Q156 PolarHBondContact OD2-NE2 2.59Å; D153-D197 WeakPolarHBondContact CA-OD2 3.46Å
154	L	78.8	Confident	82.7	Confident	24 Å²	24	60.8 Å²	60.8	13%	0.126	38%	0.377	C	S	.	.	H	α-helix	trans	-58.9	-30.2	179.5	-179.3	64.1	0	0	0	113.8	Q156 L157 E158 D197 V200 K203	L154-Q156 VanDerWaalsContact C-N 3.32Å; L154-Q156 PolarHBondContact O-N 3.39Å; L154-L157 HydrophobicContact CD1-CD2 4.37Å; L154-L157 WeakPolarHBondContact O-CB 3.49Å; L154-L157 PolarHBondContact O-N 3.13Å; L154-L157 VanDerWaalsContact O-N 3.12Å; L154-E158 HydrophobicContact CD1-CG 4.36Å; L154-E158 HydrophobicContact CG-CG 4.2Å; L154-E158 WeakPolarHBondContact O-CG 3.41Å; L154-E158 PolarHBondContact O-N 2.83Å; L154-D197 PolarHBondContact N-OD2 2.81Å; L154-V200 HydrophobicContact CB-CG2 4.33Å; L154-V200 HydrophobicContact CD1-CG2 4Å; L154-K203 HydrophobicContact CD1-CD 3.7Å; L154-K203 HydrophobicContact CD2-CD 3.87Å; L154-K203 HydrophobicContact CG-CD 4.42Å
155	S	81.9	Confident	83.1	Confident	75 Å²	75	56.6 Å²	56.6	52%	0.524	34%	0.343	S	S	.	.	H	α-helix	trans	-67.9	-33.6	-176.2	80.1	0	0	0	0	112.4	D153 L157 E158 A159	D153-S155 PolarHBondContact O-N 3.45Å; D153-S155 WeakPolarHBondContact OD1-CA 3.36Å; D153-S155 VanDerWaalsContact OD1-CB 3.28Å; D153-S155 WeakPolarHBondContact OD1-CB 3.43Å; D153-S155 PolarHBondContact OD1-N 3.01Å; D153-S155 PolarHBondContact OD1-OG 2.96Å; S155-L157 VanDerWaalsContact C-N 3.3Å; S155-L157 PolarHBondContact O-N 3.18Å; S155-E158 PolarHBondContact O-N 3.38Å; S155-A159 PolarHBondContact O-N 3.09Å; S155-A159 VanDerWaalsContact O-N 3.08Å
156	Q	82.6	Confident	83.9	Confident	82 Å²	82	53.8 Å²	53.8	38%	0.383	31%	0.313	S	S	.	.	H	α-helix	trans	-63.5	-37.3	172.7	-67.1	173.9	16.1	0	0	111.8	I151 D153 L154 I160	I151-Q156 HydrophobicContact CG2-CB 4.07Å; D153-Q156 PolarHBondContact O-N 3.48Å; D153-Q156 PolarHBondContact OD1-N 3.49Å; D153-Q156 PolarHBondContact OD2-NE2 2.59Å; L154-Q156 VanDerWaalsContact C-N 3.32Å; L154-Q156 PolarHBondContact O-N 3.39Å; Q156-I160 WeakPolarHBondContact O-CG1 3.29Å
157	L	81.2	Confident	84.8	Confident	3 Å²	3	49 Å²	49	2%	0.016	28%	0.284	C	S	.	.	H	α-helix	trans	-71.9	-37.1	176.5	-174.8	59.8	0	0	0	111.5	I151 L154 S155 A159 I160 I164 V166 V200 Y204 L214	I151-L157 HydrophobicContact CD1-CB 4.37Å; I151-L157 HydrophobicContact CD1-CD1 3.96Å; I151-L157 HydrophobicContact CG2-CB 4.42Å; L154-L157 HydrophobicContact CD1-CD2 4.37Å; L154-L157 WeakPolarHBondContact O-CB 3.49Å; L154-L157 PolarHBondContact O-N 3.13Å; L154-L157 VanDerWaalsContact O-N 3.12Å; S155-L157 VanDerWaalsContact C-N 3.3Å; S155-L157 PolarHBondContact O-N 3.18Å; L157-A159 VanDerWaalsContact C-N 3.3Å; L157-A159 PolarHBondContact O-N 3.04Å; L157-I160 PolarHBondContact O-N 2.96Å; L157-I164 HydrophobicContact CD1-CD1 4.23Å; L157-I164 HydrophobicContact CD1-CG2 3.84Å; L157-V166 HydrophobicContact CD1-CG2 3.66Å; L157-V166 HydrophobicContact CD2-CG2 4.47Å; L157-V200 HydrophobicContact CD2-CG1 4.34Å; L157-V200 HydrophobicContact CD2-CG2 4.5Å; L157-Y204 HydrophobicContact CD2-CE2 4.22Å; L157-L214 HydrophobicContact CD1-CD1 3.99Å; L157-L214 HydrophobicContact CD2-CD1 3.64Å; L157-L214 HydrophobicContact CG-CD1 4.13Å
158	E	83.4	Confident	85.3	Confident	96 Å²	96	48.8 Å²	48.8	45%	0.449	28%	0.282	S	S	.	.	H	α-helix	trans	-69.3	-26.2	178.8	-71.2	-176.1	164	0	0	113.9	L154 S155 I160 K203 S217	L154-E158 HydrophobicContact CD1-CG 4.36Å; L154-E158 HydrophobicContact CG-CG 4.2Å; L154-E158 WeakPolarHBondContact O-CG 3.41Å; L154-E158 PolarHBondContact O-N 2.83Å; S155-E158 PolarHBondContact O-N 3.38Å; E158-I160 PolarHBondContact O-N 3Å; E158-K203 IonicContact OE1-NZ 2.63Å; E158-K203 PolarHBondContact OE1-NZ 2.87Å; E158-S217 WeakPolarHBondContact CA-OG 3.37Å
159	A	84.7	Confident	85.5	Confident	80 Å²	80	48.2 Å²	48.2	66%	0.661	28%	0.277	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.3	-7.3	175.1	0	0	0	0	0	113.9	S155 L157	S155-A159 PolarHBondContact O-N 3.09Å; S155-A159 VanDerWaalsContact O-N 3.08Å; L157-A159 VanDerWaalsContact C-N 3.3Å; L157-A159 PolarHBondContact O-N 3.04Å
160	I	84.1	Confident	85.1	Confident	30 Å²	30	48.7 Å²	48.7	15%	0.154	27%	0.274	C	S	.	.			trans	-94.9	109.4	-175.6	-59.7	173.6	0	0	0	110.4	I151 Q156 L157 E158 I164	I151-I160 HydrophobicContact CD1-CD1 4.47Å; Q156-I160 WeakPolarHBondContact O-CG1 3.29Å; L157-I160 PolarHBondContact O-N 2.96Å; E158-I160 PolarHBondContact O-N 3Å; I160-I164 HydrophobicContact CD1-CD1 3.49Å; I160-I164 VanDerWaalsContact CD1-CD1 3.49Å; I160-I164 HydrophobicContact CG2-CB 4.3Å; I160-I164 HydrophobicContact CG2-CG2 4.32Å
161	D	85.3	Confident	84.6	Confident	109 Å²	109	48.5 Å²	48.5	58%	0.583	27%	0.269	S	S	*	.			trans	-79.6	-28.4	177.5	-78.5	-34.8	0	0	0	113.7	K216	D161-K216 VanDerWaalsContact O-CG 3.24Å; D161-K216 WeakPolarHBondContact O-CG 3.46Å
162	D	87.2	Confident	83.9	Confident	87 Å²	87	52.6 Å²	52.6	47%	0.465	29%	0.291	S	S	.	.	S	Bend	trans	-79.8	169.6	-177.5	-64.9	-40.7	0	0	0	112.2	I164 R191	D162-I164 PolarHBondContact O-N 2.96Å; D162-R191 IonicContact OD2-CZ 2.7Å; D162-R191 VanDerWaalsContact OD2-CZ 3.31Å; D162-R191 IonicContact OD2-NH1 3.91Å; D162-R191 PolarHBondContact OD2-NH1 3.46Å; D162-R191 IonicContact OD2-NH2 2.67Å; D162-R191 PolarHBondContact OD2-NH2 3Å
163	L	90.9	Very high	83.2	Confident	34 Å²	34	53 Å²	53	18%	0.178	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.5	130.5	171.3	-175.9	79.7	0	0	0	110.1	V190 L214 K215 I220 Q242	L163-V190 HydrophobicContact CD2-CG1 4.46Å; L163-L214 WeakPolarHBondContact CA-O 3.38Å; L163-K215 HydrophobicContact CD1-CB 4.29Å; L163-I220 HydrophobicContact CD1-CD1 3.47Å; L163-I220 VanDerWaalsContact CD1-CD1 3.47Å; L163-Q242 HydrophobicContact CD2-CB 3.39Å
164	I	93.1	Very high	82.8	Confident	8 Å²	8	56.8 Å²	56.8	4%	0.041	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.2	140.1	173.5	-174.4	165.4	0	0	0	110.9	I151 L157 I160 D162 V166 R191 A193 L214	I151-I164 HydrophobicContact CD1-CD1 4.02Å; L157-I164 HydrophobicContact CD1-CD1 4.23Å; L157-I164 HydrophobicContact CD1-CG2 3.84Å; I160-I164 HydrophobicContact CD1-CD1 3.49Å; I160-I164 VanDerWaalsContact CD1-CD1 3.49Å; I160-I164 HydrophobicContact CG2-CB 4.3Å; I160-I164 HydrophobicContact CG2-CG2 4.32Å; D162-I164 PolarHBondContact O-N 2.96Å; I164-V166 HydrophobicContact CD1-CG2 4.28Å; I164-V166 HydrophobicContact CG1-CG2 4Å; I164-V166 HydrophobicContact CG2-CG2 4.15Å; I164-R191 HydrophobicContact CB-CB 4.45Å; I164-R191 HydrophobicContact CG1-CB 4.18Å; I164-A193 HydrophobicContact CD1-CB 3.8Å; I164-A193 HydrophobicContact CG1-CB 4.43Å; I164-L214 HydrophobicContact CG2-CB 3.93Å; I164-L214 PolarHBondContact N-O 3.11Å; I164-L214 PolarHBondContact O-N 3.34Å
165	V	94.9	Very high	83	Confident	0 Å²	0	62.7 Å²	62.7	0%	0	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.2	115.2	172.5	179.7	0	0	0	0	107.9	F180 V190 R191 F192 A193 V211 L212 L213 I238	V165-F180 HydrophobicContact CG1-CE2 3.82Å; V165-F180 HydrophobicContact CG1-CZ 4.28Å; V165-V190 HydrophobicContact CB-CG1 4.46Å; V165-V190 HydrophobicContact CG2-CG1 3.51Å; V165-R191 PolarHBondContact N-O 2.8Å; V165-F192 HydrophobicContact CB-CD1 3.99Å; V165-F192 HydrophobicContact CB-CD2 4.47Å; V165-F192 HydrophobicContact CB-CE1 4.03Å; V165-F192 HydrophobicContact CB-CG 4.22Å; V165-F192 HydrophobicContact CB-CZ 4.29Å; V165-F192 HydrophobicContact CG1-CD1 3.85Å; V165-F192 HydrophobicContact CG1-CE1 3.68Å; V165-F192 HydrophobicContact CG1-CZ 4.27Å; V165-F192 HydrophobicContact CG2-CE1 4.49Å; V165-F192 HydrophobicContact CG2-CE2 4.46Å; V165-F192 HydrophobicContact CG2-CZ 4.31Å; V165-F192 CarbonylContact O-C 3.49Å; V165-F192 WeakPolarHBondContact O-CA 3.3Å; V165-A193 PolarHBondContact O-N 3.3Å; V165-V211 HydrophobicContact CG1-CG1 3.35Å; V165-L212 CarbonylContact C-O 3.5Å; V165-L212 WeakPolarHBondContact CA-O 3.41Å; V165-L213 HydrophobicContact CG1-CD1 4.22Å; V165-L213 HydrophobicContact CG2-CD1 4Å; V165-L213 HydrophobicContact CG2-CG 4.12Å; V165-I238 HydrophobicContact CG1-CD1 3.96Å; V165-I238 HydrophobicContact CG1-CG1 4.38Å; V165-I238 HydrophobicContact CG2-CD1 4.31Å; V165-I238 HydrophobicContact CG2-CG1 4.28Å; V165-I238 HydrophobicContact CG2-CG2 3.71Å
166	V	93.3	Very high	83.3	Confident	0 Å²	0	59.9 Å²	59.9	0%	0	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	116	-178.1	-175.3	0	0	0	0	109.4	L157 I164 A193 T195 V211 L212 L214	L157-V166 HydrophobicContact CD1-CG2 3.66Å; L157-V166 HydrophobicContact CD2-CG2 4.47Å; I164-V166 HydrophobicContact CD1-CG2 4.28Å; I164-V166 HydrophobicContact CG1-CG2 4Å; I164-V166 HydrophobicContact CG2-CG2 4.15Å; V166-A193 CarbonylContact C-O 3.59Å; V166-A193 WeakPolarHBondContact CA-O 3.31Å; V166-T195 HydrophobicContact CG1-CG2 3.58Å; V166-V211 WeakPolarHBondContact O-CA 3.35Å; V166-L212 HydrophobicContact CB-CB 4.4Å; V166-L212 PolarHBondContact N-O 3.36Å; V166-L212 PolarHBondContact O-N 3.42Å; V166-L214 HydrophobicContact CB-CD1 4.47Å; V166-L214 HydrophobicContact CG2-CD1 3.87Å
167	G	92	Very high	83.5	Confident	0 Å²	0	56.4 Å²	56.4	0%	0	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.6	121.1	170.3	0	0	0	0	0	110.2	A193 L194 T195	G167-A193 PolarHBondContact N-O 3.27Å; G167-L194 WeakPolarHBondContact O-CA 3.21Å; G167-T195 PolarHBondContact O-N 3.19Å
168	F	88.7	Confident	83.9	Confident	5 Å²	5	60.2 Å²	60.2	2%	0.022	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	119.9	171.3	176.5	-91	0	0	0	109	K170 T195 I201 V206 Q208 D209 V210	F168-K170 HydrophobicContact CE1-CG 3.95Å; F168-K170 HydrophobicContact CZ-CG 4.29Å; F168-T195 HydrophobicContact CD2-CG2 4.29Å; F168-T195 WeakPolarHBondContact CD2-O 3.34Å; F168-I201 HydrophobicContact CD2-CD1 4.44Å; F168-I201 HydrophobicContact CD2-CG1 3.8Å; F168-I201 HydrophobicContact CE1-CD1 4.07Å; F168-I201 HydrophobicContact CE1-CG1 3.92Å; F168-I201 HydrophobicContact CE2-CD1 3.29Å; F168-I201 HydrophobicContact CE2-CG1 3.06Å; F168-I201 HydrophobicContact CZ-CD1 3.07Å; F168-I201 HydrophobicContact CZ-CG1 3.17Å; F168-V206 HydrophobicContact CB-CG1 4.26Å; F168-V206 HydrophobicContact CD1-CB 4.32Å; F168-V206 HydrophobicContact CD1-CG1 3.26Å; F168-V206 HydrophobicContact CE1-CG1 3.88Å; F168-V206 HydrophobicContact CG-CG1 3.87Å; F168-Q208 WeakPolarHBondContact CD1-O 3.22Å; F168-D209 CarbonylContact O-C 3.51Å; F168-D209 WeakPolarHBondContact O-CA 3.43Å; F168-V210 HydrophobicContact CB-CG2 4.13Å; F168-V210 PolarHBondContact N-O 3.19Å; F168-V210 PolarHBondContact O-N 2.83Å
169	F	85.2	Confident	84.3	Confident	1 Å²	1	57.1 Å²	57.1	0%	0.004	30%	0.295	C	S	.	.			trans	-134.9	121.3	-178.1	-58.6	-82	0	0	0	110.1	L176 V177 F180 L194 Q196 D209 V211 M225	F169-L176 HydrophobicContact CD1-CB 4.15Å; F169-L176 HydrophobicContact CE1-CB 3.9Å; F169-V177 HydrophobicContact CD2-CG2 4.12Å; F169-V177 HydrophobicContact CE2-CG2 4.5Å; F169-V177 HydrophobicContact CG-CG2 4.15Å; F169-F180 HydrophobicContact CE2-CB 4.23Å; F169-F180 HydrophobicContact CE2-CD1 4.34Å; F169-F180 HydrophobicContact CE2-CD2 4.43Å; F169-F180 HydrophobicContact CE2-CG 4.1Å; F169-F180 HydrophobicContact CZ-CB 3.95Å; F169-F180 HydrophobicContact CZ-CD2 4.33Å; F169-F180 HydrophobicContact CZ-CG 4.15Å; F169-L194 HydrophobicContact CD2-CD2 3.57Å; F169-L194 HydrophobicContact CE2-CD2 3.5Å; F169-Q196 PolarHBondContact O-NE2 3.34Å; F169-D209 WeakPolarHBondContact CA-OD1 3.47Å; F169-D209 HydrophobicContact CD1-CB 3.8Å; F169-D209 HydrophobicContact CE1-CB 4.35Å; F169-V211 HydrophobicContact CZ-CG2 4.48Å; F169-M225 HydrophobicContact CE1-CB 4.36Å; F169-M225 HydrophobicContact CE1-CG 4.02Å; F169-M225 HydrophobicContact CZ-CG 4.4Å
170	K	75.7	Confident	84.7	Confident	129 Å²	129	53.3 Å²	53.3	56%	0.561	26%	0.263	S	S	*	.	S	Bend	trans	-62.5	-48.3	-179.8	-70.3	-174.3	176.3	-177	0	111.6	F168 T207 D209	F168-K170 HydrophobicContact CE1-CG 3.95Å; F168-K170 HydrophobicContact CZ-CG 4.29Å; K170-T207 WeakPolarHBondContact CE-O 3.4Å; K170-T207 PolarHBondContact NZ-O 2.93Å; K170-D209 PolarHBondContact N-OD1 2.83Å
171	E	73.8	Confident	85.1	Confident	123 Å²	123	54.6 Å²	54.6	58%	0.575	27%	0.266	S	S	*	.	S	Bend	trans	-112.6	135.5	169.3	-68.8	175.2	178.8	0	0	105.7	N173	E171-N173 PolarHBondContact O-N 3.4Å; E171-N173 PolarHBondContact OE2-ND2 2.9Å; E171-N173 VanDerWaalsContact OE2-ND2 3.12Å; E171-N173 PolarHBondContact OE2-OD1 3.28Å
172	L	66.6	Low	85.4	Confident	97 Å²	97	51 Å²	51	51%	0.508	25%	0.252	S	S	.	.			trans	-72.4	50.4	170.6	-62.5	170.1	0	0	0	109.6	H174 V177	L172-H174 PolarHBondContact O-N 3.42Å; L172-V177 HydrophobicContact CB-CG2 4.39Å; L172-V177 HydrophobicContact CD2-CG2 4.15Å
173	N	64.5	Low	85.7	Confident	79 Å²	79	46.8 Å²	46.8	42%	0.422	23%	0.229	S	C	.	.			trans	-53.9	108.2	174.4	-83.1	-29.3	0	0	0	106.3	E171 E175 L176 V177	E171-N173 PolarHBondContact O-N 3.4Å; E171-N173 PolarHBondContact OE2-ND2 2.9Å; E171-N173 VanDerWaalsContact OE2-ND2 3.12Å; E171-N173 PolarHBondContact OE2-OD1 3.28Å; N173-E175 PolarHBondContact O-N 3.14Å; N173-L176 PolarHBondContact O-N 3.4Å; N173-L176 VanDerWaalsContact O-N 3.09Å; N173-V177 PolarHBondContact O-N 3.09Å
174	H	71.1	Confident	85.8	Confident	131 Å²	131	45.2 Å²	45.2	61%	0.606	22%	0.221	S	C	*	.	H	α-helix	trans	-52.5	-39.1	-163.4	-175.5	-93.1	0	0	0	110.4	L172 L176 V177 Q178	L172-H174 PolarHBondContact O-N 3.42Å; H174-L176 PolarHBondContact O-N 2.79Å; H174-V177 PolarHBondContact O-N 2.99Å; H174-Q178 WeakPolarHBondContact CE1-CG 3.11Å; H174-Q178 PolarHBondContact CE1-NE2 3.46Å; H174-Q178 WeakPolarHBondContact ND1-CG 3.5Å; H174-Q178 PolarHBondContact NE2-NE2 3.15Å; H174-Q178 VanDerWaalsContact O-CB 3.3Å; H174-Q178 WeakPolarHBondContact O-CB 3.42Å; H174-Q178 WeakPolarHBondContact O-CG 3.41Å; H174-Q178 PolarHBondContact O-N 3.3Å
175	E	83.3	Confident	85.8	Confident	148 Å²	148	46.1 Å²	46.1	69%	0.692	23%	0.226	S	C	*	.	H	α-helix	trans	-58.6	-49.6	-179.8	-63.2	-176.1	173.7	0	0	114.3	N173 Q178 V179	N173-E175 PolarHBondContact O-N 3.14Å; E175-Q178 PolarHBondContact O-N 3.17Å; E175-V179 WeakPolarHBondContact O-CG2 3.3Å; E175-V179 PolarHBondContact O-N 3.49Å
176	L	87.5	Confident	85.6	Confident	15 Å²	15	48.4 Å²	48.4	8%	0.079	24%	0.238	C	C	.	.	H	α-helix	trans	-67.6	-39.8	179.7	-66.2	-177.7	0	0	0	111.9	F169 N173 H174 Q178 V179 F180 D209 M225 K226	F169-L176 HydrophobicContact CD1-CB 4.15Å; F169-L176 HydrophobicContact CE1-CB 3.9Å; N173-L176 PolarHBondContact O-N 3.4Å; N173-L176 VanDerWaalsContact O-N 3.09Å; H174-L176 PolarHBondContact O-N 2.79Å; L176-Q178 VanDerWaalsContact C-N 3.31Å; L176-V179 PolarHBondContact O-N 3.17Å; L176-F180 PolarHBondContact O-N 2.82Å; L176-D209 HydrophobicContact CD1-CB 4.15Å; L176-D209 WeakPolarHBondContact CD1-OD2 3.3Å; L176-M225 HydrophobicContact CD2-CB 4.42Å; L176-M225 HydrophobicContact CD2-CE 4.47Å; L176-K226 WeakPolarHBondContact CD2-O 3.44Å
177	V	88.1	Confident	85.5	Confident	10 Å²	10	49.4 Å²	49.4	6%	0.061	24%	0.243	C	C	.	.	H	α-helix	trans	-66.3	-36.4	176.3	-179	0	0	0	0	110.6	F169 L172 N173 H174 F180 Y181 L194	F169-V177 HydrophobicContact CD2-CG2 4.12Å; F169-V177 HydrophobicContact CE2-CG2 4.5Å; F169-V177 HydrophobicContact CG-CG2 4.15Å; L172-V177 HydrophobicContact CB-CG2 4.39Å; L172-V177 HydrophobicContact CD2-CG2 4.15Å; N173-V177 PolarHBondContact O-N 3.09Å; H174-V177 PolarHBondContact O-N 2.99Å; V177-F180 WeakPolarHBondContact O-CB 3.45Å; V177-F180 PolarHBondContact O-N 2.88Å; V177-Y181 HydrophobicContact CG1-CD2 3.92Å; V177-Y181 HydrophobicContact CG1-CE1 4.15Å; V177-Y181 HydrophobicContact CG1-CE2 3.48Å; V177-Y181 VanDerWaalsContact CG1-CE2 3.48Å; V177-Y181 HydrophobicContact CG1-CG 4.43Å; V177-Y181 WeakPolarHBondContact O-CB 3.41Å; V177-Y181 VanDerWaalsContact O-CG 3.3Å; V177-Y181 PolarHBondContact O-N 3.23Å; V177-L194 HydrophobicContact CG1-CD1 4.15Å
178	Q	88.7	Confident	85.4	Confident	82 Å²	82	49.8 Å²	49.8	38%	0.383	25%	0.246	S	C	.	.	H	α-helix	trans	-65.9	-40.3	174.6	-74.3	-52	-36.1	0	0	111.8	H174 E175 L176 F180 Y181 A182	H174-Q178 WeakPolarHBondContact CE1-CG 3.11Å; H174-Q178 PolarHBondContact CE1-NE2 3.46Å; H174-Q178 WeakPolarHBondContact ND1-CG 3.5Å; H174-Q178 PolarHBondContact NE2-NE2 3.15Å; H174-Q178 VanDerWaalsContact O-CB 3.3Å; H174-Q178 WeakPolarHBondContact O-CB 3.42Å; H174-Q178 WeakPolarHBondContact O-CG 3.41Å; H174-Q178 PolarHBondContact O-N 3.3Å; E175-Q178 PolarHBondContact O-N 3.17Å; L176-Q178 VanDerWaalsContact C-N 3.31Å; Q178-F180 VanDerWaalsContact C-N 3.33Å; Q178-Y181 PolarHBondContact O-N 2.88Å; Q178-A182 VanDerWaalsContact O-CB 3.25Å; Q178-A182 WeakPolarHBondContact O-CB 3.46Å; Q178-A182 PolarHBondContact O-N 3.18Å
179	V	91.9	Very high	85.4	Confident	32 Å²	32	53.2 Å²	53.2	19%	0.194	26%	0.264	C	S	.	.	H	α-helix	trans	-61.4	-44.1	173.2	174.5	0	0	0	0	110.6	E175 L176 A182 A183 M225 K231	E175-V179 WeakPolarHBondContact O-CG2 3.3Å; E175-V179 PolarHBondContact O-N 3.49Å; L176-V179 PolarHBondContact O-N 3.17Å; V179-A182 PolarHBondContact O-N 2.96Å; V179-A183 PolarHBondContact O-N 3.41Å; V179-M225 HydrophobicContact CB-CE 4.24Å; V179-M225 HydrophobicContact CG1-CE 3.98Å; V179-K231 HydrophobicContact CG1-CB 4.26Å
180	F	92.8	Very high	85.7	Confident	0 Å²	0	53.7 Å²	53.7	0%	0	27%	0.267	C	S	.	.	H	α-helix	trans	-60.6	-47.1	176.5	-179.3	-104.1	0	0	0	112.5	A148 V165 F169 L176 V177 Q178 A183 A184 F192 A193 L194 V211 L234	A148-F180 HydrophobicContact CB-CE1 3.9Å; V165-F180 HydrophobicContact CG1-CE2 3.82Å; V165-F180 HydrophobicContact CG1-CZ 4.28Å; F169-F180 HydrophobicContact CE2-CB 4.23Å; F169-F180 HydrophobicContact CE2-CD1 4.34Å; F169-F180 HydrophobicContact CE2-CD2 4.43Å; F169-F180 HydrophobicContact CE2-CG 4.1Å; F169-F180 HydrophobicContact CZ-CB 3.95Å; F169-F180 HydrophobicContact CZ-CD2 4.33Å; F169-F180 HydrophobicContact CZ-CG 4.15Å; L176-F180 PolarHBondContact O-N 2.82Å; V177-F180 WeakPolarHBondContact O-CB 3.45Å; V177-F180 PolarHBondContact O-N 2.88Å; Q178-F180 VanDerWaalsContact C-N 3.33Å; F180-A183 PolarHBondContact O-N 2.84Å; F180-A184 PolarHBondContact O-N 3.33Å; F180-F192 HydrophobicContact CD2-CD1 4.38Å; F180-F192 HydrophobicContact CD2-CE1 4.48Å; F180-F192 HydrophobicContact CE1-CB 4.48Å; F180-F192 AromaticContact CE1-CD1 3.94Å; F180-F192 HydrophobicContact CE1-CD1 3.94Å; F180-F192 AromaticContact CE2-CD1 3.72Å; F180-F192 HydrophobicContact CE2-CD1 3.72Å; F180-F192 HydrophobicContact CE2-CE1 4.05Å; F180-F192 HydrophobicContact CZ-CB 4.38Å; F180-F192 AromaticContact CZ-CD1 3.48Å; F180-F192 HydrophobicContact CZ-CD1 3.48Å; F180-F192 VanDerWaalsContact CZ-CD1 3.48Å; F180-F192 HydrophobicContact CZ-CE1 4.28Å; F180-F192 HydrophobicContact CZ-CG 4.39Å; F180-A193 WeakPolarHBondContact CZ-O 3.29Å; F180-L194 HydrophobicContact CD1-CD2 3.74Å; F180-L194 HydrophobicContact CD1-CG 4.31Å; F180-L194 HydrophobicContact CE1-CD2 3.59Å; F180-L194 HydrophobicContact CE1-CG 3.94Å; F180-L194 HydrophobicContact CZ-CD2 4.38Å; F180-V211 HydrophobicContact CD2-CG2 3.62Å; F180-V211 HydrophobicContact CE2-CG1 4.01Å; F180-V211 HydrophobicContact CE2-CG2 3.83Å; F180-L234 HydrophobicContact CD2-CD2 4.29Å
181	Y	91.8	Very high	86.4	Confident	56 Å²	56	53.3 Å²	53.3	22%	0.22	26%	0.262	C	S	.	.	H	α-helix	trans	-64.1	-40.2	175.7	-71.5	-22.1	0	0	0	112.9	A148 V177 Q178 A183 A184 I185 L194	A148-Y181 HydrophobicContact CB-CD1 4.22Å; A148-Y181 HydrophobicContact CB-CE1 3.81Å; V177-Y181 HydrophobicContact CG1-CD2 3.92Å; V177-Y181 HydrophobicContact CG1-CE1 4.15Å; V177-Y181 HydrophobicContact CG1-CE2 3.48Å; V177-Y181 VanDerWaalsContact CG1-CE2 3.48Å; V177-Y181 HydrophobicContact CG1-CG 4.43Å; V177-Y181 WeakPolarHBondContact O-CB 3.41Å; V177-Y181 VanDerWaalsContact O-CG 3.3Å; V177-Y181 PolarHBondContact O-N 3.23Å; Q178-Y181 PolarHBondContact O-N 2.88Å; Y181-A183 VanDerWaalsContact C-N 3.28Å; Y181-A183 PolarHBondContact O-N 3.17Å; Y181-A184 WeakPolarHBondContact O-CB 3.47Å; Y181-A184 PolarHBondContact O-N 2.82Å; Y181-A184 VanDerWaalsContact O-N 3.13Å; Y181-I185 WeakPolarHBondContact O-CG1 3.41Å; Y181-I185 PolarHBondContact O-N 2.89Å; Y181-L194 HydrophobicContact CE1-CD1 3.49Å; Y181-L194 VanDerWaalsContact CE1-CD1 3.49Å; Y181-L194 HydrophobicContact CE1-CG 4.26Å; Y181-L194 WeakPolarHBondContact OH-CD1 3.44Å
182	A	91.8	Very high	87.4	Confident	33 Å²	33	47.6 Å²	47.6	27%	0.273	24%	0.235	S	C	.	.	H	α-helix	trans	-62.5	-38.4	175.9	0	0	0	0	0	111.4	Q178 V179 I185 D186 K231	Q178-A182 VanDerWaalsContact O-CB 3.25Å; Q178-A182 WeakPolarHBondContact O-CB 3.46Å; Q178-A182 PolarHBondContact O-N 3.18Å; V179-A182 PolarHBondContact O-N 2.96Å; A182-I185 PolarHBondContact O-N 3.11Å; A182-D186 PolarHBondContact O-N 2.81Å; A182-K231 HydrophobicContact CB-CD 3.58Å; A182-K231 HydrophobicContact CB-CG 4Å
183	A	93.6	Very high	88.5	Confident	0 Å²	0	43.1 Å²	43.1	0%	0	21%	0.212	C	C	.	.	H	α-helix	trans	-66.8	-38.9	172.4	0	0	0	0	0	112.1	V179 F180 Y181 I185 D186 L187 K231 L234 V235	V179-A183 PolarHBondContact O-N 3.41Å; F180-A183 PolarHBondContact O-N 2.84Å; Y181-A183 VanDerWaalsContact C-N 3.28Å; Y181-A183 PolarHBondContact O-N 3.17Å; A183-I185 VanDerWaalsContact C-N 3.32Å; A183-I185 PolarHBondContact O-N 3.4Å; A183-D186 PolarHBondContact O-N 2.69Å; A183-D186 VanDerWaalsContact O-N 3.14Å; A183-L187 PolarHBondContact O-N 2.84Å; A183-L187 VanDerWaalsContact O-N 3.13Å; A183-K231 HydrophobicContact CB-CG 4.16Å; A183-L234 HydrophobicContact CB-CB 4.41Å; A183-L234 HydrophobicContact CB-CD2 3.74Å; A183-L234 HydrophobicContact CB-CG 4.05Å; A183-V235 HydrophobicContact CB-CG2 3.84Å
184	A	93.6	Very high	89.7	Confident	0 Å²	0	39.8 Å²	39.8	0%	0	19%	0.194	C	C	.	.	H	α-helix	trans	-62.1	-38.2	175.4	0	0	0	0	0	112.5	R142 S147 F180 Y181 D186 L187 F192	R142-A184 VanDerWaalsContact CD-O 3.29Å; R142-A184 WeakPolarHBondContact CD-O 3.32Å; R142-A184 PolarHBondContact NH1-O 3.11Å; S147-A184 WeakPolarHBondContact O-CB 3.41Å; F180-A184 PolarHBondContact O-N 3.33Å; Y181-A184 WeakPolarHBondContact O-CB 3.47Å; Y181-A184 PolarHBondContact O-N 2.82Å; Y181-A184 VanDerWaalsContact O-N 3.13Å; A184-D186 VanDerWaalsContact C-N 3.3Å; A184-D186 PolarHBondContact O-N 3.15Å; A184-L187 CarbonylContact O-C 3.54Å; A184-L187 PolarHBondContact O-N 2.78Å; A184-F192 HydrophobicContact CB-CB 4Å; A184-F192 HydrophobicContact CB-CD1 3.49Å; A184-F192 VanDerWaalsContact CB-CD1 3.49Å; A184-F192 HydrophobicContact CB-CD2 3.8Å; A184-F192 HydrophobicContact CB-CE1 3.81Å; A184-F192 HydrophobicContact CB-CE2 4.09Å; A184-F192 HydrophobicContact CB-CG 3.49Å; A184-F192 VanDerWaalsContact CB-CG 3.49Å; A184-F192 HydrophobicContact CB-CZ 4.09Å
185	I	92.3	Very high	90.5	Very high	28 Å²	28	33.6 Å²	33.6	14%	0.144	17%	0.166	C	C	.	.	H	α-helix	trans	-60.8	-42.3	173.7	-70.2	164	0	0	0	110.4	W139 R142 R143 Y181 A182 A183 L187	W139-I185 VanDerWaalsContact CD1-O 3.24Å; R142-I185 HydrophobicContact CB-CG1 3.82Å; R143-I185 HydrophobicContact CG-CD1 4.26Å; R143-I185 HydrophobicContact CG-CG1 4.26Å; R143-I185 HydrophobicContact CG-CG2 3.65Å; Y181-I185 WeakPolarHBondContact O-CG1 3.41Å; Y181-I185 PolarHBondContact O-N 2.89Å; A182-I185 PolarHBondContact O-N 3.11Å; A183-I185 VanDerWaalsContact C-N 3.32Å; A183-I185 PolarHBondContact O-N 3.4Å; I185-L187 PolarHBondContact O-N 3.17Å
186	D	91.4	Very high	90.4	Very high	47 Å²	47	31 Å²	31	25%	0.251	15%	0.154	S	C	.	.	H	α-helix	trans	-76.8	-10	-177.8	-70.6	-8	0	0	0	113.6	P128 A182 A183 A184 P188 K231 V235	P128-D186 VanDerWaalsContact CG-O 3.27Å; P128-D186 WeakPolarHBondContact CG-O 3.02Å; A182-D186 PolarHBondContact O-N 2.81Å; A183-D186 PolarHBondContact O-N 2.69Å; A183-D186 VanDerWaalsContact O-N 3.14Å; A184-D186 VanDerWaalsContact C-N 3.3Å; A184-D186 PolarHBondContact O-N 3.15Å; D186-P188 VanDerWaalsContact C-CD 3.43Å; D186-P188 WeakPolarHBondContact O-CD 3.34Å; D186-K231 VanDerWaalsContact OD2-CE 3.27Å; D186-K231 WeakPolarHBondContact OD2-CE 3.32Å; D186-K231 IonicContact OD2-NZ 3.53Å; D186-K231 PolarHBondContact OD2-NZ 2.94Å; D186-V235 HydrophobicContact CB-CG2 4.18Å
187	L	90.9	Very high	90.2	Very high	21 Å²	21	31.7 Å²	31.7	11%	0.11	16%	0.158	C	C	.	.			trans	-124.7	63.3	-179.6	-66.7	171.7	0	0	0	111.9	R142 A183 A184 I185 D189 V190 F192 V235 I238	R142-L187 PolarHBondContact NH1-O 3.18Å; A183-L187 PolarHBondContact O-N 2.84Å; A183-L187 VanDerWaalsContact O-N 3.13Å; A184-L187 CarbonylContact O-C 3.54Å; A184-L187 PolarHBondContact O-N 2.78Å; I185-L187 PolarHBondContact O-N 3.17Å; L187-D189 PolarHBondContact O-N 2.92Å; L187-V190 HydrophobicContact CB-CB 4.4Å; L187-V190 HydrophobicContact CB-CG2 4.43Å; L187-V190 PolarHBondContact O-N 2.65Å; L187-V190 VanDerWaalsContact O-N 3.15Å; L187-F192 HydrophobicContact CB-CE2 3.84Å; L187-F192 HydrophobicContact CB-CZ 4.09Å; L187-F192 HydrophobicContact CD1-CE2 4.48Å; L187-F192 HydrophobicContact CD1-CZ 4Å; L187-V235 HydrophobicContact CD1-CG1 4.32Å; L187-V235 HydrophobicContact CD1-CG2 4.37Å; L187-V235 HydrophobicContact CD2-CG1 4.27Å; L187-V235 HydrophobicContact CG-CG1 4.31Å; L187-I238 HydrophobicContact CD1-CB 3.75Å; L187-I238 HydrophobicContact CD1-CD1 3.91Å; L187-I238 HydrophobicContact CD1-CG1 4.44Å; L187-I238 HydrophobicContact CD1-CG2 3.66Å
188	P	90.4	Very high	89.9	Confident	9 Å²	9	36.8 Å²	36.8	6%	0.058	18%	0.184	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.9	-20.9	-173.8	27.9	-36	0	0	0	114.1	S135 T138 W139 D186 V190	S135-P188 VanDerWaalsContact O-CB 3.22Å; S135-P188 WeakPolarHBondContact O-CB 3.38Å; T138-P188 HydrophobicContact CG2-CB 4.39Å; W139-P188 HydrophobicContact CB-CB 3.99Å; W139-P188 HydrophobicContact CB-CG 4.38Å; D186-P188 VanDerWaalsContact C-CD 3.43Å; D186-P188 WeakPolarHBondContact O-CD 3.34Å; P188-V190 VanDerWaalsContact C-N 3.31Å
189	D	89.1	Confident	89.6	Confident	77 Å²	77	38.7 Å²	38.7	41%	0.412	19%	0.194	S	C	.	.	T	Hydrogen-bonded Turn	trans	-83.3	-7	179.6	-64.7	-59.3	0	0	0	113.6	Q131 S135 L187	Q131-D189 WeakPolarHBondContact CG-OD2 3.35Å; S135-D189 WeakPolarHBondContact CB-OD1 3.34Å; S135-D189 PolarHBondContact OG-OD1 3.23Å; L187-D189 PolarHBondContact O-N 2.92Å
190	V	90.5	Very high	88.9	Confident	10 Å²	10	37.2 Å²	37.2	6%	0.061	19%	0.185	C	C	.	.	S	Bend	trans	-108.1	138.8	179.8	-178.5	0	0	0	0	109.1	R142 L163 V165 L187 P188 F192 I238	R142-V190 PolarHBondContact NH1-O 2.92Å; R142-V190 PolarHBondContact NH2-O 2.97Å; L163-V190 HydrophobicContact CD2-CG1 4.46Å; V165-V190 HydrophobicContact CB-CG1 4.46Å; V165-V190 HydrophobicContact CG2-CG1 3.51Å; L187-V190 HydrophobicContact CB-CB 4.4Å; L187-V190 HydrophobicContact CB-CG2 4.43Å; L187-V190 PolarHBondContact O-N 2.65Å; L187-V190 VanDerWaalsContact O-N 3.15Å; P188-V190 VanDerWaalsContact C-N 3.31Å; V190-F192 HydrophobicContact CB-CD2 4.38Å; V190-F192 HydrophobicContact CB-CE2 3.88Å; V190-F192 HydrophobicContact CG1-CD2 4.32Å; V190-F192 HydrophobicContact CG1-CE2 3.94Å; V190-F192 WeakPolarHBondContact O-CD2 3.27Å; V190-I238 HydrophobicContact CG1-CG2 4.37Å
191	R	91.1	Very high	88.2	Confident	122 Å²	122	39 Å²	39	46%	0.46	19%	0.194	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.6	132.6	174.4	-66.1	-169.5	-169.3	143.8	15.4	109.9	D162 I164 V165	D162-R191 IonicContact OD2-CZ 2.7Å; D162-R191 VanDerWaalsContact OD2-CZ 3.31Å; D162-R191 IonicContact OD2-NH1 3.91Å; D162-R191 PolarHBondContact OD2-NH1 3.46Å; D162-R191 IonicContact OD2-NH2 2.67Å; D162-R191 PolarHBondContact OD2-NH2 3Å; I164-R191 HydrophobicContact CB-CB 4.45Å; I164-R191 HydrophobicContact CG1-CB 4.18Å; V165-R191 PolarHBondContact N-O 2.8Å
192	F	93.6	Very high	87.9	Confident	2 Å²	2	40.5 Å²	40.5	1%	0.009	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	135.5	176.6	-79.4	-109.8	0	0	0	109	A148 D149 V165 F180 A184 L187 V190 I238	A148-F192 WeakPolarHBondContact CA-O 3.5Å; A148-F192 HydrophobicContact CB-CB 3.85Å; D149-F192 PolarHBondContact N-O 3.16Å; D149-F192 VanDerWaalsContact N-O 3.16Å; V165-F192 HydrophobicContact CB-CD1 3.99Å; V165-F192 HydrophobicContact CB-CD2 4.47Å; V165-F192 HydrophobicContact CB-CE1 4.03Å; V165-F192 HydrophobicContact CB-CG 4.22Å; V165-F192 HydrophobicContact CB-CZ 4.29Å; V165-F192 HydrophobicContact CG1-CD1 3.85Å; V165-F192 HydrophobicContact CG1-CE1 3.68Å; V165-F192 HydrophobicContact CG1-CZ 4.27Å; V165-F192 HydrophobicContact CG2-CE1 4.49Å; V165-F192 HydrophobicContact CG2-CE2 4.46Å; V165-F192 HydrophobicContact CG2-CZ 4.31Å; V165-F192 CarbonylContact O-C 3.49Å; V165-F192 WeakPolarHBondContact O-CA 3.3Å; F180-F192 HydrophobicContact CD2-CD1 4.38Å; F180-F192 HydrophobicContact CD2-CE1 4.48Å; F180-F192 HydrophobicContact CE1-CB 4.48Å; F180-F192 AromaticContact CE1-CD1 3.94Å; F180-F192 HydrophobicContact CE1-CD1 3.94Å; F180-F192 AromaticContact CE2-CD1 3.72Å; F180-F192 HydrophobicContact CE2-CD1 3.72Å; F180-F192 HydrophobicContact CE2-CE1 4.05Å; F180-F192 HydrophobicContact CZ-CB 4.38Å; F180-F192 AromaticContact CZ-CD1 3.48Å; F180-F192 HydrophobicContact CZ-CD1 3.48Å; F180-F192 VanDerWaalsContact CZ-CD1 3.48Å; F180-F192 HydrophobicContact CZ-CE1 4.28Å; F180-F192 HydrophobicContact CZ-CG 4.39Å; A184-F192 HydrophobicContact CB-CB 4Å; A184-F192 HydrophobicContact CB-CD1 3.49Å; A184-F192 VanDerWaalsContact CB-CD1 3.49Å; A184-F192 HydrophobicContact CB-CD2 3.8Å; A184-F192 HydrophobicContact CB-CE1 3.81Å; A184-F192 HydrophobicContact CB-CE2 4.09Å; A184-F192 HydrophobicContact CB-CG 3.49Å; A184-F192 VanDerWaalsContact CB-CG 3.49Å; A184-F192 HydrophobicContact CB-CZ 4.09Å; L187-F192 HydrophobicContact CB-CE2 3.84Å; L187-F192 HydrophobicContact CB-CZ 4.09Å; L187-F192 HydrophobicContact CD1-CE2 4.48Å; L187-F192 HydrophobicContact CD1-CZ 4Å; V190-F192 HydrophobicContact CB-CD2 4.38Å; V190-F192 HydrophobicContact CB-CE2 3.88Å; V190-F192 HydrophobicContact CG1-CD2 4.32Å; V190-F192 HydrophobicContact CG1-CE2 3.94Å; V190-F192 WeakPolarHBondContact O-CD2 3.27Å; F192-I238 HydrophobicContact CE1-CD1 3.74Å; F192-I238 HydrophobicContact CZ-CD1 3.61Å
193	A	91.5	Very high	87.6	Confident	3 Å²	3	43 Å²	43	3%	0.025	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.8	156.4	171.5	0	0	0	0	0	111.4	D149 I151 I164 V165 V166 G167 F180	D149-A193 CarbonylContact O-C 3.59Å; D149-A193 WeakPolarHBondContact O-CA 3.46Å; D149-A193 WeakPolarHBondContact O-CB 3.15Å; I151-A193 HydrophobicContact CD1-CB 3.32Å; I151-A193 HydrophobicContact CG1-CB 3.7Å; I164-A193 HydrophobicContact CD1-CB 3.8Å; I164-A193 HydrophobicContact CG1-CB 4.43Å; V165-A193 PolarHBondContact O-N 3.3Å; V166-A193 CarbonylContact C-O 3.59Å; V166-A193 WeakPolarHBondContact CA-O 3.31Å; G167-A193 PolarHBondContact N-O 3.27Å; F180-A193 WeakPolarHBondContact CZ-O 3.29Å
194	L	89.8	Confident	87.2	Confident	9 Å²	9	44.2 Å²	44.2	5%	0.047	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	147.4	168.3	-74.2	174.6	0	0	0	109.6	A148 D149 L150 I151 G167 F169 V177 F180 Y181	A148-L194 HydrophobicContact CB-CG 4.19Å; D149-L194 PolarHBondContact O-N 3.29Å; L150-L194 HydrophobicContact CD1-CB 4.32Å; I151-L194 PolarHBondContact N-O 3.35Å; G167-L194 WeakPolarHBondContact O-CA 3.21Å; F169-L194 HydrophobicContact CD2-CD2 3.57Å; F169-L194 HydrophobicContact CE2-CD2 3.5Å; V177-L194 HydrophobicContact CG1-CD1 4.15Å; F180-L194 HydrophobicContact CD1-CD2 3.74Å; F180-L194 HydrophobicContact CD1-CG 4.31Å; F180-L194 HydrophobicContact CE1-CD2 3.59Å; F180-L194 HydrophobicContact CE1-CG 3.94Å; F180-L194 HydrophobicContact CZ-CD2 4.38Å; Y181-L194 HydrophobicContact CE1-CD1 3.49Å; Y181-L194 VanDerWaalsContact CE1-CD1 3.49Å; Y181-L194 HydrophobicContact CE1-CG 4.26Å; Y181-L194 WeakPolarHBondContact OH-CD1 3.44Å
195	T	86.4	Confident	86.8	Confident	2 Å²	2	49.9 Å²	49.9	1%	0.012	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.1	149.1	170.6	-171.7	0	0	0	0	110.9	I151 V166 G167 F168 D197 V200	I151-T195 PolarHBondContact O-OG1 3.42Å; V166-T195 HydrophobicContact CG1-CG2 3.58Å; G167-T195 PolarHBondContact O-N 3.19Å; F168-T195 HydrophobicContact CD2-CG2 4.29Å; F168-T195 WeakPolarHBondContact CD2-O 3.34Å; T195-D197 WeakPolarHBondContact OG1-CB 3.14Å; T195-D197 PolarHBondContact OG1-N 2.97Å; T195-D197 VanDerWaalsContact OG1-N 3.17Å; T195-V200 HydrophobicContact CG2-CB 4.28Å; T195-V200 HydrophobicContact CG2-CG1 4Å; T195-V200 HydrophobicContact CG2-CG2 4.42Å
196	Q	82.8	Confident	86.1	Confident	92 Å²	92	48.9 Å²	48.9	43%	0.43	25%	0.252	S	S	.	.			trans	-122.9	15.2	169.5	-57.7	-167.3	-72.9	0	0	110.8	F169 D198	F169-Q196 PolarHBondContact O-NE2 3.34Å; Q196-D198 PolarHBondContact O-N 3.33Å
197	D	82.6	Confident	85.4	Confident	30 Å²	30	51.2 Å²	51.2	16%	0.16	27%	0.268	C	S	.	.			trans	-72.6	123.4	-176.4	-178.5	3.9	0	0	0	111.2	D153 L154 T195 E199 V200 I201	D153-D197 WeakPolarHBondContact CA-OD2 3.46Å; L154-D197 PolarHBondContact N-OD2 2.81Å; T195-D197 WeakPolarHBondContact OG1-CB 3.14Å; T195-D197 PolarHBondContact OG1-N 2.97Å; T195-D197 VanDerWaalsContact OG1-N 3.17Å; D197-E199 PolarHBondContact O-N 2.86Å; D197-E199 WeakPolarHBondContact OD1-CB 3.49Å; D197-E199 PolarHBondContact OD1-N 2.98Å; D197-V200 HydrophobicContact CB-CB 4.45Å; D197-V200 HydrophobicContact CB-CG2 3.97Å; D197-V200 PolarHBondContact O-N 2.85Å; D197-V200 VanDerWaalsContact O-N 3.16Å; D197-I201 PolarHBondContact O-N 3.03Å
198	D	80.5	Confident	84.9	Confident	117 Å²	117	53.9 Å²	53.9	63%	0.626	28%	0.28	S	S	*	.	H	α-helix	trans	-63.8	-23.6	178.3	-71.4	-30.5	0	0	0	112.7	Q196 I201 S202	Q196-D198 PolarHBondContact O-N 3.33Å; D198-I201 WeakPolarHBondContact O-CB 3.47Å; D198-I201 VanDerWaalsContact OD1-CD1 3.3Å; D198-I201 WeakPolarHBondContact OD1-CD1 3.35Å; D198-S202 WeakPolarHBondContact O-CB 3.49Å; D198-S202 PolarHBondContact O-N 3.14Å; D198-S202 PolarHBondContact O-OG 3.3Å
199	E	82.7	Confident	84.8	Confident	123 Å²	123	54.7 Å²	54.7	58%	0.575	28%	0.284	S	S	*	.	H	α-helix	trans	-69.8	-40.2	174.3	-64	-169.6	173.4	0	0	111.4	D197 S202 K203	D197-E199 PolarHBondContact O-N 2.86Å; D197-E199 WeakPolarHBondContact OD1-CB 3.49Å; D197-E199 PolarHBondContact OD1-N 2.98Å; E199-S202 PolarHBondContact O-N 3.37Å; E199-K203 WeakPolarHBondContact O-CB 3.26Å; E199-K203 PolarHBondContact O-N 3.31Å
200	V	78.8	Confident	84.9	Confident	1 Å²	1	51.5 Å²	51.5	1%	0.006	27%	0.267	C	S	.	.	H	α-helix	trans	-65.7	-41.6	175.1	-178.9	0	0	0	0	110.3	L154 L157 T195 D197 S202 K203 Y204	L154-V200 HydrophobicContact CB-CG2 4.33Å; L154-V200 HydrophobicContact CD1-CG2 4Å; L157-V200 HydrophobicContact CD2-CG1 4.34Å; L157-V200 HydrophobicContact CD2-CG2 4.5Å; T195-V200 HydrophobicContact CG2-CB 4.28Å; T195-V200 HydrophobicContact CG2-CG1 4Å; T195-V200 HydrophobicContact CG2-CG2 4.42Å; D197-V200 HydrophobicContact CB-CB 4.45Å; D197-V200 HydrophobicContact CB-CG2 3.97Å; D197-V200 PolarHBondContact O-N 2.85Å; D197-V200 VanDerWaalsContact O-N 3.16Å; V200-S202 VanDerWaalsContact C-N 3.31Å; V200-S202 PolarHBondContact O-N 2.88Å; V200-K203 PolarHBondContact O-N 3.15Å; V200-Y204 HydrophobicContact CG1-CD2 3.82Å; V200-Y204 HydrophobicContact CG1-CE2 4.14Å; V200-Y204 WeakPolarHBondContact O-CD2 3.24Å; V200-Y204 PolarHBondContact O-N 3.41Å; V200-Y204 VanDerWaalsContact O-N 3.11Å
201	I	77.3	Confident	85.1	Confident	37 Å²	37	51 Å²	51	19%	0.19	26%	0.264	C	S	.	.	H	α-helix	trans	-53.6	-50.7	172.4	-68.6	173	0	0	0	110.8	F168 D197 D198 T205 V206	F168-I201 HydrophobicContact CD2-CD1 4.44Å; F168-I201 HydrophobicContact CD2-CG1 3.8Å; F168-I201 HydrophobicContact CE1-CD1 4.07Å; F168-I201 HydrophobicContact CE1-CG1 3.92Å; F168-I201 HydrophobicContact CE2-CD1 3.29Å; F168-I201 HydrophobicContact CE2-CG1 3.06Å; F168-I201 HydrophobicContact CZ-CD1 3.07Å; F168-I201 HydrophobicContact CZ-CG1 3.17Å; D197-I201 PolarHBondContact O-N 3.03Å; D198-I201 WeakPolarHBondContact O-CB 3.47Å; D198-I201 VanDerWaalsContact OD1-CD1 3.3Å; D198-I201 WeakPolarHBondContact OD1-CD1 3.35Å; I201-T205 CarbonylContact O-C 3.6Å; I201-T205 VanDerWaalsContact O-CA 3.29Å; I201-T205 WeakPolarHBondContact O-CA 3.42Å; I201-T205 PolarHBondContact O-N 2.92Å; I201-V206 WeakPolarHBondContact CG2-O 3.49Å; I201-V206 PolarHBondContact O-N 2.96Å
202	S	84.7	Confident	85.2	Confident	88 Å²	88	45.2 Å²	45.2	62%	0.615	24%	0.242	S	C	*	.	H	α-helix	trans	-66.1	-43.6	-174.9	-61.4	0	0	0	0	111.1	D198 E199 V200 T205	D198-S202 WeakPolarHBondContact O-CB 3.49Å; D198-S202 PolarHBondContact O-N 3.14Å; D198-S202 PolarHBondContact O-OG 3.3Å; E199-S202 PolarHBondContact O-N 3.37Å; V200-S202 VanDerWaalsContact C-N 3.31Å; V200-S202 PolarHBondContact O-N 2.88Å; S202-T205 PolarHBondContact O-N 3.43Å
203	K	86	Confident	85.2	Confident	85 Å²	85	45.1 Å²	45.1	37%	0.37	24%	0.242	S	C	.	.	H	α-helix	trans	-62.3	-44.7	-180	-175.3	175.3	-176.8	178.1	0	112.8	L154 E158 E199 V200	L154-K203 HydrophobicContact CD1-CD 3.7Å; L154-K203 HydrophobicContact CD2-CD 3.87Å; L154-K203 HydrophobicContact CG-CD 4.42Å; E158-K203 IonicContact OE1-NZ 2.63Å; E158-K203 PolarHBondContact OE1-NZ 2.87Å; E199-K203 WeakPolarHBondContact O-CB 3.26Å; E199-K203 PolarHBondContact O-N 3.31Å; V200-K203 PolarHBondContact O-N 3.15Å
204	Y	86	Confident	85.3	Confident	26 Å²	26	45 Å²	45	10%	0.102	24%	0.241	C	C	.	.	H	α-helix	trans	-99.1	7.4	-176.7	-61.2	-70.7	0	0	0	113.6	L157 V200 V206 L212 L214 S217 L219	L157-Y204 HydrophobicContact CD2-CE2 4.22Å; V200-Y204 HydrophobicContact CG1-CD2 3.82Å; V200-Y204 HydrophobicContact CG1-CE2 4.14Å; V200-Y204 WeakPolarHBondContact O-CD2 3.24Å; V200-Y204 PolarHBondContact O-N 3.41Å; V200-Y204 VanDerWaalsContact O-N 3.11Å; Y204-V206 VanDerWaalsContact C-N 3.29Å; Y204-V206 PolarHBondContact O-N 3.08Å; Y204-L212 HydrophobicContact CD2-CD1 4.08Å; Y204-L212 HydrophobicContact CG-CD1 4.15Å; Y204-L214 HydrophobicContact CD1-CD2 4.29Å; Y204-L214 HydrophobicContact CE1-CD2 3.78Å; Y204-L214 HydrophobicContact CE2-CD1 4.06Å; Y204-S217 PolarHBondContact OH-O 3.29Å; Y204-L219 HydrophobicContact CD1-CB 4.04Å; Y204-L219 HydrophobicContact CE1-CB 4.16Å
205	T	83.6	Confident	85.3	Confident	118 Å²	118	49.4 Å²	49.4	72%	0.724	26%	0.26	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.8	42.7	178.9	-44	0	0	0	0	112.8	I201 S202 T207	I201-T205 CarbonylContact O-C 3.6Å; I201-T205 VanDerWaalsContact O-CA 3.29Å; I201-T205 WeakPolarHBondContact O-CA 3.42Å; I201-T205 PolarHBondContact O-N 2.92Å; S202-T205 PolarHBondContact O-N 3.43Å; T205-T207 PolarHBondContact O-N 3.28Å
206	V	78.8	Confident	85.4	Confident	8 Å²	8	55.9 Å²	55.9	5%	0.048	29%	0.287	C	S	.	.			trans	-90.3	107.9	-173.7	177.2	0	0	0	0	110.9	F168 I201 Y204 Q208 V210 L212	F168-V206 HydrophobicContact CB-CG1 4.26Å; F168-V206 HydrophobicContact CD1-CB 4.32Å; F168-V206 HydrophobicContact CD1-CG1 3.26Å; F168-V206 HydrophobicContact CE1-CG1 3.88Å; F168-V206 HydrophobicContact CG-CG1 3.87Å; I201-V206 WeakPolarHBondContact CG2-O 3.49Å; I201-V206 PolarHBondContact O-N 2.96Å; Y204-V206 VanDerWaalsContact C-N 3.29Å; Y204-V206 PolarHBondContact O-N 3.08Å; V206-Q208 WeakPolarHBondContact CG1-O 3.39Å; V206-V210 HydrophobicContact CB-CG2 4.29Å; V206-V210 HydrophobicContact CG1-CB 4.39Å; V206-V210 HydrophobicContact CG1-CG1 4.25Å; V206-V210 HydrophobicContact CG1-CG2 3.26Å; V206-V210 HydrophobicContact CG2-CG2 3.99Å; V206-L212 HydrophobicContact CG2-CD1 4.13Å; V206-L212 HydrophobicContact CG2-CD2 4.01Å
207	T	75.3	Confident	85.5	Confident	96 Å²	96	52.8 Å²	52.8	59%	0.589	28%	0.276	S	S	*	.			trans	-103.7	5.4	-177.4	55.6	0	0	0	0	113.8	K170 T205	K170-T207 WeakPolarHBondContact CE-O 3.4Å; K170-T207 PolarHBondContact NZ-O 2.93Å; T205-T207 PolarHBondContact O-N 3.28Å
208	Q	82.2	Confident	85.8	Confident	76 Å²	76	58.3 Å²	58.3	36%	0.355	30%	0.301	S	S	.	.	S	Bend	trans	-151.2	173.5	-172.1	-55.9	-171.2	30.9	0	0	110.7	F168 V206 V210	F168-Q208 WeakPolarHBondContact CD1-O 3.22Å; V206-Q208 WeakPolarHBondContact CG1-O 3.39Å; Q208-V210 PolarHBondContact O-N 3.23Å
209	D	88.1	Confident	86.3	Confident	27 Å²	27	56.2 Å²	56.2	14%	0.144	29%	0.29	C	S	.	.	S	Bend	trans	-69.6	117.1	174.8	-64.1	-11.5	0	0	0	110.3	F168 F169 K170 L176 M225	F168-D209 CarbonylContact O-C 3.51Å; F168-D209 WeakPolarHBondContact O-CA 3.43Å; F169-D209 WeakPolarHBondContact CA-OD1 3.47Å; F169-D209 HydrophobicContact CD1-CB 3.8Å; F169-D209 HydrophobicContact CE1-CB 4.35Å; K170-D209 PolarHBondContact N-OD1 2.83Å; L176-D209 HydrophobicContact CD1-CB 4.15Å; L176-D209 WeakPolarHBondContact CD1-OD2 3.3Å; D209-M225 HydrophobicContact CB-CB 4.49Å; D209-M225 PolarHBondContact O-N 3.04Å
210	V	91.1	Very high	86.8	Confident	10 Å²	10	53.7 Å²	53.7	6%	0.061	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.5	160.6	-173.4	-57.2	0	0	0	0	111.5	F168 V206 Q208 L212 T222 Y223	F168-V210 HydrophobicContact CB-CG2 4.13Å; F168-V210 PolarHBondContact N-O 3.19Å; F168-V210 PolarHBondContact O-N 2.83Å; V206-V210 HydrophobicContact CB-CG2 4.29Å; V206-V210 HydrophobicContact CG1-CB 4.39Å; V206-V210 HydrophobicContact CG1-CG1 4.25Å; V206-V210 HydrophobicContact CG1-CG2 3.26Å; V206-V210 HydrophobicContact CG2-CG2 3.99Å; Q208-V210 PolarHBondContact O-N 3.23Å; V210-L212 HydrophobicContact CG2-CD2 3.78Å; V210-L212 HydrophobicContact CG2-CG 4.14Å; V210-T222 HydrophobicContact CB-CG2 3.83Å; V210-T222 HydrophobicContact CG1-CG2 3.91Å; V210-T222 HydrophobicContact CG2-CG2 4.19Å; V210-Y223 CarbonylContact C-O 3.52Å; V210-Y223 WeakPolarHBondContact CA-O 3.39Å; V210-Y223 WeakPolarHBondContact CB-O 3.28Å
211	V	93.5	Very high	87.5	Confident	0 Å²	0	56.8 Å²	56.8	0%	0	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	126	166.1	175.7	0	0	0	0	108.3	V165 V166 F169 F180 L213 Y223 M225 L234	V165-V211 HydrophobicContact CG1-CG1 3.35Å; V166-V211 WeakPolarHBondContact O-CA 3.35Å; F169-V211 HydrophobicContact CZ-CG2 4.48Å; F180-V211 HydrophobicContact CD2-CG2 3.62Å; F180-V211 HydrophobicContact CE2-CG1 4.01Å; F180-V211 HydrophobicContact CE2-CG2 3.83Å; V211-L213 HydrophobicContact CG1-CD1 4.26Å; V211-Y223 PolarHBondContact N-O 2.63Å; V211-Y223 PolarHBondContact O-N 3Å; V211-M225 HydrophobicContact CG2-CG 3.89Å; V211-M225 HydrophobicContact CG2-SD 3.86Å; V211-L234 HydrophobicContact CB-CD1 4.16Å; V211-L234 HydrophobicContact CG1-CD1 4.19Å; V211-L234 HydrophobicContact CG2-CD1 4.04Å; V211-L234 HydrophobicContact CG2-CD2 4.38Å
212	L	93.4	Very high	88.3	Confident	0 Å²	0	57.5 Å²	57.5	0%	0	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	134.6	177.8	-53.1	177.4	0	0	0	109.4	V165 V166 Y204 V206 V210 L214 L219 T222	V165-L212 CarbonylContact C-O 3.5Å; V165-L212 WeakPolarHBondContact CA-O 3.41Å; V166-L212 HydrophobicContact CB-CB 4.4Å; V166-L212 PolarHBondContact N-O 3.36Å; V166-L212 PolarHBondContact O-N 3.42Å; Y204-L212 HydrophobicContact CD2-CD1 4.08Å; Y204-L212 HydrophobicContact CG-CD1 4.15Å; V206-L212 HydrophobicContact CG2-CD1 4.13Å; V206-L212 HydrophobicContact CG2-CD2 4.01Å; V210-L212 HydrophobicContact CG2-CD2 3.78Å; V210-L212 HydrophobicContact CG2-CG 4.14Å; L212-L214 HydrophobicContact CB-CD2 4.16Å; L212-L214 HydrophobicContact CB-CG 4.15Å; L212-L219 HydrophobicContact CB-CD1 4.17Å; L212-L219 HydrophobicContact CD2-CD1 3.97Å; L212-T222 HydrophobicContact CD2-CG2 3.83Å; L212-T222 WeakPolarHBondContact CD2-OG1 3.37Å
213	L	94.6	Very high	88.7	Confident	0 Å²	0	54.7 Å²	54.7	0%	0	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.5	119.6	164	-90.5	62.9	0	0	0	108.7	V165 V211 I220 Q221 F237 I238	V165-L213 HydrophobicContact CG1-CD1 4.22Å; V165-L213 HydrophobicContact CG2-CD1 4Å; V165-L213 HydrophobicContact CG2-CG 4.12Å; V211-L213 HydrophobicContact CG1-CD1 4.26Å; L213-I220 HydrophobicContact CB-CB 4.22Å; L213-I220 WeakPolarHBondContact O-CB 3.49Å; L213-I220 PolarHBondContact O-N 3.47Å; L213-Q221 PolarHBondContact N-O 3.25Å; L213-F237 HydrophobicContact CD1-CD1 4.25Å; L213-F237 HydrophobicContact CD1-CE1 3.47Å; L213-F237 VanDerWaalsContact CD1-CE1 3.47Å; L213-F237 HydrophobicContact CD1-CZ 4.25Å; L213-F237 HydrophobicContact CD2-CE1 4.42Å; L213-I238 HydrophobicContact CD1-CG1 4.13Å
214	L	92.5	Very high	88.9	Confident	1 Å²	1	57.2 Å²	57.2	1%	0.005	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	143.9	-176.8	-53.9	178	0	0	0	110	L157 L163 I164 V166 Y204 L212 Q218 L219	L157-L214 HydrophobicContact CD1-CD1 3.99Å; L157-L214 HydrophobicContact CD2-CD1 3.64Å; L157-L214 HydrophobicContact CG-CD1 4.13Å; L163-L214 WeakPolarHBondContact CA-O 3.38Å; I164-L214 HydrophobicContact CG2-CB 3.93Å; I164-L214 PolarHBondContact N-O 3.11Å; I164-L214 PolarHBondContact O-N 3.34Å; V166-L214 HydrophobicContact CB-CD1 4.47Å; V166-L214 HydrophobicContact CG2-CD1 3.87Å; Y204-L214 HydrophobicContact CD1-CD2 4.29Å; Y204-L214 HydrophobicContact CE1-CD2 3.78Å; Y204-L214 HydrophobicContact CE2-CD1 4.06Å; L212-L214 HydrophobicContact CB-CD2 4.16Å; L212-L214 HydrophobicContact CB-CG 4.15Å; L214-Q218 VanDerWaalsContact CA-O 3.3Å; L214-Q218 WeakPolarHBondContact CA-O 3.19Å; L214-L219 HydrophobicContact CD2-CB 4.05Å; L214-L219 HydrophobicContact CD2-CD1 3.68Å
215	K	90.8	Very high	89.1	Confident	101 Å²	101	56.5 Å²	56.5	44%	0.439	28%	0.281	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140	124	169.1	-175.5	175.4	-176.7	177.7	0	108	L163 S217 Q218 I220	L163-K215 HydrophobicContact CD1-CB 4.29Å; K215-S217 VanDerWaalsContact C-N 3.25Å; K215-S217 PolarHBondContact O-N 3.42Å; K215-Q218 PolarHBondContact N-O 3.42Å; K215-Q218 WeakPolarHBondContact O-CB 3.4Å; K215-Q218 PolarHBondContact O-N 2.94Å; K215-I220 HydrophobicContact CB-CD1 3.72Å; K215-I220 HydrophobicContact CB-CG1 4.41Å
216	K	88.3	Confident	89.3	Confident	137 Å²	137	55.5 Å²	55.5	60%	0.596	27%	0.266	S	S	*	.	T	Hydrogen-bonded Turn	trans	50.6	46	-174	-56.3	-177	175.8	-172.2	0	112.4	D161 Q218	D161-K216 VanDerWaalsContact O-CG 3.24Å; D161-K216 WeakPolarHBondContact O-CG 3.46Å; K216-Q218 PolarHBondContact O-N 2.92Å
217	S	84.1	Confident	89.6	Confident	28 Å²	28	60 Å²	60	20%	0.196	30%	0.296	C	S	.	.	T	Hydrogen-bonded Turn	trans	60.4	4.2	-174.9	-59.7	0	0	0	0	117.1	E158 Y204 K215	E158-S217 WeakPolarHBondContact CA-OG 3.37Å; Y204-S217 PolarHBondContact OH-O 3.29Å; K215-S217 VanDerWaalsContact C-N 3.25Å; K215-S217 PolarHBondContact O-N 3.42Å
218	Q	89.4	Confident	90.1	Very high	145 Å²	145	61.9 Å²	61.9	68%	0.678	30%	0.298	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-89.7	133.5	175.2	-63.3	-176	-9	0	0	110	L214 K215 K216 I220	L214-Q218 VanDerWaalsContact CA-O 3.3Å; L214-Q218 WeakPolarHBondContact CA-O 3.19Å; K215-Q218 PolarHBondContact N-O 3.42Å; K215-Q218 WeakPolarHBondContact O-CB 3.4Å; K215-Q218 PolarHBondContact O-N 2.94Å; K216-Q218 PolarHBondContact O-N 2.92Å; Q218-I220 PolarHBondContact O-N 2.87Å
219	L	91.8	Very high	90.4	Very high	74 Å²	74	58.8 Å²	58.8	39%	0.387	28%	0.284	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.2	116.8	175.3	-179.5	64.8	0	0	0	109.9	Y204 L212 L214	Y204-L219 HydrophobicContact CD1-CB 4.04Å; Y204-L219 HydrophobicContact CE1-CB 4.16Å; L212-L219 HydrophobicContact CB-CD1 4.17Å; L212-L219 HydrophobicContact CD2-CD1 3.97Å; L214-L219 HydrophobicContact CD2-CB 4.05Å; L214-L219 HydrophobicContact CD2-CD1 3.68Å
220	I	92.4	Very high	90.6	Very high	70 Å²	70	60.2 Å²	60.2	36%	0.359	30%	0.295	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.5	-54	172.1	-63.8	170.5	0	0	0	109	L163 L213 K215 Q218 Y241	L163-I220 HydrophobicContact CD1-CD1 3.47Å; L163-I220 VanDerWaalsContact CD1-CD1 3.47Å; L213-I220 HydrophobicContact CB-CB 4.22Å; L213-I220 WeakPolarHBondContact O-CB 3.49Å; L213-I220 PolarHBondContact O-N 3.47Å; K215-I220 HydrophobicContact CB-CD1 3.72Å; K215-I220 HydrophobicContact CB-CG1 4.41Å; Q218-I220 PolarHBondContact O-N 2.87Å; I220-Y241 HydrophobicContact CG2-CD1 4.32Å
221	Q	93.6	Very high	90.7	Very high	66 Å²	66	62.4 Å²	62.4	31%	0.308	30%	0.303	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-159.8	151.8	-179	-170.9	56.8	-77.7	0	0	112	L213 F237 Y241	L213-Q221 PolarHBondContact N-O 3.25Å; Q221-F237 HydrophobicContact CB-CE2 4.15Å; Q221-F237 HydrophobicContact CB-CZ 3.86Å; Q221-F237 HydrophobicContact CG-CE2 3.39Å; Q221-F237 HydrophobicContact CG-CZ 3.52Å; Q221-Y241 HydrophobicContact CB-CD1 3.62Å; Q221-Y241 HydrophobicContact CB-CD2 4.47Å; Q221-Y241 HydrophobicContact CB-CE1 3.84Å; Q221-Y241 HydrophobicContact CB-CG 3.96Å; Q221-Y241 HydrophobicContact CG-CD1 3.91Å; Q221-Y241 HydrophobicContact CG-CD2 4.23Å; Q221-Y241 HydrophobicContact CG-CE1 3.66Å; Q221-Y241 HydrophobicContact CG-CE2 4Å; Q221-Y241 HydrophobicContact CG-CG 4.19Å; Q221-Y241 PolarHBondContact NE2-OH 3.33Å
222	T	93.6	Very high	90.6	Very high	52 Å²	52	67.7 Å²	67.7	32%	0.319	33%	0.328	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	131.8	173.6	-59.5	0	0	0	0	110.3	V210 L212	V210-T222 HydrophobicContact CB-CG2 3.83Å; V210-T222 HydrophobicContact CG1-CG2 3.91Å; V210-T222 HydrophobicContact CG2-CG2 4.19Å; L212-T222 HydrophobicContact CD2-CG2 3.83Å; L212-T222 WeakPolarHBondContact CD2-OG1 3.37Å
223	Y	93.3	Very high	90.6	Very high	28 Å²	28	72.2 Å²	72.2	11%	0.11	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	124.6	169.5	-174.8	-86.7	0	0	0	110.1	V210 V211 M225 T229 E233 L234 F237	V210-Y223 CarbonylContact C-O 3.52Å; V210-Y223 WeakPolarHBondContact CA-O 3.39Å; V210-Y223 WeakPolarHBondContact CB-O 3.28Å; V211-Y223 PolarHBondContact N-O 2.63Å; V211-Y223 PolarHBondContact O-N 3Å; Y223-M225 HydrophobicContact CD1-CG 4.35Å; Y223-M225 HydrophobicContact CD1-SD 3.7Å; Y223-M225 HydrophobicContact CE1-SD 3.73Å; Y223-T229 HydrophobicContact CE1-CG2 3.71Å; Y223-T229 WeakPolarHBondContact OH-CG2 3.34Å; Y223-E233 HydrophobicContact CE2-CG 4.19Å; Y223-E233 WeakPolarHBondContact CE2-OE1 3.49Å; Y223-E233 PolarHBondContact OH-OE1 3.46Å; Y223-L234 HydrophobicContact CD1-CD1 4.05Å; Y223-L234 HydrophobicContact CG-CD1 4.33Å; Y223-F237 HydrophobicContact CD2-CB 4.09Å; Y223-F237 HydrophobicContact CD2-CD1 4.11Å; Y223-F237 AromaticContact CD2-CD2 3.71Å; Y223-F237 HydrophobicContact CD2-CD2 3.71Å; Y223-F237 HydrophobicContact CD2-CE2 4.16Å; Y223-F237 AromaticContact CD2-CG 3.7Å; Y223-F237 HydrophobicContact CD2-CG 3.7Å; Y223-F237 HydrophobicContact CG-CD1 4.1Å; Y223-F237 HydrophobicContact CG-CD2 4.38Å; Y223-F237 HydrophobicContact CG-CE1 4.29Å; Y223-F237 HydrophobicContact CG-CG 4.17Å
224	R	91.4	Very high	90.6	Very high	139 Å²	139	72.2 Å²	72.2	53%	0.525	35%	0.349	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.7	118.2	177.8	-177.4	179.8	179	-170.1	-0.1	109.8
225	M	89.1	Confident	90.6	Very high	10 Å²	10	73.4 Å²	73.4	5%	0.049	36%	0.356	C	S	.	.			trans	-78.7	141	177.6	-65.1	-67.9	-69.1	0	0	110.3	F169 L176 V179 D209 V211 Y223 T229 L234	F169-M225 HydrophobicContact CE1-CB 4.36Å; F169-M225 HydrophobicContact CE1-CG 4.02Å; F169-M225 HydrophobicContact CZ-CG 4.4Å; L176-M225 HydrophobicContact CD2-CB 4.42Å; L176-M225 HydrophobicContact CD2-CE 4.47Å; V179-M225 HydrophobicContact CB-CE 4.24Å; V179-M225 HydrophobicContact CG1-CE 3.98Å; D209-M225 HydrophobicContact CB-CB 4.49Å; D209-M225 PolarHBondContact O-N 3.04Å; V211-M225 HydrophobicContact CG2-CG 3.89Å; V211-M225 HydrophobicContact CG2-SD 3.86Å; Y223-M225 HydrophobicContact CD1-CG 4.35Å; Y223-M225 HydrophobicContact CD1-SD 3.7Å; Y223-M225 HydrophobicContact CE1-SD 3.73Å; M225-T229 HydrophobicContact CE-CG2 4.07Å; M225-T229 HydrophobicContact SD-CG2 4.02Å; M225-L234 HydrophobicContact CE-CD2 4.25Å; M225-L234 HydrophobicContact SD-CD1 4.3Å; M225-L234 HydrophobicContact SD-CD2 4.15Å
226	K	88.6	Confident	90.7	Very high	98 Å²	98	70.6 Å²	70.6	43%	0.426	35%	0.348	S	S	.	.			trans	-130.5	156.4	170.9	-57.5	-177.9	-171.2	170.1	0	109.1	L176 E228 T229	L176-K226 WeakPolarHBondContact CD2-O 3.44Å; K226-E228 HydrophobicContact CB-CG 4.37Å; K226-E228 WeakPolarHBondContact CD-OE1 3.27Å; K226-E228 PolarHBondContact O-N 2.9Å; K226-E228 VanDerWaalsContact O-N 3.1Å; K226-T229 PolarHBondContact N-OG1 3.33Å; K226-T229 VanDerWaalsContact O-CB 3.22Å; K226-T229 WeakPolarHBondContact O-CB 3.44Å; K226-T229 PolarHBondContact O-N 3.47Å; K226-T229 PolarHBondContact O-OG1 2.94Å
227	P	84	Confident	91.1	Very high	102 Å²	102	64.4 Å²	64.4	66%	0.662	32%	0.321	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.6	-33.6	178.6	-28.4	36.6	0	0	0	113.8
228	E	87.2	Confident	91.6	Very high	136 Å²	136	63 Å²	63	64%	0.636	31%	0.311	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.6	0.8	178.1	67.9	-85.5	-166.6	0	0	115.1	K226 P230	K226-E228 HydrophobicContact CB-CG 4.37Å; K226-E228 WeakPolarHBondContact CD-OE1 3.27Å; K226-E228 PolarHBondContact O-N 2.9Å; K226-E228 VanDerWaalsContact O-N 3.1Å; E228-P230 VanDerWaalsContact O-CD 3.24Å; E228-P230 WeakPolarHBondContact O-CD 3.5Å
229	T	88.8	Confident	91.7	Very high	10 Å²	10	56.7 Å²	56.7	6%	0.061	28%	0.283	C	S	.	.			trans	-61.7	116.7	-179.3	-70.9	0	0	0	0	110.1	Y223 M225 K226	Y223-T229 HydrophobicContact CE1-CG2 3.71Å; Y223-T229 WeakPolarHBondContact OH-CG2 3.34Å; M225-T229 HydrophobicContact CE-CG2 4.07Å; M225-T229 HydrophobicContact SD-CG2 4.02Å; K226-T229 PolarHBondContact N-OG1 3.33Å; K226-T229 VanDerWaalsContact O-CB 3.22Å; K226-T229 WeakPolarHBondContact O-CB 3.44Å; K226-T229 PolarHBondContact O-N 3.47Å; K226-T229 PolarHBondContact O-OG1 2.94Å
230	P	92.3	Very high	91.8	Very high	57 Å²	57	53.3 Å²	53.3	37%	0.37	27%	0.266	S	S	.	.			trans	-75.9	145.3	174.8	31.1	-31.3	0	0	0	110.1	E228 E232 E233 L234	E228-P230 VanDerWaalsContact O-CD 3.24Å; E228-P230 WeakPolarHBondContact O-CD 3.5Å; P230-E232 PolarHBondContact O-N 3.36Å; P230-E233 HydrophobicContact CG-CB 3.74Å; P230-E233 PolarHBondContact O-N 3.35Å; P230-E233 VanDerWaalsContact O-N 3.16Å; P230-L234 PolarHBondContact O-N 2.83Å
231	K	92.3	Very high	91.8	Very high	56 Å²	56	51.5 Å²	51.5	24%	0.243	25%	0.254	C	S	.	.	H	α-helix	trans	-54.7	-39.9	176.3	178.9	-159	64.3	167.1	0	111.5	V179 A182 A183 D186 E233 L234 V235	V179-K231 HydrophobicContact CG1-CB 4.26Å; A182-K231 HydrophobicContact CB-CD 3.58Å; A182-K231 HydrophobicContact CB-CG 4Å; A183-K231 HydrophobicContact CB-CG 4.16Å; D186-K231 VanDerWaalsContact OD2-CE 3.27Å; D186-K231 WeakPolarHBondContact OD2-CE 3.32Å; D186-K231 IonicContact OD2-NZ 3.53Å; D186-K231 PolarHBondContact OD2-NZ 2.94Å; K231-E233 VanDerWaalsContact C-N 3.29Å; K231-E233 PolarHBondContact O-N 3.28Å; K231-L234 PolarHBondContact O-N 3.27Å; K231-L234 VanDerWaalsContact O-N 3.16Å; K231-V235 HydrophobicContact CG-CG2 4.31Å; K231-V235 WeakPolarHBondContact O-CG2 3.42Å; K231-V235 PolarHBondContact O-N 3.44Å
232	E	91.9	Very high	91.7	Very high	112 Å²	112	51 Å²	51	52%	0.523	25%	0.252	S	S	.	.	H	α-helix	trans	-60.5	-38.4	-178.1	-68	66.2	-145.8	0	0	111.7	P230 V235 V236	P230-E232 PolarHBondContact O-N 3.36Å; E232-V235 PolarHBondContact O-N 3.17Å; E232-V236 WeakPolarHBondContact O-CB 3.48Å; E232-V236 WeakPolarHBondContact O-CG2 3.5Å; E232-V236 PolarHBondContact O-N 2.85Å
233	E	92.8	Very high	91.6	Very high	95 Å²	95	48.9 Å²	48.9	44%	0.444	24%	0.239	S	C	.	.	H	α-helix	trans	-67.1	-40.7	177	-174.9	-178.2	155	0	0	111.2	Y223 P230 K231 V236 F237	Y223-E233 HydrophobicContact CE2-CG 4.19Å; Y223-E233 WeakPolarHBondContact CE2-OE1 3.49Å; Y223-E233 PolarHBondContact OH-OE1 3.46Å; P230-E233 HydrophobicContact CG-CB 3.74Å; P230-E233 PolarHBondContact O-N 3.35Å; P230-E233 VanDerWaalsContact O-N 3.16Å; K231-E233 VanDerWaalsContact C-N 3.29Å; K231-E233 PolarHBondContact O-N 3.28Å; E233-V236 PolarHBondContact O-N 3.45Å; E233-F237 VanDerWaalsContact O-CB 3.32Å; E233-F237 WeakPolarHBondContact O-CB 3.47Å; E233-F237 PolarHBondContact O-N 3Å
234	L	94.2	Very high	91.6	Very high	0 Å²	0	52.7 Å²	52.7	0%	0	26%	0.261	C	S	.	.	H	α-helix	trans	-65.4	-41.9	176.2	-176.1	60	0	0	0	111.6	F180 A183 V211 Y223 M225 P230 K231 F237 I238	F180-L234 HydrophobicContact CD2-CD2 4.29Å; A183-L234 HydrophobicContact CB-CB 4.41Å; A183-L234 HydrophobicContact CB-CD2 3.74Å; A183-L234 HydrophobicContact CB-CG 4.05Å; V211-L234 HydrophobicContact CB-CD1 4.16Å; V211-L234 HydrophobicContact CG1-CD1 4.19Å; V211-L234 HydrophobicContact CG2-CD1 4.04Å; V211-L234 HydrophobicContact CG2-CD2 4.38Å; Y223-L234 HydrophobicContact CD1-CD1 4.05Å; Y223-L234 HydrophobicContact CG-CD1 4.33Å; M225-L234 HydrophobicContact CE-CD2 4.25Å; M225-L234 HydrophobicContact SD-CD1 4.3Å; M225-L234 HydrophobicContact SD-CD2 4.15Å; P230-L234 PolarHBondContact O-N 2.83Å; K231-L234 PolarHBondContact O-N 3.27Å; K231-L234 VanDerWaalsContact O-N 3.16Å; L234-F237 HydrophobicContact CD1-CD1 4.23Å; L234-F237 WeakPolarHBondContact O-CB 3.23Å; L234-F237 PolarHBondContact O-N 2.95Å; L234-I238 HydrophobicContact CD1-CD1 4.05Å; L234-I238 HydrophobicContact CD1-CG1 4.28Å; L234-I238 HydrophobicContact CG-CD1 3.9Å; L234-I238 VanDerWaalsContact O-CG1 3.27Å; L234-I238 WeakPolarHBondContact O-CG1 3.32Å; L234-I238 PolarHBondContact O-N 3.32Å
235	V	93.4	Very high	91.8	Very high	25 Å²	25	47.1 Å²	47.1	15%	0.152	24%	0.243	C	C	.	.	H	α-helix	trans	-62.2	-44.2	175.3	170.7	0	0	0	0	111.1	A183 D186 L187 K231 E232 I238 S239	A183-V235 HydrophobicContact CB-CG2 3.84Å; D186-V235 HydrophobicContact CB-CG2 4.18Å; L187-V235 HydrophobicContact CD1-CG1 4.32Å; L187-V235 HydrophobicContact CD1-CG2 4.37Å; L187-V235 HydrophobicContact CD2-CG1 4.27Å; L187-V235 HydrophobicContact CG-CG1 4.31Å; K231-V235 HydrophobicContact CG-CG2 4.31Å; K231-V235 WeakPolarHBondContact O-CG2 3.42Å; K231-V235 PolarHBondContact O-N 3.44Å; E232-V235 PolarHBondContact O-N 3.17Å; V235-I238 PolarHBondContact O-N 2.93Å; V235-S239 WeakPolarHBondContact O-CB 3.16Å; V235-S239 PolarHBondContact O-N 3.19Å; V235-S239 PolarHBondContact O-OG 3.06Å
236	V	93.2	Very high	92.2	Very high	43 Å²	43	47 Å²	47	26%	0.261	24%	0.243	S	C	.	.	H	α-helix	trans	-59.8	-48.3	174.7	171.5	0	0	0	0	110.9	E232 E233 S239 V240 P261 V262 L293	E232-V236 WeakPolarHBondContact O-CB 3.48Å; E232-V236 WeakPolarHBondContact O-CG2 3.5Å; E232-V236 PolarHBondContact O-N 2.85Å; E233-V236 PolarHBondContact O-N 3.45Å; V236-S239 PolarHBondContact O-N 3.37Å; V236-V240 HydrophobicContact CG1-CG2 4.42Å; V236-V240 WeakPolarHBondContact O-CB 3.38Å; V236-V240 VanDerWaalsContact O-CG2 3.27Å; V236-V240 WeakPolarHBondContact O-CG2 3.36Å; V236-V240 PolarHBondContact O-N 2.67Å; V236-P261 HydrophobicContact CB-CG 4.12Å; V236-P261 HydrophobicContact CG1-CG 4.21Å; V236-P261 HydrophobicContact CG2-CB 3.8Å; V236-P261 HydrophobicContact CG2-CG 3.74Å; V236-V262 HydrophobicContact CG1-CG2 4.49Å; V236-L293 HydrophobicContact CG1-CD2 4.18Å
237	F	95.3	Very high	92.6	Very high	6 Å²	6	42.9 Å²	42.9	3%	0.026	23%	0.225	C	C	.	.	H	α-helix	trans	-55.3	-54.8	177.8	169.4	-98.1	0	0	0	111.3	L213 Q221 Y223 E233 L234 S239 V240 Y241	L213-F237 HydrophobicContact CD1-CD1 4.25Å; L213-F237 HydrophobicContact CD1-CE1 3.47Å; L213-F237 VanDerWaalsContact CD1-CE1 3.47Å; L213-F237 HydrophobicContact CD1-CZ 4.25Å; L213-F237 HydrophobicContact CD2-CE1 4.42Å; Q221-F237 HydrophobicContact CB-CE2 4.15Å; Q221-F237 HydrophobicContact CB-CZ 3.86Å; Q221-F237 HydrophobicContact CG-CE2 3.39Å; Q221-F237 HydrophobicContact CG-CZ 3.52Å; Y223-F237 HydrophobicContact CD2-CB 4.09Å; Y223-F237 HydrophobicContact CD2-CD1 4.11Å; Y223-F237 AromaticContact CD2-CD2 3.71Å; Y223-F237 HydrophobicContact CD2-CD2 3.71Å; Y223-F237 HydrophobicContact CD2-CE2 4.16Å; Y223-F237 AromaticContact CD2-CG 3.7Å; Y223-F237 HydrophobicContact CD2-CG 3.7Å; Y223-F237 HydrophobicContact CG-CD1 4.1Å; Y223-F237 HydrophobicContact CG-CD2 4.38Å; Y223-F237 HydrophobicContact CG-CE1 4.29Å; Y223-F237 HydrophobicContact CG-CG 4.17Å; E233-F237 VanDerWaalsContact O-CB 3.32Å; E233-F237 WeakPolarHBondContact O-CB 3.47Å; E233-F237 PolarHBondContact O-N 3Å; L234-F237 HydrophobicContact CD1-CD1 4.23Å; L234-F237 WeakPolarHBondContact O-CB 3.23Å; L234-F237 PolarHBondContact O-N 2.95Å; F237-S239 VanDerWaalsContact C-N 3.35Å; F237-S239 PolarHBondContact O-N 3.4Å; F237-V240 PolarHBondContact O-N 2.91Å; F237-Y241 AromaticContact CD2-CD2 3.41Å; F237-Y241 HydrophobicContact CD2-CD2 3.41Å; F237-Y241 VanDerWaalsContact CD2-CD2 3.41Å; F237-Y241 AromaticContact CD2-CE2 3.52Å; F237-Y241 HydrophobicContact CD2-CE2 3.52Å; F237-Y241 AromaticContact CE2-CD2 3.35Å; F237-Y241 HydrophobicContact CE2-CD2 3.35Å; F237-Y241 AromaticContact CE2-CE2 3.44Å; F237-Y241 HydrophobicContact CE2-CE2 3.44Å; F237-Y241 VanDerWaalsContact CE2-CE2 3.44Å; F237-Y241 HydrophobicContact CE2-CG 4.16Å; F237-Y241 HydrophobicContact CG-CD2 4.18Å; F237-Y241 HydrophobicContact CZ-CD2 4.07Å; F237-Y241 HydrophobicContact CZ-CE2 4.49Å; F237-Y241 WeakPolarHBondContact O-CD2 3.42Å; F237-Y241 PolarHBondContact O-N 3.24Å
238	I	94.7	Very high	93.3	Very high	0 Å²	0	40.7 Å²	40.7	0%	0	21%	0.207	C	C	.	.	H	α-helix	trans	-61.7	-45.4	-179	-62.8	164.5	0	0	0	110.5	V165 L187 V190 F192 L213 L234 V235 V240 Y241 Q242	V165-I238 HydrophobicContact CG1-CD1 3.96Å; V165-I238 HydrophobicContact CG1-CG1 4.38Å; V165-I238 HydrophobicContact CG2-CD1 4.31Å; V165-I238 HydrophobicContact CG2-CG1 4.28Å; V165-I238 HydrophobicContact CG2-CG2 3.71Å; L187-I238 HydrophobicContact CD1-CB 3.75Å; L187-I238 HydrophobicContact CD1-CD1 3.91Å; L187-I238 HydrophobicContact CD1-CG1 4.44Å; L187-I238 HydrophobicContact CD1-CG2 3.66Å; V190-I238 HydrophobicContact CG1-CG2 4.37Å; F192-I238 HydrophobicContact CE1-CD1 3.74Å; F192-I238 HydrophobicContact CZ-CD1 3.61Å; L213-I238 HydrophobicContact CD1-CG1 4.13Å; L234-I238 HydrophobicContact CD1-CD1 4.05Å; L234-I238 HydrophobicContact CD1-CG1 4.28Å; L234-I238 HydrophobicContact CG-CD1 3.9Å; L234-I238 VanDerWaalsContact O-CG1 3.27Å; L234-I238 WeakPolarHBondContact O-CG1 3.32Å; L234-I238 PolarHBondContact O-N 3.32Å; V235-I238 PolarHBondContact O-N 2.93Å; I238-V240 PolarHBondContact O-N 3.09Å; I238-Y241 PolarHBondContact O-N 3.4Å; I238-Q242 WeakPolarHBondContact O-CB 3.33Å; I238-Q242 WeakPolarHBondContact O-CG 3.38Å; I238-Q242 PolarHBondContact O-N 3.04Å
239	S	92.3	Very high	93.8	Very high	12 Å²	12	36.7 Å²	36.7	8%	0.084	19%	0.186	C	C	.	.	H	α-helix	trans	-63.8	-28.2	-177.3	-60.4	0	0	0	0	113.6	V235 V236 F237 Q242 M243	V235-S239 WeakPolarHBondContact O-CB 3.16Å; V235-S239 PolarHBondContact O-N 3.19Å; V235-S239 PolarHBondContact O-OG 3.06Å; V236-S239 PolarHBondContact O-N 3.37Å; F237-S239 VanDerWaalsContact C-N 3.35Å; F237-S239 PolarHBondContact O-N 3.4Å; S239-Q242 WeakPolarHBondContact O-CG 3.28Å; S239-Q242 PolarHBondContact O-NE2 3.19Å; S239-M243 WeakPolarHBondContact O-CE 3.47Å
240	V	92.9	Very high	94	Very high	3 Å²	3	38.2 Å²	38.2	2%	0.018	19%	0.194	C	C	.	.	H	α-helix	trans	-85.7	-44.4	177.1	171	0	0	0	0	110.9	V236 F237 I238 Q242 M243 V262 R292 L293	V236-V240 HydrophobicContact CG1-CG2 4.42Å; V236-V240 WeakPolarHBondContact O-CB 3.38Å; V236-V240 VanDerWaalsContact O-CG2 3.27Å; V236-V240 WeakPolarHBondContact O-CG2 3.36Å; V236-V240 PolarHBondContact O-N 2.67Å; F237-V240 PolarHBondContact O-N 2.91Å; I238-V240 PolarHBondContact O-N 3.09Å; V240-Q242 VanDerWaalsContact C-N 3.33Å; V240-Q242 PolarHBondContact O-N 2.73Å; V240-M243 WeakPolarHBondContact O-CB 3.44Å; V240-M243 PolarHBondContact O-N 3.5Å; V240-M243 VanDerWaalsContact O-N 3.08Å; V240-V262 HydrophobicContact CG2-CG2 3.41Å; V240-V262 VanDerWaalsContact CG2-CG2 3.41Å; V240-R292 PolarHBondContact O-NH2 2.88Å; V240-L293 HydrophobicContact CB-CD2 3.74Å; V240-L293 HydrophobicContact CG1-CD2 3.89Å; V240-L293 HydrophobicContact CG2-CD2 3.98Å
241	Y	93.8	Very high	93.7	Very high	32 Å²	32	38.8 Å²	38.8	13%	0.125	21%	0.21	C	C	.	.	H	α-helix	trans	-78	-11	-177.1	-77	-80.9	0	0	0	115.3	I220 Q221 F237 I238 M243 R292 L293	I220-Y241 HydrophobicContact CG2-CD1 4.32Å; Q221-Y241 HydrophobicContact CB-CD1 3.62Å; Q221-Y241 HydrophobicContact CB-CD2 4.47Å; Q221-Y241 HydrophobicContact CB-CE1 3.84Å; Q221-Y241 HydrophobicContact CB-CG 3.96Å; Q221-Y241 HydrophobicContact CG-CD1 3.91Å; Q221-Y241 HydrophobicContact CG-CD2 4.23Å; Q221-Y241 HydrophobicContact CG-CE1 3.66Å; Q221-Y241 HydrophobicContact CG-CE2 4Å; Q221-Y241 HydrophobicContact CG-CG 4.19Å; Q221-Y241 PolarHBondContact NE2-OH 3.33Å; F237-Y241 AromaticContact CD2-CD2 3.41Å; F237-Y241 HydrophobicContact CD2-CD2 3.41Å; F237-Y241 VanDerWaalsContact CD2-CD2 3.41Å; F237-Y241 AromaticContact CD2-CE2 3.52Å; F237-Y241 HydrophobicContact CD2-CE2 3.52Å; F237-Y241 AromaticContact CE2-CD2 3.35Å; F237-Y241 HydrophobicContact CE2-CD2 3.35Å; F237-Y241 AromaticContact CE2-CE2 3.44Å; F237-Y241 HydrophobicContact CE2-CE2 3.44Å; F237-Y241 VanDerWaalsContact CE2-CE2 3.44Å; F237-Y241 HydrophobicContact CE2-CG 4.16Å; F237-Y241 HydrophobicContact CG-CD2 4.18Å; F237-Y241 HydrophobicContact CZ-CD2 4.07Å; F237-Y241 HydrophobicContact CZ-CE2 4.49Å; F237-Y241 WeakPolarHBondContact O-CD2 3.42Å; F237-Y241 PolarHBondContact O-N 3.24Å; I238-Y241 PolarHBondContact O-N 3.4Å; Y241-M243 PolarHBondContact O-N 3.38Å; Y241-R292 VanDerWaalsContact CA-NH2 3.31Å; Y241-L293 HydrophobicContact CD2-CD2 4.27Å; Y241-L293 HydrophobicContact CE2-CD1 4.22Å; Y241-L293 HydrophobicContact CE2-CD2 3.96Å; Y241-L293 HydrophobicContact CE2-CG 4.1Å
242	Q	91.3	Very high	93.5	Very high	56 Å²	56	44.6 Å²	44.6	26%	0.262	24%	0.238	S	C	.	.	T	Hydrogen-bonded Turn	trans	-69.1	-20.2	162.7	61.9	174.9	1.7	0	0	113.5	L163 I238 S239 V240 Q256	L163-Q242 HydrophobicContact CD2-CB 3.39Å; I238-Q242 WeakPolarHBondContact O-CB 3.33Å; I238-Q242 WeakPolarHBondContact O-CG 3.38Å; I238-Q242 PolarHBondContact O-N 3.04Å; S239-Q242 WeakPolarHBondContact O-CG 3.28Å; S239-Q242 PolarHBondContact O-NE2 3.19Å; V240-Q242 VanDerWaalsContact C-N 3.33Å; V240-Q242 PolarHBondContact O-N 2.73Å; Q242-Q256 VanDerWaalsContact CG-NE2 3.35Å; Q242-Q256 VanDerWaalsContact NE2-NE2 3.11Å
243	M	91.3	Very high	93.5	Very high	7 Å²	7	40.5 Å²	40.5	3%	0.034	22%	0.22	C	C	.	.	S	Bend	trans	-98.4	144.3	178.6	-68.6	-175	-68.1	0	0	110.3	S239 V240 Y241 Q256 R292 L296	S239-M243 WeakPolarHBondContact O-CE 3.47Å; V240-M243 WeakPolarHBondContact O-CB 3.44Å; V240-M243 PolarHBondContact O-N 3.5Å; V240-M243 VanDerWaalsContact O-N 3.08Å; Y241-M243 PolarHBondContact O-N 3.38Å; M243-Q256 VanDerWaalsContact CG-CD 3.4Å; M243-Q256 HydrophobicContact CG-CG 3.94Å; M243-Q256 HydrophobicContact SD-CG 3.81Å; M243-R292 PolarHBondContact O-NH1 3.37Å; M243-R292 PolarHBondContact O-NH2 3.4Å; M243-R292 VanDerWaalsContact O-NH2 3.09Å; M243-L296 HydrophobicContact CE-CD1 3.42Å; M243-L296 VanDerWaalsContact CE-CD1 3.42Å; M243-L296 HydrophobicContact CE-CD2 4.18Å; M243-L296 HydrophobicContact CE-CG 4.47Å; M243-L296 HydrophobicContact SD-CD1 4.2Å
244	D	93.1	Very high	93.4	Very high	107 Å²	107	36.6 Å²	36.6	57%	0.572	21%	0.205	S	C	*	.			trans	-57.6	154	169.7	-64.8	-30.9	0	0	0	110.2	V246 T247 R292	D244-V246 PolarHBondContact O-N 3.29Å; D244-V246 VanDerWaalsContact O-N 3.1Å; D244-T247 PolarHBondContact O-OG1 3.22Å; D244-R292 PolarHBondContact O-NH1 3.35Å
245	P	95.4	Very high	92.9	Very high	22 Å²	22	38.7 Å²	38.7	14%	0.143	22%	0.219	C	C	.	.	S	Bend	trans	-50.1	-38.6	178.6	-28.6	35.8	0	0	0	112.8	A288 E289 F297	P245-A288 HydrophobicContact CB-CB 4.09Å; P245-A288 WeakPolarHBondContact O-CB 3.39Å; P245-E289 WeakPolarHBondContact CG-OE1 3.29Å; P245-F297 WeakPolarHBondContact O-CB 3.44Å
246	V	97.9	Very high	92.6	Very high	9 Å²	9	40.4 Å²	40.4	6%	0.055	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	119.6	169	179.5	0	0	0	0	108.9	D244 F281 F284 H285 A288 F297 L299	D244-V246 PolarHBondContact O-N 3.29Å; D244-V246 VanDerWaalsContact O-N 3.1Å; V246-F281 HydrophobicContact CB-CE2 4.11Å; V246-F281 HydrophobicContact CB-CZ 4.45Å; V246-F281 HydrophobicContact CG1-CE2 3.84Å; V246-F284 HydrophobicContact CB-CD1 4.48Å; V246-F284 HydrophobicContact CG1-CD1 3.86Å; V246-F284 HydrophobicContact CG1-CE1 3.91Å; V246-F284 HydrophobicContact CG2-CD1 3.71Å; V246-F284 HydrophobicContact CG2-CE1 4.12Å; V246-H285 HydrophobicContact CG2-CB 4.06Å; V246-A288 HydrophobicContact CG2-CB 3.95Å; V246-F297 WeakPolarHBondContact CA-O 3.21Å; V246-F297 HydrophobicContact CG2-CB 4.05Å; V246-L299 HydrophobicContact CG1-CB 3.87Å
247	T	97.4	Very high	92.6	Very high	10 Å²	10	38.6 Å²	38.6	6%	0.061	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	125.4	177.8	-56.4	0	0	0	0	110.3	D244 T253 I257 F297 V298 L299	D244-T247 PolarHBondContact O-OG1 3.22Å; T247-T253 HydrophobicContact CG2-CG2 3.87Å; T247-I257 HydrophobicContact CG2-CD1 3.95Å; T247-I257 HydrophobicContact CG2-CG1 4.02Å; T247-F297 PolarHBondContact N-O 2.95Å; T247-V298 CarbonylContact O-C 3.56Å; T247-V298 VanDerWaalsContact O-CA 3.28Å; T247-V298 WeakPolarHBondContact O-CA 3.44Å; T247-L299 PolarHBondContact O-N 2.93Å
248	E	97.8	Very high	92.2	Very high	57 Å²	57	43.4 Å²	43.4	27%	0.266	24%	0.24	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.1	132.7	174.6	176.1	167.6	-163.8	0	0	110.3	N250 T253 K272 L299	E248-N250 PolarHBondContact O-N 3.43Å; E248-T253 WeakPolarHBondContact O-CB 3.49Å; E248-T253 PolarHBondContact O-OG1 3.37Å; E248-K272 WeakPolarHBondContact OE1-CD 3Å; E248-K272 IonicContact OE1-NZ 3.09Å; E248-K272 PolarHBondContact OE1-NZ 3.39Å; E248-K272 IonicContact OE2-NZ 2.72Å; E248-K272 PolarHBondContact OE2-NZ 3.06Å; E248-L299 CarbonylContact C-O 3.5Å; E248-L299 WeakPolarHBondContact CA-O 3.28Å; E248-L299 HydrophobicContact CB-CB 4.45Å; E248-L299 HydrophobicContact CB-CD2 4.05Å; E248-L299 HydrophobicContact CG-CD2 3.7Å
249	Y	97.3	Very high	91.7	Very high	52 Å²	52	46.3 Å²	46.3	20%	0.204	27%	0.27	C	S	.	.			trans	-76.9	112.6	171.3	-179.9	-91.4	0	0	0	110.2	A254 I257 L299 N307 L310	Y249-A254 HydrophobicContact CD2-CB 4.03Å; Y249-A254 HydrophobicContact CE2-CB 3.51Å; Y249-I257 HydrophobicContact CD2-CD1 4.12Å; Y249-L299 PolarHBondContact N-O 3.02Å; Y249-N307 WeakPolarHBondContact CD1-OD1 3.49Å; Y249-L310 HydrophobicContact CD1-CD2 3.63Å; Y249-L310 HydrophobicContact CD2-CD2 4.34Å; Y249-L310 HydrophobicContact CE1-CD2 3.85Å; Y249-L310 HydrophobicContact CG-CD2 3.89Å
250	N	94.1	Very high	91.6	Very high	41 Å²	41	46.2 Å²	46.2	22%	0.219	27%	0.269	C	S	.	.	S	Bend	trans	-152.1	-177.8	176.7	65	51.8	0	0	0	110.7	E248 Q252 T253 A254	E248-N250 PolarHBondContact O-N 3.43Å; N250-Q252 PolarHBondContact O-N 3.48Å; N250-Q252 VanDerWaalsContact O-N 3.07Å; N250-Q252 WeakPolarHBondContact OD1-CA 3.4Å; N250-Q252 WeakPolarHBondContact OD1-CB 3.19Å; N250-Q252 PolarHBondContact OD1-N 2.91Å; N250-T253 PolarHBondContact N-OG1 2.87Å; N250-T253 PolarHBondContact O-N 2.93Å; N250-T253 PolarHBondContact OD1-N 3.46Å; N250-T253 PolarHBondContact OD1-OG1 3.04Å; N250-A254 WeakPolarHBondContact O-CB 3.43Å; N250-A254 PolarHBondContact O-N 2.46Å
251	G	86.8	Confident	91.4	Very high	69 Å²	69	48.5 Å²	48.5	71%	0.711	28%	0.284	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.8	-13.6	-177.3	0	0	0	0	0	116.1
252	Q	88	Confident	91.4	Very high	178 Å²	178	47.4 Å²	47.4	83%	0.832	28%	0.281	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.2	-39.1	178.5	-61.2	177.1	-11.2	0	0	112	N250	N250-Q252 PolarHBondContact O-N 3.48Å; N250-Q252 VanDerWaalsContact O-N 3.07Å; N250-Q252 WeakPolarHBondContact OD1-CA 3.4Å; N250-Q252 WeakPolarHBondContact OD1-CB 3.19Å; N250-Q252 PolarHBondContact OD1-N 2.91Å
253	T	91.6	Very high	91.5	Very high	26 Å²	26	48.4 Å²	48.4	16%	0.16	29%	0.288	C	S	.	.	T	Hydrogen-bonded Turn	trans	-99.7	-15.1	-172	52.6	0	0	0	0	113.7	T247 E248 N250 S255 Q256 I257	T247-T253 HydrophobicContact CG2-CG2 3.87Å; E248-T253 WeakPolarHBondContact O-CB 3.49Å; E248-T253 PolarHBondContact O-OG1 3.37Å; N250-T253 PolarHBondContact N-OG1 2.87Å; N250-T253 PolarHBondContact O-N 2.93Å; N250-T253 PolarHBondContact OD1-N 3.46Å; N250-T253 PolarHBondContact OD1-OG1 3.04Å; T253-S255 VanDerWaalsContact C-N 3.34Å; T253-S255 PolarHBondContact O-N 2.79Å; T253-Q256 WeakPolarHBondContact O-CB 3.47Å; T253-Q256 PolarHBondContact O-N 2.95Å; T253-I257 WeakPolarHBondContact O-CG1 3.39Å; T253-I257 PolarHBondContact O-N 2.84Å
254	A	89.6	Confident	91.8	Very high	14 Å²	14	49.5 Å²	49.5	12%	0.116	29%	0.294	C	S	.	.	H	α-helix	trans	-54.9	-45.8	-175.4	0	0	0	0	0	112.9	Y249 N250 Q256 I257 L258	Y249-A254 HydrophobicContact CD2-CB 4.03Å; Y249-A254 HydrophobicContact CE2-CB 3.51Å; N250-A254 WeakPolarHBondContact O-CB 3.43Å; N250-A254 PolarHBondContact O-N 2.46Å; A254-Q256 VanDerWaalsContact C-N 3.28Å; A254-Q256 PolarHBondContact O-N 2.74Å; A254-I257 PolarHBondContact O-N 3.32Å; A254-L258 WeakPolarHBondContact O-CB 3.48Å; A254-L258 VanDerWaalsContact O-CG 3.24Å; A254-L258 WeakPolarHBondContact O-CG 3.36Å; A254-L258 PolarHBondContact O-N 2.87Å
255	S	83.9	Confident	92	Very high	44 Å²	44	44.8 Å²	44.8	31%	0.308	27%	0.268	S	S	.	.	H	α-helix	trans	-63.5	-35	178.9	-58.4	0	0	0	0	112.4	T253 G259	T253-S255 VanDerWaalsContact C-N 3.34Å; T253-S255 PolarHBondContact O-N 2.79Å; S255-G259 PolarHBondContact O-N 3.33Å
256	Q	87.3	Confident	92.2	Very high	61 Å²	61	43.7 Å²	43.7	29%	0.285	26%	0.261	S	S	.	.	H	α-helix	trans	-71.5	-42.3	177.7	-168.9	-177.8	22.8	0	0	111.7	Q242 M243 T253 A254 S260	Q242-Q256 VanDerWaalsContact CG-NE2 3.35Å; Q242-Q256 VanDerWaalsContact NE2-NE2 3.11Å; M243-Q256 VanDerWaalsContact CG-CD 3.4Å; M243-Q256 HydrophobicContact CG-CG 3.94Å; M243-Q256 HydrophobicContact SD-CG 3.81Å; T253-Q256 WeakPolarHBondContact O-CB 3.47Å; T253-Q256 PolarHBondContact O-N 2.95Å; A254-Q256 VanDerWaalsContact C-N 3.28Å; A254-Q256 PolarHBondContact O-N 2.74Å; Q256-S260 PolarHBondContact O-N 2.98Å; Q256-S260 VanDerWaalsContact O-N 3.11Å
257	I	92.7	Very high	92.2	Very high	4 Å²	4	43.7 Å²	43.7	2%	0.021	26%	0.261	C	S	.	.	H	α-helix	trans	-62.6	-50.9	176.1	-68	162.3	0	0	0	110.1	T247 Y249 T253 A254 G259 S260 H265 L296 V298	T247-I257 HydrophobicContact CG2-CD1 3.95Å; T247-I257 HydrophobicContact CG2-CG1 4.02Å; Y249-I257 HydrophobicContact CD2-CD1 4.12Å; T253-I257 WeakPolarHBondContact O-CG1 3.39Å; T253-I257 PolarHBondContact O-N 2.84Å; A254-I257 PolarHBondContact O-N 3.32Å; I257-G259 VanDerWaalsContact C-N 3.32Å; I257-G259 PolarHBondContact O-N 2.94Å; I257-S260 WeakPolarHBondContact O-CB 3.35Å; I257-S260 PolarHBondContact O-N 2.81Å; I257-H265 PolarHBondContact O-CE1 3.35Å; I257-L296 HydrophobicContact CG2-CD2 4.05Å; I257-V298 HydrophobicContact CD1-CG1 4.04Å; I257-V298 HydrophobicContact CG2-CG1 4.45Å; I257-V298 HydrophobicContact CG2-CG2 3.76Å
258	L	87.6	Confident	92.2	Very high	107 Å²	107	43.2 Å²	43.2	56%	0.56	26%	0.258	S	S	*	.	H	α-helix	trans	-70.6	-28.7	-177.1	-65.4	174.1	0	0	0	112.8	A254 S260	A254-L258 WeakPolarHBondContact O-CB 3.48Å; A254-L258 VanDerWaalsContact O-CG 3.24Å; A254-L258 WeakPolarHBondContact O-CG 3.36Å; A254-L258 PolarHBondContact O-N 2.87Å; L258-S260 VanDerWaalsContact C-N 3.31Å
259	G	84.3	Confident	92.2	Very high	62 Å²	62	40.5 Å²	40.5	64%	0.639	25%	0.245	S	C	*	.	T	Hydrogen-bonded Turn	trans	-85	0.7	173.5	0	0	0	0	0	114.1	S255 I257	S255-G259 PolarHBondContact O-N 3.33Å; I257-G259 VanDerWaalsContact C-N 3.32Å; I257-G259 PolarHBondContact O-N 2.94Å
260	S	89.9	Confident	92.1	Very high	9 Å²	9	38 Å²	38	6%	0.063	24%	0.236	C	C	.	.			trans	-64.1	136.1	-179.8	-173.3	0	0	0	0	110.7	Q256 I257 L258 V262	Q256-S260 PolarHBondContact O-N 2.98Å; Q256-S260 VanDerWaalsContact O-N 3.11Å; I257-S260 WeakPolarHBondContact O-CB 3.35Å; I257-S260 PolarHBondContact O-N 2.81Å; L258-S260 VanDerWaalsContact C-N 3.31Å; S260-V262 PolarHBondContact O-N 3.08Å; S260-V262 PolarHBondContact OG-N 3.44Å
261	P	89.3	Confident	92.2	Very high	52 Å²	52	37.8 Å²	37.8	34%	0.338	23%	0.234	S	C	.	.	S	Bend	trans	-75	-9.9	176	31.8	-35.4	0	0	0	112.8	V236 L263	V236-P261 HydrophobicContact CB-CG 4.12Å; V236-P261 HydrophobicContact CG1-CG 4.21Å; V236-P261 HydrophobicContact CG2-CB 3.8Å; V236-P261 HydrophobicContact CG2-CG 3.74Å; P261-L263 PolarHBondContact O-N 2.84Å
262	V	93.2	Very high	92.6	Very high	8 Å²	8	38.2 Å²	38.2	5%	0.048	22%	0.216	C	C	.	.			trans	-80.2	112.2	171.7	178.1	0	0	0	0	108.6	V236 V240 S260 H265 L296	V236-V262 HydrophobicContact CG1-CG2 4.49Å; V240-V262 HydrophobicContact CG2-CG2 3.41Å; V240-V262 VanDerWaalsContact CG2-CG2 3.41Å; S260-V262 PolarHBondContact O-N 3.08Å; S260-V262 PolarHBondContact OG-N 3.44Å; V262-H265 PolarHBondContact O-CD2 3.49Å; V262-H265 PolarHBondContact O-NE2 3.48Å; V262-L296 HydrophobicContact CB-CB 4.46Å; V262-L296 HydrophobicContact CG1-CB 4.23Å
263	L	93.4	Very high	92.9	Very high	78 Å²	78	34.7 Å²	34.7	41%	0.408	21%	0.211	S	C	.	.			trans	-85.5	-16.2	-171.6	-57.9	176.2	0	0	0	114.1	P261 N328 L329 T330	P261-L263 PolarHBondContact O-N 2.84Å; L263-N328 WeakPolarHBondContact O-CA 3.46Å; L263-L329 PolarHBondContact O-N 3.2Å; L263-T330 WeakPolarHBondContact CD1-OG1 3.18Å
264	N	97.1	Very high	93	Very high	30 Å²	30	35.6 Å²	35.6	16%	0.16	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.5	118.2	176	-54	-58.4	0	0	0	109.3	K294 I295 L296 V327 N328 Y354	N264-K294 WeakPolarHBondContact CB-O 3.45Å; N264-K294 PolarHBondContact ND2-O 3.3Å; N264-I295 HydrophobicContact CB-CB 4.44Å; N264-I295 HydrophobicContact CB-CG1 4.02Å; N264-I295 CarbonylContact O-C 3.56Å; N264-I295 VanDerWaalsContact O-CA 3.28Å; N264-I295 WeakPolarHBondContact O-CA 3.29Å; N264-L296 PolarHBondContact O-N 2.99Å; N264-V327 CarbonylContact C-O 3.59Å; N264-V327 WeakPolarHBondContact CA-O 3.48Å; N264-N328 PolarHBondContact OD1-ND2 3.19Å; N264-Y354 HydrophobicContact CB-CE1 4.04Å; N264-Y354 PolarHBondContact OD1-OH 2.79Å
265	H	97.9	Very high	93.1	Very high	7 Å²	7	44 Å²	44	3%	0.032	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	126	-179.7	-68.4	-167	0	0	0	109.6	I257 V262 L267 L296 L326 V327 L329	I257-H265 PolarHBondContact O-CE1 3.35Å; V262-H265 PolarHBondContact O-CD2 3.49Å; V262-H265 PolarHBondContact O-NE2 3.48Å; H265-L267 HydrophobicContact CB-CD1 4Å; H265-L296 CarbonylContact C-O 3.46Å; H265-L296 WeakPolarHBondContact CA-O 3.22Å; H265-L326 CarbonylContact O-C 3.55Å; H265-L326 VanDerWaalsContact O-CA 3.25Å; H265-L326 WeakPolarHBondContact O-CA 3.49Å; H265-V327 HydrophobicContact CB-CG1 4.06Å; H265-V327 PolarHBondContact N-O 3.3Å; H265-V327 PolarHBondContact O-N 2.98Å; H265-L329 VanDerWaalsContact CE1-CD1 3.49Å; H265-L329 WeakPolarHBondContact CE1-CD1 3.47Å
266	A	98.3	Very high	93.5	Very high	0 Å²	0	46.8 Å²	46.8	0%	0	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.8	120.3	166.5	0	0	0	0	0	108.5	F284 I295 L296 F297 V298 R325 L326	A266-F284 HydrophobicContact CB-CE2 4.43Å; A266-F284 HydrophobicContact CB-CZ 4.32Å; A266-I295 HydrophobicContact CB-CG2 3.72Å; A266-L296 PolarHBondContact N-O 3.14Å; A266-F297 HydrophobicContact CB-CD2 4.32Å; A266-F297 HydrophobicContact CB-CE2 4.31Å; A266-F297 HydrophobicContact CB-CG 4.42Å; A266-F297 HydrophobicContact CB-CZ 4.45Å; A266-F297 WeakPolarHBondContact O-CA 3.39Å; A266-V298 PolarHBondContact O-N 2.76Å; A266-R325 CarbonylContact C-O 3.46Å; A266-R325 WeakPolarHBondContact CA-O 3.24Å; A266-L326 HydrophobicContact CB-CD1 4.48Å
267	L	98.3	Very high	93.9	Very high	8 Å²	8	45.7 Å²	45.7	4%	0.042	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	117.6	-177.2	-60.1	93.3	0	0	0	109.9	H265 F269 V298 V300 L310 F314 I324 R325 V327	H265-L267 HydrophobicContact CB-CD1 4Å; L267-F269 HydrophobicContact CB-CD2 4.37Å; L267-F269 HydrophobicContact CB-CE2 3.73Å; L267-F269 HydrophobicContact CB-CZ 4.25Å; L267-F269 HydrophobicContact CD2-CZ 4.37Å; L267-V298 CarbonylContact C-O 3.56Å; L267-V298 VanDerWaalsContact CA-O 3.3Å; L267-V298 WeakPolarHBondContact CA-O 3.42Å; L267-V298 HydrophobicContact CG-CB 4.25Å; L267-V300 HydrophobicContact CB-CG2 4.4Å; L267-V300 HydrophobicContact CD2-CG2 4.01Å; L267-L310 HydrophobicContact CD2-CD2 4.4Å; L267-F314 HydrophobicContact CD1-CE1 3.75Å; L267-F314 HydrophobicContact CD1-CE2 4.17Å; L267-F314 HydrophobicContact CD1-CZ 3.48Å; L267-F314 VanDerWaalsContact CD1-CZ 3.48Å; L267-F314 HydrophobicContact CD2-CD2 4.19Å; L267-F314 HydrophobicContact CD2-CE2 3.51Å; L267-F314 HydrophobicContact CD2-CZ 3.71Å; L267-F314 HydrophobicContact CG-CE2 4.47Å; L267-F314 HydrophobicContact CG-CZ 4.24Å; L267-I324 WeakPolarHBondContact O-CA 3.3Å; L267-R325 PolarHBondContact N-O 3.37Å; L267-R325 PolarHBondContact O-N 3.07Å; L267-V327 HydrophobicContact CD1-CG1 3.94Å
268	L	98.3	Very high	94	Very high	0 Å²	0	55.6 Å²	55.6	0%	0	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.2	108.6	169.2	172.4	64.1	0	0	0	109.3	V270 I280 F284 V298 V300 I324 L342	L268-V270 HydrophobicContact CD1-CB 4.27Å; L268-V270 HydrophobicContact CD2-CB 4.41Å; L268-V270 HydrophobicContact CD2-CG1 4.08Å; L268-V270 HydrophobicContact CG-CB 4.05Å; L268-V270 HydrophobicContact CG-CG1 3.99Å; L268-I280 HydrophobicContact CD1-CG2 3.9Å; L268-I280 HydrophobicContact CD2-CG2 3.96Å; L268-F284 HydrophobicContact CB-CD1 3.81Å; L268-F284 HydrophobicContact CB-CD2 4.19Å; L268-F284 HydrophobicContact CB-CE1 3.59Å; L268-F284 HydrophobicContact CB-CE2 4Å; L268-F284 HydrophobicContact CB-CG 4.11Å; L268-F284 HydrophobicContact CB-CZ 3.69Å; L268-F284 HydrophobicContact CD2-CB 3.92Å; L268-F284 HydrophobicContact CD2-CD1 3.8Å; L268-F284 HydrophobicContact CD2-CE1 4.44Å; L268-F284 HydrophobicContact CD2-CG 3.84Å; L268-F284 HydrophobicContact CG-CD1 4.45Å; L268-V298 PolarHBondContact N-O 3.43Å; L268-V300 PolarHBondContact O-N 3.21Å; L268-I324 HydrophobicContact CB-CG1 4.38Å; L268-I324 HydrophobicContact CD1-CD1 4.33Å; L268-I324 HydrophobicContact CD1-CG1 3.78Å; L268-L342 HydrophobicContact CD1-CD1 4.18Å
269	F	97.1	Very high	94.4	Very high	0 Å²	0	57.6 Å²	57.6	0%	0	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.9	114.9	168.8	-64.8	-92.9	0	0	0	108.5	L267 V300 V302 M311 F314 V316 P322 H323 R325	L267-F269 HydrophobicContact CB-CD2 4.37Å; L267-F269 HydrophobicContact CB-CE2 3.73Å; L267-F269 HydrophobicContact CB-CZ 4.25Å; L267-F269 HydrophobicContact CD2-CZ 4.37Å; F269-V300 WeakPolarHBondContact CA-O 3.36Å; F269-V300 HydrophobicContact CD1-CB 3.82Å; F269-V300 HydrophobicContact CD1-CG1 3.74Å; F269-V300 HydrophobicContact CD1-CG2 4.43Å; F269-V300 HydrophobicContact CE1-CB 3.98Å; F269-V300 HydrophobicContact CE1-CG1 3.75Å; F269-V300 HydrophobicContact CE1-CG2 4.16Å; F269-V300 HydrophobicContact CG-CB 4.38Å; F269-V300 HydrophobicContact CZ-CG2 4.41Å; F269-V302 HydrophobicContact CB-CG1 3.92Å; F269-V302 HydrophobicContact CD1-CG1 4.4Å; F269-M311 HydrophobicContact CD1-CG 4.1Å; F269-M311 HydrophobicContact CE1-CG 3.97Å; F269-F314 HydrophobicContact CE2-CB 4.13Å; F269-F314 HydrophobicContact CE2-CD2 4.47Å; F269-F314 HydrophobicContact CE2-CG 4.22Å; F269-F314 HydrophobicContact CZ-CB 3.65Å; F269-F314 AromaticContact CZ-CD2 3.67Å; F269-F314 HydrophobicContact CZ-CD2 3.67Å; F269-F314 AromaticContact CZ-CG 3.74Å; F269-F314 HydrophobicContact CZ-CG 3.74Å; F269-V316 HydrophobicContact CB-CG1 3.89Å; F269-V316 HydrophobicContact CD1-CB 4.13Å; F269-V316 HydrophobicContact CD1-CG1 3.99Å; F269-V316 HydrophobicContact CD1-CG2 4.47Å; F269-V316 HydrophobicContact CD2-CB 4.41Å; F269-V316 HydrophobicContact CD2-CG1 4.26Å; F269-V316 HydrophobicContact CD2-CG2 3.94Å; F269-V316 HydrophobicContact CE1-CB 4.3Å; F269-V316 HydrophobicContact CE1-CG2 4.46Å; F269-V316 HydrophobicContact CE2-CG2 3.93Å; F269-V316 HydrophobicContact CG-CB 4.19Å; F269-V316 HydrophobicContact CG-CG1 3.78Å; F269-V316 HydrophobicContact CG-CG2 4.22Å; F269-V316 HydrophobicContact CZ-CG2 4.21Å; F269-P322 CarbonylContact O-C 3.58Å; F269-P322 VanDerWaalsContact O-CA 3.28Å; F269-P322 WeakPolarHBondContact O-CA 3.42Å; F269-H323 PolarHBondContact N-O 3.11Å; F269-H323 PolarHBondContact O-N 3.24Å; F269-R325 HydrophobicContact CD2-CG 4.2Å; F269-R325 HydrophobicContact CE2-CB 3.94Å; F269-R325 HydrophobicContact CE2-CG 3.72Å
270	V	96.4	Very high	95	Very high	1 Å²	1	55.4 Å²	55.4	1%	0.006	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.1	149.9	-174.9	65.3	0	0	0	0	111.2	L268 F277 L299 V300 N301 V302 P322	L268-V270 HydrophobicContact CD1-CB 4.27Å; L268-V270 HydrophobicContact CD2-CB 4.41Å; L268-V270 HydrophobicContact CD2-CG1 4.08Å; L268-V270 HydrophobicContact CG-CB 4.05Å; L268-V270 HydrophobicContact CG-CG1 3.99Å; V270-F277 HydrophobicContact CG1-CD2 4Å; V270-F277 HydrophobicContact CG1-CE2 3.87Å; V270-F277 HydrophobicContact CG2-CD2 3.84Å; V270-L299 HydrophobicContact CG1-CD1 4.07Å; V270-L299 HydrophobicContact CG1-CG 4.12Å; V270-V300 PolarHBondContact N-O 3.08Å; V270-N301 WeakPolarHBondContact O-CA 3.4Å; V270-N301 PolarHBondContact O-OD1 2.95Å; V270-V302 PolarHBondContact O-N 2.91Å; V270-P322 HydrophobicContact CG2-CB 4.17Å
271	N	95.3	Very high	95.3	Very high	36 Å²	36	58.2 Å²	58.2	19%	0.193	29%	0.29	C	S	.	.			trans	-86.1	114.5	168.5	-175.8	-29.2	0	0	0	109.1	S273 S274 V302 D303	N271-S273 PolarHBondContact O-N 3.09Å; N271-S273 WeakPolarHBondContact OD1-CA 3.36Å; N271-S273 VanDerWaalsContact OD1-CB 3.3Å; N271-S273 WeakPolarHBondContact OD1-CB 3.2Å; N271-S273 PolarHBondContact OD1-N 3.48Å; N271-S274 WeakPolarHBondContact O-CB 3.4Å; N271-S274 PolarHBondContact O-N 3.48Å; N271-S274 VanDerWaalsContact O-N 3.13Å; N271-S274 PolarHBondContact O-OG 3.28Å; N271-V302 HydrophobicContact CB-CG2 3.9Å; N271-D303 VanDerWaalsContact ND2-CG 3.28Å; N271-D303 PolarHBondContact ND2-OD1 3.48Å; N271-D303 PolarHBondContact ND2-OD2 3.27Å; N271-D303 PolarHBondContact OD1-OD2 3.28Å
272	K	95.4	Very high	95.7	Very high	77 Å²	77	58.5 Å²	58.5	34%	0.335	29%	0.293	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.7	-18.5	-179.7	-67.6	176.8	68.5	174.7	0	113.8	E248 F277 L299 N301	E248-K272 WeakPolarHBondContact OE1-CD 3Å; E248-K272 IonicContact OE1-NZ 3.09Å; E248-K272 PolarHBondContact OE1-NZ 3.39Å; E248-K272 IonicContact OE2-NZ 2.72Å; E248-K272 PolarHBondContact OE2-NZ 3.06Å; K272-F277 HydrophobicContact CB-CE2 4.47Å; K272-F277 HydrophobicContact CB-CZ 4.49Å; K272-F277 HydrophobicContact CG-CD2 4.39Å; K272-F277 HydrophobicContact CG-CE2 3.91Å; K272-F277 HydrophobicContact CG-CZ 4.01Å; K272-L299 HydrophobicContact CD-CD2 4.22Å; K272-N301 HydrophobicContact CD-CB 3.8Å; K272-N301 HydrophobicContact CG-CB 4.14Å; K272-N301 PolarHBondContact N-OD1 3.26Å
273	S	94.4	Very high	95.9	Very high	104 Å²	104	58.7 Å²	58.7	73%	0.727	30%	0.295	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.6	-4.6	177.1	-63	0	0	0	0	113.7	N271	N271-S273 PolarHBondContact O-N 3.09Å; N271-S273 WeakPolarHBondContact OD1-CA 3.36Å; N271-S273 VanDerWaalsContact OD1-CB 3.3Å; N271-S273 WeakPolarHBondContact OD1-CB 3.2Å; N271-S273 PolarHBondContact OD1-N 3.48Å
274	S	92.9	Very high	96.1	Very high	45 Å²	45	55 Å²	55	32%	0.315	28%	0.276	S	S	.	.	S	Bend	trans	-70.8	148.6	175	71	0	0	0	0	112.1	N271 D276 F277	N271-S274 WeakPolarHBondContact O-CB 3.4Å; N271-S274 PolarHBondContact O-N 3.48Å; N271-S274 VanDerWaalsContact O-N 3.13Å; N271-S274 PolarHBondContact O-OG 3.28Å; S274-D276 VanDerWaalsContact C-N 3.28Å; S274-D276 PolarHBondContact O-N 2.88Å; S274-F277 VanDerWaalsContact O-CB 3.24Å; S274-F277 WeakPolarHBondContact O-CB 3.25Å; S274-F277 PolarHBondContact O-N 3.26Å; S274-F277 PolarHBondContact OG-N 3.06Å
275	E	92.2	Very high	96.1	Very high	190 Å²	190	56.1 Å²	56.1	89%	0.888	28%	0.28	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.9	-38.2	179.6	-62.9	-175.3	172.2	0	0	112.2	F277	E275-F277 VanDerWaalsContact C-N 3.25Å; E275-F277 PolarHBondContact O-N 3.45Å
276	D	91.9	Very high	96.1	Very high	103 Å²	103	59 Å²	59	55%	0.551	30%	0.296	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.9	-3.8	-176.6	-53	-25.1	0	0	0	113.5	S274 R278 E279 I280	S274-D276 VanDerWaalsContact C-N 3.28Å; S274-D276 PolarHBondContact O-N 2.88Å; D276-R278 VanDerWaalsContact C-N 3.27Å; D276-R278 PolarHBondContact O-N 2.88Å; D276-E279 PolarHBondContact O-N 2.92Å; D276-I280 HydrophobicContact CB-CD1 3.89Å; D276-I280 HydrophobicContact CB-CG1 4.49Å; D276-I280 WeakPolarHBondContact O-CG1 3.25Å; D276-I280 PolarHBondContact O-N 3.39Å; D276-I280 VanDerWaalsContact O-N 3.13Å
277	F	95.3	Very high	96.1	Very high	38 Å²	38	59 Å²	59	17%	0.167	30%	0.296	C	S	.	.	H	α-helix	trans	-53.9	-43.1	-173.8	170.1	-112.4	0	0	0	112.7	V270 K272 S274 E275 E279 I280 F281 L299	V270-F277 HydrophobicContact CG1-CD2 4Å; V270-F277 HydrophobicContact CG1-CE2 3.87Å; V270-F277 HydrophobicContact CG2-CD2 3.84Å; K272-F277 HydrophobicContact CB-CE2 4.47Å; K272-F277 HydrophobicContact CB-CZ 4.49Å; K272-F277 HydrophobicContact CG-CD2 4.39Å; K272-F277 HydrophobicContact CG-CE2 3.91Å; K272-F277 HydrophobicContact CG-CZ 4.01Å; S274-F277 VanDerWaalsContact O-CB 3.24Å; S274-F277 WeakPolarHBondContact O-CB 3.25Å; S274-F277 PolarHBondContact O-N 3.26Å; S274-F277 PolarHBondContact OG-N 3.06Å; E275-F277 VanDerWaalsContact C-N 3.25Å; E275-F277 PolarHBondContact O-N 3.45Å; F277-E279 PolarHBondContact O-N 3.04Å; F277-I280 PolarHBondContact O-N 3.42Å; F277-F281 HydrophobicContact CD2-CB 4.48Å; F277-F281 HydrophobicContact CE2-CB 4.02Å; F277-F281 HydrophobicContact CE2-CD2 4.44Å; F277-F281 HydrophobicContact CE2-CG 4.49Å; F277-F281 HydrophobicContact CZ-CB 4.05Å; F277-F281 HydrophobicContact CZ-CD2 4.25Å; F277-F281 HydrophobicContact CZ-CG 4.19Å; F277-F281 WeakPolarHBondContact O-CB 3.33Å; F277-F281 PolarHBondContact O-N 3.25Å; F277-L299 HydrophobicContact CE2-CD1 3.85Å; F277-L299 HydrophobicContact CZ-CD1 4.14Å
278	R	96	Very high	96	Very high	213 Å²	213	58.6 Å²	58.6	80%	0.804	29%	0.294	S	S	*	.	H	α-helix	trans	-63.7	-41.9	-176.3	-70.4	-177.1	177.3	174.6	0.2	112.3	D276 S282	D276-R278 VanDerWaalsContact C-N 3.27Å; D276-R278 PolarHBondContact O-N 2.88Å; R278-S282 VanDerWaalsContact O-CB 3.27Å; R278-S282 WeakPolarHBondContact O-CB 3.41Å; R278-S282 PolarHBondContact O-N 2.85Å
279	E	96.1	Very high	95.8	Very high	149 Å²	149	63.4 Å²	63.4	70%	0.696	32%	0.316	S	S	*	.	H	α-helix	trans	-68.4	-48.1	179.8	-175.6	175.8	173.4	0	0	110.6	D276 F277 F281 S282 A283	D276-E279 PolarHBondContact O-N 2.92Å; F277-E279 PolarHBondContact O-N 3.04Å; E279-F281 PolarHBondContact O-N 3.16Å; E279-S282 WeakPolarHBondContact O-CB 3.36Å; E279-S282 PolarHBondContact O-N 2.7Å; E279-A283 WeakPolarHBondContact O-CB 3.42Å; E279-A283 PolarHBondContact O-N 2.96Å
280	I	95.8	Very high	95.8	Very high	16 Å²	16	66.1 Å²	66.1	8%	0.082	34%	0.339	C	S	.	.	H	α-helix	trans	-61.7	-45.3	179.3	-63.1	164.1	0	0	0	110.9	L268 D276 F277 A283 F284 P322 L342	L268-I280 HydrophobicContact CD1-CG2 3.9Å; L268-I280 HydrophobicContact CD2-CG2 3.96Å; D276-I280 HydrophobicContact CB-CD1 3.89Å; D276-I280 HydrophobicContact CB-CG1 4.49Å; D276-I280 WeakPolarHBondContact O-CG1 3.25Å; D276-I280 PolarHBondContact O-N 3.39Å; D276-I280 VanDerWaalsContact O-N 3.13Å; F277-I280 PolarHBondContact O-N 3.42Å; I280-A283 PolarHBondContact O-N 2.97Å; I280-F284 WeakPolarHBondContact O-CB 3.43Å; I280-F284 PolarHBondContact O-N 3.27Å; I280-P322 HydrophobicContact CD1-CB 3.83Å; I280-P322 HydrophobicContact CD1-CG 3.69Å; I280-L342 HydrophobicContact CG2-CB 4.27Å; I280-L342 HydrophobicContact CG2-CD1 3.93Å
281	F	97.1	Very high	95.8	Very high	68 Å²	68	66.5 Å²	66.5	30%	0.298	34%	0.34	S	S	.	.	H	α-helix	trans	-62.8	-43.8	177.7	179.3	-99.3	0	0	0	111.5	V246 F277 E279 F284 H285 L299	V246-F281 HydrophobicContact CB-CE2 4.11Å; V246-F281 HydrophobicContact CB-CZ 4.45Å; V246-F281 HydrophobicContact CG1-CE2 3.84Å; F277-F281 HydrophobicContact CD2-CB 4.48Å; F277-F281 HydrophobicContact CE2-CB 4.02Å; F277-F281 HydrophobicContact CE2-CD2 4.44Å; F277-F281 HydrophobicContact CE2-CG 4.49Å; F277-F281 HydrophobicContact CZ-CB 4.05Å; F277-F281 HydrophobicContact CZ-CD2 4.25Å; F277-F281 HydrophobicContact CZ-CG 4.19Å; F277-F281 WeakPolarHBondContact O-CB 3.33Å; F277-F281 PolarHBondContact O-N 3.25Å; E279-F281 PolarHBondContact O-N 3.16Å; F281-F284 PolarHBondContact O-N 3.22Å; F281-H285 HydrophobicContact CE1-CB 4.42Å; F281-H285 WeakPolarHBondContact O-CB 3.2Å; F281-H285 PolarHBondContact O-N 3.36Å; F281-L299 HydrophobicContact CD2-CD1 3.54Å; F281-L299 HydrophobicContact CE2-CD1 3.84Å
282	S	97.1	Very high	95.7	Very high	58 Å²	58	66.1 Å²	66.1	41%	0.406	34%	0.336	S	S	.	.	H	α-helix	trans	-59.6	-47.6	177	-175.3	0	0	0	0	111.5	R278 E279 F284 H285 N286	R278-S282 VanDerWaalsContact O-CB 3.27Å; R278-S282 WeakPolarHBondContact O-CB 3.41Å; R278-S282 PolarHBondContact O-N 2.85Å; E279-S282 WeakPolarHBondContact O-CB 3.36Å; E279-S282 PolarHBondContact O-N 2.7Å; S282-F284 PolarHBondContact O-N 3.46Å; S282-H285 PolarHBondContact O-N 3.06Å; S282-N286 WeakPolarHBondContact O-CB 3.41Å; S282-N286 PolarHBondContact O-N 2.95Å; S282-N286 PolarHBondContact O-OD1 3.29Å
283	A	97.4	Very high	95.7	Very high	11 Å²	11	65.9 Å²	65.9	9%	0.091	34%	0.338	C	S	.	.	H	α-helix	trans	-59.5	-45.6	176.3	0	0	0	0	0	112.4	E279 I280 A287 I347	E279-A283 WeakPolarHBondContact O-CB 3.42Å; E279-A283 PolarHBondContact O-N 2.96Å; I280-A283 PolarHBondContact O-N 2.97Å; A283-A287 WeakPolarHBondContact O-CB 3.06Å; A283-A287 PolarHBondContact O-N 2.52Å; A283-I347 HydrophobicContact CB-CD1 4.12Å
284	F	98	Very high	95.7	Very high	0 Å²	0	66.5 Å²	66.5	0%	0	33%	0.328	C	S	.	.	H	α-helix	trans	-66.4	-39.9	178.6	-168.4	-114.8	0	0	0	112.1	V246 A266 L268 I280 F281 S282 A287 A288 F297 I324 I347	V246-F284 HydrophobicContact CB-CD1 4.48Å; V246-F284 HydrophobicContact CG1-CD1 3.86Å; V246-F284 HydrophobicContact CG1-CE1 3.91Å; V246-F284 HydrophobicContact CG2-CD1 3.71Å; V246-F284 HydrophobicContact CG2-CE1 4.12Å; A266-F284 HydrophobicContact CB-CE2 4.43Å; A266-F284 HydrophobicContact CB-CZ 4.32Å; L268-F284 HydrophobicContact CB-CD1 3.81Å; L268-F284 HydrophobicContact CB-CD2 4.19Å; L268-F284 HydrophobicContact CB-CE1 3.59Å; L268-F284 HydrophobicContact CB-CE2 4Å; L268-F284 HydrophobicContact CB-CG 4.11Å; L268-F284 HydrophobicContact CB-CZ 3.69Å; L268-F284 HydrophobicContact CD2-CB 3.92Å; L268-F284 HydrophobicContact CD2-CD1 3.8Å; L268-F284 HydrophobicContact CD2-CE1 4.44Å; L268-F284 HydrophobicContact CD2-CG 3.84Å; L268-F284 HydrophobicContact CG-CD1 4.45Å; I280-F284 WeakPolarHBondContact O-CB 3.43Å; I280-F284 PolarHBondContact O-N 3.27Å; F281-F284 PolarHBondContact O-N 3.22Å; S282-F284 PolarHBondContact O-N 3.46Å; F284-A287 PolarHBondContact O-N 3.12Å; F284-A288 PolarHBondContact O-N 3.41Å; F284-F297 AromaticContact CD1-CD1 4Å; F284-F297 HydrophobicContact CD1-CD1 4Å; F284-F297 AromaticContact CD2-CD1 3.74Å; F284-F297 HydrophobicContact CD2-CD1 3.74Å; F284-F297 AromaticContact CD2-CE1 3.91Å; F284-F297 HydrophobicContact CD2-CE1 3.91Å; F284-F297 HydrophobicContact CE1-CB 3.82Å; F284-F297 AromaticContact CE1-CD1 3.64Å; F284-F297 HydrophobicContact CE1-CD1 3.64Å; F284-F297 HydrophobicContact CE1-CG 4.17Å; F284-F297 AromaticContact CE2-CD1 3.35Å; F284-F297 HydrophobicContact CE2-CD1 3.35Å; F284-F297 AromaticContact CE2-CE1 3.64Å; F284-F297 HydrophobicContact CE2-CE1 3.64Å; F284-F297 HydrophobicContact CE2-CG 4.33Å; F284-F297 HydrophobicContact CG-CD1 4.05Å; F284-F297 HydrophobicContact CZ-CB 3.94Å; F284-F297 AromaticContact CZ-CD1 3.3Å; F284-F297 HydrophobicContact CZ-CD1 3.3Å; F284-F297 HydrophobicContact CZ-CE1 4.06Å; F284-F297 AromaticContact CZ-CG 3.9Å; F284-F297 HydrophobicContact CZ-CG 3.9Å; F284-I324 HydrophobicContact CD2-CD1 3.68Å; F284-I324 HydrophobicContact CD2-CG1 4.46Å; F284-I324 HydrophobicContact CE2-CD1 3.83Å; F284-I324 HydrophobicContact CE2-CG1 4.27Å; F284-I324 HydrophobicContact CE2-CG2 4.42Å; F284-I347 HydrophobicContact CB-CD1 4.24Å; F284-I347 HydrophobicContact CD2-CD1 4.21Å; F284-I347 HydrophobicContact CD2-CG2 4.11Å
285	H	97.6	Very high	96	Very high	55 Å²	55	64.6 Å²	64.6	26%	0.255	31%	0.314	S	S	.	.	H	α-helix	trans	-63.7	-49.5	176.3	-179.4	-77.8	0	0	0	112.3	V246 F281 S282 A287 A288	V246-H285 HydrophobicContact CG2-CB 4.06Å; F281-H285 HydrophobicContact CE1-CB 4.42Å; F281-H285 WeakPolarHBondContact O-CB 3.2Å; F281-H285 PolarHBondContact O-N 3.36Å; S282-H285 PolarHBondContact O-N 3.06Å; H285-A287 VanDerWaalsContact C-N 3.27Å; H285-A287 PolarHBondContact O-N 2.81Å; H285-A288 VanDerWaalsContact O-CB 3.3Å; H285-A288 WeakPolarHBondContact O-CB 3.47Å; H285-A288 PolarHBondContact O-N 2.98Å; H285-A288 VanDerWaalsContact O-N 3.11Å
286	N	97	Very high	96.3	Very high	66 Å²	66	55.7 Å²	55.7	35%	0.353	27%	0.273	S	S	.	.	H	α-helix	trans	-64	-35.3	178.8	-65.2	-10.3	0	0	0	112	S282 E344	S282-N286 WeakPolarHBondContact O-CB 3.41Å; S282-N286 PolarHBondContact O-N 2.95Å; S282-N286 PolarHBondContact O-OD1 3.29Å; N286-E344 VanDerWaalsContact CB-CD 3.4Å; N286-E344 HydrophobicContact CB-CG 3.96Å; N286-E344 WeakPolarHBondContact CB-OE2 3.33Å; N286-E344 PolarHBondContact ND2-OE2 3.06Å
287	A	97.9	Very high	96.6	Very high	0 Å²	0	50.9 Å²	50.9	0%	0	25%	0.247	C	C	.	.	H	α-helix	trans	-65.4	-38.8	173.7	0	0	0	0	0	112.1	A283 F284 H285 E289 A290 F291 F297 E344 I347 K348	A283-A287 WeakPolarHBondContact O-CB 3.06Å; A283-A287 PolarHBondContact O-N 2.52Å; F284-A287 PolarHBondContact O-N 3.12Å; H285-A287 VanDerWaalsContact C-N 3.27Å; H285-A287 PolarHBondContact O-N 2.81Å; A287-E289 PolarHBondContact O-N 2.6Å; A287-A290 PolarHBondContact O-N 2.64Å; A287-A290 VanDerWaalsContact O-N 3.16Å; A287-F291 WeakPolarHBondContact O-CD2 3.41Å; A287-F297 HydrophobicContact CB-CE1 4.16Å; A287-E344 HydrophobicContact CB-CG 4.44Å; A287-I347 HydrophobicContact CB-CB 3.95Å; A287-I347 HydrophobicContact CB-CG2 3.55Å; A287-K348 HydrophobicContact CB-CG 3.99Å
288	A	97.6	Very high	96.7	Very high	1 Å²	1	49.1 Å²	49.1	1%	0.008	24%	0.239	C	C	.	.	H	α-helix	trans	-56.7	-36.6	-177.2	0	0	0	0	0	113.3	P245 V246 F284 H285 A290 F291 R292 F297	P245-A288 HydrophobicContact CB-CB 4.09Å; P245-A288 WeakPolarHBondContact O-CB 3.39Å; V246-A288 HydrophobicContact CG2-CB 3.95Å; F284-A288 PolarHBondContact O-N 3.41Å; H285-A288 VanDerWaalsContact O-CB 3.3Å; H285-A288 WeakPolarHBondContact O-CB 3.47Å; H285-A288 PolarHBondContact O-N 2.98Å; H285-A288 VanDerWaalsContact O-N 3.11Å; A288-A290 VanDerWaalsContact C-N 3.25Å; A288-A290 PolarHBondContact O-N 2.86Å; A288-F291 PolarHBondContact O-N 3.38Å; A288-R292 PolarHBondContact O-N 2.96Å; A288-F297 HydrophobicContact CB-CB 3.75Å; A288-F297 HydrophobicContact CB-CD1 3.51Å; A288-F297 HydrophobicContact CB-CD2 3.93Å; A288-F297 HydrophobicContact CB-CE1 4.05Å; A288-F297 HydrophobicContact CB-CE2 4.44Å; A288-F297 HydrophobicContact CB-CG 3.46Å; A288-F297 VanDerWaalsContact CB-CG 3.46Å; A288-F297 HydrophobicContact CB-CZ 4.49Å
289	E	93.6	Very high	96.8	Very high	101 Å²	101	39.2 Å²	39.2	47%	0.472	20%	0.202	S	C	.	.	H	α-helix	trans	-58.6	-36.4	-179.7	-68.1	-66.8	-176.2	0	0	112.8	P245 A287 F291 R292	P245-E289 WeakPolarHBondContact CG-OE1 3.29Å; A287-E289 PolarHBondContact O-N 2.6Å; E289-F291 PolarHBondContact O-N 3.09Å; E289-R292 WeakPolarHBondContact O-CG 3.3Å
290	A	95.9	Very high	96.9	Very high	57 Å²	57	32.1 Å²	32.1	47%	0.471	17%	0.169	S	C	.	.	T	Hydrogen-bonded Turn	trans	-69.8	-17.8	-179.9	0	0	0	0	0	113.5	A287 A288	A287-A290 PolarHBondContact O-N 2.64Å; A287-A290 VanDerWaalsContact O-N 3.16Å; A288-A290 VanDerWaalsContact C-N 3.25Å; A288-A290 PolarHBondContact O-N 2.86Å
291	F	97	Very high	97	Very high	9 Å²	9	32.5 Å²	32.5	4%	0.039	17%	0.171	C	C	.	.	T	Hydrogen-bonded Turn	trans	-119.5	13.6	-173.9	-55.6	-76.9	0	0	0	113.8	A287 A288 E289 L293 K294 I295 F297 K348 C351 Q352 L355	A287-F291 WeakPolarHBondContact O-CD2 3.41Å; A288-F291 PolarHBondContact O-N 3.38Å; E289-F291 PolarHBondContact O-N 3.09Å; F291-L293 PolarHBondContact O-N 3.12Å; F291-K294 WeakPolarHBondContact O-CA 3.43Å; F291-K294 WeakPolarHBondContact O-CB 3.27Å; F291-K294 PolarHBondContact O-N 2.85Å; F291-I295 HydrophobicContact CB-CB 4.05Å; F291-I295 HydrophobicContact CB-CD1 4.36Å; F291-I295 HydrophobicContact CB-CG1 4.41Å; F291-I295 HydrophobicContact CD1-CD1 4.14Å; F291-I295 HydrophobicContact CG-CD1 4.27Å; F291-I295 PolarHBondContact O-N 2.9Å; F291-F297 HydrophobicContact CB-CE2 3.86Å; F291-F297 HydrophobicContact CB-CZ 4.48Å; F291-F297 AromaticContact CD2-CE2 3.97Å; F291-F297 HydrophobicContact CD2-CE2 3.97Å; F291-F297 AromaticContact CD2-CZ 3.73Å; F291-F297 HydrophobicContact CD2-CZ 3.73Å; F291-F297 HydrophobicContact CE2-CZ 4.46Å; F291-F297 HydrophobicContact CG-CE2 4.27Å; F291-F297 HydrophobicContact CG-CZ 4.45Å; F291-K348 HydrophobicContact CE2-CB 4.18Å; F291-K348 HydrophobicContact CE2-CG 3.87Å; F291-K348 HydrophobicContact CZ-CB 4.22Å; F291-K348 HydrophobicContact CZ-CG 4.31Å; F291-K348 WeakPolarHBondContact CZ-O 3.48Å; F291-C351 HydrophobicContact CD1-CB 4.1Å; F291-C351 HydrophobicContact CD2-CB 3.94Å; F291-C351 HydrophobicContact CE1-CB 3.71Å; F291-C351 HydrophobicContact CE2-CB 3.54Å; F291-C351 HydrophobicContact CG-CB 4.22Å; F291-C351 HydrophobicContact CZ-CB 3.43Å; F291-C351 VanDerWaalsContact CZ-CB 3.43Å; F291-Q352 HydrophobicContact CE1-CB 4.48Å; F291-L355 HydrophobicContact CD1-CD1 3.82Å; F291-L355 HydrophobicContact CE1-CD1 4.15Å
292	R	94	Very high	97	Very high	27 Å²	27	29.6 Å²	29.6	10%	0.102	16%	0.159	C	C	.	.	T	Hydrogen-bonded Turn	trans	-48.7	139.7	171.9	-63.4	-67.6	-70.1	174.7	-12	110.2	V240 Y241 M243 D244 A288 E289 K294	V240-R292 PolarHBondContact O-NH2 2.88Å; Y241-R292 VanDerWaalsContact CA-NH2 3.31Å; M243-R292 PolarHBondContact O-NH1 3.37Å; M243-R292 PolarHBondContact O-NH2 3.4Å; M243-R292 VanDerWaalsContact O-NH2 3.09Å; D244-R292 PolarHBondContact O-NH1 3.35Å; A288-R292 PolarHBondContact O-N 2.96Å; E289-R292 WeakPolarHBondContact O-CG 3.3Å; R292-K294 PolarHBondContact O-N 2.91Å; R292-K294 VanDerWaalsContact O-N 3.08Å
293	L	94.3	Very high	96.8	Very high	73 Å²	73	29.7 Å²	29.7	38%	0.382	16%	0.155	S	C	.	.	T	Hydrogen-bonded Turn	trans	67.1	-10.6	-174.2	-48.6	171.2	0	0	0	116.1	V236 V240 Y241 F291	V236-L293 HydrophobicContact CG1-CD2 4.18Å; V240-L293 HydrophobicContact CB-CD2 3.74Å; V240-L293 HydrophobicContact CG1-CD2 3.89Å; V240-L293 HydrophobicContact CG2-CD2 3.98Å; Y241-L293 HydrophobicContact CD2-CD2 4.27Å; Y241-L293 HydrophobicContact CE2-CD1 4.22Å; Y241-L293 HydrophobicContact CE2-CD2 3.96Å; Y241-L293 HydrophobicContact CE2-CG 4.1Å; F291-L293 PolarHBondContact O-N 3.12Å
294	K	96.1	Very high	96.7	Very high	117 Å²	117	31.6 Å²	31.6	51%	0.509	16%	0.162	S	C	.	.	T	Hydrogen-bonded Turn	trans	-107	-43.4	-179.3	-60.3	176.6	-176	172	0	112.5	N264 F291 R292 L355	N264-K294 WeakPolarHBondContact CB-O 3.45Å; N264-K294 PolarHBondContact ND2-O 3.3Å; F291-K294 WeakPolarHBondContact O-CA 3.43Å; F291-K294 WeakPolarHBondContact O-CB 3.27Å; F291-K294 PolarHBondContact O-N 2.85Å; R292-K294 PolarHBondContact O-N 2.91Å; R292-K294 VanDerWaalsContact O-N 3.08Å; K294-L355 HydrophobicContact CB-CD1 4.24Å; K294-L355 HydrophobicContact CD-CD1 4.11Å
295	I	97.9	Very high	96.4	Very high	4 Å²	4	40.1 Å²	40.1	2%	0.021	20%	0.202	C	C	.	.			trans	-135.9	128.1	178.9	-56.6	170.9	0	0	0	108	N264 A266 F291 F297 L326 C351 Y354 L355	N264-I295 HydrophobicContact CB-CB 4.44Å; N264-I295 HydrophobicContact CB-CG1 4.02Å; N264-I295 CarbonylContact O-C 3.56Å; N264-I295 VanDerWaalsContact O-CA 3.28Å; N264-I295 WeakPolarHBondContact O-CA 3.29Å; A266-I295 HydrophobicContact CB-CG2 3.72Å; F291-I295 HydrophobicContact CB-CB 4.05Å; F291-I295 HydrophobicContact CB-CD1 4.36Å; F291-I295 HydrophobicContact CB-CG1 4.41Å; F291-I295 HydrophobicContact CD1-CD1 4.14Å; F291-I295 HydrophobicContact CG-CD1 4.27Å; F291-I295 PolarHBondContact O-N 2.9Å; I295-F297 HydrophobicContact CB-CD2 4.37Å; I295-F297 HydrophobicContact CB-CE2 3.96Å; I295-F297 HydrophobicContact CG2-CD2 3.97Å; I295-F297 HydrophobicContact CG2-CE2 3.72Å; I295-L326 HydrophobicContact CD1-CD1 4.12Å; I295-L326 HydrophobicContact CG2-CD1 4.48Å; I295-C351 HydrophobicContact CD1-CB 3.72Å; I295-Y354 HydrophobicContact CD1-CD1 4.32Å; I295-L355 HydrophobicContact CD1-CD1 3.98Å; I295-L355 HydrophobicContact CD1-CD2 4.13Å; I295-L355 HydrophobicContact CD1-CG 3.94Å; I295-L355 HydrophobicContact CG1-CD1 4.38Å; I295-L355 HydrophobicContact CG1-CD2 4.07Å; I295-L355 HydrophobicContact CG1-CG 4.39Å
296	L	97.8	Very high	96.2	Very high	4 Å²	4	46 Å²	46	2%	0.021	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.9	129.1	171.6	-174.3	65	0	0	0	109.4	M243 I257 V262 N264 H265 A266 V298	M243-L296 HydrophobicContact CE-CD1 3.42Å; M243-L296 VanDerWaalsContact CE-CD1 3.42Å; M243-L296 HydrophobicContact CE-CD2 4.18Å; M243-L296 HydrophobicContact CE-CG 4.47Å; M243-L296 HydrophobicContact SD-CD1 4.2Å; I257-L296 HydrophobicContact CG2-CD2 4.05Å; V262-L296 HydrophobicContact CB-CB 4.46Å; V262-L296 HydrophobicContact CG1-CB 4.23Å; N264-L296 PolarHBondContact O-N 2.99Å; H265-L296 CarbonylContact C-O 3.46Å; H265-L296 WeakPolarHBondContact CA-O 3.22Å; A266-L296 PolarHBondContact N-O 3.14Å; L296-V298 HydrophobicContact CD2-CG2 4.15Å; L296-V298 HydrophobicContact CG-CG2 4.08Å
297	F	98.6	Very high	96	Very high	2 Å²	2	43 Å²	43	1%	0.009	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.7	122.6	179	-80	-126.6	0	0	0	109.7	P245 V246 T247 A266 F284 A287 A288 F291 I295 I347 C351	P245-F297 WeakPolarHBondContact O-CB 3.44Å; V246-F297 WeakPolarHBondContact CA-O 3.21Å; V246-F297 HydrophobicContact CG2-CB 4.05Å; T247-F297 PolarHBondContact N-O 2.95Å; A266-F297 HydrophobicContact CB-CD2 4.32Å; A266-F297 HydrophobicContact CB-CE2 4.31Å; A266-F297 HydrophobicContact CB-CG 4.42Å; A266-F297 HydrophobicContact CB-CZ 4.45Å; A266-F297 WeakPolarHBondContact O-CA 3.39Å; F284-F297 AromaticContact CD1-CD1 4Å; F284-F297 HydrophobicContact CD1-CD1 4Å; F284-F297 AromaticContact CD2-CD1 3.74Å; F284-F297 HydrophobicContact CD2-CD1 3.74Å; F284-F297 AromaticContact CD2-CE1 3.91Å; F284-F297 HydrophobicContact CD2-CE1 3.91Å; F284-F297 HydrophobicContact CE1-CB 3.82Å; F284-F297 AromaticContact CE1-CD1 3.64Å; F284-F297 HydrophobicContact CE1-CD1 3.64Å; F284-F297 HydrophobicContact CE1-CG 4.17Å; F284-F297 AromaticContact CE2-CD1 3.35Å; F284-F297 HydrophobicContact CE2-CD1 3.35Å; F284-F297 AromaticContact CE2-CE1 3.64Å; F284-F297 HydrophobicContact CE2-CE1 3.64Å; F284-F297 HydrophobicContact CE2-CG 4.33Å; F284-F297 HydrophobicContact CG-CD1 4.05Å; F284-F297 HydrophobicContact CZ-CB 3.94Å; F284-F297 AromaticContact CZ-CD1 3.3Å; F284-F297 HydrophobicContact CZ-CD1 3.3Å; F284-F297 HydrophobicContact CZ-CE1 4.06Å; F284-F297 AromaticContact CZ-CG 3.9Å; F284-F297 HydrophobicContact CZ-CG 3.9Å; A287-F297 HydrophobicContact CB-CE1 4.16Å; A288-F297 HydrophobicContact CB-CB 3.75Å; A288-F297 HydrophobicContact CB-CD1 3.51Å; A288-F297 HydrophobicContact CB-CD2 3.93Å; A288-F297 HydrophobicContact CB-CE1 4.05Å; A288-F297 HydrophobicContact CB-CE2 4.44Å; A288-F297 HydrophobicContact CB-CG 3.46Å; A288-F297 VanDerWaalsContact CB-CG 3.46Å; A288-F297 HydrophobicContact CB-CZ 4.49Å; F291-F297 HydrophobicContact CB-CE2 3.86Å; F291-F297 HydrophobicContact CB-CZ 4.48Å; F291-F297 AromaticContact CD2-CE2 3.97Å; F291-F297 HydrophobicContact CD2-CE2 3.97Å; F291-F297 AromaticContact CD2-CZ 3.73Å; F291-F297 HydrophobicContact CD2-CZ 3.73Å; F291-F297 HydrophobicContact CE2-CZ 4.46Å; F291-F297 HydrophobicContact CG-CE2 4.27Å; F291-F297 HydrophobicContact CG-CZ 4.45Å; I295-F297 HydrophobicContact CB-CD2 4.37Å; I295-F297 HydrophobicContact CB-CE2 3.96Å; I295-F297 HydrophobicContact CG2-CD2 3.97Å; I295-F297 HydrophobicContact CG2-CE2 3.72Å; F297-I347 HydrophobicContact CE1-CG2 4.03Å; F297-C351 VanDerWaalsContact CZ-SG 3.6Å
298	V	98.4	Very high	95.8	Very high	1 Å²	1	44.3 Å²	44.3	1%	0.006	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	131.4	-173	-178.6	0	0	0	0	109.5	T247 I257 A266 L267 L268 L296 V300	T247-V298 CarbonylContact O-C 3.56Å; T247-V298 VanDerWaalsContact O-CA 3.28Å; T247-V298 WeakPolarHBondContact O-CA 3.44Å; I257-V298 HydrophobicContact CD1-CG1 4.04Å; I257-V298 HydrophobicContact CG2-CG1 4.45Å; I257-V298 HydrophobicContact CG2-CG2 3.76Å; A266-V298 PolarHBondContact O-N 2.76Å; L267-V298 CarbonylContact C-O 3.56Å; L267-V298 VanDerWaalsContact CA-O 3.3Å; L267-V298 WeakPolarHBondContact CA-O 3.42Å; L267-V298 HydrophobicContact CG-CB 4.25Å; L268-V298 PolarHBondContact N-O 3.43Å; L296-V298 HydrophobicContact CD2-CG2 4.15Å; L296-V298 HydrophobicContact CG-CG2 4.08Å; V298-V300 HydrophobicContact CG1-CG2 4.36Å
299	L	98.4	Very high	95.5	Very high	4 Å²	4	54.4 Å²	54.4	2%	0.021	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.2	133	172	178.3	150.4	0	0	0	110.1	V246 T247 E248 Y249 V270 K272 F277 F281	V246-L299 HydrophobicContact CG1-CB 3.87Å; T247-L299 PolarHBondContact O-N 2.93Å; E248-L299 CarbonylContact C-O 3.5Å; E248-L299 WeakPolarHBondContact CA-O 3.28Å; E248-L299 HydrophobicContact CB-CB 4.45Å; E248-L299 HydrophobicContact CB-CD2 4.05Å; E248-L299 HydrophobicContact CG-CD2 3.7Å; Y249-L299 PolarHBondContact N-O 3.02Å; V270-L299 HydrophobicContact CG1-CD1 4.07Å; V270-L299 HydrophobicContact CG1-CG 4.12Å; K272-L299 HydrophobicContact CD-CD2 4.22Å; F277-L299 HydrophobicContact CE2-CD1 3.85Å; F277-L299 HydrophobicContact CZ-CD1 4.14Å; F281-L299 HydrophobicContact CD2-CD1 3.54Å; F281-L299 HydrophobicContact CE2-CD1 3.84Å
300	V	98.3	Very high	95.4	Very high	0 Å²	0	50.9 Å²	50.9	0%	0	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	112	175.9	-175.9	0	0	0	0	108.6	L267 L268 F269 V270 V298 V302 N307 L310	L267-V300 HydrophobicContact CB-CG2 4.4Å; L267-V300 HydrophobicContact CD2-CG2 4.01Å; L268-V300 PolarHBondContact O-N 3.21Å; F269-V300 WeakPolarHBondContact CA-O 3.36Å; F269-V300 HydrophobicContact CD1-CB 3.82Å; F269-V300 HydrophobicContact CD1-CG1 3.74Å; F269-V300 HydrophobicContact CD1-CG2 4.43Å; F269-V300 HydrophobicContact CE1-CB 3.98Å; F269-V300 HydrophobicContact CE1-CG1 3.75Å; F269-V300 HydrophobicContact CE1-CG2 4.16Å; F269-V300 HydrophobicContact CG-CB 4.38Å; F269-V300 HydrophobicContact CZ-CG2 4.41Å; V270-V300 PolarHBondContact N-O 3.08Å; V298-V300 HydrophobicContact CG1-CG2 4.36Å; V300-V302 PolarHBondContact O-N 3.05Å; V300-N307 HydrophobicContact CG1-CB 4.13Å; V300-L310 HydrophobicContact CB-CD2 4.47Å; V300-L310 HydrophobicContact CG1-CD2 3.92Å; V300-L310 HydrophobicContact CG2-CD2 3.64Å
301	N	97.3	Very high	95.3	Very high	24 Å²	24	49.2 Å²	49.2	13%	0.128	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.5	119.5	173.2	-175.3	18	0	0	0	110.2	V270 K272 D303 E304 N307	V270-N301 WeakPolarHBondContact O-CA 3.4Å; V270-N301 PolarHBondContact O-OD1 2.95Å; K272-N301 HydrophobicContact CD-CB 3.8Å; K272-N301 HydrophobicContact CG-CB 4.14Å; K272-N301 PolarHBondContact N-OD1 3.26Å; N301-D303 VanDerWaalsContact C-N 3.28Å; N301-D303 PolarHBondContact O-N 3.01Å; N301-D303 PolarHBondContact OD1-N 2.91Å; N301-E304 HydrophobicContact CB-CB 4.18Å; N301-E304 PolarHBondContact O-N 3.18Å; N301-N307 PolarHBondContact O-ND2 3.34Å
302	V	95.8	Very high	94.9	Very high	8 Å²	8	55.6 Å²	55.6	5%	0.048	25%	0.253	C	S	.	.	T	Hydrogen-bonded Turn	trans	-74.8	-17.3	179.4	-60.2	0	0	0	0	113.7	F269 V270 N271 V300 E304 M311 A321	F269-V302 HydrophobicContact CB-CG1 3.92Å; F269-V302 HydrophobicContact CD1-CG1 4.4Å; V270-V302 PolarHBondContact O-N 2.91Å; N271-V302 HydrophobicContact CB-CG2 3.9Å; V300-V302 PolarHBondContact O-N 3.05Å; V302-E304 VanDerWaalsContact C-N 3.32Å; V302-M311 HydrophobicContact CB-CE 3.99Å; V302-M311 HydrophobicContact CB-SD 4.27Å; V302-M311 HydrophobicContact CG1-CE 4Å; V302-M311 HydrophobicContact CG1-SD 4.34Å; V302-A321 HydrophobicContact CG1-CB 3.89Å; V302-A321 HydrophobicContact CG2-CB 4.03Å
303	D	94.8	Very high	94.6	Very high	59 Å²	59	59.5 Å²	59.5	32%	0.316	27%	0.269	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.5	-10.5	175.6	-76.3	1.4	0	0	0	112.8	N271 N301 H305 H318	N271-D303 VanDerWaalsContact ND2-CG 3.28Å; N271-D303 PolarHBondContact ND2-OD1 3.48Å; N271-D303 PolarHBondContact ND2-OD2 3.27Å; N271-D303 PolarHBondContact OD1-OD2 3.28Å; N301-D303 VanDerWaalsContact C-N 3.28Å; N301-D303 PolarHBondContact O-N 3.01Å; N301-D303 PolarHBondContact OD1-N 2.91Å; D303-H305 PolarHBondContact O-N 3.09Å; D303-H318 IonicContact OD1-CD2 2.93Å; D303-H318 IonicContact OD1-CE1 3.64Å; D303-H318 IonicContact OD1-NE2 3.82Å; D303-H318 PolarHBondContact OD1-NE2 2.9Å
304	E	95.1	Very high	94.4	Very high	52 Å²	52	56.5 Å²	56.5	24%	0.243	25%	0.253	C	S	.	.			trans	-85	105.3	178.3	170.8	56.7	-108.8	0	0	110.4	N301 V302 R306 N307	N301-E304 HydrophobicContact CB-CB 4.18Å; N301-E304 PolarHBondContact O-N 3.18Å; V302-E304 VanDerWaalsContact C-N 3.32Å; E304-R306 VanDerWaalsContact CD-NE 3.33Å; E304-R306 HydrophobicContact CG-CB 4.25Å; E304-R306 PolarHBondContact O-N 3.33Å; E304-R306 VanDerWaalsContact O-N 3.08Å; E304-R306 VanDerWaalsContact OE1-CB 3.31Å; E304-R306 WeakPolarHBondContact OE1-CB 3.41Å; E304-R306 WeakPolarHBondContact OE1-CG 3.29Å; E304-R306 IonicContact OE1-CZ 3.17Å; E304-R306 PolarHBondContact OE1-N 2.96Å; E304-R306 IonicContact OE1-NE 2.6Å; E304-R306 PolarHBondContact OE1-NE 2.79Å; E304-R306 IonicContact OE1-NH2 2.91Å; E304-R306 IonicContact OE2-CZ 2.7Å; E304-R306 IonicContact OE2-NE 3.31Å; E304-R306 PolarHBondContact OE2-NE 2.88Å; E304-R306 IonicContact OE2-NH2 3.46Å; E304-R306 PolarHBondContact OE2-NH2 3.38Å; E304-N307 VanDerWaalsContact O-CB 3.3Å; E304-N307 WeakPolarHBondContact O-CB 3.45Å; E304-N307 PolarHBondContact O-N 3.1Å
305	H	91.4	Very high	93.9	Very high	179 Å²	179	56.4 Å²	56.4	83%	0.829	25%	0.249	S	C	*	.	G	3₁₀ helix	trans	-55.5	-29.9	-177.1	-66.4	-61.3	0	0	0	114.3	D303 N307 G308	D303-H305 PolarHBondContact O-N 3.09Å; H305-N307 PolarHBondContact O-N 3.29Å; H305-G308 PolarHBondContact O-N 2.74Å
306	R	92.1	Very high	93.4	Very high	178 Å²	178	56.4 Å²	56.4	67%	0.672	25%	0.25	S	C	*	.	G	3₁₀ helix	trans	-64.8	-19.1	176.5	-67.2	174.7	-70.4	176.2	0.8	113.1	E304 G308	E304-R306 VanDerWaalsContact CD-NE 3.33Å; E304-R306 HydrophobicContact CG-CB 4.25Å; E304-R306 PolarHBondContact O-N 3.33Å; E304-R306 VanDerWaalsContact O-N 3.08Å; E304-R306 VanDerWaalsContact OE1-CB 3.31Å; E304-R306 WeakPolarHBondContact OE1-CB 3.41Å; E304-R306 WeakPolarHBondContact OE1-CG 3.29Å; E304-R306 IonicContact OE1-CZ 3.17Å; E304-R306 PolarHBondContact OE1-N 2.96Å; E304-R306 IonicContact OE1-NE 2.6Å; E304-R306 PolarHBondContact OE1-NE 2.79Å; E304-R306 IonicContact OE1-NH2 2.91Å; E304-R306 IonicContact OE2-CZ 2.7Å; E304-R306 IonicContact OE2-NE 3.31Å; E304-R306 PolarHBondContact OE2-NE 2.88Å; E304-R306 IonicContact OE2-NH2 3.46Å; E304-R306 PolarHBondContact OE2-NH2 3.38Å; R306-G308 VanDerWaalsContact C-N 3.29Å; R306-G308 PolarHBondContact O-N 3.19Å
307	N	94.8	Very high	92.9	Very high	4 Å²	4	59 Å²	59	2%	0.021	26%	0.259	C	S	.	.	G	3₁₀ helix	trans	-81.6	-3	178.7	-65.3	-17	0	0	0	113.5	Y249 V300 N301 E304 H305 R309 L310 M311	Y249-N307 WeakPolarHBondContact CD1-OD1 3.49Å; V300-N307 HydrophobicContact CG1-CB 4.13Å; N301-N307 PolarHBondContact O-ND2 3.34Å; E304-N307 VanDerWaalsContact O-CB 3.3Å; E304-N307 WeakPolarHBondContact O-CB 3.45Å; E304-N307 PolarHBondContact O-N 3.1Å; H305-N307 PolarHBondContact O-N 3.29Å; N307-R309 VanDerWaalsContact C-N 3.33Å; N307-R309 PolarHBondContact O-N 2.72Å; N307-L310 WeakPolarHBondContact O-CA 3.45Å; N307-L310 WeakPolarHBondContact O-CB 3.39Å; N307-L310 PolarHBondContact O-N 3.06Å; N307-M311 PolarHBondContact O-N 2.65Å
308	G	92.1	Very high	92.3	Very high	26 Å²	26	63.4 Å²	63.4	27%	0.268	28%	0.279	S	S	.	.	H	α-helix	trans	-51.5	-45.1	-176.1	0	0	0	0	0	114.4	H305 R306 L310 M311 E312	H305-G308 PolarHBondContact O-N 2.74Å; R306-G308 VanDerWaalsContact C-N 3.29Å; R306-G308 PolarHBondContact O-N 3.19Å; G308-L310 VanDerWaalsContact C-N 3.33Å; G308-L310 PolarHBondContact O-N 3.2Å; G308-M311 WeakPolarHBondContact O-CB 3Å; G308-M311 PolarHBondContact O-N 3.27Å; G308-E312 WeakPolarHBondContact O-CB 3.4Å; G308-E312 VanDerWaalsContact O-CG 3.31Å; G308-E312 WeakPolarHBondContact O-CG 3.42Å; G308-E312 PolarHBondContact O-N 3.44Å
309	R	91.3	Very high	91.6	Very high	213 Å²	213	66.3 Å²	66.3	80%	0.804	29%	0.292	S	S	*	.	H	α-helix	trans	-63.9	-36.4	177.4	-70.4	-176	179.5	173	0.4	113.4	N307 Y313	N307-R309 VanDerWaalsContact C-N 3.33Å; N307-R309 PolarHBondContact O-N 2.72Å; R309-Y313 PolarHBondContact O-N 2.96Å
310	L	92.6	Very high	90.9	Very high	28 Å²	28	67.6 Å²	67.6	15%	0.147	30%	0.299	C	S	.	.	H	α-helix	trans	-67.7	-46.6	176.6	-172.9	70.9	0	0	0	109.5	Y249 L267 V300 N307 G308 E312 Y313 F314	Y249-L310 HydrophobicContact CD1-CD2 3.63Å; Y249-L310 HydrophobicContact CD2-CD2 4.34Å; Y249-L310 HydrophobicContact CE1-CD2 3.85Å; Y249-L310 HydrophobicContact CG-CD2 3.89Å; L267-L310 HydrophobicContact CD2-CD2 4.4Å; V300-L310 HydrophobicContact CB-CD2 4.47Å; V300-L310 HydrophobicContact CG1-CD2 3.92Å; V300-L310 HydrophobicContact CG2-CD2 3.64Å; N307-L310 WeakPolarHBondContact O-CA 3.45Å; N307-L310 WeakPolarHBondContact O-CB 3.39Å; N307-L310 PolarHBondContact O-N 3.06Å; G308-L310 VanDerWaalsContact C-N 3.33Å; G308-L310 PolarHBondContact O-N 3.2Å; L310-E312 VanDerWaalsContact C-N 3.32Å; L310-E312 PolarHBondContact O-N 3.48Å; L310-Y313 WeakPolarHBondContact O-CB 3.4Å; L310-Y313 PolarHBondContact O-N 2.85Å; L310-F314 HydrophobicContact CD1-CD2 4.06Å; L310-F314 HydrophobicContact CD1-CE2 3.65Å; L310-F314 HydrophobicContact CG-CD2 4.11Å; L310-F314 HydrophobicContact CG-CE2 4.14Å; L310-F314 VanDerWaalsContact O-CD2 3.27Å; L310-F314 WeakPolarHBondContact O-CD2 3.49Å; L310-F314 PolarHBondContact O-N 2.81Å; L310-F314 VanDerWaalsContact O-N 3.09Å
311	M	92.4	Very high	90.5	Very high	21 Å²	21	68.9 Å²	68.9	10%	0.103	31%	0.309	C	S	.	.	H	α-helix	trans	-58.9	-41.9	175.7	-71.2	176.8	65.8	0	0	112.2	F269 V302 N307 G308 F314 R315 V316	F269-M311 HydrophobicContact CD1-CG 4.1Å; F269-M311 HydrophobicContact CE1-CG 3.97Å; V302-M311 HydrophobicContact CB-CE 3.99Å; V302-M311 HydrophobicContact CB-SD 4.27Å; V302-M311 HydrophobicContact CG1-CE 4Å; V302-M311 HydrophobicContact CG1-SD 4.34Å; N307-M311 PolarHBondContact O-N 2.65Å; G308-M311 WeakPolarHBondContact O-CB 3Å; G308-M311 PolarHBondContact O-N 3.27Å; M311-F314 CarbonylContact O-C 3.57Å; M311-F314 PolarHBondContact O-N 3.06Å; M311-R315 WeakPolarHBondContact O-CA 3.46Å; M311-R315 PolarHBondContact O-N 3.32Å; M311-V316 WeakPolarHBondContact CB-O 3.43Å; M311-V316 WeakPolarHBondContact CE-O 3.48Å; M311-V316 PolarHBondContact O-N 3.1Å
312	E	88.9	Confident	90.2	Very high	144 Å²	144	70.7 Å²	70.7	67%	0.673	32%	0.323	S	S	*	.	H	α-helix	trans	-61.4	-45.5	173.8	-75.9	169.3	-176.5	0	0	112.2	G308 L310 F314 R315	G308-E312 WeakPolarHBondContact O-CB 3.4Å; G308-E312 VanDerWaalsContact O-CG 3.31Å; G308-E312 WeakPolarHBondContact O-CG 3.42Å; G308-E312 PolarHBondContact O-N 3.44Å; L310-E312 VanDerWaalsContact C-N 3.32Å; L310-E312 PolarHBondContact O-N 3.48Å; E312-F314 VanDerWaalsContact C-N 3.29Å; E312-F314 PolarHBondContact O-N 3.17Å; E312-R315 PolarHBondContact O-N 2.75Å
313	Y	88.9	Confident	90	Very high	108 Å²	108	71 Å²	71	42%	0.424	32%	0.323	S	S	.	.	H	α-helix	trans	-56.8	-44.3	176.8	177	-90.4	0	0	0	111.7	R309 L310 R315	R309-Y313 PolarHBondContact O-N 2.96Å; L310-Y313 WeakPolarHBondContact O-CB 3.4Å; L310-Y313 PolarHBondContact O-N 2.85Å; Y313-R315 VanDerWaalsContact C-N 3.31Å
314	F	89.8	Confident	90	Very high	10 Å²	10	68.2 Å²	68.2	4%	0.044	31%	0.309	C	S	.	.	T	Hydrogen-bonded Turn	trans	-85.3	-0.6	178.4	-73.5	-76.5	0	0	0	114.5	L267 F269 L310 M311 E312 V316 R325 V327 T334	L267-F314 HydrophobicContact CD1-CE1 3.75Å; L267-F314 HydrophobicContact CD1-CE2 4.17Å; L267-F314 HydrophobicContact CD1-CZ 3.48Å; L267-F314 VanDerWaalsContact CD1-CZ 3.48Å; L267-F314 HydrophobicContact CD2-CD2 4.19Å; L267-F314 HydrophobicContact CD2-CE2 3.51Å; L267-F314 HydrophobicContact CD2-CZ 3.71Å; L267-F314 HydrophobicContact CG-CE2 4.47Å; L267-F314 HydrophobicContact CG-CZ 4.24Å; F269-F314 HydrophobicContact CE2-CB 4.13Å; F269-F314 HydrophobicContact CE2-CD2 4.47Å; F269-F314 HydrophobicContact CE2-CG 4.22Å; F269-F314 HydrophobicContact CZ-CB 3.65Å; F269-F314 AromaticContact CZ-CD2 3.67Å; F269-F314 HydrophobicContact CZ-CD2 3.67Å; F269-F314 AromaticContact CZ-CG 3.74Å; F269-F314 HydrophobicContact CZ-CG 3.74Å; L310-F314 HydrophobicContact CD1-CD2 4.06Å; L310-F314 HydrophobicContact CD1-CE2 3.65Å; L310-F314 HydrophobicContact CG-CD2 4.11Å; L310-F314 HydrophobicContact CG-CE2 4.14Å; L310-F314 VanDerWaalsContact O-CD2 3.27Å; L310-F314 WeakPolarHBondContact O-CD2 3.49Å; L310-F314 PolarHBondContact O-N 2.81Å; L310-F314 VanDerWaalsContact O-N 3.09Å; M311-F314 CarbonylContact O-C 3.57Å; M311-F314 PolarHBondContact O-N 3.06Å; E312-F314 VanDerWaalsContact C-N 3.29Å; E312-F314 PolarHBondContact O-N 3.17Å; F314-V316 HydrophobicContact CB-CG2 4.03Å; F314-V316 WeakPolarHBondContact O-CG2 3.46Å; F314-V316 PolarHBondContact O-N 2.96Å; F314-R325 HydrophobicContact CB-CG 4.29Å; F314-R325 HydrophobicContact CD1-CB 3.94Å; F314-R325 HydrophobicContact CD1-CG 4.15Å; F314-R325 HydrophobicContact CE1-CB 4.4Å; F314-R325 PolarHBondContact O-NE 3.27Å; F314-V327 HydrophobicContact CE1-CB 3.86Å; F314-V327 HydrophobicContact CE1-CG1 3.73Å; F314-V327 HydrophobicContact CE1-CG2 4.49Å; F314-V327 HydrophobicContact CZ-CB 4.33Å; F314-V327 HydrophobicContact CZ-CG1 3.71Å; F314-T334 HydrophobicContact CD1-CG2 4.1Å; F314-T334 HydrophobicContact CE1-CG2 4.14Å
315	R	86.4	Confident	90.1	Very high	115 Å²	115	66.3 Å²	66.3	43%	0.434	30%	0.299	S	S	.	.	T	Hydrogen-bonded Turn	trans	50.2	44.7	-176.6	-58.3	176.9	172.9	-141	-11.4	112.2	M311 E312 Y313 D439	M311-R315 WeakPolarHBondContact O-CA 3.46Å; M311-R315 PolarHBondContact O-N 3.32Å; E312-R315 PolarHBondContact O-N 2.75Å; Y313-R315 VanDerWaalsContact C-N 3.31Å; R315-D439 VanDerWaalsContact CD-CG 3.49Å; R315-D439 WeakPolarHBondContact CD-OD2 3.02Å; R315-D439 IonicContact CZ-OD2 3.82Å; R315-D439 IonicContact NE-OD2 3.47Å; R315-D439 PolarHBondContact NE-OD2 3.02Å; R315-D439 VanDerWaalsContact NH1-CB 3.31Å; R315-D439 IonicContact NH1-OD2 3.75Å; R315-D439 PolarHBondContact NH1-OD2 3.46Å
316	V	87.5	Confident	90.3	Very high	5 Å²	5	57.8 Å²	57.8	3%	0.03	26%	0.26	C	S	.	.			trans	-108.6	122.2	176.3	-179.6	0	0	0	0	108.1	F269 M311 F314 D320 R325	F269-V316 HydrophobicContact CB-CG1 3.89Å; F269-V316 HydrophobicContact CD1-CB 4.13Å; F269-V316 HydrophobicContact CD1-CG1 3.99Å; F269-V316 HydrophobicContact CD1-CG2 4.47Å; F269-V316 HydrophobicContact CD2-CB 4.41Å; F269-V316 HydrophobicContact CD2-CG1 4.26Å; F269-V316 HydrophobicContact CD2-CG2 3.94Å; F269-V316 HydrophobicContact CE1-CB 4.3Å; F269-V316 HydrophobicContact CE1-CG2 4.46Å; F269-V316 HydrophobicContact CE2-CG2 3.93Å; F269-V316 HydrophobicContact CG-CB 4.19Å; F269-V316 HydrophobicContact CG-CG1 3.78Å; F269-V316 HydrophobicContact CG-CG2 4.22Å; F269-V316 HydrophobicContact CZ-CG2 4.21Å; M311-V316 WeakPolarHBondContact CB-O 3.43Å; M311-V316 WeakPolarHBondContact CE-O 3.48Å; M311-V316 PolarHBondContact O-N 3.1Å; F314-V316 HydrophobicContact CB-CG2 4.03Å; F314-V316 WeakPolarHBondContact O-CG2 3.46Å; F314-V316 PolarHBondContact O-N 2.96Å; V316-D320 HydrophobicContact CG1-CB 4.12Å; V316-R325 HydrophobicContact CG2-CG 3.88Å
317	R	86.1	Confident	90.5	Very high	58 Å²	58	49.3 Å²	49.3	22%	0.219	23%	0.228	C	C	.	.			trans	-94.5	164.3	174.2	-61.5	158.5	-64.2	-176	8.3	109.5	F319 D320 M442 Y448	R317-F319 VanDerWaalsContact C-N 3.29Å; R317-F319 HydrophobicContact CB-CD1 4.01Å; R317-F319 HydrophobicContact CB-CE1 3.69Å; R317-F319 HydrophobicContact CB-CE2 4.48Å; R317-F319 HydrophobicContact CB-CZ 3.99Å; R317-F319 VanDerWaalsContact CD-CZ 3.47Å; R317-F319 HydrophobicContact CG-CE1 4.25Å; R317-F319 HydrophobicContact CG-CZ 4.34Å; R317-F319 PolarHBondContact O-N 3.08Å; R317-D320 WeakPolarHBondContact CA-OD2 3.27Å; R317-D320 VanDerWaalsContact CB-OD2 3.27Å; R317-D320 WeakPolarHBondContact CB-OD2 3.17Å; R317-D320 IonicContact CZ-OD1 2.64Å; R317-D320 IonicContact CZ-OD2 2.86Å; R317-D320 PolarHBondContact N-OD2 3.32Å; R317-D320 IonicContact NE-OD1 3.43Å; R317-D320 IonicContact NE-OD2 3.86Å; R317-D320 PolarHBondContact NE-OD2 2.99Å; R317-D320 IonicContact NH2-OD1 3.41Å; R317-D320 PolarHBondContact NH2-OD1 3.38Å; R317-D320 IonicContact NH2-OD2 2.76Å; R317-D320 PolarHBondContact NH2-OD2 3.23Å; R317-D320 WeakPolarHBondContact O-CB 3.4Å; R317-D320 PolarHBondContact O-N 3.3Å; R317-M442 PolarHBondContact NH1-O 3.21Å; R317-Y448 PolarHBondContact NH2-OH 3.1Å
318	H	86.8	Confident	90.5	Very high	95 Å²	95	50.2 Å²	50.2	44%	0.44	23%	0.233	S	C	.	.	G	3₁₀ helix	trans	-53	-45.3	-179.2	-173.7	-82.3	0	0	0	113	D303 D320 A321	D303-H318 IonicContact OD1-CD2 2.93Å; D303-H318 IonicContact OD1-CE1 3.64Å; D303-H318 IonicContact OD1-NE2 3.82Å; D303-H318 PolarHBondContact OD1-NE2 2.9Å; H318-D320 VanDerWaalsContact C-N 3.28Å; H318-D320 PolarHBondContact O-N 3.4Å; H318-A321 WeakPolarHBondContact O-CB 3.17Å; H318-A321 PolarHBondContact O-N 3.06Å
319	F	83.6	Confident	90.4	Very high	62 Å²	62	51.9 Å²	51.9	27%	0.272	24%	0.235	S	C	.	.	G	3₁₀ helix	trans	-77.2	-7.8	-179.6	62.2	-100.8	0	0	0	114.7	R317 A321 M444 G446 Y448	R317-F319 VanDerWaalsContact C-N 3.29Å; R317-F319 HydrophobicContact CB-CD1 4.01Å; R317-F319 HydrophobicContact CB-CE1 3.69Å; R317-F319 HydrophobicContact CB-CE2 4.48Å; R317-F319 HydrophobicContact CB-CZ 3.99Å; R317-F319 VanDerWaalsContact CD-CZ 3.47Å; R317-F319 HydrophobicContact CG-CE1 4.25Å; R317-F319 HydrophobicContact CG-CZ 4.34Å; R317-F319 PolarHBondContact O-N 3.08Å; F319-A321 VanDerWaalsContact C-N 3.26Å; F319-M444 WeakPolarHBondContact CE1-O 3.35Å; F319-M444 WeakPolarHBondContact CZ-O 3.44Å; F319-G446 WeakPolarHBondContact CD2-O 3.33Å; F319-G446 WeakPolarHBondContact CE2-O 3.35Å; F319-Y448 HydrophobicContact CE2-CE2 4.37Å
320	D	83.4	Confident	90.4	Very high	31 Å²	31	46.6 Å²	46.6	17%	0.166	23%	0.227	C	C	.	.	G	3₁₀ helix	trans	-78.1	-17.6	173.2	-61.7	-47.2	0	0	0	110.4	V316 R317 H318 H323 Y448	V316-D320 HydrophobicContact CG1-CB 4.12Å; R317-D320 WeakPolarHBondContact CA-OD2 3.27Å; R317-D320 VanDerWaalsContact CB-OD2 3.27Å; R317-D320 WeakPolarHBondContact CB-OD2 3.17Å; R317-D320 IonicContact CZ-OD1 2.64Å; R317-D320 IonicContact CZ-OD2 2.86Å; R317-D320 PolarHBondContact N-OD2 3.32Å; R317-D320 IonicContact NE-OD1 3.43Å; R317-D320 IonicContact NE-OD2 3.86Å; R317-D320 PolarHBondContact NE-OD2 2.99Å; R317-D320 IonicContact NH2-OD1 3.41Å; R317-D320 PolarHBondContact NH2-OD1 3.38Å; R317-D320 IonicContact NH2-OD2 2.76Å; R317-D320 PolarHBondContact NH2-OD2 3.23Å; R317-D320 WeakPolarHBondContact O-CB 3.4Å; R317-D320 PolarHBondContact O-N 3.3Å; H318-D320 VanDerWaalsContact C-N 3.28Å; H318-D320 PolarHBondContact O-N 3.4Å; D320-H323 WeakPolarHBondContact O-CB 3.34Å; D320-Y448 WeakPolarHBondContact OD1-CE2 3.3Å
321	A	89.2	Confident	90.2	Very high	26 Å²	26	49.2 Å²	49.2	22%	0.215	24%	0.241	C	C	.	.			trans	-75.2	146.7	179.7	0	0	0	0	0	112.8	V302 H318 F319	V302-A321 HydrophobicContact CG1-CB 3.89Å; V302-A321 HydrophobicContact CG2-CB 4.03Å; H318-A321 WeakPolarHBondContact O-CB 3.17Å; H318-A321 PolarHBondContact O-N 3.06Å; F319-A321 VanDerWaalsContact C-N 3.26Å
322	P	92.3	Very high	90.1	Very high	63 Å²	63	54.2 Å²	54.2	41%	0.409	26%	0.264	S	S	.	.	S	Bend	cis	-79.3	136	3.2	33.5	-36.5	0	0	0	112.9	F269 V270 I280 L342	F269-P322 CarbonylContact O-C 3.58Å; F269-P322 VanDerWaalsContact O-CA 3.28Å; F269-P322 WeakPolarHBondContact O-CA 3.42Å; V270-P322 HydrophobicContact CG2-CB 4.17Å; I280-P322 HydrophobicContact CD1-CB 3.83Å; I280-P322 HydrophobicContact CD1-CG 3.69Å; P322-L342 HydrophobicContact CB-CD1 3.79Å; P322-L342 HydrophobicContact CG-CD1 4.14Å
323	H	90.6	Very high	90.1	Very high	14 Å²	14	50.5 Å²	50.5	7%	0.065	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.3	146.7	-174.8	-159.2	55.1	0	0	0	113.3	F269 D320 R325 Q336 M337	F269-H323 PolarHBondContact N-O 3.11Å; F269-H323 PolarHBondContact O-N 3.24Å; D320-H323 WeakPolarHBondContact O-CB 3.34Å; H323-R325 PolarHBondContact NE2-NH1 2.91Å; H323-Q336 PolarHBondContact CE1-NE2 3.46Å; H323-Q336 WeakPolarHBondContact NE2-CG 3.45Å; H323-Q336 PolarHBondContact NE2-NE2 3.35Å; H323-M337 PolarHBondContact CE1-O 3.29Å
324	I	95.9	Very high	90.3	Very high	1 Å²	1	46.7 Å²	46.7	1%	0.005	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114	125.2	177.2	-62.5	174.2	0	0	0	110.9	L267 L268 F284 M337 L342 I347 F350	L267-I324 WeakPolarHBondContact O-CA 3.3Å; L268-I324 HydrophobicContact CB-CG1 4.38Å; L268-I324 HydrophobicContact CD1-CD1 4.33Å; L268-I324 HydrophobicContact CD1-CG1 3.78Å; F284-I324 HydrophobicContact CD2-CD1 3.68Å; F284-I324 HydrophobicContact CD2-CG1 4.46Å; F284-I324 HydrophobicContact CE2-CD1 3.83Å; F284-I324 HydrophobicContact CE2-CG1 4.27Å; F284-I324 HydrophobicContact CE2-CG2 4.42Å; I324-M337 HydrophobicContact CB-CB 4.03Å; I324-M337 HydrophobicContact CB-SD 4.22Å; I324-M337 HydrophobicContact CD1-SD 3.87Å; I324-M337 HydrophobicContact CG2-CB 4.48Å; I324-M337 PolarHBondContact O-N 3.06Å; I324-L342 HydrophobicContact CD1-CD2 4.07Å; I324-L342 HydrophobicContact CG1-CD2 4.38Å; I324-I347 HydrophobicContact CD1-CD1 4.02Å; I324-I347 HydrophobicContact CD1-CG1 3.8Å; I324-I347 HydrophobicContact CD1-CG2 4.36Å; I324-F350 HydrophobicContact CG2-CD1 4.44Å; I324-F350 HydrophobicContact CG2-CE1 4.17Å
325	R	95.5	Very high	90.5	Very high	12 Å²	12	47.7 Å²	47.7	5%	0.045	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108	148	168.1	-67.6	-83.2	-179.2	-123.5	-0.4	109.2	A266 L267 F269 F314 V316 H323 Y335	A266-R325 CarbonylContact C-O 3.46Å; A266-R325 WeakPolarHBondContact CA-O 3.24Å; L267-R325 PolarHBondContact N-O 3.37Å; L267-R325 PolarHBondContact O-N 3.07Å; F269-R325 HydrophobicContact CD2-CG 4.2Å; F269-R325 HydrophobicContact CE2-CB 3.94Å; F269-R325 HydrophobicContact CE2-CG 3.72Å; F314-R325 HydrophobicContact CB-CG 4.29Å; F314-R325 HydrophobicContact CD1-CB 3.94Å; F314-R325 HydrophobicContact CD1-CG 4.15Å; F314-R325 HydrophobicContact CE1-CB 4.4Å; F314-R325 PolarHBondContact O-NE 3.27Å; V316-R325 HydrophobicContact CG2-CG 3.88Å; H323-R325 PolarHBondContact NE2-NH1 2.91Å; R325-Y335 WeakPolarHBondContact CA-O 3.4Å
326	L	97.1	Very high	90.7	Very high	0 Å²	0	43.1 Å²	43.1	0%	0	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	141	167	-169.2	158.4	0	0	0	109.1	H265 A266 I295 T334 Y335 F350 Y354	H265-L326 CarbonylContact O-C 3.55Å; H265-L326 VanDerWaalsContact O-CA 3.25Å; H265-L326 WeakPolarHBondContact O-CA 3.49Å; A266-L326 HydrophobicContact CB-CD1 4.48Å; I295-L326 HydrophobicContact CD1-CD1 4.12Å; I295-L326 HydrophobicContact CG2-CD1 4.48Å; L326-T334 CarbonylContact O-C 3.45Å; L326-T334 VanDerWaalsContact O-CA 3.25Å; L326-T334 WeakPolarHBondContact O-CA 3.24Å; L326-Y335 HydrophobicContact CD2-CD2 4.23Å; L326-Y335 PolarHBondContact N-O 3.49Å; L326-Y335 PolarHBondContact O-N 3.41Å; L326-F350 HydrophobicContact CB-CE1 3.92Å; L326-F350 HydrophobicContact CB-CZ 4.06Å; L326-F350 HydrophobicContact CD1-CE1 4.37Å; L326-Y354 HydrophobicContact CD1-CD1 3.58Å; L326-Y354 HydrophobicContact CD1-CD2 4.42Å; L326-Y354 HydrophobicContact CD1-CE1 4.19Å; L326-Y354 HydrophobicContact CD1-CG 3.7Å; L326-Y354 HydrophobicContact CD2-CD1 3.51Å; L326-Y354 HydrophobicContact CD2-CD2 3.54Å; L326-Y354 HydrophobicContact CD2-CE1 3.37Å; L326-Y354 HydrophobicContact CD2-CE2 3.38Å; L326-Y354 HydrophobicContact CD2-CG 3.58Å; L326-Y354 HydrophobicContact CG-CD1 4.23Å; L326-Y354 HydrophobicContact CG-CE1 4.42Å; L326-Y354 HydrophobicContact CG-CG 4.31Å
327	V	95.9	Very high	90.9	Very high	0 Å²	0	43.2 Å²	43.2	0%	0	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137	147.9	175.6	62.6	0	0	0	0	111.5	N264 H265 L267 F314 L329 I333 T334	N264-V327 CarbonylContact C-O 3.59Å; N264-V327 WeakPolarHBondContact CA-O 3.48Å; H265-V327 HydrophobicContact CB-CG1 4.06Å; H265-V327 PolarHBondContact N-O 3.3Å; H265-V327 PolarHBondContact O-N 2.98Å; L267-V327 HydrophobicContact CD1-CG1 3.94Å; F314-V327 HydrophobicContact CE1-CB 3.86Å; F314-V327 HydrophobicContact CE1-CG1 3.73Å; F314-V327 HydrophobicContact CE1-CG2 4.49Å; F314-V327 HydrophobicContact CZ-CB 4.33Å; F314-V327 HydrophobicContact CZ-CG1 3.71Å; V327-L329 HydrophobicContact CG1-CD2 4.09Å; V327-I333 WeakPolarHBondContact CA-O 3.01Å; V327-T334 HydrophobicContact CB-CG2 4.21Å; V327-T334 HydrophobicContact CG2-CG2 4.02Å
328	N	94.5	Very high	91	Very high	23 Å²	23	44.9 Å²	44.9	12%	0.123	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.1	125.4	159.9	-173.5	-72.3	0	0	0	109.3	L263 N264 T330 D331 Q332 I333 Y354	L263-N328 WeakPolarHBondContact O-CA 3.46Å; N264-N328 PolarHBondContact OD1-ND2 3.19Å; N328-T330 PolarHBondContact O-N 3Å; N328-T330 WeakPolarHBondContact OD1-CA 3.22Å; N328-T330 WeakPolarHBondContact OD1-CB 3.47Å; N328-T330 PolarHBondContact OD1-N 3.35Å; N328-T330 PolarHBondContact OD1-OG1 3.38Å; N328-D331 WeakPolarHBondContact CB-OD1 3.49Å; N328-Q332 VanDerWaalsContact O-CA 3.24Å; N328-Q332 WeakPolarHBondContact O-CA 3.44Å; N328-Q332 PolarHBondContact O-N 3.16Å; N328-I333 PolarHBondContact N-O 3.26Å; N328-Y354 WeakPolarHBondContact CB-OH 3.28Å
329	L	90.9	Very high	90.9	Very high	60 Å²	60	42 Å²	42	31%	0.314	23%	0.226	S	C	.	.	T	Hydrogen-bonded Turn	trans	-71.1	-11.9	-176.8	-62.2	-175.1	0	0	0	114.1	L263 H265 V327	L263-L329 PolarHBondContact O-N 3.2Å; H265-L329 VanDerWaalsContact CE1-CD1 3.49Å; H265-L329 WeakPolarHBondContact CE1-CD1 3.47Å; V327-L329 HydrophobicContact CG1-CD2 4.09Å
330	T	89.3	Confident	90.6	Very high	103 Å²	103	43.8 Å²	43.8	63%	0.632	24%	0.236	S	C	*	.	T	Hydrogen-bonded Turn	trans	-79.4	-52.3	177.9	-40.5	0	0	0	0	111.6	L263 N328	L263-T330 WeakPolarHBondContact CD1-OG1 3.18Å; N328-T330 PolarHBondContact O-N 3Å; N328-T330 WeakPolarHBondContact OD1-CA 3.22Å; N328-T330 WeakPolarHBondContact OD1-CB 3.47Å; N328-T330 PolarHBondContact OD1-N 3.35Å; N328-T330 PolarHBondContact OD1-OG1 3.38Å
331	D	89.9	Confident	90.5	Very high	82 Å²	82	46.3 Å²	46.3	44%	0.439	25%	0.252	S	S	.	.	T	Hydrogen-bonded Turn	trans	-95.5	-12.2	-177.5	63.6	22.8	0	0	0	113	N328 I333	N328-D331 WeakPolarHBondContact CB-OD1 3.49Å; D331-I333 HydrophobicContact CB-CD1 4.12Å; D331-I333 HydrophobicContact CB-CG1 4.02Å; D331-I333 PolarHBondContact O-N 3.34Å; D331-I333 WeakPolarHBondContact OD1-CB 3.3Å; D331-I333 PolarHBondContact OD1-N 3.07Å
332	Q	88.9	Confident	90.6	Very high	126 Å²	126	46.3 Å²	46.3	59%	0.589	25%	0.248	S	C	*	.			trans	60	17	-177.5	-56.8	-179.4	7.1	0	0	113.8	N328	N328-Q332 VanDerWaalsContact O-CA 3.24Å; N328-Q332 WeakPolarHBondContact O-CA 3.44Å; N328-Q332 PolarHBondContact O-N 3.16Å
333	I	90.4	Very high	90.7	Very high	67 Å²	67	46.5 Å²	46.5	34%	0.344	25%	0.246	S	C	.	.			trans	-76.8	128.4	177.5	-59.9	177.2	0	0	0	108.5	V327 N328 D331 Y335 P361	V327-I333 WeakPolarHBondContact CA-O 3.01Å; N328-I333 PolarHBondContact N-O 3.26Å; D331-I333 HydrophobicContact CB-CD1 4.12Å; D331-I333 HydrophobicContact CB-CG1 4.02Å; D331-I333 PolarHBondContact O-N 3.34Å; D331-I333 WeakPolarHBondContact OD1-CB 3.3Å; D331-I333 PolarHBondContact OD1-N 3.07Å; I333-Y335 HydrophobicContact CB-CE2 4.17Å; I333-Y335 HydrophobicContact CG2-CD2 4.44Å; I333-Y335 HydrophobicContact CG2-CE2 3.66Å; I333-P361 HydrophobicContact CG2-CB 3.76Å; I333-P361 HydrophobicContact CG2-CG 4.16Å
334	T	91.9	Very high	91	Very high	27 Å²	27	49.1 Å²	49.1	17%	0.166	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.3	150.4	178.5	68.6	0	0	0	0	111.3	F314 L326 V327 K362	F314-T334 HydrophobicContact CD1-CG2 4.1Å; F314-T334 HydrophobicContact CE1-CG2 4.14Å; L326-T334 CarbonylContact O-C 3.45Å; L326-T334 VanDerWaalsContact O-CA 3.25Å; L326-T334 WeakPolarHBondContact O-CA 3.24Å; V327-T334 HydrophobicContact CB-CG2 4.21Å; V327-T334 HydrophobicContact CG2-CG2 4.02Å; T334-K362 PolarHBondContact O-N 3.47Å
335	Y	93.6	Very high	91	Very high	32 Å²	32	54.1 Å²	54.1	13%	0.125	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	147.5	179.8	-61	-100.2	0	0	0	108.7	R325 L326 I333 Y354 A359 K360 P361	R325-Y335 WeakPolarHBondContact CA-O 3.4Å; L326-Y335 HydrophobicContact CD2-CD2 4.23Å; L326-Y335 PolarHBondContact N-O 3.49Å; L326-Y335 PolarHBondContact O-N 3.41Å; I333-Y335 HydrophobicContact CB-CE2 4.17Å; I333-Y335 HydrophobicContact CG2-CD2 4.44Å; I333-Y335 HydrophobicContact CG2-CE2 3.66Å; Y335-Y354 HydrophobicContact CD1-CD2 4.12Å; Y335-Y354 AromaticContact CD2-CD2 3.81Å; Y335-Y354 HydrophobicContact CD2-CD2 3.81Å; Y335-Y354 AromaticContact CD2-CE2 3.65Å; Y335-Y354 HydrophobicContact CD2-CE2 3.65Å; Y335-Y354 HydrophobicContact CE1-CD2 4.14Å; Y335-Y354 HydrophobicContact CE1-CE2 4.35Å; Y335-Y354 AromaticContact CE2-CD2 3.87Å; Y335-Y354 HydrophobicContact CE2-CD2 3.87Å; Y335-Y354 AromaticContact CE2-CE2 3.38Å; Y335-Y354 HydrophobicContact CE2-CE2 3.38Å; Y335-Y354 AromaticContact CG-CD2 3.97Å; Y335-Y354 HydrophobicContact CG-CD2 3.97Å; Y335-Y354 HydrophobicContact CG-CE2 4.28Å; Y335-Y354 AromaticContact CZ-CE2 3.76Å; Y335-A359 HydrophobicContact CD1-CB 3.71Å; Y335-A359 HydrophobicContact CE1-CB 4.21Å; Y335-A359 WeakPolarHBondContact CE1-O 3.42Å; Y335-K360 WeakPolarHBondContact CD1-O 3.37Å; Y335-P361 HydrophobicContact CE1-CB 4.31Å; Y335-P361 HydrophobicContact CE1-CG 3.85Å
336	Q	91.6	Very high	91	Very high	19 Å²	19	54.3 Å²	54.3	9%	0.089	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	129.8	-178.5	-179.1	156.9	-23.8	0	0	110.1	H323 L338 F350 K362 S436	H323-Q336 PolarHBondContact CE1-NE2 3.46Å; H323-Q336 WeakPolarHBondContact NE2-CG 3.45Å; H323-Q336 PolarHBondContact NE2-NE2 3.35Å; Q336-L338 HydrophobicContact CB-CD2 4.37Å; Q336-L338 HydrophobicContact CG-CD2 3.76Å; Q336-L338 HydrophobicContact CG-CG 4.45Å; Q336-L338 PolarHBondContact O-N 2.95Å; Q336-F350 WeakPolarHBondContact O-CE2 3.35Å; Q336-K362 HydrophobicContact CB-CD 4.42Å; Q336-S436 PolarHBondContact OE1-O 3.28Å
337	M	92.1	Very high	91	Very high	6 Å²	6	54.4 Å²	54.4	3%	0.03	29%	0.285	C	S	.	.			trans	-72.5	123.6	163.4	-171.5	170.1	170	0	0	109.1	H323 I324 L342 S346 I347 F350	H323-M337 PolarHBondContact CE1-O 3.29Å; I324-M337 HydrophobicContact CB-CB 4.03Å; I324-M337 HydrophobicContact CB-SD 4.22Å; I324-M337 HydrophobicContact CD1-SD 3.87Å; I324-M337 HydrophobicContact CG2-CB 4.48Å; I324-M337 PolarHBondContact O-N 3.06Å; M337-L342 HydrophobicContact CE-CD2 3.95Å; M337-L342 HydrophobicContact SD-CD2 3.86Å; M337-S346 VanDerWaalsContact CE-C 3.43Å; M337-S346 WeakPolarHBondContact CE-O 3.36Å; M337-S346 WeakPolarHBondContact CE-OG 3.21Å; M337-I347 HydrophobicContact CE-CG1 3.98Å; M337-I347 HydrophobicContact SD-CG1 4.14Å; M337-F350 HydrophobicContact CB-CD1 3.78Å; M337-F350 HydrophobicContact CB-CD2 4.28Å; M337-F350 HydrophobicContact CB-CE1 3.88Å; M337-F350 HydrophobicContact CB-CE2 4.38Å; M337-F350 HydrophobicContact CB-CG 3.99Å; M337-F350 HydrophobicContact CB-CZ 4.18Å; M337-F350 HydrophobicContact CG-CB 4.11Å; M337-F350 HydrophobicContact CG-CD1 4.05Å; M337-F350 HydrophobicContact CG-CD2 4.42Å; M337-F350 HydrophobicContact CG-CG 3.93Å; M337-F350 HydrophobicContact SD-CB 4.21Å; M337-F350 HydrophobicContact SD-CD1 4.19Å; M337-F350 HydrophobicContact SD-CG 4.36Å
338	L	87.2	Confident	91.1	Very high	94 Å²	94	57 Å²	57	49%	0.492	30%	0.297	S	S	.	.			trans	-106.5	81.5	-180	-60.6	176.3	0	0	0	109	Q336 Y404	Q336-L338 HydrophobicContact CB-CD2 4.37Å; Q336-L338 HydrophobicContact CG-CD2 3.76Å; Q336-L338 HydrophobicContact CG-CG 4.45Å; Q336-L338 PolarHBondContact O-N 2.95Å; L338-Y404 HydrophobicContact CB-CD1 3.78Å; L338-Y404 HydrophobicContact CB-CE1 4.2Å; L338-Y404 HydrophobicContact CB-CG 4.44Å; L338-Y404 HydrophobicContact CD2-CD1 3.81Å; L338-Y404 HydrophobicContact CD2-CE1 3.64Å; L338-Y404 HydrophobicContact CG-CD1 4.38Å
339	S	85	Confident	91.1	Very high	33 Å²	33	61.4 Å²	61.4	23%	0.231	32%	0.317	C	S	.	.			trans	-147.6	145.9	-178.8	-174.5	0	0	0	0	110.8	T341 Y404	S339-T341 PolarHBondContact OG-N 3.5Å; S339-T341 PolarHBondContact OG-O 2.81Å; S339-Y404 VanDerWaalsContact O-CE2 3.29Å; S339-Y404 WeakPolarHBondContact O-CE2 3.47Å
340	E	78.2	Confident	91.4	Very high	101 Å²	101	59.6 Å²	59.6	47%	0.472	31%	0.306	S	S	.	.	S	Bend	trans	-77.7	-27.4	169.8	-69.1	-164.7	129	0	0	112.5	Y404 S405 E406	E340-Y404 HydrophobicContact CG-CD2 3.93Å; E340-Y404 HydrophobicContact CG-CE2 4.5Å; E340-S405 VanDerWaalsContact OE1-C 3.29Å; E340-S405 WeakPolarHBondContact OE1-CA 3.3Å; E340-S405 VanDerWaalsContact OE1-CB 3.27Å; E340-S405 WeakPolarHBondContact OE1-CB 3.19Å; E340-S405 PolarHBondContact OE1-OG 2.9Å; E340-E406 PolarHBondContact OE1-N 2.99Å
341	T	81.4	Confident	91.8	Very high	83 Å²	83	54.8 Å²	54.8	51%	0.509	28%	0.276	S	S	.	.			trans	-119	135.4	-179.1	59.7	0	0	0	0	111.1	S339 N343 S346	S339-T341 PolarHBondContact OG-N 3.5Å; S339-T341 PolarHBondContact OG-O 2.81Å; T341-N343 PolarHBondContact OG1-ND2 3.01Å; T341-S346 PolarHBondContact O-OG 3.4Å
342	L	90.8	Very high	92.2	Very high	26 Å²	26	54.7 Å²	54.7	14%	0.136	27%	0.273	C	S	.	.			trans	-101.9	78.4	175.2	-59	-177.9	0	0	0	108.6	L268 I280 P322 I324 M337	L268-L342 HydrophobicContact CD1-CD1 4.18Å; I280-L342 HydrophobicContact CG2-CB 4.27Å; I280-L342 HydrophobicContact CG2-CD1 3.93Å; P322-L342 HydrophobicContact CB-CD1 3.79Å; P322-L342 HydrophobicContact CG-CD1 4.14Å; I324-L342 HydrophobicContact CD1-CD2 4.07Å; I324-L342 HydrophobicContact CG1-CD2 4.38Å; M337-L342 HydrophobicContact CE-CD2 3.95Å; M337-L342 HydrophobicContact SD-CD2 3.86Å
343	N	94.3	Very high	92.6	Very high	67 Å²	67	50.4 Å²	50.4	36%	0.358	26%	0.258	S	S	.	.			trans	-108.3	165	174.5	66.2	60.6	0	0	0	110.1	T341 E345 S346 I347	T341-N343 PolarHBondContact OG1-ND2 3.01Å; N343-E345 VanDerWaalsContact C-N 3.27Å; N343-E345 PolarHBondContact O-N 2.98Å; N343-E345 PolarHBondContact OD1-N 3.37Å; N343-S346 PolarHBondContact N-OG 2.96Å; N343-S346 PolarHBondContact O-N 3.42Å; N343-S346 PolarHBondContact O-OG 3.21Å; N343-S346 VanDerWaalsContact O-OG 3.1Å; N343-S346 PolarHBondContact OD1-N 3.26Å; N343-S346 PolarHBondContact OD1-OG 2.79Å; N343-I347 WeakPolarHBondContact O-CD1 3.45Å; N343-I347 WeakPolarHBondContact O-CG1 3.11Å; N343-I347 PolarHBondContact O-N 3.38Å
344	E	96.2	Very high	92.9	Very high	69 Å²	69	48.4 Å²	48.4	32%	0.322	25%	0.246	S	C	.	.	H	α-helix	trans	-55.7	-42.2	-174.1	-178.3	179.5	156.6	0	0	112.5	N286 A287 K348	N286-E344 VanDerWaalsContact CB-CD 3.4Å; N286-E344 HydrophobicContact CB-CG 3.96Å; N286-E344 WeakPolarHBondContact CB-OE2 3.33Å; N286-E344 PolarHBondContact ND2-OE2 3.06Å; A287-E344 HydrophobicContact CB-CG 4.44Å; E344-K348 HydrophobicContact CG-CD 4.2Å; E344-K348 WeakPolarHBondContact O-CB 3.31Å; E344-K348 VanDerWaalsContact O-CG 3.29Å; E344-K348 WeakPolarHBondContact O-CG 3.47Å; E344-K348 PolarHBondContact O-N 2.95Å; E344-K348 VanDerWaalsContact OE1-CE 3.29Å; E344-K348 WeakPolarHBondContact OE1-CE 3.49Å; E344-K348 IonicContact OE1-NZ 2.68Å; E344-K348 PolarHBondContact OE1-NZ 3.22Å
345	E	95.6	Very high	93.1	Very high	106 Å²	106	50 Å²	50	50%	0.495	25%	0.253	S	S	.	.	H	α-helix	trans	-69.8	-44.7	-177.4	-177.3	58.3	-159.9	0	0	111.8	N343 I347 K348 Q349	N343-E345 VanDerWaalsContact C-N 3.27Å; N343-E345 PolarHBondContact O-N 2.98Å; N343-E345 PolarHBondContact OD1-N 3.37Å; E345-I347 VanDerWaalsContact C-N 3.3Å; E345-I347 PolarHBondContact O-N 2.85Å; E345-K348 PolarHBondContact O-N 3.36Å; E345-Q349 WeakPolarHBondContact O-CB 3.33Å; E345-Q349 VanDerWaalsContact O-CG 3.27Å; E345-Q349 WeakPolarHBondContact O-CG 3.45Å; E345-Q349 PolarHBondContact O-N 3.07Å; E345-Q349 PolarHBondContact OE1-NE2 2.83Å
346	S	95.4	Very high	93.3	Very high	17 Å²	17	53 Å²	53	12%	0.119	27%	0.268	C	S	.	.	H	α-helix	trans	-64.7	-36.8	178.7	66.5	0	0	0	0	111.7	M337 T341 N343 F350	M337-S346 VanDerWaalsContact CE-C 3.43Å; M337-S346 WeakPolarHBondContact CE-O 3.36Å; M337-S346 WeakPolarHBondContact CE-OG 3.21Å; T341-S346 PolarHBondContact O-OG 3.4Å; N343-S346 PolarHBondContact N-OG 2.96Å; N343-S346 PolarHBondContact O-N 3.42Å; N343-S346 PolarHBondContact O-OG 3.21Å; N343-S346 VanDerWaalsContact O-OG 3.1Å; N343-S346 PolarHBondContact OD1-N 3.26Å; N343-S346 PolarHBondContact OD1-OG 2.79Å; S346-F350 WeakPolarHBondContact O-CB 3.44Å; S346-F350 PolarHBondContact O-N 3.26Å
347	I	97.6	Very high	93.4	Very high	1 Å²	1	55.3 Å²	55.3	1%	0.005	30%	0.298	C	S	.	.	H	α-helix	trans	-66.6	-46	175.5	-62	165.5	0	0	0	110.2	A283 F284 A287 F297 I324 M337 N343 E345 Q349 F350 C351	A283-I347 HydrophobicContact CB-CD1 4.12Å; F284-I347 HydrophobicContact CB-CD1 4.24Å; F284-I347 HydrophobicContact CD2-CD1 4.21Å; F284-I347 HydrophobicContact CD2-CG2 4.11Å; A287-I347 HydrophobicContact CB-CB 3.95Å; A287-I347 HydrophobicContact CB-CG2 3.55Å; F297-I347 HydrophobicContact CE1-CG2 4.03Å; I324-I347 HydrophobicContact CD1-CD1 4.02Å; I324-I347 HydrophobicContact CD1-CG1 3.8Å; I324-I347 HydrophobicContact CD1-CG2 4.36Å; M337-I347 HydrophobicContact CE-CG1 3.98Å; M337-I347 HydrophobicContact SD-CG1 4.14Å; N343-I347 WeakPolarHBondContact O-CD1 3.45Å; N343-I347 WeakPolarHBondContact O-CG1 3.11Å; N343-I347 PolarHBondContact O-N 3.38Å; E345-I347 VanDerWaalsContact C-N 3.3Å; E345-I347 PolarHBondContact O-N 2.85Å; I347-Q349 PolarHBondContact O-N 2.93Å; I347-F350 PolarHBondContact O-N 2.89Å; I347-C351 PolarHBondContact O-N 2.84Å; I347-C351 PolarHBondContact O-SG 3.28Å
348	K	97.4	Very high	93.6	Very high	56 Å²	56	61.9 Å²	61.9	24%	0.243	33%	0.326	C	S	.	.	H	α-helix	trans	-59.7	-46.4	176.3	-77	176.2	-177.4	176.8	0	112.1	A287 F291 E344 E345 F350 C351 Q352	A287-K348 HydrophobicContact CB-CG 3.99Å; F291-K348 HydrophobicContact CE2-CB 4.18Å; F291-K348 HydrophobicContact CE2-CG 3.87Å; F291-K348 HydrophobicContact CZ-CB 4.22Å; F291-K348 HydrophobicContact CZ-CG 4.31Å; F291-K348 WeakPolarHBondContact CZ-O 3.48Å; E344-K348 HydrophobicContact CG-CD 4.2Å; E344-K348 WeakPolarHBondContact O-CB 3.31Å; E344-K348 VanDerWaalsContact O-CG 3.29Å; E344-K348 WeakPolarHBondContact O-CG 3.47Å; E344-K348 PolarHBondContact O-N 2.95Å; E344-K348 VanDerWaalsContact OE1-CE 3.29Å; E344-K348 WeakPolarHBondContact OE1-CE 3.49Å; E344-K348 IonicContact OE1-NZ 2.68Å; E344-K348 PolarHBondContact OE1-NZ 3.22Å; E345-K348 PolarHBondContact O-N 3.36Å; K348-F350 VanDerWaalsContact C-N 3.31Å; K348-F350 PolarHBondContact O-N 2.99Å; K348-C351 PolarHBondContact O-N 3.02Å; K348-Q352 VanDerWaalsContact O-CB 3.28Å; K348-Q352 WeakPolarHBondContact O-CB 3.49Å; K348-Q352 PolarHBondContact O-N 2.89Å
349	Q	96.1	Very high	93.8	Very high	115 Å²	115	58 Å²	58	54%	0.537	31%	0.308	S	S	.	.	H	α-helix	trans	-60.9	-41.1	178	-73.1	175.6	4.6	0	0	112	E345 I347 S353	E345-Q349 WeakPolarHBondContact O-CB 3.33Å; E345-Q349 VanDerWaalsContact O-CG 3.27Å; E345-Q349 WeakPolarHBondContact O-CG 3.45Å; E345-Q349 PolarHBondContact O-N 3.07Å; E345-Q349 PolarHBondContact OE1-NE2 2.83Å; I347-Q349 PolarHBondContact O-N 2.93Å; Q349-S353 VanDerWaalsContact O-CB 3.23Å; Q349-S353 WeakPolarHBondContact O-CB 3.35Å; Q349-S353 PolarHBondContact O-N 2.83Å
350	F	96.7	Very high	93.9	Very high	22 Å²	22	64.8 Å²	64.8	10%	0.096	33%	0.333	C	S	.	.	H	α-helix	trans	-63.2	-50.3	176.1	174.2	-118.9	0	0	0	112	I324 L326 Q336 M337 S346 I347 K348 Q352 S353 Y354	I324-F350 HydrophobicContact CG2-CD1 4.44Å; I324-F350 HydrophobicContact CG2-CE1 4.17Å; L326-F350 HydrophobicContact CB-CE1 3.92Å; L326-F350 HydrophobicContact CB-CZ 4.06Å; L326-F350 HydrophobicContact CD1-CE1 4.37Å; Q336-F350 WeakPolarHBondContact O-CE2 3.35Å; M337-F350 HydrophobicContact CB-CD1 3.78Å; M337-F350 HydrophobicContact CB-CD2 4.28Å; M337-F350 HydrophobicContact CB-CE1 3.88Å; M337-F350 HydrophobicContact CB-CE2 4.38Å; M337-F350 HydrophobicContact CB-CG 3.99Å; M337-F350 HydrophobicContact CB-CZ 4.18Å; M337-F350 HydrophobicContact CG-CB 4.11Å; M337-F350 HydrophobicContact CG-CD1 4.05Å; M337-F350 HydrophobicContact CG-CD2 4.42Å; M337-F350 HydrophobicContact CG-CG 3.93Å; M337-F350 HydrophobicContact SD-CB 4.21Å; M337-F350 HydrophobicContact SD-CD1 4.19Å; M337-F350 HydrophobicContact SD-CG 4.36Å; S346-F350 WeakPolarHBondContact O-CB 3.44Å; S346-F350 PolarHBondContact O-N 3.26Å; I347-F350 PolarHBondContact O-N 2.89Å; K348-F350 VanDerWaalsContact C-N 3.31Å; K348-F350 PolarHBondContact O-N 2.99Å; F350-Q352 VanDerWaalsContact C-N 3.32Å; F350-Q352 PolarHBondContact O-N 3.35Å; F350-S353 PolarHBondContact O-N 2.78Å; F350-Y354 PolarHBondContact O-N 2.79Å
351	C	97.8	Very high	94.5	Very high	1 Å²	1	62.8 Å²	62.8	1%	0.007	33%	0.329	C	S	.	.	H	α-helix	trans	-60.4	-41.1	177.6	-73.3	0	0	0	0	112.4	F291 I295 F297 I347 K348 Y354 L355	F291-C351 HydrophobicContact CD1-CB 4.1Å; F291-C351 HydrophobicContact CD2-CB 3.94Å; F291-C351 HydrophobicContact CE1-CB 3.71Å; F291-C351 HydrophobicContact CE2-CB 3.54Å; F291-C351 HydrophobicContact CG-CB 4.22Å; F291-C351 HydrophobicContact CZ-CB 3.43Å; F291-C351 VanDerWaalsContact CZ-CB 3.43Å; I295-C351 HydrophobicContact CD1-CB 3.72Å; F297-C351 VanDerWaalsContact CZ-SG 3.6Å; I347-C351 PolarHBondContact O-N 2.84Å; I347-C351 PolarHBondContact O-SG 3.28Å; K348-C351 PolarHBondContact O-N 3.02Å; C351-Y354 WeakPolarHBondContact O-CB 3.47Å; C351-Y354 PolarHBondContact O-N 3.2Å; C351-L355 WeakPolarHBondContact O-CG 3.39Å; C351-L355 PolarHBondContact O-N 3.31Å
352	Q	97.5	Very high	94.7	Very high	80 Å²	80	60.1 Å²	60.1	37%	0.374	31%	0.31	S	S	.	.	H	α-helix	trans	-66.5	-45.7	177	-174.2	60.2	29.9	0	0	111.7	F291 K348 F350 Y354 L355 E356	F291-Q352 HydrophobicContact CE1-CB 4.48Å; K348-Q352 VanDerWaalsContact O-CB 3.28Å; K348-Q352 WeakPolarHBondContact O-CB 3.49Å; K348-Q352 PolarHBondContact O-N 2.89Å; F350-Q352 VanDerWaalsContact C-N 3.32Å; F350-Q352 PolarHBondContact O-N 3.35Å; Q352-Y354 PolarHBondContact O-N 3.4Å; Q352-L355 PolarHBondContact O-N 2.85Å; Q352-L355 VanDerWaalsContact O-N 3.15Å; Q352-E356 WeakPolarHBondContact CG-OE1 3.46Å; Q352-E356 PolarHBondContact NE2-OE1 3.15Å; Q352-E356 WeakPolarHBondContact O-CB 3.18Å; Q352-E356 VanDerWaalsContact O-CG 3.32Å; Q352-E356 WeakPolarHBondContact O-CG 3.39Å; Q352-E356 PolarHBondContact O-N 2.91Å
353	S	97.1	Very high	94.3	Very high	37 Å²	37	62.9 Å²	62.9	26%	0.259	32%	0.324	S	S	.	.	H	α-helix	trans	-57.2	-38.4	175	179.5	0	0	0	0	112	Q349 F350 G357 K358 A359	Q349-S353 VanDerWaalsContact O-CB 3.23Å; Q349-S353 WeakPolarHBondContact O-CB 3.35Å; Q349-S353 PolarHBondContact O-N 2.83Å; F350-S353 PolarHBondContact O-N 2.78Å; S353-G357 PolarHBondContact O-N 3.36Å; S353-K358 WeakPolarHBondContact O-CA 3.15Å; S353-K358 PolarHBondContact O-N 3.23Å; S353-K358 WeakPolarHBondContact OG-CB 3.46Å; S353-A359 PolarHBondContact O-N 2.89Å; S353-A359 VanDerWaalsContact O-N 3.14Å; S353-A359 PolarHBondContact OG-N 2.79Å
354	Y	97.1	Very high	93.8	Very high	24 Å²	24	65.7 Å²	65.7	9%	0.094	34%	0.337	C	S	.	.	H	α-helix	trans	-64.1	-50.7	173.4	168.1	-99.7	0	0	0	112.5	N264 I295 L326 N328 Y335 F350 C351 Q352 E356 G357 A359	N264-Y354 HydrophobicContact CB-CE1 4.04Å; N264-Y354 PolarHBondContact OD1-OH 2.79Å; I295-Y354 HydrophobicContact CD1-CD1 4.32Å; L326-Y354 HydrophobicContact CD1-CD1 3.58Å; L326-Y354 HydrophobicContact CD1-CD2 4.42Å; L326-Y354 HydrophobicContact CD1-CE1 4.19Å; L326-Y354 HydrophobicContact CD1-CG 3.7Å; L326-Y354 HydrophobicContact CD2-CD1 3.51Å; L326-Y354 HydrophobicContact CD2-CD2 3.54Å; L326-Y354 HydrophobicContact CD2-CE1 3.37Å; L326-Y354 HydrophobicContact CD2-CE2 3.38Å; L326-Y354 HydrophobicContact CD2-CG 3.58Å; L326-Y354 HydrophobicContact CG-CD1 4.23Å; L326-Y354 HydrophobicContact CG-CE1 4.42Å; L326-Y354 HydrophobicContact CG-CG 4.31Å; N328-Y354 WeakPolarHBondContact CB-OH 3.28Å; Y335-Y354 HydrophobicContact CD1-CD2 4.12Å; Y335-Y354 AromaticContact CD2-CD2 3.81Å; Y335-Y354 HydrophobicContact CD2-CD2 3.81Å; Y335-Y354 AromaticContact CD2-CE2 3.65Å; Y335-Y354 HydrophobicContact CD2-CE2 3.65Å; Y335-Y354 HydrophobicContact CE1-CD2 4.14Å; Y335-Y354 HydrophobicContact CE1-CE2 4.35Å; Y335-Y354 AromaticContact CE2-CD2 3.87Å; Y335-Y354 HydrophobicContact CE2-CD2 3.87Å; Y335-Y354 AromaticContact CE2-CE2 3.38Å; Y335-Y354 HydrophobicContact CE2-CE2 3.38Å; Y335-Y354 AromaticContact CG-CD2 3.97Å; Y335-Y354 HydrophobicContact CG-CD2 3.97Å; Y335-Y354 HydrophobicContact CG-CE2 4.28Å; Y335-Y354 AromaticContact CZ-CE2 3.76Å; F350-Y354 PolarHBondContact O-N 2.79Å; C351-Y354 WeakPolarHBondContact O-CB 3.47Å; C351-Y354 PolarHBondContact O-N 3.2Å; Q352-Y354 PolarHBondContact O-N 3.4Å; Y354-E356 PolarHBondContact O-N 3.21Å; Y354-G357 PolarHBondContact O-N 2.51Å; Y354-A359 HydrophobicContact CD2-CB 4.44Å
355	L	96.7	Very high	93.5	Very high	62 Å²	62	63.4 Å²	63.4	33%	0.325	33%	0.329	S	S	.	.	H	α-helix	trans	-62.7	-27.4	179.4	-68.2	175.7	0	0	0	112.8	F291 K294 I295 C351 Q352 G357	F291-L355 HydrophobicContact CD1-CD1 3.82Å; F291-L355 HydrophobicContact CE1-CD1 4.15Å; K294-L355 HydrophobicContact CB-CD1 4.24Å; K294-L355 HydrophobicContact CD-CD1 4.11Å; I295-L355 HydrophobicContact CD1-CD1 3.98Å; I295-L355 HydrophobicContact CD1-CD2 4.13Å; I295-L355 HydrophobicContact CD1-CG 3.94Å; I295-L355 HydrophobicContact CG1-CD1 4.38Å; I295-L355 HydrophobicContact CG1-CD2 4.07Å; I295-L355 HydrophobicContact CG1-CG 4.39Å; C351-L355 WeakPolarHBondContact O-CG 3.39Å; C351-L355 PolarHBondContact O-N 3.31Å; Q352-L355 PolarHBondContact O-N 2.85Å; Q352-L355 VanDerWaalsContact O-N 3.15Å; L355-G357 VanDerWaalsContact C-N 3.29Å
356	E	96.8	Very high	93.3	Very high	93 Å²	93	61.6 Å²	61.6	44%	0.435	32%	0.32	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.9	-2.5	174.4	-69.2	175.7	-174	0	0	113.8	Q352 Y354 K358	Q352-E356 WeakPolarHBondContact CG-OE1 3.46Å; Q352-E356 PolarHBondContact NE2-OE1 3.15Å; Q352-E356 WeakPolarHBondContact O-CB 3.18Å; Q352-E356 VanDerWaalsContact O-CG 3.32Å; Q352-E356 WeakPolarHBondContact O-CG 3.39Å; Q352-E356 PolarHBondContact O-N 2.91Å; Y354-E356 PolarHBondContact O-N 3.21Å; E356-K358 VanDerWaalsContact C-N 3.29Å; E356-K358 HydrophobicContact CB-CD 4.18Å; E356-K358 HydrophobicContact CB-CG 4.2Å; E356-K358 PolarHBondContact O-N 2.82Å; E356-K358 WeakPolarHBondContact OE2-CD 3.48Å; E356-K358 VanDerWaalsContact OE2-CE 3.29Å; E356-K358 WeakPolarHBondContact OE2-CE 3.33Å; E356-K358 IonicContact OE2-NZ 3.95Å; E356-K358 PolarHBondContact OE2-NZ 2.89Å
357	G	95.3	Very high	93.1	Very high	69 Å²	69	65.8 Å²	65.8	71%	0.711	35%	0.347	S	S	*	.	T	Hydrogen-bonded Turn	trans	72.4	18	-177.9	0	0	0	0	0	114.5	S353 Y354 L355	S353-G357 PolarHBondContact O-N 3.36Å; Y354-G357 PolarHBondContact O-N 2.51Å; L355-G357 VanDerWaalsContact C-N 3.29Å
358	K	94.9	Very high	92.9	Very high	143 Å²	143	69.5 Å²	69.5	62%	0.622	37%	0.366	S	S	*	.			trans	-95.1	-21.5	-179.5	-65.3	174.8	-176.4	164.1	0	113.2	S353 E356	S353-K358 WeakPolarHBondContact O-CA 3.15Å; S353-K358 PolarHBondContact O-N 3.23Å; S353-K358 WeakPolarHBondContact OG-CB 3.46Å; E356-K358 VanDerWaalsContact C-N 3.29Å; E356-K358 HydrophobicContact CB-CD 4.18Å; E356-K358 HydrophobicContact CB-CG 4.2Å; E356-K358 PolarHBondContact O-N 2.82Å; E356-K358 WeakPolarHBondContact OE2-CD 3.48Å; E356-K358 VanDerWaalsContact OE2-CE 3.29Å; E356-K358 WeakPolarHBondContact OE2-CE 3.33Å; E356-K358 IonicContact OE2-NZ 3.95Å; E356-K358 PolarHBondContact OE2-NZ 2.89Å
359	A	91.7	Very high	92.6	Very high	13 Å²	13	69.5 Å²	69.5	11%	0.107	37%	0.372	C	S	.	.	S	Bend	trans	-62.8	137.8	176.4	0	0	0	0	0	110.5	Y335 S353 Y354	Y335-A359 HydrophobicContact CD1-CB 3.71Å; Y335-A359 HydrophobicContact CE1-CB 4.21Å; Y335-A359 WeakPolarHBondContact CE1-O 3.42Å; S353-A359 PolarHBondContact O-N 2.89Å; S353-A359 VanDerWaalsContact O-N 3.14Å; S353-A359 PolarHBondContact OG-N 2.79Å; Y354-A359 HydrophobicContact CD2-CB 4.44Å
360	K	88.3	Confident	92.4	Very high	175 Å²	175	72.6 Å²	72.6	76%	0.761	39%	0.386	S	S	*	.	P	Polyproline II helix	trans	-84.3	130.4	177.7	-67	-176.7	-179.6	179.7	0	110.1	Y335	Y335-K360 WeakPolarHBondContact CD1-O 3.37Å
361	P	89.1	Confident	92.1	Very high	60 Å²	60	79.8 Å²	79.8	39%	0.39	41%	0.412	S	S	.	.	B	Isolated β-bridge	trans	-56.4	144.8	171.6	-25.9	35	0	0	0	111.7	I333 Y335 L363	I333-P361 HydrophobicContact CG2-CB 3.76Å; I333-P361 HydrophobicContact CG2-CG 4.16Å; Y335-P361 HydrophobicContact CE1-CB 4.31Å; Y335-P361 HydrophobicContact CE1-CG 3.85Å; P361-L363 PolarHBondContact O-N 3.33Å
362	K	86.4	Confident	91.8	Very high	27 Å²	27	82.5 Å²	82.5	12%	0.117	42%	0.423	C	S	.	.			trans	-73.4	114.7	168.6	179.1	60.3	175.4	-179.7	0	108.1	T334 Q336 A435 S436 N438 D439	T334-K362 PolarHBondContact O-N 3.47Å; Q336-K362 HydrophobicContact CB-CD 4.42Å; K362-A435 PolarHBondContact NZ-O 2.8Å; K362-S436 PolarHBondContact NZ-O 3.35Å; K362-N438 PolarHBondContact NZ-O 2.83Å; K362-D439 WeakPolarHBondContact CE-OD1 3.43Å; K362-D439 IonicContact NZ-OD1 3.39Å
363	L	82.3	Confident	91.5	Very high	83 Å²	83	82.5 Å²	82.5	44%	0.435	43%	0.425	S	S	.	.			trans	-89.5	151.8	177.8	-58.8	177.5	0	0	0	110.5	P361 S365	P361-L363 PolarHBondContact O-N 3.33Å; L363-S365 WeakPolarHBondContact CB-O 3.41Å; L363-S365 PolarHBondContact O-N 2.94Å
364	M	83.5	Confident	91.1	Very high	126 Å²	126	86.9 Å²	86.9	62%	0.621	44%	0.442	S	S	*	.	S	Bend	trans	-63.4	-36.4	167.5	-67.1	-176.4	69.5	0	0	111.2	D439	M364-D439 PolarHBondContact O-N 2.78Å
365	S	89.6	Confident	90.8	Very high	21 Å²	21	92.3 Å²	92.3	15%	0.147	47%	0.466	C	S	.	.	S	Bend	trans	-152.3	143.4	175.5	-178.9	0	0	0	0	108.9	L363 V381 G382 M383 N438	L363-S365 WeakPolarHBondContact CB-O 3.41Å; L363-S365 PolarHBondContact O-N 2.94Å; S365-V381 WeakPolarHBondContact OG-CB 3.5Å; S365-G382 WeakPolarHBondContact OG-CA 3.48Å; S365-G382 PolarHBondContact OG-N 3.4Å; S365-M383 PolarHBondContact OG-N 3.49Å; S365-N438 WeakPolarHBondContact CA-OD1 3.26Å
366	E	91.3	Very high	90.6	Very high	69 Å²	69	93.7 Å²	93.7	32%	0.322	48%	0.478	S	S	.	.	P	Polyproline II helix	trans	-63.9	157.3	161.4	-71.1	-179.8	108.4	0	0	110.6	V381 A437 N438	E366-V381 HydrophobicContact CB-CB 4.31Å; E366-V381 HydrophobicContact CB-CG1 3.79Å; E366-A437 HydrophobicContact CG-CB 3.68Å; E366-A437 WeakPolarHBondContact OE2-CB 3.22Å; E366-N438 PolarHBondContact N-OD1 3.42Å; E366-N438 PolarHBondContact OE2-ND2 2.8Å
367	P	92.3	Very high	90.6	Very high	104 Å²	104	89.8 Å²	89.8	68%	0.675	46%	0.461	S	S	*	.	P	Polyproline II helix	trans	-59.9	142.2	169.4	27.2	-34.7	0	0	0	110	P369	P367-P369 VanDerWaalsContact O-CD 3.22Å; P367-P369 WeakPolarHBondContact O-CD 3.47Å
368	I	93.8	Very high	90.7	Very high	80 Å²	80	89.3 Å²	89.3	41%	0.41	44%	0.439	S	S	.	.	P	Polyproline II helix	trans	-62.6	118.5	177.9	-57.7	175.4	0	0	0	108.5	W372 V381 M383 T384	I368-W372 VanDerWaalsContact CG2-CD1 3.43Å; I368-W372 HydrophobicContact CG2-CG 4.02Å; I368-V381 HydrophobicContact CB-CG2 4.39Å; I368-V381 HydrophobicContact CG1-CG2 3.74Å; I368-M383 HydrophobicContact CD1-CB 4.48Å; I368-T384 HydrophobicContact CD1-CG2 3.81Å; I368-T384 HydrophobicContact CG1-CG2 3.95Å; I368-T384 HydrophobicContact CG2-CG2 4.26Å
369	P	91.6	Very high	90.7	Very high	55 Å²	55	85 Å²	85	36%	0.357	42%	0.421	S	S	.	.	P	Polyproline II helix	trans	-62.1	147	179.8	-22.6	33.6	0	0	0	111.7	P367 R371 W372 V381	P367-P369 VanDerWaalsContact O-CD 3.22Å; P367-P369 WeakPolarHBondContact O-CD 3.47Å; P369-R371 PolarHBondContact O-N 2.72Å; P369-W372 HydrophobicContact CB-CB 4.23Å; P369-W372 HydrophobicContact CG-CB 4.48Å; P369-W372 WeakPolarHBondContact O-CB 3.3Å; P369-W372 PolarHBondContact O-N 3.25Å; P369-V381 HydrophobicContact CG-CG1 4.41Å
370	E	90.6	Very high	90.9	Very high	180 Å²	180	84.6 Å²	84.6	84%	0.841	42%	0.417	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.1	135.2	166.9	-67	-173	-175.8	0	0	109.3	W372	E370-W372 PolarHBondContact O-N 3.22Å
371	R	91.1	Very high	91.3	Very high	173 Å²	173	76.4 Å²	76.4	65%	0.653	38%	0.382	S	S	*	.	T	Hydrogen-bonded Turn	trans	62	26.5	176.3	-48.2	179.6	176.6	-163.3	3.9	114.5	P369 D373 Q374	P369-R371 PolarHBondContact O-N 2.72Å; R371-D373 PolarHBondContact O-N 3.46Å; R371-Q374 HydrophobicContact CB-CB 4.16Å; R371-Q374 VanDerWaalsContact CB-CD 3.43Å; R371-Q374 HydrophobicContact CB-CG 3.8Å; R371-Q374 VanDerWaalsContact CD-OE1 3.27Å; R371-Q374 HydrophobicContact CG-CG 4.42Å; R371-Q374 PolarHBondContact O-N 2.94Å; R371-Q374 VanDerWaalsContact O-N 3.08Å
372	W	91.6	Very high	91.4	Very high	59 Å²	59	74.6 Å²	74.6	22%	0.223	37%	0.374	C	S	.	.	T	Hydrogen-bonded Turn	trans	-54.1	-22.7	179.8	72.4	-89.6	0	0	0	114.5	I368 P369 E370 K378 E379 L380 V388	I368-W372 VanDerWaalsContact CG2-CD1 3.43Å; I368-W372 HydrophobicContact CG2-CG 4.02Å; P369-W372 HydrophobicContact CB-CB 4.23Å; P369-W372 HydrophobicContact CG-CB 4.48Å; P369-W372 WeakPolarHBondContact O-CB 3.3Å; P369-W372 PolarHBondContact O-N 3.25Å; E370-W372 PolarHBondContact O-N 3.22Å; W372-K378 HydrophobicContact CE3-CB 4.31Å; W372-K378 HydrophobicContact CZ3-CB 4.27Å; W372-K378 HydrophobicContact CZ3-CD 4.18Å; W372-K378 WeakPolarHBondContact O-CA 3.29Å; W372-E379 HydrophobicContact CB-CB 4.42Å; W372-E379 WeakPolarHBondContact CB-O 3.43Å; W372-E379 PolarHBondContact O-N 3.32Å; W372-L380 HydrophobicContact CE3-CD2 3.92Å; W372-L380 HydrophobicContact CH2-CD2 4.43Å; W372-L380 HydrophobicContact CZ3-CD2 3.47Å; W372-L380 VanDerWaalsContact CZ3-CD2 3.47Å; W372-V388 HydrophobicContact CH2-CG2 3.54Å; W372-V388 HydrophobicContact CZ3-CG2 3.91Å
373	D	90.4	Very high	91.6	Very high	80 Å²	80	80.1 Å²	80.1	43%	0.428	40%	0.402	S	S	.	.	T	Hydrogen-bonded Turn	trans	-106.9	3.7	-177.2	66.3	-19.1	0	0	0	114.9	R371 K378	R371-D373 PolarHBondContact O-N 3.46Å; D373-K378 HydrophobicContact CB-CD 4.21Å
374	Q	89.3	Confident	92.2	Very high	129 Å²	129	76.7 Å²	76.7	60%	0.603	39%	0.385	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.4	-25.6	-175.4	-64.9	-172.2	5.4	0	0	114.2	R371	R371-Q374 HydrophobicContact CB-CB 4.16Å; R371-Q374 VanDerWaalsContact CB-CD 3.43Å; R371-Q374 HydrophobicContact CB-CG 3.8Å; R371-Q374 VanDerWaalsContact CD-OE1 3.27Å; R371-Q374 HydrophobicContact CG-CG 4.42Å; R371-Q374 PolarHBondContact O-N 2.94Å; R371-Q374 VanDerWaalsContact O-N 3.08Å
375	K	90	Very high	92.6	Very high	138 Å²	138	70.9 Å²	70.9	60%	0.6	36%	0.356	S	S	*	.	S	Bend	trans	-80.2	156	177.5	-68.2	-177.4	-177.2	178.5	0	110.6	V377	K375-V377 WeakPolarHBondContact CB-O 3.36Å; K375-V377 PolarHBondContact O-N 3.45Å
376	P	92.3	Very high	92.7	Very high	90 Å²	90	74.8 Å²	74.8	58%	0.584	37%	0.372	S	S	*	.	S	Bend	trans	-54.4	-38.6	175.1	-27.2	35.3	0	0	0	113.3	A419	P376-A419 HydrophobicContact CB-CB 3.76Å
377	V	97.1	Very high	92.8	Very high	12 Å²	12	80 Å²	80	7%	0.073	39%	0.394	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.5	119.6	167.5	-179.3	0	0	0	0	108.5	K375 E416 A419 I430 Q432	K375-V377 WeakPolarHBondContact CB-O 3.36Å; K375-V377 PolarHBondContact O-N 3.45Å; V377-E416 HydrophobicContact CG2-CG 4.38Å; V377-A419 HydrophobicContact CG2-CB 3.69Å; V377-I430 HydrophobicContact CG2-CG2 4.2Å; V377-Q432 HydrophobicContact CG1-CB 4.15Å; V377-Q432 HydrophobicContact CG1-CG 3.81Å
378	K	96.8	Very high	92.9	Very high	58 Å²	58	76 Å²	76	25%	0.252	37%	0.367	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.4	136.5	177.2	-56.2	-167.6	-176.9	-176.3	0	111.6	W372 D373 V429 I430 A431 Q432	W372-K378 HydrophobicContact CE3-CB 4.31Å; W372-K378 HydrophobicContact CZ3-CB 4.27Å; W372-K378 HydrophobicContact CZ3-CD 4.18Å; W372-K378 WeakPolarHBondContact O-CA 3.29Å; D373-K378 HydrophobicContact CB-CD 4.21Å; K378-V429 HydrophobicContact CD-CG1 3.66Å; K378-V429 HydrophobicContact CG-CG1 4.2Å; K378-I430 PolarHBondContact N-O 2.95Å; K378-A431 HydrophobicContact CB-CB 4.03Å; K378-A431 CarbonylContact O-C 3.56Å; K378-A431 WeakPolarHBondContact O-CA 3.5Å; K378-A431 WeakPolarHBondContact O-CB 3.27Å; K378-Q432 PolarHBondContact O-N 3.26Å
379	E	96.7	Very high	93	Very high	53 Å²	53	72.2 Å²	72.2	25%	0.248	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.2	110.5	176.2	-64.8	-70.6	-175.8	0	0	109.7	W372 Q432	W372-E379 HydrophobicContact CB-CB 4.42Å; W372-E379 WeakPolarHBondContact CB-O 3.43Å; W372-E379 PolarHBondContact O-N 3.32Å; E379-Q432 PolarHBondContact OE1-NE2 2.98Å; E379-Q432 WeakPolarHBondContact OE2-CG 3.45Å; E379-Q432 PolarHBondContact OE2-NE2 3.02Å
380	L	96.1	Very high	93.1	Very high	4 Å²	4	71.8 Å²	71.8	2%	0.021	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.3	146.4	177.3	-51.6	179.7	0	0	0	110.2	W372 T384 L385 V388 V398 A431 Q432 I433	W372-L380 HydrophobicContact CE3-CD2 3.92Å; W372-L380 HydrophobicContact CH2-CD2 4.43Å; W372-L380 HydrophobicContact CZ3-CD2 3.47Å; W372-L380 VanDerWaalsContact CZ3-CD2 3.47Å; L380-T384 WeakPolarHBondContact CA-OG1 3.44Å; L380-L385 HydrophobicContact CD1-CD1 3.86Å; L380-V388 HydrophobicContact CD1-CB 4.44Å; L380-V388 HydrophobicContact CD1-CG1 4.36Å; L380-V388 HydrophobicContact CD2-CB 4.02Å; L380-V388 HydrophobicContact CD2-CG1 4.01Å; L380-V388 HydrophobicContact CD2-CG2 3.91Å; L380-V398 HydrophobicContact CD1-CG1 4.19Å; L380-V398 HydrophobicContact CD1-CG2 4.22Å; L380-A431 HydrophobicContact CD1-CB 3.69Å; L380-A431 HydrophobicContact CD2-CB 4.36Å; L380-A431 HydrophobicContact CG-CB 3.86Å; L380-Q432 WeakPolarHBondContact CB-O 3.2Å; L380-Q432 PolarHBondContact N-O 3.07Å; L380-I433 HydrophobicContact CB-CB 4.18Å; L380-I433 HydrophobicContact CB-CD1 4.44Å; L380-I433 WeakPolarHBondContact O-CG1 3.35Å
381	V	94.7	Very high	93.3	Very high	4 Å²	4	65.8 Å²	65.8	2%	0.024	31%	0.314	C	S	.	.			trans	-117.4	170.2	164.8	-61	0	0	0	0	109.5	S365 E366 I368 P369 M383 T384 L385 N438	S365-V381 WeakPolarHBondContact OG-CB 3.5Å; E366-V381 HydrophobicContact CB-CB 4.31Å; E366-V381 HydrophobicContact CB-CG1 3.79Å; I368-V381 HydrophobicContact CB-CG2 4.39Å; I368-V381 HydrophobicContact CG1-CG2 3.74Å; P369-V381 HydrophobicContact CG-CG1 4.41Å; V381-M383 HydrophobicContact CG2-CB 4.41Å; V381-M383 PolarHBondContact O-N 3.11Å; V381-M383 VanDerWaalsContact O-N 3.14Å; V381-T384 HydrophobicContact CG2-CG2 4.1Å; V381-T384 PolarHBondContact N-OG1 3.06Å; V381-T384 PolarHBondContact O-N 2.91Å; V381-T384 PolarHBondContact O-OG1 3.41Å; V381-L385 PolarHBondContact O-N 3.3Å; V381-N438 WeakPolarHBondContact CA-OD1 3.33Å; V381-N438 WeakPolarHBondContact CB-OD1 3.33Å
382	G	91.4	Very high	93.5	Very high	22 Å²	22	59.5 Å²	59.5	23%	0.227	30%	0.296	C	S	.	.	H	α-helix	trans	-50.1	-41.5	-178.5	0	0	0	0	0	113.5	S365 T384 N438	S365-G382 WeakPolarHBondContact OG-CA 3.48Å; S365-G382 PolarHBondContact OG-N 3.4Å; G382-T384 VanDerWaalsContact C-N 3.27Å; G382-T384 PolarHBondContact O-N 3.24Å; G382-N438 PolarHBondContact N-OD1 3.24Å
383	M	91.3	Very high	93.6	Very high	142 Å²	142	61.3 Å²	61.3	70%	0.7	31%	0.31	S	S	*	.	H	α-helix	trans	-67.4	-21.8	178.4	-70.8	-177.7	75.4	0	0	114.9	S365 I368 V381	S365-M383 PolarHBondContact OG-N 3.49Å; I368-M383 HydrophobicContact CD1-CB 4.48Å; V381-M383 HydrophobicContact CG2-CB 4.41Å; V381-M383 PolarHBondContact O-N 3.11Å; V381-M383 VanDerWaalsContact O-N 3.14Å
384	T	94	Very high	93.9	Very high	11 Å²	11	60.4 Å²	60.4	7%	0.067	30%	0.302	C	S	.	.	H	α-helix	trans	-103.6	-20.4	-177.1	55.5	0	0	0	0	113.2	I368 L380 V381 G382 E386 K387 V388	I368-T384 HydrophobicContact CD1-CG2 3.81Å; I368-T384 HydrophobicContact CG1-CG2 3.95Å; I368-T384 HydrophobicContact CG2-CG2 4.26Å; L380-T384 WeakPolarHBondContact CA-OG1 3.44Å; V381-T384 HydrophobicContact CG2-CG2 4.1Å; V381-T384 PolarHBondContact N-OG1 3.06Å; V381-T384 PolarHBondContact O-N 2.91Å; V381-T384 PolarHBondContact O-OG1 3.41Å; G382-T384 VanDerWaalsContact C-N 3.27Å; G382-T384 PolarHBondContact O-N 3.24Å; T384-E386 PolarHBondContact O-N 2.91Å; T384-K387 PolarHBondContact O-N 3.39Å; T384-V388 WeakPolarHBondContact O-CG2 3.37Å; T384-V388 PolarHBondContact O-N 3.33Å
385	L	93.8	Very high	94.3	Very high	5 Å²	5	54.5 Å²	54.5	3%	0.026	28%	0.275	C	S	.	.	H	α-helix	trans	-55.6	-60.1	-169.4	177.4	63.7	0	0	0	112.1	L380 V381 K387 V388 A389 V398 F400 I433 I440 M442	L380-L385 HydrophobicContact CD1-CD1 3.86Å; V381-L385 PolarHBondContact O-N 3.3Å; L385-K387 PolarHBondContact O-N 3.31Å; L385-V388 PolarHBondContact O-N 2.85Å; L385-A389 HydrophobicContact CD1-CB 4.32Å; L385-A389 WeakPolarHBondContact O-CB 3.44Å; L385-A389 PolarHBondContact O-N 2.96Å; L385-V398 HydrophobicContact CD1-CG1 4.4Å; L385-F400 HydrophobicContact CD1-CE1 4.03Å; L385-F400 HydrophobicContact CD1-CZ 3.78Å; L385-F400 HydrophobicContact CD2-CE1 3.76Å; L385-F400 HydrophobicContact CD2-CZ 4.07Å; L385-I433 HydrophobicContact CB-CD1 4.21Å; L385-I433 HydrophobicContact CD1-CD1 4.38Å; L385-I433 HydrophobicContact CD2-CD1 4.16Å; L385-I433 HydrophobicContact CG-CD1 4.48Å; L385-I440 HydrophobicContact CD2-CG1 4.28Å; L385-I440 HydrophobicContact CD2-CG2 4.03Å; L385-M442 HydrophobicContact CD2-SD 4.23Å
386	E	91.8	Very high	94.7	Very high	103 Å²	103	47.9 Å²	47.9	48%	0.481	25%	0.246	S	C	.	.	H	α-helix	trans	-60.9	-46.2	-174.1	-68.5	178.5	-176.3	0	0	111.8	T384 V388 A389 F390	T384-E386 PolarHBondContact O-N 2.91Å; E386-V388 VanDerWaalsContact C-N 3.32Å; E386-V388 PolarHBondContact O-N 2.87Å; E386-A389 PolarHBondContact O-N 2.78Å; E386-F390 HydrophobicContact CB-CD2 4.33Å; E386-F390 WeakPolarHBondContact O-CB 3.38Å; E386-F390 PolarHBondContact O-N 2.68Å
387	K	92.7	Very high	95	Very high	177 Å²	177	43.6 Å²	43.6	77%	0.77	22%	0.218	S	C	*	.	H	α-helix	trans	-60.1	-40.8	-179.6	-179.2	-178.7	176.7	-176.3	0	112.4	T384 L385	T384-K387 PolarHBondContact O-N 3.39Å; L385-K387 PolarHBondContact O-N 3.31Å
388	V	94.9	Very high	95	Very high	21 Å²	21	43 Å²	43	13%	0.127	22%	0.215	C	C	.	.	H	α-helix	trans	-77.6	-50.5	-179.7	176	0	0	0	0	109.9	W372 L380 T384 L385 E386 N391 V396 V429	W372-V388 HydrophobicContact CH2-CG2 3.54Å; W372-V388 HydrophobicContact CZ3-CG2 3.91Å; L380-V388 HydrophobicContact CD1-CB 4.44Å; L380-V388 HydrophobicContact CD1-CG1 4.36Å; L380-V388 HydrophobicContact CD2-CB 4.02Å; L380-V388 HydrophobicContact CD2-CG1 4.01Å; L380-V388 HydrophobicContact CD2-CG2 3.91Å; T384-V388 WeakPolarHBondContact O-CG2 3.37Å; T384-V388 PolarHBondContact O-N 3.33Å; L385-V388 PolarHBondContact O-N 2.85Å; E386-V388 VanDerWaalsContact C-N 3.32Å; E386-V388 PolarHBondContact O-N 2.87Å; V388-N391 WeakPolarHBondContact O-CB 3Å; V388-N391 PolarHBondContact O-N 3.42Å; V388-V396 HydrophobicContact CG1-CG1 4.23Å; V388-V396 HydrophobicContact CG1-CG2 4.49Å; V388-V396 WeakPolarHBondContact O-CG2 3.3Å; V388-V429 HydrophobicContact CG1-CG1 4.34Å
389	A	94.6	Very high	95	Very high	0 Å²	0	40.3 Å²	40.3	0%	0	20%	0.203	C	C	.	.	H	α-helix	trans	-67.2	-41.4	-170.9	0	0	0	0	0	112.2	L385 E386 N391 V398 F454	L385-A389 HydrophobicContact CD1-CB 4.32Å; L385-A389 WeakPolarHBondContact O-CB 3.44Å; L385-A389 PolarHBondContact O-N 2.96Å; E386-A389 PolarHBondContact O-N 2.78Å; A389-N391 VanDerWaalsContact C-N 3.28Å; A389-N391 PolarHBondContact O-N 3.21Å; A389-V398 HydrophobicContact CB-CG2 4.49Å; A389-F454 HydrophobicContact CB-CB 4.45Å; A389-F454 HydrophobicContact CB-CD1 3.42Å; A389-F454 VanDerWaalsContact CB-CD1 3.42Å; A389-F454 HydrophobicContact CB-CD2 4.01Å; A389-F454 HydrophobicContact CB-CE1 3.36Å; A389-F454 HydrophobicContact CB-CE2 4.06Å; A389-F454 HydrophobicContact CB-CG 3.74Å; A389-F454 HydrophobicContact CB-CZ 3.76Å; A389-F454 WeakPolarHBondContact O-CB 3.21Å
390	F	94.1	Very high	94.9	Very high	47 Å²	47	37.8 Å²	37.8	21%	0.206	19%	0.191	C	C	.	.	T	Hydrogen-bonded Turn	trans	-91.1	28.7	178.1	-63.2	-64.5	0	0	0	114	E386 P392 M442 F454 E460 V462	E386-F390 HydrophobicContact CB-CD2 4.33Å; E386-F390 WeakPolarHBondContact O-CB 3.38Å; E386-F390 PolarHBondContact O-N 2.68Å; F390-P392 WeakPolarHBondContact O-CD 3.32Å; F390-M442 HydrophobicContact CE1-CE 4.19Å; F390-M442 HydrophobicContact CE2-CE 3.59Å; F390-M442 HydrophobicContact CE2-SD 3.71Å; F390-M442 HydrophobicContact CZ-CE 3.21Å; F390-M442 HydrophobicContact CZ-SD 4Å; F390-F454 AromaticContact CD1-CD1 3.96Å; F390-F454 HydrophobicContact CD1-CD1 3.96Å; F390-F454 AromaticContact CE1-CD1 3.79Å; F390-F454 HydrophobicContact CE1-CD1 3.79Å; F390-F454 HydrophobicContact CE1-CE1 4.14Å; F390-F454 HydrophobicContact CE2-CE1 4.43Å; F390-F454 HydrophobicContact CZ-CD1 4.23Å; F390-F454 HydrophobicContact CZ-CE1 4.11Å; F390-E460 HydrophobicContact CD1-CB 3.95Å; F390-E460 HydrophobicContact CD1-CG 3.98Å; F390-E460 HydrophobicContact CD2-CG 4.47Å; F390-E460 VanDerWaalsContact CE1-CA 3.47Å; F390-E460 HydrophobicContact CE1-CB 3.58Å; F390-E460 HydrophobicContact CE1-CG 4.05Å; F390-E460 HydrophobicContact CG-CG 4.17Å; F390-E460 HydrophobicContact CZ-CB 3.9Å; F390-E460 HydrophobicContact CZ-CG 4.26Å; F390-V462 HydrophobicContact CE1-CG2 4.27Å; F390-V462 HydrophobicContact CZ-CG2 4.4Å
391	N	95	Very high	94.8	Very high	54 Å²	54	38.9 Å²	38.9	29%	0.289	20%	0.195	S	C	.	.			trans	-66.4	120.7	174.4	-173.2	-51.9	0	0	0	110.2	V388 A389 N393 K394	V388-N391 WeakPolarHBondContact O-CB 3Å; V388-N391 PolarHBondContact O-N 3.42Å; A389-N391 VanDerWaalsContact C-N 3.28Å; A389-N391 PolarHBondContact O-N 3.21Å; N391-N393 PolarHBondContact O-N 3.04Å; N391-N393 PolarHBondContact OD1-N 3.08Å; N391-K394 HydrophobicContact CB-CB 4.15Å; N391-K394 PolarHBondContact O-N 3.46Å; N391-K394 PolarHBondContact OD1-N 3.46Å
392	P	94.2	Very high	94.6	Very high	41 Å²	41	39.9 Å²	39.9	27%	0.266	20%	0.2	S	C	.	.	T	Hydrogen-bonded Turn	trans	-71.3	-7.1	-172.4	29.7	-37.2	0	0	0	114.2	F390 A456 L457 Y458 R489	F390-P392 WeakPolarHBondContact O-CD 3.32Å; P392-A456 CarbonylContact O-C 3.51Å; P392-L457 VanDerWaalsContact CA-O 3.32Å; P392-L457 WeakPolarHBondContact CA-O 3.41Å; P392-Y458 HydrophobicContact CB-CD1 3.86Å; P392-Y458 HydrophobicContact CB-CE1 4.16Å; P392-R489 PolarHBondContact O-NH1 3.22Å; P392-R489 PolarHBondContact O-NH2 3.04Å
393	N	94.8	Very high	94.6	Very high	97 Å²	97	40.8 Å²	40.8	52%	0.519	21%	0.205	S	C	.	.	T	Hydrogen-bonded Turn	trans	-116	-3.3	-177.7	-58.2	-33	0	0	0	112.6	N391 R489	N391-N393 PolarHBondContact O-N 3.04Å; N391-N393 PolarHBondContact OD1-N 3.08Å; N393-R489 PolarHBondContact OD1-NH2 3.42Å
394	K	96.8	Very high	94.4	Very high	61 Å²	61	36.2 Å²	36.2	27%	0.265	18%	0.181	S	C	.	.			trans	-126.4	137.1	-178.9	-60.1	-63.4	175.6	-165.9	0	109.8	N391 V396 E426 D427 V429	N391-K394 HydrophobicContact CB-CB 4.15Å; N391-K394 PolarHBondContact O-N 3.46Å; N391-K394 PolarHBondContact OD1-N 3.46Å; K394-V396 HydrophobicContact CB-CG2 4.3Å; K394-E426 PolarHBondContact NZ-O 2.84Å; K394-D427 HydrophobicContact CD-CB 4.39Å; K394-D427 IonicContact NZ-OD1 3.5Å; K394-D427 PolarHBondContact NZ-OD1 2.92Å; K394-V429 HydrophobicContact CB-CG2 4.31Å
395	T	97.8	Very high	94.3	Very high	4 Å²	4	36.3 Å²	36.3	3%	0.025	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.4	115	166.8	-62.1	0	0	0	0	107.7	D427 V428 V429 L453 F454 M482	T395-D427 PolarHBondContact N-O 3.19Å; T395-V428 WeakPolarHBondContact O-CA 3.21Å; T395-V429 PolarHBondContact O-N 3.09Å; T395-L453 HydrophobicContact CG2-CD1 3.95Å; T395-L453 HydrophobicContact CG2-CD2 3.92Å; T395-L453 HydrophobicContact CG2-CG 3.92Å; T395-F454 CarbonylContact C-O 3.55Å; T395-F454 WeakPolarHBondContact CA-O 3.31Å; T395-M482 HydrophobicContact CG2-CG 3.89Å
396	V	98.1	Very high	94.2	Very high	0 Å²	0	42.5 Å²	42.5	0%	0	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106	126.9	-177.6	-171.8	0	0	0	0	109.2	V388 K394 V398 V429 A431 L453 F454	V388-V396 HydrophobicContact CG1-CG1 4.23Å; V388-V396 HydrophobicContact CG1-CG2 4.49Å; V388-V396 WeakPolarHBondContact O-CG2 3.3Å; K394-V396 HydrophobicContact CB-CG2 4.3Å; V396-V398 HydrophobicContact CG1-CG2 3.61Å; V396-V429 CarbonylContact C-O 3.37Å; V396-V429 WeakPolarHBondContact CA-O 3.48Å; V396-V429 HydrophobicContact CB-CB 4.36Å; V396-V429 HydrophobicContact CG1-CB 4.06Å; V396-V429 HydrophobicContact CG1-CG1 4.07Å; V396-V429 HydrophobicContact CG2-CB 3.99Å; V396-V429 HydrophobicContact CG2-CG2 4.42Å; V396-A431 HydrophobicContact CG1-CB 4.47Å; V396-L453 CarbonylContact O-C 3.56Å; V396-L453 WeakPolarHBondContact O-CA 3.18Å; V396-F454 HydrophobicContact CB-CB 4.28Å; V396-F454 PolarHBondContact N-O 2.86Å; V396-F454 PolarHBondContact O-N 2.84Å
397	F	98	Very high	94.1	Very high	0 Å²	0	43.6 Å²	43.6	0%	0	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	117.8	171.6	-157.6	-177	0	0	0	108.3	W415 L418 V429 I430 A431 L451 C452 L453 Y465 L474 F477 M478	F397-W415 HydrophobicContact CB-CH2 4.29Å; F397-W415 HydrophobicContact CB-CZ2 4.45Å; F397-W415 AromaticContact CD1-CH2 3.83Å; F397-W415 HydrophobicContact CD1-CH2 3.83Å; F397-W415 HydrophobicContact CD1-CZ3 4.33Å; F397-W415 AromaticContact CD2-CH2 3.73Å; F397-W415 HydrophobicContact CD2-CH2 3.73Å; F397-W415 HydrophobicContact CD2-CZ2 4.49Å; F397-W415 HydrophobicContact CE1-CH2 4.09Å; F397-W415 HydrophobicContact CE1-CZ3 4.24Å; F397-W415 HydrophobicContact CE2-CH2 4.01Å; F397-W415 AromaticContact CG-CH2 3.66Å; F397-W415 HydrophobicContact CG-CH2 3.66Å; F397-W415 HydrophobicContact CG-CZ2 4.29Å; F397-W415 HydrophobicContact CZ-CH2 4.18Å; F397-W415 HydrophobicContact CZ-CZ3 4.39Å; F397-W415 WeakPolarHBondContact O-CZ2 3.37Å; F397-L418 HydrophobicContact CD1-CD2 3.83Å; F397-L418 HydrophobicContact CE1-CD2 4.09Å; F397-V429 PolarHBondContact N-O 3.42Å; F397-I430 HydrophobicContact CB-CD1 3.82Å; F397-A431 PolarHBondContact O-N 3.41Å; F397-L451 HydrophobicContact CE2-CB 3.8Å; F397-L451 HydrophobicContact CZ-CB 4.03Å; F397-L451 HydrophobicContact CZ-CD2 4.45Å; F397-C452 WeakPolarHBondContact CD2-O 3.39Å; F397-L453 HydrophobicContact CD2-CB 3.89Å; F397-L453 HydrophobicContact CE2-CB 4.15Å; F397-L453 HydrophobicContact CG-CB 4.42Å; F397-Y465 HydrophobicContact CZ-CG 4.25Å; F397-L474 HydrophobicContact CE1-CD2 3.83Å; F397-L474 HydrophobicContact CZ-CD2 3.97Å; F397-F477 HydrophobicContact CE1-CD1 4.29Å; F397-F477 HydrophobicContact CE2-CE1 4.27Å; F397-F477 HydrophobicContact CZ-CD1 4.06Å; F397-F477 HydrophobicContact CZ-CE1 4.01Å; F397-M478 HydrophobicContact CD1-CG 3.76Å; F397-M478 HydrophobicContact CD1-SD 3.63Å; F397-M478 HydrophobicContact CE1-CG 4.09Å; F397-M478 HydrophobicContact CE1-SD 4.23Å
398	V	97.4	Very high	94.2	Very high	0 Å²	0	35.2 Å²	35.2	0%	0	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	128.6	-172.9	-171	0	0	0	0	110.4	L380 L385 A389 V396 F400 A431 I433 C452 F454	L380-V398 HydrophobicContact CD1-CG1 4.19Å; L380-V398 HydrophobicContact CD1-CG2 4.22Å; L385-V398 HydrophobicContact CD1-CG1 4.4Å; A389-V398 HydrophobicContact CB-CG2 4.49Å; V396-V398 HydrophobicContact CG1-CG2 3.61Å; V398-F400 HydrophobicContact CB-CD2 4.05Å; V398-F400 HydrophobicContact CB-CE2 3.6Å; V398-F400 HydrophobicContact CB-CZ 4.33Å; V398-F400 HydrophobicContact CG1-CD2 3.79Å; V398-F400 HydrophobicContact CG1-CE2 3.52Å; V398-F400 HydrophobicContact CG1-CG 4.45Å; V398-F400 HydrophobicContact CG1-CZ 3.95Å; V398-A431 CarbonylContact C-O 3.53Å; V398-A431 VanDerWaalsContact CA-O 3.3Å; V398-A431 WeakPolarHBondContact CA-O 3.11Å; V398-A431 HydrophobicContact CG2-CB 4.38Å; V398-I433 HydrophobicContact CG1-CG2 3.9Å; V398-C452 PolarHBondContact N-O 2.94Å; V398-C452 PolarHBondContact O-N 2.76Å; V398-F454 HydrophobicContact CB-CE2 3.96Å; V398-F454 HydrophobicContact CG2-CD2 3.89Å; V398-F454 HydrophobicContact CG2-CE2 3.6Å; V398-F454 HydrophobicContact CG2-CZ 4.46Å
399	L	96.6	Very high	94.1	Very high	0 Å²	0	39.5 Å²	39.5	0%	0	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.6	112.3	166.6	171.9	63	0	0	0	109.1	Y401 V411 F412 W415 A431 Q432 I433 P449 L451	L399-Y401 HydrophobicContact CG-CD1 4.4Å; L399-V411 HydrophobicContact CD1-CB 4.44Å; L399-V411 HydrophobicContact CD1-CG1 3.96Å; L399-V411 HydrophobicContact CD2-CB 4.25Å; L399-V411 HydrophobicContact CD2-CG1 3.95Å; L399-F412 HydrophobicContact CD2-CD1 3.87Å; L399-F412 HydrophobicContact CD2-CE1 4.05Å; L399-W415 HydrophobicContact CB-CD2 3.79Å; L399-W415 VanDerWaalsContact CB-CE2 3.4Å; L399-W415 HydrophobicContact CB-CE3 4.32Å; L399-W415 HydrophobicContact CB-CG 4.2Å; L399-W415 HydrophobicContact CB-CH2 4.19Å; L399-W415 HydrophobicContact CB-CZ2 3.64Å; L399-W415 HydrophobicContact CD2-CB 4.29Å; L399-W415 HydrophobicContact CD2-CD2 4.24Å; L399-W415 HydrophobicContact CD2-CG 3.99Å; L399-A431 PolarHBondContact N-O 3.42Å; L399-Q432 HydrophobicContact CB-CB 4.01Å; L399-Q432 CarbonylContact O-C 3.37Å; L399-Q432 WeakPolarHBondContact O-CA 3.31Å; L399-I433 PolarHBondContact O-N 3.18Å; L399-P449 HydrophobicContact CD1-CB 3.85Å; L399-L451 HydrophobicContact CD1-CD1 3.92Å; L399-L451 HydrophobicContact CD1-CG 4.37Å
400	F	94.8	Very high	94.1	Very high	0 Å²	0	43 Å²	43	0%	0	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.5	119.4	170.2	-68.5	-99.4	0	0	0	108.6	L385 V398 I433 I440 M444 Y448 P449 S450 C452 F454	L385-F400 HydrophobicContact CD1-CE1 4.03Å; L385-F400 HydrophobicContact CD1-CZ 3.78Å; L385-F400 HydrophobicContact CD2-CE1 3.76Å; L385-F400 HydrophobicContact CD2-CZ 4.07Å; V398-F400 HydrophobicContact CB-CD2 4.05Å; V398-F400 HydrophobicContact CB-CE2 3.6Å; V398-F400 HydrophobicContact CB-CZ 4.33Å; V398-F400 HydrophobicContact CG1-CD2 3.79Å; V398-F400 HydrophobicContact CG1-CE2 3.52Å; V398-F400 HydrophobicContact CG1-CG 4.45Å; V398-F400 HydrophobicContact CG1-CZ 3.95Å; F400-I433 HydrophobicContact CB-CG2 4.36Å; F400-I433 HydrophobicContact CD1-CG2 3.19Å; F400-I433 HydrophobicContact CD2-CG2 4.4Å; F400-I433 HydrophobicContact CE1-CG2 3.47Å; F400-I433 VanDerWaalsContact CE1-CG2 3.47Å; F400-I433 HydrophobicContact CG-CG2 3.74Å; F400-I433 HydrophobicContact CZ-CG2 4.22Å; F400-I440 HydrophobicContact CD1-CD1 3.52Å; F400-I440 HydrophobicContact CD1-CG1 4.34Å; F400-I440 HydrophobicContact CE1-CD1 3.83Å; F400-I440 HydrophobicContact CE1-CG1 4.17Å; F400-I440 HydrophobicContact CE1-CG2 4.03Å; F400-M444 HydrophobicContact CB-CE 4.01Å; F400-M444 HydrophobicContact CB-SD 4.32Å; F400-M444 HydrophobicContact CD1-CE 3.87Å; F400-M444 HydrophobicContact CD1-SD 3.39Å; F400-M444 WeakPolarHBondContact CD1-SD 3.38Å; F400-M444 HydrophobicContact CD2-CE 3.07Å; F400-M444 HydrophobicContact CD2-SD 3.79Å; F400-M444 HydrophobicContact CE1-CE 4.02Å; F400-M444 HydrophobicContact CE1-SD 3.37Å; F400-M444 WeakPolarHBondContact CE1-SD 3.37Å; F400-M444 HydrophobicContact CE2-CE 3.24Å; F400-M444 HydrophobicContact CE2-SD 3.75Å; F400-M444 HydrophobicContact CG-CE 3.38Å; F400-M444 HydrophobicContact CG-SD 3.57Å; F400-M444 VanDerWaalsContact CG-SD 3.57Å; F400-M444 HydrophobicContact CZ-CE 3.71Å; F400-M444 HydrophobicContact CZ-SD 3.53Å; F400-M444 VanDerWaalsContact CZ-SD 3.53Å; F400-Y448 HydrophobicContact CB-CD1 4.23Å; F400-Y448 HydrophobicContact CB-CE1 3.95Å; F400-P449 CarbonylContact O-C 3.59Å; F400-P449 VanDerWaalsContact O-CA 3.27Å; F400-P449 WeakPolarHBondContact O-CA 3.27Å; F400-S450 PolarHBondContact N-O 2.78Å; F400-S450 PolarHBondContact O-N 2.93Å; F400-C452 HydrophobicContact CD2-CB 4.15Å; F400-C452 HydrophobicContact CE2-CB 3.86Å; F400-F454 HydrophobicContact CE2-CE2 4.04Å; F400-F454 HydrophobicContact CE2-CZ 4.07Å; F400-F454 HydrophobicContact CZ-CE2 4.4Å; F400-F454 HydrophobicContact CZ-CZ 4.02Å
401	Y	93.7	Very high	94.2	Very high	28 Å²	28	41.1 Å²	41.1	11%	0.11	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.4	166.4	-171.9	73	-93.8	0	0	0	112.1	L399 A403 F412 Q432 I433 D434 A435	L399-Y401 HydrophobicContact CG-CD1 4.4Å; Y401-A403 HydrophobicContact CE2-CB 4.1Å; Y401-F412 HydrophobicContact CD1-CE1 4.03Å; Y401-F412 HydrophobicContact CD1-CZ 4.45Å; Y401-F412 AromaticContact CD2-CE1 3.98Å; Y401-F412 HydrophobicContact CD2-CE1 3.98Å; Y401-F412 AromaticContact CD2-CZ 3.7Å; Y401-F412 HydrophobicContact CD2-CZ 3.7Å; Y401-F412 HydrophobicContact CE1-CE1 4.36Å; Y401-F412 HydrophobicContact CE2-CE1 4.34Å; Y401-F412 AromaticContact CE2-CZ 3.81Å; Y401-F412 HydrophobicContact CE2-CZ 3.81Å; Y401-F412 AromaticContact CG-CE1 3.84Å; Y401-F412 HydrophobicContact CG-CE1 3.84Å; Y401-F412 HydrophobicContact CG-CZ 4.06Å; Y401-Q432 HydrophobicContact CD1-CB 4.18Å; Y401-Q432 HydrophobicContact CE1-CB 3.98Å; Y401-Q432 HydrophobicContact CE1-CG 3.94Å; Y401-I433 WeakPolarHBondContact CD1-O 3.48Å; Y401-I433 WeakPolarHBondContact CE1-O 3.49Å; Y401-I433 PolarHBondContact N-O 2.95Å; Y401-D434 HydrophobicContact CD2-CB 4.46Å; Y401-D434 HydrophobicContact CE1-CB 4.38Å; Y401-D434 HydrophobicContact CE2-CB 3.73Å; Y401-A435 WeakPolarHBondContact O-CB 3.41Å; Y401-A435 PolarHBondContact O-N 3.22Å
402	L	91.3	Very high	94.3	Very high	24 Å²	24	41 Å²	41	13%	0.126	21%	0.213	C	C	.	.			trans	-112.7	118.6	169.6	-60	171.4	0	0	0	107.9	Y404 S405 S408 A435 Y448	L402-Y404 HydrophobicContact CB-CD1 4.39Å; L402-Y404 HydrophobicContact CB-CE1 4.04Å; L402-Y404 HydrophobicContact CB-CE2 4.25Å; L402-Y404 HydrophobicContact CD1-CE2 4.16Å; L402-Y404 HydrophobicContact CD2-CE1 4.37Å; L402-Y404 PolarHBondContact O-N 3.33Å; L402-Y404 VanDerWaalsContact O-N 3.15Å; L402-S405 PolarHBondContact O-N 2.98Å; L402-S408 PolarHBondContact N-OG 3.3Å; L402-S408 VanDerWaalsContact N-OG 3.11Å; L402-S408 VanDerWaalsContact O-CB 3.3Å; L402-S408 WeakPolarHBondContact O-CB 3.47Å; L402-A435 HydrophobicContact CD2-CB 4.13Å; L402-Y448 HydrophobicContact CD1-CD2 3.77Å; L402-Y448 HydrophobicContact CD1-CG 3.89Å; L402-Y448 HydrophobicContact CD2-CD1 4.48Å; L402-Y448 HydrophobicContact CD2-CD2 3.94Å; L402-Y448 HydrophobicContact CD2-CE2 4.23Å; L402-Y448 HydrophobicContact CD2-CG 4.07Å; L402-Y448 HydrophobicContact CG-CD1 4.31Å; L402-Y448 HydrophobicContact CG-CD2 3.88Å; L402-Y448 HydrophobicContact CG-CG 3.68Å
403	A	91	Very high	94.4	Very high	41 Å²	41	42.6 Å²	42.6	34%	0.339	22%	0.223	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58.2	-32.6	-173.2	0	0	0	0	0	113.8	Y401 S405 R409 D434	Y401-A403 HydrophobicContact CE2-CB 4.1Å; A403-S405 VanDerWaalsContact C-N 3.28Å; A403-S405 PolarHBondContact O-N 2.78Å; A403-R409 PolarHBondContact O-NH1 3.39Å; A403-D434 WeakPolarHBondContact CB-OD2 3.27Å; A403-D434 PolarHBondContact N-OD1 3.4Å
404	Y	88.2	Confident	94.5	Very high	47 Å²	47	39.2 Å²	39.2	18%	0.184	21%	0.205	C	C	.	.	T	Hydrogen-bonded Turn	trans	-74.3	-17.3	177.6	55.8	-95.6	0	0	0	113.3	L338 S339 E340 L402 R409	L338-Y404 HydrophobicContact CB-CD1 3.78Å; L338-Y404 HydrophobicContact CB-CE1 4.2Å; L338-Y404 HydrophobicContact CB-CG 4.44Å; L338-Y404 HydrophobicContact CD2-CD1 3.81Å; L338-Y404 HydrophobicContact CD2-CE1 3.64Å; L338-Y404 HydrophobicContact CG-CD1 4.38Å; S339-Y404 VanDerWaalsContact O-CE2 3.29Å; S339-Y404 WeakPolarHBondContact O-CE2 3.47Å; E340-Y404 HydrophobicContact CG-CD2 3.93Å; E340-Y404 HydrophobicContact CG-CE2 4.5Å; L402-Y404 HydrophobicContact CB-CD1 4.39Å; L402-Y404 HydrophobicContact CB-CE1 4.04Å; L402-Y404 HydrophobicContact CB-CE2 4.25Å; L402-Y404 HydrophobicContact CD1-CE2 4.16Å; L402-Y404 HydrophobicContact CD2-CE1 4.37Å; L402-Y404 PolarHBondContact O-N 3.33Å; L402-Y404 VanDerWaalsContact O-N 3.15Å; Y404-R409 PolarHBondContact O-NH1 3.04Å
405	S	90.9	Very high	94.6	Very high	12 Å²	12	36.3 Å²	36.3	8%	0.084	19%	0.192	C	C	.	.			trans	-85.4	129.8	-172.7	176.3	0	0	0	0	114.7	E340 L402 A403 M407 S408 R409	E340-S405 VanDerWaalsContact OE1-C 3.29Å; E340-S405 WeakPolarHBondContact OE1-CA 3.3Å; E340-S405 VanDerWaalsContact OE1-CB 3.27Å; E340-S405 WeakPolarHBondContact OE1-CB 3.19Å; E340-S405 PolarHBondContact OE1-OG 2.9Å; L402-S405 PolarHBondContact O-N 2.98Å; A403-S405 VanDerWaalsContact C-N 3.28Å; A403-S405 PolarHBondContact O-N 2.78Å; S405-M407 PolarHBondContact OG-N 2.81Å; S405-S408 WeakPolarHBondContact O-CB 3.27Å; S405-S408 PolarHBondContact O-N 2.89Å; S405-S408 PolarHBondContact OG-N 2.84Å; S405-R409 WeakPolarHBondContact O-CG 3.46Å; S405-R409 PolarHBondContact O-N 3.02Å
406	E	91	Very high	94.6	Very high	136 Å²	136	42.5 Å²	42.5	64%	0.636	22%	0.221	S	C	*	.	H	α-helix	trans	-64.7	-44.1	174.9	-171.6	179.2	177.1	0	0	111.5	E340 S408 R409 A410	E340-E406 PolarHBondContact OE1-N 2.99Å; E406-S408 PolarHBondContact O-N 2.73Å; E406-R409 PolarHBondContact O-N 3.36Å; E406-A410 WeakPolarHBondContact O-CB 3.48Å; E406-A410 PolarHBondContact O-N 3.46Å
407	M	90.6	Very high	94.5	Very high	126 Å²	126	47.9 Å²	47.9	62%	0.621	25%	0.246	S	C	*	.	H	α-helix	trans	-58.6	-34.7	176	-68.3	-175.5	69.5	0	0	112.4	S405	S405-M407 PolarHBondContact OG-N 2.81Å
408	S	93.6	Very high	94.6	Very high	0 Å²	0	47.9 Å²	47.9	0%	0	25%	0.246	C	C	.	.	H	α-helix	trans	-68.5	-51.7	174.4	-79	0	0	0	0	111.8	L402 S405 E406 A410 V411	L402-S408 PolarHBondContact N-OG 3.3Å; L402-S408 VanDerWaalsContact N-OG 3.11Å; L402-S408 VanDerWaalsContact O-CB 3.3Å; L402-S408 WeakPolarHBondContact O-CB 3.47Å; S405-S408 WeakPolarHBondContact O-CB 3.27Å; S405-S408 PolarHBondContact O-N 2.89Å; S405-S408 PolarHBondContact OG-N 2.84Å; E406-S408 PolarHBondContact O-N 2.73Å; S408-A410 VanDerWaalsContact C-N 3.25Å; S408-A410 PolarHBondContact O-N 3.02Å; S408-V411 WeakPolarHBondContact O-CB 3.38Å; S408-V411 PolarHBondContact O-N 2.89Å; S408-V411 VanDerWaalsContact O-N 3.08Å
409	R	93.6	Very high	94.6	Very high	111 Å²	111	48.1 Å²	48.1	42%	0.419	25%	0.248	S	C	.	.	H	α-helix	trans	-62.1	-32.6	-179.5	-68.6	-171.1	-64.3	-96.2	-3.1	112.7	A403 Y404 S405 E406 V411 F412	A403-R409 PolarHBondContact O-NH1 3.39Å; Y404-R409 PolarHBondContact O-NH1 3.04Å; S405-R409 WeakPolarHBondContact O-CG 3.46Å; S405-R409 PolarHBondContact O-N 3.02Å; E406-R409 PolarHBondContact O-N 3.36Å; R409-V411 PolarHBondContact O-N 3.27Å; R409-V411 VanDerWaalsContact O-N 3.14Å; R409-F412 HydrophobicContact CB-CD2 4.24Å; R409-F412 HydrophobicContact CB-CE2 4.05Å; R409-F412 HydrophobicContact CG-CD2 4.38Å; R409-F412 HydrophobicContact CG-CE2 3.72Å; R409-F412 HydrophobicContact CG-CZ 4.19Å; R409-F412 WeakPolarHBondContact O-CB 3.4Å; R409-F412 WeakPolarHBondContact O-CG 3.36Å; R409-F412 PolarHBondContact O-N 2.97Å; R409-F412 VanDerWaalsContact O-N 3.11Å
410	A	94.9	Very high	94.6	Very high	75 Å²	75	52.8 Å²	52.8	62%	0.62	27%	0.27	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.1	-18.3	176.6	0	0	0	0	0	113.8	E406 S408	E406-A410 WeakPolarHBondContact O-CB 3.48Å; E406-A410 PolarHBondContact O-N 3.46Å; S408-A410 VanDerWaalsContact C-N 3.25Å; S408-A410 PolarHBondContact O-N 3.02Å
411	V	95.9	Very high	94.7	Very high	6 Å²	6	55.3 Å²	55.3	4%	0.036	29%	0.291	C	S	.	.	T	Hydrogen-bonded Turn	trans	-83.8	-20.3	177.6	-175.8	0	0	0	0	112.2	L399 S408 R409 L414 W415 P449	L399-V411 HydrophobicContact CD1-CB 4.44Å; L399-V411 HydrophobicContact CD1-CG1 3.96Å; L399-V411 HydrophobicContact CD2-CB 4.25Å; L399-V411 HydrophobicContact CD2-CG1 3.95Å; S408-V411 WeakPolarHBondContact O-CB 3.38Å; S408-V411 PolarHBondContact O-N 2.89Å; S408-V411 VanDerWaalsContact O-N 3.08Å; R409-V411 PolarHBondContact O-N 3.27Å; R409-V411 VanDerWaalsContact O-N 3.14Å; V411-L414 WeakPolarHBondContact O-CB 3.48Å; V411-L414 PolarHBondContact O-N 2.95Å; V411-W415 PolarHBondContact O-N 3.39Å; V411-P449 HydrophobicContact CG2-CB 4.34Å; V411-P449 HydrophobicContact CG2-CG 3.8Å
412	F	96.4	Very high	94.8	Very high	53 Å²	53	54.2 Å²	54.2	23%	0.232	29%	0.287	C	S	.	.	H	α-helix	trans	-56.8	-45.3	-173.4	-59.7	-20.2	0	0	0	114	L399 Y401 R409 L414 W415 E416	L399-F412 HydrophobicContact CD2-CD1 3.87Å; L399-F412 HydrophobicContact CD2-CE1 4.05Å; Y401-F412 HydrophobicContact CD1-CE1 4.03Å; Y401-F412 HydrophobicContact CD1-CZ 4.45Å; Y401-F412 AromaticContact CD2-CE1 3.98Å; Y401-F412 HydrophobicContact CD2-CE1 3.98Å; Y401-F412 AromaticContact CD2-CZ 3.7Å; Y401-F412 HydrophobicContact CD2-CZ 3.7Å; Y401-F412 HydrophobicContact CE1-CE1 4.36Å; Y401-F412 HydrophobicContact CE2-CE1 4.34Å; Y401-F412 AromaticContact CE2-CZ 3.81Å; Y401-F412 HydrophobicContact CE2-CZ 3.81Å; Y401-F412 AromaticContact CG-CE1 3.84Å; Y401-F412 HydrophobicContact CG-CE1 3.84Å; Y401-F412 HydrophobicContact CG-CZ 4.06Å; R409-F412 HydrophobicContact CB-CD2 4.24Å; R409-F412 HydrophobicContact CB-CE2 4.05Å; R409-F412 HydrophobicContact CG-CD2 4.38Å; R409-F412 HydrophobicContact CG-CE2 3.72Å; R409-F412 HydrophobicContact CG-CZ 4.19Å; R409-F412 WeakPolarHBondContact O-CB 3.4Å; R409-F412 WeakPolarHBondContact O-CG 3.36Å; R409-F412 PolarHBondContact O-N 2.97Å; R409-F412 VanDerWaalsContact O-N 3.11Å; F412-L414 PolarHBondContact O-N 3.33Å; F412-W415 WeakPolarHBondContact O-CB 3.43Å; F412-W415 PolarHBondContact O-N 3.06Å; F412-E416 PolarHBondContact O-N 2.74Å
413	P	97.1	Very high	94.9	Very high	73 Å²	73	58.8 Å²	58.8	47%	0.474	31%	0.306	S	S	.	.	H	α-helix	trans	-61.5	-42.5	178.5	-23.4	35.1	0	0	0	112.8	W415 E416 E417	P413-W415 PolarHBondContact O-N 3.11Å; P413-E416 PolarHBondContact O-N 3.11Å; P413-E417 WeakPolarHBondContact O-CG 3.39Å; P413-E417 PolarHBondContact O-N 3.3Å
414	L	97.7	Very high	95.1	Very high	26 Å²	26	63.4 Å²	63.4	14%	0.136	33%	0.325	C	S	.	.	H	α-helix	trans	-62.7	-34.3	175.9	178.4	68.9	0	0	0	111.6	V411 F412 L418 R469 I471 L474	V411-L414 WeakPolarHBondContact O-CB 3.48Å; V411-L414 PolarHBondContact O-N 2.95Å; F412-L414 PolarHBondContact O-N 3.33Å; L414-L418 WeakPolarHBondContact O-CB 3.28Å; L414-L418 PolarHBondContact O-N 2.91Å; L414-R469 HydrophobicContact CD2-CB 3.77Å; L414-R469 WeakPolarHBondContact CD2-O 3.39Å; L414-I471 HydrophobicContact CD1-CD1 3.55Å; L414-I471 HydrophobicContact CD1-CG1 3.85Å; L414-I471 HydrophobicContact CG-CD1 4.43Å; L414-L474 HydrophobicContact CD1-CD1 4.18Å; L414-L474 HydrophobicContact CD2-CD1 3.84Å; L414-L474 HydrophobicContact CG-CD1 3.96Å
415	W	97.9	Very high	95.4	Very high	0 Å²	0	65 Å²	65	0%	0	33%	0.331	C	S	.	.	H	α-helix	trans	-71.8	-38.9	179.9	-151.1	-117.9	0	0	0	112.2	F397 L399 V411 F412 P413 L418 A419 I430 A431 L451	F397-W415 HydrophobicContact CB-CH2 4.29Å; F397-W415 HydrophobicContact CB-CZ2 4.45Å; F397-W415 AromaticContact CD1-CH2 3.83Å; F397-W415 HydrophobicContact CD1-CH2 3.83Å; F397-W415 HydrophobicContact CD1-CZ3 4.33Å; F397-W415 AromaticContact CD2-CH2 3.73Å; F397-W415 HydrophobicContact CD2-CH2 3.73Å; F397-W415 HydrophobicContact CD2-CZ2 4.49Å; F397-W415 HydrophobicContact CE1-CH2 4.09Å; F397-W415 HydrophobicContact CE1-CZ3 4.24Å; F397-W415 HydrophobicContact CE2-CH2 4.01Å; F397-W415 AromaticContact CG-CH2 3.66Å; F397-W415 HydrophobicContact CG-CH2 3.66Å; F397-W415 HydrophobicContact CG-CZ2 4.29Å; F397-W415 HydrophobicContact CZ-CH2 4.18Å; F397-W415 HydrophobicContact CZ-CZ3 4.39Å; F397-W415 WeakPolarHBondContact O-CZ2 3.37Å; L399-W415 HydrophobicContact CB-CD2 3.79Å; L399-W415 VanDerWaalsContact CB-CE2 3.4Å; L399-W415 HydrophobicContact CB-CE3 4.32Å; L399-W415 HydrophobicContact CB-CG 4.2Å; L399-W415 HydrophobicContact CB-CH2 4.19Å; L399-W415 HydrophobicContact CB-CZ2 3.64Å; L399-W415 HydrophobicContact CD2-CB 4.29Å; L399-W415 HydrophobicContact CD2-CD2 4.24Å; L399-W415 HydrophobicContact CD2-CG 3.99Å; V411-W415 PolarHBondContact O-N 3.39Å; F412-W415 WeakPolarHBondContact O-CB 3.43Å; F412-W415 PolarHBondContact O-N 3.06Å; P413-W415 PolarHBondContact O-N 3.11Å; W415-L418 HydrophobicContact CE3-CD2 4.04Å; W415-L418 HydrophobicContact CH2-CD2 4.29Å; W415-L418 HydrophobicContact CZ3-CD2 3.85Å; W415-L418 PolarHBondContact O-N 3.17Å; W415-A419 PolarHBondContact O-N 3.03Å; W415-I430 HydrophobicContact CD2-CG2 4.2Å; W415-I430 HydrophobicContact CG-CG2 4.33Å; W415-I430 HydrophobicContact CZ2-CG2 4.04Å; W415-A431 WeakPolarHBondContact CZ2-O 3.33Å; W415-A431 PolarHBondContact NE1-O 2.98Å; W415-L451 HydrophobicContact CH2-CG 4.29Å; W415-L451 HydrophobicContact CZ3-CD2 3.78Å; W415-L451 HydrophobicContact CZ3-CG 3.86Å
416	E	97.3	Very high	95.2	Very high	134 Å²	134	72.7 Å²	72.7	63%	0.626	37%	0.365	S	S	*	.	H	α-helix	trans	-64.9	-46.1	171.4	-69.2	-177.4	169.9	0	0	111.6	V377 F412 P413 L418 A419 E420	V377-E416 HydrophobicContact CG2-CG 4.38Å; F412-E416 PolarHBondContact O-N 2.74Å; P413-E416 PolarHBondContact O-N 3.11Å; E416-L418 VanDerWaalsContact C-N 3.28Å; E416-L418 PolarHBondContact O-N 3.14Å; E416-A419 PolarHBondContact O-N 3.08Å; E416-E420 PolarHBondContact O-N 3.24Å
417	E	97.6	Very high	95.2	Very high	114 Å²	114	69.6 Å²	69.6	53%	0.533	35%	0.353	S	S	.	.	H	α-helix	trans	-59.2	-39	174.5	-76.8	178.9	-153.5	0	0	112.1	P413 E420 A421 I471	P413-E417 WeakPolarHBondContact O-CG 3.39Å; P413-E417 PolarHBondContact O-N 3.3Å; E417-E420 PolarHBondContact O-N 3.5Å; E417-A421 WeakPolarHBondContact O-CB 3.4Å; E417-A421 PolarHBondContact O-N 2.82Å; E417-I471 HydrophobicContact CB-CD1 3.61Å; E417-I471 HydrophobicContact CB-CG1 4.14Å
418	L	98.2	Very high	95.6	Very high	0 Å²	0	64.5 Å²	64.5	0%	0	33%	0.329	C	S	.	.	H	α-helix	trans	-64.7	-45.5	176.3	179	65.5	0	0	0	111.3	F397 L414 W415 E416 E420 A421 V422 I430 I471 L474 V475 M478	F397-L418 HydrophobicContact CD1-CD2 3.83Å; F397-L418 HydrophobicContact CE1-CD2 4.09Å; L414-L418 WeakPolarHBondContact O-CB 3.28Å; L414-L418 PolarHBondContact O-N 2.91Å; W415-L418 HydrophobicContact CE3-CD2 4.04Å; W415-L418 HydrophobicContact CH2-CD2 4.29Å; W415-L418 HydrophobicContact CZ3-CD2 3.85Å; W415-L418 PolarHBondContact O-N 3.17Å; E416-L418 VanDerWaalsContact C-N 3.28Å; E416-L418 PolarHBondContact O-N 3.14Å; L418-E420 VanDerWaalsContact C-N 3.29Å; L418-E420 PolarHBondContact O-N 3.32Å; L418-A421 PolarHBondContact O-N 2.86Å; L418-V422 HydrophobicContact CD1-CG1 4.35Å; L418-V422 WeakPolarHBondContact O-CG2 3.43Å; L418-V422 PolarHBondContact O-N 3.46Å; L418-I430 HydrophobicContact CD2-CD1 4.02Å; L418-I430 HydrophobicContact CG-CD1 4.19Å; L418-I471 HydrophobicContact CB-CD1 3.94Å; L418-L474 HydrophobicContact CD1-CB 3.93Å; L418-L474 HydrophobicContact CD2-CB 4.37Å; L418-L474 HydrophobicContact CD2-CD1 4.28Å; L418-V475 HydrophobicContact CD1-CG2 3.85Å; L418-M478 HydrophobicContact CD1-SD 4.03Å; L418-M478 HydrophobicContact CD2-SD 4.28Å; L418-M478 HydrophobicContact CG-SD 4.48Å
419	A	97.6	Very high	95.8	Very high	4 Å²	4	65.3 Å²	65.3	3%	0.033	33%	0.334	C	S	.	.	H	α-helix	trans	-59.6	-41.5	177.5	0	0	0	0	0	111.8	P376 V377 W415 E416 V422 K423 I430	P376-A419 HydrophobicContact CB-CB 3.76Å; V377-A419 HydrophobicContact CG2-CB 3.69Å; W415-A419 PolarHBondContact O-N 3.03Å; E416-A419 PolarHBondContact O-N 3.08Å; A419-V422 PolarHBondContact O-N 3.48Å; A419-K423 PolarHBondContact O-N 3.46Å; A419-K423 VanDerWaalsContact O-N 3.13Å; A419-I430 HydrophobicContact CB-CB 3.97Å; A419-I430 HydrophobicContact CB-CG1 4.18Å; A419-I430 HydrophobicContact CB-CG2 4.03Å
420	E	96.8	Very high	96	Very high	99 Å²	99	60.3 Å²	60.3	46%	0.463	32%	0.315	S	S	.	.	H	α-helix	trans	-65.6	-42	175	-177.5	59.2	-160.3	0	0	111.9	E416 E417 L418 V422 K423	E416-E420 PolarHBondContact O-N 3.24Å; E417-E420 PolarHBondContact O-N 3.5Å; L418-E420 VanDerWaalsContact C-N 3.29Å; L418-E420 PolarHBondContact O-N 3.32Å; E420-V422 PolarHBondContact O-N 3.41Å; E420-K423 WeakPolarHBondContact O-CG 3.27Å; E420-K423 PolarHBondContact O-N 2.75Å; E420-K423 WeakPolarHBondContact OE1-CD 2.97Å; E420-K423 WeakPolarHBondContact OE1-CE 3.4Å; E420-K423 IonicContact OE1-NZ 2.84Å; E420-K423 PolarHBondContact OE1-NZ 2.79Å
421	A	96.8	Very high	96.2	Very high	53 Å²	53	56.7 Å²	56.7	44%	0.438	29%	0.286	S	S	.	.	H	α-helix	trans	-64.8	-24.4	-179.4	0	0	0	0	0	114	E417 L418 I471 V475	E417-A421 WeakPolarHBondContact O-CB 3.4Å; E417-A421 PolarHBondContact O-N 2.82Å; L418-A421 PolarHBondContact O-N 2.86Å; A421-I471 HydrophobicContact CB-CG2 4.11Å; A421-V475 HydrophobicContact CB-CG2 4.5Å
422	V	96.1	Very high	96.2	Very high	5 Å²	5	57.3 Å²	57.3	3%	0.03	29%	0.288	C	S	.	.	T	Hydrogen-bonded Turn	trans	-114.1	11.4	-178.6	-54.1	0	0	0	0	113.3	L418 A419 E420 D424 W425 V428 I430 V475 M478	L418-V422 HydrophobicContact CD1-CG1 4.35Å; L418-V422 WeakPolarHBondContact O-CG2 3.43Å; L418-V422 PolarHBondContact O-N 3.46Å; A419-V422 PolarHBondContact O-N 3.48Å; E420-V422 PolarHBondContact O-N 3.41Å; V422-D424 PolarHBondContact O-N 3.04Å; V422-D424 VanDerWaalsContact O-N 3.11Å; V422-W425 HydrophobicContact CB-CB 4.48Å; V422-W425 HydrophobicContact CB-CD2 4.12Å; V422-W425 HydrophobicContact CB-CE3 4.5Å; V422-W425 HydrophobicContact CB-CG 4.14Å; V422-W425 HydrophobicContact CG1-CD2 4.25Å; V422-W425 HydrophobicContact CG1-CE3 4.42Å; V422-W425 HydrophobicContact CG1-CZ2 4.4Å; V422-W425 VanDerWaalsContact O-CB 3.3Å; V422-W425 WeakPolarHBondContact O-CB 3.46Å; V422-W425 PolarHBondContact O-N 3.12Å; V422-V428 HydrophobicContact CB-CG1 4.37Å; V422-V428 HydrophobicContact CG2-CG1 3.77Å; V422-I430 HydrophobicContact CG2-CD1 4.04Å; V422-I430 HydrophobicContact CG2-CG1 3.69Å; V422-V475 HydrophobicContact CG1-CG2 4.19Å; V422-M478 HydrophobicContact CG1-CE 4.11Å; V422-M478 HydrophobicContact CG1-SD 4.44Å; V422-M478 HydrophobicContact CG2-CE 4.36Å
423	K	94.1	Very high	96.1	Very high	120 Å²	120	54.8 Å²	54.8	52%	0.522	28%	0.277	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.8	-30.6	-175.1	72.3	-173.9	179.4	-177.3	0	114.4	A419 E420 W425	A419-K423 PolarHBondContact O-N 3.46Å; A419-K423 VanDerWaalsContact O-N 3.13Å; E420-K423 WeakPolarHBondContact O-CG 3.27Å; E420-K423 PolarHBondContact O-N 2.75Å; E420-K423 WeakPolarHBondContact OE1-CD 2.97Å; E420-K423 WeakPolarHBondContact OE1-CE 3.4Å; E420-K423 IonicContact OE1-NZ 2.84Å; E420-K423 PolarHBondContact OE1-NZ 2.79Å; K423-W425 VanDerWaalsContact C-N 3.3Å
424	D	94.1	Very high	96	Very high	137 Å²	137	52 Å²	52	73%	0.733	26%	0.258	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.8	2.1	-179.2	-58.8	-45.2	0	0	0	112.5	V422 E426	V422-D424 PolarHBondContact O-N 3.04Å; V422-D424 VanDerWaalsContact O-N 3.11Å; D424-E426 PolarHBondContact O-N 3.34Å
425	W	94.7	Very high	95.6	Very high	82 Å²	82	51.1 Å²	51.1	31%	0.311	26%	0.255	S	S	.	.			trans	-87	102.9	177.6	-66.1	23.1	0	0	0	109.4	V422 K423 D427 V428 V475 M478 D479 M482	V422-W425 HydrophobicContact CB-CB 4.48Å; V422-W425 HydrophobicContact CB-CD2 4.12Å; V422-W425 HydrophobicContact CB-CE3 4.5Å; V422-W425 HydrophobicContact CB-CG 4.14Å; V422-W425 HydrophobicContact CG1-CD2 4.25Å; V422-W425 HydrophobicContact CG1-CE3 4.42Å; V422-W425 HydrophobicContact CG1-CZ2 4.4Å; V422-W425 VanDerWaalsContact O-CB 3.3Å; V422-W425 WeakPolarHBondContact O-CB 3.46Å; V422-W425 PolarHBondContact O-N 3.12Å; K423-W425 VanDerWaalsContact C-N 3.3Å; W425-D427 PolarHBondContact O-N 2.93Å; W425-V428 HydrophobicContact CB-CB 4.04Å; W425-V428 HydrophobicContact CB-CG2 4.03Å; W425-V428 HydrophobicContact CD2-CG2 4.48Å; W425-V428 HydrophobicContact CE3-CG2 3.67Å; W425-V428 PolarHBondContact O-N 3.5Å; W425-V475 HydrophobicContact CH2-CG1 3.78Å; W425-V475 HydrophobicContact CZ2-CG1 3.85Å; W425-M478 HydrophobicContact CZ3-CB 4.23Å; W425-M478 HydrophobicContact CZ3-CE 4.4Å; W425-D479 HydrophobicContact CH2-CB 4.22Å; W425-M482 HydrophobicContact CE3-CE 4.32Å; W425-M482 HydrophobicContact CE3-SD 3.7Å; W425-M482 HydrophobicContact CZ3-SD 3.65Å
426	E	86.9	Confident	95.1	Very high	173 Å²	173	51.4 Å²	51.4	81%	0.808	26%	0.257	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.9	-28.7	-172.5	-64.2	-176.2	167	0	0	114.4	K394 D424	K394-E426 PolarHBondContact NZ-O 2.84Å; D424-E426 PolarHBondContact O-N 3.34Å
427	D	92.6	Very high	94.7	Very high	70 Å²	70	46.1 Å²	46.1	37%	0.374	24%	0.236	S	C	.	.	T	Hydrogen-bonded Turn	trans	-108	23.3	-175.1	-65.8	-37	0	0	0	115	K394 T395 W425	K394-D427 HydrophobicContact CD-CB 4.39Å; K394-D427 IonicContact NZ-OD1 3.5Å; K394-D427 PolarHBondContact NZ-OD1 2.92Å; T395-D427 PolarHBondContact N-O 3.19Å; W425-D427 PolarHBondContact O-N 2.93Å
428	V	97.3	Very high	94.3	Very high	20 Å²	20	40.8 Å²	40.8	12%	0.121	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	142.7	178.6	168	0	0	0	0	112.2	T395 V422 W425 I430 M478 M482	T395-V428 WeakPolarHBondContact O-CA 3.21Å; V422-V428 HydrophobicContact CB-CG1 4.37Å; V422-V428 HydrophobicContact CG2-CG1 3.77Å; W425-V428 HydrophobicContact CB-CB 4.04Å; W425-V428 HydrophobicContact CB-CG2 4.03Å; W425-V428 HydrophobicContact CD2-CG2 4.48Å; W425-V428 HydrophobicContact CE3-CG2 3.67Å; W425-V428 PolarHBondContact O-N 3.5Å; V428-I430 HydrophobicContact CG1-CD1 3.95Å; V428-I430 HydrophobicContact CG1-CG1 4.33Å; V428-M478 HydrophobicContact CB-CE 4.36Å; V428-M478 HydrophobicContact CG1-CE 3.38Å; V428-M478 HydrophobicContact CG2-CE 3.99Å; V428-M482 HydrophobicContact CG2-CE 3.85Å; V428-M482 HydrophobicContact CG2-SD 3.68Å
429	V	97.9	Very high	93.6	Very high	16 Å²	16	41.9 Å²	41.9	10%	0.097	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128	123.9	169.5	177.1	0	0	0	0	108.7	K378 V388 K394 T395 V396 F397 A431	K378-V429 HydrophobicContact CD-CG1 3.66Å; K378-V429 HydrophobicContact CG-CG1 4.2Å; V388-V429 HydrophobicContact CG1-CG1 4.34Å; K394-V429 HydrophobicContact CB-CG2 4.31Å; T395-V429 PolarHBondContact O-N 3.09Å; V396-V429 CarbonylContact C-O 3.37Å; V396-V429 WeakPolarHBondContact CA-O 3.48Å; V396-V429 HydrophobicContact CB-CB 4.36Å; V396-V429 HydrophobicContact CG1-CB 4.06Å; V396-V429 HydrophobicContact CG1-CG1 4.07Å; V396-V429 HydrophobicContact CG2-CB 3.99Å; V396-V429 HydrophobicContact CG2-CG2 4.42Å; F397-V429 PolarHBondContact N-O 3.42Å; V429-A431 HydrophobicContact CG1-CB 4.34Å
430	I	98.4	Very high	92.9	Very high	6 Å²	6	42.8 Å²	42.8	3%	0.031	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.8	128.5	167.6	-55.9	-53.4	0	0	0	108	V377 K378 F397 W415 L418 A419 V422 V428 M478	V377-I430 HydrophobicContact CG2-CG2 4.2Å; K378-I430 PolarHBondContact N-O 2.95Å; F397-I430 HydrophobicContact CB-CD1 3.82Å; W415-I430 HydrophobicContact CD2-CG2 4.2Å; W415-I430 HydrophobicContact CG-CG2 4.33Å; W415-I430 HydrophobicContact CZ2-CG2 4.04Å; L418-I430 HydrophobicContact CD2-CD1 4.02Å; L418-I430 HydrophobicContact CG-CD1 4.19Å; A419-I430 HydrophobicContact CB-CB 3.97Å; A419-I430 HydrophobicContact CB-CG1 4.18Å; A419-I430 HydrophobicContact CB-CG2 4.03Å; V422-I430 HydrophobicContact CG2-CD1 4.04Å; V422-I430 HydrophobicContact CG2-CG1 3.69Å; V428-I430 HydrophobicContact CG1-CD1 3.95Å; V428-I430 HydrophobicContact CG1-CG1 4.33Å; I430-M478 HydrophobicContact CD1-CE 3.88Å; I430-M478 HydrophobicContact CD1-SD 4.25Å
431	A	98.1	Very high	91.7	Very high	0 Å²	0	44.5 Å²	44.5	0%	0	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.1	165.5	-174.6	0	0	0	0	0	112	K378 L380 V396 F397 V398 L399 W415 V429	K378-A431 HydrophobicContact CB-CB 4.03Å; K378-A431 CarbonylContact O-C 3.56Å; K378-A431 WeakPolarHBondContact O-CA 3.5Å; K378-A431 WeakPolarHBondContact O-CB 3.27Å; L380-A431 HydrophobicContact CD1-CB 3.69Å; L380-A431 HydrophobicContact CD2-CB 4.36Å; L380-A431 HydrophobicContact CG-CB 3.86Å; V396-A431 HydrophobicContact CG1-CB 4.47Å; F397-A431 PolarHBondContact O-N 3.41Å; V398-A431 CarbonylContact C-O 3.53Å; V398-A431 VanDerWaalsContact CA-O 3.3Å; V398-A431 WeakPolarHBondContact CA-O 3.11Å; V398-A431 HydrophobicContact CG2-CB 4.38Å; L399-A431 PolarHBondContact N-O 3.42Å; W415-A431 WeakPolarHBondContact CZ2-O 3.33Å; W415-A431 PolarHBondContact NE1-O 2.98Å; V429-A431 HydrophobicContact CG1-CB 4.34Å
432	Q	97.2	Very high	90.6	Very high	18 Å²	18	43 Å²	43	8%	0.084	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.5	160	176	69	-177.2	28.4	0	0	111.5	V377 K378 E379 L380 L399 Y401	V377-Q432 HydrophobicContact CG1-CB 4.15Å; V377-Q432 HydrophobicContact CG1-CG 3.81Å; K378-Q432 PolarHBondContact O-N 3.26Å; E379-Q432 PolarHBondContact OE1-NE2 2.98Å; E379-Q432 WeakPolarHBondContact OE2-CG 3.45Å; E379-Q432 PolarHBondContact OE2-NE2 3.02Å; L380-Q432 WeakPolarHBondContact CB-O 3.2Å; L380-Q432 PolarHBondContact N-O 3.07Å; L399-Q432 HydrophobicContact CB-CB 4.01Å; L399-Q432 CarbonylContact O-C 3.37Å; L399-Q432 WeakPolarHBondContact O-CA 3.31Å; Y401-Q432 HydrophobicContact CD1-CB 4.18Å; Y401-Q432 HydrophobicContact CE1-CB 3.98Å; Y401-Q432 HydrophobicContact CE1-CG 3.94Å
433	I	95.1	Very high	89.1	Confident	0 Å²	0	48 Å²	48	0%	0	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.9	134.1	178.3	-178.8	164.2	0	0	0	111.3	L380 L385 V398 L399 F400 Y401 A435 N438	L380-I433 HydrophobicContact CB-CB 4.18Å; L380-I433 HydrophobicContact CB-CD1 4.44Å; L380-I433 WeakPolarHBondContact O-CG1 3.35Å; L385-I433 HydrophobicContact CB-CD1 4.21Å; L385-I433 HydrophobicContact CD1-CD1 4.38Å; L385-I433 HydrophobicContact CD2-CD1 4.16Å; L385-I433 HydrophobicContact CG-CD1 4.48Å; V398-I433 HydrophobicContact CG1-CG2 3.9Å; L399-I433 PolarHBondContact O-N 3.18Å; F400-I433 HydrophobicContact CB-CG2 4.36Å; F400-I433 HydrophobicContact CD1-CG2 3.19Å; F400-I433 HydrophobicContact CD2-CG2 4.4Å; F400-I433 HydrophobicContact CE1-CG2 3.47Å; F400-I433 VanDerWaalsContact CE1-CG2 3.47Å; F400-I433 HydrophobicContact CG-CG2 3.74Å; F400-I433 HydrophobicContact CZ-CG2 4.22Å; Y401-I433 WeakPolarHBondContact CD1-O 3.48Å; Y401-I433 WeakPolarHBondContact CE1-O 3.49Å; Y401-I433 PolarHBondContact N-O 2.95Å; I433-A435 PolarHBondContact O-N 3.24Å; I433-N438 HydrophobicContact CD1-CB 4.03Å; I433-N438 HydrophobicContact CG1-CB 4.25Å
434	D	93.6	Very high	87.8	Confident	14 Å²	14	42.5 Å²	42.5	8%	0.075	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78	103.7	170.1	-173.2	0.8	0	0	0	110.4	Y401 A403 S436 A437 N438	Y401-D434 HydrophobicContact CD2-CB 4.46Å; Y401-D434 HydrophobicContact CE1-CB 4.38Å; Y401-D434 HydrophobicContact CE2-CB 3.73Å; A403-D434 WeakPolarHBondContact CB-OD2 3.27Å; A403-D434 PolarHBondContact N-OD1 3.4Å; D434-S436 PolarHBondContact O-N 3.16Å; D434-S436 WeakPolarHBondContact OD1-CA 3.23Å; D434-S436 VanDerWaalsContact OD1-CB 3.22Å; D434-S436 WeakPolarHBondContact OD1-CB 3.36Å; D434-S436 PolarHBondContact OD1-N 2.97Å; D434-S436 PolarHBondContact OD1-OG 3.22Å; D434-S436 PolarHBondContact OD2-OG 2.94Å; D434-S436 VanDerWaalsContact OD2-OG 3.06Å; D434-A437 HydrophobicContact CB-CB 4.37Å; D434-A437 PolarHBondContact O-N 3.02Å; D434-N438 WeakPolarHBondContact O-CB 3.32Å; D434-N438 PolarHBondContact O-N 3.2Å; D434-N438 VanDerWaalsContact O-N 3.1Å; D434-N438 PolarHBondContact O-ND2 3.44Å
435	A	90.3	Very high	86.3	Confident	9 Å²	9	43.5 Å²	43.5	7%	0.074	23%	0.229	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69.6	-18.4	176.6	0	0	0	0	0	113.2	K362 Y401 L402 I433 A437 I440 Y448	K362-A435 PolarHBondContact NZ-O 2.8Å; Y401-A435 WeakPolarHBondContact O-CB 3.41Å; Y401-A435 PolarHBondContact O-N 3.22Å; L402-A435 HydrophobicContact CD2-CB 4.13Å; I433-A435 PolarHBondContact O-N 3.24Å; A435-A437 VanDerWaalsContact C-N 3.32Å; A435-I440 HydrophobicContact CB-CD1 3.4Å; A435-Y448 HydrophobicContact CB-CD1 4.04Å; A435-Y448 HydrophobicContact CB-CE1 3.23Å; A435-Y448 HydrophobicContact CB-CE2 4.33Å; A435-Y448 WeakPolarHBondContact CB-OH 3.2Å
436	S	87.3	Confident	85	Confident	6 Å²	6	41 Å²	41	4%	0.042	23%	0.229	C	C	.	.	T	Hydrogen-bonded Turn	trans	-74.5	-26.6	176.8	80.2	0	0	0	0	112.5	Q336 K362 D434	Q336-S436 PolarHBondContact OE1-O 3.28Å; K362-S436 PolarHBondContact NZ-O 3.35Å; D434-S436 PolarHBondContact O-N 3.16Å; D434-S436 WeakPolarHBondContact OD1-CA 3.23Å; D434-S436 VanDerWaalsContact OD1-CB 3.22Å; D434-S436 WeakPolarHBondContact OD1-CB 3.36Å; D434-S436 PolarHBondContact OD1-N 2.97Å; D434-S436 PolarHBondContact OD1-OG 3.22Å; D434-S436 PolarHBondContact OD2-OG 2.94Å; D434-S436 VanDerWaalsContact OD2-OG 3.06Å
437	A	89.2	Confident	84.7	Confident	23 Å²	23	36.9 Å²	36.9	19%	0.19	22%	0.219	C	C	.	.	T	Hydrogen-bonded Turn	trans	-105.4	-16.2	-178.6	0	0	0	0	0	114	E366 D434 A435	E366-A437 HydrophobicContact CG-CB 3.68Å; E366-A437 WeakPolarHBondContact OE2-CB 3.22Å; D434-A437 HydrophobicContact CB-CB 4.37Å; D434-A437 PolarHBondContact O-N 3.02Å; A435-A437 VanDerWaalsContact C-N 3.32Å
438	N	88.1	Confident	84.5	Confident	1 Å²	1	35.2 Å²	35.2	1%	0.005	21%	0.208	C	C	.	.	S	Bend	trans	-119.2	139.9	-179.6	-61.8	-87.4	0	0	0	111.3	K362 S365 E366 V381 G382 I433 D434	K362-N438 PolarHBondContact NZ-O 2.83Å; S365-N438 WeakPolarHBondContact CA-OD1 3.26Å; E366-N438 PolarHBondContact N-OD1 3.42Å; E366-N438 PolarHBondContact OE2-ND2 2.8Å; V381-N438 WeakPolarHBondContact CA-OD1 3.33Å; V381-N438 WeakPolarHBondContact CB-OD1 3.33Å; G382-N438 PolarHBondContact N-OD1 3.24Å; I433-N438 HydrophobicContact CD1-CB 4.03Å; I433-N438 HydrophobicContact CG1-CB 4.25Å; D434-N438 WeakPolarHBondContact O-CB 3.32Å; D434-N438 PolarHBondContact O-N 3.2Å; D434-N438 VanDerWaalsContact O-N 3.1Å; D434-N438 PolarHBondContact O-ND2 3.44Å
439	D	83.9	Confident	84.3	Confident	24 Å²	24	34.4 Å²	34.4	13%	0.128	20%	0.203	C	C	.	.			trans	-80.2	129	170	-75.5	-19.6	0	0	0	110	R315 K362 M364	R315-D439 VanDerWaalsContact CD-CG 3.49Å; R315-D439 WeakPolarHBondContact CD-OD2 3.02Å; R315-D439 IonicContact CZ-OD2 3.82Å; R315-D439 IonicContact NE-OD2 3.47Å; R315-D439 PolarHBondContact NE-OD2 3.02Å; R315-D439 VanDerWaalsContact NH1-CB 3.31Å; R315-D439 IonicContact NH1-OD2 3.75Å; R315-D439 PolarHBondContact NH1-OD2 3.46Å; K362-D439 WeakPolarHBondContact CE-OD1 3.43Å; K362-D439 IonicContact NZ-OD1 3.39Å; M364-D439 PolarHBondContact O-N 2.78Å
440	I	82.5	Confident	84	Confident	22 Å²	22	34 Å²	34	11%	0.113	20%	0.201	C	C	.	.			trans	-109.1	103.2	-178.8	-62.8	156.3	0	0	0	108.1	L385 F400 A435 M442 M444	L385-I440 HydrophobicContact CD2-CG1 4.28Å; L385-I440 HydrophobicContact CD2-CG2 4.03Å; F400-I440 HydrophobicContact CD1-CD1 3.52Å; F400-I440 HydrophobicContact CD1-CG1 4.34Å; F400-I440 HydrophobicContact CE1-CD1 3.83Å; F400-I440 HydrophobicContact CE1-CG1 4.17Å; F400-I440 HydrophobicContact CE1-CG2 4.03Å; A435-I440 HydrophobicContact CB-CD1 3.4Å; I440-M442 HydrophobicContact CG2-CB 3.85Å; I440-M442 HydrophobicContact CG2-CG 4.34Å; I440-M442 PolarHBondContact O-N 3.39Å; I440-M444 HydrophobicContact CG2-CG 4.39Å; I440-M444 HydrophobicContact CG2-SD 4.03Å
441	N	72.8	Confident	83.8	Confident	135 Å²	135	33.9 Å²	33.9	72%	0.722	20%	0.2	S	C	*	.			trans	-81.5	39.4	178.7	-164.1	28	0	0	0	112.4
442	M	72.9	Confident	83.7	Confident	23 Å²	23	33.9 Å²	33.9	11%	0.113	20%	0.2	C	C	.	.	S	Bend	trans	-126.9	135.3	-178.5	-64.6	-169.1	55.4	0	0	109.8	R317 L385 F390 I440 M444 F454 V462	R317-M442 PolarHBondContact NH1-O 3.21Å; L385-M442 HydrophobicContact CD2-SD 4.23Å; F390-M442 HydrophobicContact CE1-CE 4.19Å; F390-M442 HydrophobicContact CE2-CE 3.59Å; F390-M442 HydrophobicContact CE2-SD 3.71Å; F390-M442 HydrophobicContact CZ-CE 3.21Å; F390-M442 HydrophobicContact CZ-SD 4Å; I440-M442 HydrophobicContact CG2-CB 3.85Å; I440-M442 HydrophobicContact CG2-CG 4.34Å; I440-M442 PolarHBondContact O-N 3.39Å; M442-M444 HydrophobicContact CB-CG 4.3Å; M442-M444 PolarHBondContact O-N 3.03Å; M442-F454 HydrophobicContact CE-CD1 4.48Å; M442-F454 HydrophobicContact CE-CE1 3.45Å; M442-F454 VanDerWaalsContact CE-CE1 3.45Å; M442-F454 HydrophobicContact CE-CZ 4Å; M442-F454 HydrophobicContact SD-CE1 3.91Å; M442-F454 HydrophobicContact SD-CZ 4.27Å; M442-V462 HydrophobicContact CE-CG2 3.53Å
443	S	64.6	Low	83.7	Confident	110 Å²	110	33 Å²	33	77%	0.769	20%	0.196	S	C	*	.			trans	-72.5	83.4	172	-170.3	0	0	0	0	109.3
444	M	66.4	Low	83.8	Confident	4 Å²	4	33 Å²	33	2%	0.02	20%	0.196	C	C	.	.			trans	-84.3	114.8	171.2	-65.7	-167.1	75.9	0	0	108.2	F319 F400 I440 M442 G446 C452	F319-M444 WeakPolarHBondContact CE1-O 3.35Å; F319-M444 WeakPolarHBondContact CZ-O 3.44Å; F400-M444 HydrophobicContact CB-CE 4.01Å; F400-M444 HydrophobicContact CB-SD 4.32Å; F400-M444 HydrophobicContact CD1-CE 3.87Å; F400-M444 HydrophobicContact CD1-SD 3.39Å; F400-M444 WeakPolarHBondContact CD1-SD 3.38Å; F400-M444 HydrophobicContact CD2-CE 3.07Å; F400-M444 HydrophobicContact CD2-SD 3.79Å; F400-M444 HydrophobicContact CE1-CE 4.02Å; F400-M444 HydrophobicContact CE1-SD 3.37Å; F400-M444 WeakPolarHBondContact CE1-SD 3.37Å; F400-M444 HydrophobicContact CE2-CE 3.24Å; F400-M444 HydrophobicContact CE2-SD 3.75Å; F400-M444 HydrophobicContact CG-CE 3.38Å; F400-M444 HydrophobicContact CG-SD 3.57Å; F400-M444 VanDerWaalsContact CG-SD 3.57Å; F400-M444 HydrophobicContact CZ-CE 3.71Å; F400-M444 HydrophobicContact CZ-SD 3.53Å; F400-M444 VanDerWaalsContact CZ-SD 3.53Å; I440-M444 HydrophobicContact CG2-CG 4.39Å; I440-M444 HydrophobicContact CG2-SD 4.03Å; M442-M444 HydrophobicContact CB-CG 4.3Å; M442-M444 PolarHBondContact O-N 3.03Å; M444-G446 PolarHBondContact O-N 2.94Å; M444-C452 HydrophobicContact CE-CB 3.8Å; M444-C452 WeakPolarHBondContact CE-SG 3.12Å
445	Q	62.6	Low	83.9	Confident	158 Å²	158	32.7 Å²	32.7	74%	0.738	20%	0.195	S	C	*	.			trans	-80	102.7	170.6	-68.9	-176.5	-6	0	0	108.6	V464	Q445-V464 WeakPolarHBondContact O-CG2 3.18Å
446	G	67	Low	84.2	Confident	29 Å²	29	33.2 Å²	33.2	30%	0.299	20%	0.199	S	C	.	.	S	Bend	trans	151.7	163.6	170.4	0	0	0	0	0	115.1	F319 M444	F319-G446 WeakPolarHBondContact CD2-O 3.33Å; F319-G446 WeakPolarHBondContact CE2-O 3.35Å; M444-G446 PolarHBondContact O-N 2.94Å
447	S	79.9	Confident	84.5	Confident	86 Å²	86	33.1 Å²	33.1	60%	0.601	20%	0.198	S	C	*	.	P	Polyproline II helix	trans	-83.7	164.4	173.8	56.2	0	0	0	0	112.1	P449 S450	S447-P449 CarbonylContact O-C 3.57Å; S447-S450 WeakPolarHBondContact O-CB 3.4Å; S447-S450 PolarHBondContact O-N 2.85Å
448	Y	88.4	Confident	84.6	Confident	35 Å²	35	36.7 Å²	36.7	14%	0.137	21%	0.207	C	C	.	.	S	Bend	trans	-84.4	144.7	175	-62.8	-75.5	0	0	0	111.9	R317 F319 D320 F400 L402 A435	R317-Y448 PolarHBondContact NH2-OH 3.1Å; F319-Y448 HydrophobicContact CE2-CE2 4.37Å; D320-Y448 WeakPolarHBondContact OD1-CE2 3.3Å; F400-Y448 HydrophobicContact CB-CD1 4.23Å; F400-Y448 HydrophobicContact CB-CE1 3.95Å; L402-Y448 HydrophobicContact CD1-CD2 3.77Å; L402-Y448 HydrophobicContact CD1-CG 3.89Å; L402-Y448 HydrophobicContact CD2-CD1 4.48Å; L402-Y448 HydrophobicContact CD2-CD2 3.94Å; L402-Y448 HydrophobicContact CD2-CE2 4.23Å; L402-Y448 HydrophobicContact CD2-CG 4.07Å; L402-Y448 HydrophobicContact CG-CD1 4.31Å; L402-Y448 HydrophobicContact CG-CD2 3.88Å; L402-Y448 HydrophobicContact CG-CG 3.68Å; A435-Y448 HydrophobicContact CB-CD1 4.04Å; A435-Y448 HydrophobicContact CB-CE1 3.23Å; A435-Y448 HydrophobicContact CB-CE2 4.33Å; A435-Y448 WeakPolarHBondContact CB-OH 3.2Å
449	P	93.1	Very high	84.6	Confident	4 Å²	4	39 Å²	39	3%	0.026	23%	0.227	C	C	.	.	S	Bend	cis	-71.1	138.9	-9.9	29.8	-35.1	0	0	0	111.9	L399 F400 V411 S447 R469	L399-P449 HydrophobicContact CD1-CB 3.85Å; F400-P449 CarbonylContact O-C 3.59Å; F400-P449 VanDerWaalsContact O-CA 3.27Å; F400-P449 WeakPolarHBondContact O-CA 3.27Å; V411-P449 HydrophobicContact CG2-CB 4.34Å; V411-P449 HydrophobicContact CG2-CG 3.8Å; S447-P449 CarbonylContact O-C 3.57Å; P449-R469 PolarHBondContact O-NH2 2.8Å; P449-R469 VanDerWaalsContact O-NH2 3.16Å
450	S	92.4	Very high	84.8	Confident	8 Å²	8	45.5 Å²	45.5	6%	0.056	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	133.3	178.7	-175.7	0	0	0	0	110.7	F400 S447 C452	F400-S450 PolarHBondContact N-O 2.78Å; F400-S450 PolarHBondContact O-N 2.93Å; S447-S450 WeakPolarHBondContact O-CB 3.4Å; S447-S450 PolarHBondContact O-N 2.85Å; S450-C452 PolarHBondContact OG-SG 2.84Å; S450-C452 VanDerWaalsContact OG-SG 3.4Å
451	L	95.2	Very high	85.2	Confident	2 Å²	2	47.3 Å²	47.3	1%	0.01	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	110.1	-178.6	-75.4	67.9	0	0	0	107.4	F397 L399 W415 Y465 L474	F397-L451 HydrophobicContact CE2-CB 3.8Å; F397-L451 HydrophobicContact CZ-CB 4.03Å; F397-L451 HydrophobicContact CZ-CD2 4.45Å; L399-L451 HydrophobicContact CD1-CD1 3.92Å; L399-L451 HydrophobicContact CD1-CG 4.37Å; W415-L451 HydrophobicContact CH2-CG 4.29Å; W415-L451 HydrophobicContact CZ3-CD2 3.78Å; W415-L451 HydrophobicContact CZ3-CG 3.86Å; L451-Y465 HydrophobicContact CD2-CD1 4.05Å; L451-Y465 WeakPolarHBondContact O-CB 3.38Å; L451-Y465 PolarHBondContact O-N 2.67Å; L451-L474 HydrophobicContact CD2-CD2 3.87Å
452	C	95.4	Very high	86.1	Confident	0 Å²	0	43 Å²	43	0%	0	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	123.1	-171.5	-76.8	0	0	0	0	112.3	F397 V398 F400 M444 S450 F454 V462	F397-C452 WeakPolarHBondContact CD2-O 3.39Å; V398-C452 PolarHBondContact N-O 2.94Å; V398-C452 PolarHBondContact O-N 2.76Å; F400-C452 HydrophobicContact CD2-CB 4.15Å; F400-C452 HydrophobicContact CE2-CB 3.86Å; M444-C452 HydrophobicContact CE-CB 3.8Å; M444-C452 WeakPolarHBondContact CE-SG 3.12Å; S450-C452 PolarHBondContact OG-SG 2.84Å; S450-C452 VanDerWaalsContact OG-SG 3.4Å; C452-F454 HydrophobicContact CB-CE2 3.91Å; C452-F454 WeakPolarHBondContact O-CD2 3.03Å; C452-F454 WeakPolarHBondContact O-CE2 3.42Å; C452-V462 HydrophobicContact CB-CG1 4.05Å
453	L	96.8	Very high	87.1	Confident	0 Å²	0	43.3 Å²	43.3	0%	0	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.5	131.7	178.4	-175.3	148.9	0	0	0	110.8	T395 V396 F397 P455 V463 F477 M478 E481	T395-L453 HydrophobicContact CG2-CD1 3.95Å; T395-L453 HydrophobicContact CG2-CD2 3.92Å; T395-L453 HydrophobicContact CG2-CG 3.92Å; V396-L453 CarbonylContact O-C 3.56Å; V396-L453 WeakPolarHBondContact O-CA 3.18Å; F397-L453 HydrophobicContact CD2-CB 3.89Å; F397-L453 HydrophobicContact CE2-CB 4.15Å; F397-L453 HydrophobicContact CG-CB 4.42Å; L453-P455 HydrophobicContact CD2-CB 4.2Å; L453-V463 PolarHBondContact N-O 2.93Å; L453-V463 PolarHBondContact O-N 3.11Å; L453-F477 HydrophobicContact CB-CE1 3.72Å; L453-F477 HydrophobicContact CB-CZ 4.18Å; L453-F477 HydrophobicContact CD1-CD1 4.15Å; L453-F477 HydrophobicContact CD1-CE1 3.76Å; L453-F477 HydrophobicContact CG-CE1 4.34Å; L453-M478 HydrophobicContact CD1-CB 4.29Å; L453-M478 HydrophobicContact CD1-CG 3.83Å; L453-E481 HydrophobicContact CD1-CB 4.23Å; L453-E481 HydrophobicContact CD2-CB 3.72Å; L453-E481 HydrophobicContact CD2-CG 4.25Å
454	F	96.4	Very high	88.5	Confident	1 Å²	1	40.1 Å²	40.1	0%	0.004	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	104.1	178.5	-58.3	-112.8	0	0	0	106.8	A389 F390 T395 V396 V398 F400 M442 C452 V462	A389-F454 HydrophobicContact CB-CB 4.45Å; A389-F454 HydrophobicContact CB-CD1 3.42Å; A389-F454 VanDerWaalsContact CB-CD1 3.42Å; A389-F454 HydrophobicContact CB-CD2 4.01Å; A389-F454 HydrophobicContact CB-CE1 3.36Å; A389-F454 HydrophobicContact CB-CE2 4.06Å; A389-F454 HydrophobicContact CB-CG 3.74Å; A389-F454 HydrophobicContact CB-CZ 3.76Å; A389-F454 WeakPolarHBondContact O-CB 3.21Å; F390-F454 AromaticContact CD1-CD1 3.96Å; F390-F454 HydrophobicContact CD1-CD1 3.96Å; F390-F454 AromaticContact CE1-CD1 3.79Å; F390-F454 HydrophobicContact CE1-CD1 3.79Å; F390-F454 HydrophobicContact CE1-CE1 4.14Å; F390-F454 HydrophobicContact CE2-CE1 4.43Å; F390-F454 HydrophobicContact CZ-CD1 4.23Å; F390-F454 HydrophobicContact CZ-CE1 4.11Å; T395-F454 CarbonylContact C-O 3.55Å; T395-F454 WeakPolarHBondContact CA-O 3.31Å; V396-F454 HydrophobicContact CB-CB 4.28Å; V396-F454 PolarHBondContact N-O 2.86Å; V396-F454 PolarHBondContact O-N 2.84Å; V398-F454 HydrophobicContact CB-CE2 3.96Å; V398-F454 HydrophobicContact CG2-CD2 3.89Å; V398-F454 HydrophobicContact CG2-CE2 3.6Å; V398-F454 HydrophobicContact CG2-CZ 4.46Å; F400-F454 HydrophobicContact CE2-CE2 4.04Å; F400-F454 HydrophobicContact CE2-CZ 4.07Å; F400-F454 HydrophobicContact CZ-CE2 4.4Å; F400-F454 HydrophobicContact CZ-CZ 4.02Å; M442-F454 HydrophobicContact CE-CD1 4.48Å; M442-F454 HydrophobicContact CE-CE1 3.45Å; M442-F454 VanDerWaalsContact CE-CE1 3.45Å; M442-F454 HydrophobicContact CE-CZ 4Å; M442-F454 HydrophobicContact SD-CE1 3.91Å; M442-F454 HydrophobicContact SD-CZ 4.27Å; C452-F454 HydrophobicContact CB-CE2 3.91Å; C452-F454 WeakPolarHBondContact O-CD2 3.03Å; C452-F454 WeakPolarHBondContact O-CE2 3.42Å; F454-V462 HydrophobicContact CD1-CG2 3.52Å; F454-V462 HydrophobicContact CE1-CG2 3.32Å; F454-V462 HydrophobicContact CE2-CG2 4.42Å; F454-V462 HydrophobicContact CG-CG2 4.22Å; F454-V462 HydrophobicContact CZ-CG2 3.77Å
455	P	96.8	Very high	89.8	Confident	6 Å²	6	41.1 Å²	41.1	4%	0.039	22%	0.223	C	C	.	.			trans	-73.4	151	-176.9	25.1	-24.5	0	0	0	111.2	L453 L457 R461 A485	L453-P455 HydrophobicContact CD2-CB 4.2Å; P455-L457 VanDerWaalsContact C-N 3.29Å; P455-L457 HydrophobicContact CB-CD1 4.41Å; P455-L457 HydrophobicContact CB-CG 4.37Å; P455-L457 HydrophobicContact CG-CD1 4.1Å; P455-L457 HydrophobicContact CG-CG 4.44Å; P455-L457 PolarHBondContact O-N 2.87Å; P455-R461 VanDerWaalsContact CD-O 3.26Å; P455-R461 WeakPolarHBondContact CD-O 3.44Å; P455-R461 HydrophobicContact CG-CB 4.17Å; P455-R461 HydrophobicContact CG-CG 4.34Å; P455-A485 HydrophobicContact CB-CB 3.69Å
456	A	96	Very high	91.2	Very high	20 Å²	20	40 Å²	40	17%	0.165	23%	0.227	C	C	.	.	S	Bend	trans	-65.4	81.4	175.1	0	0	0	0	0	112.1	P392	P392-A456 CarbonylContact O-C 3.51Å
457	L	94.4	Very high	92.5	Very high	4 Å²	4	40.5 Å²	40.5	2%	0.021	23%	0.232	C	C	.	.	S	Bend	trans	-138.1	161.9	-177.9	-70.2	-178.3	0	0	0	110.9	P392 P455 R461 A485 D488 R489	P392-L457 VanDerWaalsContact CA-O 3.32Å; P392-L457 WeakPolarHBondContact CA-O 3.41Å; P455-L457 VanDerWaalsContact C-N 3.29Å; P455-L457 HydrophobicContact CB-CD1 4.41Å; P455-L457 HydrophobicContact CB-CG 4.37Å; P455-L457 HydrophobicContact CG-CD1 4.1Å; P455-L457 HydrophobicContact CG-CG 4.44Å; P455-L457 PolarHBondContact O-N 2.87Å; L457-R461 VanDerWaalsContact CD1-NH2 3.3Å; L457-A485 HydrophobicContact CD2-CB 4.32Å; L457-A485 WeakPolarHBondContact CD2-O 3.35Å; L457-A485 HydrophobicContact CG-CB 4.26Å; L457-D488 HydrophobicContact CD1-CB 4.23Å; L457-D488 HydrophobicContact CD2-CB 3.96Å; L457-R489 VanDerWaalsContact C-NH1 3.28Å; L457-R489 HydrophobicContact CD2-CB 3.9Å
458	Y	90.6	Very high	93.3	Very high	98 Å²	98	43.7 Å²	43.7	38%	0.384	24%	0.235	S	C	.	.	S	Bend	trans	-79	-29.5	169.6	-58.8	-69.5	0	0	0	111.1	P392 R489 E492 D493 R496	P392-Y458 HydrophobicContact CB-CD1 3.86Å; P392-Y458 HydrophobicContact CB-CE1 4.16Å; Y458-R489 VanDerWaalsContact CD2-NH1 3.26Å; Y458-R489 VanDerWaalsContact CG-NH1 3.32Å; Y458-R489 VanDerWaalsContact N-NH1 3.11Å; Y458-R489 PolarHBondContact OH-NH2 3.4Å; Y458-E492 HydrophobicContact CD2-CB 4.04Å; Y458-E492 WeakPolarHBondContact CD2-OE2 3.35Å; Y458-E492 PolarHBondContact N-OE2 2.92Å; Y458-D493 VanDerWaalsContact CE2-OD1 3.23Å; Y458-D493 WeakPolarHBondContact CE2-OD1 3.37Å; Y458-D493 PolarHBondContact OH-OD1 3.39Å; Y458-R496 PolarHBondContact OH-NH2 3.19Å; Y458-R496 VanDerWaalsContact OH-NH2 3.16Å
459	A	87.9	Confident	93.6	Very high	50 Å²	50	47.9 Å²	47.9	41%	0.413	25%	0.251	S	S	.	.	S	Bend	trans	-69.2	134.7	173.9	0	0	0	0	0	111.1	R461 E492	A459-R461 PolarHBondContact O-N 3.36Å; A459-E492 VanDerWaalsContact CB-OE1 3.27Å; A459-E492 WeakPolarHBondContact CB-OE1 3.31Å; A459-E492 PolarHBondContact N-OE1 3.28Å
460	E	88.6	Confident	93.8	Very high	161 Å²	161	50.3 Å²	50.3	75%	0.752	26%	0.263	S	S	*	.			trans	-71.8	74.5	175.4	-69	-179.3	-176.4	0	0	111.2	F390	F390-E460 HydrophobicContact CD1-CB 3.95Å; F390-E460 HydrophobicContact CD1-CG 3.98Å; F390-E460 HydrophobicContact CD2-CG 4.47Å; F390-E460 VanDerWaalsContact CE1-CA 3.47Å; F390-E460 HydrophobicContact CE1-CB 3.58Å; F390-E460 HydrophobicContact CE1-CG 4.05Å; F390-E460 HydrophobicContact CG-CG 4.17Å; F390-E460 HydrophobicContact CZ-CB 3.9Å; F390-E460 HydrophobicContact CZ-CG 4.26Å
461	R	91.1	Very high	94	Very high	60 Å²	60	51.9 Å²	51.9	23%	0.226	27%	0.271	C	S	.	.			trans	-101.4	137.1	-178.8	-171.7	168.1	74	-170.1	5	111.3	P455 L457 A459 V463 D488	P455-R461 VanDerWaalsContact CD-O 3.26Å; P455-R461 WeakPolarHBondContact CD-O 3.44Å; P455-R461 HydrophobicContact CG-CB 4.17Å; P455-R461 HydrophobicContact CG-CG 4.34Å; L457-R461 VanDerWaalsContact CD1-NH2 3.3Å; A459-R461 PolarHBondContact O-N 3.36Å; R461-V463 HydrophobicContact CG-CG2 4.46Å; R461-D488 IonicContact CZ-OD2 3.81Å; R461-D488 IonicContact NH1-OD2 3.05Å; R461-D488 PolarHBondContact NH1-OD2 2.85Å; R461-D488 IonicContact NH2-OD2 3.33Å; R461-D488 PolarHBondContact NH2-OD2 3.37Å; R461-D488 VanDerWaalsContact NH2-OD2 3.12Å
462	V	92.3	Very high	94.2	Very high	43 Å²	43	59.1 Å²	59.1	26%	0.261	30%	0.302	S	S	.	.			trans	-122.8	138.1	169.3	166.4	0	0	0	0	109.8	F390 M442 C452 F454 V464	F390-V462 HydrophobicContact CE1-CG2 4.27Å; F390-V462 HydrophobicContact CZ-CG2 4.4Å; M442-V462 HydrophobicContact CE-CG2 3.53Å; C452-V462 HydrophobicContact CB-CG1 4.05Å; F454-V462 HydrophobicContact CD1-CG2 3.52Å; F454-V462 HydrophobicContact CE1-CG2 3.32Å; F454-V462 HydrophobicContact CE2-CG2 4.42Å; F454-V462 HydrophobicContact CG-CG2 4.22Å; F454-V462 HydrophobicContact CZ-CG2 3.77Å; V462-V464 HydrophobicContact CG1-CG2 4.49Å
463	V	93.5	Very high	94.3	Very high	30 Å²	30	60.9 Å²	60.9	18%	0.182	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	114.4	174.3	-170.2	0	0	0	0	108.9	L453 R461 F477	L453-V463 PolarHBondContact N-O 2.93Å; L453-V463 PolarHBondContact O-N 3.11Å; R461-V463 HydrophobicContact CG-CG2 4.46Å; V463-F477 HydrophobicContact CB-CZ 4.27Å; V463-F477 HydrophobicContact CG1-CE2 4.01Å; V463-F477 HydrophobicContact CG1-CZ 3.77Å
464	V	93.1	Very high	94.4	Very high	43 Å²	43	60.9 Å²	60.9	26%	0.261	31%	0.311	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.5	129.5	178.1	-174.3	0	0	0	0	109.5	Q445 V462 T466	Q445-V464 WeakPolarHBondContact O-CG2 3.18Å; V462-V464 HydrophobicContact CG1-CG2 4.49Å; V464-T466 HydrophobicContact CG1-CG2 4.43Å
465	Y	94.6	Very high	94.4	Very high	26 Å²	26	62.5 Å²	62.5	10%	0.102	32%	0.322	C	S	.	.			trans	-87.1	117.3	176.4	-178.5	-101.1	0	0	0	111.4	F397 L451 G467 K468 D473 L474 F477	F397-Y465 HydrophobicContact CZ-CG 4.25Å; L451-Y465 HydrophobicContact CD2-CD1 4.05Å; L451-Y465 WeakPolarHBondContact O-CB 3.38Å; L451-Y465 PolarHBondContact O-N 2.67Å; Y465-G467 VanDerWaalsContact CE1-C 3.41Å; Y465-G467 WeakPolarHBondContact CE1-O 3.49Å; Y465-G467 VanDerWaalsContact CZ-CA 3.4Å; Y465-G467 WeakPolarHBondContact OH-CA 3.48Å; Y465-K468 PolarHBondContact OH-N 3.38Å; Y465-K468 PolarHBondContact OH-O 3.25Å; Y465-D473 WeakPolarHBondContact OH-CB 3.36Å; Y465-L474 HydrophobicContact CD1-CD2 3.73Å; Y465-L474 HydrophobicContact CE1-CD2 3.49Å; Y465-L474 VanDerWaalsContact CE1-CD2 3.49Å; Y465-L474 HydrophobicContact CE1-CG 4.43Å; Y465-L474 HydrophobicContact CE2-CD2 4.43Å; Y465-L474 HydrophobicContact CG-CD2 4.28Å; Y465-F477 HydrophobicContact CD2-CB 3.88Å; Y465-F477 AromaticContact CD2-CD1 3.48Å; Y465-F477 HydrophobicContact CD2-CD1 3.48Å; Y465-F477 VanDerWaalsContact CD2-CD1 3.48Å; Y465-F477 AromaticContact CD2-CD2 3.74Å; Y465-F477 HydrophobicContact CD2-CD2 3.74Å; Y465-F477 AromaticContact CD2-CE1 3.84Å; Y465-F477 HydrophobicContact CD2-CE1 3.84Å; Y465-F477 HydrophobicContact CD2-CE2 4.09Å; Y465-F477 AromaticContact CD2-CG 3.4Å; Y465-F477 HydrophobicContact CD2-CG 3.4Å; Y465-F477 VanDerWaalsContact CD2-CG 3.4Å; Y465-F477 HydrophobicContact CD2-CZ 4.13Å; Y465-F477 HydrophobicContact CE2-CB 3.64Å; Y465-F477 HydrophobicContact CE2-CD1 4.12Å; Y465-F477 HydrophobicContact CE2-CD2 4.16Å; Y465-F477 AromaticContact CE2-CG 3.71Å; Y465-F477 HydrophobicContact CE2-CG 3.71Å; Y465-F477 HydrophobicContact CG-CD1 4.24Å; Y465-F477 HydrophobicContact CG-CE1 4.32Å
466	T	92.8	Very high	94.5	Very high	133 Å²	133	68.6 Å²	68.6	82%	0.816	34%	0.344	S	S	*	.			trans	-113.3	9.5	179.5	56.8	0	0	0	0	113.2	V464	V464-T466 HydrophobicContact CG1-CG2 4.43Å
467	G	93.9	Very high	94.6	Very high	40 Å²	40	69 Å²	69	41%	0.412	34%	0.342	S	S	.	.	S	Bend	trans	-82.9	-170.4	-178.2	0	0	0	0	0	114.3	Y465	Y465-G467 VanDerWaalsContact CE1-C 3.41Å; Y465-G467 WeakPolarHBondContact CE1-O 3.49Å; Y465-G467 VanDerWaalsContact CZ-CA 3.4Å; Y465-G467 WeakPolarHBondContact OH-CA 3.48Å
468	K	95.9	Very high	94.7	Very high	154 Å²	154	68.9 Å²	68.9	67%	0.67	34%	0.341	S	S	*	.			trans	-69.6	129.6	179.3	-65	-177.2	178.6	-176.6	0	111.4	Y465 N470 D473	Y465-K468 PolarHBondContact OH-N 3.38Å; Y465-K468 PolarHBondContact OH-O 3.25Å; K468-N470 VanDerWaalsContact C-N 3.28Å; K468-N470 WeakPolarHBondContact CB-ND2 3.3Å; K468-N470 PolarHBondContact O-N 3.13Å; K468-D473 WeakPolarHBondContact CB-OD2 3.48Å
469	R	94.9	Very high	95	Very high	122 Å²	122	66.7 Å²	66.7	46%	0.46	34%	0.336	S	S	.	.	S	Bend	trans	-78.5	71.9	179.9	-62.2	-179.3	-178.7	-177	-3.8	111.8	L414 P449	L414-R469 HydrophobicContact CD2-CB 3.77Å; L414-R469 WeakPolarHBondContact CD2-O 3.39Å; P449-R469 PolarHBondContact O-NH2 2.8Å; P449-R469 VanDerWaalsContact O-NH2 3.16Å
470	N	96.9	Very high	95.5	Very high	55 Å²	55	71 Å²	71	29%	0.294	35%	0.345	S	S	.	.	S	Bend	trans	-140.9	155.5	170.5	68	74.3	0	0	0	110.2	K468 K472 D473 L474	K468-N470 VanDerWaalsContact C-N 3.28Å; K468-N470 WeakPolarHBondContact CB-ND2 3.3Å; K468-N470 PolarHBondContact O-N 3.13Å; N470-K472 VanDerWaalsContact C-N 3.32Å; N470-K472 PolarHBondContact O-N 2.94Å; N470-K472 PolarHBondContact OD1-N 3.44Å; N470-D473 PolarHBondContact ND2-OD2 3.48Å; N470-D473 PolarHBondContact O-N 3.45Å; N470-D473 PolarHBondContact OD1-N 3.01Å; N470-D473 PolarHBondContact OD1-OD2 3.18Å; N470-L474 WeakPolarHBondContact O-CG 3.43Å; N470-L474 PolarHBondContact O-N 3.21Å
471	I	97.8	Very high	95.9	Very high	41 Å²	41	63.8 Å²	63.8	21%	0.21	31%	0.312	C	S	.	.	H	α-helix	trans	-54.3	-45.5	-174	-62.1	-59.8	0	0	0	112.7	L414 E417 L418 A421 D473 L474 V475	L414-I471 HydrophobicContact CD1-CD1 3.55Å; L414-I471 HydrophobicContact CD1-CG1 3.85Å; L414-I471 HydrophobicContact CG-CD1 4.43Å; E417-I471 HydrophobicContact CB-CD1 3.61Å; E417-I471 HydrophobicContact CB-CG1 4.14Å; L418-I471 HydrophobicContact CB-CD1 3.94Å; A421-I471 HydrophobicContact CB-CG2 4.11Å; I471-D473 VanDerWaalsContact C-N 3.31Å; I471-D473 PolarHBondContact O-N 3.04Å; I471-L474 PolarHBondContact O-N 3.2Å; I471-V475 HydrophobicContact CG2-CG2 4.08Å; I471-V475 WeakPolarHBondContact O-CB 3.24Å; I471-V475 VanDerWaalsContact O-CG2 3.31Å; I471-V475 WeakPolarHBondContact O-CG2 3.44Å; I471-V475 PolarHBondContact O-N 2.65Å
472	K	97.6	Very high	96.2	Very high	155 Å²	155	62.1 Å²	62.1	67%	0.674	31%	0.307	S	S	*	.	H	α-helix	trans	-60.1	-40.5	-176.8	-176.3	-175.1	176.9	177.7	0	112.5	N470 R476	N470-K472 VanDerWaalsContact C-N 3.32Å; N470-K472 PolarHBondContact O-N 2.94Å; N470-K472 PolarHBondContact OD1-N 3.44Å; K472-R476 WeakPolarHBondContact O-CB 3.44Å; K472-R476 PolarHBondContact O-N 2.97Å
473	D	98.3	Very high	96.4	Very high	36 Å²	36	67 Å²	67	19%	0.193	32%	0.321	C	S	.	.	H	α-helix	trans	-81.5	-32.5	-178.5	-68.5	-39.8	0	0	0	112.1	Y465 K468 N470 I471 R476 F477	Y465-D473 WeakPolarHBondContact OH-CB 3.36Å; K468-D473 WeakPolarHBondContact CB-OD2 3.48Å; N470-D473 PolarHBondContact ND2-OD2 3.48Å; N470-D473 PolarHBondContact O-N 3.45Å; N470-D473 PolarHBondContact OD1-N 3.01Å; N470-D473 PolarHBondContact OD1-OD2 3.18Å; I471-D473 VanDerWaalsContact C-N 3.31Å; I471-D473 PolarHBondContact O-N 3.04Å; D473-R476 IonicContact OD1-CZ 3.67Å; D473-R476 IonicContact OD1-NH1 2.74Å; D473-R476 IonicContact OD1-NH2 2.95Å; D473-R476 PolarHBondContact OD1-NH2 3.23Å; D473-F477 WeakPolarHBondContact O-CB 3.49Å; D473-F477 PolarHBondContact O-N 3.46Å
474	L	98.3	Very high	96.5	Very high	0 Å²	0	69.4 Å²	69.4	0%	0	33%	0.329	C	S	.	.	H	α-helix	trans	-65.4	-49.6	173.9	-69.4	168.9	0	0	0	111.7	F397 L414 L418 L451 Y465 N470 I471 R476 F477 M478	F397-L474 HydrophobicContact CE1-CD2 3.83Å; F397-L474 HydrophobicContact CZ-CD2 3.97Å; L414-L474 HydrophobicContact CD1-CD1 4.18Å; L414-L474 HydrophobicContact CD2-CD1 3.84Å; L414-L474 HydrophobicContact CG-CD1 3.96Å; L418-L474 HydrophobicContact CD1-CB 3.93Å; L418-L474 HydrophobicContact CD2-CB 4.37Å; L418-L474 HydrophobicContact CD2-CD1 4.28Å; L451-L474 HydrophobicContact CD2-CD2 3.87Å; Y465-L474 HydrophobicContact CD1-CD2 3.73Å; Y465-L474 HydrophobicContact CE1-CD2 3.49Å; Y465-L474 VanDerWaalsContact CE1-CD2 3.49Å; Y465-L474 HydrophobicContact CE1-CG 4.43Å; Y465-L474 HydrophobicContact CE2-CD2 4.43Å; Y465-L474 HydrophobicContact CG-CD2 4.28Å; N470-L474 WeakPolarHBondContact O-CG 3.43Å; N470-L474 PolarHBondContact O-N 3.21Å; I471-L474 PolarHBondContact O-N 3.2Å; L474-R476 VanDerWaalsContact C-N 3.32Å; L474-R476 PolarHBondContact O-N 3.5Å; L474-F477 WeakPolarHBondContact O-CB 3.33Å; L474-F477 PolarHBondContact O-N 3.37Å; L474-M478 WeakPolarHBondContact O-CG 3.47Å; L474-M478 PolarHBondContact O-N 3.37Å
475	V	97.8	Very high	96.6	Very high	36 Å²	36	67.5 Å²	67.5	22%	0.218	32%	0.317	C	S	.	.	H	α-helix	trans	-61	-41.6	177.5	172.2	0	0	0	0	111.1	L418 A421 V422 W425 I471 F477 M478 D479	L418-V475 HydrophobicContact CD1-CG2 3.85Å; A421-V475 HydrophobicContact CB-CG2 4.5Å; V422-V475 HydrophobicContact CG1-CG2 4.19Å; W425-V475 HydrophobicContact CH2-CG1 3.78Å; W425-V475 HydrophobicContact CZ2-CG1 3.85Å; I471-V475 HydrophobicContact CG2-CG2 4.08Å; I471-V475 WeakPolarHBondContact O-CB 3.24Å; I471-V475 VanDerWaalsContact O-CG2 3.31Å; I471-V475 WeakPolarHBondContact O-CG2 3.44Å; I471-V475 PolarHBondContact O-N 2.65Å; V475-F477 VanDerWaalsContact C-N 3.34Å; V475-F477 PolarHBondContact O-N 2.86Å; V475-M478 PolarHBondContact O-N 3.06Å; V475-D479 PolarHBondContact O-N 2.93Å
476	R	97.9	Very high	96.6	Very high	133 Å²	133	73 Å²	73	50%	0.502	34%	0.342	S	S	.	.	H	α-helix	trans	-63.7	-40.5	176.8	-169.6	-173	-46.4	151.9	29.3	112.1	K472 D473 L474 K480	K472-R476 WeakPolarHBondContact O-CB 3.44Å; K472-R476 PolarHBondContact O-N 2.97Å; D473-R476 IonicContact OD1-CZ 3.67Å; D473-R476 IonicContact OD1-NH1 2.74Å; D473-R476 IonicContact OD1-NH2 2.95Å; D473-R476 PolarHBondContact OD1-NH2 3.23Å; L474-R476 VanDerWaalsContact C-N 3.32Å; L474-R476 PolarHBondContact O-N 3.5Å; R476-K480 WeakPolarHBondContact O-CB 3.25Å; R476-K480 PolarHBondContact O-N 2.98Å
477	F	98.2	Very high	96.7	Very high	30 Å²	30	74.2 Å²	74.2	13%	0.132	33%	0.332	C	S	.	.	H	α-helix	trans	-62.7	-46.3	176.5	168.7	-106	0	0	0	111.3	F397 L453 V463 Y465 D473 L474 V475 K480 E481	F397-F477 HydrophobicContact CE1-CD1 4.29Å; F397-F477 HydrophobicContact CE2-CE1 4.27Å; F397-F477 HydrophobicContact CZ-CD1 4.06Å; F397-F477 HydrophobicContact CZ-CE1 4.01Å; L453-F477 HydrophobicContact CB-CE1 3.72Å; L453-F477 HydrophobicContact CB-CZ 4.18Å; L453-F477 HydrophobicContact CD1-CD1 4.15Å; L453-F477 HydrophobicContact CD1-CE1 3.76Å; L453-F477 HydrophobicContact CG-CE1 4.34Å; V463-F477 HydrophobicContact CB-CZ 4.27Å; V463-F477 HydrophobicContact CG1-CE2 4.01Å; V463-F477 HydrophobicContact CG1-CZ 3.77Å; Y465-F477 HydrophobicContact CD2-CB 3.88Å; Y465-F477 AromaticContact CD2-CD1 3.48Å; Y465-F477 HydrophobicContact CD2-CD1 3.48Å; Y465-F477 VanDerWaalsContact CD2-CD1 3.48Å; Y465-F477 AromaticContact CD2-CD2 3.74Å; Y465-F477 HydrophobicContact CD2-CD2 3.74Å; Y465-F477 AromaticContact CD2-CE1 3.84Å; Y465-F477 HydrophobicContact CD2-CE1 3.84Å; Y465-F477 HydrophobicContact CD2-CE2 4.09Å; Y465-F477 AromaticContact CD2-CG 3.4Å; Y465-F477 HydrophobicContact CD2-CG 3.4Å; Y465-F477 VanDerWaalsContact CD2-CG 3.4Å; Y465-F477 HydrophobicContact CD2-CZ 4.13Å; Y465-F477 HydrophobicContact CE2-CB 3.64Å; Y465-F477 HydrophobicContact CE2-CD1 4.12Å; Y465-F477 HydrophobicContact CE2-CD2 4.16Å; Y465-F477 AromaticContact CE2-CG 3.71Å; Y465-F477 HydrophobicContact CE2-CG 3.71Å; Y465-F477 HydrophobicContact CG-CD1 4.24Å; Y465-F477 HydrophobicContact CG-CE1 4.32Å; D473-F477 WeakPolarHBondContact O-CB 3.49Å; D473-F477 PolarHBondContact O-N 3.46Å; L474-F477 WeakPolarHBondContact O-CB 3.33Å; L474-F477 PolarHBondContact O-N 3.37Å; V475-F477 VanDerWaalsContact C-N 3.34Å; V475-F477 PolarHBondContact O-N 2.86Å; F477-K480 PolarHBondContact O-N 3.18Å; F477-E481 HydrophobicContact CD2-CG 4.16Å; F477-E481 HydrophobicContact CE2-CG 3.7Å; F477-E481 HydrophobicContact CZ-CG 3.9Å; F477-E481 PolarHBondContact O-N 3.13Å
478	M	97.8	Very high	96.7	Very high	0 Å²	0	74.7 Å²	74.7	0%	0	32%	0.324	C	S	.	.	H	α-helix	trans	-59.5	-50.8	176.5	-68.6	170.8	62.2	0	0	112.1	F397 L418 V422 W425 V428 I430 L453 L474 V475 K480 E481 M482	F397-M478 HydrophobicContact CD1-CG 3.76Å; F397-M478 HydrophobicContact CD1-SD 3.63Å; F397-M478 HydrophobicContact CE1-CG 4.09Å; F397-M478 HydrophobicContact CE1-SD 4.23Å; L418-M478 HydrophobicContact CD1-SD 4.03Å; L418-M478 HydrophobicContact CD2-SD 4.28Å; L418-M478 HydrophobicContact CG-SD 4.48Å; V422-M478 HydrophobicContact CG1-CE 4.11Å; V422-M478 HydrophobicContact CG1-SD 4.44Å; V422-M478 HydrophobicContact CG2-CE 4.36Å; W425-M478 HydrophobicContact CZ3-CB 4.23Å; W425-M478 HydrophobicContact CZ3-CE 4.4Å; V428-M478 HydrophobicContact CB-CE 4.36Å; V428-M478 HydrophobicContact CG1-CE 3.38Å; V428-M478 HydrophobicContact CG2-CE 3.99Å; I430-M478 HydrophobicContact CD1-CE 3.88Å; I430-M478 HydrophobicContact CD1-SD 4.25Å; L453-M478 HydrophobicContact CD1-CB 4.29Å; L453-M478 HydrophobicContact CD1-CG 3.83Å; L474-M478 WeakPolarHBondContact O-CG 3.47Å; L474-M478 PolarHBondContact O-N 3.37Å; V475-M478 PolarHBondContact O-N 3.06Å; M478-K480 VanDerWaalsContact C-N 3.28Å; M478-K480 PolarHBondContact O-N 3.16Å; M478-E481 PolarHBondContact O-N 3.41Å; M478-M482 WeakPolarHBondContact O-CB 3.4Å; M478-M482 VanDerWaalsContact O-CG 3.24Å; M478-M482 WeakPolarHBondContact O-CG 3.27Å; M478-M482 PolarHBondContact O-N 2.76Å
479	D	96.8	Very high	96.6	Very high	53 Å²	53	69 Å²	69	28%	0.283	30%	0.299	S	S	.	.	H	α-helix	trans	-57.2	-42.5	177.9	171.8	61.7	0	0	0	111.6	W425 V475 M482 R483	W425-D479 HydrophobicContact CH2-CB 4.22Å; V475-D479 PolarHBondContact O-N 2.93Å; D479-M482 PolarHBondContact O-N 3.2Å; D479-R483 VanDerWaalsContact CG-NE 3.33Å; D479-R483 WeakPolarHBondContact O-CB 3.34Å; D479-R483 VanDerWaalsContact O-CG 3.27Å; D479-R483 WeakPolarHBondContact O-CG 3.24Å; D479-R483 PolarHBondContact O-N 3.47Å; D479-R483 IonicContact OD1-CZ 3.42Å; D479-R483 IonicContact OD1-NE 3.7Å; D479-R483 PolarHBondContact OD1-NE 2.95Å; D479-R483 IonicContact OD1-NH2 2.78Å; D479-R483 PolarHBondContact OD1-NH2 3.34Å; D479-R483 IonicContact OD2-CZ 3.52Å; D479-R483 IonicContact OD2-NE 3.69Å; D479-R483 PolarHBondContact OD2-NE 3.31Å; D479-R483 IonicContact OD2-NH2 2.73Å; D479-R483 PolarHBondContact OD2-NH2 3.13Å
480	K	97.6	Very high	96.5	Very high	139 Å²	139	67.3 Å²	67.3	60%	0.604	30%	0.302	S	S	*	.	H	α-helix	trans	-60.6	-49.3	176.4	-178.9	-174.7	172.8	-171.6	0	112	R476 F477 M478 R483 K484	R476-K480 WeakPolarHBondContact O-CB 3.25Å; R476-K480 PolarHBondContact O-N 2.98Å; F477-K480 PolarHBondContact O-N 3.18Å; M478-K480 VanDerWaalsContact C-N 3.28Å; M478-K480 PolarHBondContact O-N 3.16Å; K480-R483 PolarHBondContact O-N 3.18Å; K480-K484 PolarHBondContact O-N 3.19Å
481	E	97.3	Very high	96.2	Very high	11 Å²	11	71 Å²	71	5%	0.051	32%	0.315	C	S	.	.	H	α-helix	trans	-70.3	-34.4	-178.9	-69	-52.8	125	0	0	112.1	L453 F477 M478 K484 A485	L453-E481 HydrophobicContact CD1-CB 4.23Å; L453-E481 HydrophobicContact CD2-CB 3.72Å; L453-E481 HydrophobicContact CD2-CG 4.25Å; F477-E481 HydrophobicContact CD2-CG 4.16Å; F477-E481 HydrophobicContact CE2-CG 3.7Å; F477-E481 HydrophobicContact CZ-CG 3.9Å; F477-E481 PolarHBondContact O-N 3.13Å; M478-E481 PolarHBondContact O-N 3.41Å; E481-K484 WeakPolarHBondContact O-CB 3.39Å; E481-K484 PolarHBondContact O-N 2.76Å; E481-A485 WeakPolarHBondContact O-CB 3.41Å; E481-A485 PolarHBondContact O-N 2.99Å
482	M	96.4	Very high	95.9	Very high	25 Å²	25	70.9 Å²	70.9	12%	0.123	31%	0.314	C	S	.	.	H	α-helix	trans	-62.5	-45	172	-72.7	177	76.7	0	0	111.8	T395 W425 V428 M478 D479 K484 A485 K486	T395-M482 HydrophobicContact CG2-CG 3.89Å; W425-M482 HydrophobicContact CE3-CE 4.32Å; W425-M482 HydrophobicContact CE3-SD 3.7Å; W425-M482 HydrophobicContact CZ3-SD 3.65Å; V428-M482 HydrophobicContact CG2-CE 3.85Å; V428-M482 HydrophobicContact CG2-SD 3.68Å; M478-M482 WeakPolarHBondContact O-CB 3.4Å; M478-M482 VanDerWaalsContact O-CG 3.24Å; M478-M482 WeakPolarHBondContact O-CG 3.27Å; M478-M482 PolarHBondContact O-N 2.76Å; D479-M482 PolarHBondContact O-N 3.2Å; M482-K484 VanDerWaalsContact C-N 3.28Å; M482-K484 PolarHBondContact O-N 2.9Å; M482-A485 PolarHBondContact O-N 3.35Å; M482-K486 WeakPolarHBondContact O-CG 3.5Å; M482-K486 PolarHBondContact O-N 3.36Å
483	R	96.1	Very high	95.6	Very high	146 Å²	146	65.8 Å²	65.8	55%	0.551	29%	0.294	S	S	*	.	H	α-helix	trans	-62.6	-37.1	175.4	-71.5	175.6	-166.4	-161.6	5.9	112	D479 K480 R487	D479-R483 VanDerWaalsContact CG-NE 3.33Å; D479-R483 WeakPolarHBondContact O-CB 3.34Å; D479-R483 VanDerWaalsContact O-CG 3.27Å; D479-R483 WeakPolarHBondContact O-CG 3.24Å; D479-R483 PolarHBondContact O-N 3.47Å; D479-R483 IonicContact OD1-CZ 3.42Å; D479-R483 IonicContact OD1-NE 3.7Å; D479-R483 PolarHBondContact OD1-NE 2.95Å; D479-R483 IonicContact OD1-NH2 2.78Å; D479-R483 PolarHBondContact OD1-NH2 3.34Å; D479-R483 IonicContact OD2-CZ 3.52Å; D479-R483 IonicContact OD2-NE 3.69Å; D479-R483 PolarHBondContact OD2-NE 3.31Å; D479-R483 IonicContact OD2-NH2 2.73Å; D479-R483 PolarHBondContact OD2-NH2 3.13Å; K480-R483 PolarHBondContact O-N 3.18Å; R483-R487 PolarHBondContact O-N 2.91Å; R483-R487 PolarHBondContact O-NH1 3.22Å
484	K	96.3	Very high	95.3	Very high	79 Å²	79	68.7 Å²	68.7	34%	0.343	31%	0.307	S	S	.	.	H	α-helix	trans	-67	-47.7	175.3	-174.6	-178	173.4	-168.7	0	111	K480 E481 M482 K486 R487 D488	K480-K484 PolarHBondContact O-N 3.19Å; E481-K484 WeakPolarHBondContact O-CB 3.39Å; E481-K484 PolarHBondContact O-N 2.76Å; M482-K484 VanDerWaalsContact C-N 3.28Å; M482-K484 PolarHBondContact O-N 2.9Å; K484-K486 VanDerWaalsContact C-N 3.32Å; K484-K486 PolarHBondContact O-N 3.39Å; K484-R487 PolarHBondContact O-N 3.24Å; K484-R487 VanDerWaalsContact O-N 3.08Å; K484-D488 VanDerWaalsContact O-CG 3.29Å; K484-D488 PolarHBondContact O-N 3.47Å
485	A	95.5	Very high	94.9	Very high	3 Å²	3	72.3 Å²	72.3	3%	0.025	33%	0.326	C	S	.	.	H	α-helix	trans	-56.2	-44.2	175.8	0	0	0	0	0	111.9	P455 L457 E481 M482 R487 D488 R489	P455-A485 HydrophobicContact CB-CB 3.69Å; L457-A485 HydrophobicContact CD2-CB 4.32Å; L457-A485 WeakPolarHBondContact CD2-O 3.35Å; L457-A485 HydrophobicContact CG-CB 4.26Å; E481-A485 WeakPolarHBondContact O-CB 3.41Å; E481-A485 PolarHBondContact O-N 2.99Å; M482-A485 PolarHBondContact O-N 3.35Å; A485-R487 VanDerWaalsContact C-N 3.3Å; A485-R487 PolarHBondContact O-N 2.96Å; A485-D488 PolarHBondContact O-N 3.5Å; A485-R489 VanDerWaalsContact O-CB 3.25Å; A485-R489 WeakPolarHBondContact O-CB 3.41Å; A485-R489 PolarHBondContact O-N 2.9Å
486	K	94.4	Very high	94.5	Very high	143 Å²	143	76.4 Å²	76.4	62%	0.622	34%	0.337	S	S	*	.	H	α-helix	trans	-56.9	-40.6	175.5	-74.6	179.5	-179.8	-175.6	0	112.9	M482 K484	M482-K486 WeakPolarHBondContact O-CG 3.5Å; M482-K486 PolarHBondContact O-N 3.36Å; K484-K486 VanDerWaalsContact C-N 3.32Å; K484-K486 PolarHBondContact O-N 3.39Å
487	R	94.5	Very high	94.2	Very high	158 Å²	158	77.6 Å²	77.6	60%	0.596	34%	0.342	S	S	*	.	H	α-helix	trans	-69.5	-44.8	176.1	-68.3	-171	-60	-86.2	1.6	111.9	R483 K484 A485 R489 V490	R483-R487 PolarHBondContact O-N 2.91Å; R483-R487 PolarHBondContact O-NH1 3.22Å; K484-R487 PolarHBondContact O-N 3.24Å; K484-R487 VanDerWaalsContact O-N 3.08Å; A485-R487 VanDerWaalsContact C-N 3.3Å; A485-R487 PolarHBondContact O-N 2.96Å; R487-R489 VanDerWaalsContact C-N 3.3Å; R487-R489 PolarHBondContact O-N 3.46Å; R487-V490 PolarHBondContact O-N 2.88Å
488	D	94.4	Very high	93.9	Very high	49 Å²	49	81.6 Å²	81.6	26%	0.262	36%	0.359	S	S	.	.	H	α-helix	trans	-65.4	-36.5	-179.4	-61.9	-19.7	0	0	0	111.2	L457 R461 K484 A485 V490 K491 E492	L457-D488 HydrophobicContact CD1-CB 4.23Å; L457-D488 HydrophobicContact CD2-CB 3.96Å; R461-D488 IonicContact CZ-OD2 3.81Å; R461-D488 IonicContact NH1-OD2 3.05Å; R461-D488 PolarHBondContact NH1-OD2 2.85Å; R461-D488 IonicContact NH2-OD2 3.33Å; R461-D488 PolarHBondContact NH2-OD2 3.37Å; R461-D488 VanDerWaalsContact NH2-OD2 3.12Å; K484-D488 VanDerWaalsContact O-CG 3.29Å; K484-D488 PolarHBondContact O-N 3.47Å; A485-D488 PolarHBondContact O-N 3.5Å; D488-V490 PolarHBondContact O-N 3.42Å; D488-K491 WeakPolarHBondContact O-CB 3.35Å; D488-K491 PolarHBondContact O-N 3.47Å; D488-K491 VanDerWaalsContact O-N 3.11Å; D488-E492 PolarHBondContact O-N 3.25Å
489	R	92.7	Very high	93.5	Very high	35 Å²	35	88.4 Å²	88.4	13%	0.132	39%	0.386	C	S	.	.	H	α-helix	trans	-61.8	-39	178.4	-175	55.3	166.2	-127.6	-19.1	113.1	P392 N393 L457 Y458 A485 R487 K491 E492 D493	P392-R489 PolarHBondContact O-NH1 3.22Å; P392-R489 PolarHBondContact O-NH2 3.04Å; N393-R489 PolarHBondContact OD1-NH2 3.42Å; L457-R489 VanDerWaalsContact C-NH1 3.28Å; L457-R489 HydrophobicContact CD2-CB 3.9Å; Y458-R489 VanDerWaalsContact CD2-NH1 3.26Å; Y458-R489 VanDerWaalsContact CG-NH1 3.32Å; Y458-R489 VanDerWaalsContact N-NH1 3.11Å; Y458-R489 PolarHBondContact OH-NH2 3.4Å; A485-R489 VanDerWaalsContact O-CB 3.25Å; A485-R489 WeakPolarHBondContact O-CB 3.41Å; A485-R489 PolarHBondContact O-N 2.9Å; R487-R489 VanDerWaalsContact C-N 3.3Å; R487-R489 PolarHBondContact O-N 3.46Å; R489-K491 VanDerWaalsContact C-N 3.25Å; R489-K491 PolarHBondContact O-N 3.26Å; R489-E492 PolarHBondContact O-N 2.94Å; R489-D493 IonicContact NE-OD2 2.88Å; R489-D493 PolarHBondContact NE-OD2 3.42Å; R489-D493 PolarHBondContact O-N 3.39Å
490	V	92.9	Very high	93.2	Very high	86 Å²	86	90.2 Å²	90.2	52%	0.521	39%	0.394	S	S	.	.	H	α-helix	trans	-57.4	-44.6	174.6	173.3	0	0	0	0	110.1	R487 D488 D493 E494	R487-V490 PolarHBondContact O-N 2.88Å; D488-V490 PolarHBondContact O-N 3.42Å; V490-D493 PolarHBondContact O-N 3.12Å; V490-E494 WeakPolarHBondContact O-CG 3.35Å; V490-E494 PolarHBondContact O-N 3.41Å
491	K	91.8	Very high	92.8	Very high	133 Å²	133	88.9 Å²	88.9	58%	0.578	39%	0.389	S	S	*	.	H	α-helix	trans	-66	-45	177.2	-172.3	-177.7	176.3	-174.1	0	112	D488 R489 D493 E494 D495	D488-K491 WeakPolarHBondContact O-CB 3.35Å; D488-K491 PolarHBondContact O-N 3.47Å; D488-K491 VanDerWaalsContact O-N 3.11Å; R489-K491 VanDerWaalsContact C-N 3.25Å; R489-K491 PolarHBondContact O-N 3.26Å; K491-D493 VanDerWaalsContact C-N 3.33Å; K491-D493 PolarHBondContact O-N 2.83Å; K491-E494 PolarHBondContact O-N 3.11Å; K491-D495 WeakPolarHBondContact O-CB 3.41Å; K491-D495 PolarHBondContact O-N 3.39Å
492	E	90.9	Very high	92.5	Very high	39 Å²	39	91.9 Å²	91.9	18%	0.182	41%	0.409	C	S	.	.	H	α-helix	trans	-60.6	-40.6	177.1	-69.8	-177.8	175.1	0	0	112.4	Y458 A459 D488 R489 D495 R496	Y458-E492 HydrophobicContact CD2-CB 4.04Å; Y458-E492 WeakPolarHBondContact CD2-OE2 3.35Å; Y458-E492 PolarHBondContact N-OE2 2.92Å; A459-E492 VanDerWaalsContact CB-OE1 3.27Å; A459-E492 WeakPolarHBondContact CB-OE1 3.31Å; A459-E492 PolarHBondContact N-OE1 3.28Å; D488-E492 PolarHBondContact O-N 3.25Å; R489-E492 PolarHBondContact O-N 2.94Å; E492-D495 PolarHBondContact O-N 3.08Å; E492-R496 WeakPolarHBondContact O-CB 3.42Å; E492-R496 PolarHBondContact O-N 3.3Å
493	D	91.6	Very high	92.1	Very high	48 Å²	48	93.3 Å²	93.3	26%	0.257	42%	0.416	S	S	.	.	H	α-helix	trans	-69.5	-35.3	177.3	-83.1	-45.4	0	0	0	112.3	Y458 R489 V490 K491 R496 R497	Y458-D493 VanDerWaalsContact CE2-OD1 3.23Å; Y458-D493 WeakPolarHBondContact CE2-OD1 3.37Å; Y458-D493 PolarHBondContact OH-OD1 3.39Å; R489-D493 IonicContact NE-OD2 2.88Å; R489-D493 PolarHBondContact NE-OD2 3.42Å; R489-D493 PolarHBondContact O-N 3.39Å; V490-D493 PolarHBondContact O-N 3.12Å; K491-D493 VanDerWaalsContact C-N 3.33Å; K491-D493 PolarHBondContact O-N 2.83Å; D493-R496 IonicContact OD1-CZ 2.78Å; D493-R496 IonicContact OD1-NE 3.46Å; D493-R496 IonicContact OD1-NH2 3.32Å; D493-R496 PolarHBondContact OD1-NH2 2.97Å; D493-R497 WeakPolarHBondContact O-CB 3.41Å; D493-R497 PolarHBondContact O-N 2.93Å
494	E	91.9	Very high	91.7	Very high	97 Å²	97	92.9 Å²	92.9	45%	0.453	42%	0.419	S	S	.	.	H	α-helix	trans	-63.5	-48.2	170.8	-76.9	179.1	-172.8	0	0	111.8	V490 K491 R496 R497 K498	V490-E494 WeakPolarHBondContact O-CG 3.35Å; V490-E494 PolarHBondContact O-N 3.41Å; K491-E494 PolarHBondContact O-N 3.11Å; E494-R496 VanDerWaalsContact C-N 3.35Å; E494-R496 PolarHBondContact O-N 3.46Å; E494-R497 WeakPolarHBondContact O-CB 3.38Å; E494-R497 PolarHBondContact O-N 3.37Å; E494-K498 WeakPolarHBondContact O-CG 3.41Å; E494-K498 PolarHBondContact O-N 3.42Å
495	D	90.9	Very high	91.2	Very high	75 Å²	75	92.8 Å²	92.8	40%	0.401	43%	0.425	S	S	.	.	H	α-helix	trans	-64.3	-41.4	179.9	-71.3	-19.8	0	0	0	110.9	K491 E492 R497 K498 Y499	K491-D495 WeakPolarHBondContact O-CB 3.41Å; K491-D495 PolarHBondContact O-N 3.39Å; E492-D495 PolarHBondContact O-N 3.08Å; D495-R497 VanDerWaalsContact C-N 3.35Å; D495-R497 PolarHBondContact O-N 3.22Å; D495-K498 PolarHBondContact O-N 3.33Å; D495-K498 IonicContact OD1-NZ 2.98Å; D495-Y499 WeakPolarHBondContact O-CB 3.5Å; D495-Y499 PolarHBondContact O-N 3.41Å
496	R	88.6	Confident	90.7	Very high	123 Å²	123	97.6 Å²	97.6	46%	0.464	45%	0.447	S	S	.	.	H	α-helix	trans	-64.2	-38.2	174.7	-168.8	172.1	68.4	99.9	0.1	112.1	Y458 E492 D493 E494 Y499 M500	Y458-R496 PolarHBondContact OH-NH2 3.19Å; Y458-R496 VanDerWaalsContact OH-NH2 3.16Å; E492-R496 WeakPolarHBondContact O-CB 3.42Å; E492-R496 PolarHBondContact O-N 3.3Å; D493-R496 IonicContact OD1-CZ 2.78Å; D493-R496 IonicContact OD1-NE 3.46Å; D493-R496 IonicContact OD1-NH2 3.32Å; D493-R496 PolarHBondContact OD1-NH2 2.97Å; E494-R496 VanDerWaalsContact C-N 3.35Å; E494-R496 PolarHBondContact O-N 3.46Å; R496-Y499 PolarHBondContact O-N 2.79Å; R496-M500 VanDerWaalsContact O-CG 3.27Å; R496-M500 WeakPolarHBondContact O-CG 3.5Å; R496-M500 PolarHBondContact O-N 2.7Å
497	R	91.7	Very high	90.1	Very high	158 Å²	158	96.6 Å²	96.6	60%	0.596	44%	0.444	S	S	*	.	H	α-helix	trans	-63.2	-48.4	175.2	-169.9	-175.7	-51.9	177.5	5.9	111.3	D493 E494 D495 Y499 M500 E501	D493-R497 WeakPolarHBondContact O-CB 3.41Å; D493-R497 PolarHBondContact O-N 2.93Å; E494-R497 WeakPolarHBondContact O-CB 3.38Å; E494-R497 PolarHBondContact O-N 3.37Å; D495-R497 VanDerWaalsContact C-N 3.35Å; D495-R497 PolarHBondContact O-N 3.22Å; R497-Y499 VanDerWaalsContact C-N 3.29Å; R497-Y499 PolarHBondContact O-N 2.96Å; R497-M500 PolarHBondContact O-N 2.8Å; R497-E501 WeakPolarHBondContact O-CG 3.27Å; R497-E501 PolarHBondContact O-N 3.27Å
498	K	91.8	Very high	89.3	Confident	114 Å²	114	91.4 Å²	91.4	50%	0.496	44%	0.435	S	S	.	.	H	α-helix	trans	-58	-42.6	175.5	-70.1	171.4	-172.1	161.5	0	111.5	E494 D495 E501 T502	E494-K498 WeakPolarHBondContact O-CG 3.41Å; E494-K498 PolarHBondContact O-N 3.42Å; D495-K498 PolarHBondContact O-N 3.33Å; D495-K498 IonicContact OD1-NZ 2.98Å; K498-E501 PolarHBondContact O-N 3.05Å; K498-T502 PolarHBondContact O-N 2.91Å; K498-T502 PolarHBondContact O-OG1 2.82Å
499	Y	89.5	Confident	88.4	Confident	142 Å²	142	96 Å²	96	56%	0.557	45%	0.453	S	S	*	.	H	α-helix	trans	-61.7	-47.8	176.9	-179.9	-106.4	0	0	0	112.1	D495 R496 R497 E501 T502 L503	D495-Y499 WeakPolarHBondContact O-CB 3.5Å; D495-Y499 PolarHBondContact O-N 3.41Å; R496-Y499 PolarHBondContact O-N 2.79Å; R497-Y499 VanDerWaalsContact C-N 3.29Å; R497-Y499 PolarHBondContact O-N 2.96Å; Y499-E501 VanDerWaalsContact C-N 3.34Å; Y499-E501 PolarHBondContact O-N 3.17Å; Y499-T502 WeakPolarHBondContact O-CB 3.37Å; Y499-T502 PolarHBondContact O-N 3.46Å; Y499-L503 HydrophobicContact CD1-CD1 3.94Å; Y499-L503 HydrophobicContact CE1-CD1 3.36Å; Y499-L503 HydrophobicContact CE1-CG 4.12Å; Y499-L503 HydrophobicContact CE2-CG 4.45Å; Y499-L503 PolarHBondContact O-N 3.31Å
500	M	89.3	Confident	87.4	Confident	91 Å²	91	101.5 Å²	101.5	45%	0.448	48%	0.478	S	S	.	.	H	α-helix	trans	-64.4	-35.9	177.9	-68.8	-61.5	-66.4	0	0	112.9	R496 R497 L503 K504	R496-M500 VanDerWaalsContact O-CG 3.27Å; R496-M500 WeakPolarHBondContact O-CG 3.5Å; R496-M500 PolarHBondContact O-N 2.7Å; R497-M500 PolarHBondContact O-N 2.8Å; M500-L503 HydrophobicContact SD-CD1 4.28Å; M500-K504 WeakPolarHBondContact O-CG 3.36Å; M500-K504 PolarHBondContact O-N 3.05Å; M500-K504 VanDerWaalsContact O-N 3.09Å
501	E	90.6	Very high	86.3	Confident	111 Å²	111	102.1 Å²	102.1	52%	0.519	48%	0.478	S	S	.	.	H	α-helix	trans	-66	-38.4	173.5	-75.3	171.9	-172.8	0	0	112	R497 K498 Y499 K504 T505	R497-E501 WeakPolarHBondContact O-CG 3.27Å; R497-E501 PolarHBondContact O-N 3.27Å; K498-E501 PolarHBondContact O-N 3.05Å; Y499-E501 VanDerWaalsContact C-N 3.34Å; Y499-E501 PolarHBondContact O-N 3.17Å; E501-K504 PolarHBondContact O-N 3.3Å; E501-T505 WeakPolarHBondContact O-CB 3.45Å; E501-T505 PolarHBondContact O-N 2.97Å; E501-T505 PolarHBondContact O-OG1 3.47Å
502	T	90.5	Very high	84.9	Confident	74 Å²	74	102.8 Å²	102.8	45%	0.454	48%	0.481	S	S	.	.	H	α-helix	trans	-64	-48.2	175.8	-52.1	0	0	0	0	110.6	K498 Y499 K504 T505 E506	K498-T502 PolarHBondContact O-N 2.91Å; K498-T502 PolarHBondContact O-OG1 2.82Å; Y499-T502 WeakPolarHBondContact O-CB 3.37Å; Y499-T502 PolarHBondContact O-N 3.46Å; T502-K504 PolarHBondContact O-N 3.19Å; T502-T505 WeakPolarHBondContact O-CB 3.36Å; T502-T505 PolarHBondContact O-N 2.98Å; T502-T505 VanDerWaalsContact O-N 3.12Å; T502-E506 WeakPolarHBondContact O-CG 3.44Å; T502-E506 PolarHBondContact O-N 2.97Å
503	L	88	Confident	83.4	Confident	55 Å²	55	104.2 Å²	104.2	29%	0.288	50%	0.496	S	S	.	.	H	α-helix	trans	-57.7	-46.7	176.6	-75.9	176.6	0	0	0	112.4	Y499 M500 T505 E506 E507	Y499-L503 HydrophobicContact CD1-CD1 3.94Å; Y499-L503 HydrophobicContact CE1-CD1 3.36Å; Y499-L503 HydrophobicContact CE1-CG 4.12Å; Y499-L503 HydrophobicContact CE2-CG 4.45Å; Y499-L503 PolarHBondContact O-N 3.31Å; M500-L503 HydrophobicContact SD-CD1 4.28Å; L503-T505 VanDerWaalsContact C-N 3.27Å; L503-T505 PolarHBondContact O-N 3.35Å; L503-E506 PolarHBondContact O-N 3Å; L503-E507 WeakPolarHBondContact O-CG 3.43Å; L503-E507 PolarHBondContact O-N 3.18Å
504	K	88.4	Confident	81.6	Confident	138 Å²	138	109.3 Å²	109.3	60%	0.6	52%	0.515	S	S	*	.	H	α-helix	trans	-60.5	-37.9	176.6	-74.6	177	179.9	-177.6	0	112.3	M500 E501 T502 A508	M500-K504 WeakPolarHBondContact O-CG 3.36Å; M500-K504 PolarHBondContact O-N 3.05Å; M500-K504 VanDerWaalsContact O-N 3.09Å; E501-K504 PolarHBondContact O-N 3.3Å; T502-K504 PolarHBondContact O-N 3.19Å; K504-A508 VanDerWaalsContact O-CB 3.31Å; K504-A508 WeakPolarHBondContact O-CB 3.47Å; K504-A508 PolarHBondContact O-N 3.31Å
505	T	85.9	Confident	79.9	Confident	76 Å²	76	111.5 Å²	111.5	47%	0.466	53%	0.53	S	S	.	.	H	α-helix	trans	-68.5	-39.3	177.6	-55.4	0	0	0	0	111.3	E501 T502 L503 K509	E501-T505 WeakPolarHBondContact O-CB 3.45Å; E501-T505 PolarHBondContact O-N 2.97Å; E501-T505 PolarHBondContact O-OG1 3.47Å; T502-T505 WeakPolarHBondContact O-CB 3.36Å; T502-T505 PolarHBondContact O-N 2.98Å; T502-T505 VanDerWaalsContact O-N 3.12Å; L503-T505 VanDerWaalsContact C-N 3.27Å; L503-T505 PolarHBondContact O-N 3.35Å; T505-K509 WeakPolarHBondContact O-CG 3.43Å; T505-K509 PolarHBondContact O-N 2.93Å
506	E	85.1	Confident	78	Confident	105 Å²	105	116.2 Å²	116.2	49%	0.491	55%	0.55	S	S	.	.	H	α-helix	trans	-68.6	-40.7	175.3	-71.4	-175.4	169.9	0	0	112.8	T502 L503 K509 K510	T502-E506 WeakPolarHBondContact O-CG 3.44Å; T502-E506 PolarHBondContact O-N 2.97Å; L503-E506 PolarHBondContact O-N 3Å; E506-K509 PolarHBondContact O-N 3.31Å; E506-K510 PolarHBondContact O-N 3.2Å
507	E	81.4	Confident	75.8	Confident	121 Å²	121	119.9 Å²	119.9	57%	0.565	58%	0.578	S	S	*	*	H	α-helix	trans	-63.6	-42.9	173.8	-75.3	-179.6	164.4	0	0	111.7	L503 K509 K510 N511	L503-E507 WeakPolarHBondContact O-CG 3.43Å; L503-E507 PolarHBondContact O-N 3.18Å; E507-K509 VanDerWaalsContact C-N 3.31Å; E507-K509 PolarHBondContact O-N 3.05Å; E507-K510 PolarHBondContact O-N 3.31Å; E507-N511 PolarHBondContact O-N 3.06Å
508	A	77.6	Confident	75	Confident	50 Å²	50	118 Å²	118	41%	0.413	58%	0.577	S	S	.	*	H	α-helix	trans	-62.4	-37.1	175	0	0	0	0	0	112.3	K504 K512	K504-A508 VanDerWaalsContact O-CB 3.31Å; K504-A508 WeakPolarHBondContact O-CB 3.47Å; K504-A508 PolarHBondContact O-N 3.31Å; A508-K512 WeakPolarHBondContact O-CG 3.5Å; A508-K512 PolarHBondContact O-N 2.8Å; A508-K512 VanDerWaalsContact O-N 3.11Å
509	K	76.2	Confident	74.2	Confident	145 Å²	145	118.2 Å²	118.2	63%	0.63	58%	0.581	S	S	*	*	H	α-helix	trans	-67.9	-41.4	173.6	-75.3	175.2	-179.9	179.8	0	112.3	T505 E506 E507 K512 S513	T505-K509 WeakPolarHBondContact O-CG 3.43Å; T505-K509 PolarHBondContact O-N 2.93Å; E506-K509 PolarHBondContact O-N 3.31Å; E507-K509 VanDerWaalsContact C-N 3.31Å; E507-K509 PolarHBondContact O-N 3.05Å; K509-K512 PolarHBondContact O-N 3.21Å; K509-S513 PolarHBondContact O-N 3.25Å; K509-S513 VanDerWaalsContact O-N 3.07Å
510	K	71.9	Confident	73.3	Confident	151 Å²	151	116.9 Å²	116.9	66%	0.657	58%	0.582	S	S	*	*	H	α-helix	trans	-64.8	-37.7	175.7	-84.7	-179.9	176.3	171.6	0	112.8	E506 E507 K514	E506-K510 PolarHBondContact O-N 3.2Å; E507-K510 PolarHBondContact O-N 3.31Å; K510-K514 PolarHBondContact O-N 3.37Å
511	N	67.8	Low	72.4	Confident	98 Å²	98	118.4 Å²	118.4	52%	0.524	59%	0.59	S	S	.	*	H	α-helix	trans	-71.6	-40.3	177.8	-73	-11.9	0	0	0	111.8	E507 S513 K514 D515	E507-N511 PolarHBondContact O-N 3.06Å; N511-S513 VanDerWaalsContact C-N 3.32Å; N511-S513 PolarHBondContact O-N 3.26Å; N511-K514 PolarHBondContact O-N 2.8Å; N511-D515 PolarHBondContact O-N 2.88Å; N511-D515 VanDerWaalsContact O-N 3.16Å
512	K	64	Low	71.2	Confident	147 Å²	147	118.9 Å²	118.9	64%	0.639	60%	0.595	S	S	*	*	H	α-helix	trans	-61.3	-38.5	172.4	-75.9	-175.4	176.1	-171	0	113.1	A508 K509 K514 D515 E516	A508-K512 WeakPolarHBondContact O-CG 3.5Å; A508-K512 PolarHBondContact O-N 2.8Å; A508-K512 VanDerWaalsContact O-N 3.11Å; K509-K512 PolarHBondContact O-N 3.21Å; K512-K514 PolarHBondContact O-N 2.88Å; K512-D515 PolarHBondContact O-N 3.05Å; K512-E516 PolarHBondContact O-N 2.78Å
513	S	58.2	Low	69.9	Low	70 Å²	70	121.9 Å²	121.9	49%	0.49	60%	0.604	S	S	.	*	H	α-helix	trans	-67.9	-19.2	174.5	171.1	0	0	0	0	114	K509 N511	K509-S513 PolarHBondContact O-N 3.25Å; K509-S513 VanDerWaalsContact O-N 3.07Å; N511-S513 VanDerWaalsContact C-N 3.32Å; N511-S513 PolarHBondContact O-N 3.26Å
514	K	55.2	Low	68.6	Low	155 Å²	155	126.6 Å²	126.6	67%	0.674	63%	0.627	S	S	*	*	H	α-helix	trans	-89.2	-25.5	176	-84.4	-175.6	172.8	-176.5	0	113.2	K510 N511 K512 E516	K510-K514 PolarHBondContact O-N 3.37Å; N511-K514 PolarHBondContact O-N 2.8Å; K512-K514 PolarHBondContact O-N 2.88Å; K514-E516 VanDerWaalsContact C-N 3.34Å
515	D	55.1	Low	67.1	Low	143 Å²	143	125.8 Å²	125.8	77%	0.765	63%	0.629	S	S	*	*	H	α-helix	trans	-83.5	-12.4	175.7	-70.6	-20.4	0	0	0	112.5	N511 K512	N511-D515 PolarHBondContact O-N 2.88Å; N511-D515 VanDerWaalsContact O-N 3.16Å; K512-D515 PolarHBondContact O-N 3.05Å
516	E	52.4	Low	65.6	Low	173 Å²	173	129.9 Å²	129.9	81%	0.808	64%	0.642	S	S	*	*	T	Hydrogen-bonded Turn	trans	-97.6	5.2	176.2	-71.5	-180	176.1	0	0	114	K512 K514	K512-E516 PolarHBondContact O-N 2.78Å; K514-E516 VanDerWaalsContact C-N 3.34Å
517	L	42	Very low	63.8	Low	201 Å²	201	132.2 Å²	132.2	100%	1.052	66%	0.656	S	S	*	*			trans	-116.3	0	174.5	-99.1	158.9	0	0	0	109.7

Retrieved 517 of 517 residues in 1021.9 ms (Link to these results)

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